A0A087Y572_POEFO Loading...

Nondiscriminating glutamyl-tRNA synthetase EARS2, mitochondrial

AlphaFold DB , UniProt , Accession A0A087Y572, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 543 aa.

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(Predicted Aligned Error values between residue pairs)

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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	27.2	Very low	25.4	Very low	230 Å²	230	153 Å²	153	100%	1.133	77%	0.771	S	S	*	*				0	88.6	0	-73.8	165.8	90.8	0	0	106.5
2	L	25.8	Very low	25.3	Very low	164 Å²	164	155.3 Å²	155.3	86%	0.859	77%	0.773	S	S	*	*				66.8	119.9	103.3	-78.4	154.1	0	0	0	110.5
3	V	25.4	Very low	25.3	Very low	112 Å²	112	156 Å²	156	68%	0.679	78%	0.779	S	S	*	*			cis	-170.7	135	28.2	153.9	0	0	0	0	109.8
4	W	23.9	Very low	25.3	Very low	224 Å²	224	161.5 Å²	161.5	85%	0.848	79%	0.787	S	S	*	*			trans	39.4	160.1	137	-71.8	51.1	0	0	0	122.6
5	L	27.6	Very low	25.3	Very low	112 Å²	112	158.5 Å²	158.5	59%	0.586	79%	0.789	S	S	*	*			cis	171.5	146.5	-27.3	-117.7	145.9	0	0	0	104.8
6	K	26	Very low	25.2	Very low	172 Å²	172	163.4 Å²	163.4	75%	0.748	80%	0.795	S	S	*	*			trans	69	158.2	149.8	-76.7	-175.2	178.5	173.8	0	120.1
7	I	25.7	Very low	25.3	Very low	134 Å²	134	160.6 Å²	160.6	69%	0.687	79%	0.79	S	S	*	*			cis	-176	164.5	-26.6	-108	173.4	0	0	0	104.4
8	C	23.1	Very low	25.2	Very low	112 Å²	112	161.1 Å²	161.1	76%	0.757	80%	0.795	S	S	*	*			trans	81.5	149.5	157.7	-91.9	0	0	0	0	118.4
9	S	25.2	Very low	25.2	Very low	94 Å²	94	160.4 Å²	160.4	66%	0.657	79%	0.79	S	S	*	*			cis	178.4	136.4	-19.9	42.1	0	0	0	0	107.6
10	R	25.9	Very low	25.3	Very low	234 Å²	234	164 Å²	164	88%	0.883	79%	0.794	S	S	*	*			trans	47.7	135.5	140.5	-88.9	-176.9	176.8	-172.8	-0.8	122.8
11	C	23.6	Very low	25.2	Very low	95 Å²	95	159.3 Å²	159.3	64%	0.642	79%	0.788	S	S	*	*				109.4	124.6	126.3	-83.5	0	0	0	0	120.4
12	F	23.8	Very low	25	Very low	181 Å²	181	156.8 Å²	156.8	79%	0.794	77%	0.771	S	S	*	*			trans	63.5	124	140.7	-84.5	-105	0	0	0	119.7
13	L	25.3	Very low	25	Very low	164 Å²	164	156.3 Å²	156.3	86%	0.859	77%	0.765	S	S	*	*				-176.7	151.4	86.1	-112.2	120.2	0	0	0	113.4
14	R	25.1	Very low	24.8	Very low	233 Å²	233	156 Å²	156	88%	0.879	77%	0.768	S	S	*	*			trans	-78.7	148.2	172.8	-71.1	167.9	160.9	177.1	-5.7	111.9
15	S	25.2	Very low	24.9	Very low	117 Å²	117	151.2 Å²	151.2	82%	0.818	76%	0.763	S	S	*	*			trans	173.5	116.9	137.2	49	0	0	0	0	106.8
16	R	24.9	Very low	24.8	Very low	237 Å²	237	152.8 Å²	152.8	89%	0.894	78%	0.777	S	S	*	*				53.6	114.4	65.5	-111.6	-168.9	-158.8	-153.3	6	115.5
17	V	25.8	Very low	24.8	Very low	116 Å²	116	149.1 Å²	149.1	70%	0.703	78%	0.779	S	S	*	*			trans	86	115.4	152	-160.2	0	0	0	0	116.9
18	L	24.5	Very low	24.9	Very low	168 Å²	168	148.7 Å²	148.7	88%	0.88	78%	0.782	S	S	*	*				-174.3	148.4	109.3	-97.5	164.6	0	0	0	113.6
19	Q	25.6	Very low	25	Very low	149 Å²	149	155 Å²	155	70%	0.696	79%	0.79	S	S	*	*			trans	-87.2	154.5	-174.1	-84.8	178.2	-31.1	0	0	113.1
20	R	25.6	Very low	25.1	Very low	231 Å²	231	158 Å²	158	87%	0.872	79%	0.793	S	S	*	*			trans	75.7	137	138.7	-78.4	174.3	178.7	-165.9	0.4	121.5
21	G	23.9	Very low	24.9	Very low	66 Å²	66	158 Å²	158	68%	0.68	79%	0.794	S	S	*	*			trans	109.1	132.2	155.3	0	0	0	0	0	113
22	F	24.2	Very low	24.9	Very low	177 Å²	177	164.6 Å²	164.6	78%	0.776	81%	0.805	S	S	*	*			cis	-167.7	147.9	20.5	-124.5	-104.9	0	0	0	109.6
23	Q	24.1	Very low	25	Very low	155 Å²	155	161.9 Å²	161.9	72%	0.724	80%	0.803	S	S	*	*			trans	39	115.8	145.8	-69.2	178.3	-16.2	0	0	121.5
24	S	22.8	Very low	25	Very low	105 Å²	105	162 Å²	162	73%	0.734	80%	0.799	S	S	*	*				76.4	136.3	94.7	93.5	0	0	0	0	113.2
25	V	24.6	Very low	25.1	Very low	123 Å²	123	156 Å²	156	75%	0.745	79%	0.791	S	S	*	*			cis	-159.3	141.7	15.9	174.8	0	0	0	0	105.9
26	T	25.8	Very low	25.2	Very low	146 Å²	146	159.2 Å²	159.2	90%	0.896	79%	0.793	S	S	*	*			trans	-175.2	121.2	135.9	21.4	0	0	0	0	109.4
27	A	26.5	Very low	25.5	Very low	94 Å²	94	153.8 Å²	153.8	78%	0.777	79%	0.786	S	S	*	*			trans	-80.9	128.6	-176.4	0	0	0	0	0	110.9
28	V	26.6	Very low	25.6	Very low	125 Å²	125	155.1 Å²	155.1	76%	0.758	79%	0.789	S	S	*	*			trans	-132	111.7	151.6	-179.6	0	0	0	0	107.2	H30	V28-H30 PolarHBondContact O-N 3.25Å
29	R	26	Very low	25.9	Very low	245 Å²	245	153.2 Å²	153.2	93%	0.925	79%	0.79	S	S	*	*			trans	-69.7	106.6	174.8	-80.2	175.9	167.2	176	-3.5	109.2
30	H	26.6	Very low	26.1	Very low	156 Å²	156	150.4 Å²	150.4	72%	0.722	79%	0.791	S	S	*	*			trans	-111.6	111.5	151.1	-84.4	-74.2	0	0	0	108.5	V28 W32	V28-H30 PolarHBondContact O-N 3.25Å; H30-W32 PolarHBondContact O-N 3.43Å
31	R	23.4	Very low	26.6	Very low	236 Å²	236	143.7 Å²	143.7	89%	0.891	79%	0.786	S	S	*	*			trans	-72.2	93.1	-178.2	-161.9	-179.6	-161.5	-174.2	3.7	108.3	V33	R31-V33 PolarHBondContact O-N 3.49Å
32	W	22.9	Very low	26.9	Very low	232 Å²	232	146.7 Å²	146.7	88%	0.879	79%	0.79	S	S	*	*			trans	-74.2	112.3	162.1	-73.8	84.5	0	0	0	107.3	H30 E34	H30-W32 PolarHBondContact O-N 3.43Å; W32-E34 PolarHBondContact O-N 3.2Å
33	V	25.8	Very low	27.2	Very low	124 Å²	124	148.6 Å²	148.6	75%	0.752	79%	0.794	S	S	*	*			trans	-77.1	97.5	165.9	178.3	0	0	0	0	105.7	R31	R31-V33 PolarHBondContact O-N 3.49Å
34	E	24.3	Very low	27.7	Very low	166 Å²	166	150.3 Å²	150.3	78%	0.776	79%	0.794	S	S	*	*			trans	-63.6	126.1	162	-76.7	-178.2	159.3	0	0	107.8	W32 Q36	W32-E34 PolarHBondContact O-N 3.2Å; E34-Q36 PolarHBondContact O-N 2.97Å; E34-Q36 VanDerWaalsContact O-N 3.09Å
35	P	29.1	Very low	28.3	Very low	109 Å²	109	155.2 Å²	155.2	71%	0.708	80%	0.796	S	S	*	*			trans	-69.2	110.9	166.8	16.6	-8	0	0	0	106.9	V37	P35-V37 PolarHBondContact O-N 3.37Å
36	Q	25.8	Very low	29.2	Very low	184 Å²	184	152.8 Å²	152.8	86%	0.86	78%	0.784	S	S	*	*			trans	-61.9	92.9	162.5	-80.1	-171.2	-25.2	0	0	108	E34 N38	E34-Q36 PolarHBondContact O-N 2.97Å; E34-Q36 VanDerWaalsContact O-N 3.09Å; Q36-N38 PolarHBondContact O-N 2.96Å
37	V	32.5	Very low	30.2	Very low	123 Å²	123	147.1 Å²	147.1	75%	0.745	75%	0.75	S	S	*	*			trans	-72.7	103.6	162.5	-176.5	0	0	0	0	105.4	P35 S39	P35-V37 PolarHBondContact O-N 3.37Å; V37-S39 PolarHBondContact O-N 3.45Å
38	N	27.1	Very low	31.5	Very low	143 Å²	143	145.8 Å²	145.8	77%	0.765	73%	0.733	S	S	*	*			trans	-49	113.1	167.7	-96.9	-20.2	0	0	0	108.3	Q36 A40	Q36-N38 PolarHBondContact O-N 2.96Å; N38-A40 PolarHBondContact O-N 3.1Å
39	S	31.1	Very low	32.9	Very low	129 Å²	129	143.2 Å²	143.2	90%	0.902	72%	0.717	S	S	*	*	S	Bend	trans	-73.5	24.1	-175.9	55.3	0	0	0	0	113.8	V37	V37-S39 PolarHBondContact O-N 3.45Å
40	A	29.8	Very low	34.3	Very low	89 Å²	89	139.4 Å²	139.4	74%	0.736	71%	0.71	S	S	*	*	S	Bend	trans	-129.3	60	-174.3	0	0	0	0	0	111	N38	N38-A40 PolarHBondContact O-N 3.1Å
41	A	34.9	Very low	36	Very low	91 Å²	91	134.6 Å²	134.6	75%	0.752	70%	0.703	S	S	*	*	S	Bend	trans	174	58.7	153.5	0	0	0	0	0	112.5
42	V	31.1	Very low	38.7	Very low	128 Å²	128	128.9 Å²	128.9	78%	0.776	69%	0.686	S	S	*	*			trans	-141.3	61.7	161.5	-163.9	0	0	0	0	110.1
43	Y	30.5	Very low	42.2	Very low	217 Å²	217	117.9 Å²	117.9	85%	0.851	64%	0.644	S	S	*	*			trans	-102.8	76.5	150.7	-79.9	-81.2	0	0	0	106.8	W45	Y43-W45 VanDerWaalsContact C-N 3.28Å; Y43-W45 PolarHBondContact O-N 3.23Å
44	R	34.7	Very low	45.6	Very low	192 Å²	192	113.9 Å²	113.9	73%	0.725	62%	0.616	S	S	*	*			trans	-72.4	97	163.3	-139.6	179.5	-170	176.1	4	104.9	C46	R44-C46 PolarHBondContact O-N 3.46Å
45	W	36.3	Very low	49.2	Very low	207 Å²	207	106 Å²	106	78%	0.784	58%	0.579	S	S	*	*			trans	-55	100.5	174.9	-92.2	49.8	0	0	0	108.4	Y43 S47	Y43-W45 VanDerWaalsContact C-N 3.28Å; Y43-W45 PolarHBondContact O-N 3.23Å; W45-S47 PolarHBondContact O-N 3.18Å
46	C	43.4	Very low	52.5	Low	72 Å²	72	101.1 Å²	101.1	49%	0.486	55%	0.546	S	S	.	.			trans	-71.6	86.5	158.4	-162.9	0	0	0	0	104.8	R44 T48	R44-C46 PolarHBondContact O-N 3.46Å; C46-T48 PolarHBondContact O-N 3.43Å
47	S	44.9	Very low	55.9	Low	27 Å²	27	92.9 Å²	92.9	19%	0.189	51%	0.508	C	S	.	.			trans	-71.1	91.1	173.2	-173.9	0	0	0	0	107.4	W45 V49 E52	W45-S47 PolarHBondContact O-N 3.18Å; S47-V49 WeakPolarHBondContact OG-CB 3.46Å; S47-V49 WeakPolarHBondContact OG-CG2 3.38Å; S47-V49 PolarHBondContact OG-N 3.03Å; S47-E52 WeakPolarHBondContact CB-OE2 3.47Å; S47-E52 PolarHBondContact OG-OE2 3.14Å
48	T	55.2	Low	59.1	Low	67 Å²	67	87.9 Å²	87.9	41%	0.411	48%	0.479	S	S	.	.			trans	-86.5	28	155.7	57.6	0	0	0	0	109.6	C46 Q50 Y83	C46-T48 PolarHBondContact O-N 3.43Å; T48-Q50 PolarHBondContact O-N 3.4Å; T48-Y83 HydrophobicContact CG2-CE1 4.44Å
49	V	55.6	Low	62.4	Low	71 Å²	71	82 Å²	82	43%	0.43	45%	0.449	S	S	.	.			trans	-64	131.6	177.4	178.1	0	0	0	0	108	S47 G51 E52	S47-V49 WeakPolarHBondContact OG-CB 3.46Å; S47-V49 WeakPolarHBondContact OG-CG2 3.38Å; S47-V49 PolarHBondContact OG-N 3.03Å; V49-G51 PolarHBondContact O-N 3.49Å; V49-E52 HydrophobicContact CB-CG 4.46Å; V49-E52 PolarHBondContact O-N 2.99Å
50	Q	55.4	Low	65.5	Low	165 Å²	165	78.5 Å²	78.5	77%	0.771	42%	0.424	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.3	127.1	-178	-167.1	171.2	-1.9	0	0	110.1	T48 Y83	T48-Q50 PolarHBondContact O-N 3.4Å; Q50-Y83 WeakPolarHBondContact CA-O 3.49Å
51	G	61.3	Low	68.5	Low	55 Å²	55	74.6 Å²	74.6	57%	0.567	39%	0.391	S	S	*	.	T	Hydrogen-bonded Turn	trans	92.7	-12.9	-179.7	0	0	0	0	0	116.3	V49 Y83 G84	V49-G51 PolarHBondContact O-N 3.49Å; G51-Y83 PolarHBondContact N-O 3.43Å; G51-G84 WeakPolarHBondContact CA-O 3.43Å
52	E	81.7	Confident	71.2	Confident	115 Å²	115	72.1 Å²	72.1	54%	0.537	37%	0.367	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.2	-12.6	177.4	-65.7	-168.4	159.1	0	0	113.5	S47 V49 R54	S47-E52 WeakPolarHBondContact CB-OE2 3.47Å; S47-E52 PolarHBondContact OG-OE2 3.14Å; V49-E52 HydrophobicContact CB-CG 4.46Å; V49-E52 PolarHBondContact O-N 2.99Å; E52-R54 PolarHBondContact O-N 2.98Å
53	V	95.3	Very high	74	Confident	1 Å²	1	67.1 Å²	67.1	1%	0.006	34%	0.341	C	S	.	.			trans	-70.6	119.5	-177.7	172.4	0	0	0	0	110.5	V55 F79 Y83 G85 A86	V53-V55 HydrophobicContact CG1-CG1 3.93Å; V53-F79 HydrophobicContact CG1-CD1 3.71Å; V53-F79 HydrophobicContact CG1-CE1 3.52Å; V53-F79 HydrophobicContact CG2-CE1 4.39Å; V53-Y83 HydrophobicContact CG2-CG 4.34Å; V53-G85 CarbonylContact O-C 3.53Å; V53-G85 WeakPolarHBondContact O-CA 3.18Å; V53-A86 PolarHBondContact O-N 2.98Å
54	R	98	Very high	77	Confident	41 Å²	41	60 Å²	60	16%	0.155	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	126.1	168.1	-63.7	178.7	63.7	78.8	-3.2	109.4	E52 A86 I88 E120 M255 K256 S258 H259	E52-R54 PolarHBondContact O-N 2.98Å; R54-A86 HydrophobicContact CG-CB 4.39Å; R54-I88 HydrophobicContact CB-CD1 4.35Å; R54-I88 VanDerWaalsContact NH2-CD1 3.34Å; R54-E120 IonicContact CZ-OE1 3.1Å; R54-E120 VanDerWaalsContact CZ-OE1 3.23Å; R54-E120 IonicContact CZ-OE2 3.62Å; R54-E120 IonicContact NH1-OE1 3.2Å; R54-E120 PolarHBondContact NH1-OE1 3.44Å; R54-E120 VanDerWaalsContact NH2-CD 3.26Å; R54-E120 IonicContact NH2-OE1 3.78Å; R54-E120 PolarHBondContact NH2-OE1 3.22Å; R54-E120 IonicContact NH2-OE2 3.63Å; R54-E120 PolarHBondContact NH2-OE2 3.11Å; R54-M255 PolarHBondContact NE-O 2.64Å; R54-M255 PolarHBondContact NH2-O 3.17Å; R54-K256 WeakPolarHBondContact CB-O 3.42Å; R54-K256 WeakPolarHBondContact CD-O 3.48Å; R54-S258 PolarHBondContact N-OG 3.36Å; R54-S258 PolarHBondContact O-N 3.35Å; R54-S258 PolarHBondContact O-OG 3.03Å; R54-H259 PolarHBondContact O-N 2.93Å
55	V	98.6	Very high	79.8	Confident	0 Å²	0	51.1 Å²	51.1	0%	0	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.1	165.1	179.9	-58.7	0	0	0	0	109.9	V53 N76 F79 A80 A86 F87 I88 H259	V53-V55 HydrophobicContact CG1-CG1 3.93Å; V55-N76 HydrophobicContact CB-CB 4.39Å; V55-N76 WeakPolarHBondContact CB-OD1 3.49Å; V55-N76 HydrophobicContact CG2-CB 3.91Å; V55-N76 VanDerWaalsContact CG2-O 3.32Å; V55-N76 WeakPolarHBondContact CG2-O 3.47Å; V55-F79 HydrophobicContact CG1-CD1 3.68Å; V55-F79 HydrophobicContact CG1-CE1 4.04Å; V55-A80 HydrophobicContact CG2-CB 3.77Å; V55-A86 PolarHBondContact N-O 3.46Å; V55-F87 HydrophobicContact CG2-CD2 4.26Å; V55-I88 WeakPolarHBondContact O-CB 3.22Å; V55-I88 PolarHBondContact O-N 3.43Å; V55-H259 HydrophobicContact CG1-CB 3.83Å
56	R	98.6	Very high	82.5	Confident	7 Å²	7	43.5 Å²	43.5	3%	0.026	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.5	141.5	-178	82.8	-59.6	178	-81.1	-3.7	113.9	A58 N76 I88 D252 I257 V260	R56-A58 HydrophobicContact CG-CB 4.04Å; R56-N76 PolarHBondContact O-OD1 3.04Å; R56-I88 CarbonylContact C-O 3.59Å; R56-I88 WeakPolarHBondContact CA-O 3.46Å; R56-I88 HydrophobicContact CB-CB 4.1Å; R56-D252 IonicContact NE-OD1 2.8Å; R56-D252 PolarHBondContact NE-OD1 3.4Å; R56-D252 IonicContact NE-OD2 3.97Å; R56-D252 PolarHBondContact NE-OD2 2.89Å; R56-D252 IonicContact NH2-OD2 3.53Å; R56-I257 HydrophobicContact CB-CD1 3.9Å; R56-I257 HydrophobicContact CG-CD1 4.34Å; R56-V260 VanDerWaalsContact NH2-CG1 3.33Å
57	F	98.6	Very high	84.7	Confident	11 Å²	11	40.1 Å²	40.1	5%	0.048	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.6	119	155.9	-179	-128.2	0	0	0	108.7	P59 L65 G69 T72 A73 F87 I88 L89 R90 I107 L111	F57-P59 VanDerWaalsContact C-CD 3.42Å; F57-P59 HydrophobicContact CD1-CG 3.92Å; F57-P59 HydrophobicContact CE1-CB 3.99Å; F57-P59 HydrophobicContact CE1-CG 3.54Å; F57-P59 HydrophobicContact CE2-CB 4.34Å; F57-P59 HydrophobicContact CZ-CB 3.79Å; F57-P59 HydrophobicContact CZ-CG 3.89Å; F57-P59 WeakPolarHBondContact O-CD 3.31Å; F57-L65 HydrophobicContact CE1-CD1 3.9Å; F57-L65 HydrophobicContact CZ-CD1 3.71Å; F57-G69 VanDerWaalsContact CE2-O 3.3Å; F57-G69 WeakPolarHBondContact CE2-O 3.4Å; F57-T72 HydrophobicContact CD2-CG2 4.21Å; F57-T72 HydrophobicContact CE2-CG2 4.48Å; F57-A73 HydrophobicContact CB-CB 4.2Å; F57-A73 HydrophobicContact CD1-CB 3.75Å; F57-A73 HydrophobicContact CD2-CB 3.89Å; F57-A73 HydrophobicContact CE1-CB 4.02Å; F57-A73 HydrophobicContact CE2-CB 4.17Å; F57-A73 HydrophobicContact CG-CB 3.69Å; F57-A73 HydrophobicContact CZ-CB 4.22Å; F57-F87 HydrophobicContact CB-CE2 3.61Å; F57-F87 HydrophobicContact CB-CZ 3.68Å; F57-I88 PolarHBondContact N-O 3.3Å; F57-L89 HydrophobicContact CD1-CD1 3.86Å; F57-R90 PolarHBondContact O-N 3.06Å; F57-I107 HydrophobicContact CE1-CG2 4.16Å; F57-L111 HydrophobicContact CD1-CD1 4Å; F57-L111 HydrophobicContact CD1-CD2 4.47Å; F57-L111 HydrophobicContact CE1-CD1 4.32Å; F57-L111 HydrophobicContact CE1-CD2 4.45Å
58	A	98.1	Very high	86.9	Confident	18 Å²	18	39.7 Å²	39.7	15%	0.149	23%	0.232	C	C	.	.			trans	-122	68.5	-173	0	0	0	0	0	112.1	R56 R90 E92	R56-A58 HydrophobicContact CG-CB 4.04Å; A58-R90 CarbonylContact C-O 3.6Å; A58-R90 VanDerWaalsContact CA-O 3.22Å; A58-R90 WeakPolarHBondContact CA-O 3.4Å; A58-E92 HydrophobicContact CB-CG 4Å
59	P	97.2	Very high	88.7	Confident	19 Å²	19	36.8 Å²	36.8	12%	0.123	22%	0.215	C	C	.	.			trans	-78.6	145.9	-180	33	-34.9	0	0	0	111.7	F57 L89 R90 L91 E92 I107	F57-P59 VanDerWaalsContact C-CD 3.42Å; F57-P59 HydrophobicContact CD1-CG 3.92Å; F57-P59 HydrophobicContact CE1-CB 3.99Å; F57-P59 HydrophobicContact CE1-CG 3.54Å; F57-P59 HydrophobicContact CE2-CB 4.34Å; F57-P59 HydrophobicContact CZ-CB 3.79Å; F57-P59 HydrophobicContact CZ-CG 3.89Å; F57-P59 WeakPolarHBondContact O-CD 3.31Å; P59-L89 HydrophobicContact CG-CD1 3.97Å; P59-R90 WeakPolarHBondContact CD-O 3.07Å; P59-L91 HydrophobicContact CG-CD2 4.11Å; P59-E92 PolarHBondContact O-N 3.34Å; P59-I107 HydrophobicContact CB-CD1 4.21Å; P59-I107 HydrophobicContact CG-CD1 4.15Å; P59-I107 HydrophobicContact CG-CG2 3.93Å
60	S	95.4	Very high	90.6	Very high	55 Å²	55	33.4 Å²	33.4	39%	0.385	20%	0.195	S	C	.	.			trans	-83.4	128	162.4	-54	0	0	0	0	109.4	T62 E92	S60-T62 PolarHBondContact O-N 3.48Å; S60-E92 WeakPolarHBondContact CA-O 3.43Å; S60-E92 VanDerWaalsContact CB-O 3.29Å; S60-E92 WeakPolarHBondContact CB-O 3.43Å; S60-E92 PolarHBondContact OG-O 2.83Å; S60-E92 VanDerWaalsContact OG-O 3.12Å
61	P	94.4	Very high	92.4	Very high	7 Å²	7	25.9 Å²	25.9	5%	0.045	16%	0.159	C	C	.	.	S	Bend	trans	-76.9	48.8	179.4	28.8	-29.6	0	0	0	112.2	G63 D93 L99 V100 A103 A104 I107	P61-G63 PolarHBondContact O-N 3.42Å; P61-D93 HydrophobicContact CG-CB 3.88Å; P61-L99 HydrophobicContact CG-CD2 3.97Å; P61-V100 PolarHBondContact O-N 3.48Å; P61-A103 HydrophobicContact CB-CB 4.16Å; P61-A104 HydrophobicContact CB-CB 4.22Å; P61-I107 HydrophobicContact CB-CD1 4.37Å
62	T	91.1	Very high	94	Very high	40 Å²	40	24.5 Å²	24.5	25%	0.245	14%	0.14	C	C	.	.	S	Bend	trans	-91.1	19.2	174.8	71.8	0	0	0	0	112.5	S60 R98	S60-T62 PolarHBondContact O-N 3.48Å; T62-R98 WeakPolarHBondContact CA-O 3.27Å; T62-R98 WeakPolarHBondContact CB-O 3.48Å; T62-R98 HydrophobicContact CG2-CB 3.59Å; T62-R98 WeakPolarHBondContact CG2-O 3.18Å
63	G	90.6	Very high	94.8	Very high	22 Å²	22	19 Å²	19	23%	0.227	11%	0.114	C	C	.	.	S	Bend	trans	157.8	165	-172.6	0	0	0	0	0	110.5	P61	P61-G63 PolarHBondContact O-N 3.42Å
64	F	92.8	Very high	94.9	Very high	68 Å²	68	19 Å²	19	30%	0.298	11%	0.114	S	C	.	.			trans	-72.6	164.6	-177.1	-60.7	-75.7	0	0	0	113.1	H66 V100 A103 S106 F309	F64-H66 PolarHBondContact O-N 3.19Å; F64-V100 HydrophobicContact CE2-CG1 4.17Å; F64-V100 HydrophobicContact CZ-CG1 4.19Å; F64-A103 HydrophobicContact CD1-CB 4.35Å; F64-A103 HydrophobicContact CE1-CB 4.38Å; F64-S106 WeakPolarHBondContact CD1-OG 3.32Å; F64-F309 HydrophobicContact CB-CD1 3.92Å; F64-F309 HydrophobicContact CB-CE1 4.24Å; F64-F309 HydrophobicContact CB-CG 4.41Å
65	L	94.3	Very high	94.8	Very high	6 Å²	6	17 Å²	17	3%	0.031	11%	0.107	C	C	.	.			trans	-61	123.7	176.4	-172.5	63.3	0	0	0	109.7	F57 L70 I107 M110 L111 F309 I310	F57-L65 HydrophobicContact CE1-CD1 3.9Å; F57-L65 HydrophobicContact CZ-CD1 3.71Å; L65-L70 HydrophobicContact CD2-CB 4.49Å; L65-L70 HydrophobicContact CD2-CD1 4.29Å; L65-I107 HydrophobicContact CB-CG1 4.2Å; L65-M110 HydrophobicContact CB-CB 4.28Å; L65-M110 HydrophobicContact CD2-CB 3.73Å; L65-L111 HydrophobicContact CD2-CD2 4.04Å; L65-L111 HydrophobicContact CD2-CG 4.32Å; L65-F309 WeakPolarHBondContact O-CA 3.35Å; L65-I310 HydrophobicContact CB-CG1 4.32Å; L65-I310 HydrophobicContact CD2-CG1 4.05Å; L65-I310 HydrophobicContact CG-CG1 3.88Å; L65-I310 PolarHBondContact O-N 2.98Å
66	H	91.8	Very high	94.8	Very high	47 Å²	47	17 Å²	17	22%	0.218	11%	0.107	C	C	.	.	B	Isolated β-bridge	trans	-114.4	165.2	177.6	60.4	-72	0	0	0	109.7	F64 G68 G69 L70 I308 F309	F64-H66 PolarHBondContact O-N 3.19Å; H66-G68 VanDerWaalsContact C-N 3.32Å; H66-G68 PolarHBondContact O-N 2.81Å; H66-G69 PolarHBondContact NE2-N 3.03Å; H66-G69 CarbonylContact O-C 3.57Å; H66-G69 WeakPolarHBondContact O-CA 3.45Å; H66-G69 PolarHBondContact O-N 3.24Å; H66-L70 PolarHBondContact O-N 3.33Å; H66-I308 WeakPolarHBondContact CA-O 3.36Å; H66-I308 HydrophobicContact CB-CD1 4.04Å; H66-I308 HydrophobicContact CB-CG1 4.31Å; H66-F309 HydrophobicContact CB-CD1 4.09Å; H66-F309 HydrophobicContact CB-CE1 4.37Å
67	L	90.7	Very high	94.8	Very high	0 Å²	0	17.9 Å²	17.9	0%	0	11%	0.11	C	C	.	.	H	α-helix	trans	-57.4	-37.4	-172.2	-161.1	62	0	0	0	115	L70 R71 L293 L301 I308 I310 L323 T327 L362 L364	L67-L70 HydrophobicContact CD1-CD2 4.28Å; L67-L70 PolarHBondContact O-N 2.97Å; L67-R71 PolarHBondContact O-N 3.48Å; L67-L293 HydrophobicContact CG-CD2 4.38Å; L67-L301 HydrophobicContact CB-CD2 4.32Å; L67-I308 PolarHBondContact N-O 3.19Å; L67-I310 HydrophobicContact CB-CD1 4.43Å; L67-I310 HydrophobicContact CD1-CD1 3.85Å; L67-L323 HydrophobicContact CD1-CD2 4.38Å; L67-T327 HydrophobicContact CD1-CG2 3.39Å; L67-T327 HydrophobicContact CD2-CG2 4.29Å; L67-T327 HydrophobicContact CG-CG2 3.68Å; L67-L362 HydrophobicContact CD2-CD2 3.24Å; L67-L362 HydrophobicContact CG-CD2 4.43Å; L67-L364 HydrophobicContact CD2-CD2 4.08Å
68	G	90.2	Very high	94.7	Very high	19 Å²	19	17.3 Å²	17.3	20%	0.196	11%	0.108	C	C	.	.	H	α-helix	trans	-65.1	-37	173.4	0	0	0	0	0	113.5	H66 T72	H66-G68 VanDerWaalsContact C-N 3.32Å; H66-G68 PolarHBondContact O-N 2.81Å; G68-T72 PolarHBondContact O-N 3.3Å; G68-T72 PolarHBondContact O-OG1 3.34Å
69	G	93	Very high	94.6	Very high	6 Å²	6	16.7 Å²	16.7	6%	0.062	10%	0.101	C	C	.	.	H	α-helix	trans	-65.7	-46.5	171.9	0	0	0	0	0	111.6	F57 H66 R71 T72 A73	F57-G69 VanDerWaalsContact CE2-O 3.3Å; F57-G69 WeakPolarHBondContact CE2-O 3.4Å; H66-G69 PolarHBondContact NE2-N 3.03Å; H66-G69 CarbonylContact O-C 3.57Å; H66-G69 WeakPolarHBondContact O-CA 3.45Å; H66-G69 PolarHBondContact O-N 3.24Å; G69-R71 VanDerWaalsContact C-N 3.32Å; G69-R71 PolarHBondContact O-N 3.46Å; G69-T72 PolarHBondContact O-N 3.44Å; G69-T72 VanDerWaalsContact O-N 3.12Å; G69-A73 PolarHBondContact O-N 3.17Å
70	L	94.9	Very high	94.6	Very high	0 Å²	0	15.8 Å²	15.8	0%	0	10%	0.096	C	C	.	.	H	α-helix	trans	-58.3	-43.2	176.3	-179.5	62.9	0	0	0	111.5	L65 H66 L67 T72 A73 L74 A114 I116 I310 L323 L324	L65-L70 HydrophobicContact CD2-CB 4.49Å; L65-L70 HydrophobicContact CD2-CD1 4.29Å; H66-L70 PolarHBondContact O-N 3.33Å; L67-L70 HydrophobicContact CD1-CD2 4.28Å; L67-L70 PolarHBondContact O-N 2.97Å; L70-T72 VanDerWaalsContact C-N 3.34Å; L70-T72 PolarHBondContact O-N 3.19Å; L70-A73 PolarHBondContact O-N 2.93Å; L70-L74 VanDerWaalsContact O-CB 3.29Å; L70-L74 WeakPolarHBondContact O-CB 3.42Å; L70-L74 PolarHBondContact O-N 2.81Å; L70-A114 HydrophobicContact CD1-CB 3.92Å; L70-I116 HydrophobicContact CD1-CD1 3.7Å; L70-I310 HydrophobicContact CB-CD1 3.92Å; L70-I310 HydrophobicContact CB-CG1 4.15Å; L70-I310 HydrophobicContact CD2-CD1 3.49Å; L70-I310 VanDerWaalsContact CD2-CD1 3.49Å; L70-I310 HydrophobicContact CD2-CG1 4.06Å; L70-I310 HydrophobicContact CG-CD1 4.31Å; L70-L323 HydrophobicContact CD2-CB 4.29Å; L70-L324 HydrophobicContact CD1-CD2 4.17Å; L70-L324 HydrophobicContact CD2-CD2 4.23Å; L70-L324 HydrophobicContact CG-CD2 4.3Å
71	R	93.6	Very high	94.7	Very high	6 Å²	6	16 Å²	16	2%	0.023	9%	0.09	C	C	.	.	H	α-helix	trans	-58.9	-44.5	175.2	-177.4	177	175.4	-129.2	-2.6	112	L67 G69 L74 Y75 P291 C330	L67-R71 PolarHBondContact O-N 3.48Å; G69-R71 VanDerWaalsContact C-N 3.32Å; G69-R71 PolarHBondContact O-N 3.46Å; R71-L74 PolarHBondContact O-N 3.02Å; R71-Y75 HydrophobicContact CG-CD2 4Å; R71-Y75 HydrophobicContact CG-CE2 3.8Å; R71-Y75 WeakPolarHBondContact O-CD2 3.33Å; R71-Y75 PolarHBondContact O-N 3.06Å; R71-P291 PolarHBondContact NH1-O 3.44Å; R71-C330 PolarHBondContact NH2-O 3.04Å
72	T	95.3	Very high	94.7	Very high	27 Å²	27	19.1 Å²	19.1	17%	0.166	10%	0.103	C	C	.	.	H	α-helix	trans	-64.5	-43.7	177.6	-57.5	0	0	0	0	111.2	F57 G68 G69 L70 Y75 N76 L290	F57-T72 HydrophobicContact CD2-CG2 4.21Å; F57-T72 HydrophobicContact CE2-CG2 4.48Å; G68-T72 PolarHBondContact O-N 3.3Å; G68-T72 PolarHBondContact O-OG1 3.34Å; G69-T72 PolarHBondContact O-N 3.44Å; G69-T72 VanDerWaalsContact O-N 3.12Å; L70-T72 VanDerWaalsContact C-N 3.34Å; L70-T72 PolarHBondContact O-N 3.19Å; T72-Y75 PolarHBondContact O-N 3Å; T72-N76 PolarHBondContact O-N 3.23Å; T72-N76 VanDerWaalsContact O-N 3.16Å; T72-N76 PolarHBondContact O-ND2 3.32Å; T72-L290 HydrophobicContact CG2-CD1 4.18Å
73	A	97.9	Very high	94.9	Very high	0 Å²	0	19.9 Å²	19.9	0%	0	10%	0.101	C	C	.	.	H	α-helix	trans	-59.9	-48.3	175.9	0	0	0	0	0	111.4	F57 G69 L70 Y75 N76 Y77 F87 L111 I116	F57-A73 HydrophobicContact CB-CB 4.2Å; F57-A73 HydrophobicContact CD1-CB 3.75Å; F57-A73 HydrophobicContact CD2-CB 3.89Å; F57-A73 HydrophobicContact CE1-CB 4.02Å; F57-A73 HydrophobicContact CE2-CB 4.17Å; F57-A73 HydrophobicContact CG-CB 3.69Å; F57-A73 HydrophobicContact CZ-CB 4.22Å; G69-A73 PolarHBondContact O-N 3.17Å; L70-A73 PolarHBondContact O-N 2.93Å; A73-Y75 PolarHBondContact O-N 3.16Å; A73-N76 PolarHBondContact O-N 3.06Å; A73-Y77 WeakPolarHBondContact O-CB 3.3Å; A73-Y77 PolarHBondContact O-N 2.92Å; A73-F87 HydrophobicContact CB-CZ 4.16Å; A73-L111 HydrophobicContact CB-CD2 3.58Å; A73-I116 HydrophobicContact CB-CD1 3.9Å
74	L	97.3	Very high	95.1	Very high	0 Å²	0	20.8 Å²	20.8	0%	0	11%	0.111	C	C	.	.	H	α-helix	trans	-58.8	-46.2	178.6	176.7	60.4	0	0	0	112.3	L70 R71 N76 Y77 I78 I116 L324 T328 L343	L70-L74 VanDerWaalsContact O-CB 3.29Å; L70-L74 WeakPolarHBondContact O-CB 3.42Å; L70-L74 PolarHBondContact O-N 2.81Å; R71-L74 PolarHBondContact O-N 3.02Å; L74-N76 VanDerWaalsContact C-N 3.33Å; L74-N76 PolarHBondContact O-N 2.73Å; L74-Y77 WeakPolarHBondContact O-CB 3.47Å; L74-Y77 PolarHBondContact O-N 2.93Å; L74-I78 HydrophobicContact CD1-CG2 3.74Å; L74-I78 HydrophobicContact CG-CG2 4.44Å; L74-I78 WeakPolarHBondContact O-CG1 3.23Å; L74-I78 PolarHBondContact O-N 3.23Å; L74-I116 HydrophobicContact CB-CD1 4.41Å; L74-I116 HydrophobicContact CD1-CG2 3.97Å; L74-L324 HydrophobicContact CD1-CB 4.5Å; L74-L324 HydrophobicContact CD1-CD1 4.11Å; L74-L324 HydrophobicContact CD1-CD2 4.08Å; L74-L324 HydrophobicContact CD1-CG 4.45Å; L74-L324 HydrophobicContact CD2-CB 3.91Å; L74-L324 HydrophobicContact CD2-CD2 3.92Å; L74-L324 HydrophobicContact CD2-CG 4.41Å; L74-L324 HydrophobicContact CG-CD2 4.41Å; L74-T328 HydrophobicContact CD2-CG2 3.38Å; L74-T328 HydrophobicContact CG-CG2 4.19Å; L74-L343 HydrophobicContact CD1-CD1 4.3Å
75	Y	96.6	Very high	95.3	Very high	0 Å²	0	18.2 Å²	18.2	0%	0	10%	0.104	C	C	.	.	H	α-helix	trans	-64.7	-38	179.8	-85.5	-124.9	0	0	0	111.9	R71 T72 A73 F79 L290 T328 F350 I355	R71-Y75 HydrophobicContact CG-CD2 4Å; R71-Y75 HydrophobicContact CG-CE2 3.8Å; R71-Y75 WeakPolarHBondContact O-CD2 3.33Å; R71-Y75 PolarHBondContact O-N 3.06Å; T72-Y75 PolarHBondContact O-N 3Å; A73-Y75 PolarHBondContact O-N 3.16Å; Y75-F79 WeakPolarHBondContact O-CB 3.38Å; Y75-F79 PolarHBondContact O-N 3.01Å; Y75-F79 VanDerWaalsContact O-N 3.11Å; Y75-L290 HydrophobicContact CD1-CD1 4.42Å; Y75-L290 HydrophobicContact CD1-CD2 3.52Å; Y75-L290 HydrophobicContact CE1-CD2 4.09Å; Y75-L290 HydrophobicContact CG-CD1 4.28Å; Y75-L290 HydrophobicContact CG-CD2 4.19Å; Y75-T328 HydrophobicContact CE2-CG2 3.9Å; Y75-F350 AromaticContact CD1-CE2 3.73Å; Y75-F350 HydrophobicContact CD1-CE2 3.73Å; Y75-F350 AromaticContact CD1-CZ 3.74Å; Y75-F350 HydrophobicContact CD1-CZ 3.74Å; Y75-F350 AromaticContact CE1-CE2 3.86Å; Y75-F350 HydrophobicContact CE1-CE2 3.86Å; Y75-F350 HydrophobicContact CE1-CZ 4.29Å; Y75-F350 HydrophobicContact CG-CE2 4.39Å; Y75-F350 HydrophobicContact CG-CZ 4.36Å; Y75-I355 HydrophobicContact CD1-CD1 3.83Å; Y75-I355 HydrophobicContact CE1-CD1 3.68Å; Y75-I355 HydrophobicContact CE1-CG1 4.04Å
76	N	98.2	Very high	95.4	Very high	0 Å²	0	18.8 Å²	18.8	0%	0	11%	0.109	C	C	.	.	H	α-helix	trans	-65.6	-45.2	171.8	-78.9	-89.9	0	0	0	110.7	V55 R56 T72 A73 L74 F79 A80 F87 L261	V55-N76 HydrophobicContact CB-CB 4.39Å; V55-N76 WeakPolarHBondContact CB-OD1 3.49Å; V55-N76 HydrophobicContact CG2-CB 3.91Å; V55-N76 VanDerWaalsContact CG2-O 3.32Å; V55-N76 WeakPolarHBondContact CG2-O 3.47Å; R56-N76 PolarHBondContact O-OD1 3.04Å; T72-N76 PolarHBondContact O-N 3.23Å; T72-N76 VanDerWaalsContact O-N 3.16Å; T72-N76 PolarHBondContact O-ND2 3.32Å; A73-N76 PolarHBondContact O-N 3.06Å; L74-N76 VanDerWaalsContact C-N 3.33Å; L74-N76 PolarHBondContact O-N 2.73Å; N76-F79 PolarHBondContact O-N 3.39Å; N76-A80 WeakPolarHBondContact O-CB 3.37Å; N76-A80 PolarHBondContact O-N 2.92Å; N76-F87 HydrophobicContact CB-CD2 3.82Å; N76-F87 HydrophobicContact CB-CE2 3.64Å; N76-L261 PolarHBondContact ND2-O 2.96Å
77	Y	98.3	Very high	95.7	Very high	24 Å²	24	16.5 Å²	16.5	9%	0.094	10%	0.099	C	C	.	.	H	α-helix	trans	-59.2	-53.9	179.2	-179	-93.8	0	0	0	112.2	A73 L74 F79 A80 K81 F87 I116 L343 I347	A73-Y77 WeakPolarHBondContact O-CB 3.3Å; A73-Y77 PolarHBondContact O-N 2.92Å; L74-Y77 WeakPolarHBondContact O-CB 3.47Å; L74-Y77 PolarHBondContact O-N 2.93Å; Y77-F79 VanDerWaalsContact C-N 3.31Å; Y77-F79 PolarHBondContact O-N 3.14Å; Y77-A80 WeakPolarHBondContact O-CB 3.44Å; Y77-A80 PolarHBondContact O-N 2.91Å; Y77-K81 HydrophobicContact CD1-CG 4.18Å; Y77-K81 HydrophobicContact CD2-CG 4.48Å; Y77-K81 HydrophobicContact CE1-CG 3.82Å; Y77-K81 HydrophobicContact CE2-CD 4.41Å; Y77-K81 VanDerWaalsContact CE2-CE 3.42Å; Y77-K81 HydrophobicContact CE2-CG 4.15Å; Y77-K81 WeakPolarHBondContact O-CG 3.5Å; Y77-K81 PolarHBondContact O-N 3Å; Y77-F87 HydrophobicContact CD2-CB 4.32Å; Y77-F87 AromaticContact CD2-CD1 3.59Å; Y77-F87 HydrophobicContact CD2-CD1 3.59Å; Y77-F87 HydrophobicContact CD2-CE1 4.18Å; Y77-F87 HydrophobicContact CD2-CG 4.09Å; Y77-F87 HydrophobicContact CG-CD1 4.39Å; Y77-I116 HydrophobicContact CD1-CB 4.06Å; Y77-I116 HydrophobicContact CD1-CG2 3.56Å; Y77-I116 HydrophobicContact CD2-CB 3.87Å; Y77-I116 HydrophobicContact CD2-CG2 4.3Å; Y77-I116 HydrophobicContact CE1-CB 4.4Å; Y77-I116 HydrophobicContact CE1-CG2 3.89Å; Y77-I116 HydrophobicContact CE2-CB 4.24Å; Y77-I116 HydrophobicContact CG-CB 3.77Å; Y77-I116 HydrophobicContact CG-CG2 3.78Å; Y77-L343 HydrophobicContact CD1-CD1 4.41Å; Y77-L343 HydrophobicContact CE1-CD1 4.15Å; Y77-L343 HydrophobicContact CE1-CD2 4.11Å; Y77-L343 HydrophobicContact CE1-CG 4.42Å; Y77-I347 HydrophobicContact CE1-CD1 4.24Å
78	I	96.9	Very high	96.1	Very high	0 Å²	0	16.5 Å²	16.5	0%	0	10%	0.099	C	C	.	.	H	α-helix	trans	-66.1	-33.9	-179.2	67	-170.8	0	0	0	112	L74 K82 F334 L343 L346 I347 F350	L74-I78 HydrophobicContact CD1-CG2 3.74Å; L74-I78 HydrophobicContact CG-CG2 4.44Å; L74-I78 WeakPolarHBondContact O-CG1 3.23Å; L74-I78 PolarHBondContact O-N 3.23Å; I78-K82 WeakPolarHBondContact O-CB 3.35Å; I78-K82 PolarHBondContact O-N 2.72Å; I78-F334 HydrophobicContact CD1-CZ 4.18Å; I78-L343 HydrophobicContact CG2-CD1 4.38Å; I78-L346 HydrophobicContact CG2-CB 4.21Å; I78-I347 HydrophobicContact CB-CG1 4.26Å; I78-I347 HydrophobicContact CG2-CG1 4.01Å; I78-F350 HydrophobicContact CD1-CB 4.02Å; I78-F350 HydrophobicContact CD1-CD1 4.08Å; I78-F350 HydrophobicContact CD1-CD2 3.38Å; I78-F350 HydrophobicContact CD1-CE1 4.34Å; I78-F350 HydrophobicContact CD1-CE2 3.71Å; I78-F350 HydrophobicContact CD1-CG 3.58Å; I78-F350 HydrophobicContact CD1-CZ 4.18Å; I78-F350 HydrophobicContact CG1-CB 4.17Å; I78-F350 HydrophobicContact CG1-CD1 3.75Å; I78-F350 HydrophobicContact CG1-CD2 4.02Å; I78-F350 HydrophobicContact CG1-CE1 4.03Å; I78-F350 HydrophobicContact CG1-CE2 4.29Å; I78-F350 HydrophobicContact CG1-CG 3.73Å; I78-F350 HydrophobicContact CG1-CZ 4.29Å
79	F	96.9	Very high	96.5	Very high	4 Å²	4	15.6 Å²	15.6	2%	0.018	9%	0.089	C	C	.	.	H	α-helix	trans	-63	-49.4	172.6	-173.4	-93.7	0	0	0	110.8	V53 V55 Y75 N76 Y77 K81 K82 Y83 H259 L261 F350 P352	V53-F79 HydrophobicContact CG1-CD1 3.71Å; V53-F79 HydrophobicContact CG1-CE1 3.52Å; V53-F79 HydrophobicContact CG2-CE1 4.39Å; V55-F79 HydrophobicContact CG1-CD1 3.68Å; V55-F79 HydrophobicContact CG1-CE1 4.04Å; Y75-F79 WeakPolarHBondContact O-CB 3.38Å; Y75-F79 PolarHBondContact O-N 3.01Å; Y75-F79 VanDerWaalsContact O-N 3.11Å; N76-F79 PolarHBondContact O-N 3.39Å; Y77-F79 VanDerWaalsContact C-N 3.31Å; Y77-F79 PolarHBondContact O-N 3.14Å; F79-K81 PolarHBondContact O-N 3.34Å; F79-K82 PolarHBondContact O-N 3.19Å; F79-Y83 HydrophobicContact CD1-CD2 4.21Å; F79-Y83 AromaticContact CD2-CD2 3.89Å; F79-Y83 HydrophobicContact CD2-CD2 3.89Å; F79-Y83 AromaticContact CD2-CE2 3.59Å; F79-Y83 HydrophobicContact CD2-CE2 3.59Å; F79-Y83 HydrophobicContact CE1-CD2 4.12Å; F79-Y83 AromaticContact CE2-CD2 3.79Å; F79-Y83 HydrophobicContact CE2-CD2 3.79Å; F79-Y83 AromaticContact CE2-CE2 3.39Å; F79-Y83 HydrophobicContact CE2-CE2 3.39Å; F79-Y83 HydrophobicContact CG-CD2 4.11Å; F79-Y83 HydrophobicContact CG-CE2 4.27Å; F79-Y83 AromaticContact CZ-CD2 3.91Å; F79-Y83 HydrophobicContact CZ-CD2 3.91Å; F79-Y83 AromaticContact CZ-CE2 3.92Å; F79-Y83 HydrophobicContact CZ-CE2 3.92Å; F79-Y83 WeakPolarHBondContact O-CD2 3.44Å; F79-Y83 PolarHBondContact O-N 3.01Å; F79-H259 HydrophobicContact CE1-CB 3.91Å; F79-H259 AromaticContact CE1-CD2 3.91Å; F79-H259 AromaticContact CE1-CG 3.64Å; F79-H259 AromaticContact CE1-ND1 3.84Å; F79-H259 HydrophobicContact CZ-CB 4.38Å; F79-H259 AromaticContact CZ-CD2 3.6Å; F79-H259 AromaticContact CZ-CG 3.84Å; F79-H259 AromaticContact CZ-NE2 3.87Å; F79-L261 HydrophobicContact CB-CD1 3.85Å; F79-L261 HydrophobicContact CD1-CD1 4.33Å; F79-L261 HydrophobicContact CD2-CD1 4.16Å; F79-L261 HydrophobicContact CG-CD1 3.86Å; F79-F350 HydrophobicContact CB-CD1 4.39Å; F79-F350 HydrophobicContact CB-CE1 3.91Å; F79-F350 HydrophobicContact CD2-CD1 4.49Å; F79-F350 AromaticContact CD2-CE1 3.93Å; F79-F350 HydrophobicContact CD2-CE1 3.93Å; F79-F350 HydrophobicContact CG-CE1 4.43Å; F79-P352 HydrophobicContact CD2-CG 3.76Å; F79-P352 HydrophobicContact CE2-CG 3.75Å
80	A	97.4	Very high	96.8	Very high	0 Å²	0	15.3 Å²	15.3	0%	0	9%	0.086	C	C	.	.	H	α-helix	trans	-56.7	-53.8	176.8	0	0	0	0	0	111	V55 N76 Y77 K82 Y83 G84 G85 F87	V55-A80 HydrophobicContact CG2-CB 3.77Å; N76-A80 WeakPolarHBondContact O-CB 3.37Å; N76-A80 PolarHBondContact O-N 2.92Å; Y77-A80 WeakPolarHBondContact O-CB 3.44Å; Y77-A80 PolarHBondContact O-N 2.91Å; A80-K82 VanDerWaalsContact C-N 3.35Å; A80-K82 PolarHBondContact O-N 3.08Å; A80-Y83 CarbonylContact O-C 3.04Å; A80-Y83 PolarHBondContact O-N 3.02Å; A80-G84 PolarHBondContact O-N 2.83Å; A80-G85 PolarHBondContact O-N 3.29Å; A80-F87 HydrophobicContact CB-CB 4.02Å
81	K	96.6	Very high	96.9	Very high	61 Å²	61	15.5 Å²	15.5	27%	0.265	9%	0.087	S	C	.	.	H	α-helix	trans	-63.6	-38.5	-177	-62.3	-46.7	-178.4	-166.6	0	112.5	Y77 F79 Y83 G84 D119 I347	Y77-K81 HydrophobicContact CD1-CG 4.18Å; Y77-K81 HydrophobicContact CD2-CG 4.48Å; Y77-K81 HydrophobicContact CE1-CG 3.82Å; Y77-K81 HydrophobicContact CE2-CD 4.41Å; Y77-K81 VanDerWaalsContact CE2-CE 3.42Å; Y77-K81 HydrophobicContact CE2-CG 4.15Å; Y77-K81 WeakPolarHBondContact O-CG 3.5Å; Y77-K81 PolarHBondContact O-N 3Å; F79-K81 PolarHBondContact O-N 3.34Å; K81-Y83 VanDerWaalsContact C-N 3.3Å; K81-Y83 PolarHBondContact O-N 3.44Å; K81-G84 PolarHBondContact O-N 2.73Å; K81-D119 IonicContact NZ-OD1 3.4Å; K81-D119 PolarHBondContact NZ-OD1 2.93Å; K81-D119 IonicContact NZ-OD2 3.68Å; K81-D119 PolarHBondContact NZ-OD2 3.1Å; K81-I347 HydrophobicContact CB-CD1 3.87Å; K81-I347 HydrophobicContact CB-CG1 4.01Å; K81-I347 HydrophobicContact CB-CG2 3.78Å; K81-I347 HydrophobicContact CG-CD1 4.21Å
82	K	94.9	Very high	97.1	Very high	72 Å²	72	15.6 Å²	15.6	31%	0.313	9%	0.088	S	C	.	.	H	α-helix	trans	-61	-39.3	177.7	-176.2	179	-177.7	108.2	0	112.4	I78 F79 A80 I347 S348 F350	I78-K82 WeakPolarHBondContact O-CB 3.35Å; I78-K82 PolarHBondContact O-N 2.72Å; F79-K82 PolarHBondContact O-N 3.19Å; A80-K82 VanDerWaalsContact C-N 3.35Å; A80-K82 PolarHBondContact O-N 3.08Å; K82-I347 HydrophobicContact CB-CG2 4.25Å; K82-I347 WeakPolarHBondContact CB-O 3.36Å; K82-I347 WeakPolarHBondContact CG-O 3.22Å; K82-S348 PolarHBondContact NZ-O 2.96Å; K82-F350 HydrophobicContact CD-CB 4.3Å; K82-F350 WeakPolarHBondContact CD-O 3.41Å; K82-F350 WeakPolarHBondContact CE-O 3.33Å; K82-F350 PolarHBondContact NZ-O 2.98Å
83	Y	94.7	Very high	97.2	Very high	55 Å²	55	14.9 Å²	14.9	22%	0.216	8%	0.083	C	C	.	.	T	Hydrogen-bonded Turn	trans	-99.4	15.2	-178.3	-62.6	-72.1	0	0	0	113.2	T48 Q50 G51 V53 F79 A80 K81 G85	T48-Y83 HydrophobicContact CG2-CE1 4.44Å; Q50-Y83 WeakPolarHBondContact CA-O 3.49Å; G51-Y83 PolarHBondContact N-O 3.43Å; V53-Y83 HydrophobicContact CG2-CG 4.34Å; F79-Y83 HydrophobicContact CD1-CD2 4.21Å; F79-Y83 AromaticContact CD2-CD2 3.89Å; F79-Y83 HydrophobicContact CD2-CD2 3.89Å; F79-Y83 AromaticContact CD2-CE2 3.59Å; F79-Y83 HydrophobicContact CD2-CE2 3.59Å; F79-Y83 HydrophobicContact CE1-CD2 4.12Å; F79-Y83 AromaticContact CE2-CD2 3.79Å; F79-Y83 HydrophobicContact CE2-CD2 3.79Å; F79-Y83 AromaticContact CE2-CE2 3.39Å; F79-Y83 HydrophobicContact CE2-CE2 3.39Å; F79-Y83 HydrophobicContact CG-CD2 4.11Å; F79-Y83 HydrophobicContact CG-CE2 4.27Å; F79-Y83 AromaticContact CZ-CD2 3.91Å; F79-Y83 HydrophobicContact CZ-CD2 3.91Å; F79-Y83 AromaticContact CZ-CE2 3.92Å; F79-Y83 HydrophobicContact CZ-CE2 3.92Å; F79-Y83 WeakPolarHBondContact O-CD2 3.44Å; F79-Y83 PolarHBondContact O-N 3.01Å; A80-Y83 CarbonylContact O-C 3.04Å; A80-Y83 PolarHBondContact O-N 3.02Å; K81-Y83 VanDerWaalsContact C-N 3.3Å; K81-Y83 PolarHBondContact O-N 3.44Å; Y83-G85 PolarHBondContact O-N 3.24Å
84	G	94.9	Very high	97	Very high	42 Å²	42	15.6 Å²	15.6	43%	0.433	9%	0.087	S	C	.	.	T	Hydrogen-bonded Turn	trans	62	27.3	178.7	0	0	0	0	0	114.2	G51 A80 K81	G51-G84 WeakPolarHBondContact CA-O 3.43Å; A80-G84 PolarHBondContact O-N 2.83Å; K81-G84 PolarHBondContact O-N 2.73Å
85	G	95.8	Very high	96.7	Very high	14 Å²	14	18.4 Å²	18.4	14%	0.144	10%	0.102	C	C	.	.			trans	-96.1	-171.6	-176.8	0	0	0	0	0	115	V53 A80 Y83	V53-G85 CarbonylContact O-C 3.53Å; V53-G85 WeakPolarHBondContact O-CA 3.18Å; A80-G85 PolarHBondContact O-N 3.29Å; Y83-G85 PolarHBondContact O-N 3.24Å
86	A	97.4	Very high	96.5	Very high	17 Å²	17	22.6 Å²	22.6	14%	0.14	12%	0.122	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	134.9	179	0	0	0	0	0	112.6	V53 R54 V55 D119	V53-A86 PolarHBondContact O-N 2.98Å; R54-A86 HydrophobicContact CG-CB 4.39Å; V55-A86 PolarHBondContact N-O 3.46Å; A86-D119 HydrophobicContact CB-CB 4.47Å
87	F	98.5	Very high	96.1	Very high	0 Å²	0	27.8 Å²	27.8	0%	0	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	114.8	172.7	174.4	-123.3	0	0	0	110.8	V55 F57 A73 N76 Y77 A80 P118 D119	V55-F87 HydrophobicContact CG2-CD2 4.26Å; F57-F87 HydrophobicContact CB-CE2 3.61Å; F57-F87 HydrophobicContact CB-CZ 3.68Å; A73-F87 HydrophobicContact CB-CZ 4.16Å; N76-F87 HydrophobicContact CB-CD2 3.82Å; N76-F87 HydrophobicContact CB-CE2 3.64Å; Y77-F87 HydrophobicContact CD2-CB 4.32Å; Y77-F87 AromaticContact CD2-CD1 3.59Å; Y77-F87 HydrophobicContact CD2-CD1 3.59Å; Y77-F87 HydrophobicContact CD2-CE1 4.18Å; Y77-F87 HydrophobicContact CD2-CG 4.09Å; Y77-F87 HydrophobicContact CG-CD1 4.39Å; A80-F87 HydrophobicContact CB-CB 4.02Å; F87-P118 HydrophobicContact CD1-CB 4.26Å; F87-P118 HydrophobicContact CE1-CB 4.35Å; F87-P118 CarbonylContact O-C 3.59Å; F87-D119 PolarHBondContact N-OD2 3.49Å; F87-D119 PolarHBondContact O-N 3.25Å
88	I	98.8	Very high	95.8	Very high	0 Å²	0	33.6 Å²	33.6	0%	0	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	135	-172.5	-57.9	153	0	0	0	110.4	R54 V55 R56 F57 E120 Y131 M255 I257	R54-I88 HydrophobicContact CB-CD1 4.35Å; R54-I88 VanDerWaalsContact NH2-CD1 3.34Å; V55-I88 WeakPolarHBondContact O-CB 3.22Å; V55-I88 PolarHBondContact O-N 3.43Å; R56-I88 CarbonylContact C-O 3.59Å; R56-I88 WeakPolarHBondContact CA-O 3.46Å; R56-I88 HydrophobicContact CB-CB 4.1Å; F57-I88 PolarHBondContact N-O 3.3Å; I88-E120 CarbonylContact C-O 3.6Å; I88-E120 WeakPolarHBondContact CA-O 3.47Å; I88-E120 HydrophobicContact CB-CB 4.48Å; I88-E120 HydrophobicContact CG1-CB 4.08Å; I88-E120 HydrophobicContact CG1-CG 4.43Å; I88-E120 HydrophobicContact CG2-CB 4.19Å; I88-Y131 HydrophobicContact CG2-CD1 3.76Å; I88-Y131 HydrophobicContact CG2-CE1 3.63Å; I88-M255 HydrophobicContact CG2-SD 4.34Å; I88-I257 HydrophobicContact CD1-CD1 3.5Å
89	L	98.8	Very high	95.7	Very high	0 Å²	0	36.3 Å²	36.3	0%	0	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	119.3	166	175.7	62.6	0	0	0	109.5	F57 P59 L91 I107 E108 L111 P118 E120	F57-L89 HydrophobicContact CD1-CD1 3.86Å; P59-L89 HydrophobicContact CG-CD1 3.97Å; L89-L91 HydrophobicContact CD1-CD2 4.27Å; L89-I107 HydrophobicContact CD1-CG2 4.27Å; L89-E108 HydrophobicContact CD2-CB 3.81Å; L89-E108 HydrophobicContact CD2-CG 3.92Å; L89-L111 HydrophobicContact CD1-CD1 4.17Å; L89-L111 HydrophobicContact CD2-CD1 4.18Å; L89-P118 HydrophobicContact CB-CB 3.75Å; L89-P118 HydrophobicContact CB-CG 4.02Å; L89-P118 HydrophobicContact CD2-CG 4.36Å; L89-E120 PolarHBondContact N-O 3.21Å
90	R	98.7	Very high	95.5	Very high	0 Å²	0	38.5 Å²	38.5	0%	0	21%	0.208	C	C	.	.			trans	-120.5	124.4	172.5	179.6	177.9	67.1	-132.3	5.6	109.9	F57 A58 P59 E92 Q133 N248 D251 D252 M255	F57-R90 PolarHBondContact O-N 3.06Å; A58-R90 CarbonylContact C-O 3.6Å; A58-R90 VanDerWaalsContact CA-O 3.22Å; A58-R90 WeakPolarHBondContact CA-O 3.4Å; P59-R90 WeakPolarHBondContact CD-O 3.07Å; R90-E92 IonicContact CZ-OE1 2.88Å; R90-E92 IonicContact NE-OE1 3.23Å; R90-E92 IonicContact NH2-OE1 2.69Å; R90-E92 PolarHBondContact NH2-OE1 3.19Å; R90-E92 VanDerWaalsContact NH2-OE1 3.1Å; R90-Q133 HydrophobicContact CG-CG 4.43Å; R90-N248 PolarHBondContact NH2-ND2 2.51Å; R90-D251 IonicContact NE-OD2 3.6Å; R90-D252 IonicContact CZ-OD1 3.87Å; R90-D252 VanDerWaalsContact CZ-OD1 3.25Å; R90-D252 IonicContact NH1-OD1 2.87Å; R90-D252 PolarHBondContact NH1-OD1 3.26Å; R90-D252 IonicContact NH2-OD1 2.76Å; R90-D252 PolarHBondContact NH2-OD1 3.01Å; R90-M255 HydrophobicContact CB-CE 4.44Å; R90-M255 HydrophobicContact CB-SD 4.34Å; R90-M255 HydrophobicContact CG-CE 4.01Å; R90-M255 HydrophobicContact CG-SD 4.35Å
91	L	98.3	Very high	95.3	Very high	4 Å²	4	44.3 Å²	44.3	2%	0.021	25%	0.246	C	C	.	.	B	Isolated β-bridge	trans	-88.9	118.3	178.2	-64.5	179.7	0	0	0	110.8	P59 L89 D93 A104 P122 Y131 L132 Q133	P59-L91 HydrophobicContact CG-CD2 4.11Å; L89-L91 HydrophobicContact CD1-CD2 4.27Å; L91-D93 PolarHBondContact O-N 3.4Å; L91-A104 HydrophobicContact CD1-CB 3.48Å; L91-A104 VanDerWaalsContact CD1-CB 3.48Å; L91-P122 HydrophobicContact CD1-CG 3.83Å; L91-P122 HydrophobicContact CG-CG 3.97Å; L91-Y131 PolarHBondContact N-O 3.01Å; L91-L132 HydrophobicContact CB-CG 4.32Å; L91-L132 HydrophobicContact CD1-CD1 4.12Å; L91-L132 HydrophobicContact CD1-CG 4.34Å; L91-Q133 WeakPolarHBondContact O-CG 3.4Å; L91-Q133 PolarHBondContact O-N 3.35Å; L91-Q133 VanDerWaalsContact O-N 3.16Å
92	E	97.6	Very high	95.2	Very high	7 Å²	7	43.3 Å²	43.3	3%	0.033	25%	0.252	C	S	.	.			trans	-93.8	72.2	-178	-59.9	-161.9	155	0	0	111.2	A58 P59 S60 R90 T94 Q133 Y244 N248	A58-E92 HydrophobicContact CB-CG 4Å; P59-E92 PolarHBondContact O-N 3.34Å; S60-E92 WeakPolarHBondContact CA-O 3.43Å; S60-E92 VanDerWaalsContact CB-O 3.29Å; S60-E92 WeakPolarHBondContact CB-O 3.43Å; S60-E92 PolarHBondContact OG-O 2.83Å; S60-E92 VanDerWaalsContact OG-O 3.12Å; R90-E92 IonicContact CZ-OE1 2.88Å; R90-E92 IonicContact NE-OE1 3.23Å; R90-E92 IonicContact NH2-OE1 2.69Å; R90-E92 PolarHBondContact NH2-OE1 3.19Å; R90-E92 VanDerWaalsContact NH2-OE1 3.1Å; E92-T94 PolarHBondContact O-N 3.48Å; E92-Q133 VanDerWaalsContact CA-OE1 3.25Å; E92-Q133 VanDerWaalsContact CB-OE1 3.28Å; E92-Q133 HydrophobicContact CG-CG 4.45Å; E92-Y244 VanDerWaalsContact OE2-CD2 3.26Å; E92-Y244 WeakPolarHBondContact OE2-CD2 3.46Å; E92-Y244 WeakPolarHBondContact OE2-CE2 3.18Å; E92-N248 PolarHBondContact OE1-ND2 2.75Å
93	D	96.1	Very high	95.2	Very high	13 Å²	13	39.9 Å²	39.9	7%	0.07	24%	0.237	C	C	.	.			trans	-92.8	22.5	-172.7	64.9	-22.9	0	0	0	114.3	P61 L91 D95 Q96 L99 Q133 S134	P61-D93 HydrophobicContact CG-CB 3.88Å; L91-D93 PolarHBondContact O-N 3.4Å; D93-D95 VanDerWaalsContact C-N 3.25Å; D93-D95 PolarHBondContact O-N 3.03Å; D93-Q96 PolarHBondContact O-NE2 3.03Å; D93-L99 HydrophobicContact CB-CD1 4.37Å; D93-L99 HydrophobicContact CB-CD2 3.81Å; D93-Q133 PolarHBondContact OD1-N 3.01Å; D93-Q133 VanDerWaalsContact OD1-N 3.14Å; D93-S134 PolarHBondContact OD1-N 3.05Å; D93-S134 WeakPolarHBondContact OD2-CB 3.37Å; D93-S134 PolarHBondContact OD2-OG 3.07Å
94	T	93.3	Very high	95.2	Very high	14 Å²	14	38.3 Å²	38.3	9%	0.086	24%	0.236	C	C	.	.			trans	-66.4	-20.1	-177	59	0	0	0	0	115.2	E92 Q96 Q133 K237 P242 A247	E92-T94 PolarHBondContact O-N 3.48Å; T94-Q96 PolarHBondContact O-N 3.21Å; T94-Q133 HydrophobicContact CG2-CB 3.71Å; T94-Q133 HydrophobicContact CG2-CG 4.48Å; T94-Q133 VanDerWaalsContact CG2-OE1 3.22Å; T94-K237 PolarHBondContact O-NZ 3.11Å; T94-K237 VanDerWaalsContact O-NZ 3.09Å; T94-P242 HydrophobicContact CG2-CG 3.71Å; T94-A247 HydrophobicContact CG2-CB 4.12Å
95	D	92	Very high	95.2	Very high	59 Å²	59	41.4 Å²	41.4	32%	0.316	24%	0.239	S	C	.	.			trans	-96.8	81.2	173.4	-168.7	-11.9	0	0	0	110.5	D93 S97 R98	D93-D95 VanDerWaalsContact C-N 3.25Å; D93-D95 PolarHBondContact O-N 3.03Å; D95-S97 PolarHBondContact O-N 2.9Å; D95-S97 VanDerWaalsContact O-N 3.15Å; D95-S97 PolarHBondContact OD1-N 3.45Å; D95-S97 PolarHBondContact OD1-OG 3.39Å; D95-R98 PolarHBondContact O-N 3.32Å; D95-R98 VanDerWaalsContact O-N 3.12Å; D95-R98 WeakPolarHBondContact OD2-CD 3.47Å
96	Q	91.4	Very high	95.3	Very high	89 Å²	89	41.5 Å²	41.5	42%	0.416	24%	0.237	S	C	.	.	G	3₁₀ helix	trans	-56.3	-30.2	-177.5	-63.6	-68.6	-57.2	0	0	112.9	D93 T94 R98 F241	D93-Q96 PolarHBondContact O-NE2 3.03Å; T94-Q96 PolarHBondContact O-N 3.21Å; Q96-R98 PolarHBondContact O-N 2.68Å; Q96-F241 HydrophobicContact CG-CD1 4.4Å; Q96-F241 HydrophobicContact CG-CE1 3.86Å; Q96-F241 HydrophobicContact CG-CE2 4.17Å; Q96-F241 HydrophobicContact CG-CZ 3.73Å
97	S	91.7	Very high	95.3	Very high	108 Å²	108	40.8 Å²	40.8	76%	0.755	23%	0.231	S	C	*	.	G	3₁₀ helix	trans	-71.3	-18.3	-177.7	73.6	0	0	0	0	114.1	D95	D95-S97 PolarHBondContact O-N 2.9Å; D95-S97 VanDerWaalsContact O-N 3.15Å; D95-S97 PolarHBondContact OD1-N 3.45Å; D95-S97 PolarHBondContact OD1-OG 3.39Å
98	R	91.8	Very high	95.2	Very high	147 Å²	147	41.1 Å²	41.1	56%	0.555	23%	0.232	S	C	*	.	G	3₁₀ helix	trans	-111	1.5	-174.4	-66.7	-174.3	63.1	-167.8	-8.6	113.5	T62 D95 Q96	T62-R98 WeakPolarHBondContact CA-O 3.27Å; T62-R98 WeakPolarHBondContact CB-O 3.48Å; T62-R98 HydrophobicContact CG2-CB 3.59Å; T62-R98 WeakPolarHBondContact CG2-O 3.18Å; D95-R98 PolarHBondContact O-N 3.32Å; D95-R98 VanDerWaalsContact O-N 3.12Å; D95-R98 WeakPolarHBondContact OD2-CD 3.47Å; Q96-R98 PolarHBondContact O-N 2.68Å
99	L	93.2	Very high	95.2	Very high	57 Å²	57	44.2 Å²	44.2	30%	0.298	25%	0.249	S	C	.	.			trans	-64.1	138.4	-178.7	-60.1	-176	0	0	0	110.8	P61 D93	P61-L99 HydrophobicContact CG-CD2 3.97Å; D93-L99 HydrophobicContact CB-CD1 4.37Å; D93-L99 HydrophobicContact CB-CD2 3.81Å
100	V	93.7	Very high	95.1	Very high	50 Å²	50	45.4 Å²	45.4	30%	0.303	26%	0.255	S	S	.	.			trans	-106.7	118.4	173	174.8	0	0	0	0	107.5	P61 F64 G102 A103	P61-V100 PolarHBondContact O-N 3.48Å; F64-V100 HydrophobicContact CE2-CG1 4.17Å; F64-V100 HydrophobicContact CZ-CG1 4.19Å; V100-G102 PolarHBondContact O-N 3.12Å; V100-A103 HydrophobicContact CB-CB 3.9Å; V100-A103 HydrophobicContact CG1-CB 4.16Å; V100-A103 WeakPolarHBondContact O-CB 3.44Å; V100-A103 PolarHBondContact O-N 2.94Å; V100-A103 VanDerWaalsContact O-N 3.09Å
101	P	93.8	Very high	95.1	Very high	122 Å²	122	45.4 Å²	45.4	79%	0.792	26%	0.255	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.1	136.9	176.8	-26.5	35	0	0	0	111.7	A103	P101-A103 PolarHBondContact O-N 2.96Å
102	G	94.6	Very high	95.1	Very high	39 Å²	39	48.3 Å²	48.3	40%	0.402	27%	0.268	S	S	.	.	T	Hydrogen-bonded Turn	trans	77.5	-9.3	-178.3	0	0	0	0	0	115.2	V100 E105 S106	V100-G102 PolarHBondContact O-N 3.12Å; G102-E105 WeakPolarHBondContact CA-OE2 3.47Å; G102-S106 WeakPolarHBondContact O-CB 3.43Å; G102-S106 PolarHBondContact O-N 3.35Å
103	A	94.6	Very high	95.1	Very high	0 Å²	0	51.4 Å²	51.4	0%	0	28%	0.28	C	S	.	.	H	α-helix	trans	-69.5	-33.7	-178.9	0	0	0	0	0	112.5	P61 F64 V100 P101 I107	P61-A103 HydrophobicContact CB-CB 4.16Å; F64-A103 HydrophobicContact CD1-CB 4.35Å; F64-A103 HydrophobicContact CE1-CB 4.38Å; V100-A103 HydrophobicContact CB-CB 3.9Å; V100-A103 HydrophobicContact CG1-CB 4.16Å; V100-A103 WeakPolarHBondContact O-CB 3.44Å; V100-A103 PolarHBondContact O-N 2.94Å; V100-A103 VanDerWaalsContact O-N 3.09Å; P101-A103 PolarHBondContact O-N 2.96Å; A103-I107 WeakPolarHBondContact O-CB 3.37Å; A103-I107 WeakPolarHBondContact O-CD1 3.37Å; A103-I107 WeakPolarHBondContact O-CG1 3.3Å; A103-I107 PolarHBondContact O-N 3.03Å
104	A	94.1	Very high	95.1	Very high	22 Å²	22	50.9 Å²	50.9	18%	0.182	28%	0.278	C	S	.	.	H	α-helix	trans	-60.7	-50.9	177	0	0	0	0	0	111.5	P61 L91	P61-A104 HydrophobicContact CB-CB 4.22Å; L91-A104 HydrophobicContact CD1-CB 3.48Å; L91-A104 VanDerWaalsContact CD1-CB 3.48Å
105	E	95.8	Very high	95.3	Very high	108 Å²	108	51.7 Å²	51.7	51%	0.505	29%	0.289	S	S	.	.	H	α-helix	trans	-66.5	-47.3	179.7	-61.3	75.6	-167.6	0	0	110.7	G102 I107 E108 D109 R123	G102-E105 WeakPolarHBondContact CA-OE2 3.47Å; E105-I107 VanDerWaalsContact C-N 3.32Å; E105-I107 PolarHBondContact O-N 3.31Å; E105-E108 PolarHBondContact O-N 3.26Å; E105-E108 VanDerWaalsContact O-N 3.13Å; E105-D109 PolarHBondContact O-N 3.47Å; E105-R123 PolarHBondContact O-NH2 3.38Å
106	S	96.5	Very high	95.6	Very high	15 Å²	15	48.9 Å²	48.9	11%	0.105	27%	0.274	C	S	.	.	H	α-helix	trans	-61.1	-37.5	179.3	175.3	0	0	0	0	112.8	F64 G102 E108 D109 M110	F64-S106 WeakPolarHBondContact CD1-OG 3.32Å; G102-S106 WeakPolarHBondContact O-CB 3.43Å; G102-S106 PolarHBondContact O-N 3.35Å; S106-E108 VanDerWaalsContact C-N 3.32Å; S106-E108 PolarHBondContact O-N 3.13Å; S106-D109 PolarHBondContact O-N 3.21Å; S106-M110 WeakPolarHBondContact O-CB 3.42Å; S106-M110 VanDerWaalsContact O-CG 3.22Å; S106-M110 WeakPolarHBondContact O-CG 3.12Å; S106-M110 PolarHBondContact O-N 3.36Å
107	I	97.6	Very high	95.9	Very high	3 Å²	3	46.1 Å²	46.1	2%	0.015	26%	0.263	C	S	.	.	H	α-helix	trans	-58	-47.5	175	-77.5	162.6	0	0	0	110.4	F57 P59 P61 L65 L89 A103 E105 M110 L111	F57-I107 HydrophobicContact CE1-CG2 4.16Å; P59-I107 HydrophobicContact CB-CD1 4.21Å; P59-I107 HydrophobicContact CG-CD1 4.15Å; P59-I107 HydrophobicContact CG-CG2 3.93Å; P61-I107 HydrophobicContact CB-CD1 4.37Å; L65-I107 HydrophobicContact CB-CG1 4.2Å; L89-I107 HydrophobicContact CD1-CG2 4.27Å; A103-I107 WeakPolarHBondContact O-CB 3.37Å; A103-I107 WeakPolarHBondContact O-CD1 3.37Å; A103-I107 WeakPolarHBondContact O-CG1 3.3Å; A103-I107 PolarHBondContact O-N 3.03Å; E105-I107 VanDerWaalsContact C-N 3.32Å; E105-I107 PolarHBondContact O-N 3.31Å; I107-M110 PolarHBondContact O-N 3.47Å; I107-L111 HydrophobicContact CG2-CD1 4.38Å; I107-L111 WeakPolarHBondContact O-CG 3.34Å; I107-L111 PolarHBondContact O-N 2.96Å; I107-L111 VanDerWaalsContact O-N 3.15Å
108	E	97.6	Very high	96.2	Very high	6 Å²	6	41 Å²	41	3%	0.028	23%	0.228	C	C	.	.	H	α-helix	trans	-68	-42.7	179.8	-170.8	165.9	-168.3	0	0	111.7	L89 E105 S106 M110 L111 E112 P118 S121 R123	L89-E108 HydrophobicContact CD2-CB 3.81Å; L89-E108 HydrophobicContact CD2-CG 3.92Å; E105-E108 PolarHBondContact O-N 3.26Å; E105-E108 VanDerWaalsContact O-N 3.13Å; S106-E108 VanDerWaalsContact C-N 3.32Å; S106-E108 PolarHBondContact O-N 3.13Å; E108-M110 VanDerWaalsContact C-N 3.28Å; E108-M110 PolarHBondContact O-N 3.24Å; E108-L111 WeakPolarHBondContact O-CB 3.37Å; E108-L111 PolarHBondContact O-N 3.27Å; E108-L111 VanDerWaalsContact O-N 3.1Å; E108-E112 WeakPolarHBondContact O-CG 3.46Å; E108-E112 PolarHBondContact O-N 2.89Å; E108-P118 HydrophobicContact CG-CG 4.47Å; E108-S121 WeakPolarHBondContact OE1-CB 3.37Å; E108-S121 PolarHBondContact OE1-OG 3.11Å; E108-R123 WeakPolarHBondContact OE1-CB 3.37Å; E108-R123 WeakPolarHBondContact OE2-CB 3.27Å; E108-R123 IonicContact OE2-NE 3.28Å
109	D	97.6	Very high	96.5	Very high	65 Å²	65	37 Å²	37	35%	0.348	22%	0.217	S	C	.	.	H	α-helix	trans	-58.1	-40.3	175.6	-68	-29.7	0	0	0	112.3	E105 S106 E112 W113 R123	E105-D109 PolarHBondContact O-N 3.47Å; S106-D109 PolarHBondContact O-N 3.21Å; D109-E112 PolarHBondContact O-N 2.98Å; D109-W113 WeakPolarHBondContact O-CB 3.46Å; D109-W113 PolarHBondContact O-N 3.29Å; D109-R123 IonicContact OD1-CZ 3.35Å; D109-R123 IonicContact OD1-NH1 2.7Å; D109-R123 PolarHBondContact OD1-NH1 2.98Å; D109-R123 IonicContact OD1-NH2 2.83Å; D109-R123 PolarHBondContact OD1-NH2 2.99Å; D109-R123 IonicContact OD2-NH2 3.18Å
110	M	97.8	Very high	96.8	Very high	25 Å²	25	35 Å²	35	12%	0.123	21%	0.207	C	C	.	.	H	α-helix	trans	-73	-26	178.4	-67.4	-60.7	96.8	0	0	113	L65 S106 I107 E108 W113 A114 I310 E311	L65-M110 HydrophobicContact CB-CB 4.28Å; L65-M110 HydrophobicContact CD2-CB 3.73Å; S106-M110 WeakPolarHBondContact O-CB 3.42Å; S106-M110 VanDerWaalsContact O-CG 3.22Å; S106-M110 WeakPolarHBondContact O-CG 3.12Å; S106-M110 PolarHBondContact O-N 3.36Å; I107-M110 PolarHBondContact O-N 3.47Å; E108-M110 VanDerWaalsContact C-N 3.28Å; E108-M110 PolarHBondContact O-N 3.24Å; M110-W113 HydrophobicContact CE-CB 4.38Å; M110-A114 WeakPolarHBondContact O-CB 3.3Å; M110-A114 PolarHBondContact O-N 3.45Å; M110-I310 HydrophobicContact CB-CB 4.42Å; M110-I310 HydrophobicContact CB-CG2 4.24Å; M110-I310 HydrophobicContact CG-CB 4.41Å; M110-I310 HydrophobicContact CG-CG2 4.44Å; M110-I310 HydrophobicContact SD-CB 4.43Å; M110-I310 HydrophobicContact SD-CG2 4.1Å; M110-E311 HydrophobicContact SD-CB 4.1Å; M110-E311 HydrophobicContact SD-CG 4.35Å
111	L	98.3	Very high	97	Very high	0 Å²	0	32.7 Å²	32.7	0%	0	19%	0.192	C	C	.	.	H	α-helix	trans	-72	-41.1	171	-67.3	172.5	0	0	0	111.5	F57 L65 A73 L89 I107 E108 A114 G115 I116	F57-L111 HydrophobicContact CD1-CD1 4Å; F57-L111 HydrophobicContact CD1-CD2 4.47Å; F57-L111 HydrophobicContact CE1-CD1 4.32Å; F57-L111 HydrophobicContact CE1-CD2 4.45Å; L65-L111 HydrophobicContact CD2-CD2 4.04Å; L65-L111 HydrophobicContact CD2-CG 4.32Å; A73-L111 HydrophobicContact CB-CD2 3.58Å; L89-L111 HydrophobicContact CD1-CD1 4.17Å; L89-L111 HydrophobicContact CD2-CD1 4.18Å; I107-L111 HydrophobicContact CG2-CD1 4.38Å; I107-L111 WeakPolarHBondContact O-CG 3.34Å; I107-L111 PolarHBondContact O-N 2.96Å; I107-L111 VanDerWaalsContact O-N 3.15Å; E108-L111 WeakPolarHBondContact O-CB 3.37Å; E108-L111 PolarHBondContact O-N 3.27Å; E108-L111 VanDerWaalsContact O-N 3.1Å; L111-A114 PolarHBondContact O-N 3.47Å; L111-G115 PolarHBondContact O-N 2.94Å; L111-I116 HydrophobicContact CB-CG1 4.37Å; L111-I116 HydrophobicContact CD2-CD1 3.57Å; L111-I116 HydrophobicContact CD2-CG1 3.92Å; L111-I116 CarbonylContact O-C 3.59Å; L111-I116 PolarHBondContact O-N 3.49Å
112	E	97.8	Very high	97.2	Very high	65 Å²	65	29 Å²	29	30%	0.304	17%	0.168	S	C	.	.	H	α-helix	trans	-61.6	-49.7	173.7	-65.4	-78.3	-177.4	0	0	110.7	E108 D109 A114 G115 P117 R124	E108-E112 WeakPolarHBondContact O-CG 3.46Å; E108-E112 PolarHBondContact O-N 2.89Å; D109-E112 PolarHBondContact O-N 2.98Å; E112-A114 VanDerWaalsContact C-N 3.29Å; E112-A114 PolarHBondContact O-N 3.32Å; E112-G115 PolarHBondContact O-N 3.01Å; E112-P117 WeakPolarHBondContact OE2-CB 3.46Å; E112-R124 VanDerWaalsContact CD-NH2 3.26Å; E112-R124 IonicContact OE1-CZ 2.88Å; E112-R124 IonicContact OE1-NE 3.32Å; E112-R124 PolarHBondContact OE1-NE 3.26Å; E112-R124 IonicContact OE1-NH2 3.9Å; E112-R124 PolarHBondContact OE1-NH2 3.49Å; E112-R124 IonicContact OE2-NH2 3.29Å; E112-R124 PolarHBondContact OE2-NH2 2.87Å
113	W	97.4	Very high	97.2	Very high	72 Å²	72	33.3 Å²	33.3	27%	0.273	17%	0.173	S	C	.	.	H	α-helix	trans	-58.9	-40.4	176.1	173.1	84.7	0	0	0	112.4	D109 M110 G115 I310 C314 V318 P320 L323	D109-W113 WeakPolarHBondContact O-CB 3.46Å; D109-W113 PolarHBondContact O-N 3.29Å; M110-W113 HydrophobicContact CE-CB 4.38Å; W113-G115 PolarHBondContact O-N 3.32Å; W113-I310 HydrophobicContact CE3-CG2 3.78Å; W113-I310 HydrophobicContact CH2-CG2 4.49Å; W113-I310 HydrophobicContact CZ3-CG2 3.48Å; W113-I310 VanDerWaalsContact CZ3-CG2 3.48Å; W113-C314 HydrophobicContact CD2-CB 4.39Å; W113-C314 HydrophobicContact CH2-CB 4.07Å; W113-C314 HydrophobicContact CZ2-CB 3.62Å; W113-C314 PolarHBondContact NE1-SG 3.27Å; W113-C314 VanDerWaalsContact NE1-SG 3.36Å; W113-V318 WeakPolarHBondContact CZ2-O 3.15Å; W113-P320 HydrophobicContact CD2-CB 4.36Å; W113-P320 HydrophobicContact CE3-CB 4.16Å; W113-P320 HydrophobicContact CH2-CB 3.99Å; W113-P320 HydrophobicContact CZ2-CB 4.18Å; W113-P320 HydrophobicContact CZ2-CG 4.42Å; W113-P320 HydrophobicContact CZ3-CB 3.96Å; W113-P320 WeakPolarHBondContact O-CB 3.38Å; W113-L323 HydrophobicContact CH2-CD1 3.69Å; W113-L323 HydrophobicContact CZ3-CD1 3.76Å
114	A	97.6	Very high	97.3	Very high	3 Å²	3	39 Å²	39	3%	0.025	19%	0.194	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.6	-8.4	177.1	0	0	0	0	0	113.4	L70 M110 L111 E112 I116 L324	L70-A114 HydrophobicContact CD1-CB 3.92Å; M110-A114 WeakPolarHBondContact O-CB 3.3Å; M110-A114 PolarHBondContact O-N 3.45Å; L111-A114 PolarHBondContact O-N 3.47Å; E112-A114 VanDerWaalsContact C-N 3.29Å; E112-A114 PolarHBondContact O-N 3.32Å; A114-I116 HydrophobicContact CB-CG1 4.04Å; A114-L324 HydrophobicContact CB-CD2 4.36Å; A114-L324 WeakPolarHBondContact O-CD1 3.23Å
115	G	97.1	Very high	97.4	Very high	31 Å²	31	39.4 Å²	39.4	32%	0.32	20%	0.2	S	C	.	.	T	Hydrogen-bonded Turn	trans	78.1	20.7	-178.5	0	0	0	0	0	114.1	L111 E112 W113 P117 L343	L111-G115 PolarHBondContact O-N 2.94Å; E112-G115 PolarHBondContact O-N 3.01Å; W113-G115 PolarHBondContact O-N 3.32Å; G115-P117 WeakPolarHBondContact O-CD 3.46Å; G115-L343 VanDerWaalsContact O-CD2 3.3Å; G115-L343 WeakPolarHBondContact O-CD2 3.37Å
116	I	97.9	Very high	97.4	Very high	0 Å²	0	36.1 Å²	36.1	0%	0	20%	0.195	C	C	.	.			trans	-121.4	57.8	178	56.2	165.9	0	0	0	111.9	L70 A73 L74 Y77 L111 A114 L324 L343	L70-I116 HydrophobicContact CD1-CD1 3.7Å; A73-I116 HydrophobicContact CB-CD1 3.9Å; L74-I116 HydrophobicContact CB-CD1 4.41Å; L74-I116 HydrophobicContact CD1-CG2 3.97Å; Y77-I116 HydrophobicContact CD1-CB 4.06Å; Y77-I116 HydrophobicContact CD1-CG2 3.56Å; Y77-I116 HydrophobicContact CD2-CB 3.87Å; Y77-I116 HydrophobicContact CD2-CG2 4.3Å; Y77-I116 HydrophobicContact CE1-CB 4.4Å; Y77-I116 HydrophobicContact CE1-CG2 3.89Å; Y77-I116 HydrophobicContact CE2-CB 4.24Å; Y77-I116 HydrophobicContact CG-CB 3.77Å; Y77-I116 HydrophobicContact CG-CG2 3.78Å; L111-I116 HydrophobicContact CB-CG1 4.37Å; L111-I116 HydrophobicContact CD2-CD1 3.57Å; L111-I116 HydrophobicContact CD2-CG1 3.92Å; L111-I116 CarbonylContact O-C 3.59Å; L111-I116 PolarHBondContact O-N 3.49Å; A114-I116 HydrophobicContact CB-CG1 4.04Å; I116-L324 HydrophobicContact CG2-CD1 4.15Å; I116-L343 HydrophobicContact CG2-CD1 4.41Å
117	P	97.9	Very high	97.4	Very high	31 Å²	31	40.8 Å²	40.8	20%	0.201	23%	0.225	C	C	.	.			trans	-62.1	139.4	-175.6	26.2	-35.2	0	0	0	112.4	E112 G115 R124	E112-P117 WeakPolarHBondContact OE2-CB 3.46Å; G115-P117 WeakPolarHBondContact O-CD 3.46Å; P117-R124 VanDerWaalsContact CB-NH2 3.27Å
118	P	98.2	Very high	97.3	Very high	0 Å²	0	41.6 Å²	41.6	0%	0	23%	0.231	C	C	.	.			trans	-67.3	143.2	170.7	28.9	-32.9	0	0	0	111.7	F87 L89 E108 R124	F87-P118 HydrophobicContact CD1-CB 4.26Å; F87-P118 HydrophobicContact CE1-CB 4.35Å; F87-P118 CarbonylContact O-C 3.59Å; L89-P118 HydrophobicContact CB-CB 3.75Å; L89-P118 HydrophobicContact CB-CG 4.02Å; L89-P118 HydrophobicContact CD2-CG 4.36Å; E108-P118 HydrophobicContact CG-CG 4.47Å; P118-R124 WeakPolarHBondContact O-CD 2.98Å; P118-R124 PolarHBondContact O-NE 2.94Å; P118-R124 PolarHBondContact O-NH1 3.26Å
119	D	98.1	Very high	97.1	Very high	64 Å²	64	43.1 Å²	43.1	34%	0.342	25%	0.248	S	C	.	.	S	Bend	trans	-76.5	-32.3	171.7	-60.8	-53.7	0	0	0	110.8	K81 A86 F87	K81-D119 IonicContact NZ-OD1 3.4Å; K81-D119 PolarHBondContact NZ-OD1 2.93Å; K81-D119 IonicContact NZ-OD2 3.68Å; K81-D119 PolarHBondContact NZ-OD2 3.1Å; A86-D119 HydrophobicContact CB-CB 4.47Å; F87-D119 PolarHBondContact N-OD2 3.49Å; F87-D119 PolarHBondContact O-N 3.25Å
120	E	98.4	Very high	97.1	Very high	15 Å²	15	42.5 Å²	42.5	7%	0.07	25%	0.248	C	C	.	.	B	Isolated β-bridge	trans	-133.6	133.5	175	-62.9	173.5	-151.8	0	0	109.6	R54 I88 L89 G125 Y131	R54-E120 IonicContact CZ-OE1 3.1Å; R54-E120 VanDerWaalsContact CZ-OE1 3.23Å; R54-E120 IonicContact CZ-OE2 3.62Å; R54-E120 IonicContact NH1-OE1 3.2Å; R54-E120 PolarHBondContact NH1-OE1 3.44Å; R54-E120 VanDerWaalsContact NH2-CD 3.26Å; R54-E120 IonicContact NH2-OE1 3.78Å; R54-E120 PolarHBondContact NH2-OE1 3.22Å; R54-E120 IonicContact NH2-OE2 3.63Å; R54-E120 PolarHBondContact NH2-OE2 3.11Å; I88-E120 CarbonylContact C-O 3.6Å; I88-E120 WeakPolarHBondContact CA-O 3.47Å; I88-E120 HydrophobicContact CB-CB 4.48Å; I88-E120 HydrophobicContact CG1-CB 4.08Å; I88-E120 HydrophobicContact CG1-CG 4.43Å; I88-E120 HydrophobicContact CG2-CB 4.19Å; L89-E120 PolarHBondContact N-O 3.21Å; E120-G125 WeakPolarHBondContact CA-O 3.31Å; E120-Y131 HydrophobicContact CB-CE1 3.79Å; E120-Y131 HydrophobicContact CB-CE2 4.39Å; E120-Y131 PolarHBondContact OE2-OH 2.86Å
121	S	98.3	Very high	97.1	Very high	0 Å²	0	41.5 Å²	41.5	0%	0	24%	0.242	C	C	.	.	B	Isolated β-bridge	trans	-160.2	173.3	-174.5	77.5	0	0	0	0	112.1	E108 R123 R124 G125 Y131	E108-S121 WeakPolarHBondContact OE1-CB 3.37Å; E108-S121 PolarHBondContact OE1-OG 3.11Å; S121-R123 VanDerWaalsContact C-N 3.31Å; S121-R123 PolarHBondContact O-N 2.75Å; S121-R123 PolarHBondContact OG-N 3.19Å; S121-R124 WeakPolarHBondContact OG-CB 3.45Å; S121-R124 PolarHBondContact OG-N 3.04Å; S121-G125 PolarHBondContact N-O 2.94Å; S121-G125 VanDerWaalsContact O-CA 3.28Å; S121-G125 WeakPolarHBondContact O-CA 3.36Å; S121-G125 PolarHBondContact O-N 3.3Å; S121-Y131 VanDerWaalsContact O-CD2 3.29Å; S121-Y131 WeakPolarHBondContact O-CD2 3.43Å
122	P	97.4	Very high	97	Very high	45 Å²	45	43.2 Å²	43.2	29%	0.292	25%	0.251	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.6	-43.3	171.1	-28.3	38.9	0	0	0	113.8	L91 L132	L91-P122 HydrophobicContact CD1-CG 3.83Å; L91-P122 HydrophobicContact CG-CG 3.97Å; P122-L132 HydrophobicContact CB-CD1 3.37Å; P122-L132 HydrophobicContact CG-CD1 3.42Å; P122-L132 VanDerWaalsContact CG-CD1 3.42Å
123	R	95.9	Very high	97.1	Very high	130 Å²	130	40.1 Å²	40.1	49%	0.491	24%	0.237	S	C	.	.	T	Hydrogen-bonded Turn	trans	-77.9	-41.3	-178	-173.8	-171.3	-57	-165.3	-4.4	112.8	E105 E108 D109 S121	E105-R123 PolarHBondContact O-NH2 3.38Å; E108-R123 WeakPolarHBondContact OE1-CB 3.37Å; E108-R123 WeakPolarHBondContact OE2-CB 3.27Å; E108-R123 IonicContact OE2-NE 3.28Å; D109-R123 IonicContact OD1-CZ 3.35Å; D109-R123 IonicContact OD1-NH1 2.7Å; D109-R123 PolarHBondContact OD1-NH1 2.98Å; D109-R123 IonicContact OD1-NH2 2.83Å; D109-R123 PolarHBondContact OD1-NH2 2.99Å; D109-R123 IonicContact OD2-NH2 3.18Å; S121-R123 VanDerWaalsContact C-N 3.31Å; S121-R123 PolarHBondContact O-N 2.75Å; S121-R123 PolarHBondContact OG-N 3.19Å
124	R	96.2	Very high	97	Very high	120 Å²	120	38.3 Å²	38.3	45%	0.453	24%	0.235	S	C	.	.	T	Hydrogen-bonded Turn	trans	-84.1	-20.1	-176.6	-64.9	175.4	172.7	-139.1	-9.1	112.8	E112 P117 P118 S121	E112-R124 VanDerWaalsContact CD-NH2 3.26Å; E112-R124 IonicContact OE1-CZ 2.88Å; E112-R124 IonicContact OE1-NE 3.32Å; E112-R124 PolarHBondContact OE1-NE 3.26Å; E112-R124 IonicContact OE1-NH2 3.9Å; E112-R124 PolarHBondContact OE1-NH2 3.49Å; E112-R124 IonicContact OE2-NH2 3.29Å; E112-R124 PolarHBondContact OE2-NH2 2.87Å; P117-R124 VanDerWaalsContact CB-NH2 3.27Å; P118-R124 WeakPolarHBondContact O-CD 2.98Å; P118-R124 PolarHBondContact O-NE 2.94Å; P118-R124 PolarHBondContact O-NH1 3.26Å; S121-R124 WeakPolarHBondContact OG-CB 3.45Å; S121-R124 PolarHBondContact OG-N 3.04Å
125	G	96.6	Very high	97	Very high	29 Å²	29	44 Å²	44	30%	0.299	26%	0.261	S	S	.	.	B	Isolated β-bridge	trans	71.1	-159.1	-171.9	0	0	0	0	0	111.9	E120 S121	E120-G125 WeakPolarHBondContact CA-O 3.31Å; S121-G125 PolarHBondContact N-O 2.94Å; S121-G125 VanDerWaalsContact O-CA 3.28Å; S121-G125 WeakPolarHBondContact O-CA 3.36Å; S121-G125 PolarHBondContact O-N 3.3Å
126	G	95.9	Very high	97.1	Very high	40 Å²	40	43.5 Å²	43.5	41%	0.412	25%	0.25	S	C	.	.			trans	149.2	170.1	-178.7	0	0	0	0	0	112.4	C128 G129 Y131	G126-C128 PolarHBondContact O-N 3.26Å; G126-G129 PolarHBondContact O-N 3.18Å; G126-Y131 VanDerWaalsContact CA-OH 3.26Å; G126-Y131 WeakPolarHBondContact CA-OH 3.27Å
127	P	95.8	Very high	97.1	Very high	112 Å²	112	45.6 Å²	45.6	73%	0.727	26%	0.261	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.9	-17	-170.4	28.1	-36.5	0	0	0	114.2
128	C	95.3	Very high	97	Very high	21 Å²	21	49.9 Å²	49.9	14%	0.142	28%	0.282	C	S	.	.	T	Hydrogen-bonded Turn	trans	-111.9	13.5	-175.8	-62.2	0	0	0	0	113.1	G126 Y131 R136 M255	G126-C128 PolarHBondContact O-N 3.26Å; C128-Y131 PolarHBondContact N-OH 3.48Å; C128-Y131 VanDerWaalsContact N-OH 3.15Å; C128-R136 PolarHBondContact O-NH1 3Å; C128-R136 VanDerWaalsContact O-NH1 3.09Å; C128-M255 HydrophobicContact CB-CB 4.23Å; C128-M255 HydrophobicContact CB-CG 3.96Å
129	G	93.1	Very high	97	Very high	37 Å²	37	51.3 Å²	51.3	38%	0.381	29%	0.289	S	S	.	.			trans	-60.9	169.5	177.9	0	0	0	0	0	113.5	G126 Y131 R136	G126-G129 PolarHBondContact O-N 3.18Å; G129-Y131 VanDerWaalsContact CA-CE2 3.4Å; G129-Y131 PolarHBondContact N-OH 2.74Å; G129-R136 PolarHBondContact O-NH1 2.94Å
130	P	97.5	Very high	97	Very high	53 Å²	53	48.3 Å²	48.3	34%	0.344	27%	0.273	S	S	.	.			cis	-70	155	-2.9	26.1	-30.8	0	0	0	112.6	Q135 R136	P130-Q135 HydrophobicContact CB-CB 3.96Å; P130-Q135 VanDerWaalsContact CB-OE1 3.29Å; P130-Q135 HydrophobicContact CG-CB 3.81Å; P130-R136 HydrophobicContact CG-CG 3.8Å; P130-R136 VanDerWaalsContact O-CD 3.29Å; P130-R136 WeakPolarHBondContact O-CD 3.18Å; P130-R136 PolarHBondContact O-NH1 3.32Å
131	Y	98.3	Very high	96.9	Very high	4 Å²	4	49.6 Å²	49.6	2%	0.016	28%	0.281	C	S	.	.			trans	-101.4	9.4	-176.6	-64	-88.4	0	0	0	113.8	I88 L91 E120 S121 G126 C128 G129 M255	I88-Y131 HydrophobicContact CG2-CD1 3.76Å; I88-Y131 HydrophobicContact CG2-CE1 3.63Å; L91-Y131 PolarHBondContact N-O 3.01Å; E120-Y131 HydrophobicContact CB-CE1 3.79Å; E120-Y131 HydrophobicContact CB-CE2 4.39Å; E120-Y131 PolarHBondContact OE2-OH 2.86Å; S121-Y131 VanDerWaalsContact O-CD2 3.29Å; S121-Y131 WeakPolarHBondContact O-CD2 3.43Å; G126-Y131 VanDerWaalsContact CA-OH 3.26Å; G126-Y131 WeakPolarHBondContact CA-OH 3.27Å; C128-Y131 PolarHBondContact N-OH 3.48Å; C128-Y131 VanDerWaalsContact N-OH 3.15Å; G129-Y131 VanDerWaalsContact CA-CE2 3.4Å; G129-Y131 PolarHBondContact N-OH 2.74Å; Y131-M255 HydrophobicContact CD1-CE 3.69Å; Y131-M255 HydrophobicContact CD1-SD 4.18Å; Y131-M255 HydrophobicContact CE1-CE 4.13Å; Y131-M255 HydrophobicContact CE1-SD 4.29Å; Y131-M255 HydrophobicContact CG-CE 4.44Å
132	L	97.6	Very high	96.9	Very high	36 Å²	36	54.5 Å²	54.5	19%	0.188	30%	0.303	C	S	.	.	B	Isolated β-bridge	trans	-103	130.7	166.4	-86.8	71.6	0	0	0	109	L91 P122 S134 Q135 R136	L91-L132 HydrophobicContact CB-CG 4.32Å; L91-L132 HydrophobicContact CD1-CD1 4.12Å; L91-L132 HydrophobicContact CD1-CG 4.34Å; P122-L132 HydrophobicContact CB-CD1 3.37Å; P122-L132 HydrophobicContact CG-CD1 3.42Å; P122-L132 VanDerWaalsContact CG-CD1 3.42Å; L132-S134 VanDerWaalsContact C-N 3.34Å; L132-S134 PolarHBondContact O-N 3.5Å; L132-Q135 HydrophobicContact CB-CB 4.41Å; L132-Q135 HydrophobicContact CB-CG 4.03Å; L132-Q135 PolarHBondContact O-N 3.16Å; L132-R136 WeakPolarHBondContact O-CG 3.33Å
133	Q	98.2	Very high	97	Very high	0 Å²	0	52.3 Å²	52.3	0%	0	29%	0.29	C	S	.	.	G	3₁₀ helix	trans	-67.9	-34.1	-179.6	-66.3	-166.7	-40.4	0	0	112.3	R90 L91 E92 D93 T94 Q135 R136 Y140 D251	R90-Q133 HydrophobicContact CG-CG 4.43Å; L91-Q133 WeakPolarHBondContact O-CG 3.4Å; L91-Q133 PolarHBondContact O-N 3.35Å; L91-Q133 VanDerWaalsContact O-N 3.16Å; E92-Q133 VanDerWaalsContact CA-OE1 3.25Å; E92-Q133 VanDerWaalsContact CB-OE1 3.28Å; E92-Q133 HydrophobicContact CG-CG 4.45Å; D93-Q133 PolarHBondContact OD1-N 3.01Å; D93-Q133 VanDerWaalsContact OD1-N 3.14Å; T94-Q133 HydrophobicContact CG2-CB 3.71Å; T94-Q133 HydrophobicContact CG2-CG 4.48Å; T94-Q133 VanDerWaalsContact CG2-OE1 3.22Å; Q133-Q135 PolarHBondContact O-N 3.42Å; Q133-R136 PolarHBondContact O-N 3.45Å; Q133-Y140 WeakPolarHBondContact CA-OH 3.41Å; Q133-Y140 HydrophobicContact CB-CE2 4.32Å; Q133-Y140 VanDerWaalsContact CB-OH 3.32Å; Q133-Y140 WeakPolarHBondContact CB-OH 3.22Å; Q133-Y140 VanDerWaalsContact CG-OH 3.27Å; Q133-Y140 WeakPolarHBondContact CG-OH 3.43Å; Q133-Y140 VanDerWaalsContact O-CE2 3.31Å; Q133-Y140 WeakPolarHBondContact O-CE2 3.45Å; Q133-D251 WeakPolarHBondContact CG-OD2 3.49Å; Q133-D251 PolarHBondContact NE2-OD2 3.03Å
134	S	96.6	Very high	97	Very high	33 Å²	33	46.3 Å²	46.3	23%	0.231	27%	0.267	C	S	.	.	G	3₁₀ helix	trans	-57.3	-21.5	173.4	59.7	0	0	0	0	114.1	D93 L132 L137	D93-S134 PolarHBondContact OD1-N 3.05Å; D93-S134 WeakPolarHBondContact OD2-CB 3.37Å; D93-S134 PolarHBondContact OD2-OG 3.07Å; L132-S134 VanDerWaalsContact C-N 3.34Å; L132-S134 PolarHBondContact O-N 3.5Å; S134-L137 WeakPolarHBondContact O-CG 3.42Å
135	Q	97.4	Very high	97.1	Very high	122 Å²	122	47.3 Å²	47.3	57%	0.57	27%	0.271	S	S	*	.	G	3₁₀ helix	trans	-93.2	4.9	177.7	-61.1	178.8	-4	0	0	113.2	P130 L132 Q133	P130-Q135 HydrophobicContact CB-CB 3.96Å; P130-Q135 VanDerWaalsContact CB-OE1 3.29Å; P130-Q135 HydrophobicContact CG-CB 3.81Å; L132-Q135 HydrophobicContact CB-CB 4.41Å; L132-Q135 HydrophobicContact CB-CG 4.03Å; L132-Q135 PolarHBondContact O-N 3.16Å; Q133-Q135 PolarHBondContact O-N 3.42Å
136	R	98	Very high	97.1	Very high	21 Å²	21	50.8 Å²	50.8	8%	0.079	28%	0.278	C	S	.	.			trans	-120.3	17.8	-174.2	-60.4	173.2	75	80.9	2.7	113	C128 G129 P130 L132 Q133 D138 L139 Y140 D251	C128-R136 PolarHBondContact O-NH1 3Å; C128-R136 VanDerWaalsContact O-NH1 3.09Å; G129-R136 PolarHBondContact O-NH1 2.94Å; P130-R136 HydrophobicContact CG-CG 3.8Å; P130-R136 VanDerWaalsContact O-CD 3.29Å; P130-R136 WeakPolarHBondContact O-CD 3.18Å; P130-R136 PolarHBondContact O-NH1 3.32Å; L132-R136 WeakPolarHBondContact O-CG 3.33Å; Q133-R136 PolarHBondContact O-N 3.45Å; R136-D138 VanDerWaalsContact C-N 3.29Å; R136-D138 PolarHBondContact O-N 3.47Å; R136-L139 VanDerWaalsContact O-CB 3.28Å; R136-L139 WeakPolarHBondContact O-CB 3.22Å; R136-L139 PolarHBondContact O-N 3.39Å; R136-Y140 HydrophobicContact CB-CD2 4.45Å; R136-Y140 HydrophobicContact CB-CE1 4.42Å; R136-Y140 HydrophobicContact CB-CE2 3.62Å; R136-Y140 WeakPolarHBondContact CB-OH 3.23Å; R136-Y140 WeakPolarHBondContact O-CD2 3.42Å; R136-Y140 WeakPolarHBondContact O-CE2 3.48Å; R136-Y140 PolarHBondContact O-N 2.94Å; R136-D251 IonicContact CZ-OD1 3.18Å; R136-D251 IonicContact NE-OD1 2.7Å; R136-D251 PolarHBondContact NE-OD1 3.02Å; R136-D251 IonicContact NH2-OD1 3.03Å; R136-D251 PolarHBondContact NH2-OD1 3.34Å
137	L	97.7	Very high	97.2	Very high	45 Å²	45	48.9 Å²	48.9	24%	0.236	26%	0.259	C	S	.	.	H	α-helix	trans	-55.4	-40.8	-173.6	-61.6	-178.1	0	0	0	113.6	S134 L139 Y140 N141 F241	S134-L137 WeakPolarHBondContact O-CG 3.42Å; L137-L139 VanDerWaalsContact C-N 3.28Å; L137-L139 PolarHBondContact O-N 3.49Å; L137-Y140 HydrophobicContact CD2-CD2 4.32Å; L137-Y140 PolarHBondContact O-N 3.41Å; L137-N141 WeakPolarHBondContact O-CB 3.46Å; L137-N141 PolarHBondContact O-N 2.85Å; L137-N141 PolarHBondContact O-ND2 2.94Å; L137-F241 HydrophobicContact CD1-CD2 4.49Å; L137-F241 HydrophobicContact CD1-CE1 4.39Å; L137-F241 HydrophobicContact CD1-CE2 4.08Å; L137-F241 HydrophobicContact CD1-CZ 4.03Å; L137-F241 HydrophobicContact CD2-CD1 3.72Å; L137-F241 HydrophobicContact CD2-CD2 4.48Å; L137-F241 HydrophobicContact CD2-CE1 3.9Å; L137-F241 HydrophobicContact CD2-CG 4.03Å; L137-F241 HydrophobicContact CD2-CZ 4.35Å
138	D	97.4	Very high	97.3	Very high	121 Å²	121	45.2 Å²	45.2	65%	0.647	23%	0.234	S	C	*	.	H	α-helix	trans	-59.8	-39.7	178.6	-69.8	-26.8	0	0	0	112.2	R136 Y140 N141 Q142	R136-D138 VanDerWaalsContact C-N 3.29Å; R136-D138 PolarHBondContact O-N 3.47Å; D138-Y140 PolarHBondContact O-N 2.87Å; D138-N141 PolarHBondContact O-N 3.17Å; D138-Q142 WeakPolarHBondContact O-CB 3.36Å; D138-Q142 WeakPolarHBondContact O-CG 3.5Å; D138-Q142 PolarHBondContact O-N 2.94Å
139	L	97.3	Very high	97.3	Very high	30 Å²	30	51.7 Å²	51.7	16%	0.157	26%	0.262	C	S	.	.	H	α-helix	trans	-63.1	-43.5	179	-173.6	64.5	0	0	0	111.5	R136 L137 T143 V250 Y254	R136-L139 VanDerWaalsContact O-CB 3.28Å; R136-L139 WeakPolarHBondContact O-CB 3.22Å; R136-L139 PolarHBondContact O-N 3.39Å; L137-L139 VanDerWaalsContact C-N 3.28Å; L137-L139 PolarHBondContact O-N 3.49Å; L139-T143 WeakPolarHBondContact O-CB 3.33Å; L139-T143 PolarHBondContact O-N 3.1Å; L139-T143 PolarHBondContact O-OG1 2.99Å; L139-V250 HydrophobicContact CD2-CG1 3.67Å; L139-V250 HydrophobicContact CG-CG1 3.72Å; L139-Y254 HydrophobicContact CD1-CD1 4.43Å; L139-Y254 HydrophobicContact CD1-CD2 4.05Å; L139-Y254 HydrophobicContact CD1-CE1 4.01Å; L139-Y254 HydrophobicContact CD1-CE2 3.6Å; L139-Y254 HydrophobicContact CD1-CG 4.46Å; L139-Y254 HydrophobicContact CD2-CD2 3.76Å; L139-Y254 HydrophobicContact CD2-CE2 4.15Å; L139-Y254 HydrophobicContact CD2-CG 4.05Å; L139-Y254 HydrophobicContact CG-CD2 4.21Å; L139-Y254 HydrophobicContact CG-CE2 4.08Å
140	Y	98.3	Very high	97.4	Very high	0 Å²	0	52.8 Å²	52.8	0%	0	26%	0.264	C	S	.	.	H	α-helix	trans	-69.6	-42.7	178.8	-49.3	-51.6	0	0	0	111.5	Q133 R136 L137 D138 T143 A144 P242 A247 V250 D251	Q133-Y140 WeakPolarHBondContact CA-OH 3.41Å; Q133-Y140 HydrophobicContact CB-CE2 4.32Å; Q133-Y140 VanDerWaalsContact CB-OH 3.32Å; Q133-Y140 WeakPolarHBondContact CB-OH 3.22Å; Q133-Y140 VanDerWaalsContact CG-OH 3.27Å; Q133-Y140 WeakPolarHBondContact CG-OH 3.43Å; Q133-Y140 VanDerWaalsContact O-CE2 3.31Å; Q133-Y140 WeakPolarHBondContact O-CE2 3.45Å; R136-Y140 HydrophobicContact CB-CD2 4.45Å; R136-Y140 HydrophobicContact CB-CE1 4.42Å; R136-Y140 HydrophobicContact CB-CE2 3.62Å; R136-Y140 WeakPolarHBondContact CB-OH 3.23Å; R136-Y140 WeakPolarHBondContact O-CD2 3.42Å; R136-Y140 WeakPolarHBondContact O-CE2 3.48Å; R136-Y140 PolarHBondContact O-N 2.94Å; L137-Y140 HydrophobicContact CD2-CD2 4.32Å; L137-Y140 PolarHBondContact O-N 3.41Å; D138-Y140 PolarHBondContact O-N 2.87Å; Y140-T143 PolarHBondContact O-N 3.28Å; Y140-A144 WeakPolarHBondContact O-CB 3.12Å; Y140-A144 PolarHBondContact O-N 3.14Å; Y140-P242 HydrophobicContact CD2-CB 4.11Å; Y140-P242 HydrophobicContact CD2-CG 3.4Å; Y140-P242 HydrophobicContact CE2-CG 3.78Å; Y140-P242 HydrophobicContact CG-CB 4.03Å; Y140-P242 HydrophobicContact CG-CG 3.82Å; Y140-A247 HydrophobicContact CD1-CB 4.39Å; Y140-A247 HydrophobicContact CE1-CB 3.95Å; Y140-A247 HydrophobicContact CE2-CB 4.47Å; Y140-V250 HydrophobicContact CD1-CB 3.91Å; Y140-V250 HydrophobicContact CD1-CG1 3.73Å; Y140-V250 HydrophobicContact CD1-CG2 4.31Å; Y140-V250 HydrophobicContact CE1-CB 4.03Å; Y140-V250 HydrophobicContact CE1-CG1 3.87Å; Y140-D251 WeakPolarHBondContact CE1-OD1 3.39Å; Y140-D251 VanDerWaalsContact OH-CG 3.26Å; Y140-D251 PolarHBondContact OH-OD1 3.38Å; Y140-D251 PolarHBondContact OH-OD2 2.98Å
141	N	97.3	Very high	97.3	Very high	43 Å²	43	52 Å²	52	23%	0.23	27%	0.266	C	S	.	.	H	α-helix	trans	-63	-42.6	177.6	-77.6	-46.5	0	0	0	111.7	L137 D138 A144 R145	L137-N141 WeakPolarHBondContact O-CB 3.46Å; L137-N141 PolarHBondContact O-N 2.85Å; L137-N141 PolarHBondContact O-ND2 2.94Å; D138-N141 PolarHBondContact O-N 3.17Å; N141-A144 PolarHBondContact O-N 3.45Å; N141-R145 WeakPolarHBondContact O-CG 3.39Å; N141-R145 PolarHBondContact O-N 2.89Å
142	Q	97.7	Very high	97.3	Very high	102 Å²	102	54.4 Å²	54.4	48%	0.477	28%	0.277	S	S	.	.	H	α-helix	trans	-62.1	-43.3	173.6	-72.3	171.4	33.1	0	0	111.8	D138 R145 K146	D138-Q142 WeakPolarHBondContact O-CB 3.36Å; D138-Q142 WeakPolarHBondContact O-CG 3.5Å; D138-Q142 PolarHBondContact O-N 2.94Å; Q142-R145 PolarHBondContact O-N 2.88Å; Q142-K146 WeakPolarHBondContact O-CG 3.41Å; Q142-K146 PolarHBondContact O-N 3.4Å; Q142-K146 VanDerWaalsContact O-N 3.1Å
143	T	98.2	Very high	97.3	Very high	0 Å²	0	53 Å²	53	0%	0	27%	0.271	C	S	.	.	H	α-helix	trans	-66.1	-40.5	178	-54.9	0	0	0	0	111.7	L139 Y140 R145 K146 L147 L246 V250 L280 W282	L139-T143 WeakPolarHBondContact O-CB 3.33Å; L139-T143 PolarHBondContact O-N 3.1Å; L139-T143 PolarHBondContact O-OG1 2.99Å; Y140-T143 PolarHBondContact O-N 3.28Å; T143-R145 VanDerWaalsContact C-N 3.33Å; T143-R145 PolarHBondContact O-N 3.11Å; T143-K146 WeakPolarHBondContact O-CB 3.47Å; T143-K146 PolarHBondContact O-N 3.27Å; T143-L147 PolarHBondContact O-N 2.88Å; T143-L246 HydrophobicContact CG2-CD1 4.29Å; T143-V250 HydrophobicContact CG2-CG2 3.78Å; T143-L280 HydrophobicContact CG2-CD1 3.85Å; T143-L280 HydrophobicContact CG2-CD2 3.76Å; T143-L280 HydrophobicContact CG2-CG 4.5Å; T143-W282 HydrophobicContact CG2-CH2 3.79Å; T143-W282 HydrophobicContact CG2-CZ2 4.4Å
144	A	97.8	Very high	97.2	Very high	3 Å²	3	54.1 Å²	54.1	3%	0.025	28%	0.275	C	S	.	.	H	α-helix	trans	-62.9	-38.9	175.8	0	0	0	0	0	112.1	Y140 N141 L147 V148 V203 I236 L246	Y140-A144 WeakPolarHBondContact O-CB 3.12Å; Y140-A144 PolarHBondContact O-N 3.14Å; N141-A144 PolarHBondContact O-N 3.45Å; A144-L147 WeakPolarHBondContact O-CB 3.46Å; A144-L147 PolarHBondContact O-N 2.97Å; A144-V148 WeakPolarHBondContact O-CG2 3.33Å; A144-V148 PolarHBondContact O-N 3.34Å; A144-V203 HydrophobicContact CB-CG1 4.43Å; A144-I236 HydrophobicContact CB-CD1 4.03Å; A144-I236 HydrophobicContact CB-CG1 3.41Å; A144-I236 VanDerWaalsContact CB-CG1 3.41Å; A144-L246 HydrophobicContact CB-CD2 4.11Å
145	R	97	Very high	97.3	Very high	141 Å²	141	54.9 Å²	54.9	53%	0.532	27%	0.273	S	S	.	.	H	α-helix	trans	-60.7	-45.7	172.5	-72	173.9	-169.5	168.9	4.2	111.7	N141 Q142 T143 L147 V148 E149	N141-R145 WeakPolarHBondContact O-CG 3.39Å; N141-R145 PolarHBondContact O-N 2.89Å; Q142-R145 PolarHBondContact O-N 2.88Å; T143-R145 VanDerWaalsContact C-N 3.33Å; T143-R145 PolarHBondContact O-N 3.11Å; R145-L147 VanDerWaalsContact C-N 3.28Å; R145-L147 PolarHBondContact O-N 2.92Å; R145-V148 PolarHBondContact O-N 2.89Å; R145-E149 WeakPolarHBondContact O-CG 3.48Å; R145-E149 PolarHBondContact O-N 3.4Å
146	K	97.7	Very high	97.3	Very high	103 Å²	103	49.1 Å²	49.1	45%	0.448	25%	0.247	S	C	.	.	H	α-helix	trans	-57.8	-39.5	174.8	-68.7	176.8	-178.9	179.9	0	112.6	Q142 T143 S150	Q142-K146 WeakPolarHBondContact O-CG 3.41Å; Q142-K146 PolarHBondContact O-N 3.4Å; Q142-K146 VanDerWaalsContact O-N 3.1Å; T143-K146 WeakPolarHBondContact O-CB 3.47Å; T143-K146 PolarHBondContact O-N 3.27Å; K146-S150 WeakPolarHBondContact O-CB 3.41Å; K146-S150 PolarHBondContact O-N 3.35Å; K146-S150 PolarHBondContact O-OG 2.79Å
147	L	97.6	Very high	97.3	Very high	0 Å²	0	49.4 Å²	49.4	0%	0	25%	0.249	C	C	.	.	H	α-helix	trans	-62.6	-43.5	174.2	-71.8	171.4	0	0	0	111.4	T143 A144 R145 S150 G151 H152 G153 F205 L246 A279 L280	T143-L147 PolarHBondContact O-N 2.88Å; A144-L147 WeakPolarHBondContact O-CB 3.46Å; A144-L147 PolarHBondContact O-N 2.97Å; R145-L147 VanDerWaalsContact C-N 3.28Å; R145-L147 PolarHBondContact O-N 2.92Å; L147-S150 PolarHBondContact O-OG 2.97Å; L147-G151 PolarHBondContact O-N 2.64Å; L147-H152 HydrophobicContact CD2-CB 3.99Å; L147-H152 CarbonylContact O-C 3.51Å; L147-H152 WeakPolarHBondContact O-CA 3.32Å; L147-H152 PolarHBondContact O-N 2.85Å; L147-G153 PolarHBondContact O-N 3.48Å; L147-F205 HydrophobicContact CD1-CD2 4.32Å; L147-F205 HydrophobicContact CD2-CD2 4.26Å; L147-F205 HydrophobicContact CD2-CE2 4.13Å; L147-L246 HydrophobicContact CD1-CD1 4.01Å; L147-A279 HydrophobicContact CD2-CB 3.99Å; L147-L280 HydrophobicContact CD2-CD1 4.35Å; L147-L280 HydrophobicContact CD2-CD2 3.68Å; L147-L280 HydrophobicContact CD2-CG 3.78Å; L147-L280 HydrophobicContact CG-CD2 3.92Å; L147-L280 HydrophobicContact CG-CG 4.42Å
148	V	96.9	Very high	97.3	Very high	35 Å²	35	48.3 Å²	48.3	21%	0.212	24%	0.244	C	C	.	.	H	α-helix	trans	-65.7	-47.5	178	176.1	0	0	0	0	111.7	A144 R145 S150 G151 G153 Y155 V203	A144-V148 WeakPolarHBondContact O-CG2 3.33Å; A144-V148 PolarHBondContact O-N 3.34Å; R145-V148 PolarHBondContact O-N 2.89Å; V148-S150 VanDerWaalsContact C-N 3.29Å; V148-S150 PolarHBondContact O-N 2.88Å; V148-G151 PolarHBondContact O-N 3.4Å; V148-G153 WeakPolarHBondContact CA-O 3.49Å; V148-Y155 HydrophobicContact CG1-CD2 4.21Å; V148-Y155 HydrophobicContact CG1-CE2 3.84Å; V148-Y155 HydrophobicContact CG2-CE2 4.43Å; V148-V203 HydrophobicContact CG2-CG1 3.72Å
149	E	95.7	Very high	97.2	Very high	156 Å²	156	45 Å²	45	73%	0.729	23%	0.231	S	C	*	.	H	α-helix	trans	-61.6	-36.5	179.9	-72	165.7	-173.6	0	0	112.4	R145 G151	R145-E149 WeakPolarHBondContact O-CG 3.48Å; R145-E149 PolarHBondContact O-N 3.4Å; E149-G151 VanDerWaalsContact C-N 3.28Å; E149-G151 PolarHBondContact O-N 3.2Å
150	S	95.6	Very high	97.1	Very high	60 Å²	60	48 Å²	48	42%	0.42	25%	0.252	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.7	1.1	175.7	62.1	0	0	0	0	114.1	K146 L147 V148 H152	K146-S150 WeakPolarHBondContact O-CB 3.41Å; K146-S150 PolarHBondContact O-N 3.35Å; K146-S150 PolarHBondContact O-OG 2.79Å; L147-S150 PolarHBondContact O-OG 2.97Å; V148-S150 VanDerWaalsContact C-N 3.29Å; V148-S150 PolarHBondContact O-N 2.88Å; S150-H152 VanDerWaalsContact C-N 3.26Å; S150-H152 WeakPolarHBondContact CB-ND1 3.26Å; S150-H152 PolarHBondContact O-N 2.94Å; S150-H152 PolarHBondContact O-ND1 3.12Å; S150-H152 PolarHBondContact OG-ND1 3.31Å
151	G	95.7	Very high	97	Very high	38 Å²	38	54.5 Å²	54.5	39%	0.392	28%	0.282	S	S	.	.	T	Hydrogen-bonded Turn	trans	76.8	4.5	179.3	0	0	0	0	0	115.6	L147 V148 E149 R206	L147-G151 PolarHBondContact O-N 2.64Å; V148-G151 PolarHBondContact O-N 3.4Å; E149-G151 VanDerWaalsContact C-N 3.28Å; E149-G151 PolarHBondContact O-N 3.2Å; G151-R206 WeakPolarHBondContact O-CD 3.49Å
152	H	96.9	Very high	97	Very high	54 Å²	54	54.8 Å²	54.8	25%	0.25	28%	0.28	C	S	.	.	S	Bend	trans	-87.3	-7.2	176.1	-61.6	97.2	0	0	0	113.3	L147 S150 F205 R206 A279	L147-H152 HydrophobicContact CD2-CB 3.99Å; L147-H152 CarbonylContact O-C 3.51Å; L147-H152 WeakPolarHBondContact O-CA 3.32Å; L147-H152 PolarHBondContact O-N 2.85Å; S150-H152 VanDerWaalsContact C-N 3.26Å; S150-H152 WeakPolarHBondContact CB-ND1 3.26Å; S150-H152 PolarHBondContact O-N 2.94Å; S150-H152 PolarHBondContact O-ND1 3.12Å; S150-H152 PolarHBondContact OG-ND1 3.31Å; H152-F205 HydrophobicContact CB-CE2 4.24Å; H152-F205 VanDerWaalsContact O-CD2 3.26Å; H152-F205 WeakPolarHBondContact O-CD2 3.41Å; H152-R206 WeakPolarHBondContact O-CB 3.36Å; H152-R206 PolarHBondContact O-N 3.28Å; H152-A279 HydrophobicContact CB-CB 3.76Å
153	G	97.5	Very high	96.9	Very high	5 Å²	5	52.3 Å²	52.3	5%	0.052	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.9	164.5	172.1	0	0	0	0	0	111.5	L147 V148 R204	L147-G153 PolarHBondContact O-N 3.48Å; V148-G153 WeakPolarHBondContact CA-O 3.49Å; G153-R204 CarbonylContact C-O 3.6Å; G153-R204 WeakPolarHBondContact CA-O 3.44Å
154	Y	97.9	Very high	96.8	Very high	24 Å²	24	56.7 Å²	56.7	9%	0.094	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.3	156.6	175.1	60.6	-87.5	0	0	0	112.1	C156 Y179 C183 R184 R204 R206 D232	Y154-C156 HydrophobicContact CE2-CB 4.45Å; Y154-Y179 HydrophobicContact CE2-CE1 4.49Å; Y154-Y179 WeakPolarHBondContact OH-CE1 3.45Å; Y154-C183 HydrophobicContact CD2-CB 4.04Å; Y154-C183 HydrophobicContact CE2-CB 3.83Å; Y154-R184 HydrophobicContact CE1-CB 4.14Å; Y154-R184 HydrophobicContact CE1-CG 4.32Å; Y154-R184 HydrophobicContact CE2-CB 4.37Å; Y154-R204 HydrophobicContact CE1-CB 4.19Å; Y154-R204 HydrophobicContact CE2-CB 4.08Å; Y154-R204 PolarHBondContact N-O 3.47Å; Y154-R204 PolarHBondContact O-N 2.92Å; Y154-R206 HydrophobicContact CD1-CB 4.34Å; Y154-R206 HydrophobicContact CE1-CB 4.28Å; Y154-D232 HydrophobicContact CE1-CB 4.16Å; Y154-D232 WeakPolarHBondContact CE1-OD2 3.35Å; Y154-D232 VanDerWaalsContact CZ-OD2 3.3Å; Y154-D232 WeakPolarHBondContact OH-CB 3.29Å; Y154-D232 VanDerWaalsContact OH-CG 3.31Å; Y154-D232 PolarHBondContact OH-OD2 3.19Å
155	Y	98	Very high	96.7	Very high	49 Å²	49	61.4 Å²	61.4	19%	0.192	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.7	132.8	174.1	-65.2	-73.7	0	0	0	111.2	V148 V191 L195 H201 V202 V203	V148-Y155 HydrophobicContact CG1-CD2 4.21Å; V148-Y155 HydrophobicContact CG1-CE2 3.84Å; V148-Y155 HydrophobicContact CG2-CE2 4.43Å; Y155-V191 HydrophobicContact CD2-CG1 3.77Å; Y155-V191 HydrophobicContact CG-CG1 4.37Å; Y155-L195 HydrophobicContact CD1-CD2 4.35Å; Y155-L195 HydrophobicContact CD2-CD1 4.11Å; Y155-L195 HydrophobicContact CE1-CD2 4.49Å; Y155-L195 HydrophobicContact CE2-CD1 4.01Å; Y155-L195 HydrophobicContact CG-CD2 4.47Å; Y155-H201 AromaticContact CD1-CD2 3.49Å; Y155-H201 VanDerWaalsContact CD1-CD2 3.49Å; Y155-H201 WeakPolarHBondContact CD1-CD2 3.43Å; Y155-H201 AromaticContact CD1-NE2 3.95Å; Y155-H201 AromaticContact CE1-CD2 3.9Å; Y155-H201 AromaticContact CE1-NE2 3.89Å; Y155-V202 WeakPolarHBondContact CA-O 3.48Å; Y155-V203 HydrophobicContact CD1-CG2 3.94Å; Y155-V203 HydrophobicContact CE1-CG2 3.76Å
156	C	98.1	Very high	96.7	Very high	1 Å²	1	56.6 Å²	56.6	1%	0.007	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	124.6	177.3	176.9	0	0	0	0	110.2	Y154 Y179 C183 H201 V202 R204	Y154-C156 HydrophobicContact CE2-CB 4.45Å; C156-Y179 PolarHBondContact SG-OH 2.69Å; C156-C183 HydrophobicContact CB-CB 4.01Å; C156-H201 VanDerWaalsContact O-CA 3.31Å; C156-H201 WeakPolarHBondContact O-CA 3.41Å; C156-V202 HydrophobicContact CB-CG2 3.71Å; C156-V202 PolarHBondContact N-O 3.32Å; C156-V202 PolarHBondContact O-N 2.88Å; C156-R204 HydrophobicContact CB-CG 3.98Å; C156-R204 PolarHBondContact SG-NE 2.87Å
157	F	97.3	Very high	96.6	Very high	28 Å²	28	56.2 Å²	56.2	12%	0.123	30%	0.298	C	S	.	.			trans	-106.6	18.1	-178.8	-53.1	-87.2	0	0	0	112.2	S159 L186 V191 K194 L195 V199 H201	F157-S159 PolarHBondContact O-N 3.26Å; F157-L186 HydrophobicContact CD2-CD1 3.75Å; F157-L186 HydrophobicContact CE2-CD1 4.07Å; F157-V191 HydrophobicContact CE2-CG1 4.33Å; F157-V191 HydrophobicContact CE2-CG2 4.39Å; F157-V191 HydrophobicContact CZ-CG1 4.26Å; F157-K194 HydrophobicContact CB-CD 4.28Å; F157-K194 HydrophobicContact CD1-CB 3.93Å; F157-K194 HydrophobicContact CD1-CD 4.18Å; F157-K194 HydrophobicContact CD2-CB 4.42Å; F157-K194 HydrophobicContact CD2-CD 3.63Å; F157-K194 HydrophobicContact CE1-CB 3.56Å; F157-K194 HydrophobicContact CE1-CD 4.45Å; F157-K194 HydrophobicContact CE2-CB 4.09Å; F157-K194 HydrophobicContact CE2-CD 3.94Å; F157-K194 HydrophobicContact CG-CB 4.35Å; F157-K194 HydrophobicContact CG-CD 3.77Å; F157-K194 HydrophobicContact CZ-CB 3.64Å; F157-K194 HydrophobicContact CZ-CD 4.34Å; F157-L195 HydrophobicContact CE1-CD2 4.11Å; F157-L195 HydrophobicContact CE1-CG 4.43Å; F157-L195 HydrophobicContact CZ-CD2 4.1Å; F157-L195 HydrophobicContact CZ-CG 4.1Å; F157-V199 HydrophobicContact CB-CG1 4.33Å; F157-V199 HydrophobicContact CD1-CB 4.03Å; F157-V199 HydrophobicContact CD1-CG1 3.88Å; F157-V199 HydrophobicContact CE1-CB 4.48Å; F157-H201 HydrophobicContact CD1-CB 3.57Å; F157-H201 HydrophobicContact CE1-CB 3.6Å; F157-H201 HydrophobicContact CG-CB 4.38Å; F157-H201 HydrophobicContact CZ-CB 4.43Å
158	C	96.6	Very high	96.5	Very high	22 Å²	22	61.4 Å²	61.4	15%	0.149	32%	0.32	C	S	.	.			trans	-71.6	127.1	179.6	-71.2	0	0	0	0	110.4	R162 L163 Y179	C158-R162 PolarHBondContact SG-NH1 3.49Å; C158-R162 VanDerWaalsContact SG-NH1 3.36Å; C158-L163 HydrophobicContact CB-CD2 4.22Å; C158-Y179 HydrophobicContact CB-CE2 4.29Å; C158-Y179 PolarHBondContact SG-OH 3.26Å; C158-Y179 VanDerWaalsContact SG-OH 3.38Å
159	S	95.9	Very high	96.4	Very high	52 Å²	52	65.2 Å²	65.2	36%	0.364	34%	0.336	S	S	.	.			trans	-68.9	151.7	179.1	67.4	0	0	0	0	112.6	F157 Q161 R162 L163	F157-S159 PolarHBondContact O-N 3.26Å; S159-Q161 VanDerWaalsContact C-N 3.25Å; S159-Q161 PolarHBondContact O-N 3.34Å; S159-R162 WeakPolarHBondContact O-CB 3.18Å; S159-R162 PolarHBondContact O-N 3Å; S159-R162 VanDerWaalsContact O-N 3.14Å; S159-R162 PolarHBondContact OG-N 3.38Å; S159-L163 PolarHBondContact O-N 3.12Å
160	P	95	Very high	96.3	Very high	93 Å²	93	58.3 Å²	58.3	60%	0.604	31%	0.305	S	S	*	.	H	α-helix	trans	-55.4	-39.1	174.2	-26.5	35.2	0	0	0	113.2	R162 L163 E164	P160-R162 VanDerWaalsContact C-N 3.3Å; P160-R162 PolarHBondContact O-N 3.24Å; P160-L163 PolarHBondContact O-N 3.36Å; P160-L163 VanDerWaalsContact O-N 3.12Å; P160-E164 PolarHBondContact O-N 2.95Å
161	Q	96.8	Very high	96.3	Very high	135 Å²	135	60.4 Å²	60.4	63%	0.631	31%	0.311	S	S	*	.	H	α-helix	trans	-60.1	-41	178.6	-62.7	81	-0.3	0	0	111.4	S159 E164 L165	S159-Q161 VanDerWaalsContact C-N 3.25Å; S159-Q161 PolarHBondContact O-N 3.34Å; Q161-E164 PolarHBondContact O-N 3.26Å; Q161-L165 WeakPolarHBondContact O-CG 3.48Å; Q161-L165 PolarHBondContact O-N 3.13Å; Q161-L165 VanDerWaalsContact O-N 3.08Å
162	R	96.2	Very high	96.3	Very high	50 Å²	50	68.6 Å²	68.6	19%	0.189	33%	0.33	C	S	.	.	H	α-helix	trans	-62.7	-45.4	175.2	-178.2	-169.3	178	-96.3	-11	111.3	C158 S159 P160 E164 L165 L166 D180 R182	C158-R162 PolarHBondContact SG-NH1 3.49Å; C158-R162 VanDerWaalsContact SG-NH1 3.36Å; S159-R162 WeakPolarHBondContact O-CB 3.18Å; S159-R162 PolarHBondContact O-N 3Å; S159-R162 VanDerWaalsContact O-N 3.14Å; S159-R162 PolarHBondContact OG-N 3.38Å; P160-R162 VanDerWaalsContact C-N 3.3Å; P160-R162 PolarHBondContact O-N 3.24Å; R162-E164 VanDerWaalsContact C-N 3.29Å; R162-E164 PolarHBondContact O-N 3.1Å; R162-L165 PolarHBondContact O-N 3.36Å; R162-L166 PolarHBondContact O-N 2.96Å; R162-D180 IonicContact CZ-OD1 3.5Å; R162-D180 IonicContact CZ-OD2 3.04Å; R162-D180 IonicContact NH1-OD1 3.35Å; R162-D180 PolarHBondContact NH1-OD1 2.8Å; R162-D180 IonicContact NH1-OD2 3.92Å; R162-D180 VanDerWaalsContact NH2-CG 3.32Å; R162-D180 IonicContact NH2-OD1 2.81Å; R162-D180 PolarHBondContact NH2-OD1 3.48Å; R162-D180 IonicContact NH2-OD2 3.86Å; R162-D180 PolarHBondContact NH2-OD2 2.89Å; R162-R182 VanDerWaalsContact CZ-CD 3.47Å; R162-R182 VanDerWaalsContact NH2-CD 3.32Å
163	L	96.1	Very high	96.3	Very high	49 Å²	49	69.1 Å²	69.1	26%	0.257	34%	0.344	S	S	.	.	H	α-helix	trans	-64.4	-36.4	-178.5	-62.3	177.9	0	0	0	111.5	C158 S159 P160 L166 K167 Y179	C158-L163 HydrophobicContact CB-CD2 4.22Å; S159-L163 PolarHBondContact O-N 3.12Å; P160-L163 PolarHBondContact O-N 3.36Å; P160-L163 VanDerWaalsContact O-N 3.12Å; L163-L166 PolarHBondContact O-N 2.67Å; L163-K167 WeakPolarHBondContact O-CB 3.24Å; L163-K167 PolarHBondContact O-N 2.59Å; L163-Y179 HydrophobicContact CD2-CD2 3.6Å; L163-Y179 HydrophobicContact CD2-CE2 3.87Å
164	E	96.5	Very high	96.1	Very high	92 Å²	92	72.4 Å²	72.4	43%	0.43	38%	0.378	S	S	.	.	H	α-helix	trans	-67.3	-38.6	173.9	-77.4	-60.4	127.3	0	0	112.9	P160 Q161 R162 K167 K168	P160-E164 PolarHBondContact O-N 2.95Å; Q161-E164 PolarHBondContact O-N 3.26Å; R162-E164 VanDerWaalsContact C-N 3.29Å; R162-E164 PolarHBondContact O-N 3.1Å; E164-K167 PolarHBondContact O-N 3.22Å; E164-K168 WeakPolarHBondContact O-CG 3.42Å; E164-K168 PolarHBondContact O-N 3.43Å
165	L	96.4	Very high	95.8	Very high	103 Å²	103	77.4 Å²	77.4	54%	0.539	40%	0.402	S	S	.	.	H	α-helix	trans	-61.9	-49.3	173	-71.3	171.2	0	0	0	111.2	Q161 R162 K167 K168 E169	Q161-L165 WeakPolarHBondContact O-CG 3.48Å; Q161-L165 PolarHBondContact O-N 3.13Å; Q161-L165 VanDerWaalsContact O-N 3.08Å; R162-L165 PolarHBondContact O-N 3.36Å; L165-K167 VanDerWaalsContact C-N 3.28Å; L165-K167 PolarHBondContact O-N 2.96Å; L165-K168 PolarHBondContact O-N 3.21Å; L165-K168 VanDerWaalsContact O-N 3.12Å; L165-E169 WeakPolarHBondContact O-CG 3.47Å; L165-E169 PolarHBondContact O-N 3.08Å
166	L	95.5	Very high	95.4	Very high	39 Å²	39	79.9 Å²	79.9	20%	0.204	42%	0.422	C	S	.	.	H	α-helix	trans	-57	-42.4	177.5	-175.5	68.5	0	0	0	111.7	R162 L163 E169 A170 R178 D180	R162-L166 PolarHBondContact O-N 2.96Å; L163-L166 PolarHBondContact O-N 2.67Å; L166-E169 PolarHBondContact O-N 2.95Å; L166-A170 WeakPolarHBondContact O-CB 3.34Å; L166-A170 PolarHBondContact O-N 2.87Å; L166-R178 WeakPolarHBondContact CD2-O 3.35Å; L166-D180 HydrophobicContact CD1-CB 4.48Å; L166-D180 HydrophobicContact CD2-CB 3.98Å
167	K	95.6	Very high	95.1	Very high	95 Å²	95	82.3 Å²	82.3	41%	0.413	44%	0.438	S	S	.	.	H	α-helix	trans	-62.7	-46	176.2	-179.9	-179.7	177.6	-173	0	111.9	L163 E164 L165 A170 L171 P177	L163-K167 WeakPolarHBondContact O-CB 3.24Å; L163-K167 PolarHBondContact O-N 2.59Å; E164-K167 PolarHBondContact O-N 3.22Å; L165-K167 VanDerWaalsContact C-N 3.28Å; L165-K167 PolarHBondContact O-N 2.96Å; K167-A170 PolarHBondContact O-N 3.49Å; K167-L171 HydrophobicContact CG-CD1 4.26Å; K167-L171 VanDerWaalsContact O-CG 3.3Å; K167-L171 WeakPolarHBondContact O-CG 3.1Å; K167-L171 PolarHBondContact O-N 3.28Å; K167-P177 HydrophobicContact CB-CB 4.43Å; K167-P177 HydrophobicContact CG-CB 3.95Å; K167-P177 HydrophobicContact CG-CG 4.2Å
168	K	96.2	Very high	94.9	Very high	110 Å²	110	87.4 Å²	87.4	48%	0.478	46%	0.457	S	S	.	.	H	α-helix	trans	-64	-39.8	178.4	-73.9	175.1	-177.3	179.1	0	112	E164 L165 L171 R172	E164-K168 WeakPolarHBondContact O-CG 3.42Å; E164-K168 PolarHBondContact O-N 3.43Å; L165-K168 PolarHBondContact O-N 3.21Å; L165-K168 VanDerWaalsContact O-N 3.12Å; K168-L171 PolarHBondContact O-N 3.13Å; K168-R172 WeakPolarHBondContact O-CB 3.3Å; K168-R172 VanDerWaalsContact O-CG 3.27Å; K168-R172 WeakPolarHBondContact O-CG 3.46Å; K168-R172 PolarHBondContact O-N 2.73Å
169	E	95.6	Very high	94.9	Very high	114 Å²	114	87.3 Å²	87.3	53%	0.533	45%	0.453	S	S	.	.	H	α-helix	trans	-63.3	-47.8	176.3	-73.6	170.5	-178	0	0	111.7	L165 L166 L171 R172 A173	L165-E169 WeakPolarHBondContact O-CG 3.47Å; L165-E169 PolarHBondContact O-N 3.08Å; L166-E169 PolarHBondContact O-N 2.95Å; E169-L171 PolarHBondContact O-N 2.81Å; E169-R172 PolarHBondContact O-N 2.72Å; E169-A173 WeakPolarHBondContact O-CB 3.29Å; E169-A173 PolarHBondContact O-N 3.46Å
170	A	93.9	Very high	94.8	Very high	11 Å²	11	88.1 Å²	88.1	9%	0.091	45%	0.453	C	S	.	.	H	α-helix	trans	-58.4	-46.6	176.3	0	0	0	0	0	111.8	L166 K167 R172 A173 G174 Q175 P177	L166-A170 WeakPolarHBondContact O-CB 3.34Å; L166-A170 PolarHBondContact O-N 2.87Å; K167-A170 PolarHBondContact O-N 3.49Å; A170-R172 PolarHBondContact O-N 3.03Å; A170-A173 CarbonylContact O-C 3.51Å; A170-A173 PolarHBondContact O-N 3.34Å; A170-A173 VanDerWaalsContact O-N 3.16Å; A170-G174 PolarHBondContact O-N 3.5Å; A170-G174 VanDerWaalsContact O-N 3.15Å; A170-Q175 CarbonylContact C-O 3.5Å; A170-Q175 HydrophobicContact CB-CB 4.37Å; A170-Q175 PolarHBondContact O-N 3.03Å; A170-P177 HydrophobicContact CB-CB 4.31Å; A170-P177 HydrophobicContact CB-CG 4.27Å
171	L	95.3	Very high	94.8	Very high	104 Å²	104	85.6 Å²	85.6	55%	0.545	44%	0.435	S	S	.	.	H	α-helix	trans	-61.8	-42.1	177.5	-70.2	173.3	0	0	0	112.5	K167 K168 E169 A173 G174 P177	K167-L171 HydrophobicContact CG-CD1 4.26Å; K167-L171 VanDerWaalsContact O-CG 3.3Å; K167-L171 WeakPolarHBondContact O-CG 3.1Å; K167-L171 PolarHBondContact O-N 3.28Å; K168-L171 PolarHBondContact O-N 3.13Å; E169-L171 PolarHBondContact O-N 2.81Å; L171-A173 VanDerWaalsContact C-N 3.26Å; L171-A173 PolarHBondContact O-N 3.3Å; L171-G174 PolarHBondContact O-N 3.16Å; L171-G174 VanDerWaalsContact O-N 3.13Å; L171-P177 HydrophobicContact CD2-CG 3.68Å; L171-P177 HydrophobicContact CG-CG 3.81Å
172	R	95.9	Very high	94.8	Very high	210 Å²	210	86.4 Å²	86.4	79%	0.792	43%	0.432	S	S	*	.	H	α-helix	trans	-63	-33.7	175.5	-74.7	173.7	-171.5	170.9	1	112.3	K168 E169 A170 G174	K168-R172 WeakPolarHBondContact O-CB 3.3Å; K168-R172 VanDerWaalsContact O-CG 3.27Å; K168-R172 WeakPolarHBondContact O-CG 3.46Å; K168-R172 PolarHBondContact O-N 2.73Å; E169-R172 PolarHBondContact O-N 2.72Å; A170-R172 PolarHBondContact O-N 3.03Å; R172-G174 VanDerWaalsContact C-N 3.28Å
173	A	95.3	Very high	94.8	Very high	65 Å²	65	84.6 Å²	84.6	54%	0.537	43%	0.427	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.6	2.3	177.1	0	0	0	0	0	113.7	E169 A170 L171 Q175	E169-A173 WeakPolarHBondContact O-CB 3.29Å; E169-A173 PolarHBondContact O-N 3.46Å; A170-A173 CarbonylContact O-C 3.51Å; A170-A173 PolarHBondContact O-N 3.34Å; A170-A173 VanDerWaalsContact O-N 3.16Å; L171-A173 VanDerWaalsContact C-N 3.26Å; L171-A173 PolarHBondContact O-N 3.3Å; A173-Q175 HydrophobicContact CB-CG 4.09Å; A173-Q175 PolarHBondContact O-N 2.93Å
174	G	94.1	Very high	94.7	Very high	74 Å²	74	85.5 Å²	85.5	76%	0.763	43%	0.427	S	S	*	.	T	Hydrogen-bonded Turn	trans	66.8	19.9	-175.6	0	0	0	0	0	114	A170 L171 R172	A170-G174 PolarHBondContact O-N 3.5Å; A170-G174 VanDerWaalsContact O-N 3.15Å; L171-G174 PolarHBondContact O-N 3.16Å; L171-G174 VanDerWaalsContact O-N 3.13Å; R172-G174 VanDerWaalsContact C-N 3.28Å
175	Q	91.8	Very high	94.4	Very high	130 Å²	130	88.4 Å²	88.4	61%	0.607	44%	0.44	S	S	*	.	P	Polyproline II helix	trans	-98.6	151.4	-179.5	-64	-179.1	-7.2	0	0	111.3	A170 A173 P177	A170-Q175 CarbonylContact C-O 3.5Å; A170-Q175 HydrophobicContact CB-CB 4.37Å; A170-Q175 PolarHBondContact O-N 3.03Å; A173-Q175 HydrophobicContact CB-CG 4.09Å; A173-Q175 PolarHBondContact O-N 2.93Å; Q175-P177 WeakPolarHBondContact O-CD 3.4Å
176	T	89.3	Confident	94.3	Very high	100 Å²	100	85.9 Å²	85.9	61%	0.613	43%	0.427	S	S	*	.	P	Polyproline II helix	trans	-65.6	122	173.3	-53.7	0	0	0	0	110.2	R178	T176-R178 PolarHBondContact O-N 3.44Å
177	P	92.9	Very high	94.2	Very high	53 Å²	53	91.2 Å²	91.2	34%	0.344	45%	0.445	S	S	.	.	P	Polyproline II helix	trans	-62.9	128.1	177.2	-23.9	35.5	0	0	0	111.4	K167 A170 L171 Q175	K167-P177 HydrophobicContact CB-CB 4.43Å; K167-P177 HydrophobicContact CG-CB 3.95Å; K167-P177 HydrophobicContact CG-CG 4.2Å; A170-P177 HydrophobicContact CB-CB 4.31Å; A170-P177 HydrophobicContact CB-CG 4.27Å; L171-P177 HydrophobicContact CD2-CG 3.68Å; L171-P177 HydrophobicContact CG-CG 3.81Å; Q175-P177 WeakPolarHBondContact O-CD 3.4Å
178	R	93.1	Very high	94	Very high	135 Å²	135	92.1 Å²	92.1	51%	0.509	46%	0.458	S	S	.	.			trans	-147.5	156.8	175.8	63.2	180	-178.9	-175.1	-1	111.3	L166 T176 Q228	L166-R178 WeakPolarHBondContact CD2-O 3.35Å; T176-R178 PolarHBondContact O-N 3.44Å; R178-Q228 PolarHBondContact NH1-O 2.98Å
179	Y	95.8	Very high	93.9	Very high	20 Å²	20	91 Å²	91	8%	0.078	46%	0.457	C	S	.	.			trans	-65.1	138.4	168.5	-177	-122.3	0	0	0	109.5	Y154 C156 C158 L163 N181 R182 C183 G231 D232	Y154-Y179 HydrophobicContact CE2-CE1 4.49Å; Y154-Y179 WeakPolarHBondContact OH-CE1 3.45Å; C156-Y179 PolarHBondContact SG-OH 2.69Å; C158-Y179 HydrophobicContact CB-CE2 4.29Å; C158-Y179 PolarHBondContact SG-OH 3.26Å; C158-Y179 VanDerWaalsContact SG-OH 3.38Å; L163-Y179 HydrophobicContact CD2-CD2 3.6Å; L163-Y179 HydrophobicContact CD2-CE2 3.87Å; Y179-N181 VanDerWaalsContact CE1-CA 3.4Å; Y179-N181 PolarHBondContact O-N 3.31Å; Y179-R182 PolarHBondContact OH-N 3.2Å; Y179-C183 WeakPolarHBondContact OH-CB 3.24Å; Y179-C183 PolarHBondContact OH-N 3.25Å; Y179-C183 VanDerWaalsContact OH-N 3.08Å; Y179-G231 WeakPolarHBondContact O-CA 3.48Å; Y179-D232 HydrophobicContact CD1-CB 4.3Å
180	D	94.1	Very high	93.8	Very high	68 Å²	68	88.7 Å²	88.7	36%	0.364	45%	0.446	S	S	.	.			trans	-87.9	11.8	-174.8	67.1	-38.8	0	0	0	113.4	R162 L166 R182	R162-D180 IonicContact CZ-OD1 3.5Å; R162-D180 IonicContact CZ-OD2 3.04Å; R162-D180 IonicContact NH1-OD1 3.35Å; R162-D180 PolarHBondContact NH1-OD1 2.8Å; R162-D180 IonicContact NH1-OD2 3.92Å; R162-D180 VanDerWaalsContact NH2-CG 3.32Å; R162-D180 IonicContact NH2-OD1 2.81Å; R162-D180 PolarHBondContact NH2-OD1 3.48Å; R162-D180 IonicContact NH2-OD2 3.86Å; R162-D180 PolarHBondContact NH2-OD2 2.89Å; L166-D180 HydrophobicContact CD1-CB 4.48Å; L166-D180 HydrophobicContact CD2-CB 3.98Å; D180-R182 PolarHBondContact O-N 3.02Å
181	N	95.8	Very high	93.9	Very high	40 Å²	40	89.1 Å²	89.1	21%	0.214	45%	0.447	C	S	.	.			trans	57.1	20	178.8	-58.2	-17.6	0	0	0	114.3	Y179 C183 R184 D232	Y179-N181 VanDerWaalsContact CE1-CA 3.4Å; Y179-N181 PolarHBondContact O-N 3.31Å; N181-C183 VanDerWaalsContact C-N 3.27Å; N181-C183 PolarHBondContact O-N 2.75Å; N181-C183 VanDerWaalsContact O-N 3.1Å; N181-R184 HydrophobicContact CB-CB 4.5Å; N181-R184 WeakPolarHBondContact O-CB 3.3Å; N181-R184 PolarHBondContact O-N 3.09Å; N181-D232 WeakPolarHBondContact OD1-CB 3.28Å; N181-D232 PolarHBondContact OD1-N 3.09Å; N181-D232 PolarHBondContact OD1-OD2 3.32Å
182	R	94.9	Very high	93.8	Very high	153 Å²	153	89.6 Å²	89.6	58%	0.577	45%	0.447	S	S	*	.	G	3₁₀ helix	trans	-50	-42.8	-173	179.3	174.3	179.2	-176.5	6.9	114	R162 Y179 D180 R184	R162-R182 VanDerWaalsContact CZ-CD 3.47Å; R162-R182 VanDerWaalsContact NH2-CD 3.32Å; Y179-R182 PolarHBondContact OH-N 3.2Å; D180-R182 PolarHBondContact O-N 3.02Å; R182-R184 VanDerWaalsContact C-N 3.26Å; R182-R184 PolarHBondContact O-N 3.22Å
183	C	96.2	Very high	93.8	Very high	11 Å²	11	84.9 Å²	84.9	7%	0.074	43%	0.434	C	S	.	.	G	3₁₀ helix	trans	-79.3	-4.6	-175.2	-68.3	0	0	0	0	114.1	Y154 C156 Y179 N181 H185 L186	Y154-C183 HydrophobicContact CD2-CB 4.04Å; Y154-C183 HydrophobicContact CE2-CB 3.83Å; C156-C183 HydrophobicContact CB-CB 4.01Å; Y179-C183 WeakPolarHBondContact OH-CB 3.24Å; Y179-C183 PolarHBondContact OH-N 3.25Å; Y179-C183 VanDerWaalsContact OH-N 3.08Å; N181-C183 VanDerWaalsContact C-N 3.27Å; N181-C183 PolarHBondContact O-N 2.75Å; N181-C183 VanDerWaalsContact O-N 3.1Å; C183-H185 PolarHBondContact O-N 3.39Å; C183-L186 HydrophobicContact CB-CD1 3.89Å; C183-L186 HydrophobicContact CB-CG 4.36Å; C183-L186 PolarHBondContact O-N 3.07Å
184	R	94.4	Very high	93.8	Very high	68 Å²	68	85.2 Å²	85.2	26%	0.257	42%	0.423	S	S	.	.	G	3₁₀ helix	trans	-62.2	-25.3	179.1	-175	171.5	174.3	158.9	-5.9	113.4	Y154 N181 R182 R206 L207 D232	Y154-R184 HydrophobicContact CE1-CB 4.14Å; Y154-R184 HydrophobicContact CE1-CG 4.32Å; Y154-R184 HydrophobicContact CE2-CB 4.37Å; N181-R184 HydrophobicContact CB-CB 4.5Å; N181-R184 WeakPolarHBondContact O-CB 3.3Å; N181-R184 PolarHBondContact O-N 3.09Å; R182-R184 VanDerWaalsContact C-N 3.26Å; R182-R184 PolarHBondContact O-N 3.22Å; R184-R206 VanDerWaalsContact NH2-CZ 3.3Å; R184-R206 VanDerWaalsContact NH2-NH2 3.16Å; R184-L207 PolarHBondContact NH1-O 3.41Å; R184-D232 IonicContact NH1-OD2 3.06Å
185	H	91.6	Very high	93.8	Very high	153 Å²	153	83.8 Å²	83.8	71%	0.708	40%	0.398	S	S	*	.	G	3₁₀ helix	trans	-106.6	9.7	-174.6	-53.6	-67.5	0	0	0	113.4	C183 R187	C183-H185 PolarHBondContact O-N 3.39Å; H185-R187 PolarHBondContact O-N 3.35Å
186	L	94.1	Very high	94	Very high	51 Å²	51	82 Å²	82	27%	0.267	41%	0.405	S	S	.	.			trans	-64.3	135	173.4	-69.1	177.3	0	0	0	109.5	F157 C183 V191	F157-L186 HydrophobicContact CD2-CD1 3.75Å; F157-L186 HydrophobicContact CE2-CD1 4.07Å; C183-L186 HydrophobicContact CB-CD1 3.89Å; C183-L186 HydrophobicContact CB-CG 4.36Å; C183-L186 PolarHBondContact O-N 3.07Å; L186-V191 HydrophobicContact CB-CG2 3.78Å; L186-V191 HydrophobicContact CD1-CG2 4.42Å
187	R	93.6	Very high	94.3	Very high	151 Å²	151	82.7 Å²	82.7	57%	0.57	40%	0.401	S	S	*	.			trans	-73.8	155.4	175.3	-60.8	-168.8	-50	-127.7	2.8	110.4	H185 D189 Q190 V191	H185-R187 PolarHBondContact O-N 3.35Å; R187-D189 VanDerWaalsContact C-N 3.29Å; R187-D189 WeakPolarHBondContact CB-OD1 3.27Å; R187-D189 IonicContact CZ-OD1 3.52Å; R187-D189 IonicContact CZ-OD2 3.6Å; R187-D189 IonicContact NE-OD1 2.83Å; R187-D189 PolarHBondContact NE-OD1 2.98Å; R187-D189 IonicContact NE-OD2 3.68Å; R187-D189 PolarHBondContact NE-OD2 3.31Å; R187-D189 IonicContact NH2-OD1 3.29Å; R187-D189 IonicContact NH2-OD2 2.63Å; R187-D189 PolarHBondContact NH2-OD2 3.49Å; R187-D189 PolarHBondContact O-N 3.39Å; R187-Q190 HydrophobicContact CB-CG 4.34Å; R187-Q190 PolarHBondContact O-N 2.91Å; R187-Q190 VanDerWaalsContact O-N 3.13Å; R187-V191 WeakPolarHBondContact O-CG2 3.3Å; R187-V191 PolarHBondContact O-N 2.94Å
188	V	90.9	Very high	94.4	Very high	113 Å²	113	82.9 Å²	82.9	69%	0.685	41%	0.413	S	S	*	.	H	α-helix	trans	-58.7	-40.5	-176.9	-178.7	0	0	0	0	111.7	Q190 V191 Q192	V188-Q190 PolarHBondContact O-N 2.72Å; V188-V191 PolarHBondContact O-N 3.27Å; V188-Q192 HydrophobicContact CG1-CG 4.35Å; V188-Q192 WeakPolarHBondContact O-CG 3.38Å; V188-Q192 PolarHBondContact O-N 2.82Å
189	D	93.6	Very high	94.4	Very high	87 Å²	87	78.5 Å²	78.5	47%	0.465	40%	0.401	S	S	.	.	H	α-helix	trans	-57.3	-47.7	175.4	59.9	-35.7	0	0	0	112	R187 V191 Q192 E193	R187-D189 VanDerWaalsContact C-N 3.29Å; R187-D189 WeakPolarHBondContact CB-OD1 3.27Å; R187-D189 IonicContact CZ-OD1 3.52Å; R187-D189 IonicContact CZ-OD2 3.6Å; R187-D189 IonicContact NE-OD1 2.83Å; R187-D189 PolarHBondContact NE-OD1 2.98Å; R187-D189 IonicContact NE-OD2 3.68Å; R187-D189 PolarHBondContact NE-OD2 3.31Å; R187-D189 IonicContact NH2-OD1 3.29Å; R187-D189 IonicContact NH2-OD2 2.63Å; R187-D189 PolarHBondContact NH2-OD2 3.49Å; R187-D189 PolarHBondContact O-N 3.39Å; D189-V191 VanDerWaalsContact C-N 3.32Å; D189-V191 PolarHBondContact O-N 3.13Å; D189-Q192 PolarHBondContact O-N 3.21Å; D189-E193 WeakPolarHBondContact O-CB 3.28Å; D189-E193 PolarHBondContact O-N 3.27Å
190	Q	94.1	Very high	94.4	Very high	66 Å²	66	82.6 Å²	82.6	31%	0.308	43%	0.43	S	S	.	.	H	α-helix	trans	-65.7	-35.5	179.3	-62.2	178.7	-42.8	0	0	112.5	R187 V188 K194	R187-Q190 HydrophobicContact CB-CG 4.34Å; R187-Q190 PolarHBondContact O-N 2.91Å; R187-Q190 VanDerWaalsContact O-N 3.13Å; V188-Q190 PolarHBondContact O-N 2.72Å; Q190-K194 WeakPolarHBondContact O-CB 3.19Å; Q190-K194 VanDerWaalsContact O-CG 3.25Å; Q190-K194 WeakPolarHBondContact O-CG 3.49Å; Q190-K194 PolarHBondContact O-N 2.73Å
191	V	94.5	Very high	94.6	Very high	19 Å²	19	82.4 Å²	82.4	12%	0.115	43%	0.427	C	S	.	.	H	α-helix	trans	-67.4	-48.3	176.3	174	0	0	0	0	109.8	Y155 F157 L186 R187 V188 D189 E193 K194 L195	Y155-V191 HydrophobicContact CD2-CG1 3.77Å; Y155-V191 HydrophobicContact CG-CG1 4.37Å; F157-V191 HydrophobicContact CE2-CG1 4.33Å; F157-V191 HydrophobicContact CE2-CG2 4.39Å; F157-V191 HydrophobicContact CZ-CG1 4.26Å; L186-V191 HydrophobicContact CB-CG2 3.78Å; L186-V191 HydrophobicContact CD1-CG2 4.42Å; R187-V191 WeakPolarHBondContact O-CG2 3.3Å; R187-V191 PolarHBondContact O-N 2.94Å; V188-V191 PolarHBondContact O-N 3.27Å; D189-V191 VanDerWaalsContact C-N 3.32Å; D189-V191 PolarHBondContact O-N 3.13Å; V191-E193 PolarHBondContact O-N 2.66Å; V191-K194 PolarHBondContact O-N 3.07Å; V191-L195 HydrophobicContact CG1-CD1 3.88Å; V191-L195 HydrophobicContact CG1-CG 4.35Å; V191-L195 VanDerWaalsContact O-CG 3.29Å; V191-L195 WeakPolarHBondContact O-CG 3.34Å; V191-L195 PolarHBondContact O-N 3.39Å
192	Q	94.3	Very high	94.7	Very high	114 Å²	114	81.8 Å²	81.8	53%	0.533	43%	0.425	S	S	.	.	H	α-helix	trans	-63.3	-41.6	-180	-66.7	-56.1	-30.3	0	0	112.2	V188 D189 K194 L195 A196	V188-Q192 HydrophobicContact CG1-CG 4.35Å; V188-Q192 WeakPolarHBondContact O-CG 3.38Å; V188-Q192 PolarHBondContact O-N 2.82Å; D189-Q192 PolarHBondContact O-N 3.21Å; Q192-K194 PolarHBondContact O-N 3Å; Q192-L195 PolarHBondContact O-N 3.24Å; Q192-A196 WeakPolarHBondContact O-CB 3.42Å; Q192-A196 PolarHBondContact O-N 3.38Å
193	E	96.1	Very high	94.8	Very high	111 Å²	111	74.9 Å²	74.9	52%	0.519	40%	0.4	S	S	.	.	H	α-helix	trans	-58.5	-47.5	175.3	-171.7	-168.7	167.5	0	0	111.5	D189 V191 L195 A196 Q197	D189-E193 WeakPolarHBondContact O-CB 3.28Å; D189-E193 PolarHBondContact O-N 3.27Å; V191-E193 PolarHBondContact O-N 2.66Å; E193-L195 PolarHBondContact O-N 3.06Å; E193-A196 PolarHBondContact O-N 3.02Å; E193-Q197 WeakPolarHBondContact O-CB 3.34Å; E193-Q197 VanDerWaalsContact O-CG 3.27Å; E193-Q197 WeakPolarHBondContact O-CG 3.28Å; E193-Q197 PolarHBondContact O-N 2.92Å; E193-Q197 PolarHBondContact OE1-NE2 3.22Å; E193-Q197 VanDerWaalsContact OE1-NE2 3.07Å
194	K	95.6	Very high	94.9	Very high	72 Å²	72	75.2 Å²	75.2	31%	0.313	40%	0.4	S	S	.	.	H	α-helix	trans	-66.1	-37	179.2	-73.6	178.8	-178.6	-57.8	0	113	F157 Q190 V191 Q192 Q197 G198 V199	F157-K194 HydrophobicContact CB-CD 4.28Å; F157-K194 HydrophobicContact CD1-CB 3.93Å; F157-K194 HydrophobicContact CD1-CD 4.18Å; F157-K194 HydrophobicContact CD2-CB 4.42Å; F157-K194 HydrophobicContact CD2-CD 3.63Å; F157-K194 HydrophobicContact CE1-CB 3.56Å; F157-K194 HydrophobicContact CE1-CD 4.45Å; F157-K194 HydrophobicContact CE2-CB 4.09Å; F157-K194 HydrophobicContact CE2-CD 3.94Å; F157-K194 HydrophobicContact CG-CB 4.35Å; F157-K194 HydrophobicContact CG-CD 3.77Å; F157-K194 HydrophobicContact CZ-CB 3.64Å; F157-K194 HydrophobicContact CZ-CD 4.34Å; Q190-K194 WeakPolarHBondContact O-CB 3.19Å; Q190-K194 VanDerWaalsContact O-CG 3.25Å; Q190-K194 WeakPolarHBondContact O-CG 3.49Å; Q190-K194 PolarHBondContact O-N 2.73Å; V191-K194 PolarHBondContact O-N 3.07Å; Q192-K194 PolarHBondContact O-N 3Å; K194-Q197 PolarHBondContact O-N 3.28Å; K194-G198 PolarHBondContact O-N 2.72Å; K194-V199 HydrophobicContact CB-CB 4.4Å; K194-V199 HydrophobicContact CB-CG2 4.3Å; K194-V199 WeakPolarHBondContact O-CB 3.41Å; K194-V199 WeakPolarHBondContact O-CG2 3.46Å; K194-V199 PolarHBondContact O-N 3.28Å; K194-V199 VanDerWaalsContact O-N 3.07Å
195	L	94.1	Very high	95.1	Very high	44 Å²	44	72.2 Å²	72.2	23%	0.23	39%	0.388	C	S	.	.	H	α-helix	trans	-65.9	-44.1	174.2	-70.4	173.5	0	0	0	110.9	Y155 F157 V191 Q192 E193 Q197 G198	Y155-L195 HydrophobicContact CD1-CD2 4.35Å; Y155-L195 HydrophobicContact CD2-CD1 4.11Å; Y155-L195 HydrophobicContact CE1-CD2 4.49Å; Y155-L195 HydrophobicContact CE2-CD1 4.01Å; Y155-L195 HydrophobicContact CG-CD2 4.47Å; F157-L195 HydrophobicContact CE1-CD2 4.11Å; F157-L195 HydrophobicContact CE1-CG 4.43Å; F157-L195 HydrophobicContact CZ-CD2 4.1Å; F157-L195 HydrophobicContact CZ-CG 4.1Å; V191-L195 HydrophobicContact CG1-CD1 3.88Å; V191-L195 HydrophobicContact CG1-CG 4.35Å; V191-L195 VanDerWaalsContact O-CG 3.29Å; V191-L195 WeakPolarHBondContact O-CG 3.34Å; V191-L195 PolarHBondContact O-N 3.39Å; Q192-L195 PolarHBondContact O-N 3.24Å; E193-L195 PolarHBondContact O-N 3.06Å; L195-Q197 VanDerWaalsContact C-N 3.28Å; L195-Q197 PolarHBondContact O-N 3.14Å; L195-G198 PolarHBondContact O-N 2.67Å
196	A	95.4	Very high	95.4	Very high	92 Å²	92	68.8 Å²	68.8	76%	0.76	37%	0.369	S	S	*	.	H	α-helix	trans	-63.7	-33.1	177.2	0	0	0	0	0	112.7	Q192 E193 G198	Q192-A196 WeakPolarHBondContact O-CB 3.42Å; Q192-A196 PolarHBondContact O-N 3.38Å; E193-A196 PolarHBondContact O-N 3.02Å; A196-G198 PolarHBondContact O-N 2.85Å
197	Q	95.6	Very high	95.4	Very high	115 Å²	115	66.7 Å²	66.7	54%	0.537	36%	0.358	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.3	-4.8	173.2	-72.6	169.1	1.8	0	0	113.7	E193 K194 L195 V199	E193-Q197 WeakPolarHBondContact O-CB 3.34Å; E193-Q197 VanDerWaalsContact O-CG 3.27Å; E193-Q197 WeakPolarHBondContact O-CG 3.28Å; E193-Q197 PolarHBondContact O-N 2.92Å; E193-Q197 PolarHBondContact OE1-NE2 3.22Å; E193-Q197 VanDerWaalsContact OE1-NE2 3.07Å; K194-Q197 PolarHBondContact O-N 3.28Å; L195-Q197 VanDerWaalsContact C-N 3.28Å; L195-Q197 PolarHBondContact O-N 3.14Å; Q197-V199 VanDerWaalsContact C-N 3.28Å; Q197-V199 HydrophobicContact CB-CG2 3.98Å; Q197-V199 PolarHBondContact O-N 3.43Å
198	G	93.8	Very high	95.2	Very high	58 Å²	58	63.6 Å²	63.6	60%	0.598	35%	0.35	S	S	*	.	T	Hydrogen-bonded Turn	trans	68.3	24.9	-178.4	0	0	0	0	0	113.8	K194 L195 A196	K194-G198 PolarHBondContact O-N 2.72Å; L195-G198 PolarHBondContact O-N 2.67Å; A196-G198 PolarHBondContact O-N 2.85Å
199	V	95.1	Very high	95	Very high	42 Å²	42	61.9 Å²	61.9	26%	0.255	35%	0.348	S	S	.	.			trans	-63.1	129.3	179.8	-178.8	0	0	0	0	109.5	F157 K194 Q197 H201	F157-V199 HydrophobicContact CB-CG1 4.33Å; F157-V199 HydrophobicContact CD1-CB 4.03Å; F157-V199 HydrophobicContact CD1-CG1 3.88Å; F157-V199 HydrophobicContact CE1-CB 4.48Å; K194-V199 HydrophobicContact CB-CB 4.4Å; K194-V199 HydrophobicContact CB-CG2 4.3Å; K194-V199 WeakPolarHBondContact O-CB 3.41Å; K194-V199 WeakPolarHBondContact O-CG2 3.46Å; K194-V199 PolarHBondContact O-N 3.28Å; K194-V199 VanDerWaalsContact O-N 3.07Å; Q197-V199 VanDerWaalsContact C-N 3.28Å; Q197-V199 HydrophobicContact CB-CG2 3.98Å; Q197-V199 PolarHBondContact O-N 3.43Å; V199-H201 PolarHBondContact O-N 3.09Å; V199-H201 PolarHBondContact O-ND1 2.7Å; V199-H201 VanDerWaalsContact O-ND1 3.11Å
200	P	95.4	Very high	94.3	Very high	106 Å²	106	59.6 Å²	59.6	69%	0.688	35%	0.345	S	S	*	.			trans	-55	132.6	175.9	-26.8	34.6	0	0	0	111.3
201	H	96.8	Very high	93.6	Very high	65 Å²	65	56.6 Å²	56.6	30%	0.301	33%	0.331	S	S	.	.			trans	-145.8	163	-174	62.6	-90.2	0	0	0	111.9	Y155 C156 F157 V199 A238	Y155-H201 AromaticContact CD1-CD2 3.49Å; Y155-H201 VanDerWaalsContact CD1-CD2 3.49Å; Y155-H201 WeakPolarHBondContact CD1-CD2 3.43Å; Y155-H201 AromaticContact CD1-NE2 3.95Å; Y155-H201 AromaticContact CE1-CD2 3.9Å; Y155-H201 AromaticContact CE1-NE2 3.89Å; C156-H201 VanDerWaalsContact O-CA 3.31Å; C156-H201 WeakPolarHBondContact O-CA 3.41Å; F157-H201 HydrophobicContact CD1-CB 3.57Å; F157-H201 HydrophobicContact CE1-CB 3.6Å; F157-H201 HydrophobicContact CG-CB 4.38Å; F157-H201 HydrophobicContact CZ-CB 4.43Å; V199-H201 PolarHBondContact O-N 3.09Å; V199-H201 PolarHBondContact O-ND1 2.7Å; V199-H201 VanDerWaalsContact O-ND1 3.11Å; H201-A238 VanDerWaalsContact O-CA 3.29Å; H201-A238 WeakPolarHBondContact O-CA 3.08Å
202	V	97.9	Very high	93.2	Very high	27 Å²	27	61.9 Å²	61.9	16%	0.164	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	159.2	171	-58.7	0	0	0	0	109	Y155 C156 R204 V234 I236 A238	Y155-V202 WeakPolarHBondContact CA-O 3.48Å; C156-V202 HydrophobicContact CB-CG2 3.71Å; C156-V202 PolarHBondContact N-O 3.32Å; C156-V202 PolarHBondContact O-N 2.88Å; V202-R204 HydrophobicContact CG2-CG 4.2Å; V202-V234 HydrophobicContact CB-CG1 3.97Å; V202-V234 HydrophobicContact CG1-CG1 4.4Å; V202-V234 HydrophobicContact CG2-CG1 4.37Å; V202-V234 HydrophobicContact CG2-CG2 4.06Å; V202-I236 WeakPolarHBondContact CA-O 3.25Å; V202-I236 VanDerWaalsContact CB-O 3.29Å; V202-I236 WeakPolarHBondContact CB-O 3.26Å; V202-A238 HydrophobicContact CG1-CB 4.16Å
203	V	98.3	Very high	93	Very high	8 Å²	8	59.7 Å²	59.7	5%	0.048	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.4	128.9	167.4	-174.1	0	0	0	0	108.2	A144 V148 Y155 V235 I236	A144-V203 HydrophobicContact CB-CG1 4.43Å; V148-V203 HydrophobicContact CG2-CG1 3.72Å; Y155-V203 HydrophobicContact CD1-CG2 3.94Å; Y155-V203 HydrophobicContact CE1-CG2 3.76Å; V203-V235 HydrophobicContact CB-CG2 3.97Å; V203-V235 HydrophobicContact CG1-CG2 3.72Å; V203-V235 VanDerWaalsContact O-CG2 3.26Å; V203-V235 WeakPolarHBondContact O-CG2 3.25Å; V203-V235 PolarHBondContact O-N 3.05Å; V203-I236 HydrophobicContact CB-CB 3.92Å; V203-I236 HydrophobicContact CB-CG1 4.23Å; V203-I236 HydrophobicContact CG2-CB 4Å; V203-I236 HydrophobicContact CG2-CG1 4.32Å; V203-I236 PolarHBondContact N-O 3.02Å; V203-I236 PolarHBondContact O-N 3.45Å
204	R	98.5	Very high	92.9	Very high	18 Å²	18	54.9 Å²	54.9	7%	0.068	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	145.1	174	-68.7	-176.8	179	-85.9	-4.2	110.7	G153 Y154 C156 V202 D232 P233 V234	G153-R204 CarbonylContact C-O 3.6Å; G153-R204 WeakPolarHBondContact CA-O 3.44Å; Y154-R204 HydrophobicContact CE1-CB 4.19Å; Y154-R204 HydrophobicContact CE2-CB 4.08Å; Y154-R204 PolarHBondContact N-O 3.47Å; Y154-R204 PolarHBondContact O-N 2.92Å; C156-R204 HydrophobicContact CB-CG 3.98Å; C156-R204 PolarHBondContact SG-NE 2.87Å; V202-R204 HydrophobicContact CG2-CG 4.2Å; R204-D232 HydrophobicContact CB-CB 4.36Å; R204-D232 PolarHBondContact NH1-O 3.4Å; R204-P233 CarbonylContact C-O 3.46Å; R204-P233 VanDerWaalsContact CA-O 3.24Å; R204-P233 WeakPolarHBondContact CA-O 3.22Å; R204-V234 HydrophobicContact CG-CG2 4.25Å
205	F	98.1	Very high	92.9	Very high	4 Å²	4	57.2 Å²	57.2	2%	0.018	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.7	131.3	169.7	179.3	-106.6	0	0	0	109.6	L147 H152 L207 D232 P233 V235 L275 M276 A279	L147-F205 HydrophobicContact CD1-CD2 4.32Å; L147-F205 HydrophobicContact CD2-CD2 4.26Å; L147-F205 HydrophobicContact CD2-CE2 4.13Å; H152-F205 HydrophobicContact CB-CE2 4.24Å; H152-F205 VanDerWaalsContact O-CD2 3.26Å; H152-F205 WeakPolarHBondContact O-CD2 3.41Å; F205-L207 HydrophobicContact CD1-CD2 3.87Å; F205-L207 HydrophobicContact CE1-CD2 3.96Å; F205-L207 PolarHBondContact O-N 2.75Å; F205-D232 WeakPolarHBondContact O-CA 3.43Å; F205-D232 WeakPolarHBondContact O-CB 3.18Å; F205-P233 HydrophobicContact CB-CG 4.33Å; F205-P233 PolarHBondContact N-O 3.27Å; F205-P233 WeakPolarHBondContact O-CD 3.16Å; F205-V235 HydrophobicContact CB-CG1 3.62Å; F205-L275 HydrophobicContact CE1-CB 3.93Å; F205-L275 HydrophobicContact CZ-CB 4.06Å; F205-M276 HydrophobicContact CB-CE 3.78Å; F205-M276 HydrophobicContact CD1-CE 3.68Å; F205-M276 HydrophobicContact CD1-CG 3.84Å; F205-M276 HydrophobicContact CD2-CE 4.45Å; F205-M276 HydrophobicContact CD2-CG 3.92Å; F205-M276 HydrophobicContact CE1-CE 4.39Å; F205-M276 HydrophobicContact CE1-CG 3.66Å; F205-M276 HydrophobicContact CE2-CB 4.28Å; F205-M276 HydrophobicContact CE2-CG 3.75Å; F205-M276 HydrophobicContact CG-CE 3.72Å; F205-M276 HydrophobicContact CG-CG 3.96Å; F205-M276 HydrophobicContact CZ-CB 4.22Å; F205-M276 HydrophobicContact CZ-CG 3.63Å; F205-A279 HydrophobicContact CE2-CB 3.76Å; F205-A279 HydrophobicContact CZ-CB 4.1Å
206	R	96.7	Very high	93	Very high	81 Å²	81	55.3 Å²	55.3	31%	0.306	33%	0.33	S	S	.	.			trans	-78.8	108.5	178.9	178.4	-179.4	165.2	143.5	2.8	108.9	G151 H152 Y154 R184 E208	G151-R206 WeakPolarHBondContact O-CD 3.49Å; H152-R206 WeakPolarHBondContact O-CB 3.36Å; H152-R206 PolarHBondContact O-N 3.28Å; Y154-R206 HydrophobicContact CD1-CB 4.34Å; Y154-R206 HydrophobicContact CE1-CB 4.28Å; R184-R206 VanDerWaalsContact NH2-CZ 3.3Å; R184-R206 VanDerWaalsContact NH2-NH2 3.16Å; R206-E208 IonicContact NE-OE1 2.92Å; R206-E208 PolarHBondContact NE-OE1 2.89Å
207	L	94.6	Very high	93	Very high	7 Å²	7	53.9 Å²	53.9	4%	0.037	31%	0.309	C	S	.	.			trans	-73.1	136.7	174.1	-69	176.6	0	0	0	110.1	R184 F205 V226 A227 E230 D232 P233 K272 L275	R184-L207 PolarHBondContact NH1-O 3.41Å; F205-L207 HydrophobicContact CD1-CD2 3.87Å; F205-L207 HydrophobicContact CE1-CD2 3.96Å; F205-L207 PolarHBondContact O-N 2.75Å; L207-V226 HydrophobicContact CD2-CG2 4.18Å; L207-A227 HydrophobicContact CB-CB 3.9Å; L207-E230 HydrophobicContact CD1-CB 4.17Å; L207-D232 PolarHBondContact N-OD1 3.03Å; L207-P233 HydrophobicContact CD2-CG 4.48Å; L207-P233 HydrophobicContact CG-CG 4.48Å; L207-K272 HydrophobicContact CD2-CG 4.35Å; L207-L275 HydrophobicContact CD2-CD1 3.96Å
208	E	89.1	Confident	92.9	Very high	86 Å²	86	49.3 Å²	49.3	40%	0.402	29%	0.288	S	S	.	.			trans	-119.6	147	175.7	-56.7	-157.9	144	0	0	110.2	R206 A227	R206-E208 IonicContact NE-OE1 2.92Å; R206-E208 PolarHBondContact NE-OE1 2.89Å; E208-A227 WeakPolarHBondContact O-CB 3.41Å
209	A	87.1	Confident	92.9	Very high	77 Å²	77	49.2 Å²	49.2	64%	0.636	27%	0.271	S	S	*	.	S	Bend	trans	-74.9	159.4	176.6	0	0	0	0	0	110.9
210	G	79.3	Confident	92.9	Very high	39 Å²	39	48.5 Å²	48.5	40%	0.402	27%	0.272	S	S	.	.			trans	86.5	50.7	177.6	0	0	0	0	0	112.6	E212 E225 R278	G210-E212 PolarHBondContact O-N 3.07Å; G210-E225 PolarHBondContact N-OE2 3.31Å; G210-R278 PolarHBondContact O-NH1 2.92Å
211	V	80.2	Confident	92.8	Very high	4 Å²	4	51.8 Å²	51.8	2%	0.024	27%	0.271	C	S	.	.	P	Polyproline II helix	trans	-68.7	125.3	167.4	-175	0	0	0	0	108.1	V226 L275	V211-V226 HydrophobicContact CG2-CG2 4.32Å; V211-L275 HydrophobicContact CG2-CD1 3.71Å; V211-L275 HydrophobicContact CG2-CD2 3.92Å; V211-L275 HydrophobicContact CG2-CG 3.8Å
212	E	85	Confident	92.6	Very high	129 Å²	129	50 Å²	50	60%	0.603	26%	0.263	S	S	*	.	P	Polyproline II helix	trans	-66.9	141.3	173.6	-77.1	171.6	153.1	0	0	109.8	G210 R278	G210-E212 PolarHBondContact O-N 3.07Å; E212-R278 IonicContact OE1-NH2 3.83Å; E212-R278 IonicContact OE2-CZ 2.69Å; E212-R278 IonicContact OE2-NH2 3.97Å; E212-R278 PolarHBondContact OE2-NH2 3.43Å
213	P	91.3	Very high	92.2	Very high	68 Å²	68	56 Å²	56	44%	0.442	28%	0.283	S	S	.	.	P	Polyproline II helix	trans	-58.7	143.3	171.4	27.6	-34.1	0	0	0	109.7	W221 N222 R223	P213-W221 HydrophobicContact CB-CE3 4.13Å; P213-W221 HydrophobicContact CB-CZ3 4.43Å; P213-N222 WeakPolarHBondContact CA-O 3.37Å; P213-R223 HydrophobicContact CB-CB 4.21Å
214	F	93.9	Very high	91.8	Very high	10 Å²	10	58.3 Å²	58.3	4%	0.044	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	151.8	174.8	72.5	-84.9	0	0	0	110.3	D216 W221 N222 L267 T270 L274	F214-D216 HydrophobicContact CE2-CB 4.14Å; F214-W221 WeakPolarHBondContact O-CA 3.46Å; F214-N222 HydrophobicContact CD1-CB 4.39Å; F214-N222 HydrophobicContact CE1-CB 3.81Å; F214-N222 HydrophobicContact CE2-CB 4.27Å; F214-N222 HydrophobicContact CZ-CB 3.74Å; F214-N222 PolarHBondContact N-O 3.26Å; F214-N222 PolarHBondContact O-N 3.47Å; F214-L267 HydrophobicContact CE2-CD1 4.2Å; F214-L267 HydrophobicContact CZ-CD1 3.85Å; F214-T270 HydrophobicContact CD1-CG2 4.5Å; F214-T270 HydrophobicContact CD2-CG2 4.15Å; F214-T270 HydrophobicContact CE1-CG2 4.11Å; F214-T270 HydrophobicContact CE2-CG2 3.73Å; F214-T270 HydrophobicContact CZ-CG2 3.71Å; F214-L274 HydrophobicContact CB-CD1 3.62Å; F214-L274 HydrophobicContact CD1-CD1 3.65Å; F214-L274 HydrophobicContact CE1-CD1 4.49Å; F214-L274 HydrophobicContact CG-CD1 3.72Å
215	Q	95.3	Very high	91.4	Very high	122 Å²	122	59.1 Å²	59.1	57%	0.57	30%	0.298	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-98	113.2	176.3	-169.2	177.2	10	0	0	109	W221	Q215-W221 HydrophobicContact CB-CD2 4.07Å; Q215-W221 HydrophobicContact CB-CE3 4.03Å; Q215-W221 HydrophobicContact CB-CH2 4.14Å; Q215-W221 HydrophobicContact CB-CZ2 4.15Å; Q215-W221 HydrophobicContact CB-CZ3 4.07Å; Q215-W221 HydrophobicContact CG-CD2 4.36Å; Q215-W221 HydrophobicContact CG-CZ2 4.5Å
216	D	96	Very high	91	Very high	4 Å²	4	59.1 Å²	59.1	2%	0.021	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.9	141.5	169.2	-170.1	-95.3	0	0	0	110.4	F214 I218 F219 G220 F287 G288 H289	F214-D216 HydrophobicContact CE2-CB 4.14Å; D216-I218 PolarHBondContact O-N 2.83Å; D216-I218 WeakPolarHBondContact OD1-CA 3.45Å; D216-I218 PolarHBondContact OD1-N 3.5Å; D216-F219 HydrophobicContact CB-CB 4.09Å; D216-F219 PolarHBondContact OD1-N 2.93Å; D216-G220 WeakPolarHBondContact CB-O 3.44Å; D216-G220 PolarHBondContact N-O 3.05Å; D216-G220 WeakPolarHBondContact O-CA 3.28Å; D216-G220 PolarHBondContact O-N 3.32Å; D216-F287 WeakPolarHBondContact CA-O 3.17Å; D216-G288 WeakPolarHBondContact OD2-CA 3.35Å; D216-H289 PolarHBondContact OD1-N 3.43Å; D216-H289 VanDerWaalsContact OD1-N 3.14Å; D216-H289 IonicContact OD2-CE1 3.26Å; D216-H289 IonicContact OD2-CG 2.88Å; D216-H289 PolarHBondContact OD2-N 3.35Å; D216-H289 VanDerWaalsContact OD2-N 3.11Å; D216-H289 IonicContact OD2-ND1 2.79Å; D216-H289 PolarHBondContact OD2-ND1 3.49Å
217	L	94.4	Very high	90.6	Very high	61 Å²	61	56.7 Å²	56.7	32%	0.319	30%	0.295	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.4	-23.9	179.3	-70.4	176.2	0	0	0	113.9	L261 T286 F287	L217-L261 HydrophobicContact CD1-CD2 4.29Å; L217-T286 HydrophobicContact CD1-CG2 3.67Å; L217-T286 HydrophobicContact CD2-CG2 3.75Å; L217-T286 HydrophobicContact CG-CG2 3.6Å; L217-F287 WeakPolarHBondContact CG-O 3.39Å; L217-F287 PolarHBondContact N-O 3.19Å
218	I	94	Very high	90.3	Very high	19 Å²	19	62.5 Å²	62.5	10%	0.097	32%	0.322	C	S	.	.	T	Hydrogen-bonded Turn	trans	-116.1	-48.4	-173.6	-61.6	166	0	0	0	110.2	D216 H289 L290 I355 T357	D216-I218 PolarHBondContact O-N 2.83Å; D216-I218 WeakPolarHBondContact OD1-CA 3.45Å; D216-I218 PolarHBondContact OD1-N 3.5Å; I218-H289 WeakPolarHBondContact CB-O 3.17Å; I218-H289 WeakPolarHBondContact CD1-O 3.39Å; I218-H289 WeakPolarHBondContact CG2-O 3.22Å; I218-L290 HydrophobicContact CD1-CD2 3.78Å; I218-I355 HydrophobicContact CD1-CB 4.25Å; I218-I355 HydrophobicContact CD1-CD1 3.72Å; I218-I355 HydrophobicContact CD1-CG2 3.98Å; I218-I355 HydrophobicContact CG1-CB 4.16Å; I218-I355 HydrophobicContact CG1-CD1 4.18Å; I218-I355 HydrophobicContact CG1-CG2 4.27Å; I218-I355 HydrophobicContact CG2-CB 4.17Å; I218-I355 HydrophobicContact CG2-CG2 3.82Å; I218-T357 HydrophobicContact CG2-CG2 4.26Å; I218-T357 WeakPolarHBondContact O-CG2 3.48Å
219	F	93.8	Very high	90.2	Very high	57 Å²	57	62.5 Å²	62.5	25%	0.25	33%	0.328	C	S	.	.	T	Hydrogen-bonded Turn	trans	-88.9	-0.3	-177.7	-77.9	-94.8	0	0	0	114.2	D216 N222 L267 H289 T357	D216-F219 HydrophobicContact CB-CB 4.09Å; D216-F219 PolarHBondContact OD1-N 2.93Å; F219-N222 PolarHBondContact O-ND2 3.05Å; F219-L267 HydrophobicContact CB-CD2 4.36Å; F219-L267 HydrophobicContact CD1-CD2 4.28Å; F219-L267 HydrophobicContact CG-CD2 4.19Å; F219-H289 HydrophobicContact CD2-CB 3.88Å; F219-H289 WeakPolarHBondContact CD2-O 3.48Å; F219-H289 HydrophobicContact CE2-CB 4.14Å; F219-H289 WeakPolarHBondContact CE2-O 3.49Å; F219-T357 HydrophobicContact CD1-CG2 3.97Å; F219-T357 HydrophobicContact CE1-CG2 4.13Å; F219-T357 HydrophobicContact CG-CG2 4.18Å; F219-T357 HydrophobicContact CZ-CG2 4.47Å; F219-T357 WeakPolarHBondContact CZ-O 3.41Å
220	G	94.3	Very high	90.5	Very high	26 Å²	26	61.8 Å²	61.8	27%	0.268	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	66.7	-148.7	178.7	0	0	0	0	0	113.4	D216 N222	D216-G220 WeakPolarHBondContact CB-O 3.44Å; D216-G220 PolarHBondContact N-O 3.05Å; D216-G220 WeakPolarHBondContact O-CA 3.28Å; D216-G220 PolarHBondContact O-N 3.32Å; G220-N222 PolarHBondContact O-N 3.39Å; G220-N222 PolarHBondContact O-ND2 3.35Å
221	W	95.1	Very high	91.1	Very high	175 Å²	175	60.3 Å²	60.3	66%	0.663	30%	0.297	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-69.5	123.6	-177.5	-72.8	104.1	0	0	0	112.3	P213 F214 Q215	P213-W221 HydrophobicContact CB-CE3 4.13Å; P213-W221 HydrophobicContact CB-CZ3 4.43Å; F214-W221 WeakPolarHBondContact O-CA 3.46Å; Q215-W221 HydrophobicContact CB-CD2 4.07Å; Q215-W221 HydrophobicContact CB-CE3 4.03Å; Q215-W221 HydrophobicContact CB-CH2 4.14Å; Q215-W221 HydrophobicContact CB-CZ2 4.15Å; Q215-W221 HydrophobicContact CB-CZ3 4.07Å; Q215-W221 HydrophobicContact CG-CD2 4.36Å; Q215-W221 HydrophobicContact CG-CZ2 4.5Å
222	N	92.6	Very high	91.9	Very high	28 Å²	28	60.2 Å²	60.2	15%	0.15	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	144.5	179.9	-73.7	-86.1	0	0	0	110.8	P213 F214 F219 G220	P213-N222 WeakPolarHBondContact CA-O 3.37Å; F214-N222 HydrophobicContact CD1-CB 4.39Å; F214-N222 HydrophobicContact CE1-CB 3.81Å; F214-N222 HydrophobicContact CE2-CB 4.27Å; F214-N222 HydrophobicContact CZ-CB 3.74Å; F214-N222 PolarHBondContact N-O 3.26Å; F214-N222 PolarHBondContact O-N 3.47Å; F219-N222 PolarHBondContact O-ND2 3.05Å; G220-N222 PolarHBondContact O-N 3.39Å; G220-N222 PolarHBondContact O-ND2 3.35Å
223	R	88.8	Confident	92.5	Very high	153 Å²	153	54.8 Å²	54.8	58%	0.577	27%	0.272	S	S	*	.			trans	-145.7	122.6	173.7	-175.8	179.1	173.6	-171.4	0.5	109.7	P213 E225	P213-R223 HydrophobicContact CB-CB 4.21Å; R223-E225 IonicContact CZ-OE1 3.97Å; R223-E225 IonicContact NE-OE1 3.88Å; R223-E225 PolarHBondContact NE-OE1 2.91Å; R223-E225 IonicContact NH2-OE1 3.93Å; R223-E225 PolarHBondContact NH2-OE1 3.43Å
224	H	89.9	Confident	92.8	Very high	57 Å²	57	53.1 Å²	53.1	26%	0.264	26%	0.26	S	S	.	.			trans	-128.2	120.4	173.7	-56	-76.8	0	0	0	110.2	V226 S271	H224-V226 VanDerWaalsContact C-N 3.27Å; H224-V226 HydrophobicContact CB-CG1 4.37Å; H224-V226 PolarHBondContact O-N 3.23Å; H224-S271 WeakPolarHBondContact CB-OG 3.15Å; H224-S271 PolarHBondContact N-OG 2.89Å; H224-S271 WeakPolarHBondContact O-CB 3.21Å; H224-S271 PolarHBondContact O-OG 3.31Å; H224-S271 VanDerWaalsContact O-OG 3.09Å
225	E	89.6	Confident	93	Very high	35 Å²	35	52.7 Å²	52.7	16%	0.164	26%	0.258	C	S	.	.			trans	-81.2	70.9	176.5	-68.4	-64.3	158.6	0	0	110.7	G210 R223 A227 Q228	G210-E225 PolarHBondContact N-OE2 3.31Å; R223-E225 IonicContact CZ-OE1 3.97Å; R223-E225 IonicContact NE-OE1 3.88Å; R223-E225 PolarHBondContact NE-OE1 2.91Å; R223-E225 IonicContact NH2-OE1 3.93Å; R223-E225 PolarHBondContact NH2-OE1 3.43Å; E225-A227 PolarHBondContact O-N 2.85Å; E225-Q228 HydrophobicContact CB-CB 4.39Å; E225-Q228 HydrophobicContact CB-CG 4.04Å; E225-Q228 PolarHBondContact O-N 2.82Å
226	V	90.6	Very high	93.1	Very high	4 Å²	4	47.3 Å²	47.3	2%	0.024	23%	0.234	C	C	.	.	H	α-helix	trans	-57.7	-32.9	-174.8	-66.9	0	0	0	0	113.1	L207 V211 H224 Q228 V229 E230 I268 K272 L275	L207-V226 HydrophobicContact CD2-CG2 4.18Å; V211-V226 HydrophobicContact CG2-CG2 4.32Å; H224-V226 VanDerWaalsContact C-N 3.27Å; H224-V226 HydrophobicContact CB-CG1 4.37Å; H224-V226 PolarHBondContact O-N 3.23Å; V226-Q228 PolarHBondContact O-N 3.43Å; V226-V229 PolarHBondContact O-N 3.39Å; V226-E230 WeakPolarHBondContact O-CB 3.45Å; V226-E230 PolarHBondContact O-N 2.92Å; V226-I268 HydrophobicContact CG1-CG2 4.45Å; V226-K272 HydrophobicContact CG2-CB 4.48Å; V226-L275 HydrophobicContact CG2-CD1 3.94Å
227	A	88.7	Confident	93.1	Very high	29 Å²	29	49.7 Å²	49.7	24%	0.24	24%	0.244	C	C	.	.	H	α-helix	trans	-67.7	-19.3	179.2	0	0	0	0	0	114.1	L207 E208 E225	L207-A227 HydrophobicContact CB-CB 3.9Å; E208-A227 WeakPolarHBondContact O-CB 3.41Å; E225-A227 PolarHBondContact O-N 2.85Å
228	Q	87.1	Confident	93.1	Very high	130 Å²	130	50.3 Å²	50.3	61%	0.607	26%	0.257	S	S	*	.	H	α-helix	trans	-83.8	-27.5	178	-65.4	-176.6	0.8	0	0	112.3	R178 E225 V226	R178-Q228 PolarHBondContact NH1-O 2.98Å; E225-Q228 HydrophobicContact CB-CB 4.39Å; E225-Q228 HydrophobicContact CB-CG 4.04Å; E225-Q228 PolarHBondContact O-N 2.82Å; V226-Q228 PolarHBondContact O-N 3.43Å
229	V	88	Confident	93	Very high	86 Å²	86	53.9 Å²	53.9	52%	0.521	28%	0.277	S	S	.	.	H	α-helix	trans	-104.9	-36.7	-171.5	-171.1	0	0	0	0	111.4	V226	V226-V229 PolarHBondContact O-N 3.39Å
230	E	91.9	Very high	93	Very high	61 Å²	61	52.3 Å²	52.3	29%	0.285	28%	0.277	S	S	.	.	S	Bend	trans	-104	157.4	-176.2	-60	-177.9	-152.5	0	0	112.2	L207 V226 K272	L207-E230 HydrophobicContact CD1-CB 4.17Å; V226-E230 WeakPolarHBondContact O-CB 3.45Å; V226-E230 PolarHBondContact O-N 2.92Å; E230-K272 IonicContact OE1-NZ 3.69Å; E230-K272 WeakPolarHBondContact OE2-CE 3.37Å; E230-K272 IonicContact OE2-NZ 3.81Å; E230-K272 PolarHBondContact OE2-NZ 3.12Å
231	G	93.6	Very high	93.1	Very high	9 Å²	9	52.7 Å²	52.7	9%	0.093	27%	0.271	C	S	.	.			trans	-89.8	166.5	165.2	0	0	0	0	0	110.7	Y179 P233	Y179-G231 WeakPolarHBondContact O-CA 3.48Å; G231-P233 WeakPolarHBondContact O-CD 3.38Å; G231-P233 VanDerWaalsContact O-N 3.1Å
232	D	96.6	Very high	93.2	Very high	1 Å²	1	44.4 Å²	44.4	1%	0.005	24%	0.24	C	C	.	.			trans	-56.1	113.6	-177.8	-71.8	-15	0	0	0	111	Y154 Y179 N181 R184 R204 F205 L207	Y154-D232 HydrophobicContact CE1-CB 4.16Å; Y154-D232 WeakPolarHBondContact CE1-OD2 3.35Å; Y154-D232 VanDerWaalsContact CZ-OD2 3.3Å; Y154-D232 WeakPolarHBondContact OH-CB 3.29Å; Y154-D232 VanDerWaalsContact OH-CG 3.31Å; Y154-D232 PolarHBondContact OH-OD2 3.19Å; Y179-D232 HydrophobicContact CD1-CB 4.3Å; N181-D232 WeakPolarHBondContact OD1-CB 3.28Å; N181-D232 PolarHBondContact OD1-N 3.09Å; N181-D232 PolarHBondContact OD1-OD2 3.32Å; R184-D232 IonicContact NH1-OD2 3.06Å; R204-D232 HydrophobicContact CB-CB 4.36Å; R204-D232 PolarHBondContact NH1-O 3.4Å; F205-D232 WeakPolarHBondContact O-CA 3.43Å; F205-D232 WeakPolarHBondContact O-CB 3.18Å; L207-D232 PolarHBondContact N-OD1 3.03Å
233	P	96.6	Very high	93.4	Very high	15 Å²	15	44.3 Å²	44.3	10%	0.097	24%	0.24	C	C	.	.			trans	-75	151	-171.3	30	-35.4	0	0	0	111.2	R204 F205 L207 G231 K272 M276	R204-P233 CarbonylContact C-O 3.46Å; R204-P233 VanDerWaalsContact CA-O 3.24Å; R204-P233 WeakPolarHBondContact CA-O 3.22Å; F205-P233 HydrophobicContact CB-CG 4.33Å; F205-P233 PolarHBondContact N-O 3.27Å; F205-P233 WeakPolarHBondContact O-CD 3.16Å; L207-P233 HydrophobicContact CD2-CG 4.48Å; L207-P233 HydrophobicContact CG-CG 4.48Å; G231-P233 WeakPolarHBondContact O-CD 3.38Å; G231-P233 VanDerWaalsContact O-N 3.1Å; P233-K272 HydrophobicContact CB-CD 4.45Å; P233-K272 HydrophobicContact CG-CD 3.97Å; P233-M276 HydrophobicContact CG-CE 4.31Å
234	V	97.7	Very high	93.8	Very high	34 Å²	34	38.9 Å²	38.9	21%	0.206	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.1	134.8	170.7	-179.2	0	0	0	0	109.3	V202 R204 I236 T243	V202-V234 HydrophobicContact CB-CG1 3.97Å; V202-V234 HydrophobicContact CG1-CG1 4.4Å; V202-V234 HydrophobicContact CG2-CG1 4.37Å; V202-V234 HydrophobicContact CG2-CG2 4.06Å; R204-V234 HydrophobicContact CG-CG2 4.25Å; V234-I236 WeakPolarHBondContact CG1-O 3.36Å; V234-T243 HydrophobicContact CB-CG2 4.08Å; V234-T243 HydrophobicContact CG1-CG2 3.89Å; V234-T243 WeakPolarHBondContact O-CB 3.15Å; V234-T243 WeakPolarHBondContact O-CG2 3.2Å; V234-T243 PolarHBondContact O-OG1 2.9Å
235	V	98	Very high	94.2	Very high	0 Å²	0	37.7 Å²	37.7	0%	0	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	-31.7	174.6	-72.3	0	0	0	0	112.9	V203 F205 P242 T243 L246 M276	V203-V235 HydrophobicContact CB-CG2 3.97Å; V203-V235 HydrophobicContact CG1-CG2 3.72Å; V203-V235 VanDerWaalsContact O-CG2 3.26Å; V203-V235 WeakPolarHBondContact O-CG2 3.25Å; V203-V235 PolarHBondContact O-N 3.05Å; F205-V235 HydrophobicContact CB-CG1 3.62Å; V235-P242 CarbonylContact O-C 3.55Å; V235-P242 VanDerWaalsContact O-CA 3.26Å; V235-P242 WeakPolarHBondContact O-CA 3.39Å; V235-T243 PolarHBondContact O-N 3.38Å; V235-L246 HydrophobicContact CB-CB 3.89Å; V235-L246 HydrophobicContact CB-CD2 4.07Å; V235-L246 HydrophobicContact CB-CG 4.37Å; V235-L246 HydrophobicContact CG1-CB 4.21Å; V235-M276 HydrophobicContact CG1-CE 3.7Å
236	I	98.1	Very high	94.6	Very high	10 Å²	10	36 Å²	36	5%	0.051	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	126.4	168.8	-60.5	-69	0	0	0	108.1	A144 V202 V203 V234 P242 L246	A144-I236 HydrophobicContact CB-CD1 4.03Å; A144-I236 HydrophobicContact CB-CG1 3.41Å; A144-I236 VanDerWaalsContact CB-CG1 3.41Å; V202-I236 WeakPolarHBondContact CA-O 3.25Å; V202-I236 VanDerWaalsContact CB-O 3.29Å; V202-I236 WeakPolarHBondContact CB-O 3.26Å; V203-I236 HydrophobicContact CB-CB 3.92Å; V203-I236 HydrophobicContact CB-CG1 4.23Å; V203-I236 HydrophobicContact CG2-CB 4Å; V203-I236 HydrophobicContact CG2-CG1 4.32Å; V203-I236 PolarHBondContact N-O 3.02Å; V203-I236 PolarHBondContact O-N 3.45Å; V234-I236 WeakPolarHBondContact CG1-O 3.36Å; I236-P242 HydrophobicContact CD1-CB 4.07Å; I236-L246 HydrophobicContact CD1-CD2 3.46Å; I236-L246 VanDerWaalsContact CD1-CD2 3.46Å; I236-L246 HydrophobicContact CG1-CD2 3.89Å
237	K	96.4	Very high	94.9	Very high	54 Å²	54	35.8 Å²	35.8	24%	0.235	21%	0.206	C	C	.	.			trans	-77	169.1	176.6	-67	-179.1	-70.2	155.6	0	111	T94 D239 G240 F241 T243	T94-K237 PolarHBondContact O-NZ 3.11Å; T94-K237 VanDerWaalsContact O-NZ 3.09Å; K237-D239 WeakPolarHBondContact CB-OD1 3.41Å; K237-D239 WeakPolarHBondContact CE-OD1 3.39Å; K237-D239 IonicContact NZ-OD1 2.69Å; K237-D239 IonicContact NZ-OD2 3.2Å; K237-D239 PolarHBondContact NZ-OD2 2.97Å; K237-D239 PolarHBondContact O-N 2.85Å; K237-G240 PolarHBondContact O-N 3.25Å; K237-G240 VanDerWaalsContact O-N 3.07Å; K237-F241 WeakPolarHBondContact CB-O 3.42Å; K237-F241 PolarHBondContact N-O 3.48Å; K237-T243 HydrophobicContact CG-CG2 4.12Å
238	A	93.8	Very high	95.4	Very high	73 Å²	73	34.5 Å²	34.5	60%	0.603	19%	0.194	S	C	*	.	T	Hydrogen-bonded Turn	trans	-69.2	-20.1	-179.7	0	0	0	0	0	113.5	H201 V202 G240	H201-A238 VanDerWaalsContact O-CA 3.29Å; H201-A238 WeakPolarHBondContact O-CA 3.08Å; V202-A238 HydrophobicContact CG1-CB 4.16Å; A238-G240 PolarHBondContact O-N 2.93Å
239	D	92.6	Very high	95.9	Very high	94 Å²	94	28.3 Å²	28.3	50%	0.503	17%	0.166	S	C	.	.	T	Hydrogen-bonded Turn	trans	-80.4	1.8	172.8	62.4	6	0	0	0	112.8	K237 F241	K237-D239 WeakPolarHBondContact CB-OD1 3.41Å; K237-D239 WeakPolarHBondContact CE-OD1 3.39Å; K237-D239 IonicContact NZ-OD1 2.69Å; K237-D239 IonicContact NZ-OD2 3.2Å; K237-D239 PolarHBondContact NZ-OD2 2.97Å; K237-D239 PolarHBondContact O-N 2.85Å; D239-F241 VanDerWaalsContact C-N 3.26Å; D239-F241 PolarHBondContact O-N 3.24Å; D239-F241 WeakPolarHBondContact OD1-CB 3.38Å; D239-F241 PolarHBondContact OD1-N 2.9Å
240	G	92.7	Very high	96.4	Very high	25 Å²	25	24.2 Å²	24.2	26%	0.258	14%	0.141	S	C	.	.	S	Bend	trans	81	-4	-178.7	0	0	0	0	0	114.9	K237 A238	K237-G240 PolarHBondContact O-N 3.25Å; K237-G240 VanDerWaalsContact O-N 3.07Å; A238-G240 PolarHBondContact O-N 2.93Å
241	F	96.6	Very high	96.7	Very high	34 Å²	34	21.3 Å²	21.3	15%	0.149	13%	0.127	C	C	.	.	P	Polyproline II helix	trans	-80.4	145.3	174.8	-84	-105.3	0	0	0	111.2	Q96 L137 K237 D239	Q96-F241 HydrophobicContact CG-CD1 4.4Å; Q96-F241 HydrophobicContact CG-CE1 3.86Å; Q96-F241 HydrophobicContact CG-CE2 4.17Å; Q96-F241 HydrophobicContact CG-CZ 3.73Å; L137-F241 HydrophobicContact CD1-CD2 4.49Å; L137-F241 HydrophobicContact CD1-CE1 4.39Å; L137-F241 HydrophobicContact CD1-CE2 4.08Å; L137-F241 HydrophobicContact CD1-CZ 4.03Å; L137-F241 HydrophobicContact CD2-CD1 3.72Å; L137-F241 HydrophobicContact CD2-CD2 4.48Å; L137-F241 HydrophobicContact CD2-CE1 3.9Å; L137-F241 HydrophobicContact CD2-CG 4.03Å; L137-F241 HydrophobicContact CD2-CZ 4.35Å; K237-F241 WeakPolarHBondContact CB-O 3.42Å; K237-F241 PolarHBondContact N-O 3.48Å; D239-F241 VanDerWaalsContact C-N 3.26Å; D239-F241 PolarHBondContact O-N 3.24Å; D239-F241 WeakPolarHBondContact OD1-CB 3.38Å; D239-F241 PolarHBondContact OD1-N 2.9Å
242	P	97.9	Very high	97	Very high	0 Å²	0	21 Å²	21	0%	0	12%	0.123	C	C	.	.	B	Isolated β-bridge	trans	-69.1	161.4	171.8	36	-41.9	0	0	0	111.7	T94 Y140 V235 I236 L246 A247	T94-P242 HydrophobicContact CG2-CG 3.71Å; Y140-P242 HydrophobicContact CD2-CB 4.11Å; Y140-P242 HydrophobicContact CD2-CG 3.4Å; Y140-P242 HydrophobicContact CE2-CG 3.78Å; Y140-P242 HydrophobicContact CG-CB 4.03Å; Y140-P242 HydrophobicContact CG-CG 3.82Å; V235-P242 CarbonylContact O-C 3.55Å; V235-P242 VanDerWaalsContact O-CA 3.26Å; V235-P242 WeakPolarHBondContact O-CA 3.39Å; I236-P242 HydrophobicContact CD1-CB 4.07Å; P242-L246 HydrophobicContact CB-CB 4.36Å; P242-L246 HydrophobicContact CB-CD2 4.27Å; P242-A247 HydrophobicContact CB-CB 4Å; P242-A247 HydrophobicContact CG-CB 3.73Å
243	T	97.2	Very high	97	Very high	27 Å²	27	24 Å²	24	17%	0.166	14%	0.137	C	C	.	.	P	Polyproline II helix	trans	-83.1	163.8	160.1	67.8	0	0	0	0	110.2	V234 V235 K237 H245 L246 A247	V234-T243 HydrophobicContact CB-CG2 4.08Å; V234-T243 HydrophobicContact CG1-CG2 3.89Å; V234-T243 WeakPolarHBondContact O-CB 3.15Å; V234-T243 WeakPolarHBondContact O-CG2 3.2Å; V234-T243 PolarHBondContact O-OG1 2.9Å; V235-T243 PolarHBondContact O-N 3.38Å; K237-T243 HydrophobicContact CG-CG2 4.12Å; T243-H245 PolarHBondContact O-N 2.79Å; T243-H245 VanDerWaalsContact O-N 3.11Å; T243-L246 PolarHBondContact O-N 3.4Å; T243-A247 PolarHBondContact O-N 2.65Å; T243-A247 VanDerWaalsContact O-N 3.1Å
244	Y	96.4	Very high	97.1	Very high	38 Å²	38	27.3 Å²	27.3	15%	0.149	15%	0.148	C	C	.	.	H	α-helix	trans	-44.5	-44.6	172.7	168.5	-98.2	0	0	0	112.5	E92 L246 N248 R262 W266 H273	E92-Y244 VanDerWaalsContact OE2-CD2 3.26Å; E92-Y244 WeakPolarHBondContact OE2-CD2 3.46Å; E92-Y244 WeakPolarHBondContact OE2-CE2 3.18Å; Y244-L246 PolarHBondContact O-N 2.73Å; Y244-N248 HydrophobicContact CD2-CB 4.35Å; Y244-N248 HydrophobicContact CE1-CB 4.5Å; Y244-N248 HydrophobicContact CE2-CB 4.07Å; Y244-N248 WeakPolarHBondContact O-CB 3.38Å; Y244-N248 PolarHBondContact O-N 3.34Å; Y244-R262 PolarHBondContact OH-NH1 3.25Å; Y244-R262 VanDerWaalsContact OH-NH1 3.16Å; Y244-W266 HydrophobicContact CD1-CE3 4.14Å; Y244-W266 AromaticContact CD1-CH2 3.7Å; Y244-W266 HydrophobicContact CD1-CH2 3.7Å; Y244-W266 AromaticContact CD1-CZ3 3.4Å; Y244-W266 HydrophobicContact CD1-CZ3 3.4Å; Y244-W266 VanDerWaalsContact CD1-CZ3 3.4Å; Y244-W266 HydrophobicContact CD2-CH2 4.23Å; Y244-W266 HydrophobicContact CE1-CD2 4.07Å; Y244-W266 AromaticContact CE1-CE3 3.37Å; Y244-W266 HydrophobicContact CE1-CE3 3.37Å; Y244-W266 AromaticContact CE1-CH2 3.58Å; Y244-W266 HydrophobicContact CE1-CH2 3.58Å; Y244-W266 HydrophobicContact CE1-CZ2 4.25Å; Y244-W266 AromaticContact CE1-CZ3 3.1Å; Y244-W266 HydrophobicContact CE1-CZ3 3.1Å; Y244-W266 HydrophobicContact CE2-CH2 4.11Å; Y244-W266 HydrophobicContact CE2-CZ2 4.22Å; Y244-W266 HydrophobicContact CE2-CZ3 4.43Å; Y244-W266 HydrophobicContact CG-CH2 4.03Å; Y244-W266 HydrophobicContact CG-CZ3 4.21Å; Y244-W266 AromaticContact CZ-CD2 3.97Å; Y244-W266 AromaticContact CZ-CE3 3.76Å; Y244-W266 AromaticContact CZ-CH2 3.79Å; Y244-W266 AromaticContact CZ-CZ3 3.68Å; Y244-H273 AromaticContact CE1-CE1 3.77Å; Y244-H273 AromaticContact CE1-NE2 3.88Å
245	H	97.2	Very high	97.1	Very high	32 Å²	32	25.7 Å²	25.7	15%	0.148	14%	0.138	C	C	.	.	H	α-helix	trans	-62.1	-43.6	-174.2	-63.7	-61	0	0	0	113.2	T243 K272 H273 M276	T243-H245 PolarHBondContact O-N 2.79Å; T243-H245 VanDerWaalsContact O-N 3.11Å; H245-K272 HydrophobicContact CB-CD 4.48Å; H245-K272 PolarHBondContact NE2-NZ 3.42Å; H245-H273 AromaticContact ND1-NE2 3.42Å; H245-H273 PolarHBondContact ND1-NE2 3.31Å; H245-M276 HydrophobicContact CB-CE 4.02Å; H245-M276 HydrophobicContact CB-SD 4.23Å
246	L	98.4	Very high	97.1	Very high	0 Å²	0	32.8 Å²	32.8	0%	0	17%	0.17	C	C	.	.	H	α-helix	trans	-75.1	-48.7	179.5	-177.3	68	0	0	0	111.2	T143 A144 L147 V235 I236 P242 T243 Y244 N248 I249 V250	T143-L246 HydrophobicContact CG2-CD1 4.29Å; A144-L246 HydrophobicContact CB-CD2 4.11Å; L147-L246 HydrophobicContact CD1-CD1 4.01Å; V235-L246 HydrophobicContact CB-CB 3.89Å; V235-L246 HydrophobicContact CB-CD2 4.07Å; V235-L246 HydrophobicContact CB-CG 4.37Å; V235-L246 HydrophobicContact CG1-CB 4.21Å; I236-L246 HydrophobicContact CD1-CD2 3.46Å; I236-L246 VanDerWaalsContact CD1-CD2 3.46Å; I236-L246 HydrophobicContact CG1-CD2 3.89Å; P242-L246 HydrophobicContact CB-CB 4.36Å; P242-L246 HydrophobicContact CB-CD2 4.27Å; T243-L246 PolarHBondContact O-N 3.4Å; Y244-L246 PolarHBondContact O-N 2.73Å; L246-N248 VanDerWaalsContact C-N 3.28Å; L246-N248 PolarHBondContact O-N 2.88Å; L246-I249 WeakPolarHBondContact O-CG1 3.35Å; L246-I249 PolarHBondContact O-N 3.5Å; L246-V250 HydrophobicContact CD1-CG2 3.96Å; L246-V250 HydrophobicContact CG-CG2 4.17Å; L246-V250 WeakPolarHBondContact O-CB 3.3Å; L246-V250 WeakPolarHBondContact O-CG2 3.39Å; L246-V250 PolarHBondContact O-N 3.19Å; L246-V250 VanDerWaalsContact O-N 3.08Å
247	A	98.3	Very high	97.1	Very high	0 Å²	0	32.9 Å²	32.9	0%	0	17%	0.17	C	C	.	.	H	α-helix	trans	-59.8	-42.7	-176.9	0	0	0	0	0	111.4	T94 Y140 P242 T243 V250 D251	T94-A247 HydrophobicContact CG2-CB 4.12Å; Y140-A247 HydrophobicContact CD1-CB 4.39Å; Y140-A247 HydrophobicContact CE1-CB 3.95Å; Y140-A247 HydrophobicContact CE2-CB 4.47Å; P242-A247 HydrophobicContact CB-CB 4Å; P242-A247 HydrophobicContact CG-CB 3.73Å; T243-A247 PolarHBondContact O-N 2.65Å; T243-A247 VanDerWaalsContact O-N 3.1Å; A247-V250 PolarHBondContact O-N 2.84Å; A247-D251 WeakPolarHBondContact O-CB 3.44Å; A247-D251 VanDerWaalsContact O-CG 3.29Å; A247-D251 PolarHBondContact O-N 2.95Å
248	N	98.1	Very high	97.1	Very high	1 Å²	1	31.7 Å²	31.7	1%	0.005	17%	0.168	C	C	.	.	H	α-helix	trans	-61.7	-48.6	-178.3	-169.5	-108.6	0	0	0	112.8	R90 E92 Y244 L246 D252 R262	R90-N248 PolarHBondContact NH2-ND2 2.51Å; E92-N248 PolarHBondContact OE1-ND2 2.75Å; Y244-N248 HydrophobicContact CD2-CB 4.35Å; Y244-N248 HydrophobicContact CE1-CB 4.5Å; Y244-N248 HydrophobicContact CE2-CB 4.07Å; Y244-N248 WeakPolarHBondContact O-CB 3.38Å; Y244-N248 PolarHBondContact O-N 3.34Å; L246-N248 VanDerWaalsContact C-N 3.28Å; L246-N248 PolarHBondContact O-N 2.88Å; N248-D252 VanDerWaalsContact O-CB 3.25Å; N248-D252 WeakPolarHBondContact O-CB 3.38Å; N248-D252 PolarHBondContact O-N 3.36Å; N248-R262 PolarHBondContact OD1-NH1 2.7Å
249	I	97.9	Very high	97.3	Very high	1 Å²	1	28.5 Å²	28.5	1%	0.005	14%	0.141	C	C	.	.	H	α-helix	trans	-71.8	-34.8	-179.7	67.4	174.8	0	0	0	112.6	L246 H253 H273 M276 Y277 L280	L246-I249 WeakPolarHBondContact O-CG1 3.35Å; L246-I249 PolarHBondContact O-N 3.5Å; I249-H253 WeakPolarHBondContact O-CB 3.41Å; I249-H253 PolarHBondContact O-N 3.2Å; I249-H273 HydrophobicContact CG2-CB 3.72Å; I249-M276 HydrophobicContact CD1-CB 3.2Å; I249-M276 HydrophobicContact CD1-CG 4.02Å; I249-M276 HydrophobicContact CD1-SD 3.75Å; I249-Y277 HydrophobicContact CB-CD2 4.43Å; I249-Y277 HydrophobicContact CB-CE2 3.84Å; I249-Y277 HydrophobicContact CG2-CD2 4.19Å; I249-Y277 HydrophobicContact CG2-CE2 3.66Å; I249-Y277 PolarHBondContact O-OH 3.37Å; I249-L280 HydrophobicContact CD1-CD1 4.16Å
250	V	98.6	Very high	97.6	Very high	0 Å²	0	24 Å²	24	0%	0	12%	0.117	C	C	.	.	H	α-helix	trans	-65.6	-50.3	179.4	170.3	0	0	0	0	108.3	L139 Y140 T143 L246 A247 H253 Y254 W282	L139-V250 HydrophobicContact CD2-CG1 3.67Å; L139-V250 HydrophobicContact CG-CG1 3.72Å; Y140-V250 HydrophobicContact CD1-CB 3.91Å; Y140-V250 HydrophobicContact CD1-CG1 3.73Å; Y140-V250 HydrophobicContact CD1-CG2 4.31Å; Y140-V250 HydrophobicContact CE1-CB 4.03Å; Y140-V250 HydrophobicContact CE1-CG1 3.87Å; T143-V250 HydrophobicContact CG2-CG2 3.78Å; L246-V250 HydrophobicContact CD1-CG2 3.96Å; L246-V250 HydrophobicContact CG-CG2 4.17Å; L246-V250 WeakPolarHBondContact O-CB 3.3Å; L246-V250 WeakPolarHBondContact O-CG2 3.39Å; L246-V250 PolarHBondContact O-N 3.19Å; L246-V250 VanDerWaalsContact O-N 3.08Å; A247-V250 PolarHBondContact O-N 2.84Å; V250-H253 WeakPolarHBondContact O-CB 3.49Å; V250-H253 PolarHBondContact O-N 3.36Å; V250-Y254 HydrophobicContact CG1-CD2 3.76Å; V250-Y254 HydrophobicContact CG1-CE2 3.97Å; V250-Y254 VanDerWaalsContact O-CD2 3.25Å; V250-Y254 WeakPolarHBondContact O-CD2 3.31Å; V250-Y254 PolarHBondContact O-N 3.22Å; V250-W282 HydrophobicContact CG2-CH2 4.13Å; V250-W282 HydrophobicContact CG2-CZ3 4.18Å
251	D	98.6	Very high	97.8	Very high	0 Å²	0	23 Å²	23	0%	0	11%	0.106	C	C	.	.	H	α-helix	trans	-70.1	-36.7	-179.2	-65.1	-27.5	0	0	0	112.5	R90 Q133 R136 Y140 A247 H253 Y254 M255	R90-D251 IonicContact NE-OD2 3.6Å; Q133-D251 WeakPolarHBondContact CG-OD2 3.49Å; Q133-D251 PolarHBondContact NE2-OD2 3.03Å; R136-D251 IonicContact CZ-OD1 3.18Å; R136-D251 IonicContact NE-OD1 2.7Å; R136-D251 PolarHBondContact NE-OD1 3.02Å; R136-D251 IonicContact NH2-OD1 3.03Å; R136-D251 PolarHBondContact NH2-OD1 3.34Å; Y140-D251 WeakPolarHBondContact CE1-OD1 3.39Å; Y140-D251 VanDerWaalsContact OH-CG 3.26Å; Y140-D251 PolarHBondContact OH-OD1 3.38Å; Y140-D251 PolarHBondContact OH-OD2 2.98Å; A247-D251 WeakPolarHBondContact O-CB 3.44Å; A247-D251 VanDerWaalsContact O-CG 3.29Å; A247-D251 PolarHBondContact O-N 2.95Å; D251-H253 VanDerWaalsContact C-N 3.26Å; D251-H253 PolarHBondContact O-N 3.2Å; D251-Y254 PolarHBondContact O-N 3.25Å; D251-M255 HydrophobicContact CB-CE 4.41Å; D251-M255 HydrophobicContact CB-SD 4.37Å; D251-M255 WeakPolarHBondContact O-CA 3.34Å; D251-M255 WeakPolarHBondContact O-CB 3.33Å; D251-M255 VanDerWaalsContact O-CG 3.22Å; D251-M255 WeakPolarHBondContact O-CG 2.91Å; D251-M255 PolarHBondContact O-N 2.99Å
252	D	98.6	Very high	97.8	Very high	1 Å²	1	21.8 Å²	21.8	1%	0.005	10%	0.1	C	C	.	.	H	α-helix	trans	-60.7	-38.1	174.3	-76.4	-2	0	0	0	111	R56 R90 N248 K256 I257 V260 Y277	R56-D252 IonicContact NE-OD1 2.8Å; R56-D252 PolarHBondContact NE-OD1 3.4Å; R56-D252 IonicContact NE-OD2 3.97Å; R56-D252 PolarHBondContact NE-OD2 2.89Å; R56-D252 IonicContact NH2-OD2 3.53Å; R90-D252 IonicContact CZ-OD1 3.87Å; R90-D252 VanDerWaalsContact CZ-OD1 3.25Å; R90-D252 IonicContact NH1-OD1 2.87Å; R90-D252 PolarHBondContact NH1-OD1 3.26Å; R90-D252 IonicContact NH2-OD1 2.76Å; R90-D252 PolarHBondContact NH2-OD1 3.01Å; N248-D252 VanDerWaalsContact O-CB 3.25Å; N248-D252 WeakPolarHBondContact O-CB 3.38Å; N248-D252 PolarHBondContact O-N 3.36Å; D252-K256 PolarHBondContact O-N 2.7Å; D252-I257 HydrophobicContact CB-CB 4.03Å; D252-I257 HydrophobicContact CB-CG1 4.08Å; D252-I257 WeakPolarHBondContact O-CB 3.42Å; D252-I257 PolarHBondContact O-N 2.69Å; D252-V260 WeakPolarHBondContact OD2-CG2 3.21Å; D252-Y277 WeakPolarHBondContact CB-OH 3.19Å
253	H	98.1	Very high	97.6	Very high	65 Å²	65	22.2 Å²	22.2	30%	0.301	11%	0.105	S	C	.	.	H	α-helix	trans	-66.6	-55.2	173.2	179.2	75.6	0	0	0	112.9	I249 V250 D251 M255 K256 Y277 W282	I249-H253 WeakPolarHBondContact O-CB 3.41Å; I249-H253 PolarHBondContact O-N 3.2Å; V250-H253 WeakPolarHBondContact O-CB 3.49Å; V250-H253 PolarHBondContact O-N 3.36Å; D251-H253 VanDerWaalsContact C-N 3.26Å; D251-H253 PolarHBondContact O-N 3.2Å; H253-M255 VanDerWaalsContact C-N 3.35Å; H253-M255 PolarHBondContact O-N 3.45Å; H253-K256 WeakPolarHBondContact O-CA 3.29Å; H253-K256 PolarHBondContact O-N 2.87Å; H253-Y277 HydrophobicContact CB-CE1 4.38Å; H253-W282 HydrophobicContact CB-CD2 4.22Å; H253-W282 HydrophobicContact CB-CE3 3.74Å; H253-W282 HydrophobicContact CB-CZ3 3.92Å; H253-W282 AromaticContact CD2-CD2 3.84Å; H253-W282 AromaticContact CD2-CE2 3.7Å; H253-W282 AromaticContact CD2-CZ2 3.91Å; H253-W282 AromaticContact CE1-CD1 3.63Å; H253-W282 AromaticContact CE1-CD2 3.94Å; H253-W282 AromaticContact CE1-CG 3.66Å; H253-W282 AromaticContact CE1-NE1 3.88Å; H253-W282 AromaticContact CG-CD2 3.67Å; H253-W282 AromaticContact CG-CE3 3.73Å; H253-W282 AromaticContact ND1-CD2 3.75Å; H253-W282 AromaticContact ND1-CG 3.64Å; H253-W282 AromaticContact NE2-CD1 3.9Å; H253-W282 AromaticContact NE2-CE2 3.75Å; H253-W282 AromaticContact NE2-NE1 3.66Å
254	Y	97.7	Very high	97.5	Very high	84 Å²	84	22.3 Å²	22.3	33%	0.329	11%	0.106	S	C	.	.	H	α-helix	trans	-71.2	-27.8	-174.8	-79.7	-83.4	0	0	0	113.5	L139 V250 D251 K256 W282	L139-Y254 HydrophobicContact CD1-CD1 4.43Å; L139-Y254 HydrophobicContact CD1-CD2 4.05Å; L139-Y254 HydrophobicContact CD1-CE1 4.01Å; L139-Y254 HydrophobicContact CD1-CE2 3.6Å; L139-Y254 HydrophobicContact CD1-CG 4.46Å; L139-Y254 HydrophobicContact CD2-CD2 3.76Å; L139-Y254 HydrophobicContact CD2-CE2 4.15Å; L139-Y254 HydrophobicContact CD2-CG 4.05Å; L139-Y254 HydrophobicContact CG-CD2 4.21Å; L139-Y254 HydrophobicContact CG-CE2 4.08Å; V250-Y254 HydrophobicContact CG1-CD2 3.76Å; V250-Y254 HydrophobicContact CG1-CE2 3.97Å; V250-Y254 VanDerWaalsContact O-CD2 3.25Å; V250-Y254 WeakPolarHBondContact O-CD2 3.31Å; V250-Y254 PolarHBondContact O-N 3.22Å; D251-Y254 PolarHBondContact O-N 3.25Å; Y254-K256 PolarHBondContact O-N 2.81Å; Y254-W282 HydrophobicContact CE2-CH2 4.11Å; Y254-W282 HydrophobicContact CE2-CZ2 4.24Å
255	M	97.9	Very high	97.3	Very high	0 Å²	0	25.7 Å²	25.7	0%	0	12%	0.124	C	C	.	.	T	Hydrogen-bonded Turn	trans	-83.1	2.4	171.4	-61.1	-179.8	175.2	0	0	112.7	R54 I88 R90 C128 Y131 D251 H253 I257	R54-M255 PolarHBondContact NE-O 2.64Å; R54-M255 PolarHBondContact NH2-O 3.17Å; I88-M255 HydrophobicContact CG2-SD 4.34Å; R90-M255 HydrophobicContact CB-CE 4.44Å; R90-M255 HydrophobicContact CB-SD 4.34Å; R90-M255 HydrophobicContact CG-CE 4.01Å; R90-M255 HydrophobicContact CG-SD 4.35Å; C128-M255 HydrophobicContact CB-CB 4.23Å; C128-M255 HydrophobicContact CB-CG 3.96Å; Y131-M255 HydrophobicContact CD1-CE 3.69Å; Y131-M255 HydrophobicContact CD1-SD 4.18Å; Y131-M255 HydrophobicContact CE1-CE 4.13Å; Y131-M255 HydrophobicContact CE1-SD 4.29Å; Y131-M255 HydrophobicContact CG-CE 4.44Å; D251-M255 HydrophobicContact CB-CE 4.41Å; D251-M255 HydrophobicContact CB-SD 4.37Å; D251-M255 WeakPolarHBondContact O-CA 3.34Å; D251-M255 WeakPolarHBondContact O-CB 3.33Å; D251-M255 VanDerWaalsContact O-CG 3.22Å; D251-M255 WeakPolarHBondContact O-CG 2.91Å; D251-M255 PolarHBondContact O-N 2.99Å; H253-M255 VanDerWaalsContact C-N 3.35Å; H253-M255 PolarHBondContact O-N 3.45Å; M255-I257 VanDerWaalsContact C-N 3.27Å; M255-I257 HydrophobicContact CB-CD1 4.14Å; M255-I257 HydrophobicContact CB-CG1 4.18Å; M255-I257 PolarHBondContact O-N 3.04Å
256	K	97.2	Very high	97.2	Very high	150 Å²	150	28 Å²	28	65%	0.652	13%	0.131	S	C	*	.	T	Hydrogen-bonded Turn	trans	55.3	41.8	178.4	-54	179	-178.3	178.5	0	112.2	R54 D252 H253 Y254 S258	R54-K256 WeakPolarHBondContact CB-O 3.42Å; R54-K256 WeakPolarHBondContact CD-O 3.48Å; D252-K256 PolarHBondContact O-N 2.7Å; H253-K256 WeakPolarHBondContact O-CA 3.29Å; H253-K256 PolarHBondContact O-N 2.87Å; Y254-K256 PolarHBondContact O-N 2.81Å; K256-S258 PolarHBondContact O-N 2.88Å
257	I	98.4	Very high	97	Very high	12 Å²	12	28.9 Å²	28.9	6%	0.062	14%	0.136	C	C	.	.			trans	-64.2	125.9	177.4	-59.9	-55.4	0	0	0	108.5	R56 I88 D252 M255 H259 V260 P285	R56-I257 HydrophobicContact CB-CD1 3.9Å; R56-I257 HydrophobicContact CG-CD1 4.34Å; I88-I257 HydrophobicContact CD1-CD1 3.5Å; D252-I257 HydrophobicContact CB-CB 4.03Å; D252-I257 HydrophobicContact CB-CG1 4.08Å; D252-I257 WeakPolarHBondContact O-CB 3.42Å; D252-I257 PolarHBondContact O-N 2.69Å; M255-I257 VanDerWaalsContact C-N 3.27Å; M255-I257 HydrophobicContact CB-CD1 4.14Å; M255-I257 HydrophobicContact CB-CG1 4.18Å; M255-I257 PolarHBondContact O-N 3.04Å; I257-H259 WeakPolarHBondContact CG2-O 3.47Å; I257-V260 HydrophobicContact CG2-CG2 3.8Å; I257-P285 HydrophobicContact CG2-CB 4.49Å; I257-P285 WeakPolarHBondContact O-CB 3.4Å
258	S	97.8	Very high	96.7	Very high	29 Å²	29	33.2 Å²	33.2	20%	0.203	16%	0.158	C	C	.	.			trans	-92.1	-37.8	179.1	65.7	0	0	0	0	111.8	R54 K256 P285 T286	R54-S258 PolarHBondContact N-OG 3.36Å; R54-S258 PolarHBondContact O-N 3.35Å; R54-S258 PolarHBondContact O-OG 3.03Å; K256-S258 PolarHBondContact O-N 2.88Å; S258-P285 WeakPolarHBondContact O-CA 3.4Å; S258-P285 WeakPolarHBondContact O-CB 3.48Å; S258-T286 PolarHBondContact O-N 2.72Å
259	H	98	Very high	96.5	Very high	5 Å²	5	34 Å²	34	2%	0.023	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.1	132	-176.6	-59.5	74.2	0	0	0	110.2	R54 V55 F79 I257 T286	R54-H259 PolarHBondContact O-N 2.93Å; V55-H259 HydrophobicContact CG1-CB 3.83Å; F79-H259 HydrophobicContact CE1-CB 3.91Å; F79-H259 AromaticContact CE1-CD2 3.91Å; F79-H259 AromaticContact CE1-CG 3.64Å; F79-H259 AromaticContact CE1-ND1 3.84Å; F79-H259 HydrophobicContact CZ-CB 4.38Å; F79-H259 AromaticContact CZ-CD2 3.6Å; F79-H259 AromaticContact CZ-CG 3.84Å; F79-H259 AromaticContact CZ-NE2 3.87Å; I257-H259 WeakPolarHBondContact CG2-O 3.47Å; H259-T286 CarbonylContact C-O 3.55Å; H259-T286 VanDerWaalsContact CA-O 3.29Å; H259-T286 WeakPolarHBondContact CA-O 3.36Å
260	V	98.3	Very high	96.4	Very high	0 Å²	0	34 Å²	34	0%	0	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	100.9	176.8	171.9	0	0	0	0	108.5	R56 D252 I257 R262 P285 T286 F287 G288	R56-V260 VanDerWaalsContact NH2-CG1 3.33Å; D252-V260 WeakPolarHBondContact OD2-CG2 3.21Å; I257-V260 HydrophobicContact CG2-CG2 3.8Å; V260-R262 HydrophobicContact CG1-CB 4.45Å; V260-R262 HydrophobicContact CG1-CG 3.96Å; V260-P285 HydrophobicContact CG2-CB 3.98Å; V260-P285 HydrophobicContact CG2-CG 3.53Å; V260-T286 PolarHBondContact N-O 2.78Å; V260-F287 HydrophobicContact CB-CD1 3.73Å; V260-F287 HydrophobicContact CB-CE1 3.97Å; V260-F287 HydrophobicContact CG1-CD1 3.84Å; V260-F287 HydrophobicContact CG1-CE1 4.05Å; V260-F287 HydrophobicContact CG2-CD1 4.37Å; V260-F287 HydrophobicContact CG2-CE1 4.13Å; V260-G288 PolarHBondContact O-N 2.9Å
261	L	97.2	Very high	96.2	Very high	4 Å²	4	34 Å²	34	2%	0.021	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.3	111.3	171.3	-53.7	179.8	0	0	0	109.4	N76 F79 L217 G288	N76-L261 PolarHBondContact ND2-O 2.96Å; F79-L261 HydrophobicContact CB-CD1 3.85Å; F79-L261 HydrophobicContact CD1-CD1 4.33Å; F79-L261 HydrophobicContact CD2-CD1 4.16Å; F79-L261 HydrophobicContact CG-CD1 3.86Å; L217-L261 HydrophobicContact CD1-CD2 4.29Å; L261-G288 VanDerWaalsContact CA-O 3.3Å; L261-G288 WeakPolarHBondContact CA-O 3.46Å
262	R	96.5	Very high	96	Very high	8 Å²	8	34.4 Å²	34.4	3%	0.03	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.1	165.8	-175.3	66.1	-179.3	177.5	-165.6	-3.7	112.1	Y244 N248 V260 W266 T270 H273 G288 H289 L290	Y244-R262 PolarHBondContact OH-NH1 3.25Å; Y244-R262 VanDerWaalsContact OH-NH1 3.16Å; N248-R262 PolarHBondContact OD1-NH1 2.7Å; V260-R262 HydrophobicContact CG1-CB 4.45Å; V260-R262 HydrophobicContact CG1-CG 3.96Å; R262-W266 HydrophobicContact CG-CB 4.17Å; R262-T270 PolarHBondContact NH2-OG1 3.39Å; R262-H273 PolarHBondContact NH1-CE1 3.42Å; R262-H273 PolarHBondContact NH1-ND1 3.48Å; R262-H273 PolarHBondContact NH2-ND1 3.26Å; R262-G288 PolarHBondContact N-O 3.04Å; R262-H289 PolarHBondContact NE-NE2 3.26Å; R262-H289 VanDerWaalsContact NE-NE2 3.19Å; R262-H289 CarbonylContact O-C 3.52Å; R262-H289 VanDerWaalsContact O-CA 3.26Å; R262-H289 WeakPolarHBondContact O-CA 3.29Å; R262-L290 PolarHBondContact O-N 3.38Å
263	G	93.9	Very high	95.9	Very high	10 Å²	10	34.4 Å²	34.4	10%	0.103	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-60.3	147.3	179.6	0	0	0	0	0	114.2	E265 W266 H289 L290	G263-E265 WeakPolarHBondContact CA-OE2 3.41Å; G263-E265 PolarHBondContact O-N 3.35Å; G263-E265 VanDerWaalsContact O-N 3.15Å; G263-W266 PolarHBondContact O-N 3.11Å; G263-W266 VanDerWaalsContact O-N 3.09Å; G263-H289 PolarHBondContact O-CD2 3.36Å; G263-L290 CarbonylContact C-O 3.52Å
264	S	93.8	Very high	95.8	Very high	28 Å²	28	32.8 Å²	32.8	20%	0.196	16%	0.159	C	C	.	.	G	3₁₀ helix	trans	-65.6	-12	-176.5	64.1	0	0	0	0	114.7	W266 L267 L290	S264-W266 PolarHBondContact O-N 3.29Å; S264-W266 VanDerWaalsContact O-N 3.16Å; S264-L267 VanDerWaalsContact O-CB 3.25Å; S264-L267 WeakPolarHBondContact O-CB 3.3Å; S264-L267 PolarHBondContact O-N 3.38Å; S264-L267 VanDerWaalsContact O-N 3.09Å; S264-L290 WeakPolarHBondContact CB-O 3.46Å; S264-L290 PolarHBondContact N-O 2.94Å
265	E	92.1	Very high	95.6	Very high	110 Å²	110	29.3 Å²	29.3	51%	0.514	15%	0.146	S	C	.	.	G	3₁₀ helix	trans	-59.3	-22.9	168.5	69.3	-86	-161.4	0	0	113	G263 L292	G263-E265 WeakPolarHBondContact CA-OE2 3.41Å; G263-E265 PolarHBondContact O-N 3.35Å; G263-E265 VanDerWaalsContact O-N 3.15Å; E265-L292 VanDerWaalsContact OE2-CD2 3.26Å; E265-L292 WeakPolarHBondContact OE2-CD2 3.13Å
266	W	95.2	Very high	95.6	Very high	81 Å²	81	29.3 Å²	29.3	31%	0.307	15%	0.146	S	C	.	.	G	3₁₀ helix	trans	-92.4	-1.4	178.5	-62.6	105.4	0	0	0	114.2	Y244 R262 G263 S264 I268 S269 T270	Y244-W266 HydrophobicContact CD1-CE3 4.14Å; Y244-W266 AromaticContact CD1-CH2 3.7Å; Y244-W266 HydrophobicContact CD1-CH2 3.7Å; Y244-W266 AromaticContact CD1-CZ3 3.4Å; Y244-W266 HydrophobicContact CD1-CZ3 3.4Å; Y244-W266 VanDerWaalsContact CD1-CZ3 3.4Å; Y244-W266 HydrophobicContact CD2-CH2 4.23Å; Y244-W266 HydrophobicContact CE1-CD2 4.07Å; Y244-W266 AromaticContact CE1-CE3 3.37Å; Y244-W266 HydrophobicContact CE1-CE3 3.37Å; Y244-W266 AromaticContact CE1-CH2 3.58Å; Y244-W266 HydrophobicContact CE1-CH2 3.58Å; Y244-W266 HydrophobicContact CE1-CZ2 4.25Å; Y244-W266 AromaticContact CE1-CZ3 3.1Å; Y244-W266 HydrophobicContact CE1-CZ3 3.1Å; Y244-W266 HydrophobicContact CE2-CH2 4.11Å; Y244-W266 HydrophobicContact CE2-CZ2 4.22Å; Y244-W266 HydrophobicContact CE2-CZ3 4.43Å; Y244-W266 HydrophobicContact CG-CH2 4.03Å; Y244-W266 HydrophobicContact CG-CZ3 4.21Å; Y244-W266 AromaticContact CZ-CD2 3.97Å; Y244-W266 AromaticContact CZ-CE3 3.76Å; Y244-W266 AromaticContact CZ-CH2 3.79Å; Y244-W266 AromaticContact CZ-CZ3 3.68Å; R262-W266 HydrophobicContact CG-CB 4.17Å; G263-W266 PolarHBondContact O-N 3.11Å; G263-W266 VanDerWaalsContact O-N 3.09Å; S264-W266 PolarHBondContact O-N 3.29Å; S264-W266 VanDerWaalsContact O-N 3.16Å; W266-I268 VanDerWaalsContact C-N 3.35Å; W266-I268 PolarHBondContact O-N 2.74Å; W266-S269 WeakPolarHBondContact O-CB 3.45Å; W266-S269 PolarHBondContact O-N 3.24Å; W266-T270 PolarHBondContact O-N 2.68Å; W266-T270 PolarHBondContact O-OG1 2.82Å
267	L	94.5	Very high	95.5	Very high	18 Å²	18	22.4 Å²	22.4	9%	0.094	12%	0.116	C	C	.	.	H	α-helix	trans	-56.9	-47.4	-174.5	-177.3	63.5	0	0	0	111.8	F214 F219 S264 S269 T270 H289	F214-L267 HydrophobicContact CE2-CD1 4.2Å; F214-L267 HydrophobicContact CZ-CD1 3.85Å; F219-L267 HydrophobicContact CB-CD2 4.36Å; F219-L267 HydrophobicContact CD1-CD2 4.28Å; F219-L267 HydrophobicContact CG-CD2 4.19Å; S264-L267 VanDerWaalsContact O-CB 3.25Å; S264-L267 WeakPolarHBondContact O-CB 3.3Å; S264-L267 PolarHBondContact O-N 3.38Å; S264-L267 VanDerWaalsContact O-N 3.09Å; L267-S269 VanDerWaalsContact C-N 3.3Å; L267-S269 PolarHBondContact O-N 3.15Å; L267-T270 WeakPolarHBondContact O-CB 3.42Å; L267-T270 PolarHBondContact O-N 3.26Å; L267-T270 VanDerWaalsContact O-N 3.1Å; L267-T270 PolarHBondContact O-OG1 3.38Å; L267-H289 HydrophobicContact CD1-CB 4.18Å; L267-H289 WeakPolarHBondContact CD1-ND1 3.49Å; L267-H289 PolarHBondContact N-CD2 2.69Å
268	I	92.4	Very high	95.4	Very high	90 Å²	90	27.5 Å²	27.5	46%	0.462	13%	0.134	S	C	.	.	H	α-helix	trans	-62.7	-37.5	178.3	-59.9	173.6	0	0	0	111.4	V226 W266 T270 S271	V226-I268 HydrophobicContact CG1-CG2 4.45Å; W266-I268 VanDerWaalsContact C-N 3.35Å; W266-I268 PolarHBondContact O-N 2.74Å; I268-T270 PolarHBondContact O-N 2.79Å; I268-S271 PolarHBondContact O-N 3.2Å
269	S	94.5	Very high	95.3	Very high	19 Å²	19	26.8 Å²	26.8	13%	0.133	13%	0.13	C	C	.	.	H	α-helix	trans	-65.7	-19.9	178.7	-68.9	0	0	0	0	112.8	W266 L267 S271 K272 H273	W266-S269 WeakPolarHBondContact O-CB 3.45Å; W266-S269 PolarHBondContact O-N 3.24Å; L267-S269 VanDerWaalsContact C-N 3.3Å; L267-S269 PolarHBondContact O-N 3.15Å; S269-S271 VanDerWaalsContact C-N 3.34Å; S269-S271 PolarHBondContact O-N 2.55Å; S269-K272 WeakPolarHBondContact O-CB 3.36Å; S269-K272 PolarHBondContact O-N 2.76Å; S269-K272 VanDerWaalsContact O-N 3.13Å; S269-H273 PolarHBondContact O-N 3Å; S269-H273 PolarHBondContact O-ND1 3.22Å
270	T	95.9	Very high	95.2	Very high	0 Å²	0	28 Å²	28	0%	0	14%	0.136	C	C	.	.	H	α-helix	trans	-62.6	-39.2	179.3	-53.8	0	0	0	0	111.9	F214 R262 W266 L267 I268 K272 H273 L274 F287 H289	F214-T270 HydrophobicContact CD1-CG2 4.5Å; F214-T270 HydrophobicContact CD2-CG2 4.15Å; F214-T270 HydrophobicContact CE1-CG2 4.11Å; F214-T270 HydrophobicContact CE2-CG2 3.73Å; F214-T270 HydrophobicContact CZ-CG2 3.71Å; R262-T270 PolarHBondContact NH2-OG1 3.39Å; W266-T270 PolarHBondContact O-N 2.68Å; W266-T270 PolarHBondContact O-OG1 2.82Å; L267-T270 WeakPolarHBondContact O-CB 3.42Å; L267-T270 PolarHBondContact O-N 3.26Å; L267-T270 VanDerWaalsContact O-N 3.1Å; L267-T270 PolarHBondContact O-OG1 3.38Å; I268-T270 PolarHBondContact O-N 2.79Å; T270-K272 VanDerWaalsContact C-N 3.26Å; T270-K272 PolarHBondContact O-N 3.49Å; T270-H273 PolarHBondContact O-N 3.47Å; T270-H273 VanDerWaalsContact O-N 3.13Å; T270-L274 HydrophobicContact CG2-CD1 4.26Å; T270-L274 HydrophobicContact CG2-CG 4.32Å; T270-L274 VanDerWaalsContact O-CG 3.3Å; T270-L274 WeakPolarHBondContact O-CG 3.33Å; T270-L274 PolarHBondContact O-N 2.95Å; T270-F287 HydrophobicContact CG2-CB 4.37Å; T270-F287 HydrophobicContact CG2-CD1 3.85Å; T270-F287 HydrophobicContact CG2-CD2 3.75Å; T270-F287 HydrophobicContact CG2-CE1 4.03Å; T270-F287 HydrophobicContact CG2-CE2 3.93Å; T270-F287 HydrophobicContact CG2-CG 3.72Å; T270-F287 HydrophobicContact CG2-CZ 4.07Å; T270-H289 PolarHBondContact OG1-CE1 3.42Å; T270-H289 PolarHBondContact OG1-NE2 3.48Å
271	S	94.2	Very high	95.1	Very high	0 Å²	0	31.2 Å²	31.2	0%	0	17%	0.17	C	C	.	.	H	α-helix	trans	-56.1	-41.8	173.4	-75.7	0	0	0	0	112.5	H224 I268 S269 L274 L275	H224-S271 WeakPolarHBondContact CB-OG 3.15Å; H224-S271 PolarHBondContact N-OG 2.89Å; H224-S271 WeakPolarHBondContact O-CB 3.21Å; H224-S271 PolarHBondContact O-OG 3.31Å; H224-S271 VanDerWaalsContact O-OG 3.09Å; I268-S271 PolarHBondContact O-N 3.2Å; S269-S271 VanDerWaalsContact C-N 3.34Å; S269-S271 PolarHBondContact O-N 2.55Å; S271-L274 PolarHBondContact O-N 3.4Å; S271-L275 PolarHBondContact O-N 2.58Å; S271-L275 VanDerWaalsContact O-N 3.16Å
272	K	93.5	Very high	95.1	Very high	9 Å²	9	33 Å²	33	4%	0.039	18%	0.177	C	C	.	.	H	α-helix	trans	-67.3	-43.1	176.8	178.9	-174	-62.9	170.8	0	111.3	L207 V226 E230 P233 H245 S269 T270 L274 L275 M276	L207-K272 HydrophobicContact CD2-CG 4.35Å; V226-K272 HydrophobicContact CG2-CB 4.48Å; E230-K272 IonicContact OE1-NZ 3.69Å; E230-K272 WeakPolarHBondContact OE2-CE 3.37Å; E230-K272 IonicContact OE2-NZ 3.81Å; E230-K272 PolarHBondContact OE2-NZ 3.12Å; P233-K272 HydrophobicContact CB-CD 4.45Å; P233-K272 HydrophobicContact CG-CD 3.97Å; H245-K272 HydrophobicContact CB-CD 4.48Å; H245-K272 PolarHBondContact NE2-NZ 3.42Å; S269-K272 WeakPolarHBondContact O-CB 3.36Å; S269-K272 PolarHBondContact O-N 2.76Å; S269-K272 VanDerWaalsContact O-N 3.13Å; T270-K272 VanDerWaalsContact C-N 3.26Å; T270-K272 PolarHBondContact O-N 3.49Å; K272-L274 VanDerWaalsContact C-N 3.34Å; K272-L274 PolarHBondContact O-N 3.35Å; K272-L275 PolarHBondContact O-N 2.91Å; K272-M276 HydrophobicContact CD-CE 4.19Å; K272-M276 HydrophobicContact CG-CE 3.85Å; K272-M276 HydrophobicContact CG-SD 4.5Å; K272-M276 WeakPolarHBondContact O-CG 3.47Å; K272-M276 PolarHBondContact O-N 3.27Å; K272-M276 VanDerWaalsContact O-N 3.15Å
273	H	96.2	Very high	95.1	Very high	1 Å²	1	38.4 Å²	38.4	1%	0.005	21%	0.21	C	C	.	.	H	α-helix	trans	-60.6	-43.7	175.7	-63.5	156.2	0	0	0	111.5	Y244 H245 I249 R262 S269 T270 L275 M276 Y277	Y244-H273 AromaticContact CE1-CE1 3.77Å; Y244-H273 AromaticContact CE1-NE2 3.88Å; H245-H273 AromaticContact ND1-NE2 3.42Å; H245-H273 PolarHBondContact ND1-NE2 3.31Å; I249-H273 HydrophobicContact CG2-CB 3.72Å; R262-H273 PolarHBondContact NH1-CE1 3.42Å; R262-H273 PolarHBondContact NH1-ND1 3.48Å; R262-H273 PolarHBondContact NH2-ND1 3.26Å; S269-H273 PolarHBondContact O-N 3Å; S269-H273 PolarHBondContact O-ND1 3.22Å; T270-H273 PolarHBondContact O-N 3.47Å; T270-H273 VanDerWaalsContact O-N 3.13Å; H273-L275 PolarHBondContact O-N 2.86Å; H273-M276 WeakPolarHBondContact O-CB 3.47Å; H273-M276 PolarHBondContact O-N 3.48Å; H273-M276 VanDerWaalsContact O-N 3.1Å; H273-Y277 WeakPolarHBondContact O-CD2 3.11Å; H273-Y277 PolarHBondContact O-N 3.49Å
274	L	95.7	Very high	95.1	Very high	31 Å²	31	39.3 Å²	39.3	16%	0.162	21%	0.214	C	C	.	.	H	α-helix	trans	-61.6	-40.2	177.7	-69.4	172.4	0	0	0	112.8	F214 T270 S271 K272 M276 Y277 R278 P284 F287	F214-L274 HydrophobicContact CB-CD1 3.62Å; F214-L274 HydrophobicContact CD1-CD1 3.65Å; F214-L274 HydrophobicContact CE1-CD1 4.49Å; F214-L274 HydrophobicContact CG-CD1 3.72Å; T270-L274 HydrophobicContact CG2-CD1 4.26Å; T270-L274 HydrophobicContact CG2-CG 4.32Å; T270-L274 VanDerWaalsContact O-CG 3.3Å; T270-L274 WeakPolarHBondContact O-CG 3.33Å; T270-L274 PolarHBondContact O-N 2.95Å; S271-L274 PolarHBondContact O-N 3.4Å; K272-L274 VanDerWaalsContact C-N 3.34Å; K272-L274 PolarHBondContact O-N 3.35Å; L274-M276 VanDerWaalsContact C-N 3.3Å; L274-M276 PolarHBondContact O-N 2.77Å; L274-Y277 PolarHBondContact O-N 3.38Å; L274-R278 WeakPolarHBondContact O-CB 3.37Å; L274-R278 PolarHBondContact O-N 3.42Å; L274-P284 HydrophobicContact CD2-CB 3.64Å; L274-P284 HydrophobicContact CD2-CG 3.73Å; L274-F287 HydrophobicContact CD2-CE2 3.99Å
275	L	95.3	Very high	95.3	Very high	11 Å²	11	38.6 Å²	38.6	6%	0.058	21%	0.209	C	C	.	.	H	α-helix	trans	-60.5	-41.2	172.7	-73.6	175.5	0	0	0	111.8	F205 L207 V211 V226 S271 K272 H273 R278 A279	F205-L275 HydrophobicContact CE1-CB 3.93Å; F205-L275 HydrophobicContact CZ-CB 4.06Å; L207-L275 HydrophobicContact CD2-CD1 3.96Å; V211-L275 HydrophobicContact CG2-CD1 3.71Å; V211-L275 HydrophobicContact CG2-CD2 3.92Å; V211-L275 HydrophobicContact CG2-CG 3.8Å; V226-L275 HydrophobicContact CG2-CD1 3.94Å; S271-L275 PolarHBondContact O-N 2.58Å; S271-L275 VanDerWaalsContact O-N 3.16Å; K272-L275 PolarHBondContact O-N 2.91Å; H273-L275 PolarHBondContact O-N 2.86Å; L275-R278 PolarHBondContact O-N 3.18Å; L275-A279 WeakPolarHBondContact O-CB 3.13Å; L275-A279 PolarHBondContact O-N 3.4Å
276	M	96.1	Very high	95.5	Very high	0 Å²	0	35.5 Å²	35.5	0%	0	20%	0.198	C	C	.	.	H	α-helix	trans	-70.1	-40.1	178.5	-63.8	171.5	173.6	0	0	112.2	F205 P233 V235 H245 I249 K272 H273 L274 R278 A279 L280	F205-M276 HydrophobicContact CB-CE 3.78Å; F205-M276 HydrophobicContact CD1-CE 3.68Å; F205-M276 HydrophobicContact CD1-CG 3.84Å; F205-M276 HydrophobicContact CD2-CE 4.45Å; F205-M276 HydrophobicContact CD2-CG 3.92Å; F205-M276 HydrophobicContact CE1-CE 4.39Å; F205-M276 HydrophobicContact CE1-CG 3.66Å; F205-M276 HydrophobicContact CE2-CB 4.28Å; F205-M276 HydrophobicContact CE2-CG 3.75Å; F205-M276 HydrophobicContact CG-CE 3.72Å; F205-M276 HydrophobicContact CG-CG 3.96Å; F205-M276 HydrophobicContact CZ-CB 4.22Å; F205-M276 HydrophobicContact CZ-CG 3.63Å; P233-M276 HydrophobicContact CG-CE 4.31Å; V235-M276 HydrophobicContact CG1-CE 3.7Å; H245-M276 HydrophobicContact CB-CE 4.02Å; H245-M276 HydrophobicContact CB-SD 4.23Å; I249-M276 HydrophobicContact CD1-CB 3.2Å; I249-M276 HydrophobicContact CD1-CG 4.02Å; I249-M276 HydrophobicContact CD1-SD 3.75Å; K272-M276 HydrophobicContact CD-CE 4.19Å; K272-M276 HydrophobicContact CG-CE 3.85Å; K272-M276 HydrophobicContact CG-SD 4.5Å; K272-M276 WeakPolarHBondContact O-CG 3.47Å; K272-M276 PolarHBondContact O-N 3.27Å; K272-M276 VanDerWaalsContact O-N 3.15Å; H273-M276 WeakPolarHBondContact O-CB 3.47Å; H273-M276 PolarHBondContact O-N 3.48Å; H273-M276 VanDerWaalsContact O-N 3.1Å; L274-M276 VanDerWaalsContact C-N 3.3Å; L274-M276 PolarHBondContact O-N 2.77Å; M276-R278 VanDerWaalsContact C-N 3.31Å; M276-R278 PolarHBondContact O-N 3.23Å; M276-A279 PolarHBondContact O-N 3.21Å; M276-L280 WeakPolarHBondContact O-CG 3.49Å; M276-L280 PolarHBondContact O-N 3.32Å; M276-L280 VanDerWaalsContact O-N 3.08Å
277	Y	96.8	Very high	95.6	Very high	4 Å²	4	32 Å²	32	2%	0.016	19%	0.185	C	C	.	.	H	α-helix	trans	-57	-45.9	171.1	-84.8	-75.9	0	0	0	111	I249 D252 H253 H273 L274 L280 G281 W282 P284 P285 F287	I249-Y277 HydrophobicContact CB-CD2 4.43Å; I249-Y277 HydrophobicContact CB-CE2 3.84Å; I249-Y277 HydrophobicContact CG2-CD2 4.19Å; I249-Y277 HydrophobicContact CG2-CE2 3.66Å; I249-Y277 PolarHBondContact O-OH 3.37Å; D252-Y277 WeakPolarHBondContact CB-OH 3.19Å; H253-Y277 HydrophobicContact CB-CE1 4.38Å; H273-Y277 WeakPolarHBondContact O-CD2 3.11Å; H273-Y277 PolarHBondContact O-N 3.49Å; L274-Y277 PolarHBondContact O-N 3.38Å; Y277-L280 PolarHBondContact O-N 2.88Å; Y277-G281 PolarHBondContact O-N 2.69Å; Y277-G281 VanDerWaalsContact O-N 3.11Å; Y277-W282 HydrophobicContact CD1-CB 3.66Å; Y277-W282 HydrophobicContact CD1-CE3 4.24Å; Y277-W282 HydrophobicContact CE1-CB 4.38Å; Y277-W282 HydrophobicContact CE1-CE3 4.32Å; Y277-W282 PolarHBondContact O-N 3.36Å; Y277-P284 HydrophobicContact CD1-CB 4.21Å; Y277-P284 HydrophobicContact CD2-CB 3.82Å; Y277-P284 HydrophobicContact CE2-CB 4.25Å; Y277-P284 HydrophobicContact CG-CB 3.84Å; Y277-P285 WeakPolarHBondContact OH-CD 3Å; Y277-F287 HydrophobicContact CE2-CZ 4.47Å
278	R	95.1	Very high	95.7	Very high	119 Å²	119	31.1 Å²	31.1	45%	0.449	18%	0.18	S	C	.	.	H	α-helix	trans	-60.9	-47.5	176.6	-175.3	-174.2	-68	168.2	-4	111.9	G210 E212 L274 L275 M276 L280 G281	G210-R278 PolarHBondContact O-NH1 2.92Å; E212-R278 IonicContact OE1-NH2 3.83Å; E212-R278 IonicContact OE2-CZ 2.69Å; E212-R278 IonicContact OE2-NH2 3.97Å; E212-R278 PolarHBondContact OE2-NH2 3.43Å; L274-R278 WeakPolarHBondContact O-CB 3.37Å; L274-R278 PolarHBondContact O-N 3.42Å; L275-R278 PolarHBondContact O-N 3.18Å; M276-R278 VanDerWaalsContact C-N 3.31Å; M276-R278 PolarHBondContact O-N 3.23Å; R278-L280 PolarHBondContact O-N 3.37Å; R278-G281 PolarHBondContact O-N 3.11Å
279	A	95.8	Very high	95.9	Very high	14 Å²	14	26.9 Å²	26.9	12%	0.116	16%	0.158	C	C	.	.	H	α-helix	trans	-59	-30.7	178.3	0	0	0	0	0	113.2	L147 H152 F205 L275 M276	L147-A279 HydrophobicContact CD2-CB 3.99Å; H152-A279 HydrophobicContact CB-CB 3.76Å; F205-A279 HydrophobicContact CE2-CB 3.76Å; F205-A279 HydrophobicContact CZ-CB 4.1Å; L275-A279 WeakPolarHBondContact O-CB 3.13Å; L275-A279 PolarHBondContact O-N 3.4Å; M276-A279 PolarHBondContact O-N 3.21Å
280	L	96.6	Very high	95.8	Very high	30 Å²	30	26.1 Å²	26.1	16%	0.157	15%	0.153	C	C	.	.	T	Hydrogen-bonded Turn	trans	-91.6	-2.8	178.7	-68	164.5	0	0	0	113.3	T143 L147 I249 M276 Y277 R278 W282	T143-L280 HydrophobicContact CG2-CD1 3.85Å; T143-L280 HydrophobicContact CG2-CD2 3.76Å; T143-L280 HydrophobicContact CG2-CG 4.5Å; L147-L280 HydrophobicContact CD2-CD1 4.35Å; L147-L280 HydrophobicContact CD2-CD2 3.68Å; L147-L280 HydrophobicContact CD2-CG 3.78Å; L147-L280 HydrophobicContact CG-CD2 3.92Å; L147-L280 HydrophobicContact CG-CG 4.42Å; I249-L280 HydrophobicContact CD1-CD1 4.16Å; M276-L280 WeakPolarHBondContact O-CG 3.49Å; M276-L280 PolarHBondContact O-N 3.32Å; M276-L280 VanDerWaalsContact O-N 3.08Å; Y277-L280 PolarHBondContact O-N 2.88Å; R278-L280 PolarHBondContact O-N 3.37Å; L280-W282 HydrophobicContact CB-CD2 3.62Å; L280-W282 HydrophobicContact CB-CE3 3.94Å; L280-W282 HydrophobicContact CB-CG 3.89Å; L280-W282 HydrophobicContact CB-CZ2 4.29Å; L280-W282 HydrophobicContact CB-CZ3 4.42Å; L280-W282 HydrophobicContact CD1-CD2 4.18Å; L280-W282 HydrophobicContact CD1-CE3 3.65Å; L280-W282 HydrophobicContact CD1-CH2 3.71Å; L280-W282 HydrophobicContact CD1-CZ2 4.2Å; L280-W282 HydrophobicContact CD1-CZ3 3.4Å; L280-W282 VanDerWaalsContact CD1-CZ3 3.4Å; L280-W282 HydrophobicContact CD2-CZ2 4.45Å; L280-W282 HydrophobicContact CG-CD2 4.47Å; L280-W282 HydrophobicContact CG-CE3 4.4Å; L280-W282 HydrophobicContact CG-CZ3 4.44Å; L280-W282 VanDerWaalsContact O-CD1 3.24Å; L280-W282 PolarHBondContact O-N 3.41Å; L280-W282 PolarHBondContact O-NE1 2.68Å
281	G	96.2	Very high	95.6	Very high	69 Å²	69	26.2 Å²	26.2	71%	0.711	15%	0.154	S	C	*	.	T	Hydrogen-bonded Turn	trans	66.1	25.6	-175.2	0	0	0	0	0	113.4	Y277 R278	Y277-G281 PolarHBondContact O-N 2.69Å; Y277-G281 VanDerWaalsContact O-N 3.11Å; R278-G281 PolarHBondContact O-N 3.11Å
282	W	96.8	Very high	95.4	Very high	42 Å²	42	28.9 Å²	28.9	16%	0.159	17%	0.168	C	C	.	.	P	Polyproline II helix	trans	-98.8	147	-176.7	-66.8	-11.9	0	0	0	112	T143 V250 H253 Y254 Y277 L280	T143-W282 HydrophobicContact CG2-CH2 3.79Å; T143-W282 HydrophobicContact CG2-CZ2 4.4Å; V250-W282 HydrophobicContact CG2-CH2 4.13Å; V250-W282 HydrophobicContact CG2-CZ3 4.18Å; H253-W282 HydrophobicContact CB-CD2 4.22Å; H253-W282 HydrophobicContact CB-CE3 3.74Å; H253-W282 HydrophobicContact CB-CZ3 3.92Å; H253-W282 AromaticContact CD2-CD2 3.84Å; H253-W282 AromaticContact CD2-CE2 3.7Å; H253-W282 AromaticContact CD2-CZ2 3.91Å; H253-W282 AromaticContact CE1-CD1 3.63Å; H253-W282 AromaticContact CE1-CD2 3.94Å; H253-W282 AromaticContact CE1-CG 3.66Å; H253-W282 AromaticContact CE1-NE1 3.88Å; H253-W282 AromaticContact CG-CD2 3.67Å; H253-W282 AromaticContact CG-CE3 3.73Å; H253-W282 AromaticContact ND1-CD2 3.75Å; H253-W282 AromaticContact ND1-CG 3.64Å; H253-W282 AromaticContact NE2-CD1 3.9Å; H253-W282 AromaticContact NE2-CE2 3.75Å; H253-W282 AromaticContact NE2-NE1 3.66Å; Y254-W282 HydrophobicContact CE2-CH2 4.11Å; Y254-W282 HydrophobicContact CE2-CZ2 4.24Å; Y277-W282 HydrophobicContact CD1-CB 3.66Å; Y277-W282 HydrophobicContact CD1-CE3 4.24Å; Y277-W282 HydrophobicContact CE1-CB 4.38Å; Y277-W282 HydrophobicContact CE1-CE3 4.32Å; Y277-W282 PolarHBondContact O-N 3.36Å; L280-W282 HydrophobicContact CB-CD2 3.62Å; L280-W282 HydrophobicContact CB-CE3 3.94Å; L280-W282 HydrophobicContact CB-CG 3.89Å; L280-W282 HydrophobicContact CB-CZ2 4.29Å; L280-W282 HydrophobicContact CB-CZ3 4.42Å; L280-W282 HydrophobicContact CD1-CD2 4.18Å; L280-W282 HydrophobicContact CD1-CE3 3.65Å; L280-W282 HydrophobicContact CD1-CH2 3.71Å; L280-W282 HydrophobicContact CD1-CZ2 4.2Å; L280-W282 HydrophobicContact CD1-CZ3 3.4Å; L280-W282 VanDerWaalsContact CD1-CZ3 3.4Å; L280-W282 HydrophobicContact CD2-CZ2 4.45Å; L280-W282 HydrophobicContact CG-CD2 4.47Å; L280-W282 HydrophobicContact CG-CE3 4.4Å; L280-W282 HydrophobicContact CG-CZ3 4.44Å; L280-W282 VanDerWaalsContact O-CD1 3.24Å; L280-W282 PolarHBondContact O-N 3.41Å; L280-W282 PolarHBondContact O-NE1 2.68Å
283	T	95.6	Very high	95	Very high	120 Å²	120	29.2 Å²	29.2	74%	0.736	17%	0.17	S	C	*	.	P	Polyproline II helix	trans	-78.9	122.6	171.3	-51	0	0	0	0	109.8
284	P	95.6	Very high	94.6	Very high	29 Å²	29	31.2 Å²	31.2	19%	0.188	18%	0.18	C	C	.	.	P	Polyproline II helix	trans	-74.5	153	177.5	30.9	-35.1	0	0	0	111.8	L274 Y277 F287	L274-P284 HydrophobicContact CD2-CB 3.64Å; L274-P284 HydrophobicContact CD2-CG 3.73Å; Y277-P284 HydrophobicContact CD1-CB 4.21Å; Y277-P284 HydrophobicContact CD2-CB 3.82Å; Y277-P284 HydrophobicContact CE2-CB 4.25Å; Y277-P284 HydrophobicContact CG-CB 3.84Å; P284-F287 HydrophobicContact CB-CE2 4.23Å
285	P	96.9	Very high	94	Very high	14 Å²	14	31.1 Å²	31.1	9%	0.091	18%	0.179	C	C	.	.	P	Polyproline II helix	trans	-67.6	168.2	170.4	29.5	-34.6	0	0	0	111.7	I257 S258 V260 Y277 F287	I257-P285 HydrophobicContact CG2-CB 4.49Å; I257-P285 WeakPolarHBondContact O-CB 3.4Å; S258-P285 WeakPolarHBondContact O-CA 3.4Å; S258-P285 WeakPolarHBondContact O-CB 3.48Å; V260-P285 HydrophobicContact CG2-CB 3.98Å; V260-P285 HydrophobicContact CG2-CG 3.53Å; Y277-P285 WeakPolarHBondContact OH-CD 3Å; P285-F287 HydrophobicContact CG-CE1 4.21Å; P285-F287 HydrophobicContact CG-CE2 4.09Å; P285-F287 HydrophobicContact CG-CZ 3.76Å; P285-F287 WeakPolarHBondContact O-CD2 3.23Å; P285-F287 WeakPolarHBondContact O-CE2 3.38Å
286	T	96.4	Very high	93.4	Very high	44 Å²	44	34.2 Å²	34.2	27%	0.27	20%	0.202	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.7	135.2	166	-59	0	0	0	0	109.6	L217 S258 H259 V260	L217-T286 HydrophobicContact CD1-CG2 3.67Å; L217-T286 HydrophobicContact CD2-CG2 3.75Å; L217-T286 HydrophobicContact CG-CG2 3.6Å; S258-T286 PolarHBondContact O-N 2.72Å; H259-T286 CarbonylContact C-O 3.55Å; H259-T286 VanDerWaalsContact CA-O 3.29Å; H259-T286 WeakPolarHBondContact CA-O 3.36Å; V260-T286 PolarHBondContact N-O 2.78Å
287	F	97	Very high	92.7	Very high	8 Å²	8	40 Å²	40	4%	0.035	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	139.3	-179.4	-65.8	-88.8	0	0	0	111.5	D216 L217 V260 T270 L274 Y277 P284 P285	D216-F287 WeakPolarHBondContact CA-O 3.17Å; L217-F287 WeakPolarHBondContact CG-O 3.39Å; L217-F287 PolarHBondContact N-O 3.19Å; V260-F287 HydrophobicContact CB-CD1 3.73Å; V260-F287 HydrophobicContact CB-CE1 3.97Å; V260-F287 HydrophobicContact CG1-CD1 3.84Å; V260-F287 HydrophobicContact CG1-CE1 4.05Å; V260-F287 HydrophobicContact CG2-CD1 4.37Å; V260-F287 HydrophobicContact CG2-CE1 4.13Å; T270-F287 HydrophobicContact CG2-CB 4.37Å; T270-F287 HydrophobicContact CG2-CD1 3.85Å; T270-F287 HydrophobicContact CG2-CD2 3.75Å; T270-F287 HydrophobicContact CG2-CE1 4.03Å; T270-F287 HydrophobicContact CG2-CE2 3.93Å; T270-F287 HydrophobicContact CG2-CG 3.72Å; T270-F287 HydrophobicContact CG2-CZ 4.07Å; L274-F287 HydrophobicContact CD2-CE2 3.99Å; Y277-F287 HydrophobicContact CE2-CZ 4.47Å; P284-F287 HydrophobicContact CB-CE2 4.23Å; P285-F287 HydrophobicContact CG-CE1 4.21Å; P285-F287 HydrophobicContact CG-CE2 4.09Å; P285-F287 HydrophobicContact CG-CZ 3.76Å; P285-F287 WeakPolarHBondContact O-CD2 3.23Å; P285-F287 WeakPolarHBondContact O-CE2 3.38Å
288	G	96.6	Very high	92	Very high	0 Å²	0	41.5 Å²	41.5	0%	0	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.3	118.2	168.7	0	0	0	0	0	110.3	D216 V260 L261 R262	D216-G288 WeakPolarHBondContact OD2-CA 3.35Å; V260-G288 PolarHBondContact O-N 2.9Å; L261-G288 VanDerWaalsContact CA-O 3.3Å; L261-G288 WeakPolarHBondContact CA-O 3.46Å; R262-G288 PolarHBondContact N-O 3.04Å
289	H	96.2	Very high	91.3	Very high	0 Å²	0	38 Å²	38	0%	0	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97	121.6	-177.3	-71.4	80.7	0	0	0	111.9	D216 I218 F219 R262 G263 L267 T270	D216-H289 PolarHBondContact OD1-N 3.43Å; D216-H289 VanDerWaalsContact OD1-N 3.14Å; D216-H289 IonicContact OD2-CE1 3.26Å; D216-H289 IonicContact OD2-CG 2.88Å; D216-H289 PolarHBondContact OD2-N 3.35Å; D216-H289 VanDerWaalsContact OD2-N 3.11Å; D216-H289 IonicContact OD2-ND1 2.79Å; D216-H289 PolarHBondContact OD2-ND1 3.49Å; I218-H289 WeakPolarHBondContact CB-O 3.17Å; I218-H289 WeakPolarHBondContact CD1-O 3.39Å; I218-H289 WeakPolarHBondContact CG2-O 3.22Å; F219-H289 HydrophobicContact CD2-CB 3.88Å; F219-H289 WeakPolarHBondContact CD2-O 3.48Å; F219-H289 HydrophobicContact CE2-CB 4.14Å; F219-H289 WeakPolarHBondContact CE2-O 3.49Å; R262-H289 PolarHBondContact NE-NE2 3.26Å; R262-H289 VanDerWaalsContact NE-NE2 3.19Å; R262-H289 CarbonylContact O-C 3.52Å; R262-H289 VanDerWaalsContact O-CA 3.26Å; R262-H289 WeakPolarHBondContact O-CA 3.29Å; G263-H289 PolarHBondContact O-CD2 3.36Å; L267-H289 HydrophobicContact CD1-CB 4.18Å; L267-H289 WeakPolarHBondContact CD1-ND1 3.49Å; L267-H289 PolarHBondContact N-CD2 2.69Å; T270-H289 PolarHBondContact OG1-CE1 3.42Å; T270-H289 PolarHBondContact OG1-NE2 3.48Å
290	L	94	Very high	90.4	Very high	3 Å²	3	44.7 Å²	44.7	2%	0.016	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.5	132.9	179.6	-56.7	177.2	0	0	0	109.8	T72 Y75 I218 R262 G263 S264 I355	T72-L290 HydrophobicContact CG2-CD1 4.18Å; Y75-L290 HydrophobicContact CD1-CD1 4.42Å; Y75-L290 HydrophobicContact CD1-CD2 3.52Å; Y75-L290 HydrophobicContact CE1-CD2 4.09Å; Y75-L290 HydrophobicContact CG-CD1 4.28Å; Y75-L290 HydrophobicContact CG-CD2 4.19Å; I218-L290 HydrophobicContact CD1-CD2 3.78Å; R262-L290 PolarHBondContact O-N 3.38Å; G263-L290 CarbonylContact C-O 3.52Å; S264-L290 WeakPolarHBondContact CB-O 3.46Å; S264-L290 PolarHBondContact N-O 2.94Å; L290-I355 HydrophobicContact CD2-CD1 4.17Å
291	P	91.6	Very high	89.4	Confident	3 Å²	3	44.2 Å²	44.2	2%	0.019	27%	0.267	C	S	.	.	P	Polyproline II helix	trans	-63.2	151.3	177.4	30.1	-38.5	0	0	0	111	R71 I355 T356 H358	R71-P291 PolarHBondContact NH1-O 3.44Å; P291-I355 HydrophobicContact CG-CG2 4.39Å; P291-T356 VanDerWaalsContact CG-O 3.29Å; P291-T356 WeakPolarHBondContact CG-O 3.3Å; P291-H358 WeakPolarHBondContact CB-O 3.32Å
292	L	88.4	Confident	87.7	Confident	56 Å²	56	42.8 Å²	42.8	29%	0.293	25%	0.247	S	C	.	.	P	Polyproline II helix	trans	-61.8	140.2	179.4	-66.5	176.5	0	0	0	111.6	E265 M294 S359 A360	E265-L292 VanDerWaalsContact OE2-CD2 3.26Å; E265-L292 WeakPolarHBondContact OE2-CD2 3.13Å; L292-M294 HydrophobicContact CD1-CE 4.48Å; L292-S359 CarbonylContact O-C 3.35Å; L292-S359 WeakPolarHBondContact O-CA 3.49Å; L292-A360 PolarHBondContact O-N 3.13Å
293	L	87	Confident	85.8	Confident	16 Å²	16	47 Å²	47	8%	0.084	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.2	127	168.2	-160	68.6	0	0	0	108.7	L67 L301 C330 A360 L362	L67-L293 HydrophobicContact CG-CD2 4.38Å; L293-L301 HydrophobicContact CD2-CD1 4.33Å; L293-L301 HydrophobicContact CG-CD1 4.37Å; L293-C330 HydrophobicContact CD1-CB 4.28Å; L293-A360 WeakPolarHBondContact CA-O 3.45Å; L293-A360 HydrophobicContact CD1-CB 3.91Å; L293-L362 HydrophobicContact CD1-CB 4.02Å; L293-L362 HydrophobicContact CD2-CD2 4.08Å; L293-L362 HydrophobicContact CG-CB 4.13Å
294	M	87.1	Confident	83.7	Confident	43 Å²	43	52.7 Å²	52.7	21%	0.212	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	156.7	-179.3	-71	-177.4	172.3	0	0	109.8	L292 S299 S359 A360 L361 L362	L292-M294 HydrophobicContact CD1-CE 4.48Å; M294-S299 WeakPolarHBondContact CA-O 3.38Å; M294-S359 WeakPolarHBondContact CE-OG 3.37Å; M294-S359 WeakPolarHBondContact SD-CB 3.49Å; M294-S359 PolarHBondContact SD-OG 2.9Å; M294-S359 VanDerWaalsContact SD-OG 3.36Å; M294-A360 PolarHBondContact N-O 2.9Å; M294-L361 HydrophobicContact CB-CD2 4.04Å; M294-L362 WeakPolarHBondContact O-CB 3.34Å; M294-L362 PolarHBondContact O-N 3.39Å
295	N	83.9	Confident	81.5	Confident	28 Å²	28	55.9 Å²	55.9	15%	0.15	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.6	164.7	169.4	-69.7	-29.2	0	0	0	110.3	D297 G298 S299 L301 L361	N295-D297 WeakPolarHBondContact CB-OD1 3.19Å; N295-D297 PolarHBondContact O-N 3.36Å; N295-G298 PolarHBondContact O-N 3.49Å; N295-S299 PolarHBondContact N-O 2.53Å; N295-S299 PolarHBondContact ND2-OG 2.59Å; N295-L301 WeakPolarHBondContact OD1-CD1 3.32Å; N295-L361 WeakPolarHBondContact O-CD2 3.46Å
296	S	82	Confident	79.5	Confident	77 Å²	77	56.7 Å²	56.7	54%	0.538	30%	0.297	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.8	-27.1	177	52.9	0	0	0	0	113.4	G298 L362	S296-G298 VanDerWaalsContact C-N 3.29Å; S296-G298 PolarHBondContact O-N 3.5Å; S296-L362 PolarHBondContact N-O 3.2Å
297	D	81.8	Confident	77.8	Confident	121 Å²	121	59.2 Å²	59.2	65%	0.647	31%	0.309	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.7	-0.6	175	71	-6.3	0	0	0	114.2	N295 S299	N295-D297 WeakPolarHBondContact CB-OD1 3.19Å; N295-D297 PolarHBondContact O-N 3.36Å; D297-S299 VanDerWaalsContact C-N 3.27Å; D297-S299 VanDerWaalsContact CG-OG 3.29Å; D297-S299 PolarHBondContact O-N 3.09Å; D297-S299 VanDerWaalsContact OD1-CB 3.22Å; D297-S299 WeakPolarHBondContact OD1-CB 3.4Å; D297-S299 PolarHBondContact OD1-N 3.15Å; D297-S299 PolarHBondContact OD1-OG 2.82Å; D297-S299 PolarHBondContact OD2-OG 3.1Å
298	G	80.8	Confident	76.9	Confident	36 Å²	36	59.1 Å²	59.1	37%	0.371	31%	0.309	S	S	.	.	S	Bend	trans	81.2	-1.9	-177.8	0	0	0	0	0	114.8	N295 S296	N295-G298 PolarHBondContact O-N 3.49Å; S296-G298 VanDerWaalsContact C-N 3.29Å; S296-G298 PolarHBondContact O-N 3.5Å
299	S	80.8	Confident	76.6	Confident	46 Å²	46	61.3 Å²	61.3	32%	0.322	32%	0.318	S	S	.	.			trans	-70	154.8	172.2	70.5	0	0	0	0	111	M294 N295 D297 L301	M294-S299 WeakPolarHBondContact CA-O 3.38Å; N295-S299 PolarHBondContact N-O 2.53Å; N295-S299 PolarHBondContact ND2-OG 2.59Å; D297-S299 VanDerWaalsContact C-N 3.27Å; D297-S299 VanDerWaalsContact CG-OG 3.29Å; D297-S299 PolarHBondContact O-N 3.09Å; D297-S299 VanDerWaalsContact OD1-CB 3.22Å; D297-S299 WeakPolarHBondContact OD1-CB 3.4Å; D297-S299 PolarHBondContact OD1-N 3.15Å; D297-S299 PolarHBondContact OD1-OG 2.82Å; D297-S299 PolarHBondContact OD2-OG 3.1Å; S299-L301 PolarHBondContact O-N 3.15Å
300	K	77.1	Confident	76.5	Confident	154 Å²	154	61.3 Å²	61.3	67%	0.67	32%	0.318	S	S	*	.	B	Isolated β-bridge	trans	-66.4	131.6	176.2	-172.2	173.9	-175.8	171.8	0	109	S302	K300-S302 PolarHBondContact O-N 3.32Å
301	L	74.8	Confident	76.4	Confident	19 Å²	19	64.4 Å²	64.4	10%	0.099	33%	0.333	C	S	.	.			trans	-53.4	106.7	175.4	-148.7	110.1	0	0	0	109	L67 L293 N295 S299 I308 L362	L67-L301 HydrophobicContact CB-CD2 4.32Å; L293-L301 HydrophobicContact CD2-CD1 4.33Å; L293-L301 HydrophobicContact CG-CD1 4.37Å; N295-L301 WeakPolarHBondContact OD1-CD1 3.32Å; S299-L301 PolarHBondContact O-N 3.15Å; L301-I308 HydrophobicContact CD2-CB 3.98Å; L301-I308 HydrophobicContact CD2-CD1 3.77Å; L301-I308 HydrophobicContact CD2-CG2 3.79Å; L301-I308 HydrophobicContact CG-CG2 4.19Å; L301-L362 HydrophobicContact CD1-CB 4.48Å; L301-L362 HydrophobicContact CD1-CD2 3.87Å
302	S	61.4	Low	76.4	Confident	40 Å²	40	65.5 Å²	65.5	28%	0.28	34%	0.338	S	S	.	.			trans	-87.8	127.4	-163	93.2	0	0	0	0	110.7	K300 R304 Q305 I308	K300-S302 PolarHBondContact O-N 3.32Å; S302-R304 PolarHBondContact O-N 3Å; S302-R304 VanDerWaalsContact O-N 3.1Å; S302-Q305 PolarHBondContact O-N 3.43Å; S302-Q305 PolarHBondContact OG-OE1 3.46Å; S302-I308 WeakPolarHBondContact O-CD1 3.46Å
303	K	57.3	Low	76.7	Confident	129 Å²	129	63.3 Å²	63.3	56%	0.561	33%	0.326	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.5	-1.6	175.3	-62.8	-177.1	177.9	-175.4	0	114.2	I308	K303-I308 HydrophobicContact CG-CD1 4.31Å
304	R	50.7	Low	76.9	Confident	241 Å²	241	64.6 Å²	64.6	91%	0.909	34%	0.336	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.2	-18.2	-177.1	-68.2	-174.7	177.7	-177.2	-1.2	112.8	S302	S302-R304 PolarHBondContact O-N 3Å; S302-R304 VanDerWaalsContact O-N 3.1Å
305	Q	49.5	Very low	77.1	Confident	96 Å²	96	68.9 Å²	68.9	45%	0.449	35%	0.35	S	S	.	.	S	Bend	trans	-84.3	109.3	165	-70.6	160.6	-27.4	0	0	105.6	S302 D307 I308	S302-Q305 PolarHBondContact O-N 3.43Å; S302-Q305 PolarHBondContact OG-OE1 3.46Å; Q305-D307 PolarHBondContact O-N 3.39Å; Q305-I308 PolarHBondContact O-N 2.91Å
306	G	54.8	Low	77.4	Confident	30 Å²	30	72.8 Å²	72.8	31%	0.309	37%	0.368	S	S	.	.	G	3₁₀ helix	trans	-54	-19.6	178	0	0	0	0	0	112.8	I308 F309 N312	G306-I308 PolarHBondContact O-N 3.23Å; G306-F309 WeakPolarHBondContact O-CD2 3.34Å; G306-F309 PolarHBondContact O-N 3.32Å; G306-N312 VanDerWaalsContact C-ND2 3.28Å; G306-N312 PolarHBondContact O-ND2 3.01Å
307	D	61	Low	77.9	Confident	98 Å²	98	70.2 Å²	70.2	52%	0.524	35%	0.353	S	S	.	.	G	3₁₀ helix	trans	-65.5	-5.8	-175.4	-46.9	-29.3	0	0	0	115.1	Q305 F313	Q305-D307 PolarHBondContact O-N 3.39Å; D307-F313 WeakPolarHBondContact O-CE2 3.45Å; D307-F313 WeakPolarHBondContact O-CZ 3.18Å
308	I	78.2	Confident	78.6	Confident	5 Å²	5	65.1 Å²	65.1	3%	0.026	33%	0.326	C	S	.	.	G	3₁₀ helix	trans	-98.5	-2.8	177.1	69.1	158.4	0	0	0	114.4	H66 L67 L301 S302 K303 Q305 G306	H66-I308 WeakPolarHBondContact CA-O 3.36Å; H66-I308 HydrophobicContact CB-CD1 4.04Å; H66-I308 HydrophobicContact CB-CG1 4.31Å; L67-I308 PolarHBondContact N-O 3.19Å; L301-I308 HydrophobicContact CD2-CB 3.98Å; L301-I308 HydrophobicContact CD2-CD1 3.77Å; L301-I308 HydrophobicContact CD2-CG2 3.79Å; L301-I308 HydrophobicContact CG-CG2 4.19Å; S302-I308 WeakPolarHBondContact O-CD1 3.46Å; K303-I308 HydrophobicContact CG-CD1 4.31Å; Q305-I308 PolarHBondContact O-N 2.91Å; G306-I308 PolarHBondContact O-N 3.23Å
309	F	89.8	Confident	79.3	Confident	47 Å²	47	64.3 Å²	64.3	21%	0.206	31%	0.313	C	S	.	.	B	Isolated β-bridge	trans	-77	138.6	176.2	-64.3	-56.6	0	0	0	110.9	F64 L65 H66 G306 E311 N312 F313	F64-F309 HydrophobicContact CB-CD1 3.92Å; F64-F309 HydrophobicContact CB-CE1 4.24Å; F64-F309 HydrophobicContact CB-CG 4.41Å; L65-F309 WeakPolarHBondContact O-CA 3.35Å; H66-F309 HydrophobicContact CB-CD1 4.09Å; H66-F309 HydrophobicContact CB-CE1 4.37Å; G306-F309 WeakPolarHBondContact O-CD2 3.34Å; G306-F309 PolarHBondContact O-N 3.32Å; F309-E311 PolarHBondContact O-N 3.32Å; F309-N312 WeakPolarHBondContact O-CB 3.42Å; F309-N312 PolarHBondContact O-N 2.86Å; F309-F313 WeakPolarHBondContact O-CD2 3.48Å
310	I	93.7	Very high	80.1	Confident	0 Å²	0	62.8 Å²	62.8	0%	0	30%	0.302	C	S	.	.	H	α-helix	trans	-61.1	-35.3	-176	-58.9	-48.2	0	0	0	111.9	L65 L67 L70 M110 W113 N312 F313 C314 L323	L65-I310 HydrophobicContact CB-CG1 4.32Å; L65-I310 HydrophobicContact CD2-CG1 4.05Å; L65-I310 HydrophobicContact CG-CG1 3.88Å; L65-I310 PolarHBondContact O-N 2.98Å; L67-I310 HydrophobicContact CB-CD1 4.43Å; L67-I310 HydrophobicContact CD1-CD1 3.85Å; L70-I310 HydrophobicContact CB-CD1 3.92Å; L70-I310 HydrophobicContact CB-CG1 4.15Å; L70-I310 HydrophobicContact CD2-CD1 3.49Å; L70-I310 VanDerWaalsContact CD2-CD1 3.49Å; L70-I310 HydrophobicContact CD2-CG1 4.06Å; L70-I310 HydrophobicContact CG-CD1 4.31Å; M110-I310 HydrophobicContact CB-CB 4.42Å; M110-I310 HydrophobicContact CB-CG2 4.24Å; M110-I310 HydrophobicContact CG-CB 4.41Å; M110-I310 HydrophobicContact CG-CG2 4.44Å; M110-I310 HydrophobicContact SD-CB 4.43Å; M110-I310 HydrophobicContact SD-CG2 4.1Å; W113-I310 HydrophobicContact CE3-CG2 3.78Å; W113-I310 HydrophobicContact CH2-CG2 4.49Å; W113-I310 HydrophobicContact CZ3-CG2 3.48Å; W113-I310 VanDerWaalsContact CZ3-CG2 3.48Å; I310-N312 VanDerWaalsContact C-N 3.27Å; I310-N312 PolarHBondContact O-N 3.06Å; I310-F313 HydrophobicContact CD1-CD2 4.46Å; I310-F313 PolarHBondContact O-N 3.25Å; I310-C314 PolarHBondContact O-N 2.88Å; I310-L323 HydrophobicContact CG2-CD1 4.45Å
311	E	92.8	Very high	81	Confident	68 Å²	68	57.1 Å²	57.1	32%	0.318	28%	0.278	S	S	.	.	H	α-helix	trans	-61.7	-33.5	177.5	-157.9	-156.7	120.1	0	0	112.9	M110 F309 C314 R315	M110-E311 HydrophobicContact SD-CB 4.1Å; M110-E311 HydrophobicContact SD-CG 4.35Å; F309-E311 PolarHBondContact O-N 3.32Å; E311-C314 WeakPolarHBondContact O-CB 3.37Å; E311-C314 PolarHBondContact O-N 3.34Å; E311-R315 WeakPolarHBondContact O-CB 3.5Å; E311-R315 WeakPolarHBondContact O-CG 3.37Å; E311-R315 PolarHBondContact O-N 3.18Å; E311-R315 IonicContact OE1-CZ 2.67Å; E311-R315 IonicContact OE1-NE 2.7Å; E311-R315 PolarHBondContact OE1-NE 3.3Å; E311-R315 IonicContact OE1-NH2 2.75Å; E311-R315 PolarHBondContact OE1-NH2 3.04Å
312	N	92.1	Very high	82	Confident	26 Å²	26	56.2 Å²	56.2	14%	0.139	27%	0.273	C	S	.	.	H	α-helix	trans	-66.8	-46	176.3	-79	13.1	0	0	0	110.9	G306 F309 I310 C314 R315 E316	G306-N312 VanDerWaalsContact C-ND2 3.28Å; G306-N312 PolarHBondContact O-ND2 3.01Å; F309-N312 WeakPolarHBondContact O-CB 3.42Å; F309-N312 PolarHBondContact O-N 2.86Å; I310-N312 VanDerWaalsContact C-N 3.27Å; I310-N312 PolarHBondContact O-N 3.06Å; N312-C314 VanDerWaalsContact C-N 3.31Å; N312-C314 PolarHBondContact O-N 3.22Å; N312-R315 CarbonylContact O-C 3.46Å; N312-R315 WeakPolarHBondContact O-CA 3.4Å; N312-R315 PolarHBondContact O-N 2.87Å; N312-R315 VanDerWaalsContact O-N 3.09Å; N312-R315 PolarHBondContact OD1-NH1 3.09Å; N312-R315 VanDerWaalsContact OD1-NH1 3.11Å; N312-R315 PolarHBondContact OD1-NH2 2.84Å; N312-E316 WeakPolarHBondContact O-CG 3.17Å; N312-E316 PolarHBondContact O-N 3.26Å
313	F	93.6	Very high	83.6	Confident	9 Å²	9	54.3 Å²	54.3	4%	0.039	26%	0.26	C	S	.	.	H	α-helix	trans	-60.2	-41.1	175.5	-67.6	-69.7	0	0	0	112	D307 F309 I310 E316 G317 V318 L323 L364 L367	D307-F313 WeakPolarHBondContact O-CE2 3.45Å; D307-F313 WeakPolarHBondContact O-CZ 3.18Å; F309-F313 WeakPolarHBondContact O-CD2 3.48Å; I310-F313 HydrophobicContact CD1-CD2 4.46Å; I310-F313 PolarHBondContact O-N 3.25Å; F313-E316 PolarHBondContact O-N 2.79Å; F313-G317 PolarHBondContact O-N 3.25Å; F313-V318 HydrophobicContact CB-CB 4.07Å; F313-V318 HydrophobicContact CB-CG2 4.26Å; F313-V318 HydrophobicContact CD1-CG2 4.13Å; F313-V318 WeakPolarHBondContact O-CB 3.29Å; F313-V318 PolarHBondContact O-N 2.98Å; F313-L323 HydrophobicContact CB-CD1 3.71Å; F313-L323 HydrophobicContact CB-CD2 4.16Å; F313-L323 HydrophobicContact CB-CG 4.46Å; F313-L323 HydrophobicContact CD1-CD2 4.01Å; F313-L323 HydrophobicContact CD2-CD1 4.37Å; F313-L323 HydrophobicContact CD2-CD2 4.13Å; F313-L323 HydrophobicContact CE1-CD2 4.43Å; F313-L323 HydrophobicContact CG-CD1 4.16Å; F313-L323 HydrophobicContact CG-CD2 3.85Å; F313-L364 HydrophobicContact CE1-CD2 4.42Å; F313-L364 HydrophobicContact CZ-CD1 4.3Å; F313-L364 HydrophobicContact CZ-CD2 4.22Å; F313-L367 HydrophobicContact CD1-CD2 3.67Å; F313-L367 HydrophobicContact CE1-CD2 3.52Å
314	C	92.4	Very high	85.4	Confident	44 Å²	44	48.4 Å²	48.4	30%	0.297	24%	0.235	S	C	.	.	H	α-helix	trans	-58.4	-48.3	172.5	178.6	0	0	0	0	111.1	W113 I310 E311 N312 E316 G317	W113-C314 HydrophobicContact CD2-CB 4.39Å; W113-C314 HydrophobicContact CH2-CB 4.07Å; W113-C314 HydrophobicContact CZ2-CB 3.62Å; W113-C314 PolarHBondContact NE1-SG 3.27Å; W113-C314 VanDerWaalsContact NE1-SG 3.36Å; I310-C314 PolarHBondContact O-N 2.88Å; E311-C314 WeakPolarHBondContact O-CB 3.37Å; E311-C314 PolarHBondContact O-N 3.34Å; N312-C314 VanDerWaalsContact C-N 3.31Å; N312-C314 PolarHBondContact O-N 3.22Å; C314-E316 PolarHBondContact O-N 2.84Å; C314-G317 PolarHBondContact O-N 2.83Å
315	R	90.9	Very high	87.5	Confident	132 Å²	132	36.9 Å²	36.9	50%	0.498	19%	0.191	S	C	.	.	H	α-helix	trans	-63.2	-27.5	176.4	-78.8	-169.1	-96	111.5	-1.1	112.8	E311 N312 G317 K430	E311-R315 WeakPolarHBondContact O-CB 3.5Å; E311-R315 WeakPolarHBondContact O-CG 3.37Å; E311-R315 PolarHBondContact O-N 3.18Å; E311-R315 IonicContact OE1-CZ 2.67Å; E311-R315 IonicContact OE1-NE 2.7Å; E311-R315 PolarHBondContact OE1-NE 3.3Å; E311-R315 IonicContact OE1-NH2 2.75Å; E311-R315 PolarHBondContact OE1-NH2 3.04Å; N312-R315 CarbonylContact O-C 3.46Å; N312-R315 WeakPolarHBondContact O-CA 3.4Å; N312-R315 PolarHBondContact O-N 2.87Å; N312-R315 VanDerWaalsContact O-N 3.09Å; N312-R315 PolarHBondContact OD1-NH1 3.09Å; N312-R315 VanDerWaalsContact OD1-NH1 3.11Å; N312-R315 PolarHBondContact OD1-NH2 2.84Å; R315-G317 VanDerWaalsContact C-N 3.27Å; R315-G317 PolarHBondContact O-N 2.84Å; R315-K430 VanDerWaalsContact O-CE 3.25Å; R315-K430 WeakPolarHBondContact O-CE 3.36Å; R315-K430 PolarHBondContact O-NZ 2.95Å
316	E	90.8	Very high	89.5	Confident	111 Å²	111	32.5 Å²	32.5	52%	0.519	17%	0.171	S	C	.	.	H	α-helix	trans	-81.4	-4.4	175.7	-72	176.3	-178	0	0	113.4	N312 F313 C314 V318	N312-E316 WeakPolarHBondContact O-CG 3.17Å; N312-E316 PolarHBondContact O-N 3.26Å; F313-E316 PolarHBondContact O-N 2.79Å; C314-E316 PolarHBondContact O-N 2.84Å; E316-V318 HydrophobicContact CB-CG2 4.42Å
317	G	92.4	Very high	91.2	Very high	22 Å²	22	31 Å²	31	23%	0.227	16%	0.156	C	C	.	.	T	Hydrogen-bonded Turn	trans	79.6	23.1	-179.2	0	0	0	0	0	113.2	F313 C314 R315 N371 S428	F313-G317 PolarHBondContact O-N 3.25Å; C314-G317 PolarHBondContact O-N 2.83Å; R315-G317 VanDerWaalsContact C-N 3.27Å; R315-G317 PolarHBondContact O-N 2.84Å; G317-N371 PolarHBondContact O-ND2 3.31Å; G317-S428 PolarHBondContact O-OG 3.17Å
318	V	95.6	Very high	92.5	Very high	15 Å²	15	26.4 Å²	26.4	9%	0.091	13%	0.131	C	C	.	.			trans	-74.4	131.3	168.6	-175.7	0	0	0	0	108.7	W113 F313 E316 A322 L323 L367 N371	W113-V318 WeakPolarHBondContact CZ2-O 3.15Å; F313-V318 HydrophobicContact CB-CB 4.07Å; F313-V318 HydrophobicContact CB-CG2 4.26Å; F313-V318 HydrophobicContact CD1-CG2 4.13Å; F313-V318 WeakPolarHBondContact O-CB 3.29Å; F313-V318 PolarHBondContact O-N 2.98Å; E316-V318 HydrophobicContact CB-CG2 4.42Å; V318-A322 HydrophobicContact CG1-CB 4.33Å; V318-L323 HydrophobicContact CG1-CD1 4.41Å; V318-L323 HydrophobicContact CG1-CD2 3.87Å; V318-L323 HydrophobicContact CG1-CG 3.77Å; V318-L367 HydrophobicContact CG1-CD1 3.93Å; V318-L367 HydrophobicContact CG1-CD2 4.13Å; V318-L367 HydrophobicContact CG1-CG 4.21Å; V318-L367 HydrophobicContact CG2-CD2 4.1Å; V318-N371 WeakPolarHBondContact CA-OD1 3.31Å
319	L	96.7	Very high	92.9	Very high	18 Å²	18	27.7 Å²	27.7	9%	0.094	14%	0.138	C	C	.	.			trans	-72.2	140.9	177.5	-61.1	179.1	0	0	0	110.2	E321 A322 L323 N371 H374 L375	L319-E321 VanDerWaalsContact C-N 3.26Å; L319-E321 PolarHBondContact O-N 3.4Å; L319-A322 HydrophobicContact CB-CB 4.39Å; L319-A322 WeakPolarHBondContact O-CB 3.34Å; L319-A322 PolarHBondContact O-N 2.89Å; L319-A322 VanDerWaalsContact O-N 3.11Å; L319-L323 PolarHBondContact O-N 3.25Å; L319-N371 WeakPolarHBondContact CB-OD1 3.41Å; L319-N371 PolarHBondContact N-OD1 2.86Å; L319-H374 HydrophobicContact CD1-CB 3.96Å; L319-L375 HydrophobicContact CD1-CB 3.85Å; L319-L375 HydrophobicContact CD1-CD1 4.34Å
320	P	96.7	Very high	92.3	Very high	14 Å²	14	26.2 Å²	26.2	9%	0.091	13%	0.133	C	C	.	.	H	α-helix	trans	-58.4	-39.2	179	22.5	-32	0	0	0	111.9	W113 A322 L323 L324	W113-P320 HydrophobicContact CD2-CB 4.36Å; W113-P320 HydrophobicContact CE3-CB 4.16Å; W113-P320 HydrophobicContact CH2-CB 3.99Å; W113-P320 HydrophobicContact CZ2-CB 4.18Å; W113-P320 HydrophobicContact CZ2-CG 4.42Å; W113-P320 HydrophobicContact CZ3-CB 3.96Å; W113-P320 WeakPolarHBondContact O-CB 3.38Å; P320-A322 VanDerWaalsContact C-N 3.28Å; P320-A322 PolarHBondContact O-N 2.85Å; P320-L323 PolarHBondContact O-N 3.16Å; P320-L323 VanDerWaalsContact O-N 3.12Å; P320-L324 WeakPolarHBondContact O-CG 3.29Å; P320-L324 PolarHBondContact O-N 3.44Å
321	E	96.3	Very high	91	Very high	35 Å²	35	26.8 Å²	26.8	16%	0.164	14%	0.14	C	C	.	.	H	α-helix	trans	-60.7	-36.9	178.6	-57	93.6	145.8	0	0	112.3	L319 L323 L324 D325 H374 R378	L319-E321 VanDerWaalsContact C-N 3.26Å; L319-E321 PolarHBondContact O-N 3.4Å; E321-L323 VanDerWaalsContact C-N 3.35Å; E321-L323 PolarHBondContact O-N 3.44Å; E321-L324 PolarHBondContact O-N 3Å; E321-D325 WeakPolarHBondContact O-CB 3.4Å; E321-D325 PolarHBondContact O-N 3.48Å; E321-H374 HydrophobicContact CB-CB 4.35Å; E321-H374 WeakPolarHBondContact CB-ND1 3.25Å; E321-R378 IonicContact OE1-CZ 3.01Å; E321-R378 VanDerWaalsContact OE1-CZ 3.28Å; E321-R378 IonicContact OE1-NE 2.73Å; E321-R378 PolarHBondContact OE1-NE 2.6Å; E321-R378 IonicContact OE1-NH2 3.21Å; E321-R378 PolarHBondContact OE1-NH2 2.94Å; E321-R378 IonicContact OE2-CZ 2.72Å; E321-R378 IonicContact OE2-NE 2.83Å; E321-R378 PolarHBondContact OE2-NE 2.79Å; E321-R378 IonicContact OE2-NH2 3.02Å; E321-R378 PolarHBondContact OE2-NH2 3.44Å
322	A	96.3	Very high	90.2	Very high	0 Å²	0	24.6 Å²	24.6	0%	0	13%	0.131	C	C	.	.	H	α-helix	trans	-66.1	-37.9	177.4	0	0	0	0	0	112.1	V318 L319 P320 I326 L367 F370 N371 H374	V318-A322 HydrophobicContact CG1-CB 4.33Å; L319-A322 HydrophobicContact CB-CB 4.39Å; L319-A322 WeakPolarHBondContact O-CB 3.34Å; L319-A322 PolarHBondContact O-N 2.89Å; L319-A322 VanDerWaalsContact O-N 3.11Å; P320-A322 VanDerWaalsContact C-N 3.28Å; P320-A322 PolarHBondContact O-N 2.85Å; A322-I326 WeakPolarHBondContact O-CB 3.33Å; A322-I326 WeakPolarHBondContact O-CG2 3.42Å; A322-I326 PolarHBondContact O-N 3.44Å; A322-L367 HydrophobicContact CB-CD1 4.45Å; A322-F370 HydrophobicContact CB-CB 4.17Å; A322-N371 HydrophobicContact CB-CB 4.21Å; A322-N371 WeakPolarHBondContact CB-OD1 3.18Å; A322-H374 VanDerWaalsContact CA-CD2 3.47Å; A322-H374 WeakPolarHBondContact CA-CD2 3.36Å; A322-H374 HydrophobicContact CB-CB 4.45Å
323	L	94.9	Very high	89.7	Confident	0 Å²	0	23.3 Å²	23.3	0%	0	13%	0.125	C	C	.	.	H	α-helix	trans	-68.7	-41.4	174.5	-67.5	176.9	0	0	0	112.2	L67 L70 W113 I310 F313 V318 L319 P320 E321 D325 I326 T327 L367	L67-L323 HydrophobicContact CD1-CD2 4.38Å; L70-L323 HydrophobicContact CD2-CB 4.29Å; W113-L323 HydrophobicContact CH2-CD1 3.69Å; W113-L323 HydrophobicContact CZ3-CD1 3.76Å; I310-L323 HydrophobicContact CG2-CD1 4.45Å; F313-L323 HydrophobicContact CB-CD1 3.71Å; F313-L323 HydrophobicContact CB-CD2 4.16Å; F313-L323 HydrophobicContact CB-CG 4.46Å; F313-L323 HydrophobicContact CD1-CD2 4.01Å; F313-L323 HydrophobicContact CD2-CD1 4.37Å; F313-L323 HydrophobicContact CD2-CD2 4.13Å; F313-L323 HydrophobicContact CE1-CD2 4.43Å; F313-L323 HydrophobicContact CG-CD1 4.16Å; F313-L323 HydrophobicContact CG-CD2 3.85Å; V318-L323 HydrophobicContact CG1-CD1 4.41Å; V318-L323 HydrophobicContact CG1-CD2 3.87Å; V318-L323 HydrophobicContact CG1-CG 3.77Å; L319-L323 PolarHBondContact O-N 3.25Å; P320-L323 PolarHBondContact O-N 3.16Å; P320-L323 VanDerWaalsContact O-N 3.12Å; E321-L323 VanDerWaalsContact C-N 3.35Å; E321-L323 PolarHBondContact O-N 3.44Å; L323-D325 VanDerWaalsContact C-N 3.32Å; L323-D325 PolarHBondContact O-N 2.81Å; L323-I326 WeakPolarHBondContact O-CG2 3.46Å; L323-T327 WeakPolarHBondContact O-CB 3.2Å; L323-T327 WeakPolarHBondContact O-CG2 3.14Å; L323-T327 PolarHBondContact O-N 2.96Å; L323-T327 VanDerWaalsContact O-N 3.15Å; L323-T327 PolarHBondContact O-OG1 3.15Å; L323-L367 HydrophobicContact CD2-CD1 4.06Å; L323-L367 HydrophobicContact CD2-CD2 4.18Å
324	L	95.3	Very high	89.5	Confident	5 Å²	5	23.2 Å²	23.2	3%	0.026	12%	0.124	C	C	.	.	H	α-helix	trans	-64.5	-39.9	176.5	-59.8	-169.2	0	0	0	111.5	L70 L74 A114 I116 P320 E321 T327 T328 L343 L346	L70-L324 HydrophobicContact CD1-CD2 4.17Å; L70-L324 HydrophobicContact CD2-CD2 4.23Å; L70-L324 HydrophobicContact CG-CD2 4.3Å; L74-L324 HydrophobicContact CD1-CB 4.5Å; L74-L324 HydrophobicContact CD1-CD1 4.11Å; L74-L324 HydrophobicContact CD1-CD2 4.08Å; L74-L324 HydrophobicContact CD1-CG 4.45Å; L74-L324 HydrophobicContact CD2-CB 3.91Å; L74-L324 HydrophobicContact CD2-CD2 3.92Å; L74-L324 HydrophobicContact CD2-CG 4.41Å; L74-L324 HydrophobicContact CG-CD2 4.41Å; A114-L324 HydrophobicContact CB-CD2 4.36Å; A114-L324 WeakPolarHBondContact O-CD1 3.23Å; I116-L324 HydrophobicContact CG2-CD1 4.15Å; P320-L324 WeakPolarHBondContact O-CG 3.29Å; P320-L324 PolarHBondContact O-N 3.44Å; E321-L324 PolarHBondContact O-N 3Å; L324-T327 PolarHBondContact O-OG1 3.49Å; L324-T328 WeakPolarHBondContact O-CG2 3.13Å; L324-T328 PolarHBondContact O-N 2.97Å; L324-T328 PolarHBondContact O-OG1 3.11Å; L324-L343 HydrophobicContact CD1-CD1 4.03Å; L324-L346 HydrophobicContact CB-CD1 4.2Å
325	D	94.6	Very high	89	Confident	0 Å²	0	26.6 Å²	26.6	0%	0	14%	0.144	C	C	.	.	H	α-helix	trans	-70.2	-48.2	-178.9	-172.2	22.7	0	0	0	111.8	E321 L323 T327 T328 N329 G340 R341 F370 H374	E321-D325 WeakPolarHBondContact O-CB 3.4Å; E321-D325 PolarHBondContact O-N 3.48Å; L323-D325 VanDerWaalsContact C-N 3.32Å; L323-D325 PolarHBondContact O-N 2.81Å; D325-T327 VanDerWaalsContact C-N 3.29Å; D325-T327 PolarHBondContact O-N 2.78Å; D325-T328 PolarHBondContact O-N 3.21Å; D325-T328 PolarHBondContact O-OG1 3.45Å; D325-N329 WeakPolarHBondContact O-CB 3.47Å; D325-N329 PolarHBondContact O-N 2.9Å; D325-G340 WeakPolarHBondContact OD2-CA 3.22Å; D325-G340 PolarHBondContact OD2-N 3.24Å; D325-R341 PolarHBondContact OD2-N 2.93Å; D325-F370 HydrophobicContact CB-CD1 3.91Å; D325-F370 HydrophobicContact CB-CE1 4.2Å; D325-F370 WeakPolarHBondContact OD2-CD1 3.32Å; D325-H374 WeakPolarHBondContact CB-NE2 3.38Å; D325-H374 IonicContact OD2-CD2 2.73Å; D325-H374 IonicContact OD2-CE1 3.26Å; D325-H374 IonicContact OD2-NE2 3.77Å; D325-H374 PolarHBondContact OD2-NE2 3.18Å
326	I	91.9	Very high	88.6	Confident	3 Å²	3	23 Å²	23	2%	0.015	14%	0.138	C	C	.	.	H	α-helix	trans	-63.1	-36.8	178.1	-160.6	173.2	0	0	0	112	A322 L323 T328 N329 L362 L367 F370	A322-I326 WeakPolarHBondContact O-CB 3.33Å; A322-I326 WeakPolarHBondContact O-CG2 3.42Å; A322-I326 PolarHBondContact O-N 3.44Å; L323-I326 WeakPolarHBondContact O-CG2 3.46Å; I326-T328 VanDerWaalsContact C-N 3.31Å; I326-T328 PolarHBondContact O-N 3.29Å; I326-N329 PolarHBondContact O-N 2.81Å; I326-L362 HydrophobicContact CD1-CD1 4.32Å; I326-L362 HydrophobicContact CG1-CD1 4Å; I326-L367 HydrophobicContact CD1-CB 4.06Å; I326-L367 HydrophobicContact CD1-CD1 4.25Å; I326-L367 HydrophobicContact CG2-CD1 4.18Å; I326-F370 HydrophobicContact CB-CD1 3.88Å; I326-F370 HydrophobicContact CB-CD2 4.4Å; I326-F370 HydrophobicContact CB-CE1 3.98Å; I326-F370 HydrophobicContact CB-CE2 4.48Å; I326-F370 HydrophobicContact CB-CG 4.11Å; I326-F370 HydrophobicContact CB-CZ 4.28Å; I326-F370 HydrophobicContact CD1-CD2 4.22Å; I326-F370 HydrophobicContact CD1-CE2 4.35Å; I326-F370 HydrophobicContact CG1-CD1 4.46Å; I326-F370 HydrophobicContact CG1-CD2 4.21Å; I326-F370 HydrophobicContact CG1-CE1 4.31Å; I326-F370 HydrophobicContact CG1-CE2 4.03Å; I326-F370 HydrophobicContact CG1-CG 4.42Å; I326-F370 HydrophobicContact CG1-CZ 4.09Å
327	T	89.6	Confident	88.1	Confident	0 Å²	0	22.8 Å²	22.8	0%	0	14%	0.141	C	C	.	.	H	α-helix	trans	-71.2	-25.2	179.4	53.6	0	0	0	0	113.5	L67 L323 L324 D325	L67-T327 HydrophobicContact CD1-CG2 3.39Å; L67-T327 HydrophobicContact CD2-CG2 4.29Å; L67-T327 HydrophobicContact CG-CG2 3.68Å; L323-T327 WeakPolarHBondContact O-CB 3.2Å; L323-T327 WeakPolarHBondContact O-CG2 3.14Å; L323-T327 PolarHBondContact O-N 2.96Å; L323-T327 VanDerWaalsContact O-N 3.15Å; L323-T327 PolarHBondContact O-OG1 3.15Å; L324-T327 PolarHBondContact O-OG1 3.49Å; D325-T327 VanDerWaalsContact C-N 3.29Å; D325-T327 PolarHBondContact O-N 2.78Å
328	T	88.6	Confident	87.9	Confident	0 Å²	0	25.7 Å²	25.7	0%	0	15%	0.145	C	C	.	.	H	α-helix	trans	-91	-24.4	176.4	48.9	0	0	0	0	113.1	L74 Y75 L324 D325 I326 C330 F334 L346	L74-T328 HydrophobicContact CD2-CG2 3.38Å; L74-T328 HydrophobicContact CG-CG2 4.19Å; Y75-T328 HydrophobicContact CE2-CG2 3.9Å; L324-T328 WeakPolarHBondContact O-CG2 3.13Å; L324-T328 PolarHBondContact O-N 2.97Å; L324-T328 PolarHBondContact O-OG1 3.11Å; D325-T328 PolarHBondContact O-N 3.21Å; D325-T328 PolarHBondContact O-OG1 3.45Å; I326-T328 VanDerWaalsContact C-N 3.31Å; I326-T328 PolarHBondContact O-N 3.29Å; T328-C330 PolarHBondContact O-N 3Å; T328-F334 HydrophobicContact CG2-CE2 4.05Å; T328-L346 HydrophobicContact CG2-CD2 4.09Å; T328-L346 WeakPolarHBondContact OG1-CD2 3.3Å
329	N	86.4	Confident	87.7	Confident	33 Å²	33	27.8 Å²	27.8	18%	0.176	16%	0.155	C	C	.	.	H	α-helix	trans	-68.3	-16.1	172.4	-162.6	59.6	0	0	0	112.7	D325 I326 N337 F370	D325-N329 WeakPolarHBondContact O-CB 3.47Å; D325-N329 PolarHBondContact O-N 2.9Å; I326-N329 PolarHBondContact O-N 2.81Å; N329-N337 WeakPolarHBondContact OD1-CB 3.39Å; N329-F370 HydrophobicContact CB-CE1 4.19Å; N329-F370 HydrophobicContact CB-CZ 4.07Å
330	C	77.7	Confident	87.6	Confident	15 Å²	15	27.1 Å²	27.1	10%	0.101	15%	0.153	C	C	.	.	S	Bend	trans	-101.6	118.9	176.4	-64.3	0	0	0	0	112.5	R71 L293 T328 A360 L361	R71-C330 PolarHBondContact NH2-O 3.04Å; L293-C330 HydrophobicContact CD1-CB 4.28Å; T328-C330 PolarHBondContact O-N 3Å; C330-A360 HydrophobicContact CB-CB 4.17Å; C330-L361 PolarHBondContact SG-O 3.19Å
331	G	65.6	Low	87.4	Confident	13 Å²	13	26.5 Å²	26.5	13%	0.134	15%	0.149	C	C	.	.	S	Bend	trans	74.9	44.9	176.2	0	0	0	0	0	114
332	S	75.6	Confident	87.3	Confident	21 Å²	21	29.9 Å²	29.9	15%	0.147	16%	0.16	C	C	.	.			trans	-68	137.9	-145.9	67	0	0	0	0	116.5	F334 K354 I355	S332-F334 VanDerWaalsContact C-N 3.27Å; S332-K354 CarbonylContact O-C 3.47Å; S332-I355 VanDerWaalsContact O-CA 3.22Å; S332-I355 WeakPolarHBondContact O-CA 3.38Å; S332-I355 PolarHBondContact O-N 2.76Å
333	G	82.9	Confident	87.3	Confident	0 Å²	0	31.3 Å²	31.3	0%	0	17%	0.167	C	C	.	.	S	Bend	trans	-91.2	31.1	162.5	0	0	0	0	0	112.9	N351	G333-N351 CarbonylContact C-O 3.56Å; G333-N351 WeakPolarHBondContact CA-O 3.37Å; G333-N351 PolarHBondContact O-N 3.06Å
334	F	89.4	Confident	87.3	Confident	6 Å²	6	37.1 Å²	37.1	3%	0.026	19%	0.194	C	C	.	.	S	Bend	trans	-137.7	154.9	-170	-61.3	-84.4	0	0	0	111.1	I78 T328 S332 L346 E349 F350	I78-F334 HydrophobicContact CD1-CZ 4.18Å; T328-F334 HydrophobicContact CG2-CE2 4.05Å; S332-F334 VanDerWaalsContact C-N 3.27Å; F334-L346 HydrophobicContact CE1-CD2 4.06Å; F334-L346 WeakPolarHBondContact CE1-O 3.5Å; F334-L346 HydrophobicContact CE2-CD2 4.09Å; F334-L346 HydrophobicContact CZ-CB 4.29Å; F334-L346 HydrophobicContact CZ-CD2 3.58Å; F334-E349 HydrophobicContact CD1-CB 3.75Å; F334-E349 HydrophobicContact CE1-CB 3.97Å; F334-F350 HydrophobicContact CE1-CB 4.05Å; F334-F350 HydrophobicContact CE1-CD2 4.41Å; F334-F350 HydrophobicContact CE2-CD2 4.11Å; F334-F350 HydrophobicContact CZ-CB 4.13Å; F334-F350 AromaticContact CZ-CD2 3.86Å; F334-F350 HydrophobicContact CZ-CD2 3.86Å; F334-F350 HydrophobicContact CZ-CG 4.49Å
335	T	81.8	Confident	87.3	Confident	116 Å²	116	39.3 Å²	39.3	71%	0.712	21%	0.205	S	C	*	.	S	Bend	trans	-75.1	-25	-175.6	46.3	0	0	0	0	114.3
336	S	81.3	Confident	87.4	Confident	55 Å²	55	39.4 Å²	39.4	39%	0.385	21%	0.205	S	C	.	.	S	Bend	trans	-138.3	153.4	179.6	63.1	0	0	0	0	111	R341	S336-R341 VanDerWaalsContact O-CZ 3.3Å; S336-R341 PolarHBondContact O-NH1 3.3Å; S336-R341 PolarHBondContact O-NH2 2.79Å; S336-R341 PolarHBondContact OG-NH2 3.06Å
337	N	79.7	Confident	87.5	Confident	107 Å²	107	40.9 Å²	40.9	57%	0.572	21%	0.213	S	C	*	.			trans	-92.4	110.2	166.5	-72.9	-3.2	0	0	0	107.3	N329	N329-N337 WeakPolarHBondContact OD1-CB 3.39Å
338	R	88.7	Confident	87.8	Confident	84 Å²	84	44.6 Å²	44.6	32%	0.317	24%	0.239	S	C	.	.			trans	-133.2	139.3	173.4	66.1	176.2	176.4	138.2	1	108.1	R341 E345 E349	R338-R341 HydrophobicContact CG-CG 3.91Å; R338-R341 PolarHBondContact O-NH1 3.43Å; R338-E345 IonicContact CZ-OE1 3.91Å; R338-E345 VanDerWaalsContact CZ-OE1 3.26Å; R338-E345 IonicContact NH1-OE1 3.25Å; R338-E345 PolarHBondContact NH1-OE1 2.92Å; R338-E345 IonicContact NH2-OE1 3.55Å; R338-E345 PolarHBondContact NH2-OE1 2.95Å; R338-E345 IonicContact NH2-OE2 2.76Å; R338-E349 IonicContact CZ-OE1 2.72Å; R338-E349 IonicContact NE-OE1 2.65Å; R338-E349 IonicContact NE-OE2 3.5Å; R338-E349 IonicContact NH2-OE1 3.07Å; R338-E349 PolarHBondContact NH2-OE1 3.19Å; R338-E349 IonicContact NH2-OE2 2.66Å; R338-E349 PolarHBondContact NH2-OE2 3.3Å
339	I	91.9	Very high	88.1	Confident	58 Å²	58	47.8 Å²	47.8	30%	0.297	25%	0.253	S	S	.	.	S	Bend	trans	-86.6	146.2	174.8	-51.2	177.5	0	0	0	108.4	E369 F370 I373	I339-E369 HydrophobicContact CD1-CG 4.41Å; I339-F370 HydrophobicContact CB-CE1 4.3Å; I339-F370 HydrophobicContact CB-CZ 4.4Å; I339-F370 HydrophobicContact CD1-CD2 4.29Å; I339-F370 HydrophobicContact CD1-CE2 3.83Å; I339-F370 HydrophobicContact CD1-CZ 4.1Å; I339-F370 HydrophobicContact CG1-CE1 4.09Å; I339-F370 HydrophobicContact CG1-CE2 3.97Å; I339-F370 HydrophobicContact CG1-CZ 3.7Å; I339-F370 HydrophobicContact CG2-CB 4.37Å; I339-F370 HydrophobicContact CG2-CD1 3.6Å; I339-F370 HydrophobicContact CG2-CD2 4.11Å; I339-F370 HydrophobicContact CG2-CE1 3.78Å; I339-F370 HydrophobicContact CG2-CE2 4.29Å; I339-F370 HydrophobicContact CG2-CG 3.77Å; I339-F370 HydrophobicContact CG2-CZ 4.13Å; I339-I373 HydrophobicContact CB-CD1 3.89Å; I339-I373 HydrophobicContact CG2-CB 4.36Å; I339-I373 HydrophobicContact CG2-CD1 3.43Å; I339-I373 VanDerWaalsContact CG2-CD1 3.43Å; I339-I373 HydrophobicContact CG2-CG1 4.46Å; I339-I373 HydrophobicContact CG2-CG2 4.49Å
340	G	93.9	Very high	88.4	Confident	4 Å²	4	46.2 Å²	46.2	4%	0.041	25%	0.245	C	C	.	.			trans	93.8	22.3	177.6	0	0	0	0	0	114.2	D325 R342 Q377	D325-G340 WeakPolarHBondContact OD2-CA 3.22Å; D325-G340 PolarHBondContact OD2-N 3.24Å; G340-R342 PolarHBondContact O-N 2.61Å; G340-Q377 PolarHBondContact O-NE2 3.16Å
341	R	93.9	Very high	89.1	Confident	2 Å²	2	48.1 Å²	48.1	1%	0.008	25%	0.254	C	S	.	.			trans	-67.5	125.9	175.6	-76.1	-167.5	170	93.8	-1.7	111.1	D325 S336 R338 E345 L346 E349 H374	D325-R341 PolarHBondContact OD2-N 2.93Å; S336-R341 VanDerWaalsContact O-CZ 3.3Å; S336-R341 PolarHBondContact O-NH1 3.3Å; S336-R341 PolarHBondContact O-NH2 2.79Å; S336-R341 PolarHBondContact OG-NH2 3.06Å; R338-R341 HydrophobicContact CG-CG 3.91Å; R338-R341 PolarHBondContact O-NH1 3.43Å; R341-E345 WeakPolarHBondContact CA-OE2 3.41Å; R341-L346 HydrophobicContact CB-CD2 3.89Å; R341-L346 HydrophobicContact CB-CG 4.14Å; R341-L346 HydrophobicContact CG-CD2 4.43Å; R341-E349 IonicContact CZ-OE2 2.88Å; R341-E349 IonicContact NE-OE2 3.54Å; R341-E349 PolarHBondContact NE-OE2 2.9Å; R341-E349 IonicContact NH2-OE2 2.73Å; R341-E349 PolarHBondContact NH2-OE2 2.71Å; R341-H374 PolarHBondContact O-CE1 2.99Å
342	R	94.4	Very high	90.2	Very high	105 Å²	105	48.1 Å²	48.1	40%	0.396	25%	0.252	S	S	.	.			trans	-76	158.7	170.6	-59.5	-179.1	177.1	-175.5	0.4	110.6	G340 E344 E345 L346	G340-R342 PolarHBondContact O-N 2.61Å; R342-E344 WeakPolarHBondContact CB-OE2 3.22Å; R342-E344 PolarHBondContact O-N 3.25Å; R342-E345 HydrophobicContact CB-CG 4.28Å; R342-E345 PolarHBondContact N-OE2 3.02Å; R342-E345 WeakPolarHBondContact O-CA 3.34Å; R342-E345 WeakPolarHBondContact O-CB 3.47Å; R342-E345 PolarHBondContact O-N 3.47Å; R342-L346 PolarHBondContact O-N 3.32Å
343	L	95.1	Very high	90.8	Very high	30 Å²	30	51.3 Å²	51.3	16%	0.157	27%	0.274	C	S	.	.	H	α-helix	trans	-59	-36.9	-178.7	-177.6	58.3	0	0	0	112.1	L74 Y77 I78 G115 I116 L324 E345 L346 I347	L74-L343 HydrophobicContact CD1-CD1 4.3Å; Y77-L343 HydrophobicContact CD1-CD1 4.41Å; Y77-L343 HydrophobicContact CE1-CD1 4.15Å; Y77-L343 HydrophobicContact CE1-CD2 4.11Å; Y77-L343 HydrophobicContact CE1-CG 4.42Å; I78-L343 HydrophobicContact CG2-CD1 4.38Å; G115-L343 VanDerWaalsContact O-CD2 3.3Å; G115-L343 WeakPolarHBondContact O-CD2 3.37Å; I116-L343 HydrophobicContact CG2-CD1 4.41Å; L324-L343 HydrophobicContact CD1-CD1 4.03Å; L343-E345 VanDerWaalsContact C-N 3.31Å; L343-E345 PolarHBondContact O-N 2.85Å; L343-L346 HydrophobicContact CD1-CD1 4.4Å; L343-L346 WeakPolarHBondContact O-CB 3.37Å; L343-L346 PolarHBondContact O-N 2.98Å; L343-I347 HydrophobicContact CG-CD1 4.18Å; L343-I347 VanDerWaalsContact O-CG1 3.28Å; L343-I347 WeakPolarHBondContact O-CG1 3.48Å; L343-I347 PolarHBondContact O-N 3.15Å
344	E	95.6	Very high	91.2	Very high	122 Å²	122	56.3 Å²	56.3	57%	0.57	30%	0.296	S	S	*	.	H	α-helix	trans	-65.1	-36.3	176.9	-59	73.5	-157.6	0	0	111.8	R342 I347 S348	R342-E344 WeakPolarHBondContact CB-OE2 3.22Å; R342-E344 PolarHBondContact O-N 3.25Å; E344-I347 PolarHBondContact O-N 3.09Å; E344-S348 WeakPolarHBondContact O-CB 3.41Å; E344-S348 PolarHBondContact O-N 2.98Å; E344-S348 PolarHBondContact O-OG 3.45Å
345	E	95.2	Very high	91.3	Very high	52 Å²	52	56.7 Å²	56.7	24%	0.243	30%	0.298	C	S	.	.	H	α-helix	trans	-70.6	-40.9	174.1	-60.9	177.8	111.2	0	0	110.6	R338 R341 R342 L343 I347 S348 E349	R338-E345 IonicContact CZ-OE1 3.91Å; R338-E345 VanDerWaalsContact CZ-OE1 3.26Å; R338-E345 IonicContact NH1-OE1 3.25Å; R338-E345 PolarHBondContact NH1-OE1 2.92Å; R338-E345 IonicContact NH2-OE1 3.55Å; R338-E345 PolarHBondContact NH2-OE1 2.95Å; R338-E345 IonicContact NH2-OE2 2.76Å; R341-E345 WeakPolarHBondContact CA-OE2 3.41Å; R342-E345 HydrophobicContact CB-CG 4.28Å; R342-E345 PolarHBondContact N-OE2 3.02Å; R342-E345 WeakPolarHBondContact O-CA 3.34Å; R342-E345 WeakPolarHBondContact O-CB 3.47Å; R342-E345 PolarHBondContact O-N 3.47Å; L343-E345 VanDerWaalsContact C-N 3.31Å; L343-E345 PolarHBondContact O-N 2.85Å; E345-I347 VanDerWaalsContact C-N 3.3Å; E345-I347 PolarHBondContact O-N 2.75Å; E345-S348 WeakPolarHBondContact CA-OG 3.36Å; E345-S348 PolarHBondContact O-N 2.89Å; E345-S348 PolarHBondContact O-OG 3.11Å; E345-E349 VanDerWaalsContact O-CB 3.23Å; E345-E349 WeakPolarHBondContact O-CB 3.48Å; E345-E349 WeakPolarHBondContact O-CG 3.12Å; E345-E349 PolarHBondContact O-N 3.38Å
346	L	95.2	Very high	91.7	Very high	1 Å²	1	54 Å²	54	1%	0.005	28%	0.281	C	S	.	.	H	α-helix	trans	-57.9	-44	173.3	-66.8	175.3	0	0	0	110.9	I78 L324 T328 F334 R341 R342 L343 F350	I78-L346 HydrophobicContact CG2-CB 4.21Å; L324-L346 HydrophobicContact CB-CD1 4.2Å; T328-L346 HydrophobicContact CG2-CD2 4.09Å; T328-L346 WeakPolarHBondContact OG1-CD2 3.3Å; F334-L346 HydrophobicContact CE1-CD2 4.06Å; F334-L346 WeakPolarHBondContact CE1-O 3.5Å; F334-L346 HydrophobicContact CE2-CD2 4.09Å; F334-L346 HydrophobicContact CZ-CB 4.29Å; F334-L346 HydrophobicContact CZ-CD2 3.58Å; R341-L346 HydrophobicContact CB-CD2 3.89Å; R341-L346 HydrophobicContact CB-CG 4.14Å; R341-L346 HydrophobicContact CG-CD2 4.43Å; R342-L346 PolarHBondContact O-N 3.32Å; L343-L346 HydrophobicContact CD1-CD1 4.4Å; L343-L346 WeakPolarHBondContact O-CB 3.37Å; L343-L346 PolarHBondContact O-N 2.98Å; L346-F350 WeakPolarHBondContact O-CB 3.46Å; L346-F350 PolarHBondContact O-N 3.04Å
347	I	95.8	Very high	92.1	Very high	35 Å²	35	54.2 Å²	54.2	18%	0.179	28%	0.281	C	S	.	.	H	α-helix	trans	-65.2	-52.6	178.1	-66.7	163.2	0	0	0	111.2	Y77 I78 K81 K82 L343 E344 E345	Y77-I347 HydrophobicContact CE1-CD1 4.24Å; I78-I347 HydrophobicContact CB-CG1 4.26Å; I78-I347 HydrophobicContact CG2-CG1 4.01Å; K81-I347 HydrophobicContact CB-CD1 3.87Å; K81-I347 HydrophobicContact CB-CG1 4.01Å; K81-I347 HydrophobicContact CB-CG2 3.78Å; K81-I347 HydrophobicContact CG-CD1 4.21Å; K82-I347 HydrophobicContact CB-CG2 4.25Å; K82-I347 WeakPolarHBondContact CB-O 3.36Å; K82-I347 WeakPolarHBondContact CG-O 3.22Å; L343-I347 HydrophobicContact CG-CD1 4.18Å; L343-I347 VanDerWaalsContact O-CG1 3.28Å; L343-I347 WeakPolarHBondContact O-CG1 3.48Å; L343-I347 PolarHBondContact O-N 3.15Å; E344-I347 PolarHBondContact O-N 3.09Å; E345-I347 VanDerWaalsContact C-N 3.3Å; E345-I347 PolarHBondContact O-N 2.75Å
348	S	95.4	Very high	92.5	Very high	78 Å²	78	56 Å²	56	55%	0.545	29%	0.285	S	S	.	.	H	α-helix	trans	-68.5	-37.6	-173.7	55.3	0	0	0	0	112.9	K82 E344 E345	K82-S348 PolarHBondContact NZ-O 2.96Å; E344-S348 WeakPolarHBondContact O-CB 3.41Å; E344-S348 PolarHBondContact O-N 2.98Å; E344-S348 PolarHBondContact O-OG 3.45Å; E345-S348 WeakPolarHBondContact CA-OG 3.36Å; E345-S348 PolarHBondContact O-N 2.89Å; E345-S348 PolarHBondContact O-OG 3.11Å
349	E	94.1	Very high	92.4	Very high	66 Å²	66	54.5 Å²	54.5	31%	0.308	29%	0.287	S	S	.	.	H	α-helix	trans	-85.5	-17.9	-177.5	-64.4	-178.2	-179.7	0	0	114.2	F334 R338 R341 E345 N351	F334-E349 HydrophobicContact CD1-CB 3.75Å; F334-E349 HydrophobicContact CE1-CB 3.97Å; R338-E349 IonicContact CZ-OE1 2.72Å; R338-E349 IonicContact NE-OE1 2.65Å; R338-E349 IonicContact NE-OE2 3.5Å; R338-E349 IonicContact NH2-OE1 3.07Å; R338-E349 PolarHBondContact NH2-OE1 3.19Å; R338-E349 IonicContact NH2-OE2 2.66Å; R338-E349 PolarHBondContact NH2-OE2 3.3Å; R341-E349 IonicContact CZ-OE2 2.88Å; R341-E349 IonicContact NE-OE2 3.54Å; R341-E349 PolarHBondContact NE-OE2 2.9Å; R341-E349 IonicContact NH2-OE2 2.73Å; R341-E349 PolarHBondContact NH2-OE2 2.71Å; E345-E349 VanDerWaalsContact O-CB 3.23Å; E345-E349 WeakPolarHBondContact O-CB 3.48Å; E345-E349 WeakPolarHBondContact O-CG 3.12Å; E345-E349 PolarHBondContact O-N 3.38Å; E349-N351 PolarHBondContact O-N 3.25Å
350	F	94	Very high	92.1	Very high	0 Å²	0	51.9 Å²	51.9	0%	0	27%	0.274	C	S	.	.			trans	-57.4	129.1	-170.5	-179.6	-120.3	0	0	0	112.9	Y75 I78 F79 K82 F334 L346 P352 I355	Y75-F350 AromaticContact CD1-CE2 3.73Å; Y75-F350 HydrophobicContact CD1-CE2 3.73Å; Y75-F350 AromaticContact CD1-CZ 3.74Å; Y75-F350 HydrophobicContact CD1-CZ 3.74Å; Y75-F350 AromaticContact CE1-CE2 3.86Å; Y75-F350 HydrophobicContact CE1-CE2 3.86Å; Y75-F350 HydrophobicContact CE1-CZ 4.29Å; Y75-F350 HydrophobicContact CG-CE2 4.39Å; Y75-F350 HydrophobicContact CG-CZ 4.36Å; I78-F350 HydrophobicContact CD1-CB 4.02Å; I78-F350 HydrophobicContact CD1-CD1 4.08Å; I78-F350 HydrophobicContact CD1-CD2 3.38Å; I78-F350 HydrophobicContact CD1-CE1 4.34Å; I78-F350 HydrophobicContact CD1-CE2 3.71Å; I78-F350 HydrophobicContact CD1-CG 3.58Å; I78-F350 HydrophobicContact CD1-CZ 4.18Å; I78-F350 HydrophobicContact CG1-CB 4.17Å; I78-F350 HydrophobicContact CG1-CD1 3.75Å; I78-F350 HydrophobicContact CG1-CD2 4.02Å; I78-F350 HydrophobicContact CG1-CE1 4.03Å; I78-F350 HydrophobicContact CG1-CE2 4.29Å; I78-F350 HydrophobicContact CG1-CG 3.73Å; I78-F350 HydrophobicContact CG1-CZ 4.29Å; F79-F350 HydrophobicContact CB-CD1 4.39Å; F79-F350 HydrophobicContact CB-CE1 3.91Å; F79-F350 HydrophobicContact CD2-CD1 4.49Å; F79-F350 AromaticContact CD2-CE1 3.93Å; F79-F350 HydrophobicContact CD2-CE1 3.93Å; F79-F350 HydrophobicContact CG-CE1 4.43Å; K82-F350 HydrophobicContact CD-CB 4.3Å; K82-F350 WeakPolarHBondContact CD-O 3.41Å; K82-F350 WeakPolarHBondContact CE-O 3.33Å; K82-F350 PolarHBondContact NZ-O 2.98Å; F334-F350 HydrophobicContact CE1-CB 4.05Å; F334-F350 HydrophobicContact CE1-CD2 4.41Å; F334-F350 HydrophobicContact CE2-CD2 4.11Å; F334-F350 HydrophobicContact CZ-CB 4.13Å; F334-F350 AromaticContact CZ-CD2 3.86Å; F334-F350 HydrophobicContact CZ-CD2 3.86Å; F334-F350 HydrophobicContact CZ-CG 4.49Å; L346-F350 WeakPolarHBondContact O-CB 3.46Å; L346-F350 PolarHBondContact O-N 3.04Å; F350-P352 HydrophobicContact CD1-CG 4.33Å; F350-P352 HydrophobicContact CE1-CG 3.79Å; F350-P352 HydrophobicContact CZ-CG 4.25Å; F350-I355 HydrophobicContact CE2-CD1 4.17Å; F350-I355 HydrophobicContact CZ-CD1 4Å
351	N	91.4	Very high	91.7	Very high	56 Å²	56	56.3 Å²	56.3	30%	0.299	30%	0.297	S	S	.	.			trans	-135.6	107.4	177.9	-173.7	-16.5	0	0	0	110.1	G333 E349 S353 K354	G333-N351 CarbonylContact C-O 3.56Å; G333-N351 WeakPolarHBondContact CA-O 3.37Å; G333-N351 PolarHBondContact O-N 3.06Å; E349-N351 PolarHBondContact O-N 3.25Å; N351-S353 VanDerWaalsContact CG-OG 3.25Å; N351-S353 PolarHBondContact ND2-OG 3.33Å; N351-S353 PolarHBondContact O-N 3.48Å; N351-S353 VanDerWaalsContact O-N 3.15Å; N351-S353 WeakPolarHBondContact OD1-CB 3.18Å; N351-S353 PolarHBondContact OD1-N 3.43Å; N351-S353 PolarHBondContact OD1-OG 2.82Å; N351-K354 HydrophobicContact CB-CB 4.45Å; N351-K354 HydrophobicContact CB-CG 3.95Å; N351-K354 WeakPolarHBondContact O-CB 3.16Å; N351-K354 PolarHBondContact O-N 3Å
352	P	89.3	Confident	91.4	Very high	13 Å²	13	56.4 Å²	56.4	8%	0.084	30%	0.297	C	S	.	.	G	3₁₀ helix	trans	-55.2	-33.3	178.9	-25.9	32.9	0	0	0	114	F79 F350 K354 I355	F79-P352 HydrophobicContact CD2-CG 3.76Å; F79-P352 HydrophobicContact CE2-CG 3.75Å; F350-P352 HydrophobicContact CD1-CG 4.33Å; F350-P352 HydrophobicContact CE1-CG 3.79Å; F350-P352 HydrophobicContact CZ-CG 4.25Å; P352-K354 PolarHBondContact O-N 2.93Å; P352-K354 VanDerWaalsContact O-N 3.16Å; P352-I355 HydrophobicContact CB-CD1 4.43Å; P352-I355 WeakPolarHBondContact O-CB 3.29Å; P352-I355 WeakPolarHBondContact O-CG1 3.48Å; P352-I355 PolarHBondContact O-N 3.43Å; P352-I355 VanDerWaalsContact O-N 3.11Å
353	S	88.2	Confident	91.1	Very high	87 Å²	87	53.3 Å²	53.3	61%	0.608	29%	0.289	S	S	*	.	G	3₁₀ helix	trans	-68.2	-11.9	179.1	70.4	0	0	0	0	114	N351	N351-S353 VanDerWaalsContact CG-OG 3.25Å; N351-S353 PolarHBondContact ND2-OG 3.33Å; N351-S353 PolarHBondContact O-N 3.48Å; N351-S353 VanDerWaalsContact O-N 3.15Å; N351-S353 WeakPolarHBondContact OD1-CB 3.18Å; N351-S353 PolarHBondContact OD1-N 3.43Å; N351-S353 PolarHBondContact OD1-OG 2.82Å
354	K	90.4	Very high	90.8	Very high	106 Å²	106	54.5 Å²	54.5	46%	0.461	30%	0.295	S	S	.	.	G	3₁₀ helix	trans	-89.6	-15.2	175.6	-63.3	-59.8	-176.5	-177.6	0	112.9	S332 N351 P352 T356	S332-K354 CarbonylContact O-C 3.47Å; N351-K354 HydrophobicContact CB-CB 4.45Å; N351-K354 HydrophobicContact CB-CG 3.95Å; N351-K354 WeakPolarHBondContact O-CB 3.16Å; N351-K354 PolarHBondContact O-N 3Å; P352-K354 PolarHBondContact O-N 2.93Å; P352-K354 VanDerWaalsContact O-N 3.16Å; K354-T356 PolarHBondContact O-N 3.37Å
355	I	91.6	Very high	90.5	Very high	13 Å²	13	56.8 Å²	56.8	7%	0.067	31%	0.306	C	S	.	.			trans	-60.6	124.4	179.6	-58.3	171.6	0	0	0	109.5	Y75 I218 L290 P291 S332 F350 P352	Y75-I355 HydrophobicContact CD1-CD1 3.83Å; Y75-I355 HydrophobicContact CE1-CD1 3.68Å; Y75-I355 HydrophobicContact CE1-CG1 4.04Å; I218-I355 HydrophobicContact CD1-CB 4.25Å; I218-I355 HydrophobicContact CD1-CD1 3.72Å; I218-I355 HydrophobicContact CD1-CG2 3.98Å; I218-I355 HydrophobicContact CG1-CB 4.16Å; I218-I355 HydrophobicContact CG1-CD1 4.18Å; I218-I355 HydrophobicContact CG1-CG2 4.27Å; I218-I355 HydrophobicContact CG2-CB 4.17Å; I218-I355 HydrophobicContact CG2-CG2 3.82Å; L290-I355 HydrophobicContact CD2-CD1 4.17Å; P291-I355 HydrophobicContact CG-CG2 4.39Å; S332-I355 VanDerWaalsContact O-CA 3.22Å; S332-I355 WeakPolarHBondContact O-CA 3.38Å; S332-I355 PolarHBondContact O-N 2.76Å; F350-I355 HydrophobicContact CE2-CD1 4.17Å; F350-I355 HydrophobicContact CZ-CD1 4Å; P352-I355 HydrophobicContact CB-CD1 4.43Å; P352-I355 WeakPolarHBondContact O-CB 3.29Å; P352-I355 WeakPolarHBondContact O-CG1 3.48Å; P352-I355 PolarHBondContact O-N 3.43Å; P352-I355 VanDerWaalsContact O-N 3.11Å
356	T	89.9	Confident	90.4	Very high	59 Å²	59	59.1 Å²	59.1	36%	0.362	32%	0.315	S	S	.	.			trans	-75.3	153.2	177.8	60.1	0	0	0	0	111.4	P291 K354	P291-T356 VanDerWaalsContact CG-O 3.29Å; P291-T356 WeakPolarHBondContact CG-O 3.3Å; K354-T356 PolarHBondContact O-N 3.37Å
357	T	90.3	Very high	90.3	Very high	61 Å²	61	59.7 Å²	59.7	37%	0.374	32%	0.318	S	S	.	.	S	Bend	trans	-88.5	-17.7	177.4	52.3	0	0	0	0	113.8	I218 F219	I218-T357 HydrophobicContact CG2-CG2 4.26Å; I218-T357 WeakPolarHBondContact O-CG2 3.48Å; F219-T357 HydrophobicContact CD1-CG2 3.97Å; F219-T357 HydrophobicContact CE1-CG2 4.13Å; F219-T357 HydrophobicContact CG-CG2 4.18Å; F219-T357 HydrophobicContact CZ-CG2 4.47Å; F219-T357 WeakPolarHBondContact CZ-O 3.41Å
358	H	87.9	Confident	90.3	Very high	145 Å²	145	61 Å²	61	67%	0.671	33%	0.328	S	S	*	.	S	Bend	trans	-73.5	152.3	175.5	-53.8	-63.2	0	0	0	111.5	P291 A360	P291-H358 WeakPolarHBondContact CB-O 3.32Å; H358-A360 PolarHBondContact O-N 3.35Å
359	S	86.2	Confident	90.4	Very high	51 Å²	51	61.3 Å²	61.3	36%	0.357	32%	0.321	S	S	.	.			trans	-53.7	136.7	174.7	-57.8	0	0	0	0	111.6	L292 M294 L361	L292-S359 CarbonylContact O-C 3.35Å; L292-S359 WeakPolarHBondContact O-CA 3.49Å; M294-S359 WeakPolarHBondContact CE-OG 3.37Å; M294-S359 WeakPolarHBondContact SD-CB 3.49Å; M294-S359 PolarHBondContact SD-OG 2.9Å; M294-S359 VanDerWaalsContact SD-OG 3.36Å; S359-L361 PolarHBondContact O-N 3.12Å
360	A	85.6	Confident	90.5	Very high	3 Å²	3	58.2 Å²	58.2	3%	0.025	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.6	110.2	179.7	0	0	0	0	0	109.3	L292 L293 M294 C330 H358 L362	L292-A360 PolarHBondContact O-N 3.13Å; L293-A360 WeakPolarHBondContact CA-O 3.45Å; L293-A360 HydrophobicContact CD1-CB 3.91Å; M294-A360 PolarHBondContact N-O 2.9Å; C330-A360 HydrophobicContact CB-CB 4.17Å; H358-A360 PolarHBondContact O-N 3.35Å; A360-L362 PolarHBondContact O-N 2.91Å
361	L	86.7	Confident	90.6	Very high	97 Å²	97	58.5 Å²	58.5	51%	0.508	31%	0.308	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.7	119.8	174.1	-59.7	175.6	0	0	0	109.2	M294 N295 C330 S359	M294-L361 HydrophobicContact CB-CD2 4.04Å; N295-L361 WeakPolarHBondContact O-CD2 3.46Å; C330-L361 PolarHBondContact SG-O 3.19Å; S359-L361 PolarHBondContact O-N 3.12Å
362	L	87.5	Confident	90.9	Very high	4 Å²	4	59.1 Å²	59.1	2%	0.021	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	126.6	176.4	-178.1	73.8	0	0	0	109.9	L67 L293 M294 S296 L301 I326 A360 L364	L67-L362 HydrophobicContact CD2-CD2 3.24Å; L67-L362 HydrophobicContact CG-CD2 4.43Å; L293-L362 HydrophobicContact CD1-CB 4.02Å; L293-L362 HydrophobicContact CD2-CD2 4.08Å; L293-L362 HydrophobicContact CG-CB 4.13Å; M294-L362 WeakPolarHBondContact O-CB 3.34Å; M294-L362 PolarHBondContact O-N 3.39Å; S296-L362 PolarHBondContact N-O 3.2Å; L301-L362 HydrophobicContact CD1-CB 4.48Å; L301-L362 HydrophobicContact CD1-CD2 3.87Å; I326-L362 HydrophobicContact CD1-CD1 4.32Å; I326-L362 HydrophobicContact CG1-CD1 4Å; A360-L362 PolarHBondContact O-N 2.91Å; L362-L364 HydrophobicContact CD2-CD1 4.29Å; L362-L364 HydrophobicContact CD2-CD2 3.73Å; L362-L364 HydrophobicContact CD2-CG 3.75Å; L362-L364 HydrophobicContact CG-CD2 4.2Å; L362-L364 HydrophobicContact CG-CG 4.13Å
363	D	87.2	Confident	91.3	Very high	41 Å²	41	60.1 Å²	60.1	22%	0.219	31%	0.311	C	S	.	.			trans	-110.7	85.6	179.4	-175.3	2	0	0	0	109.6	E365 K366	D363-E365 PolarHBondContact O-N 2.92Å; D363-E365 WeakPolarHBondContact OD1-CB 3.37Å; D363-E365 PolarHBondContact OD1-N 2.81Å; D363-K366 HydrophobicContact CB-CD 4.37Å; D363-K366 PolarHBondContact O-N 2.91Å; D363-K366 WeakPolarHBondContact OD2-CD 3.46Å; D363-K366 WeakPolarHBondContact OD2-CE 3.22Å; D363-K366 IonicContact OD2-NZ 3.42Å; D363-K366 PolarHBondContact OD2-NZ 2.84Å
364	L	89.2	Confident	91.7	Very high	55 Å²	55	56.2 Å²	56.2	29%	0.288	28%	0.283	S	S	.	.	G	3₁₀ helix	trans	-66.4	-16.3	-179.1	-74.6	176.9	0	0	0	113	L67 F313 L362 K366 L367	L67-L364 HydrophobicContact CD2-CD2 4.08Å; F313-L364 HydrophobicContact CE1-CD2 4.42Å; F313-L364 HydrophobicContact CZ-CD1 4.3Å; F313-L364 HydrophobicContact CZ-CD2 4.22Å; L362-L364 HydrophobicContact CD2-CD1 4.29Å; L362-L364 HydrophobicContact CD2-CD2 3.73Å; L362-L364 HydrophobicContact CD2-CG 3.75Å; L362-L364 HydrophobicContact CG-CD2 4.2Å; L362-L364 HydrophobicContact CG-CG 4.13Å; L364-K366 PolarHBondContact O-N 3.26Å; L364-L367 HydrophobicContact CD2-CD2 4.34Å; L364-L367 WeakPolarHBondContact O-CB 3.11Å; L364-L367 PolarHBondContact O-N 3.42Å
365	E	90.4	Very high	92.1	Very high	169 Å²	169	51.2 Å²	51.2	79%	0.79	26%	0.261	S	S	*	.	G	3₁₀ helix	trans	-63.4	-22	174	-59.1	-174.5	168.7	0	0	111.9	D363 P368	D363-E365 PolarHBondContact O-N 2.92Å; D363-E365 WeakPolarHBondContact OD1-CB 3.37Å; D363-E365 PolarHBondContact OD1-N 2.81Å; E365-P368 WeakPolarHBondContact O-CD 3.18Å
366	K	92.1	Very high	92.3	Very high	101 Å²	101	53.5 Å²	53.5	44%	0.439	27%	0.272	S	S	.	.	G	3₁₀ helix	trans	-83.6	-12.6	174.4	-68.3	178.1	176.5	132.4	0	113.9	D363 L364 P368 E369 F370	D363-K366 HydrophobicContact CB-CD 4.37Å; D363-K366 PolarHBondContact O-N 2.91Å; D363-K366 WeakPolarHBondContact OD2-CD 3.46Å; D363-K366 WeakPolarHBondContact OD2-CE 3.22Å; D363-K366 IonicContact OD2-NZ 3.42Å; D363-K366 PolarHBondContact OD2-NZ 2.84Å; L364-K366 PolarHBondContact O-N 3.26Å; K366-P368 VanDerWaalsContact C-N 3.31Å; K366-E369 WeakPolarHBondContact O-CB 3.46Å; K366-E369 PolarHBondContact O-N 3.25Å; K366-F370 HydrophobicContact CB-CD2 4.25Å; K366-F370 HydrophobicContact CB-CE2 4.13Å; K366-F370 WeakPolarHBondContact O-CD2 3.28Å; K366-F370 PolarHBondContact O-N 2.99Å
367	L	94	Very high	92.7	Very high	13 Å²	13	52.5 Å²	52.5	7%	0.068	26%	0.263	C	S	.	.	H	α-helix	trans	-53.2	-39.8	-176.9	-177.7	59.8	0	0	0	113.8	F313 V318 A322 L323 I326 L364 E369 F370 N371	F313-L367 HydrophobicContact CD1-CD2 3.67Å; F313-L367 HydrophobicContact CE1-CD2 3.52Å; V318-L367 HydrophobicContact CG1-CD1 3.93Å; V318-L367 HydrophobicContact CG1-CD2 4.13Å; V318-L367 HydrophobicContact CG1-CG 4.21Å; V318-L367 HydrophobicContact CG2-CD2 4.1Å; A322-L367 HydrophobicContact CB-CD1 4.45Å; L323-L367 HydrophobicContact CD2-CD1 4.06Å; L323-L367 HydrophobicContact CD2-CD2 4.18Å; I326-L367 HydrophobicContact CD1-CB 4.06Å; I326-L367 HydrophobicContact CD1-CD1 4.25Å; I326-L367 HydrophobicContact CG2-CD1 4.18Å; L364-L367 HydrophobicContact CD2-CD2 4.34Å; L364-L367 WeakPolarHBondContact O-CB 3.11Å; L364-L367 PolarHBondContact O-N 3.42Å; L367-E369 VanDerWaalsContact C-N 3.26Å; L367-E369 PolarHBondContact O-N 3.19Å; L367-F370 PolarHBondContact O-N 2.92Å; L367-N371 WeakPolarHBondContact O-CB 3.38Å; L367-N371 PolarHBondContact O-N 2.89Å
368	P	95.8	Very high	93	Very high	62 Å²	62	51.6 Å²	51.6	40%	0.403	25%	0.253	S	S	.	.	H	α-helix	trans	-59.7	-34.1	175.4	-24.2	35.3	0	0	0	113.5	E365 K366 N371 R372 T427	E365-P368 WeakPolarHBondContact O-CD 3.18Å; K366-P368 VanDerWaalsContact C-N 3.31Å; P368-N371 PolarHBondContact O-N 2.81Å; P368-R372 VanDerWaalsContact O-CB 3.3Å; P368-R372 WeakPolarHBondContact O-CB 3.46Å; P368-R372 PolarHBondContact O-N 3.16Å; P368-T427 HydrophobicContact CB-CG2 3.91Å
369	E	96.1	Very high	93.4	Very high	85 Å²	85	44.8 Å²	44.8	40%	0.397	22%	0.221	S	C	.	.	H	α-helix	trans	-68.9	-44.5	176	-176	178.3	-165.6	0	0	111.6	I339 K366 L367 N371 R372 I373	I339-E369 HydrophobicContact CD1-CG 4.41Å; K366-E369 WeakPolarHBondContact O-CB 3.46Å; K366-E369 PolarHBondContact O-N 3.25Å; L367-E369 VanDerWaalsContact C-N 3.26Å; L367-E369 PolarHBondContact O-N 3.19Å; E369-N371 VanDerWaalsContact C-N 3.32Å; E369-N371 PolarHBondContact O-N 3.21Å; E369-R372 PolarHBondContact O-N 3.11Å; E369-I373 HydrophobicContact CG-CD1 4.19Å; E369-I373 WeakPolarHBondContact O-CG1 3.46Å; E369-I373 PolarHBondContact O-N 3.28Å; E369-I373 VanDerWaalsContact O-N 3.11Å
370	F	96.2	Very high	93.8	Very high	2 Å²	2	47 Å²	47	1%	0.009	23%	0.226	C	C	.	.	H	α-helix	trans	-58.1	-47.5	172.9	-79.8	-105.9	0	0	0	110.4	A322 D325 I326 N329 I339 K366 L367 R372 I373 H374	A322-F370 HydrophobicContact CB-CB 4.17Å; D325-F370 HydrophobicContact CB-CD1 3.91Å; D325-F370 HydrophobicContact CB-CE1 4.2Å; D325-F370 WeakPolarHBondContact OD2-CD1 3.32Å; I326-F370 HydrophobicContact CB-CD1 3.88Å; I326-F370 HydrophobicContact CB-CD2 4.4Å; I326-F370 HydrophobicContact CB-CE1 3.98Å; I326-F370 HydrophobicContact CB-CE2 4.48Å; I326-F370 HydrophobicContact CB-CG 4.11Å; I326-F370 HydrophobicContact CB-CZ 4.28Å; I326-F370 HydrophobicContact CD1-CD2 4.22Å; I326-F370 HydrophobicContact CD1-CE2 4.35Å; I326-F370 HydrophobicContact CG1-CD1 4.46Å; I326-F370 HydrophobicContact CG1-CD2 4.21Å; I326-F370 HydrophobicContact CG1-CE1 4.31Å; I326-F370 HydrophobicContact CG1-CE2 4.03Å; I326-F370 HydrophobicContact CG1-CG 4.42Å; I326-F370 HydrophobicContact CG1-CZ 4.09Å; N329-F370 HydrophobicContact CB-CE1 4.19Å; N329-F370 HydrophobicContact CB-CZ 4.07Å; I339-F370 HydrophobicContact CB-CE1 4.3Å; I339-F370 HydrophobicContact CB-CZ 4.4Å; I339-F370 HydrophobicContact CD1-CD2 4.29Å; I339-F370 HydrophobicContact CD1-CE2 3.83Å; I339-F370 HydrophobicContact CD1-CZ 4.1Å; I339-F370 HydrophobicContact CG1-CE1 4.09Å; I339-F370 HydrophobicContact CG1-CE2 3.97Å; I339-F370 HydrophobicContact CG1-CZ 3.7Å; I339-F370 HydrophobicContact CG2-CB 4.37Å; I339-F370 HydrophobicContact CG2-CD1 3.6Å; I339-F370 HydrophobicContact CG2-CD2 4.11Å; I339-F370 HydrophobicContact CG2-CE1 3.78Å; I339-F370 HydrophobicContact CG2-CE2 4.29Å; I339-F370 HydrophobicContact CG2-CG 3.77Å; I339-F370 HydrophobicContact CG2-CZ 4.13Å; K366-F370 HydrophobicContact CB-CD2 4.25Å; K366-F370 HydrophobicContact CB-CE2 4.13Å; K366-F370 WeakPolarHBondContact O-CD2 3.28Å; K366-F370 PolarHBondContact O-N 2.99Å; L367-F370 PolarHBondContact O-N 2.92Å; F370-R372 PolarHBondContact O-N 3.19Å; F370-I373 PolarHBondContact O-N 3.37Å; F370-H374 PolarHBondContact O-CD2 3.26Å; F370-H374 VanDerWaalsContact O-CD2 3.22Å; F370-H374 PolarHBondContact O-N 3.27Å
371	N	97.6	Very high	94.4	Very high	5 Å²	5	49.3 Å²	49.3	3%	0.027	24%	0.238	C	C	.	.	H	α-helix	trans	-61.6	-43.2	-178.7	-148.2	49.8	0	0	0	112.2	G317 V318 L319 A322 L367 P368 E369 I373 H374 L375 T427	G317-N371 PolarHBondContact O-ND2 3.31Å; V318-N371 WeakPolarHBondContact CA-OD1 3.31Å; L319-N371 WeakPolarHBondContact CB-OD1 3.41Å; L319-N371 PolarHBondContact N-OD1 2.86Å; A322-N371 HydrophobicContact CB-CB 4.21Å; A322-N371 WeakPolarHBondContact CB-OD1 3.18Å; L367-N371 WeakPolarHBondContact O-CB 3.38Å; L367-N371 PolarHBondContact O-N 2.89Å; P368-N371 PolarHBondContact O-N 2.81Å; E369-N371 VanDerWaalsContact C-N 3.32Å; E369-N371 PolarHBondContact O-N 3.21Å; N371-I373 PolarHBondContact O-N 3.19Å; N371-H374 PolarHBondContact O-N 3.06Å; N371-L375 WeakPolarHBondContact O-CB 3.38Å; N371-L375 PolarHBondContact O-N 2.56Å; N371-T427 WeakPolarHBondContact CB-O 3.48Å; N371-T427 PolarHBondContact ND2-O 3.03Å
372	R	97.6	Very high	94.7	Very high	70 Å²	70	50.3 Å²	50.3	26%	0.264	24%	0.24	S	C	.	.	H	α-helix	trans	-59.1	-44.2	175.9	-177.4	176.5	71.4	78.1	9.2	112.7	P368 E369 F370 L375 Q376 G424 I426 T427	P368-R372 VanDerWaalsContact O-CB 3.3Å; P368-R372 WeakPolarHBondContact O-CB 3.46Å; P368-R372 PolarHBondContact O-N 3.16Å; E369-R372 PolarHBondContact O-N 3.11Å; F370-R372 PolarHBondContact O-N 3.19Å; R372-L375 PolarHBondContact O-N 3.34Å; R372-Q376 WeakPolarHBondContact O-CB 3.32Å; R372-Q376 PolarHBondContact O-N 3.23Å; R372-G424 WeakPolarHBondContact CD-O 3.49Å; R372-G424 PolarHBondContact NH1-O 2.9Å; R372-I426 WeakPolarHBondContact CG-O 3.16Å; R372-T427 HydrophobicContact CB-CG2 4.23Å
373	I	97.2	Very high	95.1	Very high	34 Å²	34	57.8 Å²	57.8	17%	0.174	28%	0.275	C	S	.	.	H	α-helix	trans	-66.5	-45.5	179.7	-71.6	166.3	0	0	0	110.5	I339 E369 F370 N371 L375 Q376 Q377	I339-I373 HydrophobicContact CB-CD1 3.89Å; I339-I373 HydrophobicContact CG2-CB 4.36Å; I339-I373 HydrophobicContact CG2-CD1 3.43Å; I339-I373 VanDerWaalsContact CG2-CD1 3.43Å; I339-I373 HydrophobicContact CG2-CG1 4.46Å; I339-I373 HydrophobicContact CG2-CG2 4.49Å; E369-I373 HydrophobicContact CG-CD1 4.19Å; E369-I373 WeakPolarHBondContact O-CG1 3.46Å; E369-I373 PolarHBondContact O-N 3.28Å; E369-I373 VanDerWaalsContact O-N 3.11Å; F370-I373 PolarHBondContact O-N 3.37Å; N371-I373 PolarHBondContact O-N 3.19Å; I373-L375 PolarHBondContact O-N 3.04Å; I373-Q376 WeakPolarHBondContact O-CB 3.4Å; I373-Q376 PolarHBondContact O-N 3.37Å; I373-Q377 WeakPolarHBondContact O-CG 3.4Å; I373-Q377 PolarHBondContact O-N 2.93Å
374	H	97.3	Very high	95.5	Very high	4 Å²	4	59.5 Å²	59.5	2%	0.019	28%	0.28	C	S	.	.	H	α-helix	trans	-66.5	-36.7	176.9	-78.2	-71.1	0	0	0	112.6	L319 E321 A322 D325 R341 F370 N371 Q377 R378	L319-H374 HydrophobicContact CD1-CB 3.96Å; E321-H374 HydrophobicContact CB-CB 4.35Å; E321-H374 WeakPolarHBondContact CB-ND1 3.25Å; A322-H374 VanDerWaalsContact CA-CD2 3.47Å; A322-H374 WeakPolarHBondContact CA-CD2 3.36Å; A322-H374 HydrophobicContact CB-CB 4.45Å; D325-H374 WeakPolarHBondContact CB-NE2 3.38Å; D325-H374 IonicContact OD2-CD2 2.73Å; D325-H374 IonicContact OD2-CE1 3.26Å; D325-H374 IonicContact OD2-NE2 3.77Å; D325-H374 PolarHBondContact OD2-NE2 3.18Å; R341-H374 PolarHBondContact O-CE1 2.99Å; F370-H374 PolarHBondContact O-CD2 3.26Å; F370-H374 VanDerWaalsContact O-CD2 3.22Å; F370-H374 PolarHBondContact O-N 3.27Å; N371-H374 PolarHBondContact O-N 3.06Å; H374-Q377 PolarHBondContact O-N 2.8Å; H374-R378 WeakPolarHBondContact O-CG 3.27Å; H374-R378 PolarHBondContact O-N 3.29Å
375	L	97.6	Very high	95.9	Very high	2 Å²	2	57 Å²	57	1%	0.01	27%	0.267	C	S	.	.	H	α-helix	trans	-64	-42.9	174.5	-177.3	58.3	0	0	0	111.2	L319 N371 R372 I373 Q377 R378 I379 L388 I426 L429	L319-L375 HydrophobicContact CD1-CB 3.85Å; L319-L375 HydrophobicContact CD1-CD1 4.34Å; N371-L375 WeakPolarHBondContact O-CB 3.38Å; N371-L375 PolarHBondContact O-N 2.56Å; R372-L375 PolarHBondContact O-N 3.34Å; I373-L375 PolarHBondContact O-N 3.04Å; L375-Q377 VanDerWaalsContact C-N 3.32Å; L375-Q377 PolarHBondContact O-N 3.14Å; L375-R378 PolarHBondContact O-N 3.46Å; L375-I379 HydrophobicContact CD1-CD1 4.36Å; L375-I379 HydrophobicContact CG-CD1 4.06Å; L375-I379 VanDerWaalsContact O-CG1 3.29Å; L375-I379 WeakPolarHBondContact O-CG1 3.38Å; L375-I379 PolarHBondContact O-N 2.93Å; L375-L388 HydrophobicContact CD1-CD1 3.84Å; L375-L388 HydrophobicContact CD1-CD2 4.03Å; L375-I426 HydrophobicContact CD2-CD1 3.87Å; L375-I426 HydrophobicContact CD2-CG1 3.79Å; L375-L429 HydrophobicContact CD1-CD2 4.12Å; L375-L429 HydrophobicContact CD1-CG 4.34Å
376	Q	97.1	Very high	96.1	Very high	61 Å²	61	51.3 Å²	51.3	29%	0.285	25%	0.246	S	C	.	.	H	α-helix	trans	-56.7	-46.7	172.9	167.9	169.7	8.9	0	0	111.6	R372 I373 R378 I379 E380 K423	R372-Q376 WeakPolarHBondContact O-CB 3.32Å; R372-Q376 PolarHBondContact O-N 3.23Å; I373-Q376 WeakPolarHBondContact O-CB 3.4Å; I373-Q376 PolarHBondContact O-N 3.37Å; Q376-R378 VanDerWaalsContact C-N 3.32Å; Q376-R378 PolarHBondContact O-N 3.19Å; Q376-I379 PolarHBondContact O-N 3.23Å; Q376-E380 WeakPolarHBondContact CG-OE1 3.17Å; Q376-E380 PolarHBondContact NE2-OE1 2.87Å; Q376-E380 WeakPolarHBondContact O-CG 3.36Å; Q376-E380 PolarHBondContact O-N 3.06Å; Q376-E380 VanDerWaalsContact O-N 3.08Å; Q376-K423 HydrophobicContact CB-CG 4.03Å; Q376-K423 HydrophobicContact CG-CD 3.92Å; Q376-K423 HydrophobicContact CG-CG 3.76Å
377	Q	96.3	Very high	96.3	Very high	38 Å²	38	50 Å²	50	18%	0.178	25%	0.246	C	C	.	.	H	α-helix	trans	-62.6	-38.5	177.9	-67.5	-177.8	16.2	0	0	112.3	G340 I373 H374 L375 E380 D381	G340-Q377 PolarHBondContact O-NE2 3.16Å; I373-Q377 WeakPolarHBondContact O-CG 3.4Å; I373-Q377 PolarHBondContact O-N 2.93Å; H374-Q377 PolarHBondContact O-N 2.8Å; L375-Q377 VanDerWaalsContact C-N 3.32Å; L375-Q377 PolarHBondContact O-N 3.14Å; Q377-E380 PolarHBondContact O-N 3.44Å; Q377-D381 PolarHBondContact O-N 2.96Å
378	R	96.7	Very high	96.4	Very high	41 Å²	41	49.4 Å²	49.4	16%	0.155	24%	0.243	C	C	.	.	H	α-helix	trans	-67.4	-34.2	175.6	-72.6	-167.6	172.6	-162.7	1.4	112.8	E321 H374 L375 Q376 E380 D381 K384 C385 L388	E321-R378 IonicContact OE1-CZ 3.01Å; E321-R378 VanDerWaalsContact OE1-CZ 3.28Å; E321-R378 IonicContact OE1-NE 2.73Å; E321-R378 PolarHBondContact OE1-NE 2.6Å; E321-R378 IonicContact OE1-NH2 3.21Å; E321-R378 PolarHBondContact OE1-NH2 2.94Å; E321-R378 IonicContact OE2-CZ 2.72Å; E321-R378 IonicContact OE2-NE 2.83Å; E321-R378 PolarHBondContact OE2-NE 2.79Å; E321-R378 IonicContact OE2-NH2 3.02Å; E321-R378 PolarHBondContact OE2-NH2 3.44Å; H374-R378 WeakPolarHBondContact O-CG 3.27Å; H374-R378 PolarHBondContact O-N 3.29Å; L375-R378 PolarHBondContact O-N 3.46Å; Q376-R378 VanDerWaalsContact C-N 3.32Å; Q376-R378 PolarHBondContact O-N 3.19Å; R378-E380 VanDerWaalsContact C-N 3.32Å; R378-D381 PolarHBondContact O-N 3.49Å; R378-D381 VanDerWaalsContact O-O 3.12Å; R378-K384 HydrophobicContact CB-CB 4.08Å; R378-K384 HydrophobicContact CG-CB 4.21Å; R378-K384 HydrophobicContact CG-CD 3.94Å; R378-K384 CarbonylContact O-C 3.51Å; R378-C385 PolarHBondContact O-N 3.2Å; R378-C385 VanDerWaalsContact O-N 3.12Å; R378-L388 HydrophobicContact CB-CD1 3.67Å; R378-L388 HydrophobicContact CB-CG 4.32Å
379	I	96.9	Very high	96.5	Very high	3 Å²	3	47.1 Å²	47.1	2%	0.015	23%	0.227	C	C	.	.	H	α-helix	trans	-69.3	-32.9	175.7	-67.6	164.7	0	0	0	111	L375 Q376 D381 L388 L419 H420 K423	L375-I379 HydrophobicContact CD1-CD1 4.36Å; L375-I379 HydrophobicContact CG-CD1 4.06Å; L375-I379 VanDerWaalsContact O-CG1 3.29Å; L375-I379 WeakPolarHBondContact O-CG1 3.38Å; L375-I379 PolarHBondContact O-N 2.93Å; Q376-I379 PolarHBondContact O-N 3.23Å; I379-D381 VanDerWaalsContact C-N 3.35Å; I379-L388 HydrophobicContact CG1-CD1 3.67Å; I379-L419 HydrophobicContact CD1-CB 4.37Å; I379-L419 HydrophobicContact CD1-CD2 4.44Å; I379-L419 HydrophobicContact CG1-CB 4.32Å; I379-L419 HydrophobicContact CG2-CB 4.34Å; I379-H420 PolarHBondContact O-CE1 3.25Å; I379-K423 HydrophobicContact CB-CD 4.25Å; I379-K423 HydrophobicContact CB-CG 4.36Å; I379-K423 HydrophobicContact CD1-CB 4.25Å; I379-K423 HydrophobicContact CD1-CG 4.19Å; I379-K423 HydrophobicContact CG2-CB 4.39Å; I379-K423 HydrophobicContact CG2-CD 3.88Å; I379-K423 HydrophobicContact CG2-CG 4.2Å
380	E	95.9	Very high	96.5	Very high	98 Å²	98	49.8 Å²	49.8	46%	0.458	24%	0.237	S	C	.	.	H	α-helix	trans	-77.9	-18.7	178.5	-71.5	168.5	180	0	0	113.6	Q376 Q377 R378 K423	Q376-E380 WeakPolarHBondContact CG-OE1 3.17Å; Q376-E380 PolarHBondContact NE2-OE1 2.87Å; Q376-E380 WeakPolarHBondContact O-CG 3.36Å; Q376-E380 PolarHBondContact O-N 3.06Å; Q376-E380 VanDerWaalsContact O-N 3.08Å; Q377-E380 PolarHBondContact O-N 3.44Å; R378-E380 VanDerWaalsContact C-N 3.32Å; E380-K423 HydrophobicContact CG-CD 3.95Å; E380-K423 IonicContact OE1-NZ 2.81Å; E380-K423 PolarHBondContact OE1-NZ 3.4Å
381	D	96.3	Very high	96.5	Very high	50 Å²	50	52.7 Å²	52.7	27%	0.267	25%	0.253	S	S	.	.	S	Bend	trans	-92.5	118.6	176.6	-179.2	-59.7	0	0	0	110.2	Q377 R378 I379 Q383 K384 C385	Q377-D381 PolarHBondContact O-N 2.96Å; R378-D381 PolarHBondContact O-N 3.49Å; R378-D381 VanDerWaalsContact O-O 3.12Å; I379-D381 VanDerWaalsContact C-N 3.35Å; D381-Q383 VanDerWaalsContact C-N 3.31Å; D381-Q383 PolarHBondContact O-N 3.02Å; D381-Q383 PolarHBondContact OD1-N 2.93Å; D381-K384 HydrophobicContact CB-CB 4.07Å; D381-K384 HydrophobicContact CB-CD 4.31Å; D381-K384 HydrophobicContact CB-CG 4.21Å; D381-K384 PolarHBondContact O-N 3.38Å; D381-K384 PolarHBondContact OD1-N 2.83Å; D381-C385 WeakPolarHBondContact O-CB 3.5Å; D381-C385 PolarHBondContact O-N 3.21Å
382	E	94.8	Very high	96.4	Very high	118 Å²	118	52.4 Å²	52.4	55%	0.551	25%	0.252	S	S	*	.	H	α-helix	trans	-56.1	-42.3	-174.4	-170.2	66.7	-141.7	0	0	112.9	C386 R416	E382-C386 PolarHBondContact O-N 3.24Å; E382-C386 VanDerWaalsContact O-N 3.13Å; E382-C386 PolarHBondContact O-SG 3.47Å; E382-R416 IonicContact OE1-CZ 3.58Å; E382-R416 IonicContact OE1-NE 2.87Å; E382-R416 IonicContact OE1-NH2 2.98Å; E382-R416 PolarHBondContact OE1-NH2 3.24Å
383	Q	95.4	Very high	96.4	Very high	161 Å²	161	52.1 Å²	52.1	75%	0.752	25%	0.253	S	S	*	.	H	α-helix	trans	-72.8	-44.3	-176.8	-66.5	-178.8	-5.9	0	0	110.9	D381 C385 C386 V387	D381-Q383 VanDerWaalsContact C-N 3.31Å; D381-Q383 PolarHBondContact O-N 3.02Å; D381-Q383 PolarHBondContact OD1-N 2.93Å; Q383-C385 VanDerWaalsContact C-N 3.34Å; Q383-C386 WeakPolarHBondContact O-CB 3.4Å; Q383-C386 PolarHBondContact O-N 3.08Å; Q383-V387 PolarHBondContact O-N 3.05Å
384	K	95.1	Very high	96.3	Very high	78 Å²	78	55.8 Å²	55.8	34%	0.339	27%	0.269	S	S	.	.	H	α-helix	trans	-69.6	-34.5	177.9	-61	-173	-173	-172.2	0	111.6	R378 D381 C386 V387 L388	R378-K384 HydrophobicContact CB-CB 4.08Å; R378-K384 HydrophobicContact CG-CB 4.21Å; R378-K384 HydrophobicContact CG-CD 3.94Å; R378-K384 CarbonylContact O-C 3.51Å; D381-K384 HydrophobicContact CB-CB 4.07Å; D381-K384 HydrophobicContact CB-CD 4.31Å; D381-K384 HydrophobicContact CB-CG 4.21Å; D381-K384 PolarHBondContact O-N 3.38Å; D381-K384 PolarHBondContact OD1-N 2.83Å; K384-C386 VanDerWaalsContact C-N 3.33Å; K384-C386 PolarHBondContact O-N 2.86Å; K384-V387 WeakPolarHBondContact O-CB 3.25Å; K384-V387 PolarHBondContact O-N 3.41Å; K384-V387 VanDerWaalsContact O-N 3.1Å; K384-L388 WeakPolarHBondContact O-CG 3.26Å; K384-L388 PolarHBondContact O-N 3.4Å
385	C	96.6	Very high	96.1	Very high	2 Å²	2	57.4 Å²	57.4	1%	0.014	28%	0.277	C	S	.	.	H	α-helix	trans	-62.4	-40.5	174.8	-169.1	0	0	0	0	111.1	R378 D381 Q383 V387 L388 I389	R378-C385 PolarHBondContact O-N 3.2Å; R378-C385 VanDerWaalsContact O-N 3.12Å; D381-C385 WeakPolarHBondContact O-CB 3.5Å; D381-C385 PolarHBondContact O-N 3.21Å; Q383-C385 VanDerWaalsContact C-N 3.34Å; C385-V387 PolarHBondContact O-N 2.89Å; C385-L388 PolarHBondContact O-N 3.16Å; C385-L388 VanDerWaalsContact O-N 3.14Å; C385-I389 VanDerWaalsContact O-CG1 3.27Å; C385-I389 WeakPolarHBondContact O-CG1 3.35Å; C385-I389 PolarHBondContact O-N 3.11Å
386	C	96.6	Very high	96	Very high	49 Å²	49	57.3 Å²	57.3	33%	0.331	28%	0.277	S	S	.	.	H	α-helix	trans	-58.6	-34.9	172.7	-70.6	0	0	0	0	113.3	E382 Q383 K384 K390	E382-C386 PolarHBondContact O-N 3.24Å; E382-C386 VanDerWaalsContact O-N 3.13Å; E382-C386 PolarHBondContact O-SG 3.47Å; Q383-C386 WeakPolarHBondContact O-CB 3.4Å; Q383-C386 PolarHBondContact O-N 3.08Å; K384-C386 VanDerWaalsContact C-N 3.33Å; K384-C386 PolarHBondContact O-N 2.86Å; C386-K390 WeakPolarHBondContact O-CG 3.4Å; C386-K390 PolarHBondContact O-N 3.1Å
387	V	95.9	Very high	95.9	Very high	74 Å²	74	58.6 Å²	58.6	45%	0.448	28%	0.283	S	S	.	.	H	α-helix	trans	-69.7	-47.2	174	180	0	0	0	0	110.4	Q383 K384 C385 I389 K390 D391	Q383-V387 PolarHBondContact O-N 3.05Å; K384-V387 WeakPolarHBondContact O-CB 3.25Å; K384-V387 PolarHBondContact O-N 3.41Å; K384-V387 VanDerWaalsContact O-N 3.1Å; C385-V387 PolarHBondContact O-N 2.89Å; V387-I389 VanDerWaalsContact C-N 3.25Å; V387-I389 PolarHBondContact O-N 3.14Å; V387-K390 PolarHBondContact O-N 3.21Å; V387-K390 VanDerWaalsContact O-N 3.11Å; V387-D391 PolarHBondContact O-N 2.81Å
388	L	96.5	Very high	95.8	Very high	1 Å²	1	63.5 Å²	63.5	1%	0.005	31%	0.305	C	S	.	.	H	α-helix	trans	-57.6	-38.3	177	-64.4	178.5	0	0	0	112.5	L375 R378 I379 K384 C385 D391 L392 L419 L429	L375-L388 HydrophobicContact CD1-CD1 3.84Å; L375-L388 HydrophobicContact CD1-CD2 4.03Å; R378-L388 HydrophobicContact CB-CD1 3.67Å; R378-L388 HydrophobicContact CB-CG 4.32Å; I379-L388 HydrophobicContact CG1-CD1 3.67Å; K384-L388 WeakPolarHBondContact O-CG 3.26Å; K384-L388 PolarHBondContact O-N 3.4Å; C385-L388 PolarHBondContact O-N 3.16Å; C385-L388 VanDerWaalsContact O-N 3.14Å; L388-D391 PolarHBondContact O-N 3.38Å; L388-L392 VanDerWaalsContact O-CB 3.23Å; L388-L392 WeakPolarHBondContact O-CB 3.13Å; L388-L392 PolarHBondContact O-N 2.85Å; L388-L419 HydrophobicContact CB-CD1 4.07Å; L388-L429 HydrophobicContact CB-CD1 4.36Å; L388-L429 HydrophobicContact CD2-CD1 3.78Å; L388-L429 HydrophobicContact CD2-CG 4.34Å
389	I	97.3	Very high	95.7	Very high	13 Å²	13	65 Å²	65	7%	0.067	32%	0.319	C	S	.	.	H	α-helix	trans	-60.6	-48.4	176.8	-71.6	164.1	0	0	0	110.4	C385 V387 L392 Q393 I415 R416 L419	C385-I389 VanDerWaalsContact O-CG1 3.27Å; C385-I389 WeakPolarHBondContact O-CG1 3.35Å; C385-I389 PolarHBondContact O-N 3.11Å; V387-I389 VanDerWaalsContact C-N 3.25Å; V387-I389 PolarHBondContact O-N 3.14Å; I389-L392 PolarHBondContact O-N 3.47Å; I389-Q393 VanDerWaalsContact O-CB 3.27Å; I389-Q393 WeakPolarHBondContact O-CB 3.35Å; I389-Q393 PolarHBondContact O-N 3.18Å; I389-I415 HydrophobicContact CB-CG2 4.25Å; I389-I415 HydrophobicContact CG1-CG2 4.06Å; I389-I415 HydrophobicContact CG2-CB 4.19Å; I389-I415 HydrophobicContact CG2-CD1 4.42Å; I389-I415 HydrophobicContact CG2-CG2 4.15Å; I389-R416 HydrophobicContact CD1-CB 3.77Å; I389-R416 HydrophobicContact CD1-CG 4.28Å; I389-R416 HydrophobicContact CG1-CB 4.46Å; I389-L419 HydrophobicContact CG1-CD1 3.88Å
390	K	96.8	Very high	95.5	Very high	142 Å²	142	65.6 Å²	65.6	62%	0.617	32%	0.321	S	S	*	.	H	α-helix	trans	-63.6	-44.7	178.4	-69.4	176.6	-178.2	-179.7	0	111.7	C386 V387 L392 Q393 Q394	C386-K390 WeakPolarHBondContact O-CG 3.4Å; C386-K390 PolarHBondContact O-N 3.1Å; V387-K390 PolarHBondContact O-N 3.21Å; V387-K390 VanDerWaalsContact O-N 3.11Å; K390-L392 VanDerWaalsContact C-N 3.35Å; K390-L392 PolarHBondContact O-N 2.9Å; K390-Q393 PolarHBondContact O-N 2.75Å; K390-Q394 PolarHBondContact O-N 2.72Å
391	D	95.1	Very high	95.3	Very high	62 Å²	62	64.2 Å²	64.2	33%	0.332	33%	0.326	S	S	.	.	H	α-helix	trans	-61.7	-44.2	179.2	-68.7	-9.9	0	0	0	111.4	V387 L388 Q394 Q395 L429	V387-D391 PolarHBondContact O-N 2.81Å; L388-D391 PolarHBondContact O-N 3.38Å; D391-Q394 PolarHBondContact O-N 3.22Å; D391-Q395 WeakPolarHBondContact O-CG 3.17Å; D391-Q395 PolarHBondContact O-N 3.45Å; D391-Q395 VanDerWaalsContact O-N 3.09Å; D391-Q395 PolarHBondContact O-NE2 3.06Å; D391-L429 HydrophobicContact CB-CD1 4.16Å
392	L	96.1	Very high	95	Very high	0 Å²	0	66.9 Å²	66.9	0%	0	36%	0.356	C	S	.	.	H	α-helix	trans	-69.7	-40.2	178.5	-178.8	53.9	0	0	0	111.3	L388 I389 K390 Q394 Q395 I396 I415 L419 L429 L432 V433 W441	L388-L392 VanDerWaalsContact O-CB 3.23Å; L388-L392 WeakPolarHBondContact O-CB 3.13Å; L388-L392 PolarHBondContact O-N 2.85Å; I389-L392 PolarHBondContact O-N 3.47Å; K390-L392 VanDerWaalsContact C-N 3.35Å; K390-L392 PolarHBondContact O-N 2.9Å; L392-Q394 VanDerWaalsContact C-N 3.31Å; L392-Q394 PolarHBondContact O-N 2.83Å; L392-Q395 PolarHBondContact O-N 2.82Å; L392-Q395 VanDerWaalsContact O-N 3.17Å; L392-I396 HydrophobicContact CD1-CD1 4.07Å; L392-I396 HydrophobicContact CD1-CG1 4.06Å; L392-I396 HydrophobicContact CG-CD1 3.8Å; L392-I396 HydrophobicContact CG-CG1 4.32Å; L392-I396 WeakPolarHBondContact O-CD1 3.33Å; L392-I396 WeakPolarHBondContact O-CG1 3.42Å; L392-I396 PolarHBondContact O-N 2.73Å; L392-I415 HydrophobicContact CB-CG2 4.26Å; L392-I415 HydrophobicContact CD2-CG2 3.73Å; L392-I415 HydrophobicContact CG-CG2 4.17Å; L392-L419 HydrophobicContact CD2-CD2 3.9Å; L392-L419 HydrophobicContact CD2-CG 4.27Å; L392-L429 HydrophobicContact CB-CD1 4.48Å; L392-L432 HydrophobicContact CD1-CB 4.1Å; L392-L432 HydrophobicContact CD2-CD1 3.58Å; L392-V433 HydrophobicContact CD1-CG1 3.93Å; L392-W441 HydrophobicContact CD2-CH2 4.18Å; L392-W441 HydrophobicContact CD2-CZ2 4.4Å
393	Q	96.1	Very high	94.8	Very high	63 Å²	63	66.4 Å²	66.4	29%	0.294	35%	0.353	S	S	.	.	H	α-helix	trans	-56.6	-45.1	174.6	-170.6	-175.8	14.8	0	0	111.4	I389 K390 I396 Q397 L410 I415	I389-Q393 VanDerWaalsContact O-CB 3.27Å; I389-Q393 WeakPolarHBondContact O-CB 3.35Å; I389-Q393 PolarHBondContact O-N 3.18Å; K390-Q393 PolarHBondContact O-N 2.75Å; Q393-I396 PolarHBondContact O-N 2.87Å; Q393-Q397 WeakPolarHBondContact O-CG 3.21Å; Q393-Q397 PolarHBondContact O-N 2.91Å; Q393-L410 HydrophobicContact CG-CB 4.43Å; Q393-L410 HydrophobicContact CG-CD2 4.3Å; Q393-L410 PolarHBondContact NE2-O 2.85Å; Q393-I415 HydrophobicContact CB-CD1 3.72Å; Q393-I415 HydrophobicContact CG-CD1 4.11Å
394	Q	95.3	Very high	94.6	Very high	111 Å²	111	60.1 Å²	60.1	52%	0.519	33%	0.325	S	S	.	.	H	α-helix	trans	-63.7	-43.3	176.5	-172.4	-179.6	8.6	0	0	111.7	K390 D391 L392 Q397 Q398	K390-Q394 PolarHBondContact O-N 2.72Å; D391-Q394 PolarHBondContact O-N 3.22Å; L392-Q394 VanDerWaalsContact C-N 3.31Å; L392-Q394 PolarHBondContact O-N 2.83Å; Q394-Q397 PolarHBondContact O-N 2.99Å; Q394-Q398 VanDerWaalsContact O-CG 3.29Å; Q394-Q398 WeakPolarHBondContact O-CG 3.26Å; Q394-Q398 PolarHBondContact O-N 2.74Å
395	Q	94.9	Very high	94.4	Very high	39 Å²	39	61.3 Å²	61.3	18%	0.182	33%	0.331	C	S	.	.	H	α-helix	trans	-63.4	-42	177.2	-72.9	174.9	62.4	0	0	112.1	D391 L392 Q397 Q398 V399 V433	D391-Q395 WeakPolarHBondContact O-CG 3.17Å; D391-Q395 PolarHBondContact O-N 3.45Å; D391-Q395 VanDerWaalsContact O-N 3.09Å; D391-Q395 PolarHBondContact O-NE2 3.06Å; L392-Q395 PolarHBondContact O-N 2.82Å; L392-Q395 VanDerWaalsContact O-N 3.17Å; Q395-Q397 PolarHBondContact O-N 3.07Å; Q395-Q398 PolarHBondContact O-N 3.46Å; Q395-V399 WeakPolarHBondContact O-CG2 3.33Å; Q395-V399 PolarHBondContact O-N 2.99Å; Q395-V433 HydrophobicContact CB-CG1 3.97Å
396	I	95.3	Very high	94	Very high	0 Å²	0	63.2 Å²	63.2	0%	0	34%	0.341	C	S	.	.	H	α-helix	trans	-61.6	-45.6	176.4	-66.2	158.2	0	0	0	110.1	L392 Q393 Q398 V399 Y400 I404 L410 I415 V433 W441	L392-I396 HydrophobicContact CD1-CD1 4.07Å; L392-I396 HydrophobicContact CD1-CG1 4.06Å; L392-I396 HydrophobicContact CG-CD1 3.8Å; L392-I396 HydrophobicContact CG-CG1 4.32Å; L392-I396 WeakPolarHBondContact O-CD1 3.33Å; L392-I396 WeakPolarHBondContact O-CG1 3.42Å; L392-I396 PolarHBondContact O-N 2.73Å; Q393-I396 PolarHBondContact O-N 2.87Å; I396-Q398 VanDerWaalsContact C-N 3.33Å; I396-Q398 PolarHBondContact O-N 3.31Å; I396-V399 PolarHBondContact O-N 2.89Å; I396-Y400 HydrophobicContact CG2-CD2 4.35Å; I396-Y400 PolarHBondContact O-N 2.99Å; I396-I404 HydrophobicContact CG2-CD1 3.89Å; I396-L410 HydrophobicContact CB-CD2 4.09Å; I396-L410 HydrophobicContact CG2-CD2 3.6Å; I396-I415 HydrophobicContact CD1-CD1 4.28Å; I396-I415 HydrophobicContact CD1-CG1 4.49Å; I396-V433 HydrophobicContact CG1-CG1 3.9Å; I396-W441 HydrophobicContact CD1-CD2 3.72Å; I396-W441 HydrophobicContact CD1-CE3 3.46Å; I396-W441 VanDerWaalsContact CD1-CE3 3.46Å; I396-W441 HydrophobicContact CD1-CH2 3.63Å; I396-W441 HydrophobicContact CD1-CZ2 3.89Å; I396-W441 HydrophobicContact CD1-CZ3 3.4Å; I396-W441 VanDerWaalsContact CD1-CZ3 3.4Å; I396-W441 HydrophobicContact CG1-CD2 3.88Å; I396-W441 HydrophobicContact CG1-CE3 4.13Å; I396-W441 HydrophobicContact CG1-CG 4.28Å; I396-W441 HydrophobicContact CG1-CZ2 4.33Å; I396-W441 HydrophobicContact CG1-CZ3 4.44Å; I396-W441 HydrophobicContact CG2-CB 4.11Å; I396-W441 HydrophobicContact CG2-CD2 4.31Å; I396-W441 HydrophobicContact CG2-CE3 4.47Å; I396-W441 HydrophobicContact CG2-CG 4.15Å
397	Q	94.1	Very high	93.6	Very high	88 Å²	88	69.1 Å²	69.1	41%	0.411	36%	0.362	S	S	.	.	H	α-helix	trans	-62.7	-39.2	176.8	-72.8	176.9	1	0	0	112	Q393 Q394 Q395 V399 A401 L410	Q393-Q397 WeakPolarHBondContact O-CG 3.21Å; Q393-Q397 PolarHBondContact O-N 2.91Å; Q394-Q397 PolarHBondContact O-N 2.99Å; Q395-Q397 PolarHBondContact O-N 3.07Å; Q397-V399 PolarHBondContact O-N 3.4Å; Q397-A401 WeakPolarHBondContact O-CB 3.48Å; Q397-A401 PolarHBondContact O-N 3.48Å; Q397-L410 HydrophobicContact CG-CD1 4.08Å; Q397-L410 HydrophobicContact CG-CD2 4.05Å
398	Q	94.2	Very high	93.3	Very high	140 Å²	140	71.3 Å²	71.3	65%	0.654	37%	0.367	S	S	*	.	H	α-helix	trans	-65.1	-37.9	177.4	-75.3	172.8	-3.6	0	0	112.9	Q394 Q395 I396	Q394-Q398 VanDerWaalsContact O-CG 3.29Å; Q394-Q398 WeakPolarHBondContact O-CG 3.26Å; Q394-Q398 PolarHBondContact O-N 2.74Å; Q395-Q398 PolarHBondContact O-N 3.46Å; I396-Q398 VanDerWaalsContact C-N 3.33Å; I396-Q398 PolarHBondContact O-N 3.31Å
399	V	94.5	Very high	92.9	Very high	72 Å²	72	71.9 Å²	71.9	44%	0.436	37%	0.371	S	S	.	.	H	α-helix	trans	-89.4	-40	-174.2	179.9	0	0	0	0	112.2	Q395 I396 Q397 V433	Q395-V399 WeakPolarHBondContact O-CG2 3.33Å; Q395-V399 PolarHBondContact O-N 2.99Å; I396-V399 PolarHBondContact O-N 2.89Å; Q397-V399 PolarHBondContact O-N 3.4Å; V399-V433 HydrophobicContact CG2-CB 4.26Å; V399-V433 HydrophobicContact CG2-CG2 4.34Å
400	Y	93.9	Very high	92.7	Very high	16 Å²	16	72.5 Å²	72.5	6%	0.063	37%	0.374	C	S	.	.	H	α-helix	trans	-121.3	9.1	-166.8	-59.1	-64.5	0	0	0	114.7	I396 A402 E403 I404 V433 S434 S438 W441 V442	I396-Y400 HydrophobicContact CG2-CD2 4.35Å; I396-Y400 PolarHBondContact O-N 2.99Å; Y400-A402 VanDerWaalsContact C-N 3.25Å; Y400-A402 PolarHBondContact O-N 3.24Å; Y400-E403 PolarHBondContact O-N 3.24Å; Y400-I404 VanDerWaalsContact O-CG1 3.31Å; Y400-I404 WeakPolarHBondContact O-CG1 3.49Å; Y400-I404 PolarHBondContact O-N 3.09Å; Y400-V433 HydrophobicContact CE2-CB 4.17Å; Y400-V433 PolarHBondContact OH-O 3.41Å; Y400-S434 PolarHBondContact OH-O 2.94Å; Y400-S438 WeakPolarHBondContact OH-CB 3.39Å; Y400-W441 HydrophobicContact CD2-CB 4.16Å; Y400-W441 AromaticContact CD2-CD1 3.89Å; Y400-W441 HydrophobicContact CD2-CG 4.26Å; Y400-W441 AromaticContact CE2-CD1 3.58Å; Y400-W441 HydrophobicContact CE2-CG 4.37Å; Y400-V442 HydrophobicContact CD1-CG2 3.85Å; Y400-V442 HydrophobicContact CG-CG2 3.96Å
401	A	91.1	Very high	92.6	Very high	69 Å²	69	70.9 Å²	70.9	57%	0.57	37%	0.368	S	S	*	.	T	Hydrogen-bonded Turn	trans	-47.5	-41.4	-173.9	0	0	0	0	0	115.4	Q397	Q397-A401 WeakPolarHBondContact O-CB 3.48Å; Q397-A401 PolarHBondContact O-N 3.48Å
402	A	90.4	Very high	92.5	Very high	107 Å²	107	69.4 Å²	69.4	88%	0.884	37%	0.368	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80	-17.7	-178.7	0	0	0	0	0	113.7	Y400	Y400-A402 VanDerWaalsContact C-N 3.25Å; Y400-A402 PolarHBondContact O-N 3.24Å
403	E	90.6	Very high	92.3	Very high	107 Å²	107	73.7 Å²	73.7	50%	0.5	39%	0.391	S	S	.	.	T	Hydrogen-bonded Turn	trans	-101.1	-20.3	-173.2	-65.5	176.4	-138.9	0	0	112.6	Y400 Q405 V442	Y400-E403 PolarHBondContact O-N 3.24Å; E403-Q405 PolarHBondContact O-N 3.47Å; E403-Q405 VanDerWaalsContact O-N 3.08Å; E403-Q405 PolarHBondContact O-NE2 2.8Å; E403-Q405 VanDerWaalsContact O-NE2 3.16Å; E403-Q405 PolarHBondContact O-OE1 3.34Å; E403-Q405 VanDerWaalsContact O-OE1 3.07Å; E403-V442 HydrophobicContact CB-CG1 3.89Å; E403-V442 HydrophobicContact CB-CG2 3.78Å
404	I	91.4	Very high	92.1	Very high	29 Å²	29	71.6 Å²	71.6	15%	0.149	38%	0.38	C	S	.	.			trans	-62.6	112	179.2	-68	161	0	0	0	109.9	I396 Y400 D406 V409 L410	I396-I404 HydrophobicContact CG2-CD1 3.89Å; Y400-I404 VanDerWaalsContact O-CG1 3.31Å; Y400-I404 WeakPolarHBondContact O-CG1 3.49Å; Y400-I404 PolarHBondContact O-N 3.09Å; I404-D406 WeakPolarHBondContact CG2-O 3.44Å; I404-V409 HydrophobicContact CG2-CG2 3.96Å; I404-L410 HydrophobicContact CD1-CD1 4.13Å; I404-L410 HydrophobicContact CD1-CD2 4.05Å; I404-L410 HydrophobicContact CD1-CG 4.29Å
405	Q	90.1	Very high	92.1	Very high	103 Å²	103	66.3 Å²	66.3	48%	0.481	36%	0.355	S	S	.	.			trans	-86.7	-28.6	176.3	-56	92	-7.2	0	0	112.6	E403 R443	E403-Q405 PolarHBondContact O-N 3.47Å; E403-Q405 VanDerWaalsContact O-N 3.08Å; E403-Q405 PolarHBondContact O-NE2 2.8Å; E403-Q405 VanDerWaalsContact O-NE2 3.16Å; E403-Q405 PolarHBondContact O-OE1 3.34Å; E403-Q405 VanDerWaalsContact O-OE1 3.07Å; Q405-R443 PolarHBondContact NE2-O 3.1Å
406	D	87.4	Confident	92.1	Very high	42 Å²	42	67.5 Å²	67.5	23%	0.225	36%	0.358	C	S	.	.			trans	-122.2	119.4	-175.9	-162.5	-28.9	0	0	0	110.2	I404 E408 V409 R443	I404-D406 WeakPolarHBondContact CG2-O 3.44Å; D406-E408 VanDerWaalsContact C-N 3.25Å; D406-E408 PolarHBondContact O-N 3.46Å; D406-E408 WeakPolarHBondContact OD1-CB 3.43Å; D406-E408 WeakPolarHBondContact OD1-CG 3.38Å; D406-E408 PolarHBondContact OD1-N 3.03Å; D406-V409 HydrophobicContact CB-CG1 4.48Å; D406-V409 VanDerWaalsContact O-CG2 3.22Å; D406-V409 WeakPolarHBondContact O-CG2 3.18Å; D406-R443 IonicContact OD2-NH2 3.76Å; D406-R443 PolarHBondContact OD2-NH2 2.82Å
407	K	88.6	Confident	91.9	Very high	174 Å²	174	74.2 Å²	74.2	76%	0.757	38%	0.384	S	S	*	.	G	3₁₀ helix	trans	-75.2	-16	-177	-69.3	-173.8	178.7	-179.9	0	112.8	V409 L410	K407-V409 PolarHBondContact O-N 2.83Å; K407-L410 WeakPolarHBondContact O-CB 3.19Å; K407-L410 PolarHBondContact O-N 3.23Å
408	E	88.9	Confident	91.9	Very high	119 Å²	119	70.1 Å²	70.1	56%	0.556	37%	0.365	S	S	*	.	G	3₁₀ helix	trans	-60.1	-26.6	177.2	-67.8	-176.3	-174.6	0	0	112	D406 L410 E411 Y414	D406-E408 VanDerWaalsContact C-N 3.25Å; D406-E408 PolarHBondContact O-N 3.46Å; D406-E408 WeakPolarHBondContact OD1-CB 3.43Å; D406-E408 WeakPolarHBondContact OD1-CG 3.38Å; D406-E408 PolarHBondContact OD1-N 3.03Å; E408-L410 PolarHBondContact O-N 3.24Å; E408-L410 VanDerWaalsContact O-N 3.14Å; E408-E411 VanDerWaalsContact O-CB 3.31Å; E408-E411 WeakPolarHBondContact O-CB 3.46Å; E408-E411 PolarHBondContact O-N 3.02Å; E408-Y414 WeakPolarHBondContact O-CB 3.47Å
409	V	90	Very high	91.9	Very high	14 Å²	14	63.4 Å²	63.4	9%	0.085	33%	0.333	C	S	.	.	G	3₁₀ helix	trans	-65.5	-17.2	176.8	-50.3	0	0	0	0	113.3	I404 D406 K407 Y414 W441	I404-V409 HydrophobicContact CG2-CG2 3.96Å; D406-V409 HydrophobicContact CB-CG1 4.48Å; D406-V409 VanDerWaalsContact O-CG2 3.22Å; D406-V409 WeakPolarHBondContact O-CG2 3.18Å; K407-V409 PolarHBondContact O-N 2.83Å; V409-Y414 HydrophobicContact CB-CD1 4.11Å; V409-Y414 HydrophobicContact CB-CE1 3.93Å; V409-Y414 HydrophobicContact CG1-CE1 4.23Å; V409-Y414 WeakPolarHBondContact O-CD1 3.46Å; V409-W441 HydrophobicContact CB-CE3 4.42Å
410	L	92.9	Very high	91.9	Very high	25 Å²	25	64 Å²	64	13%	0.131	33%	0.331	C	S	.	.	G	3₁₀ helix	trans	-94	-3.8	176	-62.4	176.7	0	0	0	112.7	Q393 I396 Q397 I404 K407 E408	Q393-L410 HydrophobicContact CG-CB 4.43Å; Q393-L410 HydrophobicContact CG-CD2 4.3Å; Q393-L410 PolarHBondContact NE2-O 2.85Å; I396-L410 HydrophobicContact CB-CD2 4.09Å; I396-L410 HydrophobicContact CG2-CD2 3.6Å; Q397-L410 HydrophobicContact CG-CD1 4.08Å; Q397-L410 HydrophobicContact CG-CD2 4.05Å; I404-L410 HydrophobicContact CD1-CD1 4.13Å; I404-L410 HydrophobicContact CD1-CD2 4.05Å; I404-L410 HydrophobicContact CD1-CG 4.29Å; K407-L410 WeakPolarHBondContact O-CB 3.19Å; K407-L410 PolarHBondContact O-N 3.23Å; E408-L410 PolarHBondContact O-N 3.24Å; E408-L410 VanDerWaalsContact O-N 3.14Å
411	E	94	Very high	91.6	Very high	109 Å²	109	66.5 Å²	66.5	51%	0.509	35%	0.345	S	S	.	.	S	Bend	trans	-72.4	145.1	176.4	-67.1	-175.1	176.4	0	0	111.3	E408 D413 Y414 I415	E408-E411 VanDerWaalsContact O-CB 3.31Å; E408-E411 WeakPolarHBondContact O-CB 3.46Å; E408-E411 PolarHBondContact O-N 3.02Å; E411-D413 VanDerWaalsContact C-N 3.26Å; E411-D413 PolarHBondContact O-N 3.11Å; E411-Y414 PolarHBondContact O-N 3.47Å; E411-I415 WeakPolarHBondContact O-CG1 3.33Å; E411-I415 PolarHBondContact O-N 3.28Å; E411-I415 VanDerWaalsContact O-N 3.11Å
412	G	93.4	Very high	91.6	Very high	31 Å²	31	63.4 Å²	63.4	32%	0.32	32%	0.319	S	S	.	.	H	α-helix	trans	-59.3	-36.4	-175.4	0	0	0	0	0	113.2	I415 R416	G412-I415 PolarHBondContact O-N 3.1Å; G412-R416 WeakPolarHBondContact O-CB 3.46Å; G412-R416 PolarHBondContact O-N 3.4Å
413	D	91.9	Very high	91.7	Very high	90 Å²	90	61.2 Å²	61.2	48%	0.481	29%	0.289	S	S	.	.	H	α-helix	trans	-71	-36.8	-179.9	-71	-29.6	0	0	0	112.6	E411 R416 R417	E411-D413 VanDerWaalsContact C-N 3.26Å; E411-D413 PolarHBondContact O-N 3.11Å; D413-R416 IonicContact OD1-NH1 3.93Å; D413-R416 PolarHBondContact OD1-NH1 3.12Å; D413-R417 WeakPolarHBondContact O-CG 3.15Å; D413-R417 PolarHBondContact O-N 3.19Å
414	Y	91.6	Very high	91.7	Very high	18 Å²	18	57.1 Å²	57.1	7%	0.071	28%	0.276	C	S	.	.	H	α-helix	trans	-63.1	-50.6	172.9	-176.6	-88.8	0	0	0	110.7	E408 V409 E411 R416 R417 V418 L440 W441	E408-Y414 WeakPolarHBondContact O-CB 3.47Å; V409-Y414 HydrophobicContact CB-CD1 4.11Å; V409-Y414 HydrophobicContact CB-CE1 3.93Å; V409-Y414 HydrophobicContact CG1-CE1 4.23Å; V409-Y414 WeakPolarHBondContact O-CD1 3.46Å; E411-Y414 PolarHBondContact O-N 3.47Å; Y414-R416 VanDerWaalsContact C-N 3.32Å; Y414-R416 PolarHBondContact O-N 3.16Å; Y414-R417 PolarHBondContact O-N 3.1Å; Y414-V418 HydrophobicContact CD1-CG2 4.1Å; Y414-V418 HydrophobicContact CE1-CG2 3.74Å; Y414-V418 WeakPolarHBondContact O-CG2 3.35Å; Y414-V418 PolarHBondContact O-N 3.44Å; Y414-L440 WeakPolarHBondContact CE1-O 3.29Å; Y414-L440 PolarHBondContact OH-O 3.33Å; Y414-W441 HydrophobicContact CD1-CZ3 4.01Å; Y414-W441 HydrophobicContact CE1-CE3 4.01Å; Y414-W441 AromaticContact CE1-CZ3 3.68Å; Y414-W441 HydrophobicContact CE1-CZ3 3.68Å
415	I	95.2	Very high	91.6	Very high	0 Å²	0	61.5 Å²	61.5	0%	0	30%	0.295	C	S	.	.	H	α-helix	trans	-61.1	-42.7	179.5	-63.5	175.8	0	0	0	110.8	I389 L392 Q393 I396 E411 G412 R417 V418 L419 W441	I389-I415 HydrophobicContact CB-CG2 4.25Å; I389-I415 HydrophobicContact CG1-CG2 4.06Å; I389-I415 HydrophobicContact CG2-CB 4.19Å; I389-I415 HydrophobicContact CG2-CD1 4.42Å; I389-I415 HydrophobicContact CG2-CG2 4.15Å; L392-I415 HydrophobicContact CB-CG2 4.26Å; L392-I415 HydrophobicContact CD2-CG2 3.73Å; L392-I415 HydrophobicContact CG-CG2 4.17Å; Q393-I415 HydrophobicContact CB-CD1 3.72Å; Q393-I415 HydrophobicContact CG-CD1 4.11Å; I396-I415 HydrophobicContact CD1-CD1 4.28Å; I396-I415 HydrophobicContact CD1-CG1 4.49Å; E411-I415 WeakPolarHBondContact O-CG1 3.33Å; E411-I415 PolarHBondContact O-N 3.28Å; E411-I415 VanDerWaalsContact O-N 3.11Å; G412-I415 PolarHBondContact O-N 3.1Å; I415-R417 PolarHBondContact O-N 3.26Å; I415-V418 PolarHBondContact O-N 3.32Å; I415-L419 HydrophobicContact CG2-CD1 4.14Å; I415-L419 HydrophobicContact CG2-CG 4.38Å; I415-L419 WeakPolarHBondContact O-CG 3.15Å; I415-L419 PolarHBondContact O-N 2.94Å; I415-W441 HydrophobicContact CG1-CZ3 4.33Å
416	R	95.3	Very high	91.7	Very high	64 Å²	64	56.7 Å²	56.7	24%	0.242	27%	0.273	C	S	.	.	H	α-helix	trans	-57.5	-47.8	175.8	-176.3	-176.4	-80.7	138	-17.2	111.4	E382 I389 G412 D413 Y414 V418 L419 H420	E382-R416 IonicContact OE1-CZ 3.58Å; E382-R416 IonicContact OE1-NE 2.87Å; E382-R416 IonicContact OE1-NH2 2.98Å; E382-R416 PolarHBondContact OE1-NH2 3.24Å; I389-R416 HydrophobicContact CD1-CB 3.77Å; I389-R416 HydrophobicContact CD1-CG 4.28Å; I389-R416 HydrophobicContact CG1-CB 4.46Å; G412-R416 WeakPolarHBondContact O-CB 3.46Å; G412-R416 PolarHBondContact O-N 3.4Å; D413-R416 IonicContact OD1-NH1 3.93Å; D413-R416 PolarHBondContact OD1-NH1 3.12Å; Y414-R416 VanDerWaalsContact C-N 3.32Å; Y414-R416 PolarHBondContact O-N 3.16Å; R416-V418 PolarHBondContact O-N 3.26Å; R416-L419 PolarHBondContact O-N 2.89Å; R416-H420 PolarHBondContact O-CD2 3.11Å; R416-H420 PolarHBondContact O-N 3.03Å
417	R	91.3	Very high	92.1	Very high	142 Å²	142	56.7 Å²	56.7	54%	0.536	28%	0.275	S	S	.	.	H	α-helix	trans	-59	-46.1	176.5	-72.5	-172.8	-51.2	-100.8	7	111.5	D413 Y414 I415 L419 H420 L421	D413-R417 WeakPolarHBondContact O-CG 3.15Å; D413-R417 PolarHBondContact O-N 3.19Å; Y414-R417 PolarHBondContact O-N 3.1Å; I415-R417 PolarHBondContact O-N 3.26Å; R417-L419 PolarHBondContact O-N 3.08Å; R417-H420 PolarHBondContact O-N 3.4Å; R417-L421 VanDerWaalsContact O-CG 3.32Å; R417-L421 WeakPolarHBondContact O-CG 3.33Å; R417-L421 PolarHBondContact O-N 2.87Å
418	V	93.1	Very high	92.4	Very high	1 Å²	1	49 Å²	49	1%	0.006	24%	0.242	C	C	.	.	H	α-helix	trans	-59.1	-45.8	177.2	171.4	0	0	0	0	111.4	Y414 I415 R416 H420 L421 R422 L432 L440 W441	Y414-V418 HydrophobicContact CD1-CG2 4.1Å; Y414-V418 HydrophobicContact CE1-CG2 3.74Å; Y414-V418 WeakPolarHBondContact O-CG2 3.35Å; Y414-V418 PolarHBondContact O-N 3.44Å; I415-V418 PolarHBondContact O-N 3.32Å; R416-V418 PolarHBondContact O-N 3.26Å; V418-H420 PolarHBondContact O-N 3.46Å; V418-L421 PolarHBondContact O-N 3.1Å; V418-R422 HydrophobicContact CG1-CG 4.48Å; V418-R422 WeakPolarHBondContact O-CB 3.17Å; V418-R422 WeakPolarHBondContact O-CG 3.35Å; V418-R422 PolarHBondContact O-N 3.44Å; V418-L432 HydrophobicContact CG1-CD1 4.42Å; V418-L432 HydrophobicContact CG1-CD2 4.4Å; V418-L440 HydrophobicContact CG1-CD1 3.83Å; V418-W441 HydrophobicContact CB-CH2 4.21Å; V418-W441 HydrophobicContact CG1-CH2 3.8Å; V418-W441 HydrophobicContact CG1-CZ2 4.19Å; V418-W441 HydrophobicContact CG2-CH2 4.25Å; V418-W441 HydrophobicContact CG2-CZ3 4.48Å
419	L	95.1	Very high	92.6	Very high	0 Å²	0	44 Å²	44	0%	0	22%	0.22	C	C	.	.	H	α-helix	trans	-59.3	-45.7	177	-72.9	173.2	0	0	0	111.6	I379 L388 I389 L392 I415 R416 R417 L421 R422 K423 L429 L432	I379-L419 HydrophobicContact CD1-CB 4.37Å; I379-L419 HydrophobicContact CD1-CD2 4.44Å; I379-L419 HydrophobicContact CG1-CB 4.32Å; I379-L419 HydrophobicContact CG2-CB 4.34Å; L388-L419 HydrophobicContact CB-CD1 4.07Å; I389-L419 HydrophobicContact CG1-CD1 3.88Å; L392-L419 HydrophobicContact CD2-CD2 3.9Å; L392-L419 HydrophobicContact CD2-CG 4.27Å; I415-L419 HydrophobicContact CG2-CD1 4.14Å; I415-L419 HydrophobicContact CG2-CG 4.38Å; I415-L419 WeakPolarHBondContact O-CG 3.15Å; I415-L419 PolarHBondContact O-N 2.94Å; R416-L419 PolarHBondContact O-N 2.89Å; R417-L419 PolarHBondContact O-N 3.08Å; L419-L421 PolarHBondContact O-N 3.24Å; L419-R422 CarbonylContact O-C 3.55Å; L419-R422 PolarHBondContact O-N 3.49Å; L419-K423 WeakPolarHBondContact O-CB 3.35Å; L419-K423 PolarHBondContact O-N 3.16Å; L419-L429 HydrophobicContact CD2-CD2 3.6Å; L419-L432 HydrophobicContact CD2-CD1 3.9Å
420	H	93.1	Very high	92.8	Very high	85 Å²	85	48.2 Å²	48.2	39%	0.394	24%	0.237	S	C	.	.	H	α-helix	trans	-64.8	-39.2	177.5	-78.8	-65.5	0	0	0	113.3	I379 R416 R417 V418 R422 K423	I379-H420 PolarHBondContact O-CE1 3.25Å; R416-H420 PolarHBondContact O-CD2 3.11Å; R416-H420 PolarHBondContact O-N 3.03Å; R417-H420 PolarHBondContact O-N 3.4Å; V418-H420 PolarHBondContact O-N 3.46Å; H420-R422 VanDerWaalsContact C-N 3.32Å; H420-R422 PolarHBondContact O-N 3.02Å; H420-K423 VanDerWaalsContact O-CB 3.26Å; H420-K423 WeakPolarHBondContact O-CB 3.45Å; H420-K423 PolarHBondContact O-N 3.09Å
421	L	89.3	Confident	92.8	Very high	67 Å²	67	49.6 Å²	49.6	35%	0.351	24%	0.243	S	C	.	.	H	α-helix	trans	-68.6	-31.1	177.8	-71.7	170.8	0	0	0	112.7	R417 V418 L419 V522	R417-L421 VanDerWaalsContact O-CG 3.32Å; R417-L421 WeakPolarHBondContact O-CG 3.33Å; R417-L421 PolarHBondContact O-N 2.87Å; V418-L421 PolarHBondContact O-N 3.1Å; L419-L421 PolarHBondContact O-N 3.24Å; L421-V522 HydrophobicContact CD1-CG1 3.98Å; L421-V522 HydrophobicContact CD2-CG1 3.63Å; L421-V522 HydrophobicContact CG-CG1 4.49Å
422	R	90.1	Very high	92.8	Very high	4 Å²	4	44.4 Å²	44.4	2%	0.015	22%	0.218	C	C	.	.	H	α-helix	trans	-97.9	-1.5	-179.8	-59.7	-62.8	164.6	-165.1	-5.4	113.6	V418 L419 H420 G424 H425 I426 L432 Y439 E519 S523	V418-R422 HydrophobicContact CG1-CG 4.48Å; V418-R422 WeakPolarHBondContact O-CB 3.17Å; V418-R422 WeakPolarHBondContact O-CG 3.35Å; V418-R422 PolarHBondContact O-N 3.44Å; L419-R422 CarbonylContact O-C 3.55Å; L419-R422 PolarHBondContact O-N 3.49Å; H420-R422 VanDerWaalsContact C-N 3.32Å; H420-R422 PolarHBondContact O-N 3.02Å; R422-G424 PolarHBondContact O-N 2.89Å; R422-H425 WeakPolarHBondContact O-CB 3.22Å; R422-H425 PolarHBondContact O-N 2.95Å; R422-I426 HydrophobicContact CB-CD1 4.33Å; R422-I426 HydrophobicContact CB-CG1 4.47Å; R422-I426 HydrophobicContact CB-CG2 4.2Å; R422-I426 PolarHBondContact O-N 2.85Å; R422-L432 HydrophobicContact CB-CD2 4.21Å; R422-L432 HydrophobicContact CG-CD2 4.02Å; R422-Y439 PolarHBondContact NH2-OH 2.96Å; R422-E519 IonicContact CZ-OE2 3.65Å; R422-E519 IonicContact NH1-OE2 3.87Å; R422-E519 PolarHBondContact NH1-OE2 3.37Å; R422-E519 PolarHBondContact NH2-O 3.19Å; R422-S523 PolarHBondContact NH2-OG 3.38Å
423	K	92.1	Very high	92.9	Very high	62 Å²	62	43.9 Å²	43.9	27%	0.27	21%	0.209	S	C	.	.	T	Hydrogen-bonded Turn	trans	-52.2	123.5	174.2	-169.5	179.3	72.3	160.9	0	110.3	Q376 I379 E380 L419 H420 H425	Q376-K423 HydrophobicContact CB-CG 4.03Å; Q376-K423 HydrophobicContact CG-CD 3.92Å; Q376-K423 HydrophobicContact CG-CG 3.76Å; I379-K423 HydrophobicContact CB-CD 4.25Å; I379-K423 HydrophobicContact CB-CG 4.36Å; I379-K423 HydrophobicContact CD1-CB 4.25Å; I379-K423 HydrophobicContact CD1-CG 4.19Å; I379-K423 HydrophobicContact CG2-CB 4.39Å; I379-K423 HydrophobicContact CG2-CD 3.88Å; I379-K423 HydrophobicContact CG2-CG 4.2Å; E380-K423 HydrophobicContact CG-CD 3.95Å; E380-K423 IonicContact OE1-NZ 2.81Å; E380-K423 PolarHBondContact OE1-NZ 3.4Å; L419-K423 WeakPolarHBondContact O-CB 3.35Å; L419-K423 PolarHBondContact O-N 3.16Å; H420-K423 VanDerWaalsContact O-CB 3.26Å; H420-K423 WeakPolarHBondContact O-CB 3.45Å; H420-K423 PolarHBondContact O-N 3.09Å; K423-H425 VanDerWaalsContact C-N 3.28Å; K423-H425 PolarHBondContact O-N 3.47Å
424	G	90.3	Very high	92.9	Very high	21 Å²	21	41 Å²	41	22%	0.216	20%	0.196	C	C	.	.	T	Hydrogen-bonded Turn	trans	82.4	-5.4	-178.9	0	0	0	0	0	115.6	R372 R422	R372-G424 WeakPolarHBondContact CD-O 3.49Å; R372-G424 PolarHBondContact NH1-O 2.9Å; R422-G424 PolarHBondContact O-N 2.89Å
425	H	89.9	Confident	92.8	Very high	121 Å²	121	44.9 Å²	44.9	56%	0.56	22%	0.223	S	C	*	.	T	Hydrogen-bonded Turn	trans	-104.8	-22.6	175.9	-63.7	-76.3	0	0	0	113.8	R422 K423	R422-H425 WeakPolarHBondContact O-CB 3.22Å; R422-H425 PolarHBondContact O-N 2.95Å; K423-H425 VanDerWaalsContact C-N 3.28Å; K423-H425 PolarHBondContact O-N 3.47Å
426	I	93.3	Very high	92.5	Very high	1 Å²	1	48.2 Å²	48.2	1%	0.005	24%	0.244	C	C	.	.			trans	-107.1	144	177.2	58.8	174.8	0	0	0	110.4	R372 L375 R422 E431 L432 Y437	R372-I426 WeakPolarHBondContact CG-O 3.16Å; L375-I426 HydrophobicContact CD2-CD1 3.87Å; L375-I426 HydrophobicContact CD2-CG1 3.79Å; R422-I426 HydrophobicContact CB-CD1 4.33Å; R422-I426 HydrophobicContact CB-CG1 4.47Å; R422-I426 HydrophobicContact CB-CG2 4.2Å; R422-I426 PolarHBondContact O-N 2.85Å; I426-E431 HydrophobicContact CG2-CB 4.32Å; I426-L432 HydrophobicContact CD1-CD1 3.64Å; I426-L432 HydrophobicContact CD1-CD2 4.23Å; I426-L432 HydrophobicContact CD1-CG 3.79Å; I426-L432 HydrophobicContact CG2-CD2 4.06Å; I426-L432 HydrophobicContact CG2-CG 4.4Å; I426-Y437 HydrophobicContact CG2-CE2 4.43Å
427	T	94.6	Very high	92.3	Very high	43 Å²	43	46.5 Å²	46.5	26%	0.264	24%	0.237	S	C	.	.	S	Bend	trans	-95.1	-25.1	174.1	74.5	0	0	0	0	111.8	P368 N371 R372 E431	P368-T427 HydrophobicContact CB-CG2 3.91Å; N371-T427 WeakPolarHBondContact CB-O 3.48Å; N371-T427 PolarHBondContact ND2-O 3.03Å; R372-T427 HydrophobicContact CB-CG2 4.23Å; T427-E431 VanDerWaalsContact CA-OE1 3.31Å; T427-E431 WeakPolarHBondContact CA-OE1 3.39Å; T427-E431 VanDerWaalsContact CB-OE1 3.29Å; T427-E431 WeakPolarHBondContact CB-OE1 3.33Å; T427-E431 PolarHBondContact N-OE1 3.09Å; T427-E431 PolarHBondContact OG1-OE1 3.04Å
428	S	94.9	Very high	92.4	Very high	11 Å²	11	41 Å²	41	8%	0.077	22%	0.22	C	C	.	.			trans	-142.2	151.7	178.5	175.7	0	0	0	0	111.6	G317 K430 E431	G317-S428 PolarHBondContact O-OG 3.17Å; S428-K430 PolarHBondContact O-N 3.46Å; S428-K430 PolarHBondContact OG-N 3.45Å; S428-E431 PolarHBondContact N-OE1 3.21Å; S428-E431 VanDerWaalsContact N-OE1 3.15Å; S428-E431 WeakPolarHBondContact O-CB 3.46Å; S428-E431 PolarHBondContact O-N 3.32Å; S428-E431 VanDerWaalsContact O-N 3.17Å
429	L	94.2	Very high	92.3	Very high	15 Å²	15	41 Å²	41	8%	0.079	22%	0.22	C	C	.	.	H	α-helix	trans	-59	-29.6	170.8	-70.2	-174.5	0	0	0	112.1	L375 L388 D391 L392 L419 E431 L432	L375-L429 HydrophobicContact CD1-CD2 4.12Å; L375-L429 HydrophobicContact CD1-CG 4.34Å; L388-L429 HydrophobicContact CB-CD1 4.36Å; L388-L429 HydrophobicContact CD2-CD1 3.78Å; L388-L429 HydrophobicContact CD2-CG 4.34Å; D391-L429 HydrophobicContact CB-CD1 4.16Å; L392-L429 HydrophobicContact CB-CD1 4.48Å; L419-L429 HydrophobicContact CD2-CD2 3.6Å; L429-E431 PolarHBondContact O-N 3.07Å; L429-L432 WeakPolarHBondContact O-CB 3.47Å; L429-L432 PolarHBondContact O-N 2.67Å
430	K	93.3	Very high	92.3	Very high	102 Å²	102	41 Å²	41	44%	0.443	22%	0.22	S	C	.	.	H	α-helix	trans	-61.1	-27.5	178.5	-70	-165.4	168	-155.3	0	113.3	R315 S428 L432 V433 S434	R315-K430 VanDerWaalsContact O-CE 3.25Å; R315-K430 WeakPolarHBondContact O-CE 3.36Å; R315-K430 PolarHBondContact O-NZ 2.95Å; S428-K430 PolarHBondContact O-N 3.46Å; S428-K430 PolarHBondContact OG-N 3.45Å; K430-L432 PolarHBondContact O-N 3.33Å; K430-V433 VanDerWaalsContact O-CG2 3.25Å; K430-V433 WeakPolarHBondContact O-CG2 3.19Å; K430-V433 PolarHBondContact O-N 3.15Å; K430-S434 PolarHBondContact O-N 2.94Å
431	E	93.8	Very high	92.3	Very high	55 Å²	55	37 Å²	37	26%	0.257	20%	0.202	S	C	.	.	H	α-helix	trans	-61.6	-37.6	175.2	-68.9	177.5	-135.6	0	0	110.9	I426 T427 S428 L429 V433 S434 Y437	I426-E431 HydrophobicContact CG2-CB 4.32Å; T427-E431 VanDerWaalsContact CA-OE1 3.31Å; T427-E431 WeakPolarHBondContact CA-OE1 3.39Å; T427-E431 VanDerWaalsContact CB-OE1 3.29Å; T427-E431 WeakPolarHBondContact CB-OE1 3.33Å; T427-E431 PolarHBondContact N-OE1 3.09Å; T427-E431 PolarHBondContact OG1-OE1 3.04Å; S428-E431 PolarHBondContact N-OE1 3.21Å; S428-E431 VanDerWaalsContact N-OE1 3.15Å; S428-E431 WeakPolarHBondContact O-CB 3.46Å; S428-E431 PolarHBondContact O-N 3.32Å; S428-E431 VanDerWaalsContact O-N 3.17Å; L429-E431 PolarHBondContact O-N 3.07Å; E431-V433 PolarHBondContact O-N 2.84Å; E431-S434 WeakPolarHBondContact O-CB 3.18Å; E431-S434 PolarHBondContact O-N 3.2Å; E431-S434 PolarHBondContact O-OG 3.16Å; E431-Y437 HydrophobicContact CB-CE2 4.47Å; E431-Y437 WeakPolarHBondContact O-CD2 3.29Å
432	L	94.2	Very high	92.5	Very high	0 Å²	0	34.6 Å²	34.6	0%	0	19%	0.19	C	C	.	.	H	α-helix	trans	-66.4	-22.9	-178.4	-69.4	178.7	0	0	0	113	L392 V418 L419 R422 I426 L429 K430 Y437 L440 W441	L392-L432 HydrophobicContact CD1-CB 4.1Å; L392-L432 HydrophobicContact CD2-CD1 3.58Å; V418-L432 HydrophobicContact CG1-CD1 4.42Å; V418-L432 HydrophobicContact CG1-CD2 4.4Å; L419-L432 HydrophobicContact CD2-CD1 3.9Å; R422-L432 HydrophobicContact CB-CD2 4.21Å; R422-L432 HydrophobicContact CG-CD2 4.02Å; I426-L432 HydrophobicContact CD1-CD1 3.64Å; I426-L432 HydrophobicContact CD1-CD2 4.23Å; I426-L432 HydrophobicContact CD1-CG 3.79Å; I426-L432 HydrophobicContact CG2-CD2 4.06Å; I426-L432 HydrophobicContact CG2-CG 4.4Å; L429-L432 WeakPolarHBondContact O-CB 3.47Å; L429-L432 PolarHBondContact O-N 2.67Å; K430-L432 PolarHBondContact O-N 3.33Å; L432-Y437 HydrophobicContact CD2-CD1 4.34Å; L432-Y437 HydrophobicContact CD2-CG 4.31Å; L432-Y437 VanDerWaalsContact O-CB 3.28Å; L432-Y437 WeakPolarHBondContact O-CB 3.02Å; L432-L440 HydrophobicContact CD2-CD1 4.31Å; L432-W441 HydrophobicContact CB-CZ2 4.18Å; L432-W441 PolarHBondContact O-NE1 3.27Å
433	V	93.9	Very high	92.6	Very high	19 Å²	19	36.6 Å²	36.6	12%	0.115	20%	0.197	C	C	.	.	T	Hydrogen-bonded Turn	trans	-98.4	12.1	173.7	-60.3	0	0	0	0	113.3	L392 Q395 I396 V399 Y400 K430 E431	L392-V433 HydrophobicContact CD1-CG1 3.93Å; Q395-V433 HydrophobicContact CB-CG1 3.97Å; I396-V433 HydrophobicContact CG1-CG1 3.9Å; V399-V433 HydrophobicContact CG2-CB 4.26Å; V399-V433 HydrophobicContact CG2-CG2 4.34Å; Y400-V433 HydrophobicContact CE2-CB 4.17Å; Y400-V433 PolarHBondContact OH-O 3.41Å; K430-V433 VanDerWaalsContact O-CG2 3.25Å; K430-V433 WeakPolarHBondContact O-CG2 3.19Å; K430-V433 PolarHBondContact O-N 3.15Å; E431-V433 PolarHBondContact O-N 2.84Å
434	S	92.4	Very high	92.4	Very high	31 Å²	31	35 Å²	35	22%	0.217	19%	0.193	C	C	.	.	S	Bend	trans	-78.8	160.3	173.4	73.9	0	0	0	0	111.5	Y400 K430 E431 T436 Y437 S438	Y400-S434 PolarHBondContact OH-O 2.94Å; K430-S434 PolarHBondContact O-N 2.94Å; E431-S434 WeakPolarHBondContact O-CB 3.18Å; E431-S434 PolarHBondContact O-N 3.2Å; E431-S434 PolarHBondContact O-OG 3.16Å; S434-T436 PolarHBondContact O-N 3.5Å; S434-Y437 PolarHBondContact O-N 2.76Å; S434-S438 PolarHBondContact O-N 2.83Å
435	P	89.6	Confident	92.2	Very high	99 Å²	99	39.5 Å²	39.5	64%	0.643	22%	0.221	S	C	*	.	T	Hydrogen-bonded Turn	trans	-52.4	-31.7	176.3	-28.9	36.3	0	0	0	114.3	Y437 S438	P435-Y437 PolarHBondContact O-N 2.79Å; P435-S438 WeakPolarHBondContact O-CB 3.5Å; P435-S438 PolarHBondContact O-N 3.24Å; P435-S438 PolarHBondContact O-OG 2.85Å
436	T	88.3	Confident	92	Very high	70 Å²	70	35.6 Å²	35.6	43%	0.429	20%	0.204	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.4	-29.1	177.3	-53.9	0	0	0	0	113.2	S434 Y439 L511	S434-T436 PolarHBondContact O-N 3.5Å; T436-Y439 WeakPolarHBondContact O-CD1 3.21Å; T436-Y439 WeakPolarHBondContact O-CE1 3.26Å; T436-L511 WeakPolarHBondContact O-CD1 3.45Å
437	Y	92.1	Very high	91.6	Very high	28 Å²	28	37.8 Å²	37.8	11%	0.11	22%	0.22	C	C	.	.	T	Hydrogen-bonded Turn	trans	-114	2.1	-177.8	-70.7	-73.5	0	0	0	113.4	I426 E431 L432 S434 P435 Y439 L440	I426-Y437 HydrophobicContact CG2-CE2 4.43Å; E431-Y437 HydrophobicContact CB-CE2 4.47Å; E431-Y437 WeakPolarHBondContact O-CD2 3.29Å; L432-Y437 HydrophobicContact CD2-CD1 4.34Å; L432-Y437 HydrophobicContact CD2-CG 4.31Å; L432-Y437 VanDerWaalsContact O-CB 3.28Å; L432-Y437 WeakPolarHBondContact O-CB 3.02Å; S434-Y437 PolarHBondContact O-N 2.76Å; P435-Y437 PolarHBondContact O-N 2.79Å; Y437-Y439 HydrophobicContact CD1-CE1 4.11Å; Y437-Y439 PolarHBondContact O-N 2.96Å; Y437-L440 HydrophobicContact CD1-CD1 3.92Å; Y437-L440 HydrophobicContact CG-CD1 4.42Å; Y437-L440 WeakPolarHBondContact O-CB 3.11Å; Y437-L440 WeakPolarHBondContact O-CG 3.3Å; Y437-L440 PolarHBondContact O-N 3.38Å
438	S	92.3	Very high	90.9	Very high	25 Å²	25	40.4 Å²	40.4	18%	0.175	23%	0.231	C	C	.	.	G	3₁₀ helix	trans	-47.9	-35.2	176.6	59	0	0	0	0	113.7	Y400 S434 P435 L440 W441 V442	Y400-S438 WeakPolarHBondContact OH-CB 3.39Å; S434-S438 PolarHBondContact O-N 2.83Å; P435-S438 WeakPolarHBondContact O-CB 3.5Å; P435-S438 PolarHBondContact O-N 3.24Å; P435-S438 PolarHBondContact O-OG 2.85Å; S438-L440 PolarHBondContact O-N 3.45Å; S438-W441 PolarHBondContact O-N 3.17Å; S438-V442 PolarHBondContact O-N 2.85Å
439	Y	92.2	Very high	90.4	Very high	1 Å²	1	47.8 Å²	47.8	0%	0.004	26%	0.264	C	S	.	.	G	3₁₀ helix	trans	-58.7	-21.5	179.6	75.2	-87.8	0	0	0	114.8	R422 T436 Y437 W441 S509 L511 P515 M520 L524 R532	R422-Y439 PolarHBondContact NH2-OH 2.96Å; T436-Y439 WeakPolarHBondContact O-CD1 3.21Å; T436-Y439 WeakPolarHBondContact O-CE1 3.26Å; Y437-Y439 HydrophobicContact CD1-CE1 4.11Å; Y437-Y439 PolarHBondContact O-N 2.96Å; Y439-W441 VanDerWaalsContact C-N 3.27Å; Y439-S509 VanDerWaalsContact CB-CA 3.47Å; Y439-S509 VanDerWaalsContact CB-CB 3.44Å; Y439-L511 HydrophobicContact CD1-CD1 4.28Å; Y439-P515 HydrophobicContact CE1-CG 4.35Å; Y439-P515 WeakPolarHBondContact OH-CG 3.5Å; Y439-M520 HydrophobicContact CD2-CE 4.18Å; Y439-M520 HydrophobicContact CE2-CB 4.07Å; Y439-M520 HydrophobicContact CE2-CE 4.18Å; Y439-M520 HydrophobicContact CE2-CG 3.96Å; Y439-M520 HydrophobicContact CG-CE 4.44Å; Y439-L524 HydrophobicContact CD2-CD1 4.25Å; Y439-L524 HydrophobicContact CD2-CD2 4.15Å; Y439-L524 HydrophobicContact CD2-CG 4.3Å; Y439-L524 HydrophobicContact CE2-CG 4.47Å; Y439-L524 WeakPolarHBondContact O-CD2 3.48Å; Y439-R532 PolarHBondContact O-NH1 3.03Å; Y439-R532 PolarHBondContact O-NH2 3.46Å
440	L	93.9	Very high	89.9	Confident	0 Å²	0	51.3 Å²	51.3	0%	0	28%	0.281	C	S	.	.	G	3₁₀ helix	trans	-72	-23	176	-63.7	173.3	0	0	0	112.4	Y414 V418 L432 Y437 S438	Y414-L440 WeakPolarHBondContact CE1-O 3.29Å; Y414-L440 PolarHBondContact OH-O 3.33Å; V418-L440 HydrophobicContact CG1-CD1 3.83Å; L432-L440 HydrophobicContact CD2-CD1 4.31Å; Y437-L440 HydrophobicContact CD1-CD1 3.92Å; Y437-L440 HydrophobicContact CG-CD1 4.42Å; Y437-L440 WeakPolarHBondContact O-CB 3.11Å; Y437-L440 WeakPolarHBondContact O-CG 3.3Å; Y437-L440 PolarHBondContact O-N 3.38Å; S438-L440 PolarHBondContact O-N 3.45Å
441	W	94.3	Very high	89.6	Confident	2 Å²	2	47.2 Å²	47.2	1%	0.008	26%	0.264	C	S	.	.	T	Hydrogen-bonded Turn	trans	-117	-28.5	-171.3	-39	115.6	0	0	0	112.5	L392 I396 Y400 V409 Y414 I415 V418 L432 S438 Y439	L392-W441 HydrophobicContact CD2-CH2 4.18Å; L392-W441 HydrophobicContact CD2-CZ2 4.4Å; I396-W441 HydrophobicContact CD1-CD2 3.72Å; I396-W441 HydrophobicContact CD1-CE3 3.46Å; I396-W441 VanDerWaalsContact CD1-CE3 3.46Å; I396-W441 HydrophobicContact CD1-CH2 3.63Å; I396-W441 HydrophobicContact CD1-CZ2 3.89Å; I396-W441 HydrophobicContact CD1-CZ3 3.4Å; I396-W441 VanDerWaalsContact CD1-CZ3 3.4Å; I396-W441 HydrophobicContact CG1-CD2 3.88Å; I396-W441 HydrophobicContact CG1-CE3 4.13Å; I396-W441 HydrophobicContact CG1-CG 4.28Å; I396-W441 HydrophobicContact CG1-CZ2 4.33Å; I396-W441 HydrophobicContact CG1-CZ3 4.44Å; I396-W441 HydrophobicContact CG2-CB 4.11Å; I396-W441 HydrophobicContact CG2-CD2 4.31Å; I396-W441 HydrophobicContact CG2-CE3 4.47Å; I396-W441 HydrophobicContact CG2-CG 4.15Å; Y400-W441 HydrophobicContact CD2-CB 4.16Å; Y400-W441 AromaticContact CD2-CD1 3.89Å; Y400-W441 HydrophobicContact CD2-CG 4.26Å; Y400-W441 AromaticContact CE2-CD1 3.58Å; Y400-W441 HydrophobicContact CE2-CG 4.37Å; V409-W441 HydrophobicContact CB-CE3 4.42Å; Y414-W441 HydrophobicContact CD1-CZ3 4.01Å; Y414-W441 HydrophobicContact CE1-CE3 4.01Å; Y414-W441 AromaticContact CE1-CZ3 3.68Å; Y414-W441 HydrophobicContact CE1-CZ3 3.68Å; I415-W441 HydrophobicContact CG1-CZ3 4.33Å; V418-W441 HydrophobicContact CB-CH2 4.21Å; V418-W441 HydrophobicContact CG1-CH2 3.8Å; V418-W441 HydrophobicContact CG1-CZ2 4.19Å; V418-W441 HydrophobicContact CG2-CH2 4.25Å; V418-W441 HydrophobicContact CG2-CZ3 4.48Å; L432-W441 HydrophobicContact CB-CZ2 4.18Å; L432-W441 PolarHBondContact O-NE1 3.27Å; S438-W441 PolarHBondContact O-N 3.17Å; Y439-W441 VanDerWaalsContact C-N 3.27Å
442	V	92.9	Very high	89.2	Confident	16 Å²	16	47.4 Å²	47.4	10%	0.097	28%	0.275	C	S	.	.	S	Bend	trans	-129.2	140.2	-174.4	-177.8	0	0	0	0	109.9	Y400 E403 S438	Y400-V442 HydrophobicContact CD1-CG2 3.85Å; Y400-V442 HydrophobicContact CG-CG2 3.96Å; E403-V442 HydrophobicContact CB-CG1 3.89Å; E403-V442 HydrophobicContact CB-CG2 3.78Å; S438-V442 PolarHBondContact O-N 2.85Å
443	R	91.7	Very high	88.9	Confident	47 Å²	47	51.5 Å²	51.5	18%	0.177	31%	0.309	C	S	.	.	P	Polyproline II helix	trans	-75.5	130	172	-74	172	-178.7	147.2	11.7	110.2	Q405 D406 E528 H531	Q405-R443 PolarHBondContact NE2-O 3.1Å; D406-R443 IonicContact OD2-NH2 3.76Å; D406-R443 PolarHBondContact OD2-NH2 2.82Å; R443-E528 WeakPolarHBondContact CG-OE1 3.33Å; R443-E528 IonicContact CZ-OE2 2.81Å; R443-E528 VanDerWaalsContact CZ-OE2 3.29Å; R443-E528 IonicContact NE-OE1 3.37Å; R443-E528 PolarHBondContact NE-OE1 3.03Å; R443-E528 IonicContact NE-OE2 2.96Å; R443-E528 PolarHBondContact NE-OE2 2.86Å; R443-E528 IonicContact NH2-OE2 2.89Å; R443-E528 PolarHBondContact NH2-OE2 3.36Å; R443-H531 PolarHBondContact NE-CD2 3.39Å; R443-H531 VanDerWaalsContact NE-CD2 3.29Å; R443-H531 PolarHBondContact NH1-NE2 2.97Å
444	P	89.4	Confident	88.6	Confident	27 Å²	27	52.3 Å²	52.3	18%	0.175	31%	0.312	C	S	.	.	P	Polyproline II helix	trans	-68.5	140.7	-179.8	28.7	-34.8	0	0	0	111.8	L446 V507	P444-L446 HydrophobicContact CB-CD2 4.2Å; P444-L446 HydrophobicContact CG-CD2 4.4Å; P444-V507 WeakPolarHBondContact CG-O 3.44Å
445	S	85.9	Confident	88.3	Confident	116 Å²	116	51.5 Å²	51.5	81%	0.811	31%	0.306	S	S	*	.	P	Polyproline II helix	trans	-82.8	119.1	167.7	58.6	0	0	0	0	109.9
446	L	84.8	Confident	88.2	Confident	39 Å²	39	56.8 Å²	56.8	20%	0.204	32%	0.319	C	S	.	.			trans	-109.5	128.2	-177	-54.5	177.2	0	0	0	110.3	P444 L506 V507	P444-L446 HydrophobicContact CB-CD2 4.2Å; P444-L446 HydrophobicContact CG-CD2 4.4Å; L446-L506 HydrophobicContact CD2-CD1 4.33Å; L446-L506 HydrophobicContact CD2-CG 4.04Å; L446-L506 VanDerWaalsContact CD2-O 3.3Å; L446-L506 WeakPolarHBondContact CD2-O 3.2Å; L446-V507 HydrophobicContact CD1-CB 4.28Å; L446-V507 HydrophobicContact CD1-CG1 4.32Å; L446-V507 HydrophobicContact CD1-CG2 4.09Å
447	S	84.1	Confident	88.2	Confident	48 Å²	48	54.9 Å²	54.9	34%	0.336	31%	0.305	S	S	.	.			trans	-86.3	143.2	169.1	70.7	0	0	0	0	111.3	Q449 Q450 V451	S447-Q449 PolarHBondContact O-N 2.8Å; S447-Q450 VanDerWaalsContact N-OE1 3.09Å; S447-Q450 PolarHBondContact O-N 3.12Å; S447-Q450 VanDerWaalsContact O-N 3.13Å; S447-Q450 WeakPolarHBondContact OG-CB 3.38Å; S447-Q450 WeakPolarHBondContact OG-CG 3.42Å; S447-Q450 PolarHBondContact OG-N 3.46Å; S447-Q450 PolarHBondContact OG-OE1 3.07Å; S447-V451 PolarHBondContact O-N 2.69Å
448	I	81.1	Confident	88	Confident	98 Å²	98	54 Å²	54	50%	0.503	30%	0.304	S	S	.	.	H	α-helix	trans	-56.2	-37	175.9	-63.4	163.6	0	0	0	110.8	V451 A452 P540	I448-V451 PolarHBondContact O-N 3.37Å; I448-A452 VanDerWaalsContact O-CB 3.27Å; I448-A452 WeakPolarHBondContact O-CB 3.43Å; I448-A452 PolarHBondContact O-N 3.15Å; I448-P540 HydrophobicContact CD1-CB 3.58Å
449	Q	83.4	Confident	87.9	Confident	165 Å²	165	55.9 Å²	55.9	77%	0.771	32%	0.317	S	S	*	.	H	α-helix	trans	-63.8	-42.4	178.8	-65.9	-179.5	-1.9	0	0	112.4	S447 A452 A453	S447-Q449 PolarHBondContact O-N 2.8Å; Q449-A452 PolarHBondContact O-N 2.85Å; Q449-A453 VanDerWaalsContact O-CB 3.3Å; Q449-A453 WeakPolarHBondContact O-CB 3.36Å; Q449-A453 PolarHBondContact O-N 2.84Å
450	Q	85.4	Confident	87.8	Confident	90 Å²	90	59.8 Å²	59.8	42%	0.421	34%	0.335	S	S	.	.	H	α-helix	trans	-63.9	-41.5	177.6	-75.7	163.8	-41.3	0	0	111.9	S447 L506	S447-Q450 VanDerWaalsContact N-OE1 3.09Å; S447-Q450 PolarHBondContact O-N 3.12Å; S447-Q450 VanDerWaalsContact O-N 3.13Å; S447-Q450 WeakPolarHBondContact OG-CB 3.38Å; S447-Q450 WeakPolarHBondContact OG-CG 3.42Å; S447-Q450 PolarHBondContact OG-N 3.46Å; S447-Q450 PolarHBondContact OG-OE1 3.07Å; Q450-L506 HydrophobicContact CB-CD2 4.1Å
451	V	86.6	Confident	87.6	Confident	15 Å²	15	59.8 Å²	59.8	9%	0.091	34%	0.335	C	S	.	.	H	α-helix	trans	-67.1	-48.3	178.1	175.4	0	0	0	0	110.6	S447 I448 A453 L454 T455 A458 L503 L506 L536	S447-V451 PolarHBondContact O-N 2.69Å; I448-V451 PolarHBondContact O-N 3.37Å; V451-A453 VanDerWaalsContact C-N 3.26Å; V451-A453 PolarHBondContact O-N 3.03Å; V451-L454 PolarHBondContact O-N 3.04Å; V451-L454 VanDerWaalsContact O-N 3.09Å; V451-T455 PolarHBondContact O-N 3.26Å; V451-A458 HydrophobicContact CG1-CB 3.5Å; V451-A458 VanDerWaalsContact CG1-CB 3.5Å; V451-L503 HydrophobicContact CG1-CD1 3.91Å; V451-L506 HydrophobicContact CG2-CD2 4.43Å; V451-L536 HydrophobicContact CG1-CD2 4.15Å; V451-L536 HydrophobicContact CG2-CD2 4.07Å
452	A	85	Confident	87.5	Confident	60 Å²	60	59.7 Å²	59.7	50%	0.496	34%	0.335	S	S	.	.	H	α-helix	trans	-64	-29.6	-179.4	0	0	0	0	0	113.1	I448 Q449 L454	I448-A452 VanDerWaalsContact O-CB 3.27Å; I448-A452 WeakPolarHBondContact O-CB 3.43Å; I448-A452 PolarHBondContact O-N 3.15Å; Q449-A452 PolarHBondContact O-N 2.85Å; A452-L454 VanDerWaalsContact C-N 3.26Å; A452-L454 PolarHBondContact O-N 3.32Å
453	A	87.4	Confident	87.5	Confident	86 Å²	86	61.3 Å²	61.3	71%	0.711	35%	0.347	S	S	*	.	H	α-helix	trans	-66.9	-26.1	175.3	0	0	0	0	0	113.2	Q449 V451	Q449-A453 VanDerWaalsContact O-CB 3.3Å; Q449-A453 WeakPolarHBondContact O-CB 3.36Å; Q449-A453 PolarHBondContact O-N 2.84Å; V451-A453 VanDerWaalsContact C-N 3.26Å; V451-A453 PolarHBondContact O-N 3.03Å
454	L	87.1	Confident	87.5	Confident	35 Å²	35	59.9 Å²	59.9	18%	0.183	34%	0.343	C	S	.	.	H	α-helix	trans	-85.5	-45.5	178.6	-67	174.2	0	0	0	111.9	V451 A452 E499 K502 L503 L506	V451-L454 PolarHBondContact O-N 3.04Å; V451-L454 VanDerWaalsContact O-N 3.09Å; A452-L454 VanDerWaalsContact C-N 3.26Å; A452-L454 PolarHBondContact O-N 3.32Å; L454-E499 WeakPolarHBondContact CD2-OE2 3.4Å; L454-K502 HydrophobicContact CD1-CB 4.32Å; L454-K502 HydrophobicContact CD2-CB 4.03Å; L454-K502 HydrophobicContact CD2-CD 3.98Å; L454-L503 HydrophobicContact CD1-CB 4.24Å; L454-L503 HydrophobicContact CD1-CD1 4.36Å; L454-L506 HydrophobicContact CD1-CB 4.37Å; L454-L506 HydrophobicContact CD1-CD2 3.69Å
455	T	87.8	Confident	87.6	Confident	15 Å²	15	58.6 Å²	58.6	9%	0.092	34%	0.335	C	S	.	.			trans	-163.8	152.7	-179	179.8	0	0	0	0	113	V451 E457 A458 I461 T495 L503	V451-T455 PolarHBondContact O-N 3.26Å; T455-E457 PolarHBondContact OG1-N 3.28Å; T455-A458 HydrophobicContact CG2-CB 4.21Å; T455-I461 HydrophobicContact CG2-CD1 3.96Å; T455-T495 HydrophobicContact CG2-CG2 4.29Å; T455-T495 PolarHBondContact OG1-OG1 3.3Å; T455-L503 HydrophobicContact CG2-CD2 3.76Å
456	K	86.8	Confident	87.9	Confident	210 Å²	210	54 Å²	54	91%	0.913	30%	0.301	S	S	*	.	S	Bend	trans	-85	-12.2	168.5	-62.3	-175.3	179.1	-177	0	113.2	A458	K456-A458 VanDerWaalsContact C-N 3.33Å
457	E	88.8	Confident	88.2	Confident	29 Å²	29	58.2 Å²	58.2	14%	0.136	31%	0.314	C	S	.	.			trans	-95	20.5	-178.8	-62	176.1	144.1	0	0	112	T455 S459 Q460 I461 T492 K493 A494 T495	T455-E457 PolarHBondContact OG1-N 3.28Å; E457-S459 PolarHBondContact O-N 2.84Å; E457-Q460 HydrophobicContact CB-CB 4.47Å; E457-Q460 PolarHBondContact O-N 2.89Å; E457-Q460 VanDerWaalsContact O-N 3.12Å; E457-I461 HydrophobicContact CB-CD1 4.49Å; E457-I461 WeakPolarHBondContact O-CG1 3.45Å; E457-I461 PolarHBondContact O-N 2.91Å; E457-T492 WeakPolarHBondContact OE2-CB 3.41Å; E457-K493 WeakPolarHBondContact OE1-CB 3.07Å; E457-K493 PolarHBondContact OE1-N 2.75Å; E457-K493 VanDerWaalsContact OE1-N 3.13Å; E457-A494 PolarHBondContact OE1-N 3.01Å; E457-A494 VanDerWaalsContact OE1-N 3.1Å; E457-A494 PolarHBondContact OE2-N 3.46Å; E457-T495 WeakPolarHBondContact OE2-CB 3.49Å; E457-T495 PolarHBondContact OE2-N 3.15Å; E457-T495 PolarHBondContact OE2-OG1 2.88Å
458	A	87.9	Confident	88.5	Confident	10 Å²	10	56.7 Å²	56.7	8%	0.083	30%	0.302	C	S	.	.	H	α-helix	trans	-57.8	-44.7	-173.8	0	0	0	0	0	113	V451 T455 K456 Q460 I461 A462 L503	V451-A458 HydrophobicContact CG1-CB 3.5Å; V451-A458 VanDerWaalsContact CG1-CB 3.5Å; T455-A458 HydrophobicContact CG2-CB 4.21Å; K456-A458 VanDerWaalsContact C-N 3.33Å; A458-Q460 PolarHBondContact O-N 2.75Å; A458-I461 PolarHBondContact O-N 3.02Å; A458-A462 WeakPolarHBondContact O-CB 3.38Å; A458-A462 PolarHBondContact O-N 3.31Å; A458-L503 HydrophobicContact CB-CD2 4.03Å
459	S	88.9	Confident	89	Confident	65 Å²	65	52 Å²	52	46%	0.455	28%	0.278	S	S	.	.	H	α-helix	trans	-66.2	-36.2	177.5	-50.1	0	0	0	0	112.2	E457 A462 S463 L536 L537	E457-S459 PolarHBondContact O-N 2.84Å; S459-A462 PolarHBondContact O-N 3.42Å; S459-S463 PolarHBondContact O-N 3.35Å; S459-S463 PolarHBondContact O-OG 2.98Å; S459-L536 PolarHBondContact OG-O 3.43Å; S459-L537 WeakPolarHBondContact O-CD2 3.47Å
460	Q	90.3	Very high	89.2	Confident	82 Å²	82	51 Å²	51	38%	0.383	27%	0.273	S	S	.	.	H	α-helix	trans	-65.5	-45.1	174.6	-178.8	-179.5	-9.4	0	0	111	E457 A458 A462 S463 L464 Q491	E457-Q460 HydrophobicContact CB-CB 4.47Å; E457-Q460 PolarHBondContact O-N 2.89Å; E457-Q460 VanDerWaalsContact O-N 3.12Å; A458-Q460 PolarHBondContact O-N 2.75Å; Q460-A462 VanDerWaalsContact C-N 3.29Å; Q460-A462 PolarHBondContact O-N 2.91Å; Q460-S463 PolarHBondContact O-N 3.49Å; Q460-L464 WeakPolarHBondContact O-CG 3.11Å; Q460-L464 PolarHBondContact O-N 3.13Å; Q460-Q491 PolarHBondContact NE2-O 3.26Å; Q460-Q491 VanDerWaalsContact NE2-O 3.1Å
461	I	91.1	Very high	89.2	Confident	0 Å²	0	53.9 Å²	53.9	0%	0	29%	0.287	C	S	.	.	H	α-helix	trans	-61.1	-41.5	176.7	-67.6	163.3	0	0	0	110.3	T455 E457 A458 L464 V465 L488 T492 T495 V500 L503 L504	T455-I461 HydrophobicContact CG2-CD1 3.96Å; E457-I461 HydrophobicContact CB-CD1 4.49Å; E457-I461 WeakPolarHBondContact O-CG1 3.45Å; E457-I461 PolarHBondContact O-N 2.91Å; A458-I461 PolarHBondContact O-N 3.02Å; I461-L464 WeakPolarHBondContact O-CB 3.26Å; I461-L464 PolarHBondContact O-N 3.13Å; I461-V465 HydrophobicContact CG2-CG2 4.5Å; I461-V465 WeakPolarHBondContact O-CG2 3.45Å; I461-V465 PolarHBondContact O-N 3.43Å; I461-L488 HydrophobicContact CG2-CD2 4.16Å; I461-T492 HydrophobicContact CD1-CG2 4.31Å; I461-T492 HydrophobicContact CG1-CG2 3.74Å; I461-T495 HydrophobicContact CD1-CG2 4.14Å; I461-V500 HydrophobicContact CD1-CG2 4.01Å; I461-V500 HydrophobicContact CG2-CG1 4.21Å; I461-L503 HydrophobicContact CB-CD2 4.08Å; I461-L503 HydrophobicContact CD1-CD2 3.78Å; I461-L503 HydrophobicContact CG2-CD2 3.97Å; I461-L504 HydrophobicContact CG2-CD2 4.06Å
462	A	91.3	Very high	88.9	Confident	0 Å²	0	55.2 Å²	55.2	0%	0	29%	0.292	C	S	.	.	H	α-helix	trans	-59.6	-47.2	176.1	0	0	0	0	0	112.2	A458 S459 Q460 L464 V465 L466 F533 L536 L537	A458-A462 WeakPolarHBondContact O-CB 3.38Å; A458-A462 PolarHBondContact O-N 3.31Å; S459-A462 PolarHBondContact O-N 3.42Å; Q460-A462 VanDerWaalsContact C-N 3.29Å; Q460-A462 PolarHBondContact O-N 2.91Å; A462-L464 VanDerWaalsContact C-N 3.28Å; A462-L464 PolarHBondContact O-N 3.39Å; A462-V465 PolarHBondContact O-N 3.15Å; A462-L466 WeakPolarHBondContact O-CG 3.41Å; A462-L466 PolarHBondContact O-N 3.46Å; A462-F533 HydrophobicContact CB-CB 4.47Å; A462-F533 HydrophobicContact CB-CD1 3.93Å; A462-L536 HydrophobicContact CB-CB 3.94Å; A462-L536 HydrophobicContact CB-CD1 3.96Å; A462-L537 HydrophobicContact CB-CD2 4Å; A462-L537 HydrophobicContact CB-CG 4.28Å
463	S	92.3	Very high	88.6	Confident	51 Å²	51	53.9 Å²	53.9	36%	0.357	29%	0.285	S	S	.	.	H	α-helix	trans	-61.4	-35.3	176.3	-59.9	0	0	0	0	113.1	S459 Q460 R467	S459-S463 PolarHBondContact O-N 3.35Å; S459-S463 PolarHBondContact O-OG 2.98Å; Q460-S463 PolarHBondContact O-N 3.49Å; S463-R467 PolarHBondContact O-N 3.16Å; S463-R467 VanDerWaalsContact O-N 3.1Å
464	L	92.3	Very high	88	Confident	16 Å²	16	56.8 Å²	56.8	8%	0.084	28%	0.283	C	S	.	.	H	α-helix	trans	-67.2	-41.6	175.3	-69.5	174.9	0	0	0	112	Q460 I461 A462 L468 L488 Q491 T492	Q460-L464 WeakPolarHBondContact O-CG 3.11Å; Q460-L464 PolarHBondContact O-N 3.13Å; I461-L464 WeakPolarHBondContact O-CB 3.26Å; I461-L464 PolarHBondContact O-N 3.13Å; A462-L464 VanDerWaalsContact C-N 3.28Å; A462-L464 PolarHBondContact O-N 3.39Å; L464-L468 WeakPolarHBondContact O-CB 3.39Å; L464-L468 PolarHBondContact O-N 3.4Å; L464-L488 HydrophobicContact CB-CD1 4.42Å; L464-L488 HydrophobicContact CB-CG 4.32Å; L464-L488 HydrophobicContact CD1-CD2 4.47Å; L464-Q491 HydrophobicContact CD1-CB 3.82Å; L464-Q491 HydrophobicContact CD2-CB 4.38Å; L464-Q491 VanDerWaalsContact CD2-OE1 3.27Å; L464-T492 HydrophobicContact CD1-CG2 4.36Å
465	V	92.1	Very high	87.6	Confident	0 Å²	0	63.6 Å²	63.6	0%	0	31%	0.314	C	S	.	.	H	α-helix	trans	-65.3	-43.8	176.3	175.5	0	0	0	0	110.8	I461 A462 R467 L468 I469 L488 L504 M521 I529 F533	I461-V465 HydrophobicContact CG2-CG2 4.5Å; I461-V465 WeakPolarHBondContact O-CG2 3.45Å; I461-V465 PolarHBondContact O-N 3.43Å; A462-V465 PolarHBondContact O-N 3.15Å; V465-R467 VanDerWaalsContact C-N 3.35Å; V465-R467 PolarHBondContact O-N 3.29Å; V465-L468 WeakPolarHBondContact O-CB 3.36Å; V465-L468 PolarHBondContact O-N 3.21Å; V465-I469 HydrophobicContact CG1-CG1 4.48Å; V465-I469 WeakPolarHBondContact O-CG1 3.48Å; V465-I469 PolarHBondContact O-N 3.1Å; V465-L488 HydrophobicContact CG2-CD1 3.8Å; V465-L504 HydrophobicContact CG2-CD2 3.47Å; V465-L504 VanDerWaalsContact CG2-CD2 3.47Å; V465-M521 HydrophobicContact CG1-CE 4.26Å; V465-I529 HydrophobicContact CG1-CG2 4.05Å; V465-F533 HydrophobicContact CB-CD1 4.17Å; V465-F533 HydrophobicContact CB-CE1 4.21Å; V465-F533 HydrophobicContact CB-CG 4.35Å; V465-F533 HydrophobicContact CB-CZ 4.44Å; V465-F533 HydrophobicContact CG1-CD1 4.29Å; V465-F533 HydrophobicContact CG1-CD2 3.83Å; V465-F533 HydrophobicContact CG1-CE1 4.26Å; V465-F533 HydrophobicContact CG1-CE2 3.8Å; V465-F533 HydrophobicContact CG1-CG 4.08Å; V465-F533 HydrophobicContact CG1-CZ 4.03Å; V465-F533 HydrophobicContact CG2-CD1 4.37Å; V465-F533 HydrophobicContact CG2-CE1 3.95Å; V465-F533 HydrophobicContact CG2-CZ 4.16Å
466	L	91.9	Very high	87.4	Confident	19 Å²	19	64 Å²	64	10%	0.099	32%	0.316	C	S	.	.	H	α-helix	trans	-60.4	-44.3	178.6	-69.4	173.8	0	0	0	111.7	A462 L468 I469 E470 R530 F533 Q534 L537	A462-L466 WeakPolarHBondContact O-CG 3.41Å; A462-L466 PolarHBondContact O-N 3.46Å; L466-L468 VanDerWaalsContact C-N 3.35Å; L466-L468 PolarHBondContact O-N 3.21Å; L466-I469 PolarHBondContact O-N 2.6Å; L466-E470 WeakPolarHBondContact O-CG 3.49Å; L466-E470 PolarHBondContact O-N 3.44Å; L466-R530 HydrophobicContact CD2-CB 4.11Å; L466-R530 HydrophobicContact CD2-CG 4.02Å; L466-F533 HydrophobicContact CD2-CB 3.96Å; L466-F533 HydrophobicContact CG-CB 4.16Å; L466-Q534 HydrophobicContact CD1-CG 4.22Å; L466-Q534 HydrophobicContact CD2-CG 4.37Å; L466-L537 HydrophobicContact CD1-CD1 3.54Å
467	R	91.2	Very high	87.4	Confident	129 Å²	129	56.9 Å²	56.9	49%	0.487	29%	0.292	S	S	.	.	H	α-helix	trans	-60.7	-43.7	175.2	-171	-173.4	-56.4	157.3	4.2	112.2	S463 V465 I469 E470 E471	S463-R467 PolarHBondContact O-N 3.16Å; S463-R467 VanDerWaalsContact O-N 3.1Å; V465-R467 VanDerWaalsContact C-N 3.35Å; V465-R467 PolarHBondContact O-N 3.29Å; R467-I469 VanDerWaalsContact C-N 3.28Å; R467-I469 PolarHBondContact O-N 3.09Å; R467-E470 PolarHBondContact O-N 3.31Å; R467-E471 WeakPolarHBondContact CG-OE1 3.13Å; R467-E471 WeakPolarHBondContact O-CG 3.26Å; R467-E471 PolarHBondContact O-N 3.47Å
468	L	90.2	Very high	87.2	Confident	16 Å²	16	58.9 Å²	58.9	8%	0.084	30%	0.303	C	S	.	.	H	α-helix	trans	-58.8	-41.7	177.6	-178.7	160.4	0	0	0	111.4	L464 V465 L466 E471 Q472 L481 D484 L488 M521	L464-L468 WeakPolarHBondContact O-CB 3.39Å; L464-L468 PolarHBondContact O-N 3.4Å; V465-L468 WeakPolarHBondContact O-CB 3.36Å; V465-L468 PolarHBondContact O-N 3.21Å; L466-L468 VanDerWaalsContact C-N 3.35Å; L466-L468 PolarHBondContact O-N 3.21Å; L468-E471 PolarHBondContact O-N 3.41Å; L468-Q472 WeakPolarHBondContact O-CG 3.33Å; L468-Q472 PolarHBondContact O-N 3.09Å; L468-L481 HydrophobicContact CD2-CD2 3.71Å; L468-D484 HydrophobicContact CD1-CB 3.56Å; L468-D484 HydrophobicContact CG-CB 4.26Å; L468-L488 HydrophobicContact CD1-CD1 4.23Å; L468-M521 HydrophobicContact CD2-CE 4.46Å
469	I	90.9	Very high	87.2	Confident	0 Å²	0	64 Å²	64	0%	0	33%	0.329	C	S	.	.	H	α-helix	trans	-69.6	-37.8	177.6	-63.8	-61.2	0	0	0	111.8	V465 L466 R467 E471 Q472 G473 L476 M521 P526 I529 R530	V465-I469 HydrophobicContact CG1-CG1 4.48Å; V465-I469 WeakPolarHBondContact O-CG1 3.48Å; V465-I469 PolarHBondContact O-N 3.1Å; L466-I469 PolarHBondContact O-N 2.6Å; R467-I469 VanDerWaalsContact C-N 3.28Å; R467-I469 PolarHBondContact O-N 3.09Å; I469-E471 VanDerWaalsContact C-N 3.31Å; I469-E471 PolarHBondContact O-N 3.37Å; I469-Q472 PolarHBondContact O-N 3.36Å; I469-G473 PolarHBondContact O-N 2.87Å; I469-L476 HydrophobicContact CD1-CD1 4.23Å; I469-L476 HydrophobicContact CD1-CD2 3.83Å; I469-M521 HydrophobicContact CD1-CE 3.66Å; I469-M521 HydrophobicContact CG1-CE 4.37Å; I469-P526 HydrophobicContact CG2-CB 3.55Å; I469-I529 HydrophobicContact CD1-CD1 3.75Å; I469-I529 HydrophobicContact CD1-CG2 4.18Å; I469-I529 HydrophobicContact CG1-CB 4.48Å; I469-I529 HydrophobicContact CG1-CD1 4.5Å; I469-I529 HydrophobicContact CG1-CG2 3.84Å; I469-R530 HydrophobicContact CG2-CG 4.01Å
470	E	88.1	Confident	87.1	Confident	143 Å²	143	64.7 Å²	64.7	67%	0.668	33%	0.325	S	S	*	.	H	α-helix	trans	-62.5	-38.1	174	-74.4	173	179.7	0	0	112.2	L466 R467	L466-E470 WeakPolarHBondContact O-CG 3.49Å; L466-E470 PolarHBondContact O-N 3.44Å; R467-E470 PolarHBondContact O-N 3.31Å
471	E	86.4	Confident	87.1	Confident	150 Å²	150	60.8 Å²	60.8	70%	0.701	31%	0.307	S	S	*	.	H	α-helix	trans	-71.7	-31.8	178.8	-72.9	171.5	-173.3	0	0	113.3	R467 L468 I469	R467-E471 WeakPolarHBondContact CG-OE1 3.13Å; R467-E471 WeakPolarHBondContact O-CG 3.26Å; R467-E471 PolarHBondContact O-N 3.47Å; L468-E471 PolarHBondContact O-N 3.41Å; I469-E471 VanDerWaalsContact C-N 3.31Å; I469-E471 PolarHBondContact O-N 3.37Å
472	Q	80.1	Confident	87.1	Confident	43 Å²	43	63.3 Å²	63.3	20%	0.201	32%	0.323	C	S	.	.	H	α-helix	trans	-85.3	-21.3	-178.5	-71.6	-166.2	2.9	0	0	114.3	L468 I469 L476 D484	L468-Q472 WeakPolarHBondContact O-CG 3.33Å; L468-Q472 PolarHBondContact O-N 3.09Å; I469-Q472 PolarHBondContact O-N 3.36Å; Q472-L476 HydrophobicContact CB-CD2 4.05Å; Q472-L476 VanDerWaalsContact OE1-CD2 3.26Å; Q472-D484 PolarHBondContact NE2-OD2 3.11Å
473	G	77	Confident	87	Confident	33 Å²	33	69.8 Å²	69.8	34%	0.34	35%	0.351	S	S	.	.			trans	80.8	-150.2	179.3	0	0	0	0	0	114.4	I469	I469-G473 PolarHBondContact O-N 2.87Å
474	E	75.8	Confident	86.8	Confident	147 Å²	147	69.1 Å²	69.1	69%	0.687	34%	0.343	S	S	*	.	S	Bend	trans	-79.8	-29.7	-173.6	-72.4	-75.3	133.3	0	0	113.4	R530	E474-R530 IonicContact OE1-NH2 3.35Å
475	E	77.8	Confident	86.7	Confident	178 Å²	178	68.7 Å²	68.7	83%	0.832	34%	0.341	S	S	*	.			trans	-103.9	110.9	-178.4	-74.3	-171.5	172.5	0	0	112.1
476	L	83.7	Confident	86.5	Confident	23 Å²	23	74.9 Å²	74.9	12%	0.12	37%	0.368	C	S	.	.			trans	-89.4	122.9	179.3	-63	176.6	0	0	0	111.5	I469 Q472 L481 V522 P526 I529	I469-L476 HydrophobicContact CD1-CD1 4.23Å; I469-L476 HydrophobicContact CD1-CD2 3.83Å; Q472-L476 HydrophobicContact CB-CD2 4.05Å; Q472-L476 VanDerWaalsContact OE1-CD2 3.26Å; L476-L481 HydrophobicContact CB-CD1 3.85Å; L476-L481 HydrophobicContact CD1-CD1 4.37Å; L476-L481 HydrophobicContact CD2-CD1 4.5Å; L476-L481 HydrophobicContact CG-CD1 4.47Å; L476-V522 HydrophobicContact CB-CG2 4.17Å; L476-P526 HydrophobicContact CD1-CB 4.47Å; L476-I529 HydrophobicContact CD1-CD1 3.63Å
477	S	86.4	Confident	86.3	Confident	60 Å²	60	76 Å²	76	42%	0.42	38%	0.378	S	S	.	.			trans	-93.1	129.8	173.8	171.2	0	0	0	0	111.7	D479 Q480 L481	S477-D479 VanDerWaalsContact C-N 3.34Å; S477-D479 PolarHBondContact O-N 3.31Å; S477-Q480 PolarHBondContact O-N 2.82Å; S477-L481 WeakPolarHBondContact O-CB 3.4Å; S477-L481 WeakPolarHBondContact O-CG 3.39Å; S477-L481 PolarHBondContact O-N 2.98Å
478	L	86.2	Confident	86.2	Confident	71 Å²	71	70 Å²	70	37%	0.372	36%	0.356	S	S	.	.	H	α-helix	trans	-58.9	-43.3	179.6	-173.9	71.3	0	0	0	112.5	T482 A518 E519 V522	L478-T482 WeakPolarHBondContact O-CB 3.49Å; L478-T482 PolarHBondContact O-N 3.02Å; L478-T482 PolarHBondContact O-OG1 3.37Å; L478-A518 HydrophobicContact CD1-CB 3.66Å; L478-E519 HydrophobicContact CD1-CB 4.28Å; L478-E519 HydrophobicContact CD1-CG 3.72Å; L478-E519 HydrophobicContact CD2-CG 4.5Å; L478-V522 HydrophobicContact CB-CG2 4.39Å; L478-V522 HydrophobicContact CD1-CG2 4.29Å
479	D	86.9	Confident	86	Confident	117 Å²	117	70 Å²	70	63%	0.626	36%	0.356	S	S	*	.	H	α-helix	trans	-67.6	-40.6	-178.6	-75.6	-21	0	0	0	111.7	S477 T482 K483	S477-D479 VanDerWaalsContact C-N 3.34Å; S477-D479 PolarHBondContact O-N 3.31Å; D479-T482 PolarHBondContact O-N 2.86Å; D479-K483 WeakPolarHBondContact O-CG 3.22Å; D479-K483 PolarHBondContact O-N 3.33Å
480	Q	88.1	Confident	85.8	Confident	80 Å²	80	78.6 Å²	78.6	37%	0.374	39%	0.394	S	S	.	.	H	α-helix	trans	-69.7	-48.4	179.7	-170.1	52.8	44.3	0	0	110.6	S477 T482 K483 D484	S477-Q480 PolarHBondContact O-N 2.82Å; Q480-T482 VanDerWaalsContact C-N 3.26Å; Q480-T482 PolarHBondContact O-N 2.89Å; Q480-K483 WeakPolarHBondContact O-CB 3.26Å; Q480-K483 PolarHBondContact O-N 3.42Å; Q480-D484 VanDerWaalsContact NE2-CG 3.31Å; Q480-D484 PolarHBondContact NE2-OD1 2.96Å; Q480-D484 PolarHBondContact NE2-OD2 2.82Å; Q480-D484 VanDerWaalsContact O-CG 3.29Å; Q480-D484 PolarHBondContact O-N 2.89Å
481	L	89.6	Confident	85.6	Confident	0 Å²	0	76.5 Å²	76.5	0%	0	38%	0.384	C	S	.	.	H	α-helix	trans	-55.4	-41.2	173.8	-81.3	171.1	0	0	0	112.5	L468 L476 S477 K483 D484 L485 A518 M521 V522	L468-L481 HydrophobicContact CD2-CD2 3.71Å; L476-L481 HydrophobicContact CB-CD1 3.85Å; L476-L481 HydrophobicContact CD1-CD1 4.37Å; L476-L481 HydrophobicContact CD2-CD1 4.5Å; L476-L481 HydrophobicContact CG-CD1 4.47Å; S477-L481 WeakPolarHBondContact O-CB 3.4Å; S477-L481 WeakPolarHBondContact O-CG 3.39Å; S477-L481 PolarHBondContact O-N 2.98Å; L481-K483 VanDerWaalsContact C-N 3.29Å; L481-K483 PolarHBondContact O-N 2.89Å; L481-D484 PolarHBondContact O-N 3.22Å; L481-L485 VanDerWaalsContact O-CB 3.23Å; L481-L485 WeakPolarHBondContact O-CB 3.25Å; L481-L485 WeakPolarHBondContact O-CG 3.19Å; L481-L485 PolarHBondContact O-N 3.36Å; L481-A518 HydrophobicContact CB-CB 3.96Å; L481-M521 HydrophobicContact CD1-CB 3.99Å; L481-M521 HydrophobicContact CD2-CE 3.75Å; L481-M521 HydrophobicContact CD2-SD 4.24Å; L481-V522 HydrophobicContact CD1-CG2 3.57Å
482	T	89.9	Confident	85.5	Confident	54 Å²	54	70.2 Å²	70.2	33%	0.331	36%	0.356	S	S	.	.	H	α-helix	trans	-63	-36.4	178.7	-61.3	0	0	0	0	112.2	L478 D479 Q480 K486 A518	L478-T482 WeakPolarHBondContact O-CB 3.49Å; L478-T482 PolarHBondContact O-N 3.02Å; L478-T482 PolarHBondContact O-OG1 3.37Å; D479-T482 PolarHBondContact O-N 2.86Å; Q480-T482 VanDerWaalsContact C-N 3.26Å; Q480-T482 PolarHBondContact O-N 2.89Å; T482-K486 WeakPolarHBondContact O-CG 3.37Å; T482-K486 PolarHBondContact O-N 2.92Å; T482-A518 WeakPolarHBondContact OG1-CB 3.16Å
483	K	89.4	Confident	85.6	Confident	135 Å²	135	77.6 Å²	77.6	59%	0.587	39%	0.387	S	S	*	.	H	α-helix	trans	-71.1	-45.2	175	-69.3	171.1	-173.9	170	0	111.1	D479 Q480 L481 K486 S487	D479-K483 WeakPolarHBondContact O-CG 3.22Å; D479-K483 PolarHBondContact O-N 3.33Å; Q480-K483 WeakPolarHBondContact O-CB 3.26Å; Q480-K483 PolarHBondContact O-N 3.42Å; L481-K483 VanDerWaalsContact C-N 3.29Å; L481-K483 PolarHBondContact O-N 2.89Å; K483-K486 WeakPolarHBondContact O-CB 3.39Å; K483-K486 PolarHBondContact O-N 3.22Å; K483-S487 PolarHBondContact O-N 2.69Å
484	D	89.1	Confident	85.7	Confident	37 Å²	37	80.1 Å²	80.1	20%	0.198	40%	0.404	C	S	.	.	H	α-helix	trans	-68.5	-41.6	-175	-62	-23.6	0	0	0	111.3	L468 Q472 Q480 L481 K486 S487 L488	L468-D484 HydrophobicContact CD1-CB 3.56Å; L468-D484 HydrophobicContact CG-CB 4.26Å; Q472-D484 PolarHBondContact NE2-OD2 3.11Å; Q480-D484 VanDerWaalsContact NE2-CG 3.31Å; Q480-D484 PolarHBondContact NE2-OD1 2.96Å; Q480-D484 PolarHBondContact NE2-OD2 2.82Å; Q480-D484 VanDerWaalsContact O-CG 3.29Å; Q480-D484 PolarHBondContact O-N 2.89Å; L481-D484 PolarHBondContact O-N 3.22Å; D484-K486 PolarHBondContact O-N 3.39Å; D484-S487 WeakPolarHBondContact O-CA 3.49Å; D484-S487 WeakPolarHBondContact O-CB 3.41Å; D484-S487 PolarHBondContact O-N 3.03Å; D484-S487 PolarHBondContact O-OG 3.3Å; D484-L488 PolarHBondContact O-N 2.69Å
485	L	89.6	Confident	86.2	Confident	8 Å²	8	73.8 Å²	73.8	4%	0.042	38%	0.376	C	S	.	.	H	α-helix	trans	-61	-29.8	173.8	-71.7	172.3	0	0	0	113.1	L481 S487 P489 M501 L504 I517 A518 M521	L481-L485 VanDerWaalsContact O-CB 3.23Å; L481-L485 WeakPolarHBondContact O-CB 3.25Å; L481-L485 WeakPolarHBondContact O-CG 3.19Å; L481-L485 PolarHBondContact O-N 3.36Å; L485-S487 VanDerWaalsContact C-N 3.31Å; L485-P489 VanDerWaalsContact O-CD 3.3Å; L485-P489 WeakPolarHBondContact O-CD 3.34Å; L485-M501 HydrophobicContact CB-CE 4.27Å; L485-M501 VanDerWaalsContact O-CE 3.24Å; L485-M501 WeakPolarHBondContact O-CE 3.29Å; L485-L504 HydrophobicContact CD2-CD1 3.6Å; L485-I517 HydrophobicContact CD1-CB 4.04Å; L485-I517 HydrophobicContact CD1-CG2 3.85Å; L485-I517 HydrophobicContact CD2-CG2 4.31Å; L485-A518 HydrophobicContact CD1-CB 4.03Å; L485-M521 HydrophobicContact CD1-SD 4.06Å; L485-M521 HydrophobicContact CD2-SD 4.03Å; L485-M521 HydrophobicContact CG-SD 4.47Å
486	K	88.6	Confident	86.7	Confident	129 Å²	129	73.2 Å²	73.2	56%	0.561	37%	0.371	S	S	*	.	H	α-helix	trans	-71.3	-27.5	172.7	-76.2	175	-178.5	176.7	0	112.7	T482 K483 D484	T482-K486 WeakPolarHBondContact O-CG 3.37Å; T482-K486 PolarHBondContact O-N 2.92Å; K483-K486 WeakPolarHBondContact O-CB 3.39Å; K483-K486 PolarHBondContact O-N 3.22Å; D484-K486 PolarHBondContact O-N 3.39Å
487	S	88.1	Confident	86.9	Confident	44 Å²	44	77.9 Å²	77.9	31%	0.308	39%	0.388	S	S	.	.	H	α-helix	trans	-84.6	-28.1	178.7	81.9	0	0	0	0	112.9	K483 D484 L485 K490	K483-S487 PolarHBondContact O-N 2.69Å; D484-S487 WeakPolarHBondContact O-CA 3.49Å; D484-S487 WeakPolarHBondContact O-CB 3.41Å; D484-S487 PolarHBondContact O-N 3.03Å; D484-S487 PolarHBondContact O-OG 3.3Å; L485-S487 VanDerWaalsContact C-N 3.31Å; S487-K490 VanDerWaalsContact O-CB 3.27Å; S487-K490 WeakPolarHBondContact O-CB 3.31Å; S487-K490 PolarHBondContact O-N 3.06Å
488	L	87.8	Confident	87.1	Confident	3 Å²	3	83.3 Å²	83.3	2%	0.016	40%	0.399	C	S	.	.	G	3₁₀ helix	trans	-54.9	-44.3	-172.3	-165.3	150.4	0	0	0	113.8	I461 L464 V465 L468 D484 K490 Q491 V500	I461-L488 HydrophobicContact CG2-CD2 4.16Å; L464-L488 HydrophobicContact CB-CD1 4.42Å; L464-L488 HydrophobicContact CB-CG 4.32Å; L464-L488 HydrophobicContact CD1-CD2 4.47Å; V465-L488 HydrophobicContact CG2-CD1 3.8Å; L468-L488 HydrophobicContact CD1-CD1 4.23Å; D484-L488 PolarHBondContact O-N 2.69Å; L488-K490 PolarHBondContact O-N 3.36Å; L488-Q491 WeakPolarHBondContact O-CB 3.29Å; L488-Q491 PolarHBondContact O-N 2.99Å; L488-Q491 VanDerWaalsContact O-N 3.11Å; L488-V500 HydrophobicContact CD2-CG1 3.72Å
489	P	86.6	Confident	87.3	Confident	16 Å²	16	82.1 Å²	82.1	10%	0.104	39%	0.392	C	S	.	.	G	3₁₀ helix	trans	-66.7	-21.3	179.1	-25.9	39.7	0	0	0	114.2	L485 Q491 T492 Y497 V500 M501	L485-P489 VanDerWaalsContact O-CD 3.3Å; L485-P489 WeakPolarHBondContact O-CD 3.34Å; P489-Q491 PolarHBondContact O-N 3.4Å; P489-T492 PolarHBondContact O-N 3.39Å; P489-T492 VanDerWaalsContact O-N 3.11Å; P489-T492 PolarHBondContact O-OG1 2.96Å; P489-Y497 HydrophobicContact CB-CD2 4.37Å; P489-Y497 HydrophobicContact CG-CD2 3.67Å; P489-Y497 HydrophobicContact CG-CE2 4.34Å; P489-Y497 HydrophobicContact CG-CG 4.36Å; P489-V500 HydrophobicContact CB-CG2 4.04Å; P489-V500 HydrophobicContact CG-CB 4.02Å; P489-V500 HydrophobicContact CG-CG1 4.08Å; P489-V500 HydrophobicContact CG-CG2 4.04Å; P489-M501 HydrophobicContact CG-CE 4.24Å
490	K	87.1	Confident	87.5	Confident	180 Å²	180	76.6 Å²	76.6	78%	0.783	36%	0.362	S	S	*	.	G	3₁₀ helix	trans	-66.2	-17	175.8	-58.6	-178.7	180	179.6	0	112.4	S487 L488	S487-K490 VanDerWaalsContact O-CB 3.27Å; S487-K490 WeakPolarHBondContact O-CB 3.31Å; S487-K490 PolarHBondContact O-N 3.06Å; L488-K490 PolarHBondContact O-N 3.36Å
491	Q	83.8	Confident	87.7	Confident	99 Å²	99	74 Å²	74	46%	0.463	35%	0.35	S	S	.	.	G	3₁₀ helix	trans	-94.7	2.6	178.8	-53.1	-175.7	39.7	0	0	112.4	Q460 L464 L488 P489	Q460-Q491 PolarHBondContact NE2-O 3.26Å; Q460-Q491 VanDerWaalsContact NE2-O 3.1Å; L464-Q491 HydrophobicContact CD1-CB 3.82Å; L464-Q491 HydrophobicContact CD2-CB 4.38Å; L464-Q491 VanDerWaalsContact CD2-OE1 3.27Å; L488-Q491 WeakPolarHBondContact O-CB 3.29Å; L488-Q491 PolarHBondContact O-N 2.99Å; L488-Q491 VanDerWaalsContact O-N 3.11Å; P489-Q491 PolarHBondContact O-N 3.4Å
492	T	84.9	Confident	87.8	Confident	17 Å²	17	77 Å²	77	10%	0.104	36%	0.363	C	S	.	.			trans	-104.7	145.9	174.5	64.5	0	0	0	0	110.2	E457 I461 L464 P489 T495	E457-T492 WeakPolarHBondContact OE2-CB 3.41Å; I461-T492 HydrophobicContact CD1-CG2 4.31Å; I461-T492 HydrophobicContact CG1-CG2 3.74Å; L464-T492 HydrophobicContact CD1-CG2 4.36Å; P489-T492 PolarHBondContact O-N 3.39Å; P489-T492 VanDerWaalsContact O-N 3.11Å; P489-T492 PolarHBondContact O-OG1 2.96Å; T492-T495 PolarHBondContact OG1-O 3.5Å
493	K	80.5	Confident	87.9	Confident	199 Å²	199	74.4 Å²	74.4	87%	0.865	35%	0.347	S	S	*	.	S	Bend	trans	-89	-40.5	-174.5	-69.3	-178.1	179.3	178.2	0	112	E457	E457-K493 WeakPolarHBondContact OE1-CB 3.07Å; E457-K493 PolarHBondContact OE1-N 2.75Å; E457-K493 VanDerWaalsContact OE1-N 3.13Å
494	A	80.8	Confident	88.1	Confident	85 Å²	85	68 Å²	68	70%	0.702	32%	0.319	S	S	*	.	S	Bend	trans	-116.5	-21.5	-172	0	0	0	0	0	114	E457	E457-A494 PolarHBondContact OE1-N 3.01Å; E457-A494 VanDerWaalsContact OE1-N 3.1Å; E457-A494 PolarHBondContact OE2-N 3.46Å
495	T	84.9	Confident	88.3	Confident	15 Å²	15	68 Å²	68	9%	0.092	32%	0.317	C	S	.	.			trans	-83.7	122.8	-173.5	-49.9	0	0	0	0	112.4	T455 E457 I461 T492 E499 V500	T455-T495 HydrophobicContact CG2-CG2 4.29Å; T455-T495 PolarHBondContact OG1-OG1 3.3Å; E457-T495 WeakPolarHBondContact OE2-CB 3.49Å; E457-T495 PolarHBondContact OE2-N 3.15Å; E457-T495 PolarHBondContact OE2-OG1 2.88Å; I461-T495 HydrophobicContact CD1-CG2 4.14Å; T492-T495 PolarHBondContact OG1-O 3.5Å; T495-E499 HydrophobicContact CG2-CB 3.82Å; T495-V500 HydrophobicContact CG2-CG2 3.58Å
496	K	88.2	Confident	88.4	Confident	165 Å²	165	67.9 Å²	67.9	72%	0.717	32%	0.316	S	S	*	.			trans	-70.6	150.3	175.9	-64.5	-179.8	-179.1	177.1	0	110.9	R498 E499 V500	K496-R498 PolarHBondContact O-N 3.39Å; K496-R498 VanDerWaalsContact O-N 3.09Å; K496-E499 PolarHBondContact O-N 3.07Å; K496-V500 PolarHBondContact O-N 3.33Å
497	Y	89.3	Confident	88.6	Confident	121 Å²	121	61.8 Å²	61.8	48%	0.475	29%	0.289	S	S	.	.	H	α-helix	trans	-43.4	-47.4	175.8	177.7	-85.6	0	0	0	113.5	P489 E499 V500 M501	P489-Y497 HydrophobicContact CB-CD2 4.37Å; P489-Y497 HydrophobicContact CG-CD2 3.67Å; P489-Y497 HydrophobicContact CG-CE2 4.34Å; P489-Y497 HydrophobicContact CG-CG 4.36Å; Y497-E499 VanDerWaalsContact C-N 3.33Å; Y497-E499 PolarHBondContact O-N 3.46Å; Y497-V500 PolarHBondContact O-N 2.95Å; Y497-M501 HydrophobicContact CD1-CG 4.09Å; Y497-M501 HydrophobicContact CD2-CE 4.47Å; Y497-M501 HydrophobicContact CE1-CG 3.6Å; Y497-M501 HydrophobicContact CE2-CE 3.9Å; Y497-M501 HydrophobicContact CE2-CG 4.27Å; Y497-M501 WeakPolarHBondContact O-CG 3.49Å; Y497-M501 PolarHBondContact O-N 3.48Å
498	R	90	Very high	88.8	Confident	175 Å²	175	59.7 Å²	59.7	66%	0.66	28%	0.275	S	S	*	.	H	α-helix	trans	-59.5	-41.5	-179.8	-175.9	-178.5	-178	-173.9	-1.9	112.6	K496 K502	K496-R498 PolarHBondContact O-N 3.39Å; K496-R498 VanDerWaalsContact O-N 3.09Å; R498-K502 HydrophobicContact CG-CD 4.48Å; R498-K502 WeakPolarHBondContact O-CG 3.41Å; R498-K502 PolarHBondContact O-N 3.33Å
499	E	90.2	Very high	89	Confident	46 Å²	46	59.8 Å²	59.8	22%	0.215	28%	0.276	C	S	.	.	H	α-helix	trans	-75.7	-34.5	-178.8	-58.9	-49.3	130.3	0	0	111.3	L454 T495 K496 Y497 K502 L503	L454-E499 WeakPolarHBondContact CD2-OE2 3.4Å; T495-E499 HydrophobicContact CG2-CB 3.82Å; K496-E499 PolarHBondContact O-N 3.07Å; Y497-E499 VanDerWaalsContact C-N 3.33Å; Y497-E499 PolarHBondContact O-N 3.46Å; E499-K502 PolarHBondContact O-N 2.97Å; E499-K502 IonicContact OE1-NZ 2.85Å; E499-K502 PolarHBondContact OE1-NZ 3.33Å; E499-K502 WeakPolarHBondContact OE2-CD 3.2Å; E499-K502 IonicContact OE2-NZ 2.87Å; E499-K502 PolarHBondContact OE2-NZ 3.47Å; E499-L503 WeakPolarHBondContact O-CB 3.44Å; E499-L503 PolarHBondContact O-N 3.26Å
500	V	90.9	Very high	89.1	Confident	0 Å²	0	60.7 Å²	60.7	0%	0	29%	0.288	C	S	.	.	H	α-helix	trans	-58.5	-51.8	169.2	-179.3	0	0	0	0	110.2	I461 L488 P489 T495 K496 Y497 K502 L503 L504	I461-V500 HydrophobicContact CD1-CG2 4.01Å; I461-V500 HydrophobicContact CG2-CG1 4.21Å; L488-V500 HydrophobicContact CD2-CG1 3.72Å; P489-V500 HydrophobicContact CB-CG2 4.04Å; P489-V500 HydrophobicContact CG-CB 4.02Å; P489-V500 HydrophobicContact CG-CG1 4.08Å; P489-V500 HydrophobicContact CG-CG2 4.04Å; T495-V500 HydrophobicContact CG2-CG2 3.58Å; K496-V500 PolarHBondContact O-N 3.33Å; Y497-V500 PolarHBondContact O-N 2.95Å; V500-K502 VanDerWaalsContact C-N 3.32Å; V500-K502 PolarHBondContact O-N 3.48Å; V500-L503 WeakPolarHBondContact O-CB 3.24Å; V500-L503 PolarHBondContact O-N 3.29Å; V500-L503 VanDerWaalsContact O-N 3.12Å; V500-L504 HydrophobicContact CG1-CD1 4.23Å; V500-L504 HydrophobicContact CG1-CG 4.3Å; V500-L504 WeakPolarHBondContact O-CG 3.37Å; V500-L504 PolarHBondContact O-N 3.13Å
501	M	92.6	Very high	89.1	Confident	27 Å²	27	54 Å²	54	13%	0.133	26%	0.26	C	S	.	.	H	α-helix	trans	-63.6	-36.2	-178.7	-66.3	-60.9	130.8	0	0	113	L485 P489 Y497 L504 R505 I517	L485-M501 HydrophobicContact CB-CE 4.27Å; L485-M501 VanDerWaalsContact O-CE 3.24Å; L485-M501 WeakPolarHBondContact O-CE 3.29Å; P489-M501 HydrophobicContact CG-CE 4.24Å; Y497-M501 HydrophobicContact CD1-CG 4.09Å; Y497-M501 HydrophobicContact CD2-CE 4.47Å; Y497-M501 HydrophobicContact CE1-CG 3.6Å; Y497-M501 HydrophobicContact CE2-CE 3.9Å; Y497-M501 HydrophobicContact CE2-CG 4.27Å; Y497-M501 WeakPolarHBondContact O-CG 3.49Å; Y497-M501 PolarHBondContact O-N 3.48Å; M501-L504 HydrophobicContact CE-CD1 4.03Å; M501-L504 HydrophobicContact SD-CD1 4.19Å; M501-R505 WeakPolarHBondContact O-CB 3.37Å; M501-R505 PolarHBondContact O-N 2.76Å; M501-I517 HydrophobicContact SD-CG1 4.17Å
502	K	91.5	Very high	89	Confident	61 Å²	61	55.4 Å²	55.4	27%	0.265	27%	0.267	S	S	.	.	H	α-helix	trans	-64.8	-42.8	172.4	-76.8	171.5	177	174	0	111.9	L454 R498 E499 V500 R505 L506	L454-K502 HydrophobicContact CD1-CB 4.32Å; L454-K502 HydrophobicContact CD2-CB 4.03Å; L454-K502 HydrophobicContact CD2-CD 3.98Å; R498-K502 HydrophobicContact CG-CD 4.48Å; R498-K502 WeakPolarHBondContact O-CG 3.41Å; R498-K502 PolarHBondContact O-N 3.33Å; E499-K502 PolarHBondContact O-N 2.97Å; E499-K502 IonicContact OE1-NZ 2.85Å; E499-K502 PolarHBondContact OE1-NZ 3.33Å; E499-K502 WeakPolarHBondContact OE2-CD 3.2Å; E499-K502 IonicContact OE2-NZ 2.87Å; E499-K502 PolarHBondContact OE2-NZ 3.47Å; V500-K502 VanDerWaalsContact C-N 3.32Å; V500-K502 PolarHBondContact O-N 3.48Å; K502-R505 PolarHBondContact O-N 2.61Å; K502-L506 VanDerWaalsContact O-CB 3.28Å; K502-L506 WeakPolarHBondContact O-CB 3.41Å; K502-L506 PolarHBondContact O-N 2.89Å
503	L	92.1	Very high	88.9	Confident	0 Å²	0	62.4 Å²	62.4	0%	0	30%	0.299	C	S	.	.	H	α-helix	trans	-61.2	-49.5	176.2	177	67.2	0	0	0	110.3	V451 L454 T455 A458 I461 E499 V500 R505 L506 V507	V451-L503 HydrophobicContact CG1-CD1 3.91Å; L454-L503 HydrophobicContact CD1-CB 4.24Å; L454-L503 HydrophobicContact CD1-CD1 4.36Å; T455-L503 HydrophobicContact CG2-CD2 3.76Å; A458-L503 HydrophobicContact CB-CD2 4.03Å; I461-L503 HydrophobicContact CB-CD2 4.08Å; I461-L503 HydrophobicContact CD1-CD2 3.78Å; I461-L503 HydrophobicContact CG2-CD2 3.97Å; E499-L503 WeakPolarHBondContact O-CB 3.44Å; E499-L503 PolarHBondContact O-N 3.26Å; V500-L503 WeakPolarHBondContact O-CB 3.24Å; V500-L503 PolarHBondContact O-N 3.29Å; V500-L503 VanDerWaalsContact O-N 3.12Å; L503-R505 VanDerWaalsContact C-N 3.29Å; L503-R505 PolarHBondContact O-N 2.96Å; L503-L506 PolarHBondContact O-N 3.3Å; L503-V507 HydrophobicContact CD1-CG2 3.85Å; L503-V507 HydrophobicContact CG-CG2 4.21Å; L503-V507 WeakPolarHBondContact O-CB 3.35Å; L503-V507 WeakPolarHBondContact O-CG2 3.2Å; L503-V507 PolarHBondContact O-N 3.18Å
504	L	93.3	Very high	88.8	Confident	0 Å²	0	54.7 Å²	54.7	0%	0	28%	0.275	C	S	.	.	H	α-helix	trans	-56.9	-45	177.2	-62.4	-178.9	0	0	0	111	I461 V465 L485 V500 M501 V507 L508 I517 F533	I461-L504 HydrophobicContact CG2-CD2 4.06Å; V465-L504 HydrophobicContact CG2-CD2 3.47Å; V465-L504 VanDerWaalsContact CG2-CD2 3.47Å; L485-L504 HydrophobicContact CD2-CD1 3.6Å; V500-L504 HydrophobicContact CG1-CD1 4.23Å; V500-L504 HydrophobicContact CG1-CG 4.3Å; V500-L504 WeakPolarHBondContact O-CG 3.37Å; V500-L504 PolarHBondContact O-N 3.13Å; M501-L504 HydrophobicContact CE-CD1 4.03Å; M501-L504 HydrophobicContact SD-CD1 4.19Å; L504-V507 PolarHBondContact O-N 3.29Å; L504-L508 WeakPolarHBondContact O-CB 3.45Å; L504-L508 WeakPolarHBondContact O-CD1 3.47Å; L504-L508 WeakPolarHBondContact O-CG 3.19Å; L504-L508 PolarHBondContact O-N 3.06Å; L504-I517 HydrophobicContact CB-CD1 4.43Å; L504-I517 HydrophobicContact CB-CG2 3.94Å; L504-I517 HydrophobicContact CD1-CG2 4.06Å; L504-F533 HydrophobicContact CD2-CE1 3.62Å; L504-F533 HydrophobicContact CD2-CZ 3.44Å; L504-F533 VanDerWaalsContact CD2-CZ 3.44Å
505	R	93.4	Very high	88.8	Confident	39 Å²	39	51.6 Å²	51.6	15%	0.147	25%	0.248	C	C	.	.	H	α-helix	trans	-59.8	-50	176.6	-167	174.8	-71.6	-72.1	-1.2	111.9	M501 K502 L503 V507 L508 S509 L511 Q512 G514 P515 I517 M520	M501-R505 WeakPolarHBondContact O-CB 3.37Å; M501-R505 PolarHBondContact O-N 2.76Å; K502-R505 PolarHBondContact O-N 2.61Å; L503-R505 VanDerWaalsContact C-N 3.29Å; L503-R505 PolarHBondContact O-N 2.96Å; R505-V507 VanDerWaalsContact C-N 3.27Å; R505-V507 PolarHBondContact O-N 3.28Å; R505-L508 PolarHBondContact O-N 3.24Å; R505-S509 PolarHBondContact O-N 3.07Å; R505-S509 PolarHBondContact O-OG 3.19Å; R505-L511 WeakPolarHBondContact CD-O 3.35Å; R505-L511 WeakPolarHBondContact CG-O 3.31Å; R505-Q512 WeakPolarHBondContact CD-O 3.14Å; R505-G514 PolarHBondContact NH1-O 3.4Å; R505-G514 PolarHBondContact NH2-O 3.36Å; R505-P515 VanDerWaalsContact CZ-O 3.24Å; R505-P515 PolarHBondContact NH1-O 2.86Å; R505-P515 PolarHBondContact NH2-O 3.31Å; R505-I517 HydrophobicContact CB-CD1 3.62Å; R505-I517 HydrophobicContact CG-CD1 4.13Å; R505-M520 HydrophobicContact CG-CE 4.46Å; R505-M520 HydrophobicContact CG-SD 4.42Å; R505-M520 PolarHBondContact NH1-SD 3.44Å; R505-M520 VanDerWaalsContact NH1-SD 3.4Å
506	L	92.1	Very high	89	Confident	4 Å²	4	53.1 Å²	53.1	2%	0.021	26%	0.259	C	S	.	.	H	α-helix	trans	-58.9	-44.8	-178.1	-179.5	68	0	0	0	109.7	L446 Q450 V451 L454 K502 L503 S509 G510	L446-L506 HydrophobicContact CD2-CD1 4.33Å; L446-L506 HydrophobicContact CD2-CG 4.04Å; L446-L506 VanDerWaalsContact CD2-O 3.3Å; L446-L506 WeakPolarHBondContact CD2-O 3.2Å; Q450-L506 HydrophobicContact CB-CD2 4.1Å; V451-L506 HydrophobicContact CG2-CD2 4.43Å; L454-L506 HydrophobicContact CD1-CB 4.37Å; L454-L506 HydrophobicContact CD1-CD2 3.69Å; K502-L506 VanDerWaalsContact O-CB 3.28Å; K502-L506 WeakPolarHBondContact O-CB 3.41Å; K502-L506 PolarHBondContact O-N 2.89Å; L503-L506 PolarHBondContact O-N 3.3Å; L506-S509 PolarHBondContact O-N 2.95Å; L506-G510 VanDerWaalsContact O-CA 3.24Å; L506-G510 WeakPolarHBondContact O-CA 3.43Å; L506-G510 PolarHBondContact O-N 3.13Å
507	V	92.8	Very high	89.2	Confident	1 Å²	1	45.8 Å²	45.8	1%	0.006	23%	0.228	C	C	.	.	H	α-helix	trans	-70.8	-40.6	-178.1	176	0	0	0	0	111.7	P444 L446 L503 L504 R505 R532 F533 L536	P444-V507 WeakPolarHBondContact CG-O 3.44Å; L446-V507 HydrophobicContact CD1-CB 4.28Å; L446-V507 HydrophobicContact CD1-CG1 4.32Å; L446-V507 HydrophobicContact CD1-CG2 4.09Å; L503-V507 HydrophobicContact CD1-CG2 3.85Å; L503-V507 HydrophobicContact CG-CG2 4.21Å; L503-V507 WeakPolarHBondContact O-CB 3.35Å; L503-V507 WeakPolarHBondContact O-CG2 3.2Å; L503-V507 PolarHBondContact O-N 3.18Å; L504-V507 PolarHBondContact O-N 3.29Å; R505-V507 VanDerWaalsContact C-N 3.27Å; R505-V507 PolarHBondContact O-N 3.28Å; V507-R532 HydrophobicContact CG1-CB 4.3Å; V507-F533 HydrophobicContact CB-CE1 4.19Å; V507-F533 HydrophobicContact CB-CZ 4.08Å; V507-F533 HydrophobicContact CG1-CD1 3.98Å; V507-F533 HydrophobicContact CG1-CD2 4.11Å; V507-F533 HydrophobicContact CG1-CE1 3.85Å; V507-F533 HydrophobicContact CG1-CE2 3.97Å; V507-F533 HydrophobicContact CG1-CG 4.12Å; V507-F533 HydrophobicContact CG1-CZ 3.83Å; V507-L536 HydrophobicContact CB-CD1 4.39Å; V507-L536 HydrophobicContact CG1-CD1 3.94Å; V507-L536 HydrophobicContact CG1-CG 4.47Å; V507-L536 HydrophobicContact CG2-CD1 3.57Å; V507-L536 HydrophobicContact CG2-CD2 4.25Å; V507-L536 HydrophobicContact CG2-CG 4.32Å
508	L	92.9	Very high	89.3	Confident	0 Å²	0	40.2 Å²	40.2	0%	0	21%	0.206	C	C	.	.	H	α-helix	trans	-76.7	-18.2	179.3	-69.8	169.6	0	0	0	113.5	L504 R505 I517 M520 M521 L524 I529 R532 F533	L504-L508 WeakPolarHBondContact O-CB 3.45Å; L504-L508 WeakPolarHBondContact O-CD1 3.47Å; L504-L508 WeakPolarHBondContact O-CG 3.19Å; L504-L508 PolarHBondContact O-N 3.06Å; R505-L508 PolarHBondContact O-N 3.24Å; L508-I517 HydrophobicContact CD1-CG2 3.79Å; L508-M520 HydrophobicContact CB-CE 3.79Å; L508-M520 HydrophobicContact CD1-CB 4.46Å; L508-M521 HydrophobicContact CD1-CG 3.63Å; L508-M521 HydrophobicContact CD1-SD 4.37Å; L508-M521 HydrophobicContact CD2-CG 4.34Å; L508-L524 HydrophobicContact CB-CD1 4.3Å; L508-L524 HydrophobicContact CD2-CD1 3.79Å; L508-I529 HydrophobicContact CD2-CG1 4.12Å; L508-I529 HydrophobicContact CD2-CG2 4.45Å; L508-R532 PolarHBondContact O-NH1 3.46Å; L508-F533 HydrophobicContact CD2-CD2 4.5Å; L508-F533 HydrophobicContact CD2-CE2 3.69Å; L508-F533 HydrophobicContact CG-CE2 3.9Å; L508-F533 HydrophobicContact CG-CZ 4.31Å
509	S	91.4	Very high	89.2	Confident	6 Å²	6	34.4 Å²	34.4	4%	0.042	19%	0.187	C	C	.	.	H	α-helix	trans	-146.2	-15.5	-174.8	61	0	0	0	0	117.9	Y439 R505 L506 L511 M520	Y439-S509 VanDerWaalsContact CB-CA 3.47Å; Y439-S509 VanDerWaalsContact CB-CB 3.44Å; R505-S509 PolarHBondContact O-N 3.07Å; R505-S509 PolarHBondContact O-OG 3.19Å; L506-S509 PolarHBondContact O-N 2.95Å; S509-L511 PolarHBondContact O-N 3.06Å; S509-L511 WeakPolarHBondContact OG-CB 3.34Å; S509-L511 PolarHBondContact OG-N 3.42Å; S509-L511 VanDerWaalsContact OG-N 3.14Å; S509-M520 WeakPolarHBondContact OG-CE 3.29Å
510	G	88.6	Confident	89.2	Confident	34 Å²	34	32.2 Å²	32.2	35%	0.351	18%	0.177	S	C	.	.	S	Bend	trans	71.2	-1	-167.3	0	0	0	0	0	113.6	L506	L506-G510 VanDerWaalsContact O-CA 3.24Å; L506-G510 WeakPolarHBondContact O-CA 3.43Å; L506-G510 PolarHBondContact O-N 3.13Å
511	L	86	Confident	89.2	Confident	40 Å²	40	32.3 Å²	32.3	21%	0.209	18%	0.177	C	C	.	.			trans	-96.8	154.6	-174.3	-55.9	175.8	0	0	0	112.4	T436 Y439 R505 S509 Q513	T436-L511 WeakPolarHBondContact O-CD1 3.45Å; Y439-L511 HydrophobicContact CD1-CD1 4.28Å; R505-L511 WeakPolarHBondContact CD-O 3.35Å; R505-L511 WeakPolarHBondContact CG-O 3.31Å; S509-L511 PolarHBondContact O-N 3.06Å; S509-L511 WeakPolarHBondContact OG-CB 3.34Å; S509-L511 PolarHBondContact OG-N 3.42Å; S509-L511 VanDerWaalsContact OG-N 3.14Å; L511-Q513 WeakPolarHBondContact CB-O 3.44Å
512	Q	82.8	Confident	89.1	Confident	128 Å²	128	32.4 Å²	32.4	60%	0.598	18%	0.179	S	C	*	.	S	Bend	trans	-89	-25.3	174.2	-64.5	-62.9	-34.6	0	0	112.8	R505	R505-Q512 WeakPolarHBondContact CD-O 3.14Å
513	Q	82.1	Confident	88.9	Confident	165 Å²	165	29.9 Å²	29.9	77%	0.771	17%	0.169	S	C	*	.	S	Bend	trans	-135.7	163.7	-178.9	-59.1	-174.4	18.4	0	0	109.5	L511	L511-Q513 WeakPolarHBondContact CB-O 3.44Å
514	G	79	Confident	88.8	Confident	36 Å²	36	30.2 Å²	30.2	37%	0.371	17%	0.171	S	C	.	.			trans	151.1	-167.4	179.4	0	0	0	0	0	112.8	R505	R505-G514 PolarHBondContact NH1-O 3.4Å; R505-G514 PolarHBondContact NH2-O 3.36Å
515	P	81.8	Confident	88.6	Confident	21 Å²	21	31.1 Å²	31.1	14%	0.136	18%	0.18	C	C	.	.	S	Bend	trans	-59	170.8	179.2	19.3	-27.8	0	0	0	112.9	Y439 R505 E519 M520	Y439-P515 HydrophobicContact CE1-CG 4.35Å; Y439-P515 WeakPolarHBondContact OH-CG 3.5Å; R505-P515 VanDerWaalsContact CZ-O 3.24Å; R505-P515 PolarHBondContact NH1-O 2.86Å; R505-P515 PolarHBondContact NH2-O 3.31Å; P515-E519 HydrophobicContact CB-CB 4.41Å; P515-E519 WeakPolarHBondContact CB-OE2 3.27Å; P515-M520 HydrophobicContact CB-CG 4.49Å; P515-M520 HydrophobicContact CG-CG 3.9Å
516	S	88.8	Confident	88.4	Confident	46 Å²	46	29.9 Å²	29.9	32%	0.322	18%	0.177	S	C	.	.			trans	-61	149.1	178.9	72.1	0	0	0	0	111.3	A518 E519 M520	S516-A518 PolarHBondContact O-N 3.06Å; S516-E519 WeakPolarHBondContact O-CB 3.16Å; S516-E519 PolarHBondContact O-N 3.21Å; S516-E519 VanDerWaalsContact O-N 3.13Å; S516-E519 WeakPolarHBondContact OG-CB 3.33Å; S516-E519 WeakPolarHBondContact OG-CG 3.41Å; S516-E519 PolarHBondContact OG-N 3.12Å; S516-E519 PolarHBondContact OG-OE1 3.45Å; S516-M520 WeakPolarHBondContact O-CG 3.43Å; S516-M520 PolarHBondContact O-N 3.3Å
517	I	91.7	Very high	88.2	Confident	12 Å²	12	32.7 Å²	32.7	6%	0.062	20%	0.201	C	C	.	.	H	α-helix	trans	-59.4	-38.9	-179.4	-58	-57	0	0	0	111	L485 M501 L504 R505 L508 M520 M521	L485-I517 HydrophobicContact CD1-CB 4.04Å; L485-I517 HydrophobicContact CD1-CG2 3.85Å; L485-I517 HydrophobicContact CD2-CG2 4.31Å; M501-I517 HydrophobicContact SD-CG1 4.17Å; L504-I517 HydrophobicContact CB-CD1 4.43Å; L504-I517 HydrophobicContact CB-CG2 3.94Å; L504-I517 HydrophobicContact CD1-CG2 4.06Å; R505-I517 HydrophobicContact CB-CD1 3.62Å; R505-I517 HydrophobicContact CG-CD1 4.13Å; L508-I517 HydrophobicContact CD1-CG2 3.79Å; I517-M520 HydrophobicContact CD1-SD 4.07Å; I517-M520 WeakPolarHBondContact O-CB 3.47Å; I517-M520 PolarHBondContact O-N 3.14Å; I517-M521 HydrophobicContact CG2-CG 4.37Å; I517-M521 HydrophobicContact CG2-SD 3.92Å; I517-M521 VanDerWaalsContact O-CG 3.3Å; I517-M521 WeakPolarHBondContact O-CG 3.46Å; I517-M521 PolarHBondContact O-N 3.45Å
518	A	90.9	Very high	88.1	Confident	3 Å²	3	33.8 Å²	33.8	3%	0.025	21%	0.206	C	C	.	.	H	α-helix	trans	-59.5	-47.8	175.5	0	0	0	0	0	111.3	L478 L481 T482 L485 S516 M520 M521 V522	L478-A518 HydrophobicContact CD1-CB 3.66Å; L481-A518 HydrophobicContact CB-CB 3.96Å; T482-A518 WeakPolarHBondContact OG1-CB 3.16Å; L485-A518 HydrophobicContact CD1-CB 4.03Å; S516-A518 PolarHBondContact O-N 3.06Å; A518-M520 VanDerWaalsContact C-N 3.31Å; A518-M520 PolarHBondContact O-N 2.96Å; A518-M521 PolarHBondContact O-N 3.36Å; A518-V522 WeakPolarHBondContact O-CG2 2.85Å; A518-V522 PolarHBondContact O-N 3.45Å
519	E	87.8	Confident	88	Confident	53 Å²	53	33.8 Å²	33.8	25%	0.248	21%	0.206	C	C	.	.	H	α-helix	trans	-60.8	-39.3	176	-77.5	162.5	-130.1	0	0	112.7	R422 L478 P515 S516 V522 S523	R422-E519 IonicContact CZ-OE2 3.65Å; R422-E519 IonicContact NH1-OE2 3.87Å; R422-E519 PolarHBondContact NH1-OE2 3.37Å; R422-E519 PolarHBondContact NH2-O 3.19Å; L478-E519 HydrophobicContact CD1-CB 4.28Å; L478-E519 HydrophobicContact CD1-CG 3.72Å; L478-E519 HydrophobicContact CD2-CG 4.5Å; P515-E519 HydrophobicContact CB-CB 4.41Å; P515-E519 WeakPolarHBondContact CB-OE2 3.27Å; S516-E519 WeakPolarHBondContact O-CB 3.16Å; S516-E519 PolarHBondContact O-N 3.21Å; S516-E519 VanDerWaalsContact O-N 3.13Å; S516-E519 WeakPolarHBondContact OG-CB 3.33Å; S516-E519 WeakPolarHBondContact OG-CG 3.41Å; S516-E519 PolarHBondContact OG-N 3.12Å; S516-E519 PolarHBondContact OG-OE1 3.45Å; E519-V522 PolarHBondContact O-N 3.33Å; E519-S523 WeakPolarHBondContact O-CB 3.4Å; E519-S523 PolarHBondContact O-N 3.22Å; E519-S523 PolarHBondContact O-OG 3.29Å
520	M	90.3	Very high	88.1	Confident	1 Å²	1	37.1 Å²	37.1	1%	0.005	22%	0.218	C	C	.	.	H	α-helix	trans	-63.7	-44.5	177.6	-65.8	170.9	67.8	0	0	110.9	Y439 R505 L508 S509 P515 S516 I517 A518 S523 L524	Y439-M520 HydrophobicContact CD2-CE 4.18Å; Y439-M520 HydrophobicContact CE2-CB 4.07Å; Y439-M520 HydrophobicContact CE2-CE 4.18Å; Y439-M520 HydrophobicContact CE2-CG 3.96Å; Y439-M520 HydrophobicContact CG-CE 4.44Å; R505-M520 HydrophobicContact CG-CE 4.46Å; R505-M520 HydrophobicContact CG-SD 4.42Å; R505-M520 PolarHBondContact NH1-SD 3.44Å; R505-M520 VanDerWaalsContact NH1-SD 3.4Å; L508-M520 HydrophobicContact CB-CE 3.79Å; L508-M520 HydrophobicContact CD1-CB 4.46Å; S509-M520 WeakPolarHBondContact OG-CE 3.29Å; P515-M520 HydrophobicContact CB-CG 4.49Å; P515-M520 HydrophobicContact CG-CG 3.9Å; S516-M520 WeakPolarHBondContact O-CG 3.43Å; S516-M520 PolarHBondContact O-N 3.3Å; I517-M520 HydrophobicContact CD1-SD 4.07Å; I517-M520 WeakPolarHBondContact O-CB 3.47Å; I517-M520 PolarHBondContact O-N 3.14Å; A518-M520 VanDerWaalsContact C-N 3.31Å; A518-M520 PolarHBondContact O-N 2.96Å; M520-S523 PolarHBondContact O-N 3.1Å; M520-L524 VanDerWaalsContact O-CG 3.3Å; M520-L524 WeakPolarHBondContact O-CG 3.5Å; M520-L524 PolarHBondContact O-N 2.83Å
521	M	92	Very high	88.2	Confident	1 Å²	1	38.7 Å²	38.7	1%	0.005	22%	0.216	C	C	.	.	H	α-helix	trans	-61.8	-47.7	176.8	-70.8	174.8	74.9	0	0	111.2	V465 L468 I469 L481 L485 L508 I517 A518 S523 L524 G525 I529	V465-M521 HydrophobicContact CG1-CE 4.26Å; L468-M521 HydrophobicContact CD2-CE 4.46Å; I469-M521 HydrophobicContact CD1-CE 3.66Å; I469-M521 HydrophobicContact CG1-CE 4.37Å; L481-M521 HydrophobicContact CD1-CB 3.99Å; L481-M521 HydrophobicContact CD2-CE 3.75Å; L481-M521 HydrophobicContact CD2-SD 4.24Å; L485-M521 HydrophobicContact CD1-SD 4.06Å; L485-M521 HydrophobicContact CD2-SD 4.03Å; L485-M521 HydrophobicContact CG-SD 4.47Å; L508-M521 HydrophobicContact CD1-CG 3.63Å; L508-M521 HydrophobicContact CD1-SD 4.37Å; L508-M521 HydrophobicContact CD2-CG 4.34Å; I517-M521 HydrophobicContact CG2-CG 4.37Å; I517-M521 HydrophobicContact CG2-SD 3.92Å; I517-M521 VanDerWaalsContact O-CG 3.3Å; I517-M521 WeakPolarHBondContact O-CG 3.46Å; I517-M521 PolarHBondContact O-N 3.45Å; A518-M521 PolarHBondContact O-N 3.36Å; M521-S523 VanDerWaalsContact C-N 3.27Å; M521-S523 PolarHBondContact O-N 3.08Å; M521-L524 PolarHBondContact O-N 3.38Å; M521-G525 PolarHBondContact O-N 3.49Å; M521-I529 HydrophobicContact CB-CD1 3.59Å; M521-I529 HydrophobicContact CB-CG1 4.45Å; M521-I529 HydrophobicContact CE-CD1 4.07Å; M521-I529 HydrophobicContact CE-CG2 4.37Å; M521-I529 HydrophobicContact CG-CD1 3.89Å; M521-I529 HydrophobicContact CG-CG1 4.39Å; M521-I529 WeakPolarHBondContact O-CD1 3.25Å
522	V	89.3	Confident	88.5	Confident	30 Å²	30	37.4 Å²	37.4	18%	0.182	21%	0.208	C	C	.	.	H	α-helix	trans	-59.6	-39.3	175.9	176.8	0	0	0	0	111.6	L421 L476 L478 L481 A518 E519	L421-V522 HydrophobicContact CD1-CG1 3.98Å; L421-V522 HydrophobicContact CD2-CG1 3.63Å; L421-V522 HydrophobicContact CG-CG1 4.49Å; L476-V522 HydrophobicContact CB-CG2 4.17Å; L478-V522 HydrophobicContact CB-CG2 4.39Å; L478-V522 HydrophobicContact CD1-CG2 4.29Å; L481-V522 HydrophobicContact CD1-CG2 3.57Å; A518-V522 WeakPolarHBondContact O-CG2 2.85Å; A518-V522 PolarHBondContact O-N 3.45Å; E519-V522 PolarHBondContact O-N 3.33Å
523	S	87.6	Confident	89	Confident	7 Å²	7	31.4 Å²	31.4	5%	0.049	18%	0.18	C	C	.	.	H	α-helix	trans	-68.8	-38.1	-179.1	-53.4	0	0	0	0	113.2	R422 E519 M520 M521	R422-S523 PolarHBondContact NH2-OG 3.38Å; E519-S523 WeakPolarHBondContact O-CB 3.4Å; E519-S523 PolarHBondContact O-N 3.22Å; E519-S523 PolarHBondContact O-OG 3.29Å; M520-S523 PolarHBondContact O-N 3.1Å; M521-S523 VanDerWaalsContact C-N 3.27Å; M521-S523 PolarHBondContact O-N 3.08Å
524	L	89.8	Confident	89.3	Confident	8 Å²	8	28.4 Å²	28.4	4%	0.042	17%	0.166	C	C	.	.	H	α-helix	trans	-78.3	-32.3	-179.3	-69.6	169.3	0	0	0	112.4	Y439 L508 M520 M521 E528 I529	Y439-L524 HydrophobicContact CD2-CD1 4.25Å; Y439-L524 HydrophobicContact CD2-CD2 4.15Å; Y439-L524 HydrophobicContact CD2-CG 4.3Å; Y439-L524 HydrophobicContact CE2-CG 4.47Å; Y439-L524 WeakPolarHBondContact O-CD2 3.48Å; L508-L524 HydrophobicContact CB-CD1 4.3Å; L508-L524 HydrophobicContact CD2-CD1 3.79Å; M520-L524 VanDerWaalsContact O-CG 3.3Å; M520-L524 WeakPolarHBondContact O-CG 3.5Å; M520-L524 PolarHBondContact O-N 2.83Å; M521-L524 PolarHBondContact O-N 3.38Å; L524-E528 HydrophobicContact CB-CB 4.22Å; L524-E528 HydrophobicContact CB-CG 4.14Å; L524-E528 HydrophobicContact CD2-CG 3.95Å; L524-E528 WeakPolarHBondContact O-CB 3.36Å; L524-I529 HydrophobicContact CB-CG1 4.35Å
525	G	88.8	Confident	89.6	Confident	18 Å²	18	31.3 Å²	31.3	19%	0.186	17%	0.168	C	C	.	.			trans	78.3	164.9	-174.1	0	0	0	0	0	113.3	M521 A527 E528 I529	M521-G525 PolarHBondContact O-N 3.49Å; G525-A527 PolarHBondContact O-N 3.48Å; G525-E528 PolarHBondContact O-N 2.96Å; G525-I529 WeakPolarHBondContact O-CD1 3.12Å; G525-I529 VanDerWaalsContact O-CG1 3.23Å; G525-I529 WeakPolarHBondContact O-CG1 3.37Å; G525-I529 PolarHBondContact O-N 3.36Å; G525-I529 VanDerWaalsContact O-N 3.17Å
526	P	89.3	Confident	89.7	Confident	13 Å²	13	31.5 Å²	31.5	8%	0.084	17%	0.168	C	C	.	.	H	α-helix	trans	-67.7	-36.7	-167.9	25.6	-34	0	0	0	113.5	I469 L476 I529 R530	I469-P526 HydrophobicContact CG2-CB 3.55Å; L476-P526 HydrophobicContact CD1-CB 4.47Å; P526-I529 PolarHBondContact O-N 2.97Å; P526-R530 WeakPolarHBondContact O-CB 3.41Å; P526-R530 VanDerWaalsContact O-CG 3.3Å; P526-R530 WeakPolarHBondContact O-CG 3.41Å; P526-R530 PolarHBondContact O-N 3.35Å
527	A	88.4	Confident	89.4	Confident	64 Å²	64	32.9 Å²	32.9	53%	0.529	17%	0.171	S	C	.	.	H	α-helix	trans	-61.6	-45.8	179.2	0	0	0	0	0	112	G525 R530 H531	G525-A527 PolarHBondContact O-N 3.48Å; A527-R530 PolarHBondContact O-N 3.08Å; A527-H531 PolarHBondContact O-N 3Å
528	E	90.4	Very high	88.6	Confident	23 Å²	23	37 Å²	37	11%	0.107	19%	0.193	C	C	.	.	H	α-helix	trans	-72	-36.9	-178.8	-177.2	57.2	-163.5	0	0	112.1	R443 L524 G525 H531 R532	R443-E528 WeakPolarHBondContact CG-OE1 3.33Å; R443-E528 IonicContact CZ-OE2 2.81Å; R443-E528 VanDerWaalsContact CZ-OE2 3.29Å; R443-E528 IonicContact NE-OE1 3.37Å; R443-E528 PolarHBondContact NE-OE1 3.03Å; R443-E528 IonicContact NE-OE2 2.96Å; R443-E528 PolarHBondContact NE-OE2 2.86Å; R443-E528 IonicContact NH2-OE2 2.89Å; R443-E528 PolarHBondContact NH2-OE2 3.36Å; L524-E528 HydrophobicContact CB-CB 4.22Å; L524-E528 HydrophobicContact CB-CG 4.14Å; L524-E528 HydrophobicContact CD2-CG 3.95Å; L524-E528 WeakPolarHBondContact O-CB 3.36Å; G525-E528 PolarHBondContact O-N 2.96Å; E528-H531 PolarHBondContact O-N 3.12Å; E528-R532 WeakPolarHBondContact O-CG 3.34Å; E528-R532 PolarHBondContact O-N 3.43Å; E528-R532 IonicContact OE1-CZ 3.44Å; E528-R532 IonicContact OE1-NE 2.71Å; E528-R532 PolarHBondContact OE1-NE 3.36Å; E528-R532 IonicContact OE1-NH2 3.38Å; E528-R532 PolarHBondContact OE1-NH2 3.32Å
529	I	92.3	Very high	87	Confident	0 Å²	0	40.7 Å²	40.7	0%	0	22%	0.217	C	C	.	.	H	α-helix	trans	-59.6	-48.5	171.5	-63.5	163.1	0	0	0	109.9	V465 I469 L476 L508 M521 L524 G525 P526 H531 R532 F533	V465-I529 HydrophobicContact CG1-CG2 4.05Å; I469-I529 HydrophobicContact CD1-CD1 3.75Å; I469-I529 HydrophobicContact CD1-CG2 4.18Å; I469-I529 HydrophobicContact CG1-CB 4.48Å; I469-I529 HydrophobicContact CG1-CD1 4.5Å; I469-I529 HydrophobicContact CG1-CG2 3.84Å; L476-I529 HydrophobicContact CD1-CD1 3.63Å; L508-I529 HydrophobicContact CD2-CG1 4.12Å; L508-I529 HydrophobicContact CD2-CG2 4.45Å; M521-I529 HydrophobicContact CB-CD1 3.59Å; M521-I529 HydrophobicContact CB-CG1 4.45Å; M521-I529 HydrophobicContact CE-CD1 4.07Å; M521-I529 HydrophobicContact CE-CG2 4.37Å; M521-I529 HydrophobicContact CG-CD1 3.89Å; M521-I529 HydrophobicContact CG-CG1 4.39Å; M521-I529 WeakPolarHBondContact O-CD1 3.25Å; L524-I529 HydrophobicContact CB-CG1 4.35Å; G525-I529 WeakPolarHBondContact O-CD1 3.12Å; G525-I529 VanDerWaalsContact O-CG1 3.23Å; G525-I529 WeakPolarHBondContact O-CG1 3.37Å; G525-I529 PolarHBondContact O-N 3.36Å; G525-I529 VanDerWaalsContact O-N 3.17Å; P526-I529 PolarHBondContact O-N 2.97Å; I529-H531 VanDerWaalsContact C-N 3.29Å; I529-H531 PolarHBondContact O-N 2.99Å; I529-R532 PolarHBondContact O-N 2.92Å; I529-F533 HydrophobicContact CG2-CD2 3.73Å; I529-F533 HydrophobicContact CG2-CE2 4.02Å; I529-F533 WeakPolarHBondContact O-CD2 3.32Å; I529-F533 PolarHBondContact O-N 2.81Å
530	R	91.6	Very high	85.4	Confident	77 Å²	77	42.2 Å²	42.2	29%	0.291	23%	0.231	S	C	.	.	H	α-helix	trans	-55.5	-47.5	178.4	-76.1	-179.3	-116.3	151.9	-3.7	110.7	L466 I469 E474 P526 A527 R532 F533 Q534	L466-R530 HydrophobicContact CD2-CB 4.11Å; L466-R530 HydrophobicContact CD2-CG 4.02Å; I469-R530 HydrophobicContact CG2-CG 4.01Å; E474-R530 IonicContact OE1-NH2 3.35Å; P526-R530 WeakPolarHBondContact O-CB 3.41Å; P526-R530 VanDerWaalsContact O-CG 3.3Å; P526-R530 WeakPolarHBondContact O-CG 3.41Å; P526-R530 PolarHBondContact O-N 3.35Å; A527-R530 PolarHBondContact O-N 3.08Å; R530-R532 PolarHBondContact O-N 3.26Å; R530-F533 PolarHBondContact O-N 2.63Å; R530-Q534 WeakPolarHBondContact O-CB 3.3Å; R530-Q534 WeakPolarHBondContact O-CG 3.27Å; R530-Q534 PolarHBondContact O-N 3.46Å
531	H	91	Very high	83.1	Confident	67 Å²	67	49.7 Å²	49.7	31%	0.31	27%	0.271	S	S	.	.	H	α-helix	trans	-59	-48.6	178.1	-171.5	90.1	0	0	0	112.6	R443 A527 E528 I529 F533 Q534	R443-H531 PolarHBondContact NE-CD2 3.39Å; R443-H531 VanDerWaalsContact NE-CD2 3.29Å; R443-H531 PolarHBondContact NH1-NE2 2.97Å; A527-H531 PolarHBondContact O-N 3Å; E528-H531 PolarHBondContact O-N 3.12Å; I529-H531 VanDerWaalsContact C-N 3.29Å; I529-H531 PolarHBondContact O-N 2.99Å; H531-F533 PolarHBondContact O-N 3.31Å; H531-Q534 PolarHBondContact O-N 3.25Å
532	R	92.5	Very high	80.7	Confident	13 Å²	13	52.9 Å²	52.9	5%	0.049	29%	0.294	C	S	.	.	H	α-helix	trans	-63.5	-39.1	-178.4	-70.2	-177.8	-167.6	-157.4	-1.4	112.6	Y439 V507 L508 E528 I529 R530	Y439-R532 PolarHBondContact O-NH1 3.03Å; Y439-R532 PolarHBondContact O-NH2 3.46Å; V507-R532 HydrophobicContact CG1-CB 4.3Å; L508-R532 PolarHBondContact O-NH1 3.46Å; E528-R532 WeakPolarHBondContact O-CG 3.34Å; E528-R532 PolarHBondContact O-N 3.43Å; E528-R532 IonicContact OE1-CZ 3.44Å; E528-R532 IonicContact OE1-NE 2.71Å; E528-R532 PolarHBondContact OE1-NE 3.36Å; E528-R532 IonicContact OE1-NH2 3.38Å; E528-R532 PolarHBondContact OE1-NH2 3.32Å; I529-R532 PolarHBondContact O-N 2.92Å; R530-R532 PolarHBondContact O-N 3.26Å
533	F	92.6	Very high	78.1	Confident	1 Å²	1	57.7 Å²	57.7	0%	0.004	33%	0.327	C	S	.	.	H	α-helix	trans	-81.1	-29.3	-179.4	-81.6	-85.4	0	0	0	113.8	A462 V465 L466 L504 V507 L508 I529 R530 H531 K535 L536	A462-F533 HydrophobicContact CB-CB 4.47Å; A462-F533 HydrophobicContact CB-CD1 3.93Å; V465-F533 HydrophobicContact CB-CD1 4.17Å; V465-F533 HydrophobicContact CB-CE1 4.21Å; V465-F533 HydrophobicContact CB-CG 4.35Å; V465-F533 HydrophobicContact CB-CZ 4.44Å; V465-F533 HydrophobicContact CG1-CD1 4.29Å; V465-F533 HydrophobicContact CG1-CD2 3.83Å; V465-F533 HydrophobicContact CG1-CE1 4.26Å; V465-F533 HydrophobicContact CG1-CE2 3.8Å; V465-F533 HydrophobicContact CG1-CG 4.08Å; V465-F533 HydrophobicContact CG1-CZ 4.03Å; V465-F533 HydrophobicContact CG2-CD1 4.37Å; V465-F533 HydrophobicContact CG2-CE1 3.95Å; V465-F533 HydrophobicContact CG2-CZ 4.16Å; L466-F533 HydrophobicContact CD2-CB 3.96Å; L466-F533 HydrophobicContact CG-CB 4.16Å; L504-F533 HydrophobicContact CD2-CE1 3.62Å; L504-F533 HydrophobicContact CD2-CZ 3.44Å; L504-F533 VanDerWaalsContact CD2-CZ 3.44Å; V507-F533 HydrophobicContact CB-CE1 4.19Å; V507-F533 HydrophobicContact CB-CZ 4.08Å; V507-F533 HydrophobicContact CG1-CD1 3.98Å; V507-F533 HydrophobicContact CG1-CD2 4.11Å; V507-F533 HydrophobicContact CG1-CE1 3.85Å; V507-F533 HydrophobicContact CG1-CE2 3.97Å; V507-F533 HydrophobicContact CG1-CG 4.12Å; V507-F533 HydrophobicContact CG1-CZ 3.83Å; L508-F533 HydrophobicContact CD2-CD2 4.5Å; L508-F533 HydrophobicContact CD2-CE2 3.69Å; L508-F533 HydrophobicContact CG-CE2 3.9Å; L508-F533 HydrophobicContact CG-CZ 4.31Å; I529-F533 HydrophobicContact CG2-CD2 3.73Å; I529-F533 HydrophobicContact CG2-CE2 4.02Å; I529-F533 WeakPolarHBondContact O-CD2 3.32Å; I529-F533 PolarHBondContact O-N 2.81Å; R530-F533 PolarHBondContact O-N 2.63Å; H531-F533 PolarHBondContact O-N 3.31Å; F533-K535 PolarHBondContact O-N 3.5Å; F533-L536 HydrophobicContact CD1-CD1 3.92Å; F533-L536 HydrophobicContact CE1-CD1 4.29Å; F533-L536 WeakPolarHBondContact O-CB 3.5Å; F533-L536 PolarHBondContact O-N 2.98Å
534	Q	90.1	Very high	77.6	Confident	102 Å²	102	60.3 Å²	60.3	48%	0.477	34%	0.341	S	S	.	.	H	α-helix	trans	-59.2	-33.9	174.3	-80.8	171.4	-9.1	0	0	112.3	L466 R530 H531 L536 L537 L538	L466-Q534 HydrophobicContact CD1-CG 4.22Å; L466-Q534 HydrophobicContact CD2-CG 4.37Å; R530-Q534 WeakPolarHBondContact O-CB 3.3Å; R530-Q534 WeakPolarHBondContact O-CG 3.27Å; R530-Q534 PolarHBondContact O-N 3.46Å; H531-Q534 PolarHBondContact O-N 3.25Å; Q534-L536 PolarHBondContact O-N 3.13Å; Q534-L537 WeakPolarHBondContact O-CB 3.49Å; Q534-L537 PolarHBondContact O-N 3.4Å; Q534-L538 PolarHBondContact O-N 2.85Å
535	K	84	Confident	76.9	Confident	98 Å²	98	63 Å²	63	43%	0.426	36%	0.357	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.9	-27.5	174.6	-82.8	-163.5	172.7	-164.4	0	114.2	F533 L537 L538	F533-K535 PolarHBondContact O-N 3.5Å; K535-L537 PolarHBondContact O-N 3.05Å; K535-L538 PolarHBondContact O-N 3.31Å
536	L	84.2	Confident	76.3	Confident	25 Å²	25	65.5 Å²	65.5	13%	0.131	37%	0.367	C	S	.	.	T	Hydrogen-bonded Turn	trans	-77.2	-11.7	176.6	-63.1	174.3	0	0	0	113.8	V451 S459 A462 V507 F533 Q534	V451-L536 HydrophobicContact CG1-CD2 4.15Å; V451-L536 HydrophobicContact CG2-CD2 4.07Å; S459-L536 PolarHBondContact OG-O 3.43Å; A462-L536 HydrophobicContact CB-CB 3.94Å; A462-L536 HydrophobicContact CB-CD1 3.96Å; V507-L536 HydrophobicContact CB-CD1 4.39Å; V507-L536 HydrophobicContact CG1-CD1 3.94Å; V507-L536 HydrophobicContact CG1-CG 4.47Å; V507-L536 HydrophobicContact CG2-CD1 3.57Å; V507-L536 HydrophobicContact CG2-CD2 4.25Å; V507-L536 HydrophobicContact CG2-CG 4.32Å; F533-L536 HydrophobicContact CD1-CD1 3.92Å; F533-L536 HydrophobicContact CE1-CD1 4.29Å; F533-L536 WeakPolarHBondContact O-CB 3.5Å; F533-L536 PolarHBondContact O-N 2.98Å; Q534-L536 PolarHBondContact O-N 3.13Å
537	L	83	Confident	75.5	Confident	74 Å²	74	68.6 Å²	68.6	39%	0.387	38%	0.383	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97.1	-13.3	177.3	-59.1	-178.7	0	0	0	112.1	S459 A462 L466 Q534 K535	S459-L537 WeakPolarHBondContact O-CD2 3.47Å; A462-L537 HydrophobicContact CB-CD2 4Å; A462-L537 HydrophobicContact CB-CG 4.28Å; L466-L537 HydrophobicContact CD1-CD1 3.54Å; Q534-L537 WeakPolarHBondContact O-CB 3.49Å; Q534-L537 PolarHBondContact O-N 3.4Å; K535-L537 PolarHBondContact O-N 3.05Å
538	L	73.8	Confident	74.7	Confident	99 Å²	99	68.9 Å²	68.9	52%	0.518	37%	0.374	S	S	.	.	S	Bend	trans	-74.7	144	176	-66.2	173.8	0	0	0	110.6	Q534 K535	Q534-L538 PolarHBondContact O-N 2.85Å; K535-L538 PolarHBondContact O-N 3.31Å
539	P	57.7	Low	73.7	Confident	80 Å²	80	71.9 Å²	71.9	52%	0.519	39%	0.392	S	S	.	.			trans	-63	149.3	177.2	22.2	-27.8	0	0	0	111.1	D541 S542	P539-D541 PolarHBondContact O-N 3.15Å; P539-S542 PolarHBondContact O-N 3.16Å; P539-S542 VanDerWaalsContact O-N 3.14Å; P539-S542 PolarHBondContact O-OG 2.99Å
540	P	53.7	Low	72.3	Confident	85 Å²	85	77.1 Å²	77.1	55%	0.552	42%	0.42	S	S	*	.	G	3₁₀ helix	trans	-58.4	-16.2	-167.4	20.1	-32	0	0	0	115.5	I448 S542	I448-P540 HydrophobicContact CD1-CB 3.58Å; P540-S542 VanDerWaalsContact C-N 3.35Å
541	D	43.7	Very low	70.8	Confident	158 Å²	158	77.1 Å²	77.1	85%	0.845	43%	0.43	S	S	*	.	G	3₁₀ helix	trans	-88.6	6.5	-178.3	-58.8	-34.8	0	0	0	114.3	P539	P539-D541 PolarHBondContact O-N 3.15Å
542	S	40.5	Very low	69.2	Low	69 Å²	69	77.9 Å²	77.9	48%	0.483	44%	0.44	S	S	.	.	G	3₁₀ helix	trans	-112.3	8.3	-172.6	-25.5	0	0	0	0	114.7	P539 P540	P539-S542 PolarHBondContact O-N 3.16Å; P539-S542 VanDerWaalsContact O-N 3.14Å; P539-S542 PolarHBondContact O-OG 2.99Å; P540-S542 VanDerWaalsContact C-N 3.35Å
543	C	34.3	Very low	67	Low	131 Å²	131	83.8 Å²	83.8	89%	0.885	48%	0.475	S	S	*	.			trans	-100.3	0	-166.9	-140.8	0	0	0	0	113.6

Retrieved 543 of 543 residues in 737.2 ms (Link to these results)

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