A0A087YAB4_POEFO Loading...

Peroxisomal targeting signal 1 receptor

In addition to promoting peroxisomal translocation of proteins containing a PTS1 peroxisomal targeting signal, mediates peroxisomal import of proteins containing a C-terminal PTS2-type peroxisomal targeting signal via its interaction with PEX7. Interaction with PEX7 only takes place when PEX7 is associated with cargo proteins containing a PTS2 peroxisomal targeting signal. PEX7 along with PTS2-containing cargo proteins are then translocated through the PEX13-PEX14 docking complex together with PEX5. Receptor that mediates peroxisomal import of proteins containing a C-terminal PTS1-type tripeptide peroxisomal targeting signal (SKL-type). Binds to cargo proteins containing a PTS1 peroxisomal targeting signal in the cytosol, and translocates them into the peroxisome matrix by passing through the PEX13-PEX14 docking complex along with cargo proteins. PEX5 receptor is then retrotranslocated into the cytosol, leading to release of bound cargo in the peroxisome matrix, and reset for a subsequent peroxisome import cycle.

AlphaFold DB , UniProt , Accession A0A087YAB4, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 639 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	39.4	Very low	39.1	Very low	248 Å²	248	155.1 Å²	155.1	100%	1.222	83%	0.83	S	S	*	*				0	89.7	0	-69.9	-146.6	-73.4	0	0	107.8
2	A	39.9	Very low	39.9	Very low	96 Å²	96	149.4 Å²	149.4	79%	0.793	84%	0.835	S	S	*	*			trans	-156.5	16.6	-175.6	0	0	0	0	0	113.5
3	M	37.9	Very low	40.2	Very low	161 Å²	161	142.5 Å²	142.5	79%	0.793	82%	0.818	S	S	*	*			trans	-144.5	57.8	-178.5	-70.4	-64.4	-114.9	0	0	109.3	L6	M3-L6 HydrophobicContact CE-CD1 4.19Å; M3-L6 HydrophobicContact SD-CD1 3.97Å
4	R	37.1	Very low	40.6	Very low	198 Å²	198	138.2 Å²	138.2	75%	0.747	81%	0.808	S	S	*	*			trans	-118	-15.2	175.1	-157.6	173.9	179.9	171.9	0.7	113.3	L6	R4-L6 VanDerWaalsContact C-N 3.29Å; R4-L6 PolarHBondContact O-N 3.37Å
5	E	39.3	Very low	40.8	Very low	189 Å²	189	135.5 Å²	135.5	88%	0.883	79%	0.789	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.5	16.4	-178.7	-62.7	178.7	-179.9	0	0	114
6	L	45.5	Very low	41.2	Very low	127 Å²	127	132.8 Å²	132.8	67%	0.665	78%	0.778	S	S	*	*	T	Hydrogen-bonded Turn	trans	-114.1	7.8	-178.6	-74.1	171.9	0	0	0	113.9	M3 R4	M3-L6 HydrophobicContact CE-CD1 4.19Å; M3-L6 HydrophobicContact SD-CD1 3.97Å; R4-L6 VanDerWaalsContact C-N 3.29Å; R4-L6 PolarHBondContact O-N 3.37Å
7	V	39.7	Very low	41.3	Very low	133 Å²	133	132.7 Å²	132.7	81%	0.806	77%	0.772	S	S	*	*	S	Bend	trans	-131.8	-16.8	-173.9	-172	0	0	0	0	113.4
8	E	35.6	Very low	41.5	Very low	146 Å²	146	132.7 Å²	132.7	68%	0.682	77%	0.765	S	S	*	*			trans	-100.6	111.7	177.5	-69.7	176.5	-156.2	0	0	109.2	E10	E8-E10 PolarHBondContact O-N 2.59Å
9	A	40.8	Very low	41.6	Very low	95 Å²	95	134.4 Å²	134.4	79%	0.785	76%	0.763	S	S	*	*			trans	-84.3	103.4	176.9	0	0	0	0	0	110	C11	A9-C11 PolarHBondContact O-N 3.43Å
10	E	37.6	Very low	41.4	Very low	176 Å²	176	134.6 Å²	134.6	82%	0.822	76%	0.761	S	S	*	*			trans	-73.9	110.4	166.2	-67.8	-175.1	158.5	0	0	109.3	E8 G12 G13	E8-E10 PolarHBondContact O-N 2.59Å; E10-G12 PolarHBondContact O-N 3.04Å; E10-G12 VanDerWaalsContact O-N 3.14Å; E10-G13 PolarHBondContact O-N 2.95Å
11	C	37.7	Very low	41.3	Very low	137 Å²	137	133 Å²	133	93%	0.926	75%	0.754	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63.7	113.5	177.6	-59.9	0	0	0	0	110.4	A9	A9-C11 PolarHBondContact O-N 3.43Å
12	G	47.8	Very low	41.2	Very low	87 Å²	87	123.1 Å²	123.1	90%	0.897	72%	0.716	S	S	*	*	T	Hydrogen-bonded Turn	trans	120.4	-9.5	177.8	0	0	0	0	0	115.3	E10	E10-G12 PolarHBondContact O-N 3.04Å; E10-G12 VanDerWaalsContact O-N 3.14Å
13	G	44.9	Very low	40.9	Very low	60 Å²	60	126.5 Å²	126.5	62%	0.619	72%	0.715	S	S	*	*	S	Bend	trans	-83.4	150.2	175.5	0	0	0	0	0	114	E10	E10-G13 PolarHBondContact O-N 2.95Å
14	A	44.9	Very low	40.7	Very low	82 Å²	82	127.4 Å²	127.4	68%	0.678	72%	0.72	S	S	*	*	P	Polyproline II helix	trans	-64.1	142.9	172.3	0	0	0	0	0	112	M18	A14-M18 HydrophobicContact CB-SD 4.46Å
15	N	43.8	Very low	40.7	Very low	97 Å²	97	123.7 Å²	123.7	52%	0.519	72%	0.719	S	S	.	*	P	Polyproline II helix	trans	-51.9	129.2	-173.8	-174.7	-19.3	0	0	0	112.1	L17 M18	N15-L17 PolarHBondContact O-N 3.26Å; N15-L17 PolarHBondContact OD1-N 2.65Å; N15-M18 WeakPolarHBondContact O-CB 3.33Å; N15-M18 PolarHBondContact O-N 3.06Å
16	P	47.4	Very low	40.5	Very low	93 Å²	93	123.6 Å²	123.6	60%	0.604	72%	0.716	S	S	*	*	T	Hydrogen-bonded Turn	trans	-56.2	-21.3	-175	18.2	-32	0	0	0	115.4	M18 K19	P16-M18 VanDerWaalsContact C-N 3.28Å; P16-M18 PolarHBondContact O-N 3.39Å; P16-K19 PolarHBondContact O-N 3.03Å
17	L	42.8	Very low	39.8	Very low	131 Å²	131	126.2 Å²	126.2	69%	0.686	73%	0.725	S	S	*	*	T	Hydrogen-bonded Turn	trans	-62.5	-28.9	171.6	-83.9	160.1	0	0	0	113.8	N15 K19 L20	N15-L17 PolarHBondContact O-N 3.26Å; N15-L17 PolarHBondContact OD1-N 2.65Å; L17-K19 PolarHBondContact O-N 3.43Å; L17-L20 PolarHBondContact O-N 3.46Å
18	M	45	Very low	39.3	Very low	132 Å²	132	129.9 Å²	129.9	65%	0.65	73%	0.733	S	S	*	*	H	α-helix	trans	-70.9	-14	177.5	-69.4	-179.2	73.5	0	0	113.7	A14 N15 P16 L20 T21	A14-M18 HydrophobicContact CB-SD 4.46Å; N15-M18 WeakPolarHBondContact O-CB 3.33Å; N15-M18 PolarHBondContact O-N 3.06Å; P16-M18 VanDerWaalsContact C-N 3.28Å; P16-M18 PolarHBondContact O-N 3.39Å; M18-L20 VanDerWaalsContact C-N 3.3Å; M18-T21 PolarHBondContact O-OG1 3.02Å
19	K	43.1	Very low	39.1	Very low	166 Å²	166	126.6 Å²	126.6	72%	0.722	74%	0.739	S	S	*	*	H	α-helix	trans	-75.8	-18.2	175.1	-72.9	-179.3	177.3	173.6	0	112.9	P16 L17	P16-K19 PolarHBondContact O-N 3.03Å; L17-K19 PolarHBondContact O-N 3.43Å
20	L	37.8	Very low	38.7	Very low	138 Å²	138	125.5 Å²	125.5	72%	0.723	73%	0.73	S	S	*	*	H	α-helix	trans	-75	-38.1	-178.4	-144.5	89.7	0	0	0	112.4	L17 M18 G22 H23	L17-L20 PolarHBondContact O-N 3.46Å; M18-L20 VanDerWaalsContact C-N 3.3Å; L20-G22 VanDerWaalsContact C-N 3.34Å; L20-G22 PolarHBondContact O-N 3.39Å; L20-H23 PolarHBondContact O-N 2.64Å
21	T	38.4	Very low	38.2	Very low	100 Å²	100	128.9 Å²	128.9	61%	0.613	74%	0.735	S	S	*	*	H	α-helix	trans	-72.3	-24.2	-174.9	52.3	0	0	0	0	113.6	M18 H23	M18-T21 PolarHBondContact O-OG1 3.02Å; T21-H23 VanDerWaalsContact C-N 3.26Å; T21-H23 PolarHBondContact O-N 3.14Å
22	G	37.3	Very low	37.7	Very low	42 Å²	42	132.9 Å²	132.9	43%	0.433	73%	0.731	S	S	.	*	T	Hydrogen-bonded Turn	trans	-72.5	-10.3	177.9	0	0	0	0	0	115.5	L20	L20-G22 VanDerWaalsContact C-N 3.34Å; L20-G22 PolarHBondContact O-N 3.39Å
23	H	35.5	Very low	36.8	Very low	166 Å²	166	136.7 Å²	136.7	77%	0.769	73%	0.725	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92.3	-21.4	-179.3	-86.9	-83.3	0	0	0	114.3	L20 T21	L20-H23 PolarHBondContact O-N 2.64Å; T21-H23 VanDerWaalsContact C-N 3.26Å; T21-H23 PolarHBondContact O-N 3.14Å
24	M	32.8	Very low	35.8	Very low	181 Å²	181	145.9 Å²	145.9	89%	0.892	74%	0.741	S	S	*	*	S	Bend	trans	-86.3	-14.8	-179.1	-75.1	-173.3	166.4	0	0	114.5
25	T	37.1	Very low	35	Very low	120 Å²	120	146.4 Å²	146.4	74%	0.736	74%	0.74	S	S	*	*	S	Bend	trans	-94.2	11.2	-172.7	51.1	0	0	0	0	115
26	K	35	Very low	34.1	Very low	186 Å²	186	148.2 Å²	148.2	81%	0.809	76%	0.755	S	S	*	*	S	Bend	trans	-114.2	-0.3	-172.8	-97.1	-179.4	178.5	172	0	117.2
27	E	30.9	Very low	33.9	Very low	183 Å²	183	149.1 Å²	149.1	86%	0.855	76%	0.76	S	S	*	*	S	Bend	trans	-114.2	-5.7	-173.5	-103.6	-176.8	168.4	0	0	117.9	G29	E27-G29 VanDerWaalsContact C-N 3.27Å; E27-G29 PolarHBondContact O-N 3.23Å
28	E	30	Very low	33	Very low	209 Å²	209	149.9 Å²	149.9	98%	0.977	77%	0.77	S	S	*	*			trans	-87.6	62.1	170	-64.7	-144.1	146.5	0	0	112.5
29	G	31	Very low	32.1	Very low	78 Å²	78	151.6 Å²	151.6	80%	0.804	78%	0.781	S	S	*	*			trans	-120.3	-1.5	-175.9	0	0	0	0	0	116.1	E27	E27-G29 VanDerWaalsContact C-N 3.27Å; E27-G29 PolarHBondContact O-N 3.23Å
30	A	31.5	Very low	31.7	Very low	72 Å²	72	147.5 Å²	147.5	60%	0.595	78%	0.778	S	S	*	*			trans	-147.1	131.3	170.1	0	0	0	0	0	106
31	W	27.7	Very low	31.4	Very low	246 Å²	246	147.1 Å²	147.1	93%	0.932	78%	0.783	S	S	*	*			cis	-147.8	152.9	47.5	-70.1	78.6	0	0	0	112.1
32	R	27.3	Very low	31.4	Very low	221 Å²	221	148.5 Å²	148.5	83%	0.834	79%	0.792	S	S	*	*			trans	-133.4	148.3	163.4	-86	-166.8	174.3	-172.2	0.9	112.7
33	H	27.8	Very low	31.4	Very low	168 Å²	168	151.9 Å²	151.9	78%	0.778	81%	0.806	S	S	*	*			trans	81.1	99.8	163.7	-55.9	-64.1	0	0	0	120.1
34	R	25.3	Very low	31.3	Very low	252 Å²	252	151 Å²	151	95%	0.951	81%	0.806	S	S	*	*				-153.7	169.8	112.7	-116.7	179.9	-173.9	-141.1	0.6	112.3
35	S	27.1	Very low	31.2	Very low	93 Å²	93	151.4 Å²	151.4	65%	0.65	81%	0.806	S	S	*	*			trans	-140.3	136.6	-148.3	52.7	0	0	0	0	115.3
36	T	24.9	Very low	31.2	Very low	136 Å²	136	153.4 Å²	153.4	83%	0.834	81%	0.81	S	S	*	*			trans	71.6	169.4	151.9	68.8	0	0	0	0	117.9
37	P	42.9	Very low	31.5	Very low	112 Å²	112	148.1 Å²	148.1	73%	0.727	80%	0.801	S	S	*	*				-137.4	162.3	-86.4	37.7	-18.1	0	0	0	115.5
38	T	24.4	Very low	32.7	Very low	146 Å²	146	143.2 Å²	143.2	90%	0.896	78%	0.784	S	S	*	*			trans	-156.5	144.6	167.4	-4.2	0	0	0	0	116.3
39	I	26.8	Very low	33.5	Very low	169 Å²	169	141.3 Å²	141.3	87%	0.867	78%	0.775	S	S	*	*			trans	-149.8	139.9	178.9	-66	172.5	0	0	0	105.5
40	A	34.1	Very low	34.4	Very low	80 Å²	80	145 Å²	145	66%	0.661	77%	0.771	S	S	*	*			cis	-151.2	-163.5	-15.8	0	0	0	0	0	107.4
41	P	30.8	Very low	35.4	Very low	129 Å²	129	147.1 Å²	147.1	84%	0.838	77%	0.769	S	S	*	*				-150.5	160.9	103.5	37.4	-20.1	0	0	0	116.9
42	T	39.6	Very low	36.6	Very low	130 Å²	130	140.5 Å²	140.5	80%	0.798	75%	0.751	S	S	*	*			trans	-110.7	170.2	175.9	52.5	0	0	0	0	112.8
43	P	38.1	Very low	38.1	Very low	112 Å²	112	134 Å²	134	73%	0.727	74%	0.736	S	S	*	*			trans	-136.4	166.5	132	24.9	-6.3	0	0	0	111.8
44	I	31.6	Very low	39.2	Very low	149 Å²	149	130.3 Å²	130.3	76%	0.764	72%	0.721	S	S	*	*			cis	-160	133.7	-17.8	-100.2	161.4	0	0	0	103.4
45	E	31.9	Very low	40.8	Very low	189 Å²	189	125.2 Å²	125.2	88%	0.883	71%	0.709	S	S	*	*				-163.6	156.5	100.7	-84	-170.6	168.4	0	0	110.8
46	I	36	Very low	42	Very low	161 Å²	161	129.1 Å²	129.1	83%	0.826	71%	0.714	S	S	*	*			trans	-124.4	126.7	-166.1	-61.8	166.6	0	0	0	111
47	A	41.9	Very low	43.4	Very low	76 Å²	76	128.5 Å²	128.5	63%	0.628	71%	0.705	S	S	*	*			trans	-101.3	158.2	160.8	0	0	0	0	0	110.3
48	T	55.6	Low	43.5	Very low	79 Å²	79	130.5 Å²	130.5	49%	0.485	71%	0.705	S	S	.	*			trans	-99.6	146.7	-167.6	63.3	0	0	0	0	114.2	E50 E51	T48-E50 VanDerWaalsContact C-N 3.26Å; T48-E50 PolarHBondContact O-N 3.13Å; T48-E51 PolarHBondContact N-OE2 2.61Å; T48-E51 WeakPolarHBondContact O-CB 3.47Å; T48-E51 PolarHBondContact O-N 3.05Å; T48-E51 VanDerWaalsContact O-N 3.09Å; T48-E51 PolarHBondContact OG1-OE2 3.19Å
49	E	48	Very low	44.1	Very low	169 Å²	169	127.4 Å²	127.4	79%	0.79	69%	0.694	S	S	*	*	H	α-helix	trans	-60.1	-30.7	-173.6	-67.5	-178.4	134.2	0	0	113.8	E51 V53	E49-E51 VanDerWaalsContact C-N 3.27Å; E49-E51 PolarHBondContact O-N 3.47Å; E49-V53 WeakPolarHBondContact O-CG2 3.48Å; E49-V53 PolarHBondContact O-N 3.32Å
50	E	49.7	Very low	44.7	Very low	155 Å²	155	124.6 Å²	124.6	72%	0.724	69%	0.686	S	S	*	*	H	α-helix	trans	-68.4	-24	178.6	-66.9	-169	155.4	0	0	113.1	T48 N54	T48-E50 VanDerWaalsContact C-N 3.26Å; T48-E50 PolarHBondContact O-N 3.13Å; E50-N54 PolarHBondContact O-N 2.91Å; E50-N54 PolarHBondContact O-ND2 3.43Å
51	E	52.7	Low	45.2	Very low	118 Å²	118	127 Å²	127	55%	0.551	70%	0.696	S	S	*	*	H	α-helix	trans	-74.8	-48.3	178	-65.9	168.5	120.3	0	0	110.4	T48 E49 V53 N54 E55	T48-E51 PolarHBondContact N-OE2 2.61Å; T48-E51 WeakPolarHBondContact O-CB 3.47Å; T48-E51 PolarHBondContact O-N 3.05Å; T48-E51 VanDerWaalsContact O-N 3.09Å; T48-E51 PolarHBondContact OG1-OE2 3.19Å; E49-E51 VanDerWaalsContact C-N 3.27Å; E49-E51 PolarHBondContact O-N 3.47Å; E51-V53 PolarHBondContact O-N 2.99Å; E51-N54 PolarHBondContact O-N 3.39Å; E51-E55 PolarHBondContact O-N 3.1Å; E51-E55 VanDerWaalsContact O-N 3.1Å
52	L	52.9	Low	45.4	Very low	107 Å²	107	132.2 Å²	132.2	56%	0.56	70%	0.698	S	S	*	*	H	α-helix	trans	-63.9	-38.2	179.4	-64.9	171.8	0	0	0	112.5	E55 F56	L52-E55 PolarHBondContact O-N 3.06Å; L52-F56 PolarHBondContact O-N 2.91Å; L52-F56 VanDerWaalsContact O-N 3.17Å
53	V	57.5	Low	45.4	Very low	84 Å²	84	131.4 Å²	131.4	51%	0.509	70%	0.695	S	S	.	*	H	α-helix	trans	-68.9	-35.9	177.6	172.6	0	0	0	0	111.7	E49 E51 L57	E49-V53 WeakPolarHBondContact O-CG2 3.48Å; E49-V53 PolarHBondContact O-N 3.32Å; E51-V53 PolarHBondContact O-N 2.99Å; V53-L57 HydrophobicContact CG1-CD1 3.85Å; V53-L57 VanDerWaalsContact O-CG 3.28Å; V53-L57 WeakPolarHBondContact O-CG 3.45Å; V53-L57 PolarHBondContact O-N 2.88Å
54	N	52.2	Low	45.7	Very low	90 Å²	90	131.9 Å²	131.9	48%	0.481	70%	0.698	S	S	.	*	H	α-helix	trans	-70.9	-33.5	175.9	-85.6	-59.3	0	0	0	112.9	E50 E51 Q58	E50-N54 PolarHBondContact O-N 2.91Å; E50-N54 PolarHBondContact O-ND2 3.43Å; E51-N54 PolarHBondContact O-N 3.39Å; N54-Q58 WeakPolarHBondContact O-CG 3.33Å
55	E	57.5	Low	46.1	Very low	146 Å²	146	133.8 Å²	133.8	68%	0.682	70%	0.704	S	S	*	*	H	α-helix	trans	-66.3	-45.2	175.4	-171	171.4	-158.8	0	0	111.4	E51 L52 L57 Q58	E51-E55 PolarHBondContact O-N 3.1Å; E51-E55 VanDerWaalsContact O-N 3.1Å; L52-E55 PolarHBondContact O-N 3.06Å; E55-L57 VanDerWaalsContact C-N 3.35Å; E55-L57 PolarHBondContact O-N 2.76Å; E55-Q58 PolarHBondContact O-N 2.72Å
56	F	52.7	Low	46.6	Very low	174 Å²	174	131.4 Å²	131.4	76%	0.763	70%	0.703	S	S	*	*	H	α-helix	trans	-63	-36.9	178	-174.6	-102.3	0	0	0	113.4	L52 Q58	L52-F56 PolarHBondContact O-N 2.91Å; L52-F56 VanDerWaalsContact O-N 3.17Å; F56-Q58 VanDerWaalsContact C-N 3.33Å; F56-Q58 PolarHBondContact O-N 3.29Å
57	L	54	Low	47.2	Very low	123 Å²	123	131.2 Å²	131.2	64%	0.644	70%	0.696	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.8	-5.9	-175.6	-70.1	173.5	0	0	0	115	V53 E55	V53-L57 HydrophobicContact CG1-CD1 3.85Å; V53-L57 VanDerWaalsContact O-CG 3.28Å; V53-L57 WeakPolarHBondContact O-CG 3.45Å; V53-L57 PolarHBondContact O-N 2.88Å; E55-L57 VanDerWaalsContact C-N 3.35Å; E55-L57 PolarHBondContact O-N 2.76Å
58	Q	46.3	Very low	47.7	Very low	155 Å²	155	132.7 Å²	132.7	72%	0.724	69%	0.693	S	S	*	*	T	Hydrogen-bonded Turn	trans	-101	-3.3	-177.2	-72.3	-177.1	40.2	0	0	115.1	N54 E55 F56	N54-Q58 WeakPolarHBondContact O-CG 3.33Å; E55-Q58 PolarHBondContact O-N 2.72Å; F56-Q58 VanDerWaalsContact C-N 3.33Å; F56-Q58 PolarHBondContact O-N 3.29Å
59	A	36.6	Very low	47.4	Very low	80 Å²	80	134 Å²	134	66%	0.661	70%	0.695	S	S	*	*	P	Polyproline II helix	trans	-80.7	124.1	-178.9	0	0	0	0	0	113
60	P	39.4	Very low	48	Very low	110 Å²	110	127.9 Å²	127.9	71%	0.714	68%	0.677	S	S	*	*	P	Polyproline II helix	trans	-79	147.4	177.7	31.7	-34.6	0	0	0	112.5
61	P	43.4	Very low	48.4	Very low	132 Å²	132	126.8 Å²	126.8	86%	0.857	67%	0.672	S	S	*	*	P	Polyproline II helix	trans	-74.4	136.1	-177.4	30.2	-34.7	0	0	0	112.4
62	R	36.7	Very low	48.4	Very low	237 Å²	237	124.2 Å²	124.2	89%	0.894	66%	0.662	S	S	*	*	P	Polyproline II helix	trans	-86.3	145.8	167.5	-60.1	-176.6	-172.9	-178.9	3.8	109.8
63	P	38.4	Very low	48.7	Very low	113 Å²	113	124 Å²	124	73%	0.734	66%	0.66	S	S	*	*	P	Polyproline II helix	trans	-74.9	150.3	178.5	31.8	-34.9	0	0	0	111.7
64	P	44.1	Very low	48.9	Very low	122 Å²	122	125.7 Å²	125.7	79%	0.792	66%	0.663	S	S	*	*	P	Polyproline II helix	trans	-76	143.7	173.3	31.7	-33.7	0	0	0	111.4
65	H	41.6	Very low	49.2	Very low	190 Å²	190	126.6 Å²	126.6	88%	0.88	66%	0.664	S	S	*	*	P	Polyproline II helix	trans	-72.3	140.2	168.8	-75	-91.1	0	0	0	110.6
66	T	42.4	Very low	48.8	Very low	139 Å²	139	124.7 Å²	124.7	85%	0.853	66%	0.656	S	S	*	*	P	Polyproline II helix	trans	-83.4	125.7	177.1	45.7	0	0	0	0	111.1
67	F	48.5	Very low	48.7	Very low	156 Å²	156	122.5 Å²	122.5	68%	0.684	65%	0.649	S	S	*	*	P	Polyproline II helix	trans	-69.9	121.5	174	-171.4	-92.6	0	0	0	110.7	M69 L72	F67-M69 HydrophobicContact CD1-CG 4.41Å; F67-M69 HydrophobicContact CD1-SD 4.41Å; F67-M69 HydrophobicContact CE1-CG 4.44Å; F67-M69 HydrophobicContact CE1-SD 3.91Å; F67-L72 HydrophobicContact CE1-CB 4.47Å; F67-L72 HydrophobicContact CE1-CD2 4.14Å; F67-L72 HydrophobicContact CZ-CB 4.42Å; F67-L72 HydrophobicContact CZ-CD1 4.16Å; F67-L72 HydrophobicContact CZ-CD2 4.02Å; F67-L72 HydrophobicContact CZ-CG 4.43Å
68	D	51.1	Low	48.7	Very low	108 Å²	108	121.7 Å²	121.7	58%	0.578	64%	0.642	S	S	*	*			trans	-95.1	107.3	177.6	-164.9	-15.5	0	0	0	110.8	G70 Q71	D68-G70 PolarHBondContact O-N 2.97Å; D68-G70 VanDerWaalsContact O-N 3.13Å; D68-G70 PolarHBondContact OD1-N 3.49Å; D68-Q71 PolarHBondContact O-N 3.27Å
69	M	48.9	Very low	49	Very low	107 Å²	107	119 Å²	119	53%	0.527	63%	0.631	S	S	.	*	H	α-helix	trans	-60.3	-17.6	176	-81.6	-71.1	-59.8	0	0	113.6	F67 L72 L73	F67-M69 HydrophobicContact CD1-CG 4.41Å; F67-M69 HydrophobicContact CD1-SD 4.41Å; F67-M69 HydrophobicContact CE1-CG 4.44Å; F67-M69 HydrophobicContact CE1-SD 3.91Å; M69-L72 HydrophobicContact SD-CD2 4.28Å; M69-L73 HydrophobicContact CE-CD1 4.44Å; M69-L73 WeakPolarHBondContact O-CG 3.16Å; M69-L73 PolarHBondContact O-N 3.35Å
70	G	61.2	Low	49.5	Very low	39 Å²	39	119.8 Å²	119.8	40%	0.402	62%	0.624	S	S	.	*	H	α-helix	trans	-63	-48.6	175.6	0	0	0	0	0	112.5	D68 L73 E74	D68-G70 PolarHBondContact O-N 2.97Å; D68-G70 VanDerWaalsContact O-N 3.13Å; D68-G70 PolarHBondContact OD1-N 3.49Å; G70-L73 PolarHBondContact O-N 2.97Å; G70-E74 PolarHBondContact O-N 2.88Å; G70-E74 VanDerWaalsContact O-N 3.14Å
71	Q	57.9	Low	49.8	Very low	132 Å²	132	121.3 Å²	121.3	62%	0.617	62%	0.622	S	S	*	*	H	α-helix	trans	-64.4	-43.5	179.6	-81.9	-173.9	-55.2	0	0	112.1	D68 L73 E74 E75	D68-Q71 PolarHBondContact O-N 3.27Å; Q71-L73 VanDerWaalsContact C-N 3.29Å; Q71-L73 PolarHBondContact O-N 3.3Å; Q71-E74 PolarHBondContact O-N 3.37Å; Q71-E74 VanDerWaalsContact O-N 3.12Å; Q71-E75 PolarHBondContact O-N 3.14Å
72	L	53.4	Low	50.1	Low	64 Å²	64	122.2 Å²	122.2	34%	0.335	62%	0.615	S	S	.	*	H	α-helix	trans	-60.8	-39.1	-179.6	-167.6	79.4	0	0	0	112.2	F67 M69 M76	F67-L72 HydrophobicContact CE1-CB 4.47Å; F67-L72 HydrophobicContact CE1-CD2 4.14Å; F67-L72 HydrophobicContact CZ-CB 4.42Å; F67-L72 HydrophobicContact CZ-CD1 4.16Å; F67-L72 HydrophobicContact CZ-CD2 4.02Å; F67-L72 HydrophobicContact CZ-CG 4.43Å; M69-L72 HydrophobicContact SD-CD2 4.28Å; L72-M76 WeakPolarHBondContact O-CB 3.45Å; L72-M76 WeakPolarHBondContact O-CG 3.28Å; L72-M76 PolarHBondContact O-N 3.42Å
73	L	58.4	Low	50.4	Low	102 Å²	102	114.8 Å²	114.8	53%	0.534	60%	0.599	S	S	.	*	H	α-helix	trans	-72.1	-32.3	177.5	-72.8	170.1	0	0	0	112.3	M69 G70 Q71 Q77	M69-L73 HydrophobicContact CE-CD1 4.44Å; M69-L73 WeakPolarHBondContact O-CG 3.16Å; M69-L73 PolarHBondContact O-N 3.35Å; G70-L73 PolarHBondContact O-N 2.97Å; Q71-L73 VanDerWaalsContact C-N 3.29Å; Q71-L73 PolarHBondContact O-N 3.3Å; L73-Q77 WeakPolarHBondContact O-CB 3.41Å; L73-Q77 PolarHBondContact O-N 2.8Å; L73-Q77 VanDerWaalsContact O-N 3.07Å
74	E	61.4	Low	50.8	Low	121 Å²	121	118.7 Å²	118.7	57%	0.565	60%	0.601	S	S	*	*	H	α-helix	trans	-71	-40.8	175	-165.1	164	-152	0	0	111.4	G70 Q71 Q77 Q78	G70-E74 PolarHBondContact O-N 2.88Å; G70-E74 VanDerWaalsContact O-N 3.14Å; Q71-E74 PolarHBondContact O-N 3.37Å; Q71-E74 VanDerWaalsContact O-N 3.12Å; E74-Q77 PolarHBondContact O-N 2.89Å; E74-Q78 WeakPolarHBondContact O-CG 3.38Å; E74-Q78 PolarHBondContact O-N 3.01Å
75	E	58.6	Low	50.6	Low	109 Å²	109	123.8 Å²	123.8	51%	0.509	60%	0.604	S	S	.	*	H	α-helix	trans	-63.8	-47	171.6	-74.3	-177.4	160.5	0	0	112.2	Q71 Q77 Q78 I79	Q71-E75 PolarHBondContact O-N 3.14Å; E75-Q77 VanDerWaalsContact C-N 3.26Å; E75-Q77 PolarHBondContact O-N 3.29Å; E75-Q78 PolarHBondContact O-N 3.15Å; E75-I79 VanDerWaalsContact O-CG1 3.31Å; E75-I79 WeakPolarHBondContact O-CG1 3.34Å; E75-I79 PolarHBondContact O-N 2.87Å
76	M	49.3	Very low	50.3	Low	105 Å²	105	121 Å²	121	52%	0.517	59%	0.591	S	S	.	*	H	α-helix	trans	-58.4	-39.1	175	-75.8	-171.7	74.2	0	0	111.9	L72 Q78 I79 D80	L72-M76 WeakPolarHBondContact O-CB 3.45Å; L72-M76 WeakPolarHBondContact O-CG 3.28Å; L72-M76 PolarHBondContact O-N 3.42Å; M76-Q78 VanDerWaalsContact C-N 3.35Å; M76-Q78 PolarHBondContact O-N 3.2Å; M76-I79 PolarHBondContact O-N 3.27Å; M76-D80 WeakPolarHBondContact O-CB 3.46Å; M76-D80 PolarHBondContact O-N 2.85Å
77	Q	50.6	Low	49.9	Very low	129 Å²	129	118.1 Å²	118.1	60%	0.603	58%	0.582	S	S	*	*	H	α-helix	trans	-69	-29.4	175.6	-114.3	-175.4	4.9	0	0	113.8	L73 E74 E75 Q81	L73-Q77 WeakPolarHBondContact O-CB 3.41Å; L73-Q77 PolarHBondContact O-N 2.8Å; L73-Q77 VanDerWaalsContact O-N 3.07Å; E74-Q77 PolarHBondContact O-N 2.89Å; E75-Q77 VanDerWaalsContact C-N 3.26Å; E75-Q77 PolarHBondContact O-N 3.29Å; Q77-Q81 VanDerWaalsContact O-CG 3.28Å; Q77-Q81 WeakPolarHBondContact O-CG 3.49Å; Q77-Q81 PolarHBondContact O-N 2.81Å; Q77-Q81 PolarHBondContact O-NE2 3.46Å
78	Q	54.5	Low	49.3	Very low	105 Å²	105	117.1 Å²	117.1	49%	0.491	59%	0.591	S	S	.	*	H	α-helix	trans	-74.3	-40.7	173.8	-72.2	176.5	19.7	0	0	111.4	E74 E75 M76 Q81 Q82	E74-Q78 WeakPolarHBondContact O-CG 3.38Å; E74-Q78 PolarHBondContact O-N 3.01Å; E75-Q78 PolarHBondContact O-N 3.15Å; M76-Q78 VanDerWaalsContact C-N 3.35Å; M76-Q78 PolarHBondContact O-N 3.2Å; Q78-Q81 PolarHBondContact O-N 3.4Å; Q78-Q82 WeakPolarHBondContact O-CG 3.48Å; Q78-Q82 PolarHBondContact O-N 3.39Å
79	I	52.3	Low	48.6	Very low	98 Å²	98	118.8 Å²	118.8	50%	0.503	60%	0.595	S	S	.	*	H	α-helix	trans	-64.7	-43.9	176.5	-66.6	162.9	0	0	0	111.1	E75 M76 Q81 Q82 S83	E75-I79 VanDerWaalsContact O-CG1 3.31Å; E75-I79 WeakPolarHBondContact O-CG1 3.34Å; E75-I79 PolarHBondContact O-N 2.87Å; M76-I79 PolarHBondContact O-N 3.27Å; I79-Q81 VanDerWaalsContact C-N 3.27Å; I79-Q81 PolarHBondContact O-N 2.94Å; I79-Q82 PolarHBondContact O-N 3.37Å; I79-S83 PolarHBondContact O-N 2.87Å; I79-S83 VanDerWaalsContact O-N 3.13Å; I79-S83 PolarHBondContact O-OG 2.93Å
80	D	47.2	Very low	47.9	Very low	98 Å²	98	124.4 Å²	124.4	52%	0.524	61%	0.611	S	S	.	*	H	α-helix	trans	-62	-34.1	174.1	-85.3	-16.5	0	0	0	111.9	M76 S83 Y84	M76-D80 WeakPolarHBondContact O-CB 3.46Å; M76-D80 PolarHBondContact O-N 2.85Å; D80-S83 PolarHBondContact O-N 2.99Å; D80-Y84 WeakPolarHBondContact O-CD2 3.32Å
81	Q	46.1	Very low	46.9	Very low	142 Å²	142	126.5 Å²	126.5	66%	0.664	62%	0.624	S	S	*	*	H	α-helix	trans	-74	-33.6	176.7	-78.2	172	69.7	0	0	113.5	Q77 Q78 I79 S83	Q77-Q81 VanDerWaalsContact O-CG 3.28Å; Q77-Q81 WeakPolarHBondContact O-CG 3.49Å; Q77-Q81 PolarHBondContact O-N 2.81Å; Q77-Q81 PolarHBondContact O-NE2 3.46Å; Q78-Q81 PolarHBondContact O-N 3.4Å; I79-Q81 VanDerWaalsContact C-N 3.27Å; I79-Q81 PolarHBondContact O-N 2.94Å; Q81-S83 VanDerWaalsContact C-N 3.28Å; Q81-S83 PolarHBondContact O-N 3.13Å
82	Q	49.3	Very low	46.4	Very low	150 Å²	150	124.1 Å²	124.1	70%	0.701	62%	0.62	S	S	*	*	H	α-helix	trans	-70.1	-25.1	173.8	-71.7	177	1	0	0	112.6	Q78 I79 Y84	Q78-Q82 WeakPolarHBondContact O-CG 3.48Å; Q78-Q82 PolarHBondContact O-N 3.39Å; I79-Q82 PolarHBondContact O-N 3.37Å; Q82-Y84 VanDerWaalsContact C-N 3.26Å; Q82-Y84 PolarHBondContact O-N 3.39Å
83	S	43.8	Very low	45.9	Very low	82 Å²	82	125.8 Å²	125.8	57%	0.573	63%	0.63	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.8	-4.2	-175.4	-60.9	0	0	0	0	115.3	I79 D80 Q81	I79-S83 PolarHBondContact O-N 2.87Å; I79-S83 VanDerWaalsContact O-N 3.13Å; I79-S83 PolarHBondContact O-OG 2.93Å; D80-S83 PolarHBondContact O-N 2.99Å; Q81-S83 VanDerWaalsContact C-N 3.28Å; Q81-S83 PolarHBondContact O-N 3.13Å
84	Y	46.3	Very low	45.4	Very low	194 Å²	194	124.3 Å²	124.3	76%	0.761	62%	0.624	S	S	*	*	T	Hydrogen-bonded Turn	trans	-122.7	33.4	-169.4	-81.7	-74.2	0	0	0	116.7	D80 Q82	D80-Y84 WeakPolarHBondContact O-CD2 3.32Å; Q82-Y84 VanDerWaalsContact C-N 3.26Å; Q82-Y84 PolarHBondContact O-N 3.39Å
85	R	40.2	Very low	44.6	Very low	230 Å²	230	119.5 Å²	119.5	87%	0.868	61%	0.605	S	S	*	*			trans	-159.4	147	150.7	-61.6	-160.4	176.6	170.6	2.1	107.6
86	Q	34.5	Very low	44.3	Very low	130 Å²	130	117 Å²	117	61%	0.607	60%	0.604	S	S	*	*			cis	-148.5	164.7	25.6	-62	168.4	-4.5	0	0	111.1
87	A	33.8	Very low	44.4	Very low	79 Å²	79	115.7 Å²	115.7	65%	0.653	60%	0.598	S	S	*	*	S	Bend	trans	-65.6	157.9	155.8	0	0	0	0	0	109.9	Q89	A87-Q89 PolarHBondContact O-N 2.95Å
88	P	36.1	Very low	44.3	Very low	135 Å²	135	112 Å²	112	88%	0.877	59%	0.589	S	S	*	*			trans	-54.2	115	179.4	21.7	-33.7	0	0	0	110.8
89	Q	36.3	Very low	44	Very low	144 Å²	144	113 Å²	113	67%	0.673	60%	0.597	S	S	*	*	P	Polyproline II helix	trans	-75	133.7	176.4	-76.4	-168	-22.7	0	0	109.7	A87	A87-Q89 PolarHBondContact O-N 2.95Å
90	R	35.8	Very low	44.1	Very low	224 Å²	224	110.9 Å²	110.9	85%	0.845	59%	0.591	S	S	*	*	P	Polyproline II helix	trans	-59.6	136.3	164.4	-155.4	179.8	-164.9	-155	2.7	107.5
91	A	39.2	Very low	44.3	Very low	83 Å²	83	108.4 Å²	108.4	69%	0.686	59%	0.589	S	S	*	*	P	Polyproline II helix	trans	-54.2	143.9	178.1	0	0	0	0	0	110.7
92	P	47.2	Very low	44.7	Very low	83 Å²	83	106.7 Å²	106.7	54%	0.539	58%	0.584	S	S	.	*	P	Polyproline II helix	trans	-62.5	152.3	177.6	27.2	-34.6	0	0	0	111.1	L97	P92-L97 HydrophobicContact CG-CD1 4.26Å; P92-L97 HydrophobicContact CG-CD2 4Å; P92-L97 HydrophobicContact CG-CG 4.11Å
93	D	43.5	Very low	44.7	Very low	99 Å²	99	106.7 Å²	106.7	53%	0.529	58%	0.578	S	S	.	*	P	Polyproline II helix	trans	-54.1	142.3	179.6	-86.6	-46.6	0	0	0	112.1	A95 A96 L97	D93-A95 PolarHBondContact O-N 3.18Å; D93-A96 WeakPolarHBondContact O-CA 3.43Å; D93-A96 WeakPolarHBondContact O-CB 3.41Å; D93-A96 PolarHBondContact O-N 2.93Å; D93-L97 PolarHBondContact O-N 3.19Å
94	V	47.4	Very low	44.7	Very low	70 Å²	70	105.1 Å²	105.1	42%	0.424	57%	0.57	S	S	.	*	H	α-helix	trans	-57.4	-34.9	179.5	-178.1	0	0	0	0	111.2	A96 L97 A98 W270	V94-A96 VanDerWaalsContact C-N 3.3Å; V94-A96 PolarHBondContact O-N 3.14Å; V94-L97 PolarHBondContact O-N 3.37Å; V94-A98 PolarHBondContact O-N 2.91Å; V94-W270 HydrophobicContact CG1-CD2 4.31Å; V94-W270 HydrophobicContact CG1-CE3 3.9Å; V94-W270 HydrophobicContact CG1-CZ3 4.13Å
95	A	45.8	Very low	44.8	Very low	20 Å²	20	98.6 Å²	98.6	17%	0.165	56%	0.556	C	S	.	*	H	α-helix	trans	-61.6	-32.9	173.6	0	0	0	0	0	113.5	D93 L99 W270	D93-A95 PolarHBondContact O-N 3.18Å; A95-L99 WeakPolarHBondContact O-CG 3.2Å; A95-W270 HydrophobicContact CB-CB 3.83Å
96	A	50.6	Low	45.2	Very low	57 Å²	57	94.4 Å²	94.4	47%	0.471	55%	0.547	S	S	.	.	H	α-helix	trans	-76.8	-33	176.8	0	0	0	0	0	112.2	D93 V94	D93-A96 WeakPolarHBondContact O-CA 3.43Å; D93-A96 WeakPolarHBondContact O-CB 3.41Å; D93-A96 PolarHBondContact O-N 2.93Å; V94-A96 VanDerWaalsContact C-N 3.3Å; V94-A96 PolarHBondContact O-N 3.14Å
97	L	51.8	Low	45.7	Very low	78 Å²	78	96.3 Å²	96.3	41%	0.408	55%	0.553	S	S	.	*	H	α-helix	trans	-73	-34.2	175.1	-68.9	169	0	0	0	112.6	P92 D93 V94 L99 S100	P92-L97 HydrophobicContact CG-CD1 4.26Å; P92-L97 HydrophobicContact CG-CD2 4Å; P92-L97 HydrophobicContact CG-CG 4.11Å; D93-L97 PolarHBondContact O-N 3.19Å; V94-L97 PolarHBondContact O-N 3.37Å; L97-L99 VanDerWaalsContact C-N 3.32Å; L97-L99 PolarHBondContact O-N 3.46Å; L97-S100 PolarHBondContact O-OG 3.45Å
98	A	49	Very low	46.4	Very low	50 Å²	50	97.3 Å²	97.3	41%	0.413	55%	0.551	S	S	.	*	H	α-helix	trans	-66.7	-32.1	176.8	0	0	0	0	0	113.1	V94	V94-A98 PolarHBondContact O-N 2.91Å
99	L	47.1	Very low	46.8	Very low	126 Å²	126	94 Å²	94	66%	0.66	53%	0.531	S	S	*	.	H	α-helix	trans	-80.3	-22.1	-177.1	-79.3	170.1	0	0	0	114.8	A95 L97 V267	A95-L99 WeakPolarHBondContact O-CG 3.2Å; L97-L99 VanDerWaalsContact C-N 3.32Å; L97-L99 PolarHBondContact O-N 3.46Å; L99-V267 HydrophobicContact CD1-CG2 3.89Å; L99-V267 HydrophobicContact CD2-CG2 4.09Å; L99-V267 HydrophobicContact CG-CG2 4.27Å
100	S	55.8	Low	47.1	Very low	54 Å²	54	89.6 Å²	89.6	38%	0.378	52%	0.524	S	S	.	.	H	α-helix	trans	-76.2	-35	-174.7	61.8	0	0	0	0	112.9	L97 D102	L97-S100 PolarHBondContact O-OG 3.45Å; S100-D102 PolarHBondContact O-N 3.19Å
101	G	50.7	Low	47.4	Very low	46 Å²	46	83 Å²	83	47%	0.474	51%	0.512	S	S	.	.			trans	68	-24.9	-171.2	0	0	0	0	0	114.4	W103 A104	G101-W103 VanDerWaalsContact C-N 3.25Å; G101-W103 PolarHBondContact O-N 3.21Å; G101-A104 PolarHBondContact O-N 3.43Å
102	D	54.5	Low	47.3	Very low	106 Å²	106	85 Å²	85	57%	0.567	51%	0.511	S	S	*	.	H	α-helix	trans	-61.7	-26	-178.9	-64.9	-41.1	0	0	0	113.4	S100 A104 A105 E106	S100-D102 PolarHBondContact O-N 3.19Å; D102-A104 VanDerWaalsContact C-N 3.29Å; D102-A104 PolarHBondContact O-N 3.28Å; D102-A105 CarbonylContact O-C 3.58Å; D102-A105 WeakPolarHBondContact O-CA 3.42Å; D102-A105 WeakPolarHBondContact O-CB 3.39Å; D102-A105 PolarHBondContact O-N 3.31Å; D102-E106 PolarHBondContact O-N 3.14Å
103	W	48.9	Very low	46.9	Very low	150 Å²	150	85.3 Å²	85.3	57%	0.568	52%	0.515	S	S	*	.	H	α-helix	trans	-61.4	-36.3	-179.2	79.5	-92.8	0	0	0	112.8	G101 A105 F107	G101-W103 VanDerWaalsContact C-N 3.25Å; G101-W103 PolarHBondContact O-N 3.21Å; W103-A105 VanDerWaalsContact C-N 3.33Å; W103-F107 WeakPolarHBondContact O-CB 3.49Å; W103-F107 PolarHBondContact O-N 3.4Å
104	A	44.3	Very low	46.6	Very low	49 Å²	49	85 Å²	85	41%	0.405	53%	0.527	S	S	.	.	H	α-helix	trans	-72.4	-30.1	175.9	0	0	0	0	0	111.6	G101 D102 V108	G101-A104 PolarHBondContact O-N 3.43Å; D102-A104 VanDerWaalsContact C-N 3.29Å; D102-A104 PolarHBondContact O-N 3.28Å; A104-V108 WeakPolarHBondContact O-CG2 3.27Å; A104-V108 PolarHBondContact O-N 2.99Å
105	A	47.6	Very low	46.2	Very low	57 Å²	57	85.8 Å²	85.8	47%	0.471	54%	0.54	S	S	.	.	H	α-helix	trans	-77.5	-37	174.9	0	0	0	0	0	112.3	D102 W103 V108 S109	D102-A105 CarbonylContact O-C 3.58Å; D102-A105 WeakPolarHBondContact O-CA 3.42Å; D102-A105 WeakPolarHBondContact O-CB 3.39Å; D102-A105 PolarHBondContact O-N 3.31Å; W103-A105 VanDerWaalsContact C-N 3.33Å; A105-V108 PolarHBondContact O-N 3.15Å; A105-S109 VanDerWaalsContact O-CB 3.25Å; A105-S109 WeakPolarHBondContact O-CB 3.35Å; A105-S109 PolarHBondContact O-N 3.43Å; A105-S109 PolarHBondContact O-OG 2.93Å
106	E	49.5	Very low	45.6	Very low	142 Å²	142	89.8 Å²	89.8	66%	0.664	56%	0.563	S	S	*	*	H	α-helix	trans	-66	-42.2	172.4	-79.7	-167.7	135.4	0	0	111.6	D102 V108 S109 G110	D102-E106 PolarHBondContact O-N 3.14Å; E106-V108 VanDerWaalsContact C-N 3.3Å; E106-V108 PolarHBondContact O-N 2.71Å; E106-S109 WeakPolarHBondContact CA-OG 3.35Å; E106-S109 PolarHBondContact O-N 2.86Å; E106-G110 WeakPolarHBondContact O-CA 3.31Å; E106-G110 PolarHBondContact O-N 3.03Å
107	F	44.8	Very low	44.9	Very low	170 Å²	170	95 Å²	95	75%	0.746	58%	0.583	S	S	*	*	H	α-helix	trans	-62	-37.1	177.2	-168.9	-98.5	0	0	0	112.5	W103	W103-F107 WeakPolarHBondContact O-CB 3.49Å; W103-F107 PolarHBondContact O-N 3.4Å
108	V	48	Very low	43.9	Very low	101 Å²	101	95.8 Å²	95.8	61%	0.612	60%	0.601	S	S	*	*	H	α-helix	trans	-83.3	-32.1	178.2	174.9	0	0	0	0	112.8	A104 A105 E106 S111	A104-V108 WeakPolarHBondContact O-CG2 3.27Å; A104-V108 PolarHBondContact O-N 2.99Å; A105-V108 PolarHBondContact O-N 3.15Å; E106-V108 VanDerWaalsContact C-N 3.3Å; E106-V108 PolarHBondContact O-N 2.71Å; V108-S111 PolarHBondContact O-OG 2.88Å; V108-S111 VanDerWaalsContact O-OG 3.07Å
109	S	45.8	Very low	43.1	Very low	66 Å²	66	102.1 Å²	102.1	46%	0.462	63%	0.627	S	S	.	*	H	α-helix	trans	-83.3	-20.1	177.3	59.1	0	0	0	0	113.6	A105 E106 S111 D112 S113	A105-S109 VanDerWaalsContact O-CB 3.25Å; A105-S109 WeakPolarHBondContact O-CB 3.35Å; A105-S109 PolarHBondContact O-N 3.43Å; A105-S109 PolarHBondContact O-OG 2.93Å; E106-S109 WeakPolarHBondContact CA-OG 3.35Å; E106-S109 PolarHBondContact O-N 2.86Å; S109-S111 PolarHBondContact O-N 3.4Å; S109-D112 PolarHBondContact O-N 3.45Å; S109-S113 WeakPolarHBondContact O-CB 3.49Å; S109-S113 PolarHBondContact O-N 3.44Å
110	G	42.4	Very low	42.3	Very low	50 Å²	50	99.5 Å²	99.5	52%	0.515	63%	0.63	S	S	.	*	H	α-helix	trans	-61.8	-25.3	174.2	0	0	0	0	0	114.2	E106	E106-G110 WeakPolarHBondContact O-CA 3.31Å; E106-G110 PolarHBondContact O-N 3.03Å
111	S	40.5	Very low	41.1	Very low	85 Å²	85	106.5 Å²	106.5	59%	0.594	66%	0.657	S	S	*	*	H	α-helix	trans	-77.4	-30.8	174.8	60.4	0	0	0	0	113.7	V108 S109	V108-S111 PolarHBondContact O-OG 2.88Å; V108-S111 VanDerWaalsContact O-OG 3.07Å; S109-S111 PolarHBondContact O-N 3.4Å
112	D	38.5	Very low	40.8	Very low	126 Å²	126	109.5 Å²	109.5	67%	0.674	68%	0.677	S	S	*	*	H	α-helix	trans	-95.2	-25.2	-176	-80.5	1.6	0	0	0	113.3	S109 A114	S109-D112 PolarHBondContact O-N 3.45Å; D112-A114 PolarHBondContact O-N 3.1Å
113	S	37.9	Very low	40.1	Very low	89 Å²	89	108.9 Å²	108.9	62%	0.622	69%	0.686	S	S	*	*	H	α-helix	trans	-69.4	-29.2	-176.1	-172.8	0	0	0	0	113.8	S109 A115	S109-S113 WeakPolarHBondContact O-CB 3.49Å; S109-S113 PolarHBondContact O-N 3.44Å; S113-A115 PolarHBondContact O-N 3.05Å; S113-A115 VanDerWaalsContact O-N 3.12Å
114	A	37.8	Very low	39.6	Very low	94 Å²	94	109.2 Å²	109.2	78%	0.777	70%	0.699	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66.9	-11.9	-178.3	0	0	0	0	0	114.5	D112	D112-A114 PolarHBondContact O-N 3.1Å
115	A	37.9	Very low	39.5	Very low	85 Å²	85	110 Å²	110	70%	0.702	71%	0.706	S	S	*	*	T	Hydrogen-bonded Turn	trans	-98	-5	-167.8	0	0	0	0	0	116.3	S113	S113-A115 PolarHBondContact O-N 3.05Å; S113-A115 VanDerWaalsContact O-N 3.12Å
116	T	34.1	Very low	39.4	Very low	104 Å²	104	112.8 Å²	112.8	64%	0.638	71%	0.713	S	S	*	*	S	Bend	trans	-124.5	-12.1	-165.9	53.5	0	0	0	0	118.2
117	N	35.3	Very low	38.8	Very low	167 Å²	167	115.4 Å²	115.4	89%	0.893	72%	0.717	S	S	*	*	S	Bend	trans	-120.8	53.5	-179.1	-85	-27	0	0	0	113.9
118	A	31.9	Very low	38.5	Very low	95 Å²	95	110 Å²	110	79%	0.785	70%	0.698	S	S	*	*			trans	-145.8	70.2	168.7	0	0	0	0	0	111.6
119	L	32.1	Very low	38	Very low	183 Å²	183	114.3 Å²	114.3	96%	0.958	70%	0.703	S	S	*	*			trans	-110.9	89.4	169.6	-84	171	0	0	0	109.7
120	G	30.4	Very low	37.7	Very low	70 Å²	70	117.7 Å²	117.7	72%	0.722	71%	0.712	S	S	*	*	S	Bend	trans	156.9	42.4	172.3	0	0	0	0	0	119.5
121	E	31.2	Very low	37.4	Very low	202 Å²	202	122.6 Å²	122.6	94%	0.944	72%	0.719	S	S	*	*			trans	173.4	130.2	131.7	-95.8	174.4	-174.8	0	0	109.4
122	A	43.8	Very low	37.5	Very low	109 Å²	109	124.6 Å²	124.6	90%	0.901	72%	0.722	S	S	*	*			trans	-117.5	119.4	-165.4	0	0	0	0	0	111.8
123	A	39	Very low	37.5	Very low	92 Å²	92	121.9 Å²	121.9	76%	0.76	72%	0.717	S	S	*	*	S	Bend	trans	-158.7	-36.3	165	0	0	0	0	0	113.9
124	D	38.2	Very low	37.6	Very low	157 Å²	157	122.7 Å²	122.7	84%	0.84	71%	0.711	S	S	*	*	S	Bend	trans	-116	24.8	-164	-97.1	-18.5	0	0	0	115.7
125	A	43.6	Very low	37.7	Very low	65 Å²	65	122.3 Å²	122.3	54%	0.537	71%	0.708	S	S	.	*			trans	-126.4	31.5	-174.6	0	0	0	0	0	114.9
126	D	44	Very low	37.9	Very low	117 Å²	117	122.4 Å²	122.4	63%	0.626	71%	0.708	S	S	*	*	S	Bend	trans	-84.2	-33.3	176	-94.7	-20.8	0	0	0	113.6	T128 R129 E130	D126-T128 VanDerWaalsContact C-N 3.32Å; D126-T128 PolarHBondContact O-N 3.23Å; D126-R129 PolarHBondContact O-N 3.48Å; D126-E130 PolarHBondContact O-N 2.97Å
127	W	38.3	Very low	38.4	Very low	196 Å²	196	121.5 Å²	121.5	74%	0.742	70%	0.7	S	S	*	*	H	α-helix	trans	-64.1	-31.7	-173.7	78.3	-88.9	0	0	0	114.4
128	T	37.2	Very low	38.8	Very low	58 Å²	58	118.7 Å²	118.7	36%	0.356	69%	0.691	S	S	.	*	H	α-helix	trans	-79.9	-17.5	176.1	47.2	0	0	0	0	113.2	D126 I132	D126-T128 VanDerWaalsContact C-N 3.32Å; D126-T128 PolarHBondContact O-N 3.23Å; T128-I132 WeakPolarHBondContact O-CD1 3.28Å; T128-I132 VanDerWaalsContact O-CG1 3.29Å; T128-I132 WeakPolarHBondContact O-CG1 3.47Å; T128-I132 PolarHBondContact O-N 3.37Å
129	R	38	Very low	39.5	Very low	190 Å²	190	116 Å²	116	72%	0.717	67%	0.672	S	S	*	*	H	α-helix	trans	-82.8	-37.1	176.8	-87.6	-175.6	164.2	-179.7	-2	112.8	D126 A133	D126-R129 PolarHBondContact O-N 3.48Å; R129-A133 VanDerWaalsContact O-CB 3.23Å; R129-A133 WeakPolarHBondContact O-CB 3.44Å; R129-A133 PolarHBondContact O-N 2.83Å
130	E	39.5	Very low	40.1	Very low	137 Å²	137	115.1 Å²	115.1	64%	0.64	66%	0.656	S	S	*	*	H	α-helix	trans	-61.2	-52.7	174.1	-67.5	-174.4	140.5	0	0	110.2	D126 I132 A133 E134	D126-E130 PolarHBondContact O-N 2.97Å; E130-I132 VanDerWaalsContact C-N 3.3Å; E130-I132 PolarHBondContact O-N 3.35Å; E130-A133 PolarHBondContact O-N 3.25Å; E130-A133 VanDerWaalsContact O-N 3.09Å; E130-E134 WeakPolarHBondContact O-CG 3.44Å; E130-E134 PolarHBondContact O-N 3.41Å
131	F	35.3	Very low	40.6	Very low	154 Å²	154	120.2 Å²	120.2	68%	0.675	65%	0.653	S	S	*	*	H	α-helix	trans	-59.6	-33.3	-178.5	-162.7	-97.5	0	0	0	114.4
132	I	42.3	Very low	41	Very low	126 Å²	126	112.6 Å²	112.6	65%	0.646	63%	0.625	S	S	*	*	H	α-helix	trans	-85.2	-28.7	178.6	-64.6	174.3	0	0	0	111.6	T128 E130	T128-I132 WeakPolarHBondContact O-CD1 3.28Å; T128-I132 VanDerWaalsContact O-CG1 3.29Å; T128-I132 WeakPolarHBondContact O-CG1 3.47Å; T128-I132 PolarHBondContact O-N 3.37Å; E130-I132 VanDerWaalsContact C-N 3.3Å; E130-I132 PolarHBondContact O-N 3.35Å
133	A	40.5	Very low	40.9	Very low	70 Å²	70	114 Å²	114	58%	0.579	61%	0.613	S	S	*	*	H	α-helix	trans	-71.7	-32.4	173.1	0	0	0	0	0	112.4	R129 E130 A135 A136	R129-A133 VanDerWaalsContact O-CB 3.23Å; R129-A133 WeakPolarHBondContact O-CB 3.44Å; R129-A133 PolarHBondContact O-N 2.83Å; E130-A133 PolarHBondContact O-N 3.25Å; E130-A133 VanDerWaalsContact O-N 3.09Å; A133-A135 VanDerWaalsContact C-N 3.3Å; A133-A135 PolarHBondContact O-N 3.21Å; A133-A136 PolarHBondContact O-N 3.37Å
134	E	38.4	Very low	41.3	Very low	106 Å²	106	113.5 Å²	113.5	50%	0.495	60%	0.595	S	S	.	*	H	α-helix	trans	-66.5	-27.5	176.4	-76.9	172.9	153.1	0	0	113.7	E130 A136	E130-E134 WeakPolarHBondContact O-CG 3.44Å; E130-E134 PolarHBondContact O-N 3.41Å; E134-A136 PolarHBondContact O-N 3.46Å; E134-A136 VanDerWaalsContact O-N 3.09Å
135	A	40.8	Very low	41.5	Very low	86 Å²	86	114.7 Å²	114.7	71%	0.711	59%	0.589	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.2	-8.4	178.2	0	0	0	0	0	114.3	A133	A133-A135 VanDerWaalsContact C-N 3.3Å; A133-A135 PolarHBondContact O-N 3.21Å
136	A	42.5	Very low	41.5	Very low	86 Å²	86	117.5 Å²	117.5	71%	0.711	59%	0.594	S	S	*	*	T	Hydrogen-bonded Turn	trans	-94.4	-9.9	-173.4	0	0	0	0	0	115.5	A133 E134	A133-A136 PolarHBondContact O-N 3.37Å; E134-A136 PolarHBondContact O-N 3.46Å; E134-A136 VanDerWaalsContact O-N 3.09Å
137	D	44	Very low	41.6	Very low	86 Å²	86	117.8 Å²	117.8	46%	0.46	59%	0.592	S	S	.	*			trans	-139.7	91.5	-179.3	-165.2	-2.5	0	0	0	112.1	G139 R140	D137-G139 PolarHBondContact O-N 3.26Å; D137-R140 HydrophobicContact CB-CG 4.39Å; D137-R140 PolarHBondContact O-N 3.49Å; D137-R140 IonicContact OD2-NE 3.23Å
138	P	44.5	Very low	42	Very low	108 Å²	108	115.3 Å²	115.3	70%	0.701	59%	0.588	S	S	*	*	T	Hydrogen-bonded Turn	trans	-64	2.2	-172.2	-23.9	34.6	0	0	0	116.7	W141	P138-W141 VanDerWaalsContact O-CD1 3.28Å; P138-W141 PolarHBondContact O-NE1 3.02Å
139	G	45	Very low	42.3	Very low	37 Å²	37	115.5 Å²	115.5	38%	0.381	59%	0.592	S	S	.	*	T	Hydrogen-bonded Turn	trans	-91.2	-26.4	174.6	0	0	0	0	0	114.9	D137 A142 E143	D137-G139 PolarHBondContact O-N 3.26Å; G139-A142 PolarHBondContact O-N 2.92Å; G139-E143 PolarHBondContact O-N 2.93Å
140	R	45.7	Very low	42.4	Very low	165 Å²	165	114.7 Å²	114.7	62%	0.623	60%	0.596	S	S	*	*	H	α-helix	trans	-68.6	-43.5	-167.1	-76.3	-172	172.6	-138.6	-5	114.6	D137 A142 E143 E144	D137-R140 HydrophobicContact CB-CG 4.39Å; D137-R140 PolarHBondContact O-N 3.49Å; D137-R140 IonicContact OD2-NE 3.23Å; R140-A142 PolarHBondContact O-N 3.4Å; R140-A142 VanDerWaalsContact O-N 3.12Å; R140-E143 PolarHBondContact O-N 3.19Å; R140-E144 WeakPolarHBondContact O-CB 3.48Å; R140-E144 PolarHBondContact O-N 3.04Å
141	W	41.6	Very low	42.6	Very low	177 Å²	177	116.3 Å²	116.3	67%	0.67	60%	0.604	S	S	*	*	H	α-helix	trans	-57.8	-28.2	178.1	71.4	-81.8	0	0	0	112.6	P138 Y145	P138-W141 VanDerWaalsContact O-CD1 3.28Å; P138-W141 PolarHBondContact O-NE1 3.02Å; W141-Y145 WeakPolarHBondContact O-CB 3.5Å; W141-Y145 PolarHBondContact O-N 3.45Å
142	A	38	Very low	42.8	Very low	42 Å²	42	115.7 Å²	115.7	35%	0.347	60%	0.601	S	S	.	*	H	α-helix	trans	-79.1	-31.9	176.9	0	0	0	0	0	112.8	G139 R140 L146	G139-A142 PolarHBondContact O-N 2.92Å; R140-A142 PolarHBondContact O-N 3.4Å; R140-A142 VanDerWaalsContact O-N 3.12Å; A142-L146 WeakPolarHBondContact O-CD1 3.15Å; A142-L146 WeakPolarHBondContact O-CG 3.44Å; A142-L146 PolarHBondContact O-N 3.36Å
143	E	42.9	Very low	42.7	Very low	138 Å²	138	117.2 Å²	117.2	65%	0.645	61%	0.609	S	S	*	*	H	α-helix	trans	-70.3	-42.5	169.5	-66.7	-172.4	136.7	0	0	110.8	G139 R140 L146 E147	G139-E143 PolarHBondContact O-N 2.93Å; R140-E143 PolarHBondContact O-N 3.19Å; E143-L146 WeakPolarHBondContact O-CB 3.5Å; E143-L146 PolarHBondContact O-N 3.44Å; E143-L146 VanDerWaalsContact O-N 3.16Å; E143-E147 PolarHBondContact O-N 3.35Å
144	E	46.9	Very low	42.8	Very low	83 Å²	83	125 Å²	125	39%	0.388	62%	0.624	S	S	.	*	H	α-helix	trans	-69.1	-38.6	-179.2	-168.4	172.1	-154.6	0	0	112.8	R140 L146 E147 Q148	R140-E144 WeakPolarHBondContact O-CB 3.48Å; R140-E144 PolarHBondContact O-N 3.04Å; E144-L146 PolarHBondContact O-N 2.95Å; E144-E147 PolarHBondContact O-N 2.97Å; E144-E147 VanDerWaalsContact O-N 3.09Å; E144-Q148 HydrophobicContact CG-CG 4.37Å; E144-Q148 WeakPolarHBondContact O-CB 3.28Å; E144-Q148 WeakPolarHBondContact O-CG 3.41Å; E144-Q148 PolarHBondContact O-N 2.95Å; E144-Q148 PolarHBondContact OE1-NE2 3.39Å
145	Y	42.7	Very low	43	Very low	182 Å²	182	126.6 Å²	126.6	71%	0.714	64%	0.635	S	S	*	*	H	α-helix	trans	-62.4	-29	171.4	-172.8	-94.2	0	0	0	112.7	W141	W141-Y145 WeakPolarHBondContact O-CB 3.5Å; W141-Y145 PolarHBondContact O-N 3.45Å
146	L	43.4	Very low	42.8	Very low	123 Å²	123	125.3 Å²	125.3	64%	0.644	63%	0.631	S	S	*	*	H	α-helix	trans	-76.3	-36.4	171.8	-71.9	168.4	0	0	0	111.7	A142 E143 E144 S149	A142-L146 WeakPolarHBondContact O-CD1 3.15Å; A142-L146 WeakPolarHBondContact O-CG 3.44Å; A142-L146 PolarHBondContact O-N 3.36Å; E143-L146 WeakPolarHBondContact O-CB 3.5Å; E143-L146 PolarHBondContact O-N 3.44Å; E143-L146 VanDerWaalsContact O-N 3.16Å; E144-L146 PolarHBondContact O-N 2.95Å; L146-S149 PolarHBondContact O-OG 2.91Å
147	E	46.5	Very low	42.8	Very low	124 Å²	124	129 Å²	129	58%	0.579	64%	0.638	S	S	*	*	H	α-helix	trans	-69	-36.6	175	-72.3	-141	99.8	0	0	114.1	E143 E144 S149 K152	E143-E147 PolarHBondContact O-N 3.35Å; E144-E147 PolarHBondContact O-N 2.97Å; E144-E147 VanDerWaalsContact O-N 3.09Å; E147-S149 VanDerWaalsContact C-N 3.3Å; E147-S149 PolarHBondContact O-N 3.16Å; E147-K152 IonicContact OE1-NZ 3.52Å; E147-K152 PolarHBondContact OE1-NZ 3.15Å
148	Q	46.8	Very low	42.5	Very low	144 Å²	144	131.7 Å²	131.7	67%	0.673	65%	0.652	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.2	-0	-178.7	-66.9	-174.2	12.9	0	0	113.9	E144	E144-Q148 HydrophobicContact CG-CG 4.37Å; E144-Q148 WeakPolarHBondContact O-CB 3.28Å; E144-Q148 WeakPolarHBondContact O-CG 3.41Å; E144-Q148 PolarHBondContact O-N 2.95Å; E144-Q148 PolarHBondContact OE1-NE2 3.39Å
149	S	43.2	Very low	42.5	Very low	61 Å²	61	129.1 Å²	129.1	43%	0.427	65%	0.645	S	S	.	*	S	Bend	trans	-65	139.1	176.6	65.5	0	0	0	0	111.9	L146 E147 E151 K152	L146-S149 PolarHBondContact O-OG 2.91Å; E147-S149 VanDerWaalsContact C-N 3.3Å; E147-S149 PolarHBondContact O-N 3.16Å; S149-E151 PolarHBondContact O-N 3.49Å; S149-K152 PolarHBondContact O-N 2.92Å
150	E	40.5	Very low	42.2	Very low	173 Å²	173	134.8 Å²	134.8	81%	0.808	67%	0.667	S	S	*	*	G	3₁₀ helix	trans	-61.7	-7.7	-158.3	-61.3	-175.5	142.5	0	0	116.9	K152 L153	E150-K152 VanDerWaalsContact C-N 3.35Å; E150-K152 PolarHBondContact O-N 3.49Å; E150-L153 PolarHBondContact O-N 3.34Å
151	E	43	Very low	42.1	Very low	172 Å²	172	135.5 Å²	135.5	80%	0.804	68%	0.675	S	S	*	*	G	3₁₀ helix	trans	-68.8	-26.3	180	-74.7	-168.9	136.8	0	0	113.9	S149	S149-E151 PolarHBondContact O-N 3.49Å
152	K	39.8	Very low	42.1	Very low	140 Å²	140	134 Å²	134	61%	0.609	68%	0.675	S	S	*	*	G	3₁₀ helix	trans	-74.6	-22.9	177.8	-115.9	179.2	-178.2	178.5	0	113.2	E147 S149 E150 W154	E147-K152 IonicContact OE1-NZ 3.52Å; E147-K152 PolarHBondContact OE1-NZ 3.15Å; S149-K152 PolarHBondContact O-N 2.92Å; E150-K152 VanDerWaalsContact C-N 3.35Å; E150-K152 PolarHBondContact O-N 3.49Å; K152-W154 VanDerWaalsContact C-N 3.34Å; K152-W154 PolarHBondContact O-N 2.87Å
153	L	40.1	Very low	42.4	Very low	158 Å²	158	136.1 Å²	136.1	83%	0.827	68%	0.684	S	S	*	*	G	3₁₀ helix	trans	-76.4	-18.5	-169.4	-147.1	78	0	0	0	114.1	E150	E150-L153 PolarHBondContact O-N 3.34Å
154	W	42.2	Very low	42.3	Very low	234 Å²	234	137.3 Å²	137.3	89%	0.886	69%	0.689	S	S	*	*	G	3₁₀ helix	trans	-95.1	-7.6	-177.8	-83.2	87.5	0	0	0	114.8	K152	K152-W154 VanDerWaalsContact C-N 3.34Å; K152-W154 PolarHBondContact O-N 2.87Å
155	L	42	Very low	41.8	Very low	139 Å²	139	143.7 Å²	143.7	73%	0.728	71%	0.71	S	S	*	*	S	Bend	trans	-122.7	92.6	179.5	-75	163.9	0	0	0	108.9
156	G	37.6	Very low	41.8	Very low	60 Å²	60	139.4 Å²	139.4	62%	0.619	70%	0.703	S	S	*	*			trans	-59.1	152	-179.1	0	0	0	0	0	113.4	L158	G156-L158 PolarHBondContact O-N 3.49Å
157	D	41.8	Very low	41.8	Very low	163 Å²	163	141.2 Å²	141.2	87%	0.872	71%	0.706	S	S	*	*			trans	-46.1	112.4	-170.5	-173.6	19	0	0	0	114.3
158	L	37.7	Very low	41.8	Very low	142 Å²	142	143.1 Å²	143.1	74%	0.743	71%	0.714	S	S	*	*			trans	-127.9	68.3	-178.6	-84.4	169.2	0	0	0	110.1	G156	G156-L158 PolarHBondContact O-N 3.49Å
159	G	44.5	Very low	41.7	Very low	55 Å²	55	143.6 Å²	143.6	57%	0.567	71%	0.711	S	S	*	*			trans	-51.9	148.6	-179.2	0	0	0	0	0	116.1	K161	G159-K161 PolarHBondContact O-N 3.21Å
160	D	40.4	Very low	42.1	Very low	156 Å²	156	146.7 Å²	146.7	83%	0.834	72%	0.719	S	S	*	*	S	Bend	trans	52.7	-14.2	169.9	-74.6	-12.5	0	0	0	120.2	T163	D160-T163 PolarHBondContact O-OG1 3.07Å
161	K	42.7	Very low	42.6	Very low	180 Å²	180	140.9 Å²	140.9	78%	0.783	70%	0.7	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.5	-7.9	177.6	-74.3	-174	175.6	178.9	0	114.8	G159 T163	G159-K161 PolarHBondContact O-N 3.21Å; K161-T163 VanDerWaalsContact C-N 3.26Å; K161-T163 PolarHBondContact O-N 3.41Å
162	E	40.7	Very low	43.1	Very low	146 Å²	146	135.1 Å²	135.1	68%	0.682	69%	0.687	S	S	*	*	H	α-helix	trans	-73.1	-17.3	-176.9	-152	172.5	-149.2	0	0	113.4	E164 T166	E162-E164 PolarHBondContact O-N 2.97Å; E162-T166 HydrophobicContact CG-CG2 4.25Å; E162-T166 WeakPolarHBondContact O-CG2 3.34Å; E162-T166 PolarHBondContact O-N 3.36Å; E162-T166 PolarHBondContact O-OG1 3.28Å
163	T	45.3	Very low	43.9	Very low	86 Å²	86	132.4 Å²	132.4	53%	0.528	68%	0.679	S	S	.	*	H	α-helix	trans	-83.3	-5.3	-173.2	61	0	0	0	0	115.9	D160 K161 K167	D160-T163 PolarHBondContact O-OG1 3.07Å; K161-T163 VanDerWaalsContact C-N 3.26Å; K161-T163 PolarHBondContact O-N 3.41Å; T163-K167 PolarHBondContact O-NZ 3.01Å
164	E	41.2	Very low	44.9	Very low	162 Å²	162	129.4 Å²	129.4	76%	0.757	66%	0.661	S	S	*	*	H	α-helix	trans	-95.3	-46.4	169.5	-70.8	-166.6	137.5	0	0	111.8	E162 T166 K167	E162-E164 PolarHBondContact O-N 2.97Å; E164-T166 PolarHBondContact O-N 3.23Å; E164-K167 PolarHBondContact O-N 3.13Å
165	W	36.2	Very low	45.8	Very low	217 Å²	217	123.1 Å²	123.1	82%	0.822	64%	0.644	S	S	*	*	H	α-helix	trans	-69.2	-36	-174.1	-138.3	-27.2	0	0	0	113.2	K167 E168	W165-K167 PolarHBondContact O-N 2.96Å; W165-E168 PolarHBondContact O-N 3.18Å
166	T	41.9	Very low	47	Very low	92 Å²	92	121.2 Å²	121.2	56%	0.564	63%	0.627	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.2	-15	178.5	48.6	0	0	0	0	114.2	E162 E164	E162-T166 HydrophobicContact CG-CG2 4.25Å; E162-T166 WeakPolarHBondContact O-CG2 3.34Å; E162-T166 PolarHBondContact O-N 3.36Å; E162-T166 PolarHBondContact O-OG1 3.28Å; E164-T166 PolarHBondContact O-N 3.23Å
167	K	44	Very low	48.4	Very low	162 Å²	162	124.9 Å²	124.9	70%	0.704	63%	0.628	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.2	-20.3	175.9	-74.5	175.4	-176.7	150.6	0	114	T163 E164 W165	T163-K167 PolarHBondContact O-NZ 3.01Å; E164-K167 PolarHBondContact O-N 3.13Å; W165-K167 PolarHBondContact O-N 2.96Å
168	E	45.6	Very low	49.7	Very low	164 Å²	164	120.8 Å²	120.8	77%	0.766	61%	0.609	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91.7	-14.8	178.7	-66.4	-166	141.2	0	0	112.9	W165 Q170	W165-E168 PolarHBondContact O-N 3.18Å; E168-Q170 PolarHBondContact O-N 3.03Å
169	Y	44.5	Very low	51.2	Low	153 Å²	153	114.3 Å²	114.3	60%	0.6	58%	0.577	S	S	*	*			trans	-88.1	98.1	-174.7	-161.5	-109.7	0	0	0	113.3	A171 E174	Y169-A171 HydrophobicContact CE1-CB 4.18Å; Y169-E174 WeakPolarHBondContact CE2-OE2 3.42Å
170	Q	53	Low	52.7	Low	127 Å²	127	115.1 Å²	115.1	59%	0.593	57%	0.568	S	S	*	*			trans	-109.1	86	174.5	-64.2	-169.8	18.8	0	0	111.3	E168 G172 D173	E168-Q170 PolarHBondContact O-N 3.03Å; Q170-G172 PolarHBondContact O-N 2.98Å; Q170-D173 PolarHBondContact O-N 3.44Å
171	A	49.9	Very low	54.3	Low	51 Å²	51	112.4 Å²	112.4	42%	0.421	55%	0.55	S	S	.	.	H	α-helix	trans	-53.3	-24.9	-175.1	0	0	0	0	0	115.3	Y169 L175	Y169-A171 HydrophobicContact CE1-CB 4.18Å; A171-L175 PolarHBondContact O-N 3.03Å
172	G	54.7	Low	55.7	Low	51 Å²	51	107.7 Å²	107.7	53%	0.526	53%	0.533	S	S	.	.	H	α-helix	trans	-69.7	-30.7	177.9	0	0	0	0	0	114.8	Q170 R176	Q170-G172 PolarHBondContact O-N 2.98Å; G172-R176 WeakPolarHBondContact O-CG 3.31Å
173	D	56.7	Low	57.2	Low	82 Å²	82	103.1 Å²	103.1	44%	0.439	52%	0.515	S	S	.	.	H	α-helix	trans	-89	-32.9	-177.3	-84.1	-11.8	0	0	0	112.4	Q170 R176 Q177	Q170-D173 PolarHBondContact O-N 3.44Å; D173-R176 PolarHBondContact O-N 3.26Å; D173-Q177 WeakPolarHBondContact O-CG 3.43Å; D173-Q177 PolarHBondContact O-N 3.08Å
174	E	60	Low	58.5	Low	95 Å²	95	103.4 Å²	103.4	44%	0.444	52%	0.52	S	S	.	.	H	α-helix	trans	-66	-40	173.6	-64.2	-169.6	161.9	0	0	112.2	Y169 R176 Q177 T178	Y169-E174 WeakPolarHBondContact CE2-OE2 3.42Å; E174-R176 VanDerWaalsContact C-N 3.32Å; E174-R176 PolarHBondContact O-N 3.01Å; E174-Q177 PolarHBondContact O-N 3.32Å; E174-T178 WeakPolarHBondContact O-CB 2.82Å; E174-T178 WeakPolarHBondContact O-CG2 2.9Å; E174-T178 PolarHBondContact O-N 2.9Å; E174-T178 PolarHBondContact O-OG1 3.48Å
175	L	61.7	Low	59.9	Low	102 Å²	102	102.4 Å²	102.4	53%	0.534	51%	0.514	S	S	.	.	H	α-helix	trans	-64.4	-35.5	175.1	-106.6	161.4	0	0	0	112.5	A171 T178 A179	A171-L175 PolarHBondContact O-N 3.03Å; L175-T178 WeakPolarHBondContact CA-OG1 3.09Å; L175-T178 PolarHBondContact O-OG1 3.21Å; L175-A179 WeakPolarHBondContact O-CB 3.4Å; L175-A179 PolarHBondContact O-N 3.42Å
176	R	66.9	Low	61.6	Low	100 Å²	100	94.2 Å²	94.2	38%	0.377	49%	0.487	S	S	.	.	H	α-helix	trans	-69.6	-41.9	172.9	-79.5	174.9	168.9	179.3	-1.2	112.4	G172 D173 E174 N180 I203 G206	G172-R176 WeakPolarHBondContact O-CG 3.31Å; D173-R176 PolarHBondContact O-N 3.26Å; E174-R176 VanDerWaalsContact C-N 3.32Å; E174-R176 PolarHBondContact O-N 3.01Å; R176-N180 WeakPolarHBondContact O-CB 3.31Å; R176-N180 PolarHBondContact O-N 3.07Å; R176-N180 PolarHBondContact O-ND2 2.94Å; R176-I203 WeakPolarHBondContact CG-O 3.42Å; R176-G206 VanDerWaalsContact NH2-CA 3.25Å; R176-G206 PolarHBondContact NH2-O 3.33Å
177	Q	67.7	Low	62.5	Low	137 Å²	137	96.8 Å²	96.8	64%	0.64	50%	0.497	S	S	*	.	H	α-helix	trans	-64.5	-47.7	177.5	-73.5	-178.3	31.2	0	0	111.2	D173 E174 N180 E181	D173-Q177 WeakPolarHBondContact O-CG 3.43Å; D173-Q177 PolarHBondContact O-N 3.08Å; E174-Q177 PolarHBondContact O-N 3.32Å; Q177-N180 PolarHBondContact O-N 3.31Å; Q177-E181 WeakPolarHBondContact O-CB 3.35Å; Q177-E181 PolarHBondContact O-N 3.42Å
178	T	69	Low	63.6	Low	76 Å²	76	92.3 Å²	92.3	47%	0.466	48%	0.481	S	S	.	.	H	α-helix	trans	-66.1	-38	178.2	51.4	0	0	0	0	113	E174 L175 E181 L182	E174-T178 WeakPolarHBondContact O-CB 2.82Å; E174-T178 WeakPolarHBondContact O-CG2 2.9Å; E174-T178 PolarHBondContact O-N 2.9Å; E174-T178 PolarHBondContact O-OG1 3.48Å; L175-T178 WeakPolarHBondContact CA-OG1 3.09Å; L175-T178 PolarHBondContact O-OG1 3.21Å; T178-E181 PolarHBondContact O-N 3.29Å; T178-L182 WeakPolarHBondContact O-CB 3.3Å; T178-L182 PolarHBondContact O-N 2.97Å
179	A	69.6	Low	64.6	Low	7 Å²	7	89.3 Å²	89.3	6%	0.058	48%	0.476	C	S	.	.	H	α-helix	trans	-62.4	-45.8	172.9	0	0	0	0	0	112.3	L175 L182 V183 I200 I203	L175-A179 WeakPolarHBondContact O-CB 3.4Å; L175-A179 PolarHBondContact O-N 3.42Å; A179-L182 PolarHBondContact O-N 3.21Å; A179-V183 WeakPolarHBondContact O-CG2 3.2Å; A179-V183 PolarHBondContact O-N 3.08Å; A179-I200 HydrophobicContact CB-CG2 3.91Å; A179-I203 HydrophobicContact CB-CB 4.43Å; A179-I203 HydrophobicContact CB-CG2 4.04Å
180	N	74	Confident	65.6	Low	72 Å²	72	90.8 Å²	90.8	39%	0.385	49%	0.486	S	S	.	.	H	α-helix	trans	-67.5	-37.9	176.7	-75.5	-49.5	0	0	0	112.1	R176 Q177 V183 S184 G204	R176-N180 WeakPolarHBondContact O-CB 3.31Å; R176-N180 PolarHBondContact O-N 3.07Å; R176-N180 PolarHBondContact O-ND2 2.94Å; Q177-N180 PolarHBondContact O-N 3.31Å; N180-V183 PolarHBondContact O-N 2.7Å; N180-S184 WeakPolarHBondContact O-CB 3.34Å; N180-S184 PolarHBondContact O-N 3.45Å; N180-S184 PolarHBondContact O-OG 3.32Å; N180-G204 PolarHBondContact ND2-O 3.25Å
181	E	75.7	Confident	65.9	Low	98 Å²	98	88.5 Å²	88.5	46%	0.458	48%	0.477	S	S	.	.	H	α-helix	trans	-64.2	-42.9	175.2	-164.8	-176.7	-174.8	0	0	111.3	Q177 T178 S184 K185	Q177-E181 WeakPolarHBondContact O-CB 3.35Å; Q177-E181 PolarHBondContact O-N 3.42Å; T178-E181 PolarHBondContact O-N 3.29Å; E181-S184 WeakPolarHBondContact CA-OG 3.11Å; E181-S184 PolarHBondContact O-N 2.79Å; E181-S184 PolarHBondContact O-OG 2.88Å; E181-K185 HydrophobicContact CG-CD 4.35Å; E181-K185 WeakPolarHBondContact O-CG 3.49Å; E181-K185 PolarHBondContact O-N 3.39Å; E181-K185 VanDerWaalsContact OE1-CE 3.32Å; E181-K185 WeakPolarHBondContact OE1-CE 3.31Å; E181-K185 IonicContact OE1-NZ 2.73Å; E181-K185 PolarHBondContact OE1-NZ 3.37Å
182	L	70.7	Confident	66.4	Low	82 Å²	82	91.1 Å²	91.1	43%	0.429	48%	0.48	S	S	.	.	H	α-helix	trans	-61.9	-46.3	175.3	-170.6	68.5	0	0	0	111.7	T178 A179 S184 K185 V186 I200	T178-L182 WeakPolarHBondContact O-CB 3.3Å; T178-L182 PolarHBondContact O-N 2.97Å; A179-L182 PolarHBondContact O-N 3.21Å; L182-S184 VanDerWaalsContact C-N 3.3Å; L182-S184 PolarHBondContact O-N 3.34Å; L182-K185 PolarHBondContact O-N 3.31Å; L182-V186 WeakPolarHBondContact O-CG2 3.49Å; L182-V186 PolarHBondContact O-N 3.47Å; L182-I200 HydrophobicContact CD2-CG2 4.42Å
183	V	73	Confident	66.7	Low	50 Å²	50	94.9 Å²	94.9	30%	0.303	49%	0.489	S	S	.	.	H	α-helix	trans	-60.5	-39.8	175.8	170.8	0	0	0	0	111.3	A179 N180 K185 V186 I200	A179-V183 WeakPolarHBondContact O-CG2 3.2Å; A179-V183 PolarHBondContact O-N 3.08Å; N180-V183 PolarHBondContact O-N 2.7Å; V183-K185 VanDerWaalsContact C-N 3.26Å; V183-K185 PolarHBondContact O-N 3.22Å; V183-V186 PolarHBondContact O-N 2.85Å; V183-I200 HydrophobicContact CG2-CG2 3.79Å
184	S	73.4	Confident	67.6	Low	91 Å²	91	93.2 Å²	93.2	64%	0.636	48%	0.481	S	S	*	.	H	α-helix	trans	-68.7	-19.3	178.1	73.6	0	0	0	0	114.9	N180 E181 L182	N180-S184 WeakPolarHBondContact O-CB 3.34Å; N180-S184 PolarHBondContact O-N 3.45Å; N180-S184 PolarHBondContact O-OG 3.32Å; E181-S184 WeakPolarHBondContact CA-OG 3.11Å; E181-S184 PolarHBondContact O-N 2.79Å; E181-S184 PolarHBondContact O-OG 2.88Å; L182-S184 VanDerWaalsContact C-N 3.3Å; L182-S184 PolarHBondContact O-N 3.34Å
185	K	70.2	Confident	67.9	Low	142 Å²	142	96.1 Å²	96.1	62%	0.617	50%	0.495	S	S	*	.	H	α-helix	trans	-97.5	-10.8	179.9	-71	174.4	-175.2	170.5	0	113.7	E181 L182 V183	E181-K185 HydrophobicContact CG-CD 4.35Å; E181-K185 WeakPolarHBondContact O-CG 3.49Å; E181-K185 PolarHBondContact O-N 3.39Å; E181-K185 VanDerWaalsContact OE1-CE 3.32Å; E181-K185 WeakPolarHBondContact OE1-CE 3.31Å; E181-K185 IonicContact OE1-NZ 2.73Å; E181-K185 PolarHBondContact OE1-NZ 3.37Å; L182-K185 PolarHBondContact O-N 3.31Å; V183-K185 VanDerWaalsContact C-N 3.26Å; V183-K185 PolarHBondContact O-N 3.22Å
186	V	71.8	Confident	68.3	Low	44 Å²	44	97.4 Å²	97.4	27%	0.267	50%	0.497	S	S	.	.			trans	-102.3	87.5	-178.5	-179.8	0	0	0	0	110.7	L182 V183 L191 L197	L182-V186 WeakPolarHBondContact O-CG2 3.49Å; L182-V186 PolarHBondContact O-N 3.47Å; V183-V186 PolarHBondContact O-N 2.85Å; V186-L191 HydrophobicContact CG1-CB 4.33Å; V186-L191 HydrophobicContact CG1-CD1 4.14Å; V186-L197 HydrophobicContact CG1-CD1 3.87Å
187	D	61.3	Low	68.6	Low	146 Å²	146	93.7 Å²	93.7	78%	0.781	48%	0.484	S	S	*	.			trans	-105.3	48.1	-179	-147.7	9	0	0	0	112.2
188	D	67	Low	68.8	Low	69 Å²	69	93.5 Å²	93.5	37%	0.369	48%	0.477	S	S	.	.			trans	-106	117	174.5	-172	-35.1	0	0	0	110.8	K190 L191 Q192	D188-K190 PolarHBondContact O-N 3.33Å; D188-K190 WeakPolarHBondContact OD1-CB 3.29Å; D188-K190 PolarHBondContact OD1-N 3.19Å; D188-L191 HydrophobicContact CB-CB 4.41Å; D188-L191 HydrophobicContact CB-CD1 4.17Å; D188-L191 HydrophobicContact CB-CG 4.34Å; D188-L191 PolarHBondContact O-N 2.68Å; D188-Q192 PolarHBondContact O-N 3.4Å
189	P	66.3	Low	68.9	Low	100 Å²	100	94.8 Å²	94.8	65%	0.649	48%	0.477	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.1	-14.2	-176.8	26.9	-35.7	0	0	0	114.6
190	K	64.2	Low	69	Low	185 Å²	185	95.5 Å²	95.5	80%	0.804	48%	0.479	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.3	-27.1	172.9	-67.3	179.8	178.8	175.4	0	113	D188	D188-K190 PolarHBondContact O-N 3.33Å; D188-K190 WeakPolarHBondContact OD1-CB 3.29Å; D188-K190 PolarHBondContact OD1-N 3.19Å
191	L	59.6	Low	69	Low	78 Å²	78	98.9 Å²	98.9	41%	0.408	49%	0.487	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.1	-26.5	-176.6	-67.3	175.4	0	0	0	112.9	V186 D188 N193 T194 L197	V186-L191 HydrophobicContact CG1-CB 4.33Å; V186-L191 HydrophobicContact CG1-CD1 4.14Å; D188-L191 HydrophobicContact CB-CB 4.41Å; D188-L191 HydrophobicContact CB-CD1 4.17Å; D188-L191 HydrophobicContact CB-CG 4.34Å; D188-L191 PolarHBondContact O-N 2.68Å; L191-N193 PolarHBondContact O-N 3.39Å; L191-T194 HydrophobicContact CD2-CG2 4.12Å; L191-T194 WeakPolarHBondContact O-CB 3.35Å; L191-T194 WeakPolarHBondContact O-CG2 3.46Å; L191-T194 PolarHBondContact O-N 3.36Å; L191-T194 PolarHBondContact O-OG1 3.05Å; L191-L197 HydrophobicContact CB-CD1 4.08Å; L191-L197 WeakPolarHBondContact O-CD1 3.31Å
192	Q	60.5	Low	68.8	Low	106 Å²	106	98 Å²	98	50%	0.495	48%	0.483	S	S	.	.	T	Hydrogen-bonded Turn	trans	-51.4	-25.9	-176.6	-75.1	178.1	-0.7	0	0	115.6	D188	D188-Q192 PolarHBondContact O-N 3.4Å
193	N	61.6	Low	68.8	Low	131 Å²	131	95.3 Å²	95.3	70%	0.701	47%	0.468	S	S	*	.	T	Hydrogen-bonded Turn	trans	-105.6	8.3	179.8	-73.8	-41.8	0	0	0	114.5	L191	L191-N193 PolarHBondContact O-N 3.39Å
194	T	75.4	Confident	68.6	Low	46 Å²	46	93.4 Å²	93.4	28%	0.282	46%	0.459	S	S	.	.	S	Bend	trans	-70.6	146.2	176.1	58.4	0	0	0	0	111.5	L191 F196 L197 R198	L191-T194 HydrophobicContact CD2-CG2 4.12Å; L191-T194 WeakPolarHBondContact O-CB 3.35Å; L191-T194 WeakPolarHBondContact O-CG2 3.46Å; L191-T194 PolarHBondContact O-N 3.36Å; L191-T194 PolarHBondContact O-OG1 3.05Å; T194-F196 PolarHBondContact O-N 3.16Å; T194-L197 PolarHBondContact O-N 3.36Å; T194-L197 PolarHBondContact OG1-N 3.37Å; T194-R198 PolarHBondContact O-N 3.46Å; T194-R198 VanDerWaalsContact O-N 3.08Å
195	E	65.7	Low	68.4	Low	157 Å²	157	94.6 Å²	94.6	73%	0.734	45%	0.454	S	S	*	.	H	α-helix	trans	-62.6	-30.5	178.1	-55.9	-150.8	135	0	0	111.9	R198 F199	E195-R198 PolarHBondContact O-N 3.18Å; E195-F199 WeakPolarHBondContact O-CB 3.34Å; E195-F199 PolarHBondContact O-N 3.21Å
196	F	70.3	Confident	68.1	Low	129 Å²	129	88.6 Å²	88.6	57%	0.566	43%	0.433	S	S	*	.	H	α-helix	trans	-59.5	-54.4	172.6	-178.7	-100.7	0	0	0	112.8	T194 R198 F199 I200	T194-F196 PolarHBondContact O-N 3.16Å; F196-R198 VanDerWaalsContact C-N 3.27Å; F196-R198 PolarHBondContact O-N 2.57Å; F196-F199 PolarHBondContact O-N 3.3Å; F196-I200 HydrophobicContact CD1-CG1 4.35Å; F196-I200 HydrophobicContact CE1-CG1 3.95Å; F196-I200 HydrophobicContact CE2-CD1 4.26Å; F196-I200 HydrophobicContact CE2-CG1 4.24Å; F196-I200 HydrophobicContact CZ-CD1 4.04Å; F196-I200 HydrophobicContact CZ-CG1 3.89Å; F196-I200 WeakPolarHBondContact O-CG1 3.41Å; F196-I200 PolarHBondContact O-N 3.18Å
197	L	74.3	Confident	67.3	Low	22 Å²	22	90.5 Å²	90.5	12%	0.115	45%	0.448	C	S	.	.	H	α-helix	trans	-66.1	-30.3	177.1	-78.6	-171.2	0	0	0	112.5	V186 L191 T194 R201	V186-L197 HydrophobicContact CG1-CD1 3.87Å; L191-L197 HydrophobicContact CB-CD1 4.08Å; L191-L197 WeakPolarHBondContact O-CD1 3.31Å; T194-L197 PolarHBondContact O-N 3.36Å; T194-L197 PolarHBondContact OG1-N 3.37Å; L197-R201 WeakPolarHBondContact O-CB 3.47Å; L197-R201 PolarHBondContact O-N 2.79Å
198	R	70.9	Confident	66.9	Low	133 Å²	133	86.1 Å²	86.1	50%	0.502	43%	0.426	S	S	.	.	H	α-helix	trans	-63.7	-41	173	-169.7	-179.7	-72.6	150.2	-2.2	111.4	T194 E195 F196 Q202	T194-R198 PolarHBondContact O-N 3.46Å; T194-R198 VanDerWaalsContact O-N 3.08Å; E195-R198 PolarHBondContact O-N 3.18Å; F196-R198 VanDerWaalsContact C-N 3.27Å; F196-R198 PolarHBondContact O-N 2.57Å; R198-Q202 WeakPolarHBondContact O-CG 3.29Å; R198-Q202 PolarHBondContact O-N 3.12Å
199	F	71.6	Confident	66.3	Low	102 Å²	102	88.6 Å²	88.6	45%	0.447	44%	0.444	S	S	.	.	H	α-helix	trans	-68.4	-47	175.5	177.9	-107.1	0	0	0	112.8	E195 F196 R201 Q202 I203	E195-F199 WeakPolarHBondContact O-CB 3.34Å; E195-F199 PolarHBondContact O-N 3.21Å; F196-F199 PolarHBondContact O-N 3.3Å; F199-R201 PolarHBondContact O-N 2.93Å; F199-Q202 WeakPolarHBondContact O-CB 3.43Å; F199-Q202 PolarHBondContact O-N 3.25Å; F199-I203 HydrophobicContact CD1-CD1 4.05Å; F199-I203 HydrophobicContact CE1-CD1 3.54Å; F199-I203 HydrophobicContact CZ-CD1 3.81Å; F199-I203 HydrophobicContact CZ-CG1 4.47Å; F199-I203 PolarHBondContact O-N 2.82Å
200	I	72.3	Confident	65.6	Low	23 Å²	23	89.4 Å²	89.4	12%	0.118	45%	0.447	C	S	.	.	H	α-helix	trans	-59.5	-38.8	175.4	-62.9	-62.8	0	0	0	111	A179 L182 V183 F196 I203 G204	A179-I200 HydrophobicContact CB-CG2 3.91Å; L182-I200 HydrophobicContact CD2-CG2 4.42Å; V183-I200 HydrophobicContact CG2-CG2 3.79Å; F196-I200 HydrophobicContact CD1-CG1 4.35Å; F196-I200 HydrophobicContact CE1-CG1 3.95Å; F196-I200 HydrophobicContact CE2-CD1 4.26Å; F196-I200 HydrophobicContact CE2-CG1 4.24Å; F196-I200 HydrophobicContact CZ-CD1 4.04Å; F196-I200 HydrophobicContact CZ-CG1 3.89Å; F196-I200 WeakPolarHBondContact O-CG1 3.41Å; F196-I200 PolarHBondContact O-N 3.18Å; I200-I203 PolarHBondContact O-N 3.17Å; I200-G204 PolarHBondContact O-N 3.14Å
201	R	72.8	Confident	64.6	Low	143 Å²	143	88.7 Å²	88.7	54%	0.54	45%	0.447	S	S	.	.	H	α-helix	trans	-65.4	-37.5	174.4	-175.4	173.1	174.3	155.8	8.2	112.7	L197 F199 I203 G204 E205	L197-R201 WeakPolarHBondContact O-CB 3.47Å; L197-R201 PolarHBondContact O-N 2.79Å; F199-R201 PolarHBondContact O-N 2.93Å; R201-I203 VanDerWaalsContact C-N 3.32Å; R201-I203 PolarHBondContact O-N 3.44Å; R201-G204 PolarHBondContact O-N 2.78Å; R201-E205 HydrophobicContact CG-CG 4.21Å; R201-E205 IonicContact CZ-OE1 3.25Å; R201-E205 VanDerWaalsContact CZ-OE1 3.28Å; R201-E205 IonicContact NE-OE1 3.58Å; R201-E205 PolarHBondContact NE-OE1 2.75Å; R201-E205 IonicContact NE-OE2 2.68Å; R201-E205 IonicContact NH2-OE1 3.89Å; R201-E205 PolarHBondContact NH2-OE1 2.95Å; R201-E205 VanDerWaalsContact O-CB 3.3Å; R201-E205 WeakPolarHBondContact O-CB 3.35Å; R201-E205 WeakPolarHBondContact O-CG 3.43Å; R201-E205 PolarHBondContact O-N 3.07Å
202	Q	71.8	Confident	63.7	Low	79 Å²	79	88.9 Å²	88.9	37%	0.369	45%	0.454	S	S	.	.	H	α-helix	trans	-66.4	-30.6	173.3	-75.5	170.8	-27	0	0	113.2	R198 F199 G206 S207 V208	R198-Q202 WeakPolarHBondContact O-CG 3.29Å; R198-Q202 PolarHBondContact O-N 3.12Å; F199-Q202 WeakPolarHBondContact O-CB 3.43Å; F199-Q202 PolarHBondContact O-N 3.25Å; Q202-G206 PolarHBondContact O-N 2.97Å; Q202-G206 VanDerWaalsContact O-N 3.17Å; Q202-S207 WeakPolarHBondContact CB-OG 3.41Å; Q202-S207 PolarHBondContact O-N 3.25Å; Q202-S207 PolarHBondContact O-OG 3.05Å; Q202-V208 HydrophobicContact CB-CG2 4.09Å
203	I	70.1	Confident	63	Low	25 Å²	25	94.5 Å²	94.5	13%	0.128	47%	0.471	C	S	.	.	H	α-helix	trans	-68.9	-49.3	169.9	-66.6	171.4	0	0	0	110.1	R176 A179 F199 I200 R201 E205 G206	R176-I203 WeakPolarHBondContact CG-O 3.42Å; A179-I203 HydrophobicContact CB-CB 4.43Å; A179-I203 HydrophobicContact CB-CG2 4.04Å; F199-I203 HydrophobicContact CD1-CD1 4.05Å; F199-I203 HydrophobicContact CE1-CD1 3.54Å; F199-I203 HydrophobicContact CZ-CD1 3.81Å; F199-I203 HydrophobicContact CZ-CG1 4.47Å; F199-I203 PolarHBondContact O-N 2.82Å; I200-I203 PolarHBondContact O-N 3.17Å; R201-I203 VanDerWaalsContact C-N 3.32Å; R201-I203 PolarHBondContact O-N 3.44Å; I203-E205 PolarHBondContact O-N 3.42Å; I203-G206 WeakPolarHBondContact O-CA 3.31Å; I203-G206 PolarHBondContact O-N 3.03Å
204	G	69.8	Low	62.1	Low	10 Å²	10	93 Å²	93	10%	0.103	47%	0.467	C	S	.	.	H	α-helix	trans	-65.3	-35.7	-179.7	0	0	0	0	0	114.9	N180 I200 R201	N180-G204 PolarHBondContact ND2-O 3.25Å; I200-G204 PolarHBondContact O-N 3.14Å; R201-G204 PolarHBondContact O-N 2.78Å
205	E	70.1	Confident	60.6	Low	117 Å²	117	95.5 Å²	95.5	55%	0.547	48%	0.478	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.4	-9.1	171.3	-69.3	176.4	172.9	0	0	112.2	R201 I203	R201-E205 HydrophobicContact CG-CG 4.21Å; R201-E205 IonicContact CZ-OE1 3.25Å; R201-E205 VanDerWaalsContact CZ-OE1 3.28Å; R201-E205 IonicContact NE-OE1 3.58Å; R201-E205 PolarHBondContact NE-OE1 2.75Å; R201-E205 IonicContact NE-OE2 2.68Å; R201-E205 IonicContact NH2-OE1 3.89Å; R201-E205 PolarHBondContact NH2-OE1 2.95Å; R201-E205 VanDerWaalsContact O-CB 3.3Å; R201-E205 WeakPolarHBondContact O-CB 3.35Å; R201-E205 WeakPolarHBondContact O-CG 3.43Å; R201-E205 PolarHBondContact O-N 3.07Å; I203-E205 PolarHBondContact O-N 3.42Å
206	G	62.9	Low	59.5	Low	16 Å²	16	95 Å²	95	17%	0.165	47%	0.473	C	S	.	.	T	Hydrogen-bonded Turn	trans	79.9	13.6	169.8	0	0	0	0	0	116	R176 Q202 I203 V208	R176-G206 VanDerWaalsContact NH2-CA 3.25Å; R176-G206 PolarHBondContact NH2-O 3.33Å; Q202-G206 PolarHBondContact O-N 2.97Å; Q202-G206 VanDerWaalsContact O-N 3.17Å; I203-G206 WeakPolarHBondContact O-CA 3.31Å; I203-G206 PolarHBondContact O-N 3.03Å; G206-V208 VanDerWaalsContact C-N 3.3Å
207	S	55.4	Low	58.3	Low	83 Å²	83	96.1 Å²	96.1	58%	0.58	48%	0.48	S	S	*	.			trans	-79.1	-10.5	180	62.5	0	0	0	0	114.2	Q202	Q202-S207 WeakPolarHBondContact CB-OG 3.41Å; Q202-S207 PolarHBondContact O-N 3.25Å; Q202-S207 PolarHBondContact O-OG 3.05Å
208	V	53.5	Low	56.7	Low	54 Å²	54	100.9 Å²	100.9	33%	0.327	51%	0.506	S	S	.	.			trans	-115.9	111	173.8	177.3	0	0	0	0	108.3	Q202 G206	Q202-V208 HydrophobicContact CB-CG2 4.09Å; G206-V208 VanDerWaalsContact C-N 3.3Å
209	T	52.4	Low	55.3	Low	121 Å²	121	98.1 Å²	98.1	74%	0.742	50%	0.504	S	S	*	.			trans	-87.4	113.3	166.8	46.5	0	0	0	0	108.5
210	V	51.9	Low	54.1	Low	117 Å²	117	97.6 Å²	97.6	71%	0.709	51%	0.505	S	S	*	.	P	Polyproline II helix	trans	-71.8	129.1	165.5	-179.6	0	0	0	0	107.2	S212	V210-S212 PolarHBondContact O-N 2.84Å
211	E	42.8	Very low	52.8	Low	171 Å²	171	103.8 Å²	103.8	80%	0.799	53%	0.531	S	S	*	.	P	Polyproline II helix	trans	-60.1	121.8	-172.8	-70.9	175.5	169.5	0	0	111.6
212	S	42.1	Very low	51.6	Low	81 Å²	81	100.9 Å²	100.9	57%	0.566	53%	0.53	S	S	*	.	P	Polyproline II helix	trans	-76	155.6	170.2	178.3	0	0	0	0	109.9	V210 T214	V210-S212 PolarHBondContact O-N 2.84Å; S212-T214 PolarHBondContact O-N 3.17Å
213	R	45.8	Very low	50.3	Low	225 Å²	225	103.1 Å²	103.1	85%	0.849	54%	0.54	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.8	1.4	-174.5	-163.6	171.9	178.7	164.9	-0.2	115.3
214	T	43.3	Very low	49.3	Very low	100 Å²	100	104.2 Å²	104.2	61%	0.613	55%	0.553	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.2	-26.2	-176.3	43.6	0	0	0	0	115	S212	S212-T214 PolarHBondContact O-N 3.17Å
215	D	42	Very low	48.4	Very low	97 Å²	97	110.1 Å²	110.1	52%	0.519	58%	0.578	S	S	.	*	T	Hydrogen-bonded Turn	trans	-85.8	-12.1	-177.1	-71.4	-51.5	0	0	0	114.4	Q217 L218	D215-Q217 PolarHBondContact O-N 3.18Å; D215-L218 PolarHBondContact O-N 3.41Å
216	K	44.1	Very low	47.2	Very low	146 Å²	146	110.8 Å²	110.8	64%	0.635	58%	0.581	S	S	*	*	H	α-helix	trans	-61.4	-28.6	172.8	-80.8	-166.7	170.3	-168.5	0	113.6	L218 T219 D220	K216-L218 PolarHBondContact O-N 3.15Å; K216-L218 VanDerWaalsContact O-N 3.09Å; K216-T219 PolarHBondContact O-N 2.97Å; K216-T219 PolarHBondContact O-OG1 2.64Å; K216-D220 PolarHBondContact O-N 3.07Å
217	Q	43.7	Very low	46.4	Very low	153 Å²	153	112.9 Å²	112.9	72%	0.715	60%	0.596	S	S	*	*	H	α-helix	trans	-67	-11.4	179.4	-72.4	-168.7	-18	0	0	114.5	D215	D215-Q217 PolarHBondContact O-N 3.18Å
218	L	41	Very low	46.1	Very low	123 Å²	123	115.7 Å²	115.7	64%	0.644	60%	0.601	S	S	*	*	H	α-helix	trans	-94.9	-33.4	175.4	-91.9	154.9	0	0	0	112.9	D215 K216	D215-L218 PolarHBondContact O-N 3.41Å; K216-L218 PolarHBondContact O-N 3.15Å; K216-L218 VanDerWaalsContact O-N 3.09Å
219	T	43	Very low	46.1	Very low	75 Å²	75	117.9 Å²	117.9	46%	0.46	61%	0.61	S	S	.	*	H	α-helix	trans	-68	-40.9	174.6	45.7	0	0	0	0	111.9	K216 K221 V222 Q223	K216-T219 PolarHBondContact O-N 2.97Å; K216-T219 PolarHBondContact O-OG1 2.64Å; T219-K221 VanDerWaalsContact C-N 3.26Å; T219-K221 PolarHBondContact O-N 3.25Å; T219-V222 PolarHBondContact O-N 2.64Å; T219-Q223 PolarHBondContact O-N 3.35Å
220	D	45.4	Very low	45.8	Very low	90 Å²	90	121.1 Å²	121.1	48%	0.481	61%	0.609	S	S	.	*	H	α-helix	trans	-68.5	-28.1	-173.4	-57.8	-7	0	0	0	111.7	K216 A224	K216-D220 PolarHBondContact O-N 3.07Å; D220-A224 VanDerWaalsContact O-CB 3.29Å; D220-A224 WeakPolarHBondContact O-CB 3.22Å; D220-A224 PolarHBondContact O-N 3.37Å
221	K	46	Very low	45.5	Very low	153 Å²	153	117.9 Å²	117.9	67%	0.665	60%	0.595	S	S	*	*	H	α-helix	trans	-72.3	-38.8	174.3	-75.2	-172	174.6	-175.8	0	113.5	T219 A224 E225	T219-K221 VanDerWaalsContact C-N 3.26Å; T219-K221 PolarHBondContact O-N 3.25Å; K221-A224 PolarHBondContact O-N 2.85Å; K221-E225 PolarHBondContact O-N 3.3Å; K221-E225 VanDerWaalsContact O-N 3.08Å
222	V	47.3	Very low	45.8	Very low	83 Å²	83	112.5 Å²	112.5	50%	0.503	58%	0.576	S	S	.	*	H	α-helix	trans	-68.6	-41.4	176.7	179.1	0	0	0	0	109.9	T219 A224 E225 E226	T219-V222 PolarHBondContact O-N 2.64Å; V222-A224 PolarHBondContact O-N 2.88Å; V222-E225 PolarHBondContact O-N 3.15Å; V222-E226 WeakPolarHBondContact O-CG 3.39Å; V222-E226 PolarHBondContact O-N 2.96Å
223	Q	44.7	Very low	45.9	Very low	125 Å²	125	113 Å²	113	58%	0.584	57%	0.572	S	S	*	*	H	α-helix	trans	-67.6	-33.3	175.8	-70.1	-175.6	-18.6	0	0	112.8	T219 A227	T219-Q223 PolarHBondContact O-N 3.35Å; Q223-A227 VanDerWaalsContact O-CB 3.24Å; Q223-A227 WeakPolarHBondContact O-CB 3.39Å; Q223-A227 PolarHBondContact O-N 2.88Å
224	A	48.3	Very low	45.6	Very low	48 Å²	48	106.6 Å²	106.6	40%	0.397	56%	0.555	S	S	.	*	H	α-helix	trans	-65.7	-44.2	172.4	0	0	0	0	0	112.6	D220 K221 V222 A227 Q228	D220-A224 VanDerWaalsContact O-CB 3.29Å; D220-A224 WeakPolarHBondContact O-CB 3.22Å; D220-A224 PolarHBondContact O-N 3.37Å; K221-A224 PolarHBondContact O-N 2.85Å; V222-A224 PolarHBondContact O-N 2.88Å; A224-A227 PolarHBondContact O-N 3.19Å; A224-Q228 WeakPolarHBondContact O-CB 3.48Å; A224-Q228 PolarHBondContact O-N 2.97Å
225	E	50	Low	45.7	Very low	135 Å²	135	107.6 Å²	107.6	63%	0.631	56%	0.556	S	S	*	*	H	α-helix	trans	-67	-36	175.9	-73.9	-174.9	168.4	0	0	112.4	K221 V222 N229	K221-E225 PolarHBondContact O-N 3.3Å; K221-E225 VanDerWaalsContact O-N 3.08Å; V222-E225 PolarHBondContact O-N 3.15Å; E225-N229 PolarHBondContact O-N 3.47Å; E225-N229 VanDerWaalsContact O-N 3.08Å; E225-N229 PolarHBondContact O-ND2 3.49Å
226	E	45.7	Very low	45.8	Very low	130 Å²	130	109.5 Å²	109.5	61%	0.607	56%	0.562	S	S	*	*	H	α-helix	trans	-66.6	-44.2	172	-75.4	-173.8	151.5	0	0	111.7	V222 Q228 N229 W230	V222-E226 WeakPolarHBondContact O-CG 3.39Å; V222-E226 PolarHBondContact O-N 2.96Å; E226-Q228 PolarHBondContact O-N 3.42Å; E226-N229 PolarHBondContact O-N 3.48Å; E226-W230 WeakPolarHBondContact O-CB 3.38Å; E226-W230 PolarHBondContact O-N 2.9Å
227	A	46.3	Very low	45.7	Very low	60 Å²	60	106.5 Å²	106.5	50%	0.496	56%	0.555	S	S	.	*	H	α-helix	trans	-63.4	-38.3	177.2	0	0	0	0	0	112.6	Q223 A224 W230 A231	Q223-A227 VanDerWaalsContact O-CB 3.24Å; Q223-A227 WeakPolarHBondContact O-CB 3.39Å; Q223-A227 PolarHBondContact O-N 2.88Å; A224-A227 PolarHBondContact O-N 3.19Å; A227-W230 WeakPolarHBondContact O-CB 3.33Å; A227-W230 PolarHBondContact O-N 2.76Å; A227-A231 WeakPolarHBondContact O-CB 3.43Å; A227-A231 PolarHBondContact O-N 3.26Å
228	Q	49.6	Very low	45.9	Very low	143 Å²	143	102.8 Å²	102.8	67%	0.668	55%	0.546	S	S	*	.	H	α-helix	trans	-68.6	-38.9	174.8	-93.7	160.3	-7.5	0	0	112.8	A224 E226 W230 A231 S232	A224-Q228 WeakPolarHBondContact O-CB 3.48Å; A224-Q228 PolarHBondContact O-N 2.97Å; E226-Q228 PolarHBondContact O-N 3.42Å; Q228-W230 VanDerWaalsContact C-N 3.3Å; Q228-W230 PolarHBondContact O-N 3.03Å; Q228-A231 PolarHBondContact O-N 2.82Å; Q228-S232 PolarHBondContact O-N 2.86Å; Q228-S232 PolarHBondContact O-OG 2.85Å
229	N	53.1	Low	46	Very low	100 Å²	100	104.5 Å²	104.5	54%	0.535	55%	0.551	S	S	.	*	H	α-helix	trans	-66	-32.4	170.6	-80.4	-58	0	0	0	112.5	E225 E226 S232 N233	E225-N229 PolarHBondContact O-N 3.47Å; E225-N229 VanDerWaalsContact O-N 3.08Å; E225-N229 PolarHBondContact O-ND2 3.49Å; E226-N229 PolarHBondContact O-N 3.48Å; N229-S232 WeakPolarHBondContact CA-OG 3.18Å; N229-S232 PolarHBondContact O-OG 2.96Å; N229-S232 VanDerWaalsContact O-OG 3.04Å; N229-N233 PolarHBondContact O-N 3.24Å; N229-N233 VanDerWaalsContact O-N 3.17Å; N229-N233 PolarHBondContact O-ND2 3.39Å
230	W	45	Very low	46	Very low	188 Å²	188	108.4 Å²	108.4	71%	0.712	56%	0.564	S	S	*	*	H	α-helix	trans	-66.9	-48.2	174.8	-139.9	75.4	0	0	0	110.8	E226 A227 Q228 S232 N233 L234	E226-W230 WeakPolarHBondContact O-CB 3.38Å; E226-W230 PolarHBondContact O-N 2.9Å; A227-W230 WeakPolarHBondContact O-CB 3.33Å; A227-W230 PolarHBondContact O-N 2.76Å; Q228-W230 VanDerWaalsContact C-N 3.3Å; Q228-W230 PolarHBondContact O-N 3.03Å; W230-S232 PolarHBondContact O-N 3.39Å; W230-N233 PolarHBondContact O-N 2.98Å; W230-L234 HydrophobicContact CD2-CD1 4.47Å; W230-L234 HydrophobicContact CE3-CD1 3.58Å; W230-L234 HydrophobicContact CH2-CD1 4.06Å; W230-L234 HydrophobicContact CZ3-CD1 3.34Å; W230-L234 PolarHBondContact O-N 3.43Å
231	A	45.8	Very low	46.2	Very low	50 Å²	50	106.9 Å²	106.9	41%	0.413	56%	0.561	S	S	.	*	H	α-helix	trans	-61.4	-40.2	176.6	0	0	0	0	0	113	A227 Q228 L234 N235	A227-A231 WeakPolarHBondContact O-CB 3.43Å; A227-A231 PolarHBondContact O-N 3.26Å; Q228-A231 PolarHBondContact O-N 2.82Å; A231-L234 PolarHBondContact O-N 3.31Å; A231-N235 PolarHBondContact O-N 2.85Å; A231-N235 VanDerWaalsContact O-N 3.14Å
232	S	49.9	Very low	46.1	Very low	57 Å²	57	102.4 Å²	102.4	40%	0.399	55%	0.552	S	S	.	*	H	α-helix	trans	-68	-35.5	177	60.6	0	0	0	0	113.2	Q228 N229 W230 Q236	Q228-S232 PolarHBondContact O-N 2.86Å; Q228-S232 PolarHBondContact O-OG 2.85Å; N229-S232 WeakPolarHBondContact CA-OG 3.18Å; N229-S232 PolarHBondContact O-OG 2.96Å; N229-S232 VanDerWaalsContact O-OG 3.04Å; W230-S232 PolarHBondContact O-N 3.39Å; S232-Q236 PolarHBondContact O-N 2.88Å
233	N	45.1	Very low	46.1	Very low	91 Å²	91	105.8 Å²	105.8	49%	0.487	56%	0.562	S	S	.	*	H	α-helix	trans	-68.6	-39.9	173.4	-82.4	-64.6	0	0	0	111.5	N229 W230 N235 Q236 V237	N229-N233 PolarHBondContact O-N 3.24Å; N229-N233 VanDerWaalsContact O-N 3.17Å; N229-N233 PolarHBondContact O-ND2 3.39Å; W230-N233 PolarHBondContact O-N 2.98Å; N233-N235 VanDerWaalsContact C-N 3.33Å; N233-N235 PolarHBondContact O-N 3.28Å; N233-Q236 PolarHBondContact O-N 3.06Å; N233-V237 WeakPolarHBondContact O-CB 3.45Å; N233-V237 VanDerWaalsContact O-CG2 3.29Å; N233-V237 WeakPolarHBondContact O-CG2 3.26Å; N233-V237 PolarHBondContact O-N 2.95Å
234	L	38.7	Very low	46.3	Very low	92 Å²	92	102.5 Å²	102.5	48%	0.482	56%	0.556	S	S	.	*	H	α-helix	trans	-63.5	-39.2	-179.4	-131.1	143.6	0	0	0	112	W230 A231 V237 S238	W230-L234 HydrophobicContact CD2-CD1 4.47Å; W230-L234 HydrophobicContact CE3-CD1 3.58Å; W230-L234 HydrophobicContact CH2-CD1 4.06Å; W230-L234 HydrophobicContact CZ3-CD1 3.34Å; W230-L234 PolarHBondContact O-N 3.43Å; A231-L234 PolarHBondContact O-N 3.31Å; L234-V237 PolarHBondContact O-N 3.03Å; L234-S238 WeakPolarHBondContact O-CB 3.47Å; L234-S238 PolarHBondContact O-N 3.46Å
235	N	44.2	Very low	46.1	Very low	120 Å²	120	108.1 Å²	108.1	64%	0.642	57%	0.568	S	S	*	*	H	α-helix	trans	-68.4	-36.9	175.1	-72.5	-3.5	0	0	0	113	A231 N233 S238	A231-N235 PolarHBondContact O-N 2.85Å; A231-N235 VanDerWaalsContact O-N 3.14Å; N233-N235 VanDerWaalsContact C-N 3.33Å; N233-N235 PolarHBondContact O-N 3.28Å; N235-S238 PolarHBondContact O-N 2.76Å
236	Q	45.7	Very low	46.1	Very low	137 Å²	137	105.7 Å²	105.7	64%	0.64	56%	0.562	S	S	*	*	H	α-helix	trans	-68.4	-40.7	173.9	-74.7	-177.4	-9.4	0	0	112.1	S232 N233 S238	S232-Q236 PolarHBondContact O-N 2.88Å; N233-Q236 PolarHBondContact O-N 3.06Å; Q236-S238 VanDerWaalsContact C-N 3.3Å; Q236-S238 PolarHBondContact O-N 3.1Å
237	V	40.4	Very low	46.4	Very low	83 Å²	83	104.7 Å²	104.7	50%	0.503	56%	0.561	S	S	.	*	H	α-helix	trans	-66.9	-32.4	177.3	171.1	0	0	0	0	111.3	N233 L234 E239 S241	N233-V237 WeakPolarHBondContact O-CB 3.45Å; N233-V237 VanDerWaalsContact O-CG2 3.29Å; N233-V237 WeakPolarHBondContact O-CG2 3.26Å; N233-V237 PolarHBondContact O-N 2.95Å; L234-V237 PolarHBondContact O-N 3.03Å; V237-E239 PolarHBondContact O-N 3.07Å; V237-S241 VanDerWaalsContact CG1-OG 3.3Å; V237-S241 WeakPolarHBondContact CG1-OG 3.42Å; V237-S241 WeakPolarHBondContact O-CB 3.47Å; V237-S241 PolarHBondContact O-N 3.37Å; V237-S241 PolarHBondContact O-OG 2.95Å
238	S	49.5	Very low	46.5	Very low	75 Å²	75	108.1 Å²	108.1	52%	0.524	57%	0.566	S	S	.	*	H	α-helix	trans	-65.8	-35.5	-177	-168.6	0	0	0	0	114.5	L234 N235 Q236 A242	L234-S238 WeakPolarHBondContact O-CB 3.47Å; L234-S238 PolarHBondContact O-N 3.46Å; N235-S238 PolarHBondContact O-N 2.76Å; Q236-S238 VanDerWaalsContact C-N 3.3Å; Q236-S238 PolarHBondContact O-N 3.1Å; S238-A242 WeakPolarHBondContact O-CB 3.43Å; S238-A242 PolarHBondContact O-N 3.19Å
239	E	43.5	Very low	46.3	Very low	159 Å²	159	107.2 Å²	107.2	74%	0.743	56%	0.56	S	S	*	*	H	α-helix	trans	-78.8	-48.4	179.5	-70.2	-174	149.2	0	0	111.4	V237 S241 A242	V237-E239 PolarHBondContact O-N 3.07Å; E239-S241 PolarHBondContact O-N 3.21Å; E239-A242 PolarHBondContact O-N 3.38Å
240	E	42.1	Very low	46.1	Very low	158 Å²	158	104.2 Å²	104.2	74%	0.738	55%	0.546	S	S	*	.	H	α-helix	trans	-67.8	-33	178.6	-68	-171.4	159.3	0	0	112.9	A244	E240-A244 WeakPolarHBondContact O-CB 3.37Å; E240-A244 PolarHBondContact O-N 3.37Å; E240-A244 VanDerWaalsContact O-N 3.11Å
241	S	49.1	Very low	46.4	Very low	58 Å²	58	99.9 Å²	99.9	41%	0.406	54%	0.54	S	S	.	.	H	α-helix	trans	-76	-26.5	179.4	-55.1	0	0	0	0	113.2	V237 E239 W245	V237-S241 VanDerWaalsContact CG1-OG 3.3Å; V237-S241 WeakPolarHBondContact CG1-OG 3.42Å; V237-S241 WeakPolarHBondContact O-CB 3.47Å; V237-S241 PolarHBondContact O-N 3.37Å; V237-S241 PolarHBondContact O-OG 2.95Å; E239-S241 PolarHBondContact O-N 3.21Å; S241-W245 WeakPolarHBondContact O-CB 3.17Å; S241-W245 PolarHBondContact O-N 2.77Å
242	A	43.3	Very low	46.5	Very low	58 Å²	58	102 Å²	102	48%	0.479	55%	0.552	S	S	.	*	H	α-helix	trans	-66.6	-44.9	176.6	0	0	0	0	0	111.1	S238 E239 V246	S238-A242 WeakPolarHBondContact O-CB 3.43Å; S238-A242 PolarHBondContact O-N 3.19Å; E239-A242 PolarHBondContact O-N 3.38Å; A242-V246 VanDerWaalsContact O-CG2 3.3Å; A242-V246 WeakPolarHBondContact O-CG2 3.45Å; A242-V246 PolarHBondContact O-N 2.94Å
243	E	47.5	Very low	46.4	Very low	154 Å²	154	100.1 Å²	100.1	72%	0.72	54%	0.541	S	S	*	.	H	α-helix	trans	-67.7	-44.4	174.6	-64.2	-167.9	155.5	0	0	111.5	W245 V246 D247	E243-W245 PolarHBondContact O-N 3.34Å; E243-V246 PolarHBondContact O-N 2.89Å; E243-D247 PolarHBondContact O-N 3.09Å
244	A	50.2	Low	46.6	Very low	56 Å²	56	100.8 Å²	100.8	46%	0.463	55%	0.551	S	S	.	*	H	α-helix	trans	-63.3	-37.6	179.3	0	0	0	0	0	113.5	E240 D247 E248	E240-A244 WeakPolarHBondContact O-CB 3.37Å; E240-A244 PolarHBondContact O-N 3.37Å; E240-A244 VanDerWaalsContact O-N 3.11Å; A244-D247 PolarHBondContact O-N 3.48Å; A244-E248 WeakPolarHBondContact O-CB 3.27Å; A244-E248 PolarHBondContact O-N 2.87Å
245	W	44.3	Very low	47.3	Very low	167 Å²	167	102.3 Å²	102.3	63%	0.633	56%	0.56	S	S	*	*	H	α-helix	trans	-72.8	-32.7	178.8	-163.9	78.7	0	0	0	112.2	S241 E243 E248 F249	S241-W245 WeakPolarHBondContact O-CB 3.17Å; S241-W245 PolarHBondContact O-N 2.77Å; E243-W245 PolarHBondContact O-N 3.34Å; W245-E248 PolarHBondContact O-N 3.48Å; W245-F249 HydrophobicContact CH2-CD2 4.38Å; W245-F249 VanDerWaalsContact O-CB 3.23Å; W245-F249 WeakPolarHBondContact O-CB 3.27Å; W245-F249 PolarHBondContact O-N 3.05Å
246	V	50.2	Low	47.3	Very low	84 Å²	84	100 Å²	100	51%	0.509	54%	0.544	S	S	.	.	H	α-helix	trans	-66.1	-39.1	171.2	169.2	0	0	0	0	111.4	A242 E243 T250	A242-V246 VanDerWaalsContact O-CG2 3.3Å; A242-V246 WeakPolarHBondContact O-CG2 3.45Å; A242-V246 PolarHBondContact O-N 2.94Å; E243-V246 PolarHBondContact O-N 2.89Å; V246-T250 VanDerWaalsContact O-CG2 3.32Å; V246-T250 WeakPolarHBondContact O-CG2 3.38Å; V246-T250 PolarHBondContact O-N 3.37Å; V246-T250 VanDerWaalsContact O-N 3.09Å; V246-T250 PolarHBondContact O-OG1 2.95Å
247	D	50.6	Low	47.5	Very low	109 Å²	109	98.4 Å²	98.4	58%	0.583	54%	0.537	S	S	*	.	H	α-helix	trans	-70	-36.6	174.6	-86	-7	0	0	0	112.8	E243 A244 T250 T251	E243-D247 PolarHBondContact O-N 3.09Å; A244-D247 PolarHBondContact O-N 3.48Å; D247-T250 PolarHBondContact O-OG1 2.91Å; D247-T251 PolarHBondContact O-N 3.38Å; D247-T251 PolarHBondContact O-OG1 2.96Å
248	E	49.7	Very low	48	Very low	132 Å²	132	101.1 Å²	101.1	62%	0.617	54%	0.544	S	S	*	.	H	α-helix	trans	-69.6	-40.1	174.8	-171.1	171	-156	0	0	112.1	A244 W245 T250 T251 S252	A244-E248 WeakPolarHBondContact O-CB 3.27Å; A244-E248 PolarHBondContact O-N 2.87Å; W245-E248 PolarHBondContact O-N 3.48Å; E248-T250 VanDerWaalsContact C-N 3.33Å; E248-T250 PolarHBondContact O-N 2.98Å; E248-T251 WeakPolarHBondContact CA-OG1 3.46Å; E248-T251 PolarHBondContact O-N 3.2Å; E248-T251 PolarHBondContact O-OG1 3.4Å; E248-S252 WeakPolarHBondContact O-CB 3.4Å; E248-S252 PolarHBondContact O-N 3.43Å; E248-S252 PolarHBondContact O-OG 3.01Å
249	F	44.9	Very low	48	Very low	124 Å²	124	99.6 Å²	99.6	54%	0.544	54%	0.535	S	S	.	.	H	α-helix	trans	-66.1	-33.6	175.7	-167.2	-96.7	0	0	0	112.3	W245 S252	W245-F249 HydrophobicContact CH2-CD2 4.38Å; W245-F249 VanDerWaalsContact O-CB 3.23Å; W245-F249 WeakPolarHBondContact O-CB 3.27Å; W245-F249 PolarHBondContact O-N 3.05Å; F249-S252 PolarHBondContact O-OG 2.67Å
250	T	48.5	Very low	47.9	Very low	36 Å²	36	98.3 Å²	98.3	22%	0.221	53%	0.528	C	S	.	.	H	α-helix	trans	-83.7	-9	178	56.8	0	0	0	0	114.9	V246 D247 E248 Q257	V246-T250 VanDerWaalsContact O-CG2 3.32Å; V246-T250 WeakPolarHBondContact O-CG2 3.38Å; V246-T250 PolarHBondContact O-N 3.37Å; V246-T250 VanDerWaalsContact O-N 3.09Å; V246-T250 PolarHBondContact O-OG1 2.95Å; D247-T250 PolarHBondContact O-OG1 2.91Å; E248-T250 VanDerWaalsContact C-N 3.33Å; E248-T250 PolarHBondContact O-N 2.98Å; T250-Q257 PolarHBondContact O-NE2 2.86Å
251	T	51.9	Low	48.3	Very low	98 Å²	98	95.1 Å²	95.1	60%	0.601	53%	0.528	S	S	*	.	H	α-helix	trans	-101.5	-11.2	176.3	42.2	0	0	0	0	114.6	D247 E248 G253	D247-T251 PolarHBondContact O-N 3.38Å; D247-T251 PolarHBondContact O-OG1 2.96Å; E248-T251 WeakPolarHBondContact CA-OG1 3.46Å; E248-T251 PolarHBondContact O-N 3.2Å; E248-T251 PolarHBondContact O-OG1 3.4Å; T251-G253 PolarHBondContact O-N 2.77Å
252	S	47.3	Very low	48.4	Very low	93 Å²	93	95.8 Å²	95.8	65%	0.65	54%	0.537	S	S	*	.	S	Bend	trans	-89.6	20.3	-170.1	42.4	0	0	0	0	115.9	E248 F249	E248-S252 WeakPolarHBondContact O-CB 3.4Å; E248-S252 PolarHBondContact O-N 3.43Å; E248-S252 PolarHBondContact O-OG 3.01Å; F249-S252 PolarHBondContact O-OG 2.67Å
253	G	48.3	Very low	48.6	Very low	18 Å²	18	94.4 Å²	94.4	19%	0.186	52%	0.523	C	S	.	.			trans	-158.1	117.8	172.9	0	0	0	0	0	114.3	T251 D255 F256 Q257	T251-G253 PolarHBondContact O-N 2.77Å; G253-D255 VanDerWaalsContact C-N 3.31Å; G253-D255 PolarHBondContact O-N 3.45Å; G253-F256 PolarHBondContact O-N 2.93Å; G253-Q257 PolarHBondContact O-N 3.41Å
254	P	49.3	Very low	48.9	Very low	106 Å²	106	96.6 Å²	96.6	69%	0.688	53%	0.533	S	S	*	.	H	α-helix	trans	-64.7	-35.6	177.5	26.2	-33.1	0	0	0	112.2	F256 Q257 Q258	P254-F256 VanDerWaalsContact C-N 3.34Å; P254-Q257 PolarHBondContact O-N 2.99Å; P254-Q258 PolarHBondContact O-N 2.91Å; P254-Q258 VanDerWaalsContact O-N 3.09Å
255	D	52.1	Low	49.3	Very low	124 Å²	124	96.1 Å²	96.1	66%	0.663	53%	0.526	S	S	*	.	H	α-helix	trans	-69.1	-32	177.2	-58.2	-38	0	0	0	111.8	G253 Q258 A259	G253-D255 VanDerWaalsContact C-N 3.31Å; G253-D255 PolarHBondContact O-N 3.45Å; D255-Q258 PolarHBondContact O-N 2.97Å; D255-A259 WeakPolarHBondContact O-CB 3.46Å; D255-A259 PolarHBondContact O-N 3.15Å
256	F	44.3	Very low	49.5	Very low	72 Å²	72	94.4 Å²	94.4	32%	0.316	53%	0.53	S	S	.	.	H	α-helix	trans	-70.9	-39.8	177.5	-168	-101.1	0	0	0	112	G253 P254 Q258 A259 K260 F269	G253-F256 PolarHBondContact O-N 2.93Å; P254-F256 VanDerWaalsContact C-N 3.34Å; F256-Q258 VanDerWaalsContact C-N 3.31Å; F256-A259 PolarHBondContact O-N 3.5Å; F256-K260 WeakPolarHBondContact O-CB 3.45Å; F256-K260 PolarHBondContact O-N 3.24Å; F256-F269 AromaticContact CE2-CE2 3.84Å; F256-F269 HydrophobicContact CE2-CE2 3.84Å; F256-F269 AromaticContact CE2-CZ 3.99Å; F256-F269 HydrophobicContact CE2-CZ 3.99Å; F256-F269 HydrophobicContact CZ-CE2 4.04Å; F256-F269 HydrophobicContact CZ-CZ 4.03Å
257	Q	49.6	Very low	49.5	Very low	103 Å²	103	93 Å²	93	48%	0.481	52%	0.521	S	S	.	.	H	α-helix	trans	-67.2	-34	172.2	-67.3	-166.9	-7.8	0	0	112	T250 G253 P254 A261	T250-Q257 PolarHBondContact O-NE2 2.86Å; G253-Q257 PolarHBondContact O-N 3.41Å; P254-Q257 PolarHBondContact O-N 2.99Å; Q257-A261 VanDerWaalsContact O-CB 3.25Å; Q257-A261 WeakPolarHBondContact O-CB 3.33Å; Q257-A261 PolarHBondContact O-N 3.28Å
258	Q	51.8	Low	49.7	Very low	139 Å²	139	90.8 Å²	90.8	65%	0.65	51%	0.509	S	S	*	.	H	α-helix	trans	-70.6	-37.4	175.2	-161.7	167.3	26.1	0	0	112.1	P254 D255 F256 A261 A262	P254-Q258 PolarHBondContact O-N 2.91Å; P254-Q258 VanDerWaalsContact O-N 3.09Å; D255-Q258 PolarHBondContact O-N 2.97Å; F256-Q258 VanDerWaalsContact C-N 3.31Å; Q258-A261 PolarHBondContact O-N 2.99Å; Q258-A262 VanDerWaalsContact O-CB 3.24Å; Q258-A262 WeakPolarHBondContact O-CB 3.48Å; Q258-A262 PolarHBondContact O-N 2.92Å; Q258-A262 VanDerWaalsContact O-N 3.11Å
259	A	48.6	Very low	50.1	Low	43 Å²	43	86.9 Å²	86.9	36%	0.355	49%	0.49	S	S	.	.	H	α-helix	trans	-64.3	-46.9	171.2	0	0	0	0	0	111.8	D255 F256 A261 A262 V263	D255-A259 WeakPolarHBondContact O-CB 3.46Å; D255-A259 PolarHBondContact O-N 3.15Å; F256-A259 PolarHBondContact O-N 3.5Å; A259-A261 VanDerWaalsContact C-N 3.3Å; A259-A261 PolarHBondContact O-N 3.24Å; A259-A262 PolarHBondContact O-N 3.49Å; A259-A262 VanDerWaalsContact O-N 3.11Å; A259-V263 WeakPolarHBondContact O-CG2 3.33Å; A259-V263 PolarHBondContact O-N 3Å
260	K	42.3	Very low	50.4	Low	133 Å²	133	85.2 Å²	85.2	58%	0.578	48%	0.481	S	S	*	.	H	α-helix	trans	-62.7	-33.3	176.7	-170.1	173.5	-176.5	174.9	0	112.9	F256	F256-K260 WeakPolarHBondContact O-CB 3.45Å; F256-K260 PolarHBondContact O-N 3.24Å
261	A	50.8	Low	50.8	Low	90 Å²	90	88.8 Å²	88.8	74%	0.744	50%	0.495	S	S	*	.	H	α-helix	trans	-80.7	-14.4	175.5	0	0	0	0	0	114.2	Q257 Q258 A259	Q257-A261 VanDerWaalsContact O-CB 3.25Å; Q257-A261 WeakPolarHBondContact O-CB 3.33Å; Q257-A261 PolarHBondContact O-N 3.28Å; Q258-A261 PolarHBondContact O-N 2.99Å; A259-A261 VanDerWaalsContact C-N 3.3Å; A259-A261 PolarHBondContact O-N 3.24Å
262	A	51.6	Low	51.1	Low	73 Å²	73	89.2 Å²	89.2	60%	0.603	49%	0.488	S	S	*	.	T	Hydrogen-bonded Turn	trans	-104.3	10.6	179.6	0	0	0	0	0	113.3	Q258 A259	Q258-A262 VanDerWaalsContact O-CB 3.24Å; Q258-A262 WeakPolarHBondContact O-CB 3.48Å; Q258-A262 PolarHBondContact O-N 2.92Å; Q258-A262 VanDerWaalsContact O-N 3.11Å; A259-A262 PolarHBondContact O-N 3.49Å; A259-A262 VanDerWaalsContact O-N 3.11Å
263	V	46.9	Very low	51.4	Low	29 Å²	29	88.3 Å²	88.3	18%	0.176	48%	0.476	C	S	.	.			trans	-117.3	117.3	179	163.6	0	0	0	0	108.7	A259 S265 D268 F269	A259-V263 WeakPolarHBondContact O-CG2 3.33Å; A259-V263 PolarHBondContact O-N 3Å; V263-S265 WeakPolarHBondContact CG1-O 3.44Å; V263-D268 HydrophobicContact CG1-CB 4.07Å; V263-F269 HydrophobicContact CG1-CB 4.03Å
264	E	54.8	Low	51.9	Low	199 Å²	199	90.3 Å²	90.3	93%	0.93	48%	0.48	S	S	*	.	S	Bend	trans	-87.8	-9.1	-178	-64.7	-173.5	147.7	0	0	112.9
265	S	58.4	Low	52.6	Low	47 Å²	47	91 Å²	91	33%	0.329	47%	0.474	S	S	.	.	S	Bend	trans	-149.5	146.9	172	82	0	0	0	0	113	V263 V267 D268	V263-S265 WeakPolarHBondContact CG1-O 3.44Å; S265-V267 PolarHBondContact O-N 3.05Å; S265-D268 WeakPolarHBondContact CB-OD2 3.4Å; S265-D268 PolarHBondContact N-OD2 2.99Å; S265-D268 PolarHBondContact O-N 3.27Å; S265-D268 PolarHBondContact OG-OD2 2.94Å
266	D	48.4	Very low	52.9	Low	131 Å²	131	90.9 Å²	90.9	70%	0.701	47%	0.47	S	S	*	.	H	α-helix	trans	-57.9	-21.3	177.6	-63.4	-46.6	0	0	0	113.1	F269 W270	D266-F269 WeakPolarHBondContact O-CB 3.41Å; D266-F269 PolarHBondContact O-N 3.07Å; D266-W270 PolarHBondContact O-N 3.32Å
267	V	49.7	Very low	53.1	Low	54 Å²	54	96.2 Å²	96.2	33%	0.327	49%	0.488	S	S	.	.	H	α-helix	trans	-64.7	-46.5	175	-172.3	0	0	0	0	111	L99 S265 F269 W270 E271	L99-V267 HydrophobicContact CD1-CG2 3.89Å; L99-V267 HydrophobicContact CD2-CG2 4.09Å; L99-V267 HydrophobicContact CG-CG2 4.27Å; S265-V267 PolarHBondContact O-N 3.05Å; V267-F269 PolarHBondContact O-N 3.16Å; V267-W270 PolarHBondContact O-N 3.48Å; V267-E271 WeakPolarHBondContact O-CB 3.37Å; V267-E271 PolarHBondContact O-N 3.49Å
268	D	54.8	Low	53.5	Low	63 Å²	63	95.1 Å²	95.1	34%	0.337	48%	0.483	S	S	.	.	H	α-helix	trans	-68.3	-21	179	-49.7	-76.1	0	0	0	112.2	V263 S265 K272	V263-D268 HydrophobicContact CG1-CB 4.07Å; S265-D268 WeakPolarHBondContact CB-OD2 3.4Å; S265-D268 PolarHBondContact N-OD2 2.99Å; S265-D268 PolarHBondContact O-N 3.27Å; S265-D268 PolarHBondContact OG-OD2 2.94Å; D268-K272 WeakPolarHBondContact O-CB 3.46Å; D268-K272 VanDerWaalsContact O-CD 3.3Å; D268-K272 WeakPolarHBondContact O-CD 3.44Å; D268-K272 VanDerWaalsContact O-CG 3.24Å; D268-K272 WeakPolarHBondContact O-CG 3.33Å; D268-K272 PolarHBondContact O-N 3.07Å
269	F	57.8	Low	53.9	Low	50 Å²	50	92.8 Å²	92.8	22%	0.219	47%	0.472	C	S	.	.	H	α-helix	trans	-72.7	-53.1	172.5	174.7	-99	0	0	0	110.6	F256 V263 D266 V267 E271 K272 L273	F256-F269 AromaticContact CE2-CE2 3.84Å; F256-F269 HydrophobicContact CE2-CE2 3.84Å; F256-F269 AromaticContact CE2-CZ 3.99Å; F256-F269 HydrophobicContact CE2-CZ 3.99Å; F256-F269 HydrophobicContact CZ-CE2 4.04Å; F256-F269 HydrophobicContact CZ-CZ 4.03Å; V263-F269 HydrophobicContact CG1-CB 4.03Å; D266-F269 WeakPolarHBondContact O-CB 3.41Å; D266-F269 PolarHBondContact O-N 3.07Å; V267-F269 PolarHBondContact O-N 3.16Å; F269-E271 PolarHBondContact O-N 3.11Å; F269-K272 PolarHBondContact O-N 2.98Å; F269-L273 WeakPolarHBondContact O-CB 3.44Å; F269-L273 PolarHBondContact O-N 3.48Å
270	W	50.6	Low	53.9	Low	89 Å²	89	95.3 Å²	95.3	34%	0.337	48%	0.477	S	S	.	.	H	α-helix	trans	-66.6	-36.3	-179.5	-69.6	113.8	0	0	0	112.8	V94 A95 D266 V267 L273 Q274	V94-W270 HydrophobicContact CG1-CD2 4.31Å; V94-W270 HydrophobicContact CG1-CE3 3.9Å; V94-W270 HydrophobicContact CG1-CZ3 4.13Å; A95-W270 HydrophobicContact CB-CB 3.83Å; D266-W270 PolarHBondContact O-N 3.32Å; V267-W270 PolarHBondContact O-N 3.48Å; W270-L273 HydrophobicContact CE3-CD2 3.66Å; W270-L273 HydrophobicContact CZ3-CD2 3.47Å; W270-L273 VanDerWaalsContact CZ3-CD2 3.47Å; W270-L273 PolarHBondContact O-N 2.86Å; W270-Q274 WeakPolarHBondContact O-CB 3.33Å; W270-Q274 PolarHBondContact O-N 2.96Å
271	E	56.8	Low	54.3	Low	110 Å²	110	92 Å²	92	51%	0.514	47%	0.474	S	S	.	.	H	α-helix	trans	-65.9	-38.1	176.8	-166.8	174.9	-150.4	0	0	112.1	V267 F269 Q275	V267-E271 WeakPolarHBondContact O-CB 3.37Å; V267-E271 PolarHBondContact O-N 3.49Å; F269-E271 PolarHBondContact O-N 3.11Å; E271-Q275 WeakPolarHBondContact O-CG 3.35Å; E271-Q275 PolarHBondContact O-N 2.88Å; E271-Q275 VanDerWaalsContact O-N 3.12Å
272	K	59.3	Low	54.5	Low	108 Å²	108	93.4 Å²	93.4	47%	0.47	46%	0.464	S	S	.	.	H	α-helix	trans	-70.3	-40.2	172.5	-74	171.6	-170.6	159	0	112.5	D268 F269 Q274 Q275 E276	D268-K272 WeakPolarHBondContact O-CB 3.46Å; D268-K272 VanDerWaalsContact O-CD 3.3Å; D268-K272 WeakPolarHBondContact O-CD 3.44Å; D268-K272 VanDerWaalsContact O-CG 3.24Å; D268-K272 WeakPolarHBondContact O-CG 3.33Å; D268-K272 PolarHBondContact O-N 3.07Å; F269-K272 PolarHBondContact O-N 2.98Å; K272-Q274 VanDerWaalsContact C-N 3.31Å; K272-Q274 PolarHBondContact O-N 3.17Å; K272-Q275 PolarHBondContact O-N 3.25Å; K272-E276 WeakPolarHBondContact O-CG 3.44Å; K272-E276 PolarHBondContact O-N 3.17Å
273	L	53.6	Low	54.6	Low	74 Å²	74	96.7 Å²	96.7	39%	0.387	46%	0.461	S	S	.	.	H	α-helix	trans	-62.6	-40.7	176.8	-165.5	77.8	0	0	0	111.2	F269 W270 E276 W277	F269-L273 WeakPolarHBondContact O-CB 3.44Å; F269-L273 PolarHBondContact O-N 3.48Å; W270-L273 HydrophobicContact CE3-CD2 3.66Å; W270-L273 HydrophobicContact CZ3-CD2 3.47Å; W270-L273 VanDerWaalsContact CZ3-CD2 3.47Å; W270-L273 PolarHBondContact O-N 2.86Å; L273-E276 PolarHBondContact O-N 3.38Å; L273-W277 WeakPolarHBondContact O-CB 3.35Å; L273-W277 PolarHBondContact O-N 3.21Å
274	Q	58.1	Low	54.5	Low	60 Å²	60	98.8 Å²	98.8	28%	0.28	47%	0.471	S	S	.	.	H	α-helix	trans	-60.5	-44.6	173.5	-170.5	76.7	14.6	0	0	111.4	W270 K272 W277 E278	W270-Q274 WeakPolarHBondContact O-CB 3.33Å; W270-Q274 PolarHBondContact O-N 2.96Å; K272-Q274 VanDerWaalsContact C-N 3.31Å; K272-Q274 PolarHBondContact O-N 3.17Å; Q274-W277 PolarHBondContact O-N 2.8Å; Q274-E278 PolarHBondContact O-N 3.39Å
275	Q	65.3	Low	53.9	Low	119 Å²	119	90.8 Å²	90.8	56%	0.556	44%	0.439	S	S	*	.	H	α-helix	trans	-64.5	-44	176	-75.2	178.8	6	0	0	112.8	E271 K272 W277 E278 E279	E271-Q275 WeakPolarHBondContact O-CG 3.35Å; E271-Q275 PolarHBondContact O-N 2.88Å; E271-Q275 VanDerWaalsContact O-N 3.12Å; K272-Q275 PolarHBondContact O-N 3.25Å; Q275-W277 VanDerWaalsContact C-N 3.33Å; Q275-W277 PolarHBondContact O-N 3.3Å; Q275-E278 PolarHBondContact O-N 3.13Å; Q275-E279 PolarHBondContact O-N 2.86Å
276	E	56.6	Low	53.5	Low	122 Å²	122	96.6 Å²	96.6	57%	0.57	46%	0.461	S	S	*	.	H	α-helix	trans	-59.6	-42	174.5	-74.8	-87	154.8	0	0	111.4	K272 L273 E279 M280	K272-E276 WeakPolarHBondContact O-CG 3.44Å; K272-E276 PolarHBondContact O-N 3.17Å; L273-E276 PolarHBondContact O-N 3.38Å; E276-E279 PolarHBondContact O-N 2.91Å; E276-M280 VanDerWaalsContact O-CB 3.32Å; E276-M280 WeakPolarHBondContact O-CB 3.27Å; E276-M280 PolarHBondContact O-N 2.84Å
277	W	49.3	Very low	53.5	Low	185 Å²	185	93.3 Å²	93.3	70%	0.701	45%	0.448	S	S	*	.	H	α-helix	trans	-66.3	-42.2	174.8	-109.1	31.9	0	0	0	113.1	L273 Q274 Q275 M280 A281	L273-W277 WeakPolarHBondContact O-CB 3.35Å; L273-W277 PolarHBondContact O-N 3.21Å; Q274-W277 PolarHBondContact O-N 2.8Å; Q275-W277 VanDerWaalsContact C-N 3.33Å; Q275-W277 PolarHBondContact O-N 3.3Å; W277-M280 PolarHBondContact O-N 2.96Å; W277-A281 WeakPolarHBondContact O-CB 3.33Å; W277-A281 PolarHBondContact O-N 3.12Å
278	E	57.6	Low	53.2	Low	80 Å²	80	95.6 Å²	95.6	37%	0.374	46%	0.455	S	S	.	.	H	α-helix	trans	-67.1	-35	174.9	-76.8	-160.4	177.5	0	0	112.9	Q274 Q275 K282	Q274-E278 PolarHBondContact O-N 3.39Å; Q275-E278 PolarHBondContact O-N 3.13Å; E278-K282 WeakPolarHBondContact O-CB 3.2Å; E278-K282 VanDerWaalsContact O-CD 3.29Å; E278-K282 WeakPolarHBondContact O-CD 3.25Å; E278-K282 WeakPolarHBondContact O-CG 3.45Å; E278-K282 PolarHBondContact O-N 3.12Å; E278-K282 VanDerWaalsContact O-N 3.1Å; E278-K282 IonicContact OE2-NZ 2.75Å; E278-K282 PolarHBondContact OE2-NZ 3.48Å
279	E	60.4	Low	52.9	Low	89 Å²	89	96.4 Å²	96.4	42%	0.416	46%	0.464	S	S	.	.	H	α-helix	trans	-69.7	-38.3	172	-74.9	-155.2	166.8	0	0	112.1	Q275 E276 K282 R283	Q275-E279 PolarHBondContact O-N 2.86Å; E276-E279 PolarHBondContact O-N 2.91Å; E279-K282 PolarHBondContact O-N 3.22Å; E279-R283 WeakPolarHBondContact O-CB 3.26Å; E279-R283 VanDerWaalsContact O-CG 3.31Å; E279-R283 WeakPolarHBondContact O-CG 3.46Å; E279-R283 PolarHBondContact O-N 3.08Å; E279-R283 IonicContact OE2-CZ 2.9Å; E279-R283 IonicContact OE2-NH1 3.42Å; E279-R283 PolarHBondContact OE2-NH1 2.79Å; E279-R283 IonicContact OE2-NH2 3.21Å; E279-R283 PolarHBondContact OE2-NH2 3.16Å
280	M	48.8	Very low	52.1	Low	97 Å²	97	102.5 Å²	102.5	48%	0.478	49%	0.485	S	S	.	.	H	α-helix	trans	-63.7	-47.5	175.2	-166.7	-175	-55.4	0	0	110.6	E276 W277 K282 R283 D284	E276-M280 VanDerWaalsContact O-CB 3.32Å; E276-M280 WeakPolarHBondContact O-CB 3.27Å; E276-M280 PolarHBondContact O-N 2.84Å; W277-M280 PolarHBondContact O-N 2.96Å; M280-K282 VanDerWaalsContact C-N 3.29Å; M280-K282 PolarHBondContact O-N 2.67Å; M280-R283 CarbonylContact O-C 3.52Å; M280-R283 PolarHBondContact O-N 2.76Å; M280-R283 VanDerWaalsContact O-N 3.1Å; M280-D284 PolarHBondContact O-N 3.09Å
281	A	49.9	Very low	51.3	Low	62 Å²	62	101.9 Å²	101.9	51%	0.512	49%	0.488	S	S	.	.	H	α-helix	trans	-60.4	-35.2	175.5	0	0	0	0	0	113	W277 A285	W277-A281 WeakPolarHBondContact O-CB 3.33Å; W277-A281 PolarHBondContact O-N 3.12Å; A281-A285 WeakPolarHBondContact O-CB 3.32Å; A281-A285 PolarHBondContact O-N 2.89Å
282	K	55.5	Low	50.8	Low	121 Å²	121	99 Å²	99	53%	0.526	48%	0.48	S	S	.	.	H	α-helix	trans	-68.9	-41.7	173	-73.5	161.6	-168.6	145.9	0	111.9	E278 E279 M280 D284 A285 E286	E278-K282 WeakPolarHBondContact O-CB 3.2Å; E278-K282 VanDerWaalsContact O-CD 3.29Å; E278-K282 WeakPolarHBondContact O-CD 3.25Å; E278-K282 WeakPolarHBondContact O-CG 3.45Å; E278-K282 PolarHBondContact O-N 3.12Å; E278-K282 VanDerWaalsContact O-N 3.1Å; E278-K282 IonicContact OE2-NZ 2.75Å; E278-K282 PolarHBondContact OE2-NZ 3.48Å; E279-K282 PolarHBondContact O-N 3.22Å; M280-K282 VanDerWaalsContact C-N 3.29Å; M280-K282 PolarHBondContact O-N 2.67Å; K282-D284 VanDerWaalsContact C-N 3.32Å; K282-D284 PolarHBondContact O-N 2.92Å; K282-A285 PolarHBondContact O-N 3.34Å; K282-E286 PolarHBondContact O-N 3.31Å; K282-E286 VanDerWaalsContact O-N 3.13Å
283	R	53.9	Low	50	Low	142 Å²	142	97.8 Å²	97.8	54%	0.536	48%	0.479	S	S	.	.	H	α-helix	trans	-65.5	-33.6	174.6	-72.3	171.1	-179.2	120.9	14	112.3	E279 M280 E286 S287	E279-R283 WeakPolarHBondContact O-CB 3.26Å; E279-R283 VanDerWaalsContact O-CG 3.31Å; E279-R283 WeakPolarHBondContact O-CG 3.46Å; E279-R283 PolarHBondContact O-N 3.08Å; E279-R283 IonicContact OE2-CZ 2.9Å; E279-R283 IonicContact OE2-NH1 3.42Å; E279-R283 PolarHBondContact OE2-NH1 2.79Å; E279-R283 IonicContact OE2-NH2 3.21Å; E279-R283 PolarHBondContact OE2-NH2 3.16Å; M280-R283 CarbonylContact O-C 3.52Å; M280-R283 PolarHBondContact O-N 2.76Å; M280-R283 VanDerWaalsContact O-N 3.1Å; R283-E286 PolarHBondContact O-N 2.89Å; R283-S287 PolarHBondContact O-N 3.44Å
284	D	45.2	Very low	49.2	Very low	72 Å²	72	100.3 Å²	100.3	39%	0.385	48%	0.484	S	S	.	.	H	α-helix	trans	-81.1	-26.5	176.4	-75.2	-28.4	0	0	0	113.4	M280 K282 E286 S287 H288	M280-D284 PolarHBondContact O-N 3.09Å; K282-D284 VanDerWaalsContact C-N 3.32Å; K282-D284 PolarHBondContact O-N 2.92Å; D284-E286 VanDerWaalsContact C-N 3.3Å; D284-S287 WeakPolarHBondContact CA-OG 3.33Å; D284-S287 PolarHBondContact O-N 3.36Å; D284-S287 PolarHBondContact O-OG 3.49Å; D284-S287 VanDerWaalsContact O-OG 3.07Å; D284-S287 PolarHBondContact OD1-OG 3.26Å; D284-H288 WeakPolarHBondContact O-CB 3.2Å; D284-H288 PolarHBondContact O-N 2.92Å
285	A	42.9	Very low	48.2	Very low	32 Å²	32	102.8 Å²	102.8	26%	0.264	50%	0.499	S	S	.	.	H	α-helix	trans	-67.4	-31.1	166.3	0	0	0	0	0	112.3	A281 K282	A281-A285 WeakPolarHBondContact O-CB 3.32Å; A281-A285 PolarHBondContact O-N 2.89Å; K282-A285 PolarHBondContact O-N 3.34Å
286	E	49.3	Very low	47.1	Very low	169 Å²	169	103.3 Å²	103.3	79%	0.79	50%	0.502	S	S	*	.	H	α-helix	trans	-73.2	-26.6	170.7	-71.5	179.6	175.9	0	0	112.9	K282 R283 D284	K282-E286 PolarHBondContact O-N 3.31Å; K282-E286 VanDerWaalsContact O-N 3.13Å; R283-E286 PolarHBondContact O-N 2.89Å; D284-E286 VanDerWaalsContact C-N 3.3Å
287	S	48.1	Very low	46.5	Very low	61 Å²	61	103 Å²	103	43%	0.427	50%	0.503	S	S	.	.	H	α-helix	trans	-89	-27.4	179	79.1	0	0	0	0	113.5	R283 D284	R283-S287 PolarHBondContact O-N 3.44Å; D284-S287 WeakPolarHBondContact CA-OG 3.33Å; D284-S287 PolarHBondContact O-N 3.36Å; D284-S287 PolarHBondContact O-OG 3.49Å; D284-S287 VanDerWaalsContact O-OG 3.07Å; D284-S287 PolarHBondContact OD1-OG 3.26Å
288	H	43	Very low	46	Very low	103 Å²	103	99.2 Å²	99.2	48%	0.477	50%	0.496	S	S	.	.			trans	-126.4	87.8	179.8	-67.2	-62.6	0	0	0	111.6	D284 W290 L291	D284-H288 WeakPolarHBondContact O-CB 3.2Å; D284-H288 PolarHBondContact O-N 2.92Å; H288-W290 PolarHBondContact O-N 3Å; H288-L291 HydrophobicContact CB-CD1 4.23Å; H288-L291 PolarHBondContact O-N 3.42Å
289	P	48.8	Very low	45.4	Very low	80 Å²	80	98.2 Å²	98.2	52%	0.519	50%	0.498	S	S	.	.	H	α-helix	trans	-52	-31.1	179.1	-29.4	35.9	0	0	0	114.6	L291 S292 D293	P289-L291 PolarHBondContact O-N 3.4Å; P289-S292 PolarHBondContact O-N 2.97Å; P289-S292 VanDerWaalsContact O-N 3.09Å; P289-S292 PolarHBondContact O-OG 3.36Å; P289-D293 WeakPolarHBondContact O-CB 3.43Å; P289-D293 PolarHBondContact O-N 2.85Å
290	W	41.4	Very low	44.8	Very low	177 Å²	177	96.1 Å²	96.1	67%	0.67	49%	0.493	S	S	*	.	H	α-helix	trans	-55.1	-33.3	174.1	154.6	54.4	0	0	0	113.7	H288 D293 Y294	H288-W290 PolarHBondContact O-N 3Å; W290-D293 PolarHBondContact O-N 3.14Å; W290-Y294 WeakPolarHBondContact O-CB 3.29Å; W290-Y294 PolarHBondContact O-N 3.49Å
291	L	33.8	Very low	45	Very low	77 Å²	77	93.7 Å²	93.7	40%	0.403	49%	0.486	S	S	.	.	H	α-helix	trans	-69.5	-40.6	177.4	-80.7	167	0	0	0	111.7	H288 P289 Y294 D295	H288-L291 HydrophobicContact CB-CD1 4.23Å; H288-L291 PolarHBondContact O-N 3.42Å; P289-L291 PolarHBondContact O-N 3.4Å; L291-Y294 PolarHBondContact O-N 3.4Å; L291-D295 WeakPolarHBondContact O-CB 3.42Å; L291-D295 PolarHBondContact O-N 3.14Å
292	S	46.4	Very low	45.6	Very low	49 Å²	49	92.9 Å²	92.9	34%	0.343	47%	0.47	S	S	.	.	H	α-helix	trans	-73.5	-30	173.2	50.5	0	0	0	0	112.6	P289 Q296	P289-S292 PolarHBondContact O-N 2.97Å; P289-S292 VanDerWaalsContact O-N 3.09Å; P289-S292 PolarHBondContact O-OG 3.36Å; S292-Q296 WeakPolarHBondContact O-CB 3.44Å; S292-Q296 WeakPolarHBondContact O-CG 3.49Å; S292-Q296 PolarHBondContact O-N 3.47Å
293	D	41.6	Very low	45.9	Very low	82 Å²	82	91.7 Å²	91.7	44%	0.439	47%	0.469	S	S	.	.	H	α-helix	trans	-68.1	-36.1	171	-61.6	-29.4	0	0	0	111.4	P289 W290 Q296 L297	P289-D293 WeakPolarHBondContact O-CB 3.43Å; P289-D293 PolarHBondContact O-N 2.85Å; W290-D293 PolarHBondContact O-N 3.14Å; D293-Q296 CarbonylContact O-C 3.58Å; D293-Q296 PolarHBondContact O-N 3.27Å; D293-L297 WeakPolarHBondContact O-CB 3.18Å; D293-L297 VanDerWaalsContact O-CG 3.31Å; D293-L297 WeakPolarHBondContact O-CG 3.47Å; D293-L297 PolarHBondContact O-N 3.09Å
294	Y	36.4	Very low	46.5	Very low	127 Å²	127	90.9 Å²	90.9	50%	0.498	47%	0.47	S	S	.	.	H	α-helix	trans	-73.1	-43.3	176.8	-176	-100.2	0	0	0	111.8	W290 L291 Q296 L297 L298	W290-Y294 WeakPolarHBondContact O-CB 3.29Å; W290-Y294 PolarHBondContact O-N 3.49Å; L291-Y294 PolarHBondContact O-N 3.4Å; Y294-Q296 VanDerWaalsContact C-N 3.29Å; Y294-Q296 PolarHBondContact O-N 3.46Å; Y294-L297 PolarHBondContact O-N 3.08Å; Y294-L298 HydrophobicContact CD1-CD1 3.95Å; Y294-L298 HydrophobicContact CE1-CD1 3.49Å; Y294-L298 VanDerWaalsContact CE1-CD1 3.49Å; Y294-L298 HydrophobicContact CE1-CG 4.47Å; Y294-L298 WeakPolarHBondContact O-CG 3.35Å; Y294-L298 PolarHBondContact O-N 2.76Å
295	D	37.8	Very low	47.9	Very low	113 Å²	113	89 Å²	89	60%	0.604	47%	0.467	S	S	*	.	H	α-helix	trans	-64.9	-35.4	170.4	-122.8	11.6	0	0	0	110.6	L291 S299	L291-D295 WeakPolarHBondContact O-CB 3.42Å; L291-D295 PolarHBondContact O-N 3.14Å; D295-S299 WeakPolarHBondContact O-CA 3.23Å; D295-S299 WeakPolarHBondContact O-CB 3.31Å; D295-S299 PolarHBondContact O-N 3.09Å
296	Q	42.4	Very low	49.9	Very low	129 Å²	129	88.6 Å²	88.6	60%	0.603	46%	0.459	S	S	*	.	H	α-helix	trans	-64.9	-43.2	169.8	-86	-168.3	-0.3	0	0	112	S292 D293 Y294 L298 S299 S300	S292-Q296 WeakPolarHBondContact O-CB 3.44Å; S292-Q296 WeakPolarHBondContact O-CG 3.49Å; S292-Q296 PolarHBondContact O-N 3.47Å; D293-Q296 CarbonylContact O-C 3.58Å; D293-Q296 PolarHBondContact O-N 3.27Å; Y294-Q296 VanDerWaalsContact C-N 3.29Å; Y294-Q296 PolarHBondContact O-N 3.46Å; Q296-L298 VanDerWaalsContact C-N 3.33Å; Q296-L298 PolarHBondContact O-N 3.41Å; Q296-S299 CarbonylContact O-C 3.56Å; Q296-S299 PolarHBondContact O-N 3.14Å; Q296-S300 WeakPolarHBondContact O-CA 3.37Å; Q296-S300 WeakPolarHBondContact O-CB 3.35Å; Q296-S300 PolarHBondContact O-N 3.19Å; Q296-S300 PolarHBondContact O-OG 2.82Å
297	L	43.1	Very low	51.7	Low	115 Å²	115	88.1 Å²	88.1	60%	0.602	46%	0.457	S	S	*	.	H	α-helix	trans	-61.7	-38.7	177.5	-83.6	159.8	0	0	0	112.6	D293 Y294 S300	D293-L297 WeakPolarHBondContact O-CB 3.18Å; D293-L297 VanDerWaalsContact O-CG 3.31Å; D293-L297 WeakPolarHBondContact O-CG 3.47Å; D293-L297 PolarHBondContact O-N 3.09Å; Y294-L297 PolarHBondContact O-N 3.08Å; L297-S300 WeakPolarHBondContact CA-OG 3.33Å; L297-S300 PolarHBondContact O-OG 2.72Å
298	L	40.5	Very low	53.4	Low	107 Å²	107	89.3 Å²	89.3	56%	0.56	45%	0.454	S	S	*	.	H	α-helix	trans	-75.2	-32.8	174.5	-68.7	171.9	0	0	0	112.4	Y294 Q296	Y294-L298 HydrophobicContact CD1-CD1 3.95Å; Y294-L298 HydrophobicContact CE1-CD1 3.49Å; Y294-L298 VanDerWaalsContact CE1-CD1 3.49Å; Y294-L298 HydrophobicContact CE1-CG 4.47Å; Y294-L298 WeakPolarHBondContact O-CG 3.35Å; Y294-L298 PolarHBondContact O-N 2.76Å; Q296-L298 VanDerWaalsContact C-N 3.33Å; Q296-L298 PolarHBondContact O-N 3.41Å
299	S	43.2	Very low	55.1	Low	59 Å²	59	86.1 Å²	86.1	41%	0.413	44%	0.439	S	S	.	.	H	α-helix	trans	-83.9	-19.6	178.3	-166.9	0	0	0	0	112.5	D295 Q296 S301 K304	D295-S299 WeakPolarHBondContact O-CA 3.23Å; D295-S299 WeakPolarHBondContact O-CB 3.31Å; D295-S299 PolarHBondContact O-N 3.09Å; Q296-S299 CarbonylContact O-C 3.56Å; Q296-S299 PolarHBondContact O-N 3.14Å; S299-S301 PolarHBondContact O-N 3.34Å; S299-K304 VanDerWaalsContact O-CD 3.23Å; S299-K304 WeakPolarHBondContact O-CD 3.38Å; S299-K304 WeakPolarHBondContact O-CE 3.29Å; S299-K304 PolarHBondContact O-NZ 3.2Å; S299-K304 PolarHBondContact OG-NZ 2.72Å
300	S	48.4	Very low	56.2	Low	44 Å²	44	91 Å²	91	31%	0.308	46%	0.455	S	S	.	.			trans	-90	33.3	175.6	71.8	0	0	0	0	110.7	Q296 L297 Y302	Q296-S300 WeakPolarHBondContact O-CA 3.37Å; Q296-S300 WeakPolarHBondContact O-CB 3.35Å; Q296-S300 PolarHBondContact O-N 3.19Å; Q296-S300 PolarHBondContact O-OG 2.82Å; L297-S300 WeakPolarHBondContact CA-OG 3.33Å; L297-S300 PolarHBondContact O-OG 2.72Å; S300-Y302 PolarHBondContact O-N 3.02Å; S300-Y302 VanDerWaalsContact O-N 3.11Å
301	S	54.3	Low	57.7	Low	46 Å²	46	89.5 Å²	89.5	32%	0.322	46%	0.46	S	S	.	.			trans	-52.8	124	163.6	57.6	0	0	0	0	108.2	S299 D303 K304	S299-S301 PolarHBondContact O-N 3.34Å; S301-D303 PolarHBondContact O-N 3.42Å; S301-K304 PolarHBondContact O-N 3.21Å
302	Y	61.4	Low	59.8	Low	45 Å²	45	86.2 Å²	86.2	18%	0.176	44%	0.443	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61	5.1	174.5	51.9	-100.4	0	0	0	112.8	S300 I371 R375 F395 L400 Q403	S300-Y302 PolarHBondContact O-N 3.02Å; S300-Y302 VanDerWaalsContact O-N 3.11Å; Y302-I371 HydrophobicContact CD2-CG2 4.04Å; Y302-I371 HydrophobicContact CG-CG2 3.89Å; Y302-R375 PolarHBondContact O-NH1 3.1Å; Y302-F395 HydrophobicContact CE2-CE1 4.45Å; Y302-L400 HydrophobicContact CD1-CD1 3.82Å; Y302-L400 HydrophobicContact CE1-CD1 3.42Å; Y302-L400 VanDerWaalsContact CE1-CD1 3.42Å; Y302-L400 HydrophobicContact CE1-CD2 4.24Å; Y302-L400 HydrophobicContact CE1-CG 4.5Å; Y302-Q403 PolarHBondContact OH-NE2 2.7Å; Y302-Q403 VanDerWaalsContact OH-NE2 3.09Å
303	D	62.2	Low	61.1	Low	96 Å²	96	87.9 Å²	87.9	51%	0.513	45%	0.453	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.7	-15.3	169	-66.3	-49.6	0	0	0	114.2	S301 G305 R375	S301-D303 PolarHBondContact O-N 3.42Å; D303-G305 PolarHBondContact O-N 3.33Å; D303-R375 IonicContact OD1-CZ 3.74Å; D303-R375 IonicContact OD1-NH1 2.77Å; D303-R375 PolarHBondContact OD1-NH1 3.25Å; D303-R375 IonicContact OD1-NH2 3.95Å; D303-R375 PolarHBondContact OD1-NH2 3.1Å
304	K	65.4	Low	62.9	Low	125 Å²	125	84.9 Å²	84.9	54%	0.543	44%	0.438	S	S	.	.	S	Bend	trans	-67.9	-0.5	178.6	-78.6	-172.3	173.7	169.8	0	115.2	S299 S301	S299-K304 VanDerWaalsContact O-CD 3.23Å; S299-K304 WeakPolarHBondContact O-CD 3.38Å; S299-K304 WeakPolarHBondContact O-CE 3.29Å; S299-K304 PolarHBondContact O-NZ 3.2Å; S299-K304 PolarHBondContact OG-NZ 2.72Å; S301-K304 PolarHBondContact O-N 3.21Å
305	G	75.3	Confident	65	Low	32 Å²	32	81.9 Å²	81.9	33%	0.33	43%	0.431	S	S	.	.			trans	80.3	179.9	-178.7	0	0	0	0	0	113.1	D303 S372	D303-G305 PolarHBondContact O-N 3.33Å; G305-S372 PolarHBondContact O-OG 3.4Å
306	Y	86.1	Confident	67.1	Low	24 Å²	24	81.7 Å²	81.7	9%	0.094	44%	0.438	C	S	.	.	P	Polyproline II helix	trans	-79.3	128.1	-178.9	-169	-86.2	0	0	0	110.9	F308 E341 W354 L357 Q361 A369 A373	Y306-F308 AromaticContact CD1-CD1 3.55Å; Y306-F308 HydrophobicContact CD1-CD1 3.55Å; Y306-F308 HydrophobicContact CD1-CD2 4.38Å; Y306-F308 AromaticContact CD1-CE1 3.48Å; Y306-F308 HydrophobicContact CD1-CE1 3.48Å; Y306-F308 VanDerWaalsContact CD1-CE1 3.48Å; Y306-F308 HydrophobicContact CD1-CE2 4.33Å; Y306-F308 HydrophobicContact CD1-CG 4.02Å; Y306-F308 AromaticContact CD1-CZ 3.92Å; Y306-F308 HydrophobicContact CD1-CZ 3.92Å; Y306-F308 AromaticContact CE1-CD1 3.59Å; Y306-F308 HydrophobicContact CE1-CD1 3.59Å; Y306-F308 AromaticContact CE1-CE1 3.82Å; Y306-F308 HydrophobicContact CE1-CE1 3.82Å; Y306-F308 HydrophobicContact CE1-CG 4.26Å; Y306-E341 HydrophobicContact CE1-CG 4.12Å; Y306-E341 VanDerWaalsContact CE1-OE1 3.3Å; Y306-E341 WeakPolarHBondContact CE1-OE1 3.24Å; Y306-E341 PolarHBondContact OH-OE1 2.78Å; Y306-W354 HydrophobicContact CD1-CH2 4.46Å; Y306-W354 HydrophobicContact CD1-CZ3 4.33Å; Y306-W354 HydrophobicContact CD2-CZ3 4.03Å; Y306-W354 HydrophobicContact CG-CH2 4.16Å; Y306-W354 AromaticContact CG-CZ3 3.78Å; Y306-W354 HydrophobicContact CG-CZ3 3.78Å; Y306-L357 HydrophobicContact CD2-CD2 4.46Å; Y306-L357 HydrophobicContact CE1-CD2 4.12Å; Y306-L357 HydrophobicContact CE2-CD2 3.92Å; Y306-L357 HydrophobicContact CE2-CG 4.11Å; Y306-Q361 PolarHBondContact OH-NE2 3.24Å; Y306-A369 WeakPolarHBondContact CD2-O 3.48Å; Y306-A369 HydrophobicContact CE2-CB 3.98Å; Y306-A369 WeakPolarHBondContact CE2-O 3.42Å; Y306-A373 HydrophobicContact CD2-CB 3.78Å; Y306-A373 HydrophobicContact CE2-CB 3.93Å
307	Q	85.6	Confident	69.2	Low	159 Å²	159	78.4 Å²	78.4	74%	0.743	42%	0.423	S	S	*	.	P	Polyproline II helix	trans	-93.6	121.6	174.5	-61.6	-179	15.5	0	0	109
308	F	85.1	Confident	71.3	Confident	86 Å²	86	78.7 Å²	78.7	38%	0.377	43%	0.431	S	S	.	.	P	Polyproline II helix	trans	-90.2	150.9	-178.6	-65.7	-72.6	0	0	0	112.1	Y306 E310 E341 V344 Q345 W354	Y306-F308 AromaticContact CD1-CD1 3.55Å; Y306-F308 HydrophobicContact CD1-CD1 3.55Å; Y306-F308 HydrophobicContact CD1-CD2 4.38Å; Y306-F308 AromaticContact CD1-CE1 3.48Å; Y306-F308 HydrophobicContact CD1-CE1 3.48Å; Y306-F308 VanDerWaalsContact CD1-CE1 3.48Å; Y306-F308 HydrophobicContact CD1-CE2 4.33Å; Y306-F308 HydrophobicContact CD1-CG 4.02Å; Y306-F308 AromaticContact CD1-CZ 3.92Å; Y306-F308 HydrophobicContact CD1-CZ 3.92Å; Y306-F308 AromaticContact CE1-CD1 3.59Å; Y306-F308 HydrophobicContact CE1-CD1 3.59Å; Y306-F308 AromaticContact CE1-CE1 3.82Å; Y306-F308 HydrophobicContact CE1-CE1 3.82Å; Y306-F308 HydrophobicContact CE1-CG 4.26Å; F308-E310 PolarHBondContact O-N 3.12Å; F308-E341 HydrophobicContact CD1-CG 4.5Å; F308-V344 HydrophobicContact CE1-CG2 3.66Å; F308-V344 HydrophobicContact CZ-CG2 4.22Å; F308-Q345 HydrophobicContact CD1-CG 3.84Å; F308-Q345 HydrophobicContact CE1-CG 3.78Å; F308-Q345 HydrophobicContact CG-CG 4.26Å; F308-Q345 HydrophobicContact CZ-CG 4.14Å; F308-W354 HydrophobicContact CE1-CH2 4.18Å; F308-W354 AromaticContact CZ-CH2 3.75Å; F308-W354 HydrophobicContact CZ-CH2 3.75Å; F308-W354 HydrophobicContact CZ-CZ2 4.28Å
309	E	78.7	Confident	73.7	Confident	36 Å²	36	77.2 Å²	77.2	17%	0.168	42%	0.424	C	S	.	.	P	Polyproline II helix	trans	-61.6	123.5	166.8	-69.7	-175.2	-148.7	0	0	110.7	D311 N312 R338 E341 L592	E309-D311 VanDerWaalsContact C-N 3.35Å; E309-D311 PolarHBondContact O-N 2.91Å; E309-N312 HydrophobicContact CB-CB 4.25Å; E309-R338 VanDerWaalsContact OE1-CG 3.3Å; E309-R338 WeakPolarHBondContact OE1-CG 3.39Å; E309-R338 IonicContact OE1-NE 3.05Å; E309-R338 PolarHBondContact OE1-NE 2.85Å; E309-R338 IonicContact OE2-CZ 3.75Å; E309-R338 VanDerWaalsContact OE2-CZ 3.23Å; E309-R338 IonicContact OE2-NE 3.34Å; E309-R338 PolarHBondContact OE2-NE 3.15Å; E309-R338 IonicContact OE2-NH2 2.72Å; E309-R338 PolarHBondContact OE2-NH2 3.36Å; E309-E341 PolarHBondContact N-OE2 3.11Å; E309-E341 VanDerWaalsContact N-OE2 3.11Å; E309-L592 HydrophobicContact CG-CD2 4.26Å; E309-L592 WeakPolarHBondContact OE1-CD2 3.3Å
310	E	72.2	Confident	76.1	Confident	183 Å²	183	74.8 Å²	74.8	86%	0.855	41%	0.407	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.2	-39.6	-177.8	-61.9	-172.4	152.2	0	0	112.9	F308	F308-E310 PolarHBondContact O-N 3.12Å
311	D	71.6	Confident	78.2	Confident	145 Å²	145	74.7 Å²	74.7	78%	0.775	40%	0.401	S	S	*	.	T	Hydrogen-bonded Turn	trans	-115.2	51.1	-173.3	-85.5	-33.2	0	0	0	112.4	E309 P313	E309-D311 VanDerWaalsContact C-N 3.35Å; E309-D311 PolarHBondContact O-N 2.91Å; D311-P313 WeakPolarHBondContact O-CD 3.4Å
312	N	77.4	Confident	80.1	Confident	8 Å²	8	74.3 Å²	74.3	4%	0.043	40%	0.398	C	S	.	.			trans	-76.7	111.8	-179.9	-174.1	-20.9	0	0	0	112.7	E309 C314 L315 R338	E309-N312 HydrophobicContact CB-CB 4.25Å; N312-C314 PolarHBondContact O-N 2.95Å; N312-C314 VanDerWaalsContact OD1-CB 3.22Å; N312-C314 WeakPolarHBondContact OD1-CB 3.5Å; N312-C314 PolarHBondContact OD1-N 3.43Å; N312-L315 HydrophobicContact CB-CD1 4.24Å; N312-L315 HydrophobicContact CB-CG 4.22Å; N312-L315 WeakPolarHBondContact O-CG 3.42Å; N312-L315 PolarHBondContact O-N 3.31Å; N312-R338 PolarHBondContact ND2-O 3.17Å
313	P	75.3	Confident	81.5	Confident	84 Å²	84	74.4 Å²	74.4	55%	0.545	40%	0.4	S	S	.	.	G	3₁₀ helix	trans	-68.3	-21.2	-177.4	-18.5	33.9	0	0	0	113.8	D311 L315 S316	D311-P313 WeakPolarHBondContact O-CD 3.4Å; P313-L315 PolarHBondContact O-N 3.42Å; P313-S316 PolarHBondContact O-OG 3.36Å
314	C	78.3	Confident	82.9	Confident	19 Å²	19	69.9 Å²	69.9	13%	0.128	38%	0.376	C	S	.	.	G	3₁₀ helix	trans	-74.3	-13.2	-174.2	-51.3	0	0	0	0	112.8	N312 S316 H317 F339	N312-C314 PolarHBondContact O-N 2.95Å; N312-C314 VanDerWaalsContact OD1-CB 3.22Å; N312-C314 WeakPolarHBondContact OD1-CB 3.5Å; N312-C314 PolarHBondContact OD1-N 3.43Å; C314-S316 PolarHBondContact O-N 2.74Å; C314-H317 VanDerWaalsContact O-CB 3.25Å; C314-H317 WeakPolarHBondContact O-CB 3.25Å; C314-H317 PolarHBondContact O-N 3.16Å; C314-F339 HydrophobicContact CB-CD1 4.05Å; C314-F339 HydrophobicContact CB-CE1 4.01Å; C314-F339 HydrophobicContact CB-CG 4.48Å; C314-F339 HydrophobicContact CB-CZ 4.38Å
315	L	81.1	Confident	84.3	Confident	65 Å²	65	65.7 Å²	65.7	34%	0.34	36%	0.36	S	S	.	.	G	3₁₀ helix	trans	-54.1	-27.3	173.2	-68.9	170.1	0	0	0	113.1	N312 P313 Q345 K346	N312-L315 HydrophobicContact CB-CD1 4.24Å; N312-L315 HydrophobicContact CB-CG 4.22Å; N312-L315 WeakPolarHBondContact O-CG 3.42Å; N312-L315 PolarHBondContact O-N 3.31Å; P313-L315 PolarHBondContact O-N 3.42Å; L315-Q345 HydrophobicContact CD2-CB 4.03Å; L315-Q345 HydrophobicContact CD2-CG 4.49Å; L315-K346 WeakPolarHBondContact O-CE 3.5Å; L315-K346 PolarHBondContact O-NZ 3.46Å
316	S	81.8	Confident	85.2	Confident	109 Å²	109	69.2 Å²	69.2	76%	0.762	37%	0.366	S	S	*	.	G	3₁₀ helix	trans	-75.5	-16.5	176	63.8	0	0	0	0	114.8	P313 C314	P313-S316 PolarHBondContact O-OG 3.36Å; C314-S316 PolarHBondContact O-N 2.74Å
317	H	86.7	Confident	85.4	Confident	60 Å²	60	72 Å²	72	28%	0.278	38%	0.376	S	S	.	.			trans	-72.2	134.1	-172	-164.5	-101.2	0	0	0	112.3	C314 D319 F339 K346	C314-H317 VanDerWaalsContact O-CB 3.25Å; C314-H317 WeakPolarHBondContact O-CB 3.25Å; C314-H317 PolarHBondContact O-N 3.16Å; H317-D319 PolarHBondContact CE1-O 3.41Å; H317-D319 VanDerWaalsContact ND1-C 3.3Å; H317-D319 PolarHBondContact ND1-O 3.47Å; H317-D319 PolarHBondContact O-N 3.05Å; H317-F339 HydrophobicContact CB-CE1 4.28Å; H317-K346 PolarHBondContact O-NZ 2.94Å
318	P	86.6	Confident	85.7	Confident	120 Å²	120	65.9 Å²	65.9	78%	0.779	35%	0.348	S	S	*	.	S	Bend	trans	-64.8	-40.5	-171.4	23.6	-34.5	0	0	0	114.1
319	D	91.5	Very high	85.9	Confident	76 Å²	76	69 Å²	69	41%	0.406	36%	0.364	S	S	.	.			trans	-129.9	91.9	173.5	171.8	8.4	0	0	0	108.2	H317 F321 S322	H317-D319 PolarHBondContact CE1-O 3.41Å; H317-D319 VanDerWaalsContact ND1-C 3.3Å; H317-D319 PolarHBondContact ND1-O 3.47Å; H317-D319 PolarHBondContact O-N 3.05Å; D319-F321 PolarHBondContact OD1-N 2.76Å; D319-S322 PolarHBondContact OD1-N 3.12Å; D319-S322 VanDerWaalsContact OD1-N 3.12Å; D319-S322 WeakPolarHBondContact OD2-CB 3.38Å; D319-S322 PolarHBondContact OD2-OG 3.18Å
320	P	92.3	Very high	86.4	Confident	9 Å²	9	71.3 Å²	71.3	6%	0.058	39%	0.389	C	S	.	.	H	α-helix	trans	-73.9	-30.9	-179	28.9	-33.8	0	0	0	112.6	E323 G324 F339 S342 A343 K346	P320-E323 PolarHBondContact O-N 3.43Å; P320-G324 PolarHBondContact O-N 2.83Å; P320-F339 HydrophobicContact CB-CD1 4.21Å; P320-F339 WeakPolarHBondContact O-CB 3.4Å; P320-S342 WeakPolarHBondContact CB-OG 3.43Å; P320-A343 HydrophobicContact CB-CB 4.33Å; P320-A343 HydrophobicContact CG-CB 3.89Å; P320-K346 HydrophobicContact CG-CD 4.12Å
321	F	93.3	Very high	87.1	Confident	42 Å²	42	63.2 Å²	63.2	18%	0.184	35%	0.354	C	S	.	.	H	α-helix	trans	-66.2	-46.6	-173.8	-179.3	-105.6	0	0	0	112.2	D319 E323 G324 L325 F340 A343 L352 A353 Y356	D319-F321 PolarHBondContact OD1-N 2.76Å; F321-E323 VanDerWaalsContact C-N 3.28Å; F321-E323 PolarHBondContact O-N 3.37Å; F321-G324 PolarHBondContact O-N 2.97Å; F321-L325 HydrophobicContact CD1-CD1 4.26Å; F321-L325 HydrophobicContact CE1-CD1 3.7Å; F321-L325 HydrophobicContact CE1-CG 4.46Å; F321-L325 HydrophobicContact CZ-CD1 3.98Å; F321-L325 HydrophobicContact CZ-CG 4.4Å; F321-L325 PolarHBondContact O-N 3.34Å; F321-F340 AromaticContact CD2-CD1 3.96Å; F321-F340 HydrophobicContact CD2-CD1 3.96Å; F321-F340 AromaticContact CD2-CE1 3.96Å; F321-F340 HydrophobicContact CD2-CE1 3.96Å; F321-F340 HydrophobicContact CE2-CD1 4.23Å; F321-F340 AromaticContact CE2-CE1 4Å; F321-F340 HydrophobicContact CE2-CE1 4Å; F321-A343 HydrophobicContact CB-CB 4.03Å; F321-L352 HydrophobicContact CE2-CB 4.35Å; F321-L352 HydrophobicContact CZ-CB 4.03Å; F321-A353 HydrophobicContact CD2-CB 3.91Å; F321-A353 HydrophobicContact CE2-CB 4.19Å; F321-Y356 AromaticContact CE2-CD2 3.81Å; F321-Y356 HydrophobicContact CE2-CD2 3.81Å; F321-Y356 HydrophobicContact CE2-CE2 4.46Å; F321-Y356 AromaticContact CZ-CD2 3.86Å; F321-Y356 HydrophobicContact CZ-CD2 3.86Å; F321-Y356 HydrophobicContact CZ-CE2 4.04Å
322	S	93.6	Very high	88	Confident	38 Å²	38	58.5 Å²	58.5	27%	0.266	33%	0.329	S	S	.	.	H	α-helix	trans	-69.7	-26.3	178.8	75.4	0	0	0	0	113.2	D319 K326	D319-S322 PolarHBondContact OD1-N 3.12Å; D319-S322 VanDerWaalsContact OD1-N 3.12Å; D319-S322 WeakPolarHBondContact OD2-CB 3.38Å; D319-S322 PolarHBondContact OD2-OG 3.18Å; S322-K326 VanDerWaalsContact O-CE 3.31Å; S322-K326 WeakPolarHBondContact O-CE 3.33Å; S322-K326 WeakPolarHBondContact O-CG 3.36Å; S322-K326 PolarHBondContact O-N 3.36Å
323	E	91.7	Very high	88.5	Confident	47 Å²	47	58.1 Å²	58.1	22%	0.22	33%	0.327	C	S	.	.	H	α-helix	trans	-75.4	-39.3	174.8	-166.7	60.6	-161.1	0	0	111.6	P320 F321 L325 K326 R327 F339	P320-E323 PolarHBondContact O-N 3.43Å; F321-E323 VanDerWaalsContact C-N 3.28Å; F321-E323 PolarHBondContact O-N 3.37Å; E323-L325 VanDerWaalsContact C-N 3.32Å; E323-L325 PolarHBondContact O-N 2.96Å; E323-K326 PolarHBondContact O-N 2.93Å; E323-K326 IonicContact OE2-NZ 3.96Å; E323-K326 PolarHBondContact OE2-NZ 2.9Å; E323-R327 VanDerWaalsContact O-CG 3.29Å; E323-R327 WeakPolarHBondContact O-CG 3.46Å; E323-R327 PolarHBondContact O-N 3.05Å; E323-F339 HydrophobicContact CB-CD1 3.87Å; E323-F339 HydrophobicContact CB-CE1 3.97Å; E323-F339 HydrophobicContact CB-CG 4.4Å; E323-F339 HydrophobicContact CG-CD1 4Å; E323-F339 HydrophobicContact CG-CE1 3.65Å; E323-F339 HydrophobicContact CG-CE2 4.34Å; E323-F339 HydrophobicContact CG-CG 4.47Å; E323-F339 HydrophobicContact CG-CZ 3.85Å
324	G	92.3	Very high	89.1	Confident	0 Å²	0	54.7 Å²	54.7	0%	0	31%	0.305	C	S	.	.	H	α-helix	trans	-57	-43	171.8	0	0	0	0	0	112.8	P320 F321 R327 M328 A336 F339	P320-G324 PolarHBondContact O-N 2.83Å; F321-G324 PolarHBondContact O-N 2.97Å; G324-R327 WeakPolarHBondContact O-CB 3.46Å; G324-R327 PolarHBondContact O-N 3.09Å; G324-M328 WeakPolarHBondContact O-CB 3.48Å; G324-M328 PolarHBondContact O-N 2.73Å; G324-A336 WeakPolarHBondContact O-CB 3.49Å; G324-F339 VanDerWaalsContact CA-CB 3.5Å
325	L	94	Very high	89.5	Confident	38 Å²	38	53.9 Å²	53.9	20%	0.199	30%	0.3	C	S	.	.	H	α-helix	trans	-60.5	-46	174.9	-70.9	174.7	0	0	0	112.4	F321 E323 R327 M328 E329 F340 Y356	F321-L325 HydrophobicContact CD1-CD1 4.26Å; F321-L325 HydrophobicContact CE1-CD1 3.7Å; F321-L325 HydrophobicContact CE1-CG 4.46Å; F321-L325 HydrophobicContact CZ-CD1 3.98Å; F321-L325 HydrophobicContact CZ-CG 4.4Å; F321-L325 PolarHBondContact O-N 3.34Å; E323-L325 VanDerWaalsContact C-N 3.32Å; E323-L325 PolarHBondContact O-N 2.96Å; L325-R327 VanDerWaalsContact C-N 3.33Å; L325-R327 PolarHBondContact O-N 3.5Å; L325-M328 HydrophobicContact CD2-CE 4.17Å; L325-M328 PolarHBondContact O-N 3.42Å; L325-E329 WeakPolarHBondContact O-CG 3.2Å; L325-E329 PolarHBondContact O-N 3.17Å; L325-F340 HydrophobicContact CD2-CE1 4.28Å; L325-F340 HydrophobicContact CD2-CZ 4.06Å; L325-F340 HydrophobicContact CG-CE1 4.23Å; L325-F340 HydrophobicContact CG-CZ 4.3Å; L325-Y356 HydrophobicContact CD2-CD1 4.07Å; L325-Y356 HydrophobicContact CD2-CD2 4.1Å; L325-Y356 HydrophobicContact CD2-CE1 3.85Å; L325-Y356 HydrophobicContact CD2-CE2 3.88Å; L325-Y356 HydrophobicContact CD2-CG 4.2Å
326	K	93.7	Very high	90	Very high	105 Å²	105	50.8 Å²	50.8	46%	0.457	28%	0.284	S	S	.	.	H	α-helix	trans	-62.1	-38.8	176.4	-68.2	172.1	-135.3	147.3	0	112.6	S322 E323 A330	S322-K326 VanDerWaalsContact O-CE 3.31Å; S322-K326 WeakPolarHBondContact O-CE 3.33Å; S322-K326 WeakPolarHBondContact O-CG 3.36Å; S322-K326 PolarHBondContact O-N 3.36Å; E323-K326 PolarHBondContact O-N 2.93Å; E323-K326 IonicContact OE2-NZ 3.96Å; E323-K326 PolarHBondContact OE2-NZ 2.9Å; K326-A330 VanDerWaalsContact O-CB 3.22Å; K326-A330 WeakPolarHBondContact O-CB 3.26Å; K326-A330 PolarHBondContact O-N 2.98Å
327	R	90.9	Very high	90.5	Very high	84 Å²	84	45.7 Å²	45.7	32%	0.317	25%	0.248	S	C	.	.	H	α-helix	trans	-62.7	-46.8	176.4	-69.8	-71.5	-169.3	109.7	6.9	111.1	E323 G324 L325 A330 G331 D332 A336 F339	E323-R327 VanDerWaalsContact O-CG 3.29Å; E323-R327 WeakPolarHBondContact O-CG 3.46Å; E323-R327 PolarHBondContact O-N 3.05Å; G324-R327 WeakPolarHBondContact O-CB 3.46Å; G324-R327 PolarHBondContact O-N 3.09Å; L325-R327 VanDerWaalsContact C-N 3.33Å; L325-R327 PolarHBondContact O-N 3.5Å; R327-A330 CarbonylContact O-C 3.33Å; R327-A330 PolarHBondContact O-N 3.02Å; R327-G331 PolarHBondContact O-N 3.04Å; R327-D332 HydrophobicContact CB-CB 4.37Å; R327-D332 WeakPolarHBondContact CD-OD2 3.35Å; R327-D332 IonicContact CZ-OD2 2.6Å; R327-D332 IonicContact NE-OD2 3.84Å; R327-D332 IonicContact NH1-OD2 3.95Å; R327-D332 PolarHBondContact NH1-OD2 3.17Å; R327-D332 PolarHBondContact O-N 2.87Å; R327-A336 HydrophobicContact CB-CB 3.76Å; R327-F339 HydrophobicContact CG-CD2 4.06Å; R327-F339 HydrophobicContact CG-CE2 4.15Å
328	M	90.9	Very high	90.5	Very high	29 Å²	29	44 Å²	44	14%	0.143	24%	0.239	C	C	.	.	H	α-helix	trans	-61	-47.4	177.1	-173.1	-168.5	75.2	0	0	111.7	G324 L325 A330 G331 I333 A336 Y356 Q537	G324-M328 WeakPolarHBondContact O-CB 3.48Å; G324-M328 PolarHBondContact O-N 2.73Å; L325-M328 HydrophobicContact CD2-CE 4.17Å; L325-M328 PolarHBondContact O-N 3.42Å; M328-A330 VanDerWaalsContact C-N 3.26Å; M328-A330 PolarHBondContact O-N 3.44Å; M328-G331 PolarHBondContact O-N 3.4Å; M328-G331 VanDerWaalsContact O-N 3.13Å; M328-I333 HydrophobicContact CB-CD1 4.45Å; M328-I333 HydrophobicContact CG-CD1 3.71Å; M328-A336 HydrophobicContact CB-CB 4.04Å; M328-Y356 HydrophobicContact CE-CD1 4.25Å; M328-Y356 HydrophobicContact CE-CE1 3.97Å; M328-Y356 HydrophobicContact SD-CD1 3.91Å; M328-Y356 HydrophobicContact SD-CE1 4.21Å; M328-Q537 PolarHBondContact O-NE2 2.96Å
329	E	90.1	Very high	90.8	Very high	152 Å²	152	38.9 Å²	38.9	71%	0.71	21%	0.205	S	C	*	.	H	α-helix	trans	-62.9	-29.3	174.6	-73	177.9	179.6	0	0	113.2	L325 G331	L325-E329 WeakPolarHBondContact O-CG 3.2Å; L325-E329 PolarHBondContact O-N 3.17Å; E329-G331 VanDerWaalsContact C-N 3.31Å
330	A	90.2	Very high	90.9	Very high	85 Å²	85	35.3 Å²	35.3	70%	0.702	19%	0.185	S	C	*	.	T	Hydrogen-bonded Turn	trans	-83	-2.3	176.3	0	0	0	0	0	114.1	K326 R327 M328	K326-A330 VanDerWaalsContact O-CB 3.22Å; K326-A330 WeakPolarHBondContact O-CB 3.26Å; K326-A330 PolarHBondContact O-N 2.98Å; R327-A330 CarbonylContact O-C 3.33Å; R327-A330 PolarHBondContact O-N 3.02Å; M328-A330 VanDerWaalsContact C-N 3.26Å; M328-A330 PolarHBondContact O-N 3.44Å
331	G	86.4	Confident	90.9	Very high	12 Å²	12	35 Å²	35	12%	0.124	18%	0.183	C	C	.	.	T	Hydrogen-bonded Turn	trans	91.1	-2.5	-178.5	0	0	0	0	0	115.6	R327 M328 E329 I333 G539	R327-G331 PolarHBondContact O-N 3.04Å; M328-G331 PolarHBondContact O-N 3.4Å; M328-G331 VanDerWaalsContact O-N 3.13Å; E329-G331 VanDerWaalsContact C-N 3.31Å; G331-I333 VanDerWaalsContact C-N 3.31Å; G331-I333 PolarHBondContact O-N 3.33Å; G331-I333 VanDerWaalsContact O-N 3.09Å; G331-G539 WeakPolarHBondContact O-CA 3.35Å
332	D	89.4	Confident	90.8	Very high	47 Å²	47	33 Å²	33	25%	0.251	17%	0.174	S	C	.	.			trans	-85.9	67.3	178.3	-177.6	18.8	0	0	0	110.8	R327 G335 A336	R327-D332 HydrophobicContact CB-CB 4.37Å; R327-D332 WeakPolarHBondContact CD-OD2 3.35Å; R327-D332 IonicContact CZ-OD2 2.6Å; R327-D332 IonicContact NE-OD2 3.84Å; R327-D332 IonicContact NH1-OD2 3.95Å; R327-D332 PolarHBondContact NH1-OD2 3.17Å; R327-D332 PolarHBondContact O-N 2.87Å; D332-G335 PolarHBondContact O-N 3.39Å; D332-G335 VanDerWaalsContact OD1-CA 3.31Å; D332-G335 WeakPolarHBondContact OD1-CA 3.4Å; D332-G335 PolarHBondContact OD1-N 3.04Å; D332-A336 WeakPolarHBondContact O-CB 3.4Å; D332-A336 PolarHBondContact O-N 3.32Å
333	I	89.2	Confident	90.8	Very high	0 Å²	0	31.4 Å²	31.4	0%	0	16%	0.163	C	C	.	.	H	α-helix	trans	-56.9	-51.3	178.4	-61.8	-58.5	0	0	0	112	M328 G331 G335 A336 V337 C360 E363 N364	M328-I333 HydrophobicContact CB-CD1 4.45Å; M328-I333 HydrophobicContact CG-CD1 3.71Å; G331-I333 VanDerWaalsContact C-N 3.31Å; G331-I333 PolarHBondContact O-N 3.33Å; G331-I333 VanDerWaalsContact O-N 3.09Å; I333-G335 VanDerWaalsContact C-N 3.3Å; I333-G335 PolarHBondContact O-N 3Å; I333-A336 WeakPolarHBondContact O-CB 3.49Å; I333-A336 PolarHBondContact O-N 3.42Å; I333-A336 VanDerWaalsContact O-N 3.12Å; I333-V337 PolarHBondContact O-N 3.49Å; I333-V337 VanDerWaalsContact O-N 3.16Å; I333-C360 HydrophobicContact CG2-CB 4.31Å; I333-E363 WeakPolarHBondContact CD1-OE2 3.45Å; I333-E363 HydrophobicContact CG2-CB 3.92Å; I333-N364 HydrophobicContact CG2-CB 4.35Å
334	P	86.9	Confident	90.9	Very high	11 Å²	11	29.2 Å²	29.2	7%	0.071	15%	0.154	C	C	.	.	H	α-helix	trans	-71.9	-27.1	-174.9	-14.5	32.1	0	0	0	111.6	N364 V541 A574	P334-N364 WeakPolarHBondContact CB-OD1 3.09Å; P334-N364 WeakPolarHBondContact CG-OD1 3.25Å; P334-V541 HydrophobicContact CG-CG2 3.77Å; P334-A574 VanDerWaalsContact C-CB 3.43Å; P334-A574 HydrophobicContact CB-CB 3.59Å
335	G	87.1	Confident	90.8	Very high	3 Å²	3	32.7 Å²	32.7	3%	0.031	17%	0.17	C	C	.	.	H	α-helix	trans	-70.9	-35.7	170	0	0	0	0	0	112.8	D332 I333 R338 F339 A574	D332-G335 PolarHBondContact O-N 3.39Å; D332-G335 VanDerWaalsContact OD1-CA 3.31Å; D332-G335 WeakPolarHBondContact OD1-CA 3.4Å; D332-G335 PolarHBondContact OD1-N 3.04Å; I333-G335 VanDerWaalsContact C-N 3.3Å; I333-G335 PolarHBondContact O-N 3Å; G335-R338 PolarHBondContact O-N 3.06Å; G335-F339 WeakPolarHBondContact O-CD2 3.43Å; G335-A574 VanDerWaalsContact N-CB 3.29Å
336	A	91.6	Very high	90.7	Very high	0 Å²	0	35.1 Å²	35.1	0%	0	18%	0.179	C	C	.	.	H	α-helix	trans	-63.8	-38.3	176.6	0	0	0	0	0	112.8	G324 R327 M328 D332 I333 R338 F339 F340	G324-A336 WeakPolarHBondContact O-CB 3.49Å; R327-A336 HydrophobicContact CB-CB 3.76Å; M328-A336 HydrophobicContact CB-CB 4.04Å; D332-A336 WeakPolarHBondContact O-CB 3.4Å; D332-A336 PolarHBondContact O-N 3.32Å; I333-A336 WeakPolarHBondContact O-CB 3.49Å; I333-A336 PolarHBondContact O-N 3.42Å; I333-A336 VanDerWaalsContact O-N 3.12Å; A336-R338 VanDerWaalsContact C-N 3.28Å; A336-R338 PolarHBondContact O-N 2.93Å; A336-F339 WeakPolarHBondContact O-CB 2.99Å; A336-F339 PolarHBondContact O-N 3.25Å; A336-F340 HydrophobicContact CB-CD2 4.3Å; A336-F340 HydrophobicContact CB-CE2 3.86Å; A336-F340 WeakPolarHBondContact O-CD2 3.26Å; A336-F340 PolarHBondContact O-N 3.04Å
337	V	91.6	Very high	90.6	Very high	2 Å²	2	35.5 Å²	35.5	1%	0.012	18%	0.182	C	C	.	.	H	α-helix	trans	-49	-48.9	176.1	168.3	0	0	0	0	111.3	I333 F339 F340 E341 L357 C360 Q361 N364	I333-V337 PolarHBondContact O-N 3.49Å; I333-V337 VanDerWaalsContact O-N 3.16Å; V337-F339 VanDerWaalsContact C-N 3.3Å; V337-F339 PolarHBondContact O-N 3.42Å; V337-F340 CarbonylContact O-C 3.4Å; V337-F340 PolarHBondContact O-N 3.34Å; V337-E341 HydrophobicContact CG1-CG 4.43Å; V337-E341 PolarHBondContact O-N 2.81Å; V337-L357 HydrophobicContact CG1-CD1 4.01Å; V337-C360 HydrophobicContact CG2-CB 3.72Å; V337-Q361 HydrophobicContact CG1-CG 4.14Å; V337-Q361 HydrophobicContact CG2-CG 4.31Å; V337-N364 HydrophobicContact CG2-CB 4.45Å
338	R	88.1	Confident	90.6	Very high	25 Å²	25	34.7 Å²	34.7	9%	0.094	19%	0.188	C	C	.	.	H	α-helix	trans	-61.7	-36.1	-179.3	-71.7	173	152.3	-156.8	-18.3	113.7	E309 N312 G335 A336 S342 A574 A575	E309-R338 VanDerWaalsContact OE1-CG 3.3Å; E309-R338 WeakPolarHBondContact OE1-CG 3.39Å; E309-R338 IonicContact OE1-NE 3.05Å; E309-R338 PolarHBondContact OE1-NE 2.85Å; E309-R338 IonicContact OE2-CZ 3.75Å; E309-R338 VanDerWaalsContact OE2-CZ 3.23Å; E309-R338 IonicContact OE2-NE 3.34Å; E309-R338 PolarHBondContact OE2-NE 3.15Å; E309-R338 IonicContact OE2-NH2 2.72Å; E309-R338 PolarHBondContact OE2-NH2 3.36Å; N312-R338 PolarHBondContact ND2-O 3.17Å; G335-R338 PolarHBondContact O-N 3.06Å; A336-R338 VanDerWaalsContact C-N 3.28Å; A336-R338 PolarHBondContact O-N 2.93Å; R338-S342 WeakPolarHBondContact O-CB 3.02Å; R338-S342 PolarHBondContact O-N 3.24Å; R338-S342 PolarHBondContact O-OG 3.45Å; R338-A574 PolarHBondContact NH1-O 2.73Å; R338-A575 VanDerWaalsContact NH1-CA 3.27Å; R338-A575 PolarHBondContact NH1-O 3.05Å
339	F	91.6	Very high	90.7	Very high	12 Å²	12	39.7 Å²	39.7	5%	0.053	22%	0.215	C	C	.	.	H	α-helix	trans	-68.3	-45	173.2	-77.6	-77.9	0	0	0	110.8	C314 H317 P320 E323 G324 R327 G335 A336 V337 E341 S342 A343	C314-F339 HydrophobicContact CB-CD1 4.05Å; C314-F339 HydrophobicContact CB-CE1 4.01Å; C314-F339 HydrophobicContact CB-CG 4.48Å; C314-F339 HydrophobicContact CB-CZ 4.38Å; H317-F339 HydrophobicContact CB-CE1 4.28Å; P320-F339 HydrophobicContact CB-CD1 4.21Å; P320-F339 WeakPolarHBondContact O-CB 3.4Å; E323-F339 HydrophobicContact CB-CD1 3.87Å; E323-F339 HydrophobicContact CB-CE1 3.97Å; E323-F339 HydrophobicContact CB-CG 4.4Å; E323-F339 HydrophobicContact CG-CD1 4Å; E323-F339 HydrophobicContact CG-CE1 3.65Å; E323-F339 HydrophobicContact CG-CE2 4.34Å; E323-F339 HydrophobicContact CG-CG 4.47Å; E323-F339 HydrophobicContact CG-CZ 3.85Å; G324-F339 VanDerWaalsContact CA-CB 3.5Å; R327-F339 HydrophobicContact CG-CD2 4.06Å; R327-F339 HydrophobicContact CG-CE2 4.15Å; G335-F339 WeakPolarHBondContact O-CD2 3.43Å; A336-F339 WeakPolarHBondContact O-CB 2.99Å; A336-F339 PolarHBondContact O-N 3.25Å; V337-F339 VanDerWaalsContact C-N 3.3Å; V337-F339 PolarHBondContact O-N 3.42Å; F339-E341 PolarHBondContact O-N 3.25Å; F339-S342 WeakPolarHBondContact CA-OG 3.33Å; F339-S342 CarbonylContact O-C 3.18Å; F339-S342 PolarHBondContact O-N 3.11Å; F339-S342 PolarHBondContact O-OG 2.92Å; F339-A343 WeakPolarHBondContact O-CB 3.45Å; F339-A343 PolarHBondContact O-N 3.15Å
340	F	94.1	Very high	90.9	Very high	0 Å²	0	34.1 Å²	34.1	0%	0	19%	0.19	C	C	.	.	H	α-helix	trans	-65.1	-37.4	176.6	-61.6	-52.3	0	0	0	113.1	F321 L325 A336 V337 A343 V344 Y356 L357 C360	F321-F340 AromaticContact CD2-CD1 3.96Å; F321-F340 HydrophobicContact CD2-CD1 3.96Å; F321-F340 AromaticContact CD2-CE1 3.96Å; F321-F340 HydrophobicContact CD2-CE1 3.96Å; F321-F340 HydrophobicContact CE2-CD1 4.23Å; F321-F340 AromaticContact CE2-CE1 4Å; F321-F340 HydrophobicContact CE2-CE1 4Å; L325-F340 HydrophobicContact CD2-CE1 4.28Å; L325-F340 HydrophobicContact CD2-CZ 4.06Å; L325-F340 HydrophobicContact CG-CE1 4.23Å; L325-F340 HydrophobicContact CG-CZ 4.3Å; A336-F340 HydrophobicContact CB-CD2 4.3Å; A336-F340 HydrophobicContact CB-CE2 3.86Å; A336-F340 WeakPolarHBondContact O-CD2 3.26Å; A336-F340 PolarHBondContact O-N 3.04Å; V337-F340 CarbonylContact O-C 3.4Å; V337-F340 PolarHBondContact O-N 3.34Å; F340-A343 WeakPolarHBondContact O-CB 3.33Å; F340-A343 PolarHBondContact O-N 3.28Å; F340-A343 VanDerWaalsContact O-N 3.17Å; F340-V344 PolarHBondContact O-N 3.36Å; F340-Y356 HydrophobicContact CE1-CG 4.3Å; F340-Y356 HydrophobicContact CZ-CG 4.2Å; F340-L357 HydrophobicContact CB-CB 3.88Å; F340-L357 HydrophobicContact CB-CD1 4.01Å; F340-C360 HydrophobicContact CD2-CB 4.43Å; F340-C360 VanDerWaalsContact CE2-SG 3.56Å
341	E	91.9	Very high	91.1	Very high	3 Å²	3	31.8 Å²	31.8	1%	0.014	17%	0.165	C	C	.	.	H	α-helix	trans	-57.7	-50.1	169.4	-74.3	-157.9	171.6	0	0	111.7	Y306 F308 E309 V337 F339 A343 V344 Q345 L357	Y306-E341 HydrophobicContact CE1-CG 4.12Å; Y306-E341 VanDerWaalsContact CE1-OE1 3.3Å; Y306-E341 WeakPolarHBondContact CE1-OE1 3.24Å; Y306-E341 PolarHBondContact OH-OE1 2.78Å; F308-E341 HydrophobicContact CD1-CG 4.5Å; E309-E341 PolarHBondContact N-OE2 3.11Å; E309-E341 VanDerWaalsContact N-OE2 3.11Å; V337-E341 HydrophobicContact CG1-CG 4.43Å; V337-E341 PolarHBondContact O-N 2.81Å; F339-E341 PolarHBondContact O-N 3.25Å; E341-A343 PolarHBondContact O-N 3.39Å; E341-V344 VanDerWaalsContact O-CG2 3.26Å; E341-V344 WeakPolarHBondContact O-CG2 3.3Å; E341-V344 PolarHBondContact O-N 3.16Å; E341-Q345 WeakPolarHBondContact O-CB 3.46Å; E341-Q345 WeakPolarHBondContact O-CG 3.44Å; E341-Q345 PolarHBondContact O-N 2.69Å; E341-L357 HydrophobicContact CG-CD1 3.68Å; E341-L357 HydrophobicContact CG-CD2 4.22Å
342	S	91.3	Very high	91.5	Very high	0 Å²	0	35.2 Å²	35.2	0%	0	18%	0.18	C	C	.	.	H	α-helix	trans	-66.8	-21.1	178.5	69.5	0	0	0	0	113.3	P320 R338 F339 K346	P320-S342 WeakPolarHBondContact CB-OG 3.43Å; R338-S342 WeakPolarHBondContact O-CB 3.02Å; R338-S342 PolarHBondContact O-N 3.24Å; R338-S342 PolarHBondContact O-OG 3.45Å; F339-S342 WeakPolarHBondContact CA-OG 3.33Å; F339-S342 CarbonylContact O-C 3.18Å; F339-S342 PolarHBondContact O-N 3.11Å; F339-S342 PolarHBondContact O-OG 2.92Å; S342-K346 VanDerWaalsContact O-CG 3.29Å; S342-K346 WeakPolarHBondContact O-CG 3.41Å; S342-K346 PolarHBondContact O-N 3.33Å
343	A	93.4	Very high	91.7	Very high	4 Å²	4	33 Å²	33	3%	0.033	17%	0.168	C	C	.	.	H	α-helix	trans	-75	-50.3	171.9	0	0	0	0	0	111.5	P320 F321 F339 F340 E341 Q345 K346 E347 A353	P320-A343 HydrophobicContact CB-CB 4.33Å; P320-A343 HydrophobicContact CG-CB 3.89Å; F321-A343 HydrophobicContact CB-CB 4.03Å; F339-A343 WeakPolarHBondContact O-CB 3.45Å; F339-A343 PolarHBondContact O-N 3.15Å; F340-A343 WeakPolarHBondContact O-CB 3.33Å; F340-A343 PolarHBondContact O-N 3.28Å; F340-A343 VanDerWaalsContact O-N 3.17Å; E341-A343 PolarHBondContact O-N 3.39Å; A343-Q345 VanDerWaalsContact C-N 3.29Å; A343-Q345 PolarHBondContact O-N 3.42Å; A343-K346 PolarHBondContact O-N 2.96Å; A343-K346 VanDerWaalsContact O-N 3.13Å; A343-E347 PolarHBondContact O-N 3.12Å; A343-A353 HydrophobicContact CB-CB 3.99Å
344	V	93.9	Very high	92.1	Very high	2 Å²	2	33.5 Å²	33.5	1%	0.012	17%	0.17	C	C	.	.	H	α-helix	trans	-68.3	-26.9	177.9	-59.5	0	0	0	0	112.8	F308 F340 E341 K346 E347 P348 A353 W354 L357	F308-V344 HydrophobicContact CE1-CG2 3.66Å; F308-V344 HydrophobicContact CZ-CG2 4.22Å; F340-V344 PolarHBondContact O-N 3.36Å; E341-V344 VanDerWaalsContact O-CG2 3.26Å; E341-V344 WeakPolarHBondContact O-CG2 3.3Å; E341-V344 PolarHBondContact O-N 3.16Å; V344-K346 VanDerWaalsContact C-N 3.34Å; V344-E347 CarbonylContact O-C 3.58Å; V344-P348 WeakPolarHBondContact O-CA 3.41Å; V344-P348 VanDerWaalsContact O-N 3.13Å; V344-A353 HydrophobicContact CG1-CB 3.54Å; V344-W354 HydrophobicContact CB-CD2 4.06Å; V344-W354 HydrophobicContact CB-CH2 4.35Å; V344-W354 HydrophobicContact CB-CZ2 3.84Å; V344-W354 HydrophobicContact CG1-CB 4.39Å; V344-W354 HydrophobicContact CG1-CD2 3.63Å; V344-W354 HydrophobicContact CG1-CE3 4.15Å; V344-W354 HydrophobicContact CG1-CG 3.72Å; V344-W354 HydrophobicContact CG1-CZ2 4.36Å; V344-W354 HydrophobicContact CG2-CD2 4.49Å; V344-W354 HydrophobicContact CG2-CE3 4.5Å; V344-W354 HydrophobicContact CG2-CH2 4.01Å; V344-W354 HydrophobicContact CG2-CZ2 3.98Å; V344-W354 HydrophobicContact CG2-CZ3 4.27Å; V344-L357 HydrophobicContact CG1-CD2 4.35Å; V344-L357 HydrophobicContact CG2-CD2 3.76Å
345	Q	91.1	Very high	92.6	Very high	72 Å²	72	33.8 Å²	33.8	34%	0.336	17%	0.17	S	C	.	.	H	α-helix	trans	-70.3	-28.9	172.1	-73.8	-172.7	47.6	0	0	112.8	F308 L315 E341 A343	F308-Q345 HydrophobicContact CD1-CG 3.84Å; F308-Q345 HydrophobicContact CE1-CG 3.78Å; F308-Q345 HydrophobicContact CG-CG 4.26Å; F308-Q345 HydrophobicContact CZ-CG 4.14Å; L315-Q345 HydrophobicContact CD2-CB 4.03Å; L315-Q345 HydrophobicContact CD2-CG 4.49Å; E341-Q345 WeakPolarHBondContact O-CB 3.46Å; E341-Q345 WeakPolarHBondContact O-CG 3.44Å; E341-Q345 PolarHBondContact O-N 2.69Å; A343-Q345 VanDerWaalsContact C-N 3.29Å; A343-Q345 PolarHBondContact O-N 3.42Å
346	K	90.7	Very high	93	Very high	90 Å²	90	36.8 Å²	36.8	39%	0.391	18%	0.181	S	C	.	.	H	α-helix	trans	-84.1	-37.8	174.8	-71.9	-179.5	-167.7	-158	0	112.9	L315 H317 P320 S342 A343 V344	L315-K346 WeakPolarHBondContact O-CE 3.5Å; L315-K346 PolarHBondContact O-NZ 3.46Å; H317-K346 PolarHBondContact O-NZ 2.94Å; P320-K346 HydrophobicContact CG-CD 4.12Å; S342-K346 VanDerWaalsContact O-CG 3.29Å; S342-K346 WeakPolarHBondContact O-CG 3.41Å; S342-K346 PolarHBondContact O-N 3.33Å; A343-K346 PolarHBondContact O-N 2.96Å; A343-K346 VanDerWaalsContact O-N 3.13Å; V344-K346 VanDerWaalsContact C-N 3.34Å
347	E	91.6	Very high	93.2	Very high	112 Å²	112	36.8 Å²	36.8	52%	0.523	18%	0.181	S	C	.	.			trans	-128.7	79.5	-178.5	-59.4	-178.3	170.1	0	0	109.5	A343 V344 D349 N350	A343-E347 PolarHBondContact O-N 3.12Å; V344-E347 CarbonylContact O-C 3.58Å; E347-D349 PolarHBondContact O-N 3.01Å; E347-D349 VanDerWaalsContact O-N 3.12Å; E347-N350 HydrophobicContact CB-CB 3.65Å; E347-N350 VanDerWaalsContact O-CB 3.26Å; E347-N350 WeakPolarHBondContact O-CB 3.09Å; E347-N350 PolarHBondContact O-N 3.42Å; E347-N350 PolarHBondContact OE2-ND2 3.23Å
348	P	92.6	Very high	93.4	Very high	68 Å²	68	36.7 Å²	36.7	44%	0.442	18%	0.18	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.1	-24.9	-177.2	-26.8	36.5	0	0	0	114.4	V344 W354	V344-P348 WeakPolarHBondContact O-CA 3.41Å; V344-P348 VanDerWaalsContact O-N 3.13Å; P348-W354 PolarHBondContact O-NE1 2.86Å
349	D	93	Very high	93.7	Very high	134 Å²	134	36.5 Å²	36.5	72%	0.717	18%	0.182	S	C	*	.	T	Hydrogen-bonded Turn	trans	-87.7	-1.2	177.1	-56.2	-39.7	0	0	0	112.9	E347 Q351	E347-D349 PolarHBondContact O-N 3.01Å; E347-D349 VanDerWaalsContact O-N 3.12Å; D349-Q351 PolarHBondContact O-N 3Å
350	N	93.6	Very high	93.9	Very high	35 Å²	35	35.9 Å²	35.9	19%	0.187	18%	0.179	C	C	.	.			trans	-75.3	92	178.7	-172.2	-25.7	0	0	0	110.7	E347 L352 A353 W354	E347-N350 HydrophobicContact CB-CB 3.65Å; E347-N350 VanDerWaalsContact O-CB 3.26Å; E347-N350 WeakPolarHBondContact O-CB 3.09Å; E347-N350 PolarHBondContact O-N 3.42Å; E347-N350 PolarHBondContact OE2-ND2 3.23Å; N350-L352 VanDerWaalsContact C-N 3.28Å; N350-L352 PolarHBondContact O-N 3.4Å; N350-L352 PolarHBondContact OD1-N 2.92Å; N350-A353 HydrophobicContact CB-CB 4.01Å; N350-A353 WeakPolarHBondContact O-CB 3.37Å; N350-A353 PolarHBondContact O-N 3.24Å; N350-A353 VanDerWaalsContact O-N 3.16Å; N350-A353 PolarHBondContact OD1-N 3.06Å; N350-W354 PolarHBondContact O-N 3.46Å; N350-W354 VanDerWaalsContact O-N 3.16Å
351	Q	93.4	Very high	93.9	Very high	35 Å²	35	36.6 Å²	36.6	16%	0.164	18%	0.183	C	C	.	.	H	α-helix	trans	-60.4	-30.9	-177.9	-170.6	-108.8	-30.5	0	0	114	D349 Q355 C377 L380 K381 N384	D349-Q351 PolarHBondContact O-N 3Å; Q351-Q355 PolarHBondContact O-N 2.81Å; Q351-Q355 VanDerWaalsContact O-N 3.11Å; Q351-C377 PolarHBondContact NE2-SG 3.47Å; Q351-C377 VanDerWaalsContact NE2-SG 3.37Å; Q351-L380 HydrophobicContact CB-CB 4.15Å; Q351-L380 HydrophobicContact CB-CD1 4.13Å; Q351-L380 HydrophobicContact CG-CB 3.92Å; Q351-K381 VanDerWaalsContact CD-CB 3.45Å; Q351-K381 HydrophobicContact CG-CB 3.63Å; Q351-K381 VanDerWaalsContact OE1-CD 3.27Å; Q351-N384 PolarHBondContact NE2-ND2 3.31Å
352	L	94.7	Very high	94	Very high	84 Å²	84	37.3 Å²	37.3	44%	0.44	19%	0.189	S	C	.	.	H	α-helix	trans	-74.2	-39.1	175.3	-70.6	174.9	0	0	0	111.5	F321 N350 W354 Q355 Y356	F321-L352 HydrophobicContact CE2-CB 4.35Å; F321-L352 HydrophobicContact CZ-CB 4.03Å; N350-L352 VanDerWaalsContact C-N 3.28Å; N350-L352 PolarHBondContact O-N 3.4Å; N350-L352 PolarHBondContact OD1-N 2.92Å; L352-W354 VanDerWaalsContact C-N 3.32Å; L352-W354 PolarHBondContact O-N 3.32Å; L352-Q355 WeakPolarHBondContact O-CB 3.34Å; L352-Q355 PolarHBondContact O-N 2.92Å; L352-Y356 VanDerWaalsContact O-CD2 3.26Å; L352-Y356 WeakPolarHBondContact O-CD2 3.32Å; L352-Y356 PolarHBondContact O-N 3.36Å
353	A	95.4	Very high	94.1	Very high	0 Å²	0	37.8 Å²	37.8	0%	0	19%	0.192	C	C	.	.	H	α-helix	trans	-60.7	-42.1	174.8	0	0	0	0	0	111.4	F321 A343 V344 N350 Y356 L357	F321-A353 HydrophobicContact CD2-CB 3.91Å; F321-A353 HydrophobicContact CE2-CB 4.19Å; A343-A353 HydrophobicContact CB-CB 3.99Å; V344-A353 HydrophobicContact CG1-CB 3.54Å; N350-A353 HydrophobicContact CB-CB 4.01Å; N350-A353 WeakPolarHBondContact O-CB 3.37Å; N350-A353 PolarHBondContact O-N 3.24Å; N350-A353 VanDerWaalsContact O-N 3.16Å; N350-A353 PolarHBondContact OD1-N 3.06Å; A353-Y356 PolarHBondContact O-N 3.15Å; A353-L357 VanDerWaalsContact O-CB 3.26Å; A353-L357 WeakPolarHBondContact O-CB 3.44Å; A353-L357 PolarHBondContact O-N 2.96Å
354	W	96.2	Very high	94.1	Very high	12 Å²	12	38.1 Å²	38.1	5%	0.045	19%	0.193	C	C	.	.	H	α-helix	trans	-63.9	-39.6	172.7	-77.5	110.4	0	0	0	113.7	Y306 F308 V344 P348 N350 L352 L357 G358 A373 R376 C377 L380	Y306-W354 HydrophobicContact CD1-CH2 4.46Å; Y306-W354 HydrophobicContact CD1-CZ3 4.33Å; Y306-W354 HydrophobicContact CD2-CZ3 4.03Å; Y306-W354 HydrophobicContact CG-CH2 4.16Å; Y306-W354 AromaticContact CG-CZ3 3.78Å; Y306-W354 HydrophobicContact CG-CZ3 3.78Å; F308-W354 HydrophobicContact CE1-CH2 4.18Å; F308-W354 AromaticContact CZ-CH2 3.75Å; F308-W354 HydrophobicContact CZ-CH2 3.75Å; F308-W354 HydrophobicContact CZ-CZ2 4.28Å; V344-W354 HydrophobicContact CB-CD2 4.06Å; V344-W354 HydrophobicContact CB-CH2 4.35Å; V344-W354 HydrophobicContact CB-CZ2 3.84Å; V344-W354 HydrophobicContact CG1-CB 4.39Å; V344-W354 HydrophobicContact CG1-CD2 3.63Å; V344-W354 HydrophobicContact CG1-CE3 4.15Å; V344-W354 HydrophobicContact CG1-CG 3.72Å; V344-W354 HydrophobicContact CG1-CZ2 4.36Å; V344-W354 HydrophobicContact CG2-CD2 4.49Å; V344-W354 HydrophobicContact CG2-CE3 4.5Å; V344-W354 HydrophobicContact CG2-CH2 4.01Å; V344-W354 HydrophobicContact CG2-CZ2 3.98Å; V344-W354 HydrophobicContact CG2-CZ3 4.27Å; P348-W354 PolarHBondContact O-NE1 2.86Å; N350-W354 PolarHBondContact O-N 3.46Å; N350-W354 VanDerWaalsContact O-N 3.16Å; L352-W354 VanDerWaalsContact C-N 3.32Å; L352-W354 PolarHBondContact O-N 3.32Å; W354-L357 HydrophobicContact CE3-CD2 4.01Å; W354-L357 HydrophobicContact CZ3-CD2 3.91Å; W354-G358 PolarHBondContact O-N 3.33Å; W354-A373 HydrophobicContact CE3-CB 3.81Å; W354-A373 HydrophobicContact CZ3-CB 4.09Å; W354-R376 HydrophobicContact CD2-CB 3.94Å; W354-R376 HydrophobicContact CE3-CB 4.01Å; W354-R376 HydrophobicContact CG-CB 4.4Å; W354-R376 HydrophobicContact CZ3-CB 4.34Å; W354-R376 HydrophobicContact CZ3-CG 4.49Å; W354-C377 HydrophobicContact CB-CB 3.82Å; W354-L380 HydrophobicContact CG-CD1 4.49Å
355	Q	97	Very high	94.1	Very high	17 Å²	17	38.2 Å²	38.2	8%	0.079	19%	0.193	C	C	.	.	H	α-helix	trans	-59.7	-52.7	175.4	-174	-158.4	-66.9	0	0	111.2	Q351 L352 G358 T359 N384 A387	Q351-Q355 PolarHBondContact O-N 2.81Å; Q351-Q355 VanDerWaalsContact O-N 3.11Å; L352-Q355 WeakPolarHBondContact O-CB 3.34Å; L352-Q355 PolarHBondContact O-N 2.92Å; Q355-G358 PolarHBondContact O-N 3.48Å; Q355-T359 PolarHBondContact O-N 3.45Å; Q355-T359 PolarHBondContact O-OG1 3.2Å; Q355-N384 PolarHBondContact OE1-ND2 3.31Å; Q355-N384 PolarHBondContact OE1-OD1 3.15Å; Q355-A387 HydrophobicContact CG-CB 4.38Å
356	Y	96.6	Very high	94	Very high	65 Å²	65	37 Å²	37	26%	0.255	19%	0.187	S	C	.	.	H	α-helix	trans	-68.6	-34.8	-178	-77.7	-70.9	0	0	0	112.7	F321 L325 M328 F340 L352 A353 G358 T359 C360	F321-Y356 AromaticContact CE2-CD2 3.81Å; F321-Y356 HydrophobicContact CE2-CD2 3.81Å; F321-Y356 HydrophobicContact CE2-CE2 4.46Å; F321-Y356 AromaticContact CZ-CD2 3.86Å; F321-Y356 HydrophobicContact CZ-CD2 3.86Å; F321-Y356 HydrophobicContact CZ-CE2 4.04Å; L325-Y356 HydrophobicContact CD2-CD1 4.07Å; L325-Y356 HydrophobicContact CD2-CD2 4.1Å; L325-Y356 HydrophobicContact CD2-CE1 3.85Å; L325-Y356 HydrophobicContact CD2-CE2 3.88Å; L325-Y356 HydrophobicContact CD2-CG 4.2Å; M328-Y356 HydrophobicContact CE-CD1 4.25Å; M328-Y356 HydrophobicContact CE-CE1 3.97Å; M328-Y356 HydrophobicContact SD-CD1 3.91Å; M328-Y356 HydrophobicContact SD-CE1 4.21Å; F340-Y356 HydrophobicContact CE1-CG 4.3Å; F340-Y356 HydrophobicContact CZ-CG 4.2Å; L352-Y356 VanDerWaalsContact O-CD2 3.26Å; L352-Y356 WeakPolarHBondContact O-CD2 3.32Å; L352-Y356 PolarHBondContact O-N 3.36Å; A353-Y356 PolarHBondContact O-N 3.15Å; Y356-G358 VanDerWaalsContact C-N 3.34Å; Y356-T359 PolarHBondContact O-OG1 3.44Å; Y356-C360 VanDerWaalsContact O-CB 3.25Å; Y356-C360 WeakPolarHBondContact O-CB 3.5Å; Y356-C360 PolarHBondContact O-N 2.93Å; Y356-C360 PolarHBondContact O-SG 3.18Å
357	L	95.5	Very high	93.9	Very high	0 Å²	0	33 Å²	33	0%	0	17%	0.17	C	C	.	.	H	α-helix	trans	-58.6	-48	171.3	-177.7	56.2	0	0	0	110.9	Y306 V337 F340 E341 V344 A353 W354 C360 Q361 A373	Y306-L357 HydrophobicContact CD2-CD2 4.46Å; Y306-L357 HydrophobicContact CE1-CD2 4.12Å; Y306-L357 HydrophobicContact CE2-CD2 3.92Å; Y306-L357 HydrophobicContact CE2-CG 4.11Å; V337-L357 HydrophobicContact CG1-CD1 4.01Å; F340-L357 HydrophobicContact CB-CB 3.88Å; F340-L357 HydrophobicContact CB-CD1 4.01Å; E341-L357 HydrophobicContact CG-CD1 3.68Å; E341-L357 HydrophobicContact CG-CD2 4.22Å; V344-L357 HydrophobicContact CG1-CD2 4.35Å; V344-L357 HydrophobicContact CG2-CD2 3.76Å; A353-L357 VanDerWaalsContact O-CB 3.26Å; A353-L357 WeakPolarHBondContact O-CB 3.44Å; A353-L357 PolarHBondContact O-N 2.96Å; W354-L357 HydrophobicContact CE3-CD2 4.01Å; W354-L357 HydrophobicContact CZ3-CD2 3.91Å; L357-C360 PolarHBondContact O-N 2.67Å; L357-Q361 HydrophobicContact CD1-CG 4.21Å; L357-Q361 WeakPolarHBondContact O-CB 3.47Å; L357-Q361 VanDerWaalsContact O-CG 3.31Å; L357-Q361 WeakPolarHBondContact O-CG 3.36Å; L357-Q361 PolarHBondContact O-N 3.07Å; L357-A373 HydrophobicContact CB-CB 4.39Å; L357-A373 HydrophobicContact CD2-CB 4.34Å; L357-A373 HydrophobicContact CG-CB 4.12Å
358	G	95.1	Very high	93.7	Very high	0 Å²	0	31.4 Å²	31.4	0%	0	16%	0.162	C	C	.	.	H	α-helix	trans	-62.8	-46.7	179	0	0	0	0	0	113.7	W354 Q355 Y356 Q361 A362 A370	W354-G358 PolarHBondContact O-N 3.33Å; Q355-G358 PolarHBondContact O-N 3.48Å; Y356-G358 VanDerWaalsContact C-N 3.34Å; G358-Q361 PolarHBondContact O-N 3.4Å; G358-A362 PolarHBondContact O-N 2.93Å; G358-A362 VanDerWaalsContact O-N 3.11Å; G358-A370 VanDerWaalsContact O-CB 3.3Å; G358-A370 WeakPolarHBondContact O-CB 3.34Å
359	T	95.5	Very high	93.6	Very high	21 Å²	21	29.3 Å²	29.3	13%	0.129	15%	0.15	C	C	.	.	H	α-helix	trans	-66	-44	177.4	57.5	0	0	0	0	111.7	Q355 Y356 Q361 A362 E363 A390	Q355-T359 PolarHBondContact O-N 3.45Å; Q355-T359 PolarHBondContact O-OG1 3.2Å; Y356-T359 PolarHBondContact O-OG1 3.44Å; T359-Q361 VanDerWaalsContact C-N 3.33Å; T359-Q361 PolarHBondContact O-N 3.07Å; T359-A362 PolarHBondContact O-N 2.9Å; T359-E363 WeakPolarHBondContact O-CG 3.33Å; T359-E363 PolarHBondContact O-N 2.92Å; T359-A390 HydrophobicContact CG2-CB 4.05Å
360	C	95	Very high	93.6	Very high	0 Å²	0	22.9 Å²	22.9	0%	0	12%	0.115	C	C	.	.	H	α-helix	trans	-65	-35.1	178.7	-66.3	0	0	0	0	112.3	I333 V337 F340 Y356 L357 E363 N364	I333-C360 HydrophobicContact CG2-CB 4.31Å; V337-C360 HydrophobicContact CG2-CB 3.72Å; F340-C360 HydrophobicContact CD2-CB 4.43Å; F340-C360 VanDerWaalsContact CE2-SG 3.56Å; Y356-C360 VanDerWaalsContact O-CB 3.25Å; Y356-C360 WeakPolarHBondContact O-CB 3.5Å; Y356-C360 PolarHBondContact O-N 2.93Å; Y356-C360 PolarHBondContact O-SG 3.18Å; L357-C360 PolarHBondContact O-N 2.67Å; C360-E363 PolarHBondContact O-N 3.06Å; C360-N364 WeakPolarHBondContact O-CB 3.36Å; C360-N364 PolarHBondContact O-N 3.03Å
361	Q	94	Very high	93.5	Very high	14 Å²	14	21.2 Å²	21.2	7%	0.065	11%	0.107	C	C	.	.	H	α-helix	trans	-67.6	-38.8	173.9	-73.1	-72.2	39.3	0	0	112.3	Y306 V337 L357 G358 T359 E363 N364 E365 Q366 A369 A370	Y306-Q361 PolarHBondContact OH-NE2 3.24Å; V337-Q361 HydrophobicContact CG1-CG 4.14Å; V337-Q361 HydrophobicContact CG2-CG 4.31Å; L357-Q361 HydrophobicContact CD1-CG 4.21Å; L357-Q361 WeakPolarHBondContact O-CB 3.47Å; L357-Q361 VanDerWaalsContact O-CG 3.31Å; L357-Q361 WeakPolarHBondContact O-CG 3.36Å; L357-Q361 PolarHBondContact O-N 3.07Å; G358-Q361 PolarHBondContact O-N 3.4Å; T359-Q361 VanDerWaalsContact C-N 3.33Å; T359-Q361 PolarHBondContact O-N 3.07Å; Q361-E363 VanDerWaalsContact C-N 3.3Å; Q361-E363 PolarHBondContact O-N 2.91Å; Q361-N364 CarbonylContact O-C 3.47Å; Q361-N364 PolarHBondContact O-N 3Å; Q361-N364 VanDerWaalsContact O-N 3.15Å; Q361-N364 PolarHBondContact OE1-ND2 3.42Å; Q361-E365 PolarHBondContact O-N 3.48Å; Q361-Q366 HydrophobicContact CB-CB 4.25Å; Q361-Q366 PolarHBondContact O-N 3.48Å; Q361-A369 HydrophobicContact CB-CB 4.32Å; Q361-A369 HydrophobicContact CG-CB 4.15Å; Q361-A370 HydrophobicContact CB-CB 3.98Å
362	A	94.3	Very high	93.4	Very high	19 Å²	19	20 Å²	20	16%	0.157	10%	0.102	C	C	.	.	H	α-helix	trans	-63.1	-38	173.7	0	0	0	0	0	111.7	G358 T359 N364 E365 A370 R542	G358-A362 PolarHBondContact O-N 2.93Å; G358-A362 VanDerWaalsContact O-N 3.11Å; T359-A362 PolarHBondContact O-N 2.9Å; A362-N364 VanDerWaalsContact C-N 3.34Å; A362-E365 PolarHBondContact O-N 2.9Å; A362-A370 HydrophobicContact CB-CB 3.81Å; A362-R542 PolarHBondContact O-NE 3.43Å; A362-R542 PolarHBondContact O-NH2 3.28Å; A362-R542 VanDerWaalsContact O-NH2 3.09Å
363	E	94.4	Very high	93.4	Very high	10 Å²	10	16 Å²	16	5%	0.047	8%	0.081	C	C	.	.	H	α-helix	trans	-71.6	-26.3	174.2	-67.8	174.6	-130	0	0	113.6	I333 T359 C360 Q361 E365 Y507 L508 F540 V541 R542	I333-E363 WeakPolarHBondContact CD1-OE2 3.45Å; I333-E363 HydrophobicContact CG2-CB 3.92Å; T359-E363 WeakPolarHBondContact O-CG 3.33Å; T359-E363 PolarHBondContact O-N 2.92Å; C360-E363 PolarHBondContact O-N 3.06Å; Q361-E363 VanDerWaalsContact C-N 3.3Å; Q361-E363 PolarHBondContact O-N 2.91Å; E363-E365 VanDerWaalsContact C-N 3.3Å; E363-Y507 PolarHBondContact OE2-OH 3.45Å; E363-L508 HydrophobicContact CG-CD2 3.84Å; E363-F540 HydrophobicContact CB-CD2 3.92Å; E363-F540 HydrophobicContact CB-CE2 3.86Å; E363-F540 HydrophobicContact CG-CD2 4.15Å; E363-F540 HydrophobicContact CG-CE2 3.72Å; E363-V541 PolarHBondContact O-N 2.82Å; E363-R542 WeakPolarHBondContact O-CB 3.37Å; E363-R542 PolarHBondContact O-N 3.29Å
364	N	93.3	Very high	93.4	Very high	10 Å²	10	16 Å²	16	5%	0.053	8%	0.081	C	C	.	.	T	Hydrogen-bonded Turn	trans	-85.3	9	176.7	-170.1	37.4	0	0	0	113.5	I333 P334 V337 C360 Q361 A362 Q366 Q571 S594	I333-N364 HydrophobicContact CG2-CB 4.35Å; P334-N364 WeakPolarHBondContact CB-OD1 3.09Å; P334-N364 WeakPolarHBondContact CG-OD1 3.25Å; V337-N364 HydrophobicContact CG2-CB 4.45Å; C360-N364 WeakPolarHBondContact O-CB 3.36Å; C360-N364 PolarHBondContact O-N 3.03Å; Q361-N364 CarbonylContact O-C 3.47Å; Q361-N364 PolarHBondContact O-N 3Å; Q361-N364 VanDerWaalsContact O-N 3.15Å; Q361-N364 PolarHBondContact OE1-ND2 3.42Å; A362-N364 VanDerWaalsContact C-N 3.34Å; N364-Q366 VanDerWaalsContact C-N 3.34Å; N364-Q366 PolarHBondContact O-N 3.47Å; N364-Q571 PolarHBondContact O-NE2 3.47Å; N364-Q571 PolarHBondContact OD1-NE2 2.9Å; N364-S594 PolarHBondContact O-OG 3.29Å
365	E	92.8	Very high	93.2	Very high	4 Å²	4	18.5 Å²	18.5	2%	0.019	9%	0.09	C	C	.	.	T	Hydrogen-bonded Turn	trans	61.7	37.6	-176.7	-168.6	54.8	-124.1	0	0	112.9	Q361 A362 E363 V541 R542 Y545 S594 I597	Q361-E365 PolarHBondContact O-N 3.48Å; A362-E365 PolarHBondContact O-N 2.9Å; E363-E365 VanDerWaalsContact C-N 3.3Å; E365-V541 HydrophobicContact CB-CG1 4.16Å; E365-R542 IonicContact OE1-CZ 2.95Å; E365-R542 IonicContact OE1-NH1 3.75Å; E365-R542 PolarHBondContact OE1-NH1 3.04Å; E365-R542 WeakPolarHBondContact OE2-CD 3.5Å; E365-R542 IonicContact OE2-CZ 2.75Å; E365-R542 IonicContact OE2-NE 3.89Å; E365-R542 PolarHBondContact OE2-NE 2.96Å; E365-R542 IonicContact OE2-NH1 2.77Å; E365-R542 PolarHBondContact OE2-NH1 3.12Å; E365-Y545 HydrophobicContact CG-CD1 4.21Å; E365-Y545 HydrophobicContact CG-CG 4.26Å; E365-Y545 WeakPolarHBondContact OE2-CD1 3.37Å; E365-S594 VanDerWaalsContact O-CB 3.3Å; E365-S594 WeakPolarHBondContact O-CB 3.35Å; E365-S594 PolarHBondContact O-OG 3.25Å; E365-I597 HydrophobicContact CB-CD1 4.04Å; E365-I597 HydrophobicContact CB-CG1 4.45Å; E365-I597 HydrophobicContact CG-CD1 3.85Å; E365-I597 HydrophobicContact CG-CG1 3.71Å
366	Q	89.8	Confident	93	Very high	47 Å²	47	22.3 Å²	22.3	22%	0.22	10%	0.104	C	C	.	.			trans	-124.5	70.3	179.5	-69.2	-70.9	2.2	0	0	110.8	Q361 N364 A369 A370 S594	Q361-Q366 HydrophobicContact CB-CB 4.25Å; Q361-Q366 PolarHBondContact O-N 3.48Å; N364-Q366 VanDerWaalsContact C-N 3.34Å; N364-Q366 PolarHBondContact O-N 3.47Å; Q366-A369 HydrophobicContact CB-CB 4.29Å; Q366-A369 PolarHBondContact O-N 3.01Å; Q366-A370 PolarHBondContact O-N 2.98Å; Q366-S594 PolarHBondContact NE2-OG 3.36Å
367	E	88.6	Confident	92.9	Very high	6 Å²	6	19.2 Å²	19.2	3%	0.028	9%	0.092	C	C	.	.	H	α-helix	trans	-64.8	-44.8	-167	-156.4	72.5	-89.1	0	0	114	A369 A370 I371 S394 N397 E398 R542	E367-A369 VanDerWaalsContact C-N 3.35Å; E367-A369 PolarHBondContact O-N 3.12Å; E367-A370 WeakPolarHBondContact O-CB 3.07Å; E367-A370 PolarHBondContact O-N 3.03Å; E367-A370 VanDerWaalsContact O-N 3.14Å; E367-I371 HydrophobicContact CG-CD1 4.3Å; E367-I371 WeakPolarHBondContact O-CG1 3.48Å; E367-I371 PolarHBondContact O-N 3.41Å; E367-S394 VanDerWaalsContact OE1-CB 3.27Å; E367-S394 WeakPolarHBondContact OE1-CB 3.26Å; E367-S394 PolarHBondContact OE1-OG 2.86Å; E367-N397 WeakPolarHBondContact OE2-CB 3.42Å; E367-N397 PolarHBondContact OE2-ND2 3.18Å; E367-E398 HydrophobicContact CB-CG 4.46Å; E367-E398 WeakPolarHBondContact CB-OE1 3.38Å; E367-E398 HydrophobicContact CG-CG 3.78Å; E367-E398 WeakPolarHBondContact CG-OE1 3.36Å; E367-R542 VanDerWaalsContact CD-NH2 3.25Å; E367-R542 IonicContact OE1-NH2 3.23Å; E367-R542 IonicContact OE2-CZ 2.64Å; E367-R542 IonicContact OE2-NH1 2.67Å; E367-R542 IonicContact OE2-NH2 2.87Å; E367-R542 PolarHBondContact OE2-NH2 3.29Å
368	F	87.9	Confident	92.8	Very high	79 Å²	79	20.6 Å²	20.6	35%	0.346	10%	0.099	S	C	.	.	H	α-helix	trans	-63	-39.8	178.5	-64.4	-65.6	0	0	0	112.7	A370 I371 S372 E398	F368-A370 VanDerWaalsContact C-N 3.34Å; F368-I371 PolarHBondContact O-N 3.47Å; F368-S372 PolarHBondContact O-N 2.92Å; F368-S372 PolarHBondContact O-OG 3.06Å; F368-E398 HydrophobicContact CE1-CG 4.38Å; F368-E398 VanDerWaalsContact CZ-OE2 3.27Å; F368-E398 WeakPolarHBondContact CZ-OE2 3.38Å
369	A	89.9	Confident	92.6	Very high	23 Å²	23	25.6 Å²	25.6	19%	0.19	12%	0.122	C	C	.	.	H	α-helix	trans	-65	-39.3	174.4	0	0	0	0	0	111.3	Y306 Q361 Q366 E367 S372 A373	Y306-A369 WeakPolarHBondContact CD2-O 3.48Å; Y306-A369 HydrophobicContact CE2-CB 3.98Å; Y306-A369 WeakPolarHBondContact CE2-O 3.42Å; Q361-A369 HydrophobicContact CB-CB 4.32Å; Q361-A369 HydrophobicContact CG-CB 4.15Å; Q366-A369 HydrophobicContact CB-CB 4.29Å; Q366-A369 PolarHBondContact O-N 3.01Å; E367-A369 VanDerWaalsContact C-N 3.35Å; E367-A369 PolarHBondContact O-N 3.12Å; A369-S372 PolarHBondContact O-N 3.32Å; A369-A373 WeakPolarHBondContact O-CB 3.35Å; A369-A373 PolarHBondContact O-N 2.92Å
370	A	92.8	Very high	92.5	Very high	0 Å²	0	27.6 Å²	27.6	0%	0	13%	0.132	C	C	.	.	H	α-helix	trans	-60.6	-50.7	173.6	0	0	0	0	0	111.8	G358 Q361 A362 Q366 E367 F368 S372 A373 L374	G358-A370 VanDerWaalsContact O-CB 3.3Å; G358-A370 WeakPolarHBondContact O-CB 3.34Å; Q361-A370 HydrophobicContact CB-CB 3.98Å; A362-A370 HydrophobicContact CB-CB 3.81Å; Q366-A370 PolarHBondContact O-N 2.98Å; E367-A370 WeakPolarHBondContact O-CB 3.07Å; E367-A370 PolarHBondContact O-N 3.03Å; E367-A370 VanDerWaalsContact O-N 3.14Å; F368-A370 VanDerWaalsContact C-N 3.34Å; A370-S372 VanDerWaalsContact C-N 3.35Å; A370-S372 PolarHBondContact O-N 3.49Å; A370-A373 PolarHBondContact O-N 3.26Å; A370-L374 WeakPolarHBondContact O-CB 3.41Å; A370-L374 WeakPolarHBondContact O-CG 3.45Å; A370-L374 PolarHBondContact O-N 2.88Å
371	I	91.4	Very high	92.4	Very high	0 Å²	0	31.7 Å²	31.7	0%	0	15%	0.149	C	C	.	.	H	α-helix	trans	-56.4	-48.5	177.8	-67.7	167.5	0	0	0	110.4	Y302 E367 F368 A373 L374 R375 L391 F395 E398	Y302-I371 HydrophobicContact CD2-CG2 4.04Å; Y302-I371 HydrophobicContact CG-CG2 3.89Å; E367-I371 HydrophobicContact CG-CD1 4.3Å; E367-I371 WeakPolarHBondContact O-CG1 3.48Å; E367-I371 PolarHBondContact O-N 3.41Å; F368-I371 PolarHBondContact O-N 3.47Å; I371-A373 PolarHBondContact O-N 3.45Å; I371-L374 PolarHBondContact O-N 3.21Å; I371-R375 HydrophobicContact CG2-CG 4.34Å; I371-R375 WeakPolarHBondContact O-CB 3.37Å; I371-R375 VanDerWaalsContact O-CG 3.24Å; I371-R375 WeakPolarHBondContact O-CG 3.41Å; I371-R375 PolarHBondContact O-N 2.9Å; I371-L391 HydrophobicContact CB-CD1 4.31Å; I371-L391 HydrophobicContact CG1-CD1 4.23Å; I371-L391 HydrophobicContact CG2-CD1 3.98Å; I371-F395 HydrophobicContact CD1-CD1 4.17Å; I371-F395 HydrophobicContact CD1-CE1 4.41Å; I371-F395 HydrophobicContact CG1-CD1 4.48Å; I371-F395 HydrophobicContact CG2-CD1 4.49Å; I371-F395 HydrophobicContact CG2-CE1 3.75Å; I371-F395 HydrophobicContact CG2-CZ 4.32Å; I371-E398 HydrophobicContact CD1-CG 3.91Å
372	S	91.5	Very high	92.2	Very high	9 Å²	9	37.7 Å²	37.7	6%	0.063	18%	0.175	C	C	.	.	H	α-helix	trans	-59.3	-46	177.7	-72.9	0	0	0	0	112.8	G305 F368 A369 A370 R376	G305-S372 PolarHBondContact O-OG 3.4Å; F368-S372 PolarHBondContact O-N 2.92Å; F368-S372 PolarHBondContact O-OG 3.06Å; A369-S372 PolarHBondContact O-N 3.32Å; A370-S372 VanDerWaalsContact C-N 3.35Å; A370-S372 PolarHBondContact O-N 3.49Å; S372-R376 WeakPolarHBondContact O-CG 3.13Å; S372-R376 PolarHBondContact O-N 3.09Å; S372-R376 VanDerWaalsContact O-N 3.15Å
373	A	93.6	Very high	92.1	Very high	0 Å²	0	40.4 Å²	40.4	0%	0	19%	0.187	C	C	.	.	H	α-helix	trans	-67.6	-41.6	179.2	0	0	0	0	0	112.9	Y306 W354 L357 A369 A370 I371 R376 C377	Y306-A373 HydrophobicContact CD2-CB 3.78Å; Y306-A373 HydrophobicContact CE2-CB 3.93Å; W354-A373 HydrophobicContact CE3-CB 3.81Å; W354-A373 HydrophobicContact CZ3-CB 4.09Å; L357-A373 HydrophobicContact CB-CB 4.39Å; L357-A373 HydrophobicContact CD2-CB 4.34Å; L357-A373 HydrophobicContact CG-CB 4.12Å; A369-A373 WeakPolarHBondContact O-CB 3.35Å; A369-A373 PolarHBondContact O-N 2.92Å; A370-A373 PolarHBondContact O-N 3.26Å; I371-A373 PolarHBondContact O-N 3.45Å; A373-R376 PolarHBondContact O-N 2.99Å; A373-C377 PolarHBondContact O-N 3.21Å
374	L	95.3	Very high	92.2	Very high	0 Å²	0	40.6 Å²	40.6	0%	0	19%	0.189	C	C	.	.	H	α-helix	trans	-67.6	-39.3	179.1	-67.5	171.4	0	0	0	111.8	A370 I371 C377 I378 A387 A390 L391	A370-L374 WeakPolarHBondContact O-CB 3.41Å; A370-L374 WeakPolarHBondContact O-CG 3.45Å; A370-L374 PolarHBondContact O-N 2.88Å; I371-L374 PolarHBondContact O-N 3.21Å; L374-C377 WeakPolarHBondContact O-CB 3.29Å; L374-C377 PolarHBondContact O-N 3.21Å; L374-I378 WeakPolarHBondContact O-CD1 3.33Å; L374-I378 WeakPolarHBondContact O-CG1 3.27Å; L374-I378 PolarHBondContact O-N 3.14Å; L374-A387 HydrophobicContact CD2-CB 4.16Å; L374-A390 HydrophobicContact CD1-CB 3.74Å; L374-A390 HydrophobicContact CD2-CB 4.03Å; L374-L391 HydrophobicContact CB-CB 4.16Å; L374-L391 HydrophobicContact CB-CD1 4.22Å; L374-L391 HydrophobicContact CD1-CB 4.2Å
375	R	92.5	Very high	92.3	Very high	65 Å²	65	42.2 Å²	42.2	25%	0.245	20%	0.197	C	C	.	.	H	α-helix	trans	-61.5	-45.3	172.8	-72.5	177.2	76.8	-158.6	14.7	111.5	Y302 D303 I371 C377 I378 E379 L391	Y302-R375 PolarHBondContact O-NH1 3.1Å; D303-R375 IonicContact OD1-CZ 3.74Å; D303-R375 IonicContact OD1-NH1 2.77Å; D303-R375 PolarHBondContact OD1-NH1 3.25Å; D303-R375 IonicContact OD1-NH2 3.95Å; D303-R375 PolarHBondContact OD1-NH2 3.1Å; I371-R375 HydrophobicContact CG2-CG 4.34Å; I371-R375 WeakPolarHBondContact O-CB 3.37Å; I371-R375 VanDerWaalsContact O-CG 3.24Å; I371-R375 WeakPolarHBondContact O-CG 3.41Å; I371-R375 PolarHBondContact O-N 2.9Å; R375-C377 VanDerWaalsContact C-N 3.32Å; R375-C377 PolarHBondContact O-N 3.15Å; R375-I378 PolarHBondContact O-N 3.18Å; R375-E379 WeakPolarHBondContact O-CG 3.28Å; R375-E379 PolarHBondContact O-N 2.79Å; R375-L391 HydrophobicContact CG-CD1 4.22Å; R375-L391 HydrophobicContact CG-CD2 4Å
376	R	92.6	Very high	92.4	Very high	96 Å²	96	45.8 Å²	45.8	36%	0.362	22%	0.219	S	C	.	.	H	α-helix	trans	-60	-38.9	173.6	-68.7	-63.7	-62.7	164.7	-3.6	112.6	W354 S372 A373 I378 E379 L380	W354-R376 HydrophobicContact CD2-CB 3.94Å; W354-R376 HydrophobicContact CE3-CB 4.01Å; W354-R376 HydrophobicContact CG-CB 4.4Å; W354-R376 HydrophobicContact CZ3-CB 4.34Å; W354-R376 HydrophobicContact CZ3-CG 4.49Å; S372-R376 WeakPolarHBondContact O-CG 3.13Å; S372-R376 PolarHBondContact O-N 3.09Å; S372-R376 VanDerWaalsContact O-N 3.15Å; A373-R376 PolarHBondContact O-N 2.99Å; R376-I378 PolarHBondContact O-N 2.67Å; R376-E379 WeakPolarHBondContact CD-OE2 3.3Å; R376-E379 IonicContact CZ-OE2 3.28Å; R376-E379 IonicContact NE-OE2 3.99Å; R376-E379 IonicContact NH1-OE2 2.92Å; R376-E379 PolarHBondContact NH1-OE2 2.81Å; R376-E379 PolarHBondContact O-N 2.88Å; R376-L380 WeakPolarHBondContact O-CG 3.44Å; R376-L380 PolarHBondContact O-N 2.9Å
377	C	95.1	Very high	92.7	Very high	0 Å²	0	43.5 Å²	43.5	0%	0	21%	0.209	C	C	.	.	H	α-helix	trans	-60.2	-42.4	171.5	171.8	0	0	0	0	112.8	Q351 W354 A373 L374 R375 L380 K381 N384 A387	Q351-C377 PolarHBondContact NE2-SG 3.47Å; Q351-C377 VanDerWaalsContact NE2-SG 3.37Å; W354-C377 HydrophobicContact CB-CB 3.82Å; A373-C377 PolarHBondContact O-N 3.21Å; L374-C377 WeakPolarHBondContact O-CB 3.29Å; L374-C377 PolarHBondContact O-N 3.21Å; R375-C377 VanDerWaalsContact C-N 3.32Å; R375-C377 PolarHBondContact O-N 3.15Å; C377-L380 PolarHBondContact O-N 3.41Å; C377-K381 PolarHBondContact O-N 3.09Å; C377-N384 PolarHBondContact SG-ND2 3.27Å; C377-A387 HydrophobicContact CB-CB 4.3Å; C377-A387 VanDerWaalsContact SG-CB 3.55Å
378	I	92.8	Very high	93.1	Very high	30 Å²	30	43.5 Å²	43.5	15%	0.154	21%	0.209	C	C	.	.	H	α-helix	trans	-73.8	-33.7	-178.8	-69.7	157.7	0	0	0	111.8	L374 R375 R376 K381 K382 A387 L388 L391	L374-I378 WeakPolarHBondContact O-CD1 3.33Å; L374-I378 WeakPolarHBondContact O-CG1 3.27Å; L374-I378 PolarHBondContact O-N 3.14Å; R375-I378 PolarHBondContact O-N 3.18Å; R376-I378 PolarHBondContact O-N 2.67Å; I378-K381 CarbonylContact O-C 3.58Å; I378-K381 PolarHBondContact O-N 3.35Å; I378-K382 WeakPolarHBondContact O-CA 3.47Å; I378-K382 WeakPolarHBondContact O-CG 3.48Å; I378-K382 PolarHBondContact O-N 3.22Å; I378-A387 HydrophobicContact CD1-CB 4.35Å; I378-A387 HydrophobicContact CG1-CB 4.06Å; I378-L388 HydrophobicContact CD1-CD2 3.8Å; I378-L388 HydrophobicContact CD1-CG 4.27Å; I378-L388 HydrophobicContact CG1-CD2 4.18Å; I378-L388 HydrophobicContact CG1-CG 4.38Å; I378-L388 HydrophobicContact CG2-CD2 4.4Å; I378-L391 HydrophobicContact CD1-CB 4.21Å; I378-L391 HydrophobicContact CD1-CD2 3.44Å; I378-L391 VanDerWaalsContact CD1-CD2 3.44Å; I378-L391 HydrophobicContact CD1-CG 4.46Å
379	E	91.9	Very high	93.6	Very high	105 Å²	105	40.7 Å²	40.7	49%	0.491	20%	0.197	S	C	.	.	H	α-helix	trans	-61.2	-42.4	171.6	-75.3	168.7	-156.3	0	0	112	R375 R376	R375-E379 WeakPolarHBondContact O-CG 3.28Å; R375-E379 PolarHBondContact O-N 2.79Å; R376-E379 WeakPolarHBondContact CD-OE2 3.3Å; R376-E379 IonicContact CZ-OE2 3.28Å; R376-E379 IonicContact NE-OE2 3.99Å; R376-E379 IonicContact NH1-OE2 2.92Å; R376-E379 PolarHBondContact NH1-OE2 2.81Å; R376-E379 PolarHBondContact O-N 2.88Å
380	L	92.4	Very high	93.9	Very high	62 Å²	62	40.5 Å²	40.5	33%	0.325	20%	0.196	S	C	.	.	H	α-helix	trans	-68	-41.6	173.6	-68.3	171.9	0	0	0	112	Q351 W354 R376 C377	Q351-L380 HydrophobicContact CB-CB 4.15Å; Q351-L380 HydrophobicContact CB-CD1 4.13Å; Q351-L380 HydrophobicContact CG-CB 3.92Å; W354-L380 HydrophobicContact CG-CD1 4.49Å; R376-L380 WeakPolarHBondContact O-CG 3.44Å; R376-L380 PolarHBondContact O-N 2.9Å; C377-L380 PolarHBondContact O-N 3.41Å
381	K	92.9	Very high	94	Very high	86 Å²	86	41 Å²	41	37%	0.374	20%	0.198	S	C	.	.			trans	-150.2	105	-178	-174.1	-178.7	175.6	-174.2	0	112.4	Q351 C377 I378 D383 N384	Q351-K381 VanDerWaalsContact CD-CB 3.45Å; Q351-K381 HydrophobicContact CG-CB 3.63Å; Q351-K381 VanDerWaalsContact OE1-CD 3.27Å; C377-K381 PolarHBondContact O-N 3.09Å; I378-K381 CarbonylContact O-C 3.58Å; I378-K381 PolarHBondContact O-N 3.35Å; K381-D383 VanDerWaalsContact C-N 3.34Å; K381-D383 WeakPolarHBondContact CE-OD1 3.46Å; K381-D383 WeakPolarHBondContact CE-OD2 3.48Å; K381-D383 WeakPolarHBondContact CG-OD1 3.31Å; K381-D383 IonicContact NZ-OD2 2.81Å; K381-D383 PolarHBondContact NZ-OD2 3.27Å; K381-D383 VanDerWaalsContact NZ-OD2 3.15Å; K381-D383 PolarHBondContact O-N 3.13Å; K381-N384 PolarHBondContact O-N 3.43Å
382	K	91.4	Very high	94.2	Very high	140 Å²	140	41 Å²	41	61%	0.609	20%	0.198	S	C	*	.	T	Hydrogen-bonded Turn	trans	-67.7	-26.8	-174.7	-63	-175.7	179	-171.1	0	114.7	I378 N384 L388 H414	I378-K382 WeakPolarHBondContact O-CA 3.47Å; I378-K382 WeakPolarHBondContact O-CG 3.48Å; I378-K382 PolarHBondContact O-N 3.22Å; K382-N384 VanDerWaalsContact C-N 3.29Å; K382-N384 PolarHBondContact O-N 3.23Å; K382-L388 WeakPolarHBondContact O-CD1 3.33Å; K382-H414 PolarHBondContact O-CD2 3.25Å
383	D	92.1	Very high	94.4	Very high	77 Å²	77	41.5 Å²	41.5	41%	0.412	20%	0.201	S	C	.	.	T	Hydrogen-bonded Turn	trans	-86	15	-179.9	62.5	-60	0	0	0	114.2	K381 L385 H414	K381-D383 VanDerWaalsContact C-N 3.34Å; K381-D383 WeakPolarHBondContact CE-OD1 3.46Å; K381-D383 WeakPolarHBondContact CE-OD2 3.48Å; K381-D383 WeakPolarHBondContact CG-OD1 3.31Å; K381-D383 IonicContact NZ-OD2 2.81Å; K381-D383 PolarHBondContact NZ-OD2 3.27Å; K381-D383 VanDerWaalsContact NZ-OD2 3.15Å; K381-D383 PolarHBondContact O-N 3.13Å; D383-L385 PolarHBondContact O-N 2.97Å; D383-H414 HydrophobicContact CB-CB 4.22Å
384	N	95.2	Very high	94.4	Very high	13 Å²	13	41.6 Å²	41.6	7%	0.07	20%	0.201	C	C	.	.			trans	-75.3	91.6	174.1	-168.8	-20.1	0	0	0	112	Q351 Q355 C377 K381 K382 T386 A387 L388	Q351-N384 PolarHBondContact NE2-ND2 3.31Å; Q355-N384 PolarHBondContact OE1-ND2 3.31Å; Q355-N384 PolarHBondContact OE1-OD1 3.15Å; C377-N384 PolarHBondContact SG-ND2 3.27Å; K381-N384 PolarHBondContact O-N 3.43Å; K382-N384 VanDerWaalsContact C-N 3.29Å; K382-N384 PolarHBondContact O-N 3.23Å; N384-T386 VanDerWaalsContact C-N 3.26Å; N384-T386 PolarHBondContact O-N 3.45Å; N384-T386 WeakPolarHBondContact OD1-CB 3.18Å; N384-T386 PolarHBondContact OD1-N 3.44Å; N384-A387 HydrophobicContact CB-CB 3.93Å; N384-A387 PolarHBondContact O-N 2.91Å; N384-A387 PolarHBondContact OD1-N 3.48Å; N384-A387 VanDerWaalsContact OD1-N 3.08Å; N384-L388 WeakPolarHBondContact O-CB 3.39Å; N384-L388 WeakPolarHBondContact O-CG 3.31Å; N384-L388 PolarHBondContact O-N 3.4Å
385	L	95.7	Very high	94.2	Very high	45 Å²	45	42 Å²	42	24%	0.236	20%	0.203	C	C	.	.	H	α-helix	trans	-56.2	-34	176.9	-58.9	-177	0	0	0	113.9	D383 M389 W411 H414 N415	D383-L385 PolarHBondContact O-N 2.97Å; L385-M389 WeakPolarHBondContact O-CB 3.4Å; L385-M389 PolarHBondContact O-N 3.22Å; L385-M389 VanDerWaalsContact O-N 3.08Å; L385-W411 HydrophobicContact CD2-CG 4.33Å; L385-W411 WeakPolarHBondContact CD2-O 3.44Å; L385-W411 PolarHBondContact O-NE1 2.93Å; L385-H414 HydrophobicContact CD2-CB 4.07Å; L385-N415 HydrophobicContact CD1-CB 4.08Å; L385-N415 HydrophobicContact CD2-CB 4.01Å
386	T	95.6	Very high	94.1	Very high	78 Å²	78	40 Å²	40	48%	0.479	20%	0.198	S	C	.	.	H	α-helix	trans	-71.4	-45.8	178.3	-53	0	0	0	0	110.6	N384 M389 A390	N384-T386 VanDerWaalsContact C-N 3.26Å; N384-T386 PolarHBondContact O-N 3.45Å; N384-T386 WeakPolarHBondContact OD1-CB 3.18Å; N384-T386 PolarHBondContact OD1-N 3.44Å; T386-M389 PolarHBondContact O-N 3.4Å; T386-A390 WeakPolarHBondContact O-CB 3.34Å; T386-A390 PolarHBondContact O-N 3.25Å
387	A	96.4	Very high	94	Very high	0 Å²	0	39.4 Å²	39.4	0%	0	20%	0.202	C	C	.	.	H	α-helix	trans	-65.9	-40.8	177.7	0	0	0	0	0	112.2	Q355 L374 C377 I378 N384 A390 L391	Q355-A387 HydrophobicContact CG-CB 4.38Å; L374-A387 HydrophobicContact CD2-CB 4.16Å; C377-A387 HydrophobicContact CB-CB 4.3Å; C377-A387 VanDerWaalsContact SG-CB 3.55Å; I378-A387 HydrophobicContact CD1-CB 4.35Å; I378-A387 HydrophobicContact CG1-CB 4.06Å; N384-A387 HydrophobicContact CB-CB 3.93Å; N384-A387 PolarHBondContact O-N 2.91Å; N384-A387 PolarHBondContact OD1-N 3.48Å; N384-A387 VanDerWaalsContact OD1-N 3.08Å; A387-A390 PolarHBondContact O-N 3.28Å; A387-L391 VanDerWaalsContact O-CB 3.23Å; A387-L391 WeakPolarHBondContact O-CB 3.24Å; A387-L391 PolarHBondContact O-N 3.46Å
388	L	96.7	Very high	93.6	Very high	5 Å²	5	42 Å²	42	3%	0.026	21%	0.214	C	C	.	.	H	α-helix	trans	-61.5	-45.7	175.1	-74.5	169.8	0	0	0	111.9	I378 K382 N384 L391 A392 T407 D410 W411	I378-L388 HydrophobicContact CD1-CD2 3.8Å; I378-L388 HydrophobicContact CD1-CG 4.27Å; I378-L388 HydrophobicContact CG1-CD2 4.18Å; I378-L388 HydrophobicContact CG1-CG 4.38Å; I378-L388 HydrophobicContact CG2-CD2 4.4Å; K382-L388 WeakPolarHBondContact O-CD1 3.33Å; N384-L388 WeakPolarHBondContact O-CB 3.39Å; N384-L388 WeakPolarHBondContact O-CG 3.31Å; N384-L388 PolarHBondContact O-N 3.4Å; L388-L391 PolarHBondContact O-N 2.83Å; L388-A392 WeakPolarHBondContact O-CB 3.22Å; L388-A392 PolarHBondContact O-N 3.44Å; L388-T407 HydrophobicContact CB-CG2 4.28Å; L388-T407 HydrophobicContact CD2-CG2 3.79Å; L388-T407 WeakPolarHBondContact O-CG2 3.48Å; L388-D410 HydrophobicContact CD2-CB 4.49Å; L388-W411 HydrophobicContact CB-CB 4.2Å; L388-W411 HydrophobicContact CB-CG 4.48Å; L388-W411 HydrophobicContact CD1-CB 4.44Å
389	M	97.1	Very high	93.3	Very high	20 Å²	20	44.6 Å²	44.6	10%	0.099	24%	0.235	C	C	.	.	H	α-helix	trans	-66.2	-40.7	178	-174	59.8	62.2	0	0	112	L385 T386 V393 L408 W411 Q474 C477	L385-M389 WeakPolarHBondContact O-CB 3.4Å; L385-M389 PolarHBondContact O-N 3.22Å; L385-M389 VanDerWaalsContact O-N 3.08Å; T386-M389 PolarHBondContact O-N 3.4Å; M389-V393 VanDerWaalsContact O-CG2 3.29Å; M389-V393 WeakPolarHBondContact O-CG2 3.47Å; M389-V393 PolarHBondContact O-N 2.93Å; M389-L408 HydrophobicContact CE-CD2 4.13Å; M389-L408 HydrophobicContact SD-CD2 4.12Å; M389-W411 HydrophobicContact CE-CD2 3.84Å; M389-W411 HydrophobicContact CE-CE3 4.36Å; M389-W411 HydrophobicContact CE-CG 4.11Å; M389-W411 HydrophobicContact CE-CZ2 4.1Å; M389-Q474 WeakPolarHBondContact CE-O 3.28Å; M389-C477 HydrophobicContact SD-CB 4.45Å
390	A	96.8	Very high	93	Very high	20 Å²	20	41.5 Å²	41.5	17%	0.165	22%	0.222	C	C	.	.	H	α-helix	trans	-63.9	-41.6	174.9	0	0	0	0	0	112	T359 L374 T386 A387 V393 S394	T359-A390 HydrophobicContact CG2-CB 4.05Å; L374-A390 HydrophobicContact CD1-CB 3.74Å; L374-A390 HydrophobicContact CD2-CB 4.03Å; T386-A390 WeakPolarHBondContact O-CB 3.34Å; T386-A390 PolarHBondContact O-N 3.25Å; A387-A390 PolarHBondContact O-N 3.28Å; A390-V393 WeakPolarHBondContact O-CB 3.29Å; A390-V393 PolarHBondContact O-N 2.82Å; A390-S394 PolarHBondContact O-N 3.01Å; A390-S394 PolarHBondContact O-OG 3.14Å
391	L	95.1	Very high	92.6	Very high	9 Å²	9	41.4 Å²	41.4	5%	0.047	22%	0.22	C	C	.	.	H	α-helix	trans	-67.9	-40.6	179.8	-179.6	62.3	0	0	0	111.6	I371 L374 R375 I378 A387 L388 V393 S394 F395 T407	I371-L391 HydrophobicContact CB-CD1 4.31Å; I371-L391 HydrophobicContact CG1-CD1 4.23Å; I371-L391 HydrophobicContact CG2-CD1 3.98Å; L374-L391 HydrophobicContact CB-CB 4.16Å; L374-L391 HydrophobicContact CB-CD1 4.22Å; L374-L391 HydrophobicContact CD1-CB 4.2Å; R375-L391 HydrophobicContact CG-CD1 4.22Å; R375-L391 HydrophobicContact CG-CD2 4Å; I378-L391 HydrophobicContact CD1-CB 4.21Å; I378-L391 HydrophobicContact CD1-CD2 3.44Å; I378-L391 VanDerWaalsContact CD1-CD2 3.44Å; I378-L391 HydrophobicContact CD1-CG 4.46Å; A387-L391 VanDerWaalsContact O-CB 3.23Å; A387-L391 WeakPolarHBondContact O-CB 3.24Å; A387-L391 PolarHBondContact O-N 3.46Å; L388-L391 PolarHBondContact O-N 2.83Å; L391-V393 VanDerWaalsContact C-N 3.29Å; L391-V393 PolarHBondContact O-N 2.62Å; L391-S394 PolarHBondContact O-N 3.39Å; L391-F395 HydrophobicContact CD1-CD1 4.41Å; L391-F395 HydrophobicContact CD1-CD2 4.06Å; L391-F395 HydrophobicContact CD1-CE1 4.05Å; L391-F395 HydrophobicContact CD1-CE2 3.66Å; L391-F395 HydrophobicContact CD1-CG 4.43Å; L391-F395 HydrophobicContact CD1-CZ 3.66Å; L391-F395 HydrophobicContact CD2-CD2 4.46Å; L391-F395 HydrophobicContact CD2-CE2 3.67Å; L391-F395 HydrophobicContact CD2-CZ 4.09Å; L391-F395 HydrophobicContact CG-CD2 3.78Å; L391-F395 HydrophobicContact CG-CE2 3.43Å; L391-F395 VanDerWaalsContact CG-CE2 3.43Å; L391-F395 HydrophobicContact CG-CZ 3.95Å; L391-F395 WeakPolarHBondContact O-CD2 3.49Å; L391-F395 WeakPolarHBondContact O-CG 3.29Å; L391-F395 PolarHBondContact O-N 3.4Å; L391-T407 HydrophobicContact CB-CG2 4.16Å; L391-T407 HydrophobicContact CD2-CG2 4.2Å; L391-T407 HydrophobicContact CG-CG2 4.24Å
392	A	95.4	Very high	92.1	Very high	0 Å²	0	40.8 Å²	40.8	0%	0	22%	0.215	C	C	.	.	H	α-helix	trans	-60.1	-38.4	174.3	0	0	0	0	0	112.8	L388 T396 T407 L408	L388-A392 WeakPolarHBondContact O-CB 3.22Å; L388-A392 PolarHBondContact O-N 3.44Å; A392-T396 WeakPolarHBondContact O-CB 3.22Å; A392-T396 PolarHBondContact O-N 3.09Å; A392-T396 PolarHBondContact O-OG1 3.21Å; A392-T407 HydrophobicContact CB-CG2 4.09Å; A392-L408 HydrophobicContact CB-CD1 4.36Å; A392-L408 HydrophobicContact CB-CD2 3.58Å; A392-L408 HydrophobicContact CB-CG 3.61Å
393	V	95.6	Very high	91.9	Very high	21 Å²	21	36.5 Å²	36.5	13%	0.127	20%	0.197	C	C	.	.	H	α-helix	trans	-65.7	-46.7	172.9	171.1	0	0	0	0	110.6	M389 A390 L391 F395 T396 N397 V481 K512	M389-V393 VanDerWaalsContact O-CG2 3.29Å; M389-V393 WeakPolarHBondContact O-CG2 3.47Å; M389-V393 PolarHBondContact O-N 2.93Å; A390-V393 WeakPolarHBondContact O-CB 3.29Å; A390-V393 PolarHBondContact O-N 2.82Å; L391-V393 VanDerWaalsContact C-N 3.29Å; L391-V393 PolarHBondContact O-N 2.62Å; V393-F395 VanDerWaalsContact C-N 3.35Å; V393-F395 PolarHBondContact O-N 3.2Å; V393-T396 WeakPolarHBondContact O-CA 3.36Å; V393-T396 WeakPolarHBondContact O-CB 3.44Å; V393-T396 PolarHBondContact O-N 3.41Å; V393-N397 PolarHBondContact O-N 3.48Å; V393-N397 PolarHBondContact O-OD1 3.07Å; V393-V481 HydrophobicContact CG2-CG2 3.75Å; V393-K512 VanDerWaalsContact CG2-NZ 3.28Å
394	S	93.9	Very high	91.8	Very high	1 Å²	1	32.8 Å²	32.8	1%	0.007	18%	0.177	C	C	.	.	H	α-helix	trans	-60.6	-44.5	-179.7	-47.4	0	0	0	0	111.2	E367 A390 L391 T396 N397 E398	E367-S394 VanDerWaalsContact OE1-CB 3.27Å; E367-S394 WeakPolarHBondContact OE1-CB 3.26Å; E367-S394 PolarHBondContact OE1-OG 2.86Å; A390-S394 PolarHBondContact O-N 3.01Å; A390-S394 PolarHBondContact O-OG 3.14Å; L391-S394 PolarHBondContact O-N 3.39Å; S394-T396 VanDerWaalsContact C-N 3.29Å; S394-T396 PolarHBondContact O-N 2.81Å; S394-N397 PolarHBondContact O-N 3.33Å; S394-E398 PolarHBondContact O-N 2.82Å; S394-E398 VanDerWaalsContact O-N 3.13Å
395	F	91.7	Very high	91.6	Very high	9 Å²	9	32.2 Å²	32.2	4%	0.039	17%	0.174	C	C	.	.	H	α-helix	trans	-64.1	-30.6	172.8	-72	-36.7	0	0	0	113.5	Y302 I371 L391 V393 S399 L400 Q403 A404 T407	Y302-F395 HydrophobicContact CE2-CE1 4.45Å; I371-F395 HydrophobicContact CD1-CD1 4.17Å; I371-F395 HydrophobicContact CD1-CE1 4.41Å; I371-F395 HydrophobicContact CG1-CD1 4.48Å; I371-F395 HydrophobicContact CG2-CD1 4.49Å; I371-F395 HydrophobicContact CG2-CE1 3.75Å; I371-F395 HydrophobicContact CG2-CZ 4.32Å; L391-F395 HydrophobicContact CD1-CD1 4.41Å; L391-F395 HydrophobicContact CD1-CD2 4.06Å; L391-F395 HydrophobicContact CD1-CE1 4.05Å; L391-F395 HydrophobicContact CD1-CE2 3.66Å; L391-F395 HydrophobicContact CD1-CG 4.43Å; L391-F395 HydrophobicContact CD1-CZ 3.66Å; L391-F395 HydrophobicContact CD2-CD2 4.46Å; L391-F395 HydrophobicContact CD2-CE2 3.67Å; L391-F395 HydrophobicContact CD2-CZ 4.09Å; L391-F395 HydrophobicContact CG-CD2 3.78Å; L391-F395 HydrophobicContact CG-CE2 3.43Å; L391-F395 VanDerWaalsContact CG-CE2 3.43Å; L391-F395 HydrophobicContact CG-CZ 3.95Å; L391-F395 WeakPolarHBondContact O-CD2 3.49Å; L391-F395 WeakPolarHBondContact O-CG 3.29Å; L391-F395 PolarHBondContact O-N 3.4Å; V393-F395 VanDerWaalsContact C-N 3.35Å; V393-F395 PolarHBondContact O-N 3.2Å; F395-S399 PolarHBondContact O-N 3.43Å; F395-L400 HydrophobicContact CB-CB 4.09Å; F395-L400 HydrophobicContact CD1-CB 4.1Å; F395-L400 HydrophobicContact CD1-CD1 3.7Å; F395-L400 HydrophobicContact CE1-CD1 4.17Å; F395-L400 HydrophobicContact CG-CB 4.39Å; F395-L400 WeakPolarHBondContact O-CA 3.18Å; F395-L400 WeakPolarHBondContact O-CB 3.4Å; F395-L400 PolarHBondContact O-N 2.91Å; F395-Q403 HydrophobicContact CB-CB 4.45Å; F395-Q403 HydrophobicContact CD1-CB 4.11Å; F395-Q403 HydrophobicContact CD2-CB 3.6Å; F395-Q403 HydrophobicContact CE1-CB 4.16Å; F395-Q403 HydrophobicContact CE2-CB 3.66Å; F395-Q403 HydrophobicContact CG-CB 3.83Å; F395-Q403 HydrophobicContact CZ-CB 3.95Å; F395-Q403 HydrophobicContact CZ-CG 4.46Å; F395-A404 HydrophobicContact CB-CB 3.85Å; F395-T407 WeakPolarHBondContact CE2-OG1 3.48Å
396	T	90.8	Very high	91.3	Very high	23 Å²	23	32.4 Å²	32.4	14%	0.141	17%	0.174	C	C	.	.	H	α-helix	trans	-70.1	-39.4	175.2	-60.2	0	0	0	0	111.3	A392 V393 S394 S399 V481 L485	A392-T396 WeakPolarHBondContact O-CB 3.22Å; A392-T396 PolarHBondContact O-N 3.09Å; A392-T396 PolarHBondContact O-OG1 3.21Å; V393-T396 WeakPolarHBondContact O-CA 3.36Å; V393-T396 WeakPolarHBondContact O-CB 3.44Å; V393-T396 PolarHBondContact O-N 3.41Å; S394-T396 VanDerWaalsContact C-N 3.29Å; S394-T396 PolarHBondContact O-N 2.81Å; T396-S399 PolarHBondContact O-N 3.26Å; T396-V481 HydrophobicContact CG2-CG1 4.25Å; T396-V481 WeakPolarHBondContact OG1-CG1 3.3Å; T396-L485 HydrophobicContact CG2-CD2 3.74Å; T396-L485 HydrophobicContact CG2-CG 3.91Å
397	N	89.7	Confident	91.2	Very high	83 Å²	83	29.4 Å²	29.4	44%	0.444	16%	0.155	S	C	.	.	H	α-helix	trans	-64.3	-43	176.8	-63.1	-14	0	0	0	111.5	E367 V393 S394 S399	E367-N397 WeakPolarHBondContact OE2-CB 3.42Å; E367-N397 PolarHBondContact OE2-ND2 3.18Å; V393-N397 PolarHBondContact O-N 3.48Å; V393-N397 PolarHBondContact O-OD1 3.07Å; S394-N397 PolarHBondContact O-N 3.33Å; N397-S399 PolarHBondContact O-N 3.39Å
398	E	87.4	Confident	91.1	Very high	55 Å²	55	29.4 Å²	29.4	26%	0.257	16%	0.155	S	C	.	.	T	Hydrogen-bonded Turn	trans	-78	10.3	175.9	-64	-56.8	136.6	0	0	114	E367 F368 I371 S394 L400	E367-E398 HydrophobicContact CB-CG 4.46Å; E367-E398 WeakPolarHBondContact CB-OE1 3.38Å; E367-E398 HydrophobicContact CG-CG 3.78Å; E367-E398 WeakPolarHBondContact CG-OE1 3.36Å; F368-E398 HydrophobicContact CE1-CG 4.38Å; F368-E398 VanDerWaalsContact CZ-OE2 3.27Å; F368-E398 WeakPolarHBondContact CZ-OE2 3.38Å; I371-E398 HydrophobicContact CD1-CG 3.91Å; S394-E398 PolarHBondContact O-N 2.82Å; S394-E398 VanDerWaalsContact O-N 3.13Å; E398-L400 HydrophobicContact CB-CD1 3.9Å; E398-L400 HydrophobicContact CB-CG 4.04Å; E398-L400 PolarHBondContact O-N 3.37Å; E398-L400 VanDerWaalsContact O-N 3.09Å
399	S	85.6	Confident	91	Very high	85 Å²	85	31.3 Å²	31.3	59%	0.594	16%	0.162	S	C	*	.	T	Hydrogen-bonded Turn	trans	57.2	21.8	-177.9	-52.6	0	0	0	0	115.1	F395 T396 N397 H401	F395-S399 PolarHBondContact O-N 3.43Å; T396-S399 PolarHBondContact O-N 3.26Å; N397-S399 PolarHBondContact O-N 3.39Å; S399-H401 PolarHBondContact O-CD2 3.42Å; S399-H401 PolarHBondContact O-N 3.03Å
400	L	84.6	Confident	90.8	Very high	39 Å²	39	32.6 Å²	32.6	20%	0.204	17%	0.17	C	C	.	.			trans	-83	62.1	177.1	-64.3	170.1	0	0	0	110.6	Y302 F395 E398 R402 Q403 A404	Y302-L400 HydrophobicContact CD1-CD1 3.82Å; Y302-L400 HydrophobicContact CE1-CD1 3.42Å; Y302-L400 VanDerWaalsContact CE1-CD1 3.42Å; Y302-L400 HydrophobicContact CE1-CD2 4.24Å; Y302-L400 HydrophobicContact CE1-CG 4.5Å; F395-L400 HydrophobicContact CB-CB 4.09Å; F395-L400 HydrophobicContact CD1-CB 4.1Å; F395-L400 HydrophobicContact CD1-CD1 3.7Å; F395-L400 HydrophobicContact CE1-CD1 4.17Å; F395-L400 HydrophobicContact CG-CB 4.39Å; F395-L400 WeakPolarHBondContact O-CA 3.18Å; F395-L400 WeakPolarHBondContact O-CB 3.4Å; F395-L400 PolarHBondContact O-N 2.91Å; E398-L400 HydrophobicContact CB-CD1 3.9Å; E398-L400 HydrophobicContact CB-CG 4.04Å; E398-L400 PolarHBondContact O-N 3.37Å; E398-L400 VanDerWaalsContact O-N 3.09Å; L400-R402 VanDerWaalsContact C-N 3.32Å; L400-R402 PolarHBondContact O-N 3.16Å; L400-Q403 HydrophobicContact CB-CB 4.36Å; L400-Q403 PolarHBondContact O-N 2.89Å; L400-Q403 PolarHBondContact O-OE1 3.48Å; L400-A404 PolarHBondContact O-N 2.73Å
401	H	84.3	Confident	90.8	Very high	61 Å²	61	31.9 Å²	31.9	28%	0.282	16%	0.163	S	C	.	.	H	α-helix	trans	-59.3	-37.6	-166.2	-62.2	-173.7	0	0	0	113.8	S399 A404 C405 L448 L485	S399-H401 PolarHBondContact O-CD2 3.42Å; S399-H401 PolarHBondContact O-N 3.03Å; H401-A404 PolarHBondContact O-N 2.82Å; H401-C405 PolarHBondContact O-N 3.21Å; H401-C405 PolarHBondContact O-SG 2.95Å; H401-L448 HydrophobicContact CB-CD1 3.7Å; H401-L448 HydrophobicContact CB-CD2 3.74Å; H401-L448 HydrophobicContact CB-CG 3.72Å; H401-L448 WeakPolarHBondContact ND1-CD1 3.12Å; H401-L485 HydrophobicContact CB-CD2 4.08Å; H401-L485 WeakPolarHBondContact CD2-CD2 3.4Å
402	R	83.2	Confident	90.7	Very high	73 Å²	73	31.6 Å²	31.6	28%	0.275	16%	0.161	S	C	.	.	H	α-helix	trans	-64.1	-50.6	179	176.6	176.9	174.4	156.1	4.7	110.7	L400 A404 C405 E406 E442 L452	L400-R402 VanDerWaalsContact C-N 3.32Å; L400-R402 PolarHBondContact O-N 3.16Å; R402-A404 VanDerWaalsContact C-N 3.31Å; R402-A404 PolarHBondContact O-N 2.75Å; R402-C405 PolarHBondContact O-N 3.11Å; R402-E406 HydrophobicContact CG-CG 4.49Å; R402-E406 IonicContact CZ-OE1 3.17Å; R402-E406 IonicContact NE-OE1 3.25Å; R402-E406 PolarHBondContact NE-OE1 3.33Å; R402-E406 IonicContact NH2-OE1 2.7Å; R402-E406 PolarHBondContact NH2-OE1 3.42Å; R402-E406 VanDerWaalsContact NH2-OE1 3.11Å; R402-E406 WeakPolarHBondContact O-CG 3.45Å; R402-E406 PolarHBondContact O-N 3.07Å; R402-E442 IonicContact NH2-OE1 2.8Å; R402-E442 PolarHBondContact NH2-OE1 3.28Å; R402-L452 HydrophobicContact CG-CD2 4.24Å
403	Q	87.8	Confident	90.6	Very high	49 Å²	49	35.2 Å²	35.2	23%	0.229	18%	0.177	C	C	.	.	H	α-helix	trans	-62.4	-38.5	179.6	-63.4	86	-32.6	0	0	111.1	Y302 F395 L400 T407	Y302-Q403 PolarHBondContact OH-NE2 2.7Å; Y302-Q403 VanDerWaalsContact OH-NE2 3.09Å; F395-Q403 HydrophobicContact CB-CB 4.45Å; F395-Q403 HydrophobicContact CD1-CB 4.11Å; F395-Q403 HydrophobicContact CD2-CB 3.6Å; F395-Q403 HydrophobicContact CE1-CB 4.16Å; F395-Q403 HydrophobicContact CE2-CB 3.66Å; F395-Q403 HydrophobicContact CG-CB 3.83Å; F395-Q403 HydrophobicContact CZ-CB 3.95Å; F395-Q403 HydrophobicContact CZ-CG 4.46Å; L400-Q403 HydrophobicContact CB-CB 4.36Å; L400-Q403 PolarHBondContact O-N 2.89Å; L400-Q403 PolarHBondContact O-OE1 3.48Å; Q403-T407 VanDerWaalsContact O-CB 3.31Å; Q403-T407 WeakPolarHBondContact O-CB 3.46Å; Q403-T407 PolarHBondContact O-N 3.31Å; Q403-T407 PolarHBondContact O-OG1 2.92Å
404	A	89.9	Confident	90.5	Very high	0 Å²	0	37 Å²	37	0%	0	18%	0.184	C	C	.	.	H	α-helix	trans	-60.3	-48.3	172.6	0	0	0	0	0	111.9	F395 L400 H401 R402 T407 L408 L485	F395-A404 HydrophobicContact CB-CB 3.85Å; L400-A404 PolarHBondContact O-N 2.73Å; H401-A404 PolarHBondContact O-N 2.82Å; R402-A404 VanDerWaalsContact C-N 3.31Å; R402-A404 PolarHBondContact O-N 2.75Å; A404-T407 PolarHBondContact O-N 2.9Å; A404-L408 WeakPolarHBondContact O-CG 3.4Å; A404-L408 PolarHBondContact O-N 3.13Å; A404-L485 HydrophobicContact CB-CD1 3.98Å
405	C	90.9	Very high	90.6	Very high	0 Å²	0	37.4 Å²	37.4	0%	0	19%	0.186	C	C	.	.	H	α-helix	trans	-63	-43.9	178	-66	0	0	0	0	112.6	H401 R402 T407 L408 R409 L452 V456	H401-C405 PolarHBondContact O-N 3.21Å; H401-C405 PolarHBondContact O-SG 2.95Å; R402-C405 PolarHBondContact O-N 3.11Å; C405-T407 VanDerWaalsContact C-N 3.34Å; C405-T407 PolarHBondContact O-N 2.58Å; C405-L408 PolarHBondContact O-N 3.32Å; C405-R409 WeakPolarHBondContact O-CB 3.48Å; C405-R409 PolarHBondContact O-N 3.42Å; C405-L452 HydrophobicContact CB-CD2 4.23Å; C405-L452 HydrophobicContact CB-CG 4.2Å; C405-V456 HydrophobicContact CB-CG2 4.49Å
406	E	89.5	Confident	90.6	Very high	50 Å²	50	42.1 Å²	42.1	23%	0.234	22%	0.217	C	C	.	.	H	α-helix	trans	-61.4	-42.3	176.5	-70.9	173.8	176	0	0	111.5	R402 R409 D410 L452	R402-E406 HydrophobicContact CG-CG 4.49Å; R402-E406 IonicContact CZ-OE1 3.17Å; R402-E406 IonicContact NE-OE1 3.25Å; R402-E406 PolarHBondContact NE-OE1 3.33Å; R402-E406 IonicContact NH2-OE1 2.7Å; R402-E406 PolarHBondContact NH2-OE1 3.42Å; R402-E406 VanDerWaalsContact NH2-OE1 3.11Å; R402-E406 WeakPolarHBondContact O-CG 3.45Å; R402-E406 PolarHBondContact O-N 3.07Å; E406-R409 WeakPolarHBondContact O-CB 3.44Å; E406-R409 PolarHBondContact O-N 2.81Å; E406-D410 PolarHBondContact O-N 3.32Å; E406-L452 HydrophobicContact CG-CD2 4.07Å
407	T	92.9	Very high	90.7	Very high	15 Å²	15	47.4 Å²	47.4	9%	0.092	24%	0.238	C	C	.	.	H	α-helix	trans	-66.8	-40.1	178	-54.5	0	0	0	0	112.1	L388 L391 A392 F395 Q403 A404 C405 D410 W411	L388-T407 HydrophobicContact CB-CG2 4.28Å; L388-T407 HydrophobicContact CD2-CG2 3.79Å; L388-T407 WeakPolarHBondContact O-CG2 3.48Å; L391-T407 HydrophobicContact CB-CG2 4.16Å; L391-T407 HydrophobicContact CD2-CG2 4.2Å; L391-T407 HydrophobicContact CG-CG2 4.24Å; A392-T407 HydrophobicContact CB-CG2 4.09Å; F395-T407 WeakPolarHBondContact CE2-OG1 3.48Å; Q403-T407 VanDerWaalsContact O-CB 3.31Å; Q403-T407 WeakPolarHBondContact O-CB 3.46Å; Q403-T407 PolarHBondContact O-N 3.31Å; Q403-T407 PolarHBondContact O-OG1 2.92Å; A404-T407 PolarHBondContact O-N 2.9Å; C405-T407 VanDerWaalsContact C-N 3.34Å; C405-T407 PolarHBondContact O-N 2.58Å; T407-D410 PolarHBondContact O-N 3.14Å; T407-W411 PolarHBondContact O-N 3.37Å
408	L	95.2	Very high	90.9	Very high	0 Å²	0	44.3 Å²	44.3	0%	0	22%	0.22	C	C	.	.	H	α-helix	trans	-68.8	-35.5	175.5	-72.2	173.2	0	0	0	112.6	M389 A392 A404 C405 W411 L412 V456 F460 V481 L482	M389-L408 HydrophobicContact CE-CD2 4.13Å; M389-L408 HydrophobicContact SD-CD2 4.12Å; A392-L408 HydrophobicContact CB-CD1 4.36Å; A392-L408 HydrophobicContact CB-CD2 3.58Å; A392-L408 HydrophobicContact CB-CG 3.61Å; A404-L408 WeakPolarHBondContact O-CG 3.4Å; A404-L408 PolarHBondContact O-N 3.13Å; C405-L408 PolarHBondContact O-N 3.32Å; L408-W411 WeakPolarHBondContact O-CB 3.29Å; L408-W411 PolarHBondContact O-N 3.46Å; L408-L412 PolarHBondContact O-N 3.33Å; L408-L412 VanDerWaalsContact O-N 3.15Å; L408-V456 HydrophobicContact CB-CG1 4.16Å; L408-F460 HydrophobicContact CB-CE2 3.81Å; L408-F460 HydrophobicContact CB-CZ 3.96Å; L408-F460 HydrophobicContact CD2-CZ 4.03Å; L408-F460 WeakPolarHBondContact O-CE2 3.37Å; L408-V481 HydrophobicContact CD1-CB 4.5Å; L408-V481 HydrophobicContact CD1-CG1 4.03Å; L408-L482 HydrophobicContact CD1-CD1 4.33Å; L408-L482 HydrophobicContact CD1-CD2 3.68Å; L408-L482 HydrophobicContact CD1-CG 3.71Å
409	R	93.4	Very high	91.1	Very high	45 Å²	45	45.1 Å²	45.1	17%	0.17	22%	0.224	C	C	.	.	H	α-helix	trans	-61.1	-47.2	171.1	-175.3	-176.5	62.8	-174	-5.8	111.1	C405 E406 W411 L412 K413 W422 V456	C405-R409 WeakPolarHBondContact O-CB 3.48Å; C405-R409 PolarHBondContact O-N 3.42Å; E406-R409 WeakPolarHBondContact O-CB 3.44Å; E406-R409 PolarHBondContact O-N 2.81Å; R409-W411 VanDerWaalsContact C-N 3.32Å; R409-W411 PolarHBondContact O-N 3.42Å; R409-L412 PolarHBondContact O-N 2.98Å; R409-K413 WeakPolarHBondContact O-CB 3.37Å; R409-K413 PolarHBondContact O-N 3.3Å; R409-W422 HydrophobicContact CG-CH2 4.13Å; R409-W422 HydrophobicContact CG-CZ3 3.84Å; R409-V456 HydrophobicContact CB-CG2 3.94Å; R409-V456 HydrophobicContact CG-CG2 4.44Å
410	D	93	Very high	91.4	Very high	47 Å²	47	44.1 Å²	44.1	25%	0.251	22%	0.217	S	C	.	.	H	α-helix	trans	-66.6	-32.5	176.8	-82.7	-26.1	0	0	0	112.2	L388 E406 T407 K413 H414	L388-D410 HydrophobicContact CD2-CB 4.49Å; E406-D410 PolarHBondContact O-N 3.32Å; T407-D410 PolarHBondContact O-N 3.14Å; D410-K413 PolarHBondContact O-N 3.34Å; D410-K413 WeakPolarHBondContact OD1-CD 3.34Å; D410-K413 IonicContact OD1-NZ 3.15Å; D410-K413 PolarHBondContact OD1-NZ 3.23Å; D410-H414 WeakPolarHBondContact O-CB 3.2Å; D410-H414 PolarHBondContact O-CD2 2.84Å; D410-H414 PolarHBondContact O-N 3.09Å
411	W	96.3	Very high	91.7	Very high	5 Å²	5	42.8 Å²	42.8	2%	0.019	21%	0.21	C	C	.	.	H	α-helix	trans	-58.2	-48	171	-174.4	95	0	0	0	112.4	L385 L388 M389 T407 L408 R409 H414 N415 Y418 F460 Q474 L475	L385-W411 HydrophobicContact CD2-CG 4.33Å; L385-W411 WeakPolarHBondContact CD2-O 3.44Å; L385-W411 PolarHBondContact O-NE1 2.93Å; L388-W411 HydrophobicContact CB-CB 4.2Å; L388-W411 HydrophobicContact CB-CG 4.48Å; L388-W411 HydrophobicContact CD1-CB 4.44Å; M389-W411 HydrophobicContact CE-CD2 3.84Å; M389-W411 HydrophobicContact CE-CE3 4.36Å; M389-W411 HydrophobicContact CE-CG 4.11Å; M389-W411 HydrophobicContact CE-CZ2 4.1Å; T407-W411 PolarHBondContact O-N 3.37Å; L408-W411 WeakPolarHBondContact O-CB 3.29Å; L408-W411 PolarHBondContact O-N 3.46Å; R409-W411 VanDerWaalsContact C-N 3.32Å; R409-W411 PolarHBondContact O-N 3.42Å; W411-H414 PolarHBondContact O-N 3.32Å; W411-N415 WeakPolarHBondContact CH2-ND2 3.44Å; W411-N415 WeakPolarHBondContact CZ2-ND2 3.3Å; W411-N415 WeakPolarHBondContact O-CB 3.42Å; W411-N415 PolarHBondContact O-N 2.93Å; W411-N415 VanDerWaalsContact O-N 3.14Å; W411-Y418 HydrophobicContact CH2-CE2 4.15Å; W411-Y418 HydrophobicContact CZ3-CD2 4.23Å; W411-Y418 HydrophobicContact CZ3-CE2 4.19Å; W411-F460 HydrophobicContact CE3-CE1 4.13Å; W411-F460 AromaticContact CE3-CZ 3.97Å; W411-F460 HydrophobicContact CE3-CZ 3.97Å; W411-F460 HydrophobicContact CZ3-CE1 4.18Å; W411-F460 HydrophobicContact CZ3-CZ 4.47Å; W411-Q474 HydrophobicContact CH2-CB 4.13Å; W411-Q474 HydrophobicContact CZ2-CB 3.68Å; W411-L475 HydrophobicContact CH2-CB 4.4Å; W411-L475 HydrophobicContact CZ3-CD1 3.98Å
412	L	94.4	Very high	92	Very high	3 Å²	3	41.4 Å²	41.4	2%	0.016	20%	0.203	C	C	.	.	H	α-helix	trans	-66.5	-42.3	177.8	-87.7	-179	0	0	0	112.7	L408 R409 H414 N415 Y418 L459 F460 A463 L475	L408-L412 PolarHBondContact O-N 3.33Å; L408-L412 VanDerWaalsContact O-N 3.15Å; R409-L412 PolarHBondContact O-N 2.98Å; L412-H414 VanDerWaalsContact C-N 3.3Å; L412-H414 PolarHBondContact O-N 3.21Å; L412-N415 PolarHBondContact O-N 3.38Å; L412-Y418 HydrophobicContact CD2-CD2 3.57Å; L412-Y418 HydrophobicContact CD2-CE2 4.41Å; L412-Y418 HydrophobicContact CD2-CG 3.76Å; L412-L459 HydrophobicContact CB-CD2 4.32Å; L412-L459 HydrophobicContact CD1-CB 4.29Å; L412-L459 HydrophobicContact CD1-CD2 3.78Å; L412-L459 HydrophobicContact CD1-CG 3.66Å; L412-F460 HydrophobicContact CD1-CB 4.5Å; L412-F460 HydrophobicContact CD1-CD1 4.28Å; L412-F460 HydrophobicContact CD1-CD2 3.32Å; L412-F460 HydrophobicContact CD1-CE1 4.33Å; L412-F460 HydrophobicContact CD1-CE2 3.38Å; L412-F460 HydrophobicContact CD1-CG 3.8Å; L412-F460 HydrophobicContact CD1-CZ 3.91Å; L412-F460 HydrophobicContact CG-CD2 4.11Å; L412-F460 HydrophobicContact CG-CE1 4.23Å; L412-F460 HydrophobicContact CG-CE2 3.68Å; L412-F460 HydrophobicContact CG-CZ 3.75Å; L412-A463 HydrophobicContact CD2-CB 4.1Å; L412-L475 HydrophobicContact CD2-CD1 3.84Å
413	K	93.7	Very high	92.4	Very high	76 Å²	76	42.3 Å²	42.3	33%	0.33	21%	0.21	S	C	.	.	H	α-helix	trans	-60.9	-34.4	176.4	170	-176.8	159.2	-159.6	0	113.4	R409 D410 W422	R409-K413 WeakPolarHBondContact O-CB 3.37Å; R409-K413 PolarHBondContact O-N 3.3Å; D410-K413 PolarHBondContact O-N 3.34Å; D410-K413 WeakPolarHBondContact OD1-CD 3.34Å; D410-K413 IonicContact OD1-NZ 3.15Å; D410-K413 PolarHBondContact OD1-NZ 3.23Å; K413-W422 HydrophobicContact CB-CD2 3.8Å; K413-W422 HydrophobicContact CB-CE3 3.82Å; K413-W422 HydrophobicContact CB-CG 4.47Å; K413-W422 HydrophobicContact CB-CH2 4.1Å; K413-W422 HydrophobicContact CB-CZ2 4.07Å; K413-W422 HydrophobicContact CB-CZ3 3.97Å; K413-W422 HydrophobicContact CD-CH2 4.01Å; K413-W422 HydrophobicContact CD-CZ2 3.7Å; K413-W422 HydrophobicContact CG-CD2 4.14Å; K413-W422 HydrophobicContact CG-CH2 4.33Å; K413-W422 HydrophobicContact CG-CZ2 3.86Å
414	H	93.3	Very high	92.5	Very high	59 Å²	59	44.6 Å²	44.6	27%	0.273	22%	0.221	S	C	.	.	H	α-helix	trans	-88.9	-7.3	177.8	-74.8	-58.5	0	0	0	113.8	K382 D383 L385 D410 W411 L412 P416	K382-H414 PolarHBondContact O-CD2 3.25Å; D383-H414 HydrophobicContact CB-CB 4.22Å; L385-H414 HydrophobicContact CD2-CB 4.07Å; D410-H414 WeakPolarHBondContact O-CB 3.2Å; D410-H414 PolarHBondContact O-CD2 2.84Å; D410-H414 PolarHBondContact O-N 3.09Å; W411-H414 PolarHBondContact O-N 3.32Å; L412-H414 VanDerWaalsContact C-N 3.3Å; L412-H414 PolarHBondContact O-N 3.21Å; H414-P416 WeakPolarHBondContact O-CD 3.4Å
415	N	94.6	Very high	92.4	Very high	9 Å²	9	45.6 Å²	45.6	5%	0.048	23%	0.225	C	C	.	.			trans	-88.4	113.1	-178.1	-171.2	-25.7	0	0	0	112	L385 W411 L412 K417 Y418 Q419	L385-N415 HydrophobicContact CD1-CB 4.08Å; L385-N415 HydrophobicContact CD2-CB 4.01Å; W411-N415 WeakPolarHBondContact CH2-ND2 3.44Å; W411-N415 WeakPolarHBondContact CZ2-ND2 3.3Å; W411-N415 WeakPolarHBondContact O-CB 3.42Å; W411-N415 PolarHBondContact O-N 2.93Å; W411-N415 VanDerWaalsContact O-N 3.14Å; L412-N415 PolarHBondContact O-N 3.38Å; N415-K417 PolarHBondContact O-N 3.37Å; N415-K417 WeakPolarHBondContact OD1-CB 3.34Å; N415-K417 PolarHBondContact OD1-N 3.2Å; N415-K417 VanDerWaalsContact OD1-N 3.1Å; N415-Y418 HydrophobicContact CB-CD2 4.09Å; N415-Y418 WeakPolarHBondContact ND2-CD2 3.44Å; N415-Y418 WeakPolarHBondContact ND2-CE2 3.38Å; N415-Y418 PolarHBondContact O-N 3.17Å; N415-Q419 PolarHBondContact O-N 2.98Å
416	P	93	Very high	92.2	Very high	108 Å²	108	47.2 Å²	47.2	70%	0.701	23%	0.232	S	C	*	.	T	Hydrogen-bonded Turn	trans	-60.7	-23.7	-176	-24	35.1	0	0	0	114.7	H414 Y418	H414-P416 WeakPolarHBondContact O-CD 3.4Å; P416-Y418 VanDerWaalsContact C-N 3.33Å
417	K	91.8	Very high	92.1	Very high	134 Å²	134	51 Å²	51	58%	0.583	25%	0.245	S	C	*	.	T	Hydrogen-bonded Turn	trans	-64.9	-37.3	176.8	-63.4	-174.7	-174.8	-179.3	0	112.2	N415 D472	N415-K417 PolarHBondContact O-N 3.37Å; N415-K417 WeakPolarHBondContact OD1-CB 3.34Å; N415-K417 PolarHBondContact OD1-N 3.2Å; N415-K417 VanDerWaalsContact OD1-N 3.1Å; K417-D472 IonicContact NZ-OD2 2.69Å; K417-D472 PolarHBondContact NZ-OD2 3.16Å
418	Y	93.6	Very high	91.6	Very high	17 Å²	17	53.5 Å²	53.5	7%	0.067	26%	0.257	C	S	.	.	T	Hydrogen-bonded Turn	trans	-105.1	5	-171.3	-55	-61.5	0	0	0	113.3	W411 L412 N415 P416 S420 V421 W422 A463 D472 L475	W411-Y418 HydrophobicContact CH2-CE2 4.15Å; W411-Y418 HydrophobicContact CZ3-CD2 4.23Å; W411-Y418 HydrophobicContact CZ3-CE2 4.19Å; L412-Y418 HydrophobicContact CD2-CD2 3.57Å; L412-Y418 HydrophobicContact CD2-CE2 4.41Å; L412-Y418 HydrophobicContact CD2-CG 3.76Å; N415-Y418 HydrophobicContact CB-CD2 4.09Å; N415-Y418 WeakPolarHBondContact ND2-CD2 3.44Å; N415-Y418 WeakPolarHBondContact ND2-CE2 3.38Å; N415-Y418 PolarHBondContact O-N 3.17Å; P416-Y418 VanDerWaalsContact C-N 3.33Å; Y418-S420 PolarHBondContact O-N 3.09Å; Y418-S420 VanDerWaalsContact O-N 3.13Å; Y418-V421 WeakPolarHBondContact O-CA 3.3Å; Y418-V421 WeakPolarHBondContact O-CB 3.19Å; Y418-V421 PolarHBondContact O-N 3.43Å; Y418-W422 PolarHBondContact O-N 3.04Å; Y418-A463 HydrophobicContact CD1-CB 3.71Å; Y418-A463 HydrophobicContact CE1-CB 4.1Å; Y418-A463 HydrophobicContact CG-CB 4.11Å; Y418-D472 WeakPolarHBondContact OH-CB 3.48Å; Y418-D472 PolarHBondContact OH-OD2 2.82Å; Y418-D472 VanDerWaalsContact OH-OD2 3.13Å; Y418-L475 HydrophobicContact CD2-CD1 4.45Å; Y418-L475 HydrophobicContact CE1-CD2 4.06Å; Y418-L475 HydrophobicContact CE2-CB 4.3Å; Y418-L475 HydrophobicContact CE2-CD1 4.04Å; Y418-L475 HydrophobicContact CE2-CD2 4.49Å
419	Q	91.7	Very high	90.8	Very high	73 Å²	73	56 Å²	56	34%	0.341	27%	0.267	S	S	.	.	H	α-helix	trans	-49.1	-39	175.4	-177.1	62.7	28.3	0	0	113	N415 V421 W422 E423	N415-Q419 PolarHBondContact O-N 2.98Å; Q419-V421 VanDerWaalsContact C-N 3.34Å; Q419-V421 PolarHBondContact O-N 3.26Å; Q419-W422 PolarHBondContact O-N 3.2Å; Q419-E423 WeakPolarHBondContact CG-OE1 3.41Å; Q419-E423 PolarHBondContact NE2-OE1 3.39Å; Q419-E423 WeakPolarHBondContact O-CB 3.44Å; Q419-E423 WeakPolarHBondContact O-CG 3.45Å; Q419-E423 PolarHBondContact O-N 3.16Å
420	S	91.5	Very high	90	Very high	64 Å²	64	59.6 Å²	59.6	45%	0.448	29%	0.286	S	S	.	.	H	α-helix	trans	-68.6	-29.9	178.3	60.4	0	0	0	0	113.8	Y418 Q424	Y418-S420 PolarHBondContact O-N 3.09Å; Y418-S420 VanDerWaalsContact O-N 3.13Å; S420-Q424 VanDerWaalsContact O-CG 3.28Å; S420-Q424 WeakPolarHBondContact O-CG 3.3Å; S420-Q424 PolarHBondContact O-N 2.94Å; S420-Q424 PolarHBondContact O-NE2 3.45Å
421	V	92	Very high	89.2	Confident	10 Å²	10	67.4 Å²	67.4	6%	0.061	31%	0.311	C	S	.	.	H	α-helix	trans	-78.3	-41.9	174.8	-178.3	0	0	0	0	109.6	Y418 Q419 Q424 Y425 L459 R462	Y418-V421 WeakPolarHBondContact O-CA 3.3Å; Y418-V421 WeakPolarHBondContact O-CB 3.19Å; Y418-V421 PolarHBondContact O-N 3.43Å; Q419-V421 VanDerWaalsContact C-N 3.34Å; Q419-V421 PolarHBondContact O-N 3.26Å; V421-Q424 WeakPolarHBondContact O-CB 3.43Å; V421-Q424 PolarHBondContact O-N 3.47Å; V421-Y425 PolarHBondContact O-N 3.35Å; V421-L459 HydrophobicContact CG1-CD1 4.18Å; V421-R462 HydrophobicContact CG1-CB 3.86Å
422	W	91	Very high	87.7	Confident	33 Å²	33	73 Å²	73	13%	0.125	34%	0.342	C	S	.	.	H	α-helix	trans	-58.3	-47.1	173.1	177.9	-98.1	0	0	0	112.2	R409 K413 Y418 Q419 Q424 Y425 E426 L459	R409-W422 HydrophobicContact CG-CH2 4.13Å; R409-W422 HydrophobicContact CG-CZ3 3.84Å; K413-W422 HydrophobicContact CB-CD2 3.8Å; K413-W422 HydrophobicContact CB-CE3 3.82Å; K413-W422 HydrophobicContact CB-CG 4.47Å; K413-W422 HydrophobicContact CB-CH2 4.1Å; K413-W422 HydrophobicContact CB-CZ2 4.07Å; K413-W422 HydrophobicContact CB-CZ3 3.97Å; K413-W422 HydrophobicContact CD-CH2 4.01Å; K413-W422 HydrophobicContact CD-CZ2 3.7Å; K413-W422 HydrophobicContact CG-CD2 4.14Å; K413-W422 HydrophobicContact CG-CH2 4.33Å; K413-W422 HydrophobicContact CG-CZ2 3.86Å; Y418-W422 PolarHBondContact O-N 3.04Å; Q419-W422 PolarHBondContact O-N 3.2Å; W422-Q424 PolarHBondContact O-N 2.96Å; W422-Y425 HydrophobicContact CE3-CD1 4.14Å; W422-Y425 HydrophobicContact CH2-CD1 4.27Å; W422-Y425 HydrophobicContact CH2-CE1 4.14Å; W422-Y425 AromaticContact CZ3-CD1 3.91Å; W422-Y425 HydrophobicContact CZ3-CD1 3.91Å; W422-Y425 AromaticContact CZ3-CE1 3.98Å; W422-Y425 HydrophobicContact CZ3-CE1 3.98Å; W422-Y425 PolarHBondContact O-N 3.09Å; W422-E426 HydrophobicContact CZ2-CG 3.83Å; W422-E426 PolarHBondContact O-N 3.36Å; W422-L459 HydrophobicContact CE3-CD2 3.98Å; W422-L459 HydrophobicContact CZ3-CD2 4.01Å
423	E	91	Very high	86.1	Confident	92 Å²	92	75 Å²	75	43%	0.43	36%	0.363	S	S	.	.	H	α-helix	trans	-64.1	-26	176.8	-77.1	171.9	-163.8	0	0	113.6	Q419 R427	Q419-E423 WeakPolarHBondContact CG-OE1 3.41Å; Q419-E423 PolarHBondContact NE2-OE1 3.39Å; Q419-E423 WeakPolarHBondContact O-CB 3.44Å; Q419-E423 WeakPolarHBondContact O-CG 3.45Å; Q419-E423 PolarHBondContact O-N 3.16Å; E423-R427 WeakPolarHBondContact O-CG 3.33Å; E423-R427 PolarHBondContact O-N 2.9Å; E423-R427 PolarHBondContact O-NE 3.26Å; E423-R427 PolarHBondContact O-NH2 2.96Å
424	Q	89.3	Confident	84.3	Confident	96 Å²	96	72 Å²	72	45%	0.449	35%	0.354	S	S	.	.	H	α-helix	trans	-75.7	-46.5	172.1	-72.1	170.3	39.6	0	0	110.6	S420 V421 W422 E426 R427 D428	S420-Q424 VanDerWaalsContact O-CG 3.28Å; S420-Q424 WeakPolarHBondContact O-CG 3.3Å; S420-Q424 PolarHBondContact O-N 2.94Å; S420-Q424 PolarHBondContact O-NE2 3.45Å; V421-Q424 WeakPolarHBondContact O-CB 3.43Å; V421-Q424 PolarHBondContact O-N 3.47Å; W422-Q424 PolarHBondContact O-N 2.96Å; Q424-E426 PolarHBondContact O-N 2.97Å; Q424-R427 WeakPolarHBondContact O-CB 3.49Å; Q424-R427 PolarHBondContact O-N 3.34Å; Q424-R427 VanDerWaalsContact O-N 3.14Å; Q424-D428 PolarHBondContact O-N 3.29Å
425	Y	88.8	Confident	82.3	Confident	21 Å²	21	75.4 Å²	75.4	8%	0.082	37%	0.37	C	S	.	.	H	α-helix	trans	-56.8	-46.8	176.1	169.7	-100.1	0	0	0	112.5	V421 W422 R427 D428 R429 L459	V421-Y425 PolarHBondContact O-N 3.35Å; W422-Y425 HydrophobicContact CE3-CD1 4.14Å; W422-Y425 HydrophobicContact CH2-CD1 4.27Å; W422-Y425 HydrophobicContact CH2-CE1 4.14Å; W422-Y425 AromaticContact CZ3-CD1 3.91Å; W422-Y425 HydrophobicContact CZ3-CD1 3.91Å; W422-Y425 AromaticContact CZ3-CE1 3.98Å; W422-Y425 HydrophobicContact CZ3-CE1 3.98Å; W422-Y425 PolarHBondContact O-N 3.09Å; Y425-R427 VanDerWaalsContact C-N 3.31Å; Y425-R427 PolarHBondContact O-N 3.35Å; Y425-D428 PolarHBondContact O-N 2.74Å; Y425-R429 VanDerWaalsContact O-CB 3.31Å; Y425-R429 WeakPolarHBondContact O-CB 3.47Å; Y425-R429 PolarHBondContact O-N 3.25Å; Y425-L459 HydrophobicContact CD1-CD1 4.31Å; Y425-L459 HydrophobicContact CD2-CD1 3.96Å; Y425-L459 HydrophobicContact CG-CD1 3.68Å
426	E	86.3	Confident	80.1	Confident	35 Å²	35	82.5 Å²	82.5	16%	0.164	40%	0.403	C	S	.	.	H	α-helix	trans	-62.3	-36.2	176.1	-85.2	-65	134.4	0	0	112.8	W422 Q424 R429 Q430	W422-E426 HydrophobicContact CZ2-CG 3.83Å; W422-E426 PolarHBondContact O-N 3.36Å; Q424-E426 PolarHBondContact O-N 2.97Å; E426-R429 IonicContact OE1-CZ 3.1Å; E426-R429 IonicContact OE1-NH1 2.71Å; E426-R429 PolarHBondContact OE1-NH1 3.02Å; E426-R429 IonicContact OE2-NH1 2.67Å; E426-Q430 WeakPolarHBondContact O-CB 3.1Å; E426-Q430 WeakPolarHBondContact O-CG 3.37Å; E426-Q430 PolarHBondContact O-N 2.89Å; E426-Q430 PolarHBondContact OE2-NE2 3.34Å
427	R	86.4	Confident	78.1	Confident	130 Å²	130	84.7 Å²	84.7	49%	0.491	40%	0.397	S	S	.	.	H	α-helix	trans	-69.1	-36.6	174.4	-81.8	177.9	-77.7	145.9	-12.1	112.9	E423 Q424 Y425 R431	E423-R427 WeakPolarHBondContact O-CG 3.33Å; E423-R427 PolarHBondContact O-N 2.9Å; E423-R427 PolarHBondContact O-NE 3.26Å; E423-R427 PolarHBondContact O-NH2 2.96Å; Q424-R427 WeakPolarHBondContact O-CB 3.49Å; Q424-R427 PolarHBondContact O-N 3.34Å; Q424-R427 VanDerWaalsContact O-N 3.14Å; Y425-R427 VanDerWaalsContact C-N 3.31Å; Y425-R427 PolarHBondContact O-N 3.35Å; R427-R431 WeakPolarHBondContact O-CD 3.49Å; R427-R431 VanDerWaalsContact O-CG 3.28Å; R427-R431 WeakPolarHBondContact O-CG 3.35Å; R427-R431 PolarHBondContact O-N 2.9Å
428	D	83.6	Confident	76.1	Confident	66 Å²	66	80.7 Å²	80.7	35%	0.353	38%	0.38	S	S	.	.	H	α-helix	trans	-67	-48.3	174.6	-69	-15.3	0	0	0	110.1	Q424 Y425 Q430 R431 D432 R462	Q424-D428 PolarHBondContact O-N 3.29Å; Y425-D428 PolarHBondContact O-N 2.74Å; D428-Q430 PolarHBondContact O-N 3.03Å; D428-R431 WeakPolarHBondContact O-CB 3.39Å; D428-R431 PolarHBondContact O-N 3.3Å; D428-D432 PolarHBondContact O-N 3.22Å; D428-R462 IonicContact OD2-CZ 2.72Å; D428-R462 IonicContact OD2-NH1 3.77Å; D428-R462 PolarHBondContact OD2-NH1 3.47Å; D428-R462 IonicContact OD2-NH2 3.76Å
429	R	77.5	Confident	74	Confident	52 Å²	52	86.9 Å²	86.9	20%	0.196	41%	0.407	C	S	.	.	H	α-helix	trans	-60.9	-39	179.2	-175.6	174	173	-130.7	2.9	113.4	Y425 E426 R431 D432 G434 E438	Y425-R429 VanDerWaalsContact O-CB 3.31Å; Y425-R429 WeakPolarHBondContact O-CB 3.47Å; Y425-R429 PolarHBondContact O-N 3.25Å; E426-R429 IonicContact OE1-CZ 3.1Å; E426-R429 IonicContact OE1-NH1 2.71Å; E426-R429 PolarHBondContact OE1-NH1 3.02Å; E426-R429 IonicContact OE2-NH1 2.67Å; R429-R431 VanDerWaalsContact C-N 3.34Å; R429-D432 PolarHBondContact O-N 3.44Å; R429-G434 PolarHBondContact O-N 3.16Å; R429-E438 IonicContact CZ-OE1 2.98Å; R429-E438 VanDerWaalsContact CZ-OE1 3.23Å; R429-E438 IonicContact CZ-OE2 2.7Å; R429-E438 IonicContact NE-OE1 3.73Å; R429-E438 PolarHBondContact NE-OE1 3Å; R429-E438 IonicContact NH2-OE1 3.81Å; R429-E438 PolarHBondContact NH2-OE1 3.26Å; R429-E438 IonicContact NH2-OE2 2.85Å; R429-E438 PolarHBondContact NH2-OE2 3.11Å
430	Q	77.4	Confident	71.9	Confident	122 Å²	122	89.6 Å²	89.6	57%	0.57	42%	0.42	S	S	*	.	H	α-helix	trans	-70.5	-26.7	174.7	-73.1	169.7	24.2	0	0	113.2	E426 D428	E426-Q430 WeakPolarHBondContact O-CB 3.1Å; E426-Q430 WeakPolarHBondContact O-CG 3.37Å; E426-Q430 PolarHBondContact O-N 2.89Å; E426-Q430 PolarHBondContact OE2-NE2 3.34Å; D428-Q430 PolarHBondContact O-N 3.03Å
431	R	76.3	Confident	69.9	Low	210 Å²	210	91.6 Å²	91.6	79%	0.792	42%	0.421	S	S	*	.	H	α-helix	trans	-76.1	-29.4	175.6	-77.4	169.2	169.2	-173.5	-4.9	113.2	R427 D428 R429 G433	R427-R431 WeakPolarHBondContact O-CD 3.49Å; R427-R431 VanDerWaalsContact O-CG 3.28Å; R427-R431 WeakPolarHBondContact O-CG 3.35Å; R427-R431 PolarHBondContact O-N 2.9Å; D428-R431 WeakPolarHBondContact O-CB 3.39Å; D428-R431 PolarHBondContact O-N 3.3Å; R429-R431 VanDerWaalsContact C-N 3.34Å; R431-G433 VanDerWaalsContact C-N 3.32Å
432	D	65.5	Low	67.8	Low	123 Å²	123	96.1 Å²	96.1	66%	0.658	44%	0.441	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91	10.4	-176.1	-151.8	41.8	0	0	0	113.7	D428 R429 G434	D428-D432 PolarHBondContact O-N 3.22Å; R429-D432 PolarHBondContact O-N 3.44Å; D432-G434 VanDerWaalsContact C-N 3.28Å; D432-G434 PolarHBondContact O-N 3.27Å
433	G	60.3	Low	65.8	Low	45 Å²	45	104.4 Å²	104.4	46%	0.464	47%	0.473	S	S	.	.	T	Hydrogen-bonded Turn	trans	69.1	19.8	178.8	0	0	0	0	0	114.7	R431 Q435 E436	R431-G433 VanDerWaalsContact C-N 3.32Å; G433-Q435 VanDerWaalsContact C-N 3.26Å; G433-Q435 PolarHBondContact O-N 3.25Å; G433-E436 PolarHBondContact O-N 2.68Å
434	G	55.1	Low	63.6	Low	13 Å²	13	109 Å²	109	13%	0.134	49%	0.491	C	S	.	.	H	α-helix	trans	-61.3	-21.3	-164.5	0	0	0	0	0	116.9	R429 D432 E436 E438	R429-G434 PolarHBondContact O-N 3.16Å; D432-G434 VanDerWaalsContact C-N 3.28Å; D432-G434 PolarHBondContact O-N 3.27Å; G434-E436 VanDerWaalsContact C-N 3.35Å; G434-E436 PolarHBondContact O-N 3.41Å; G434-E438 WeakPolarHBondContact O-CB 3.22Å; G434-E438 PolarHBondContact O-N 2.99Å
435	Q	52.4	Low	61.4	Low	131 Å²	131	105.9 Å²	105.9	61%	0.612	49%	0.486	S	S	*	.	H	α-helix	trans	-69	-26	-175.3	-73.9	-172	-20.9	0	0	114.8	G433	G433-Q435 VanDerWaalsContact C-N 3.26Å; G433-Q435 PolarHBondContact O-N 3.25Å
436	E	47.6	Very low	59.3	Low	157 Å²	157	111 Å²	111	73%	0.734	52%	0.524	S	S	*	.	H	α-helix	trans	-84.7	-48.3	176.3	-69.9	175.6	157.5	0	0	110.3	G433 G434 E438 K439 E440	G433-E436 PolarHBondContact O-N 2.68Å; G434-E436 VanDerWaalsContact C-N 3.35Å; G434-E436 PolarHBondContact O-N 3.41Å; E436-E438 VanDerWaalsContact C-N 3.29Å; E436-E438 PolarHBondContact O-N 2.82Å; E436-K439 PolarHBondContact O-N 3.03Å; E436-K439 VanDerWaalsContact O-N 3.15Å; E436-E440 PolarHBondContact O-N 2.69Å
437	R	50.6	Low	57.6	Low	154 Å²	154	116.7 Å²	116.7	58%	0.581	56%	0.555	S	S	*	*	H	α-helix	trans	-59.7	-32.2	177.9	-75.9	177.6	165.6	176.2	-4.6	114.3	K441	R437-K441 WeakPolarHBondContact O-CB 3.02Å; R437-K441 VanDerWaalsContact O-CG 3.29Å; R437-K441 WeakPolarHBondContact O-CG 3.28Å; R437-K441 PolarHBondContact O-N 2.96Å
438	E	49.8	Very low	56	Low	50 Å²	50	113.2 Å²	113.2	23%	0.234	55%	0.546	C	S	.	.	H	α-helix	trans	-69.6	-42.9	175.2	-82.7	-178.8	-143.7	0	0	112.4	R429 G434 E436 E440 K441 E442	R429-E438 IonicContact CZ-OE1 2.98Å; R429-E438 VanDerWaalsContact CZ-OE1 3.23Å; R429-E438 IonicContact CZ-OE2 2.7Å; R429-E438 IonicContact NE-OE1 3.73Å; R429-E438 PolarHBondContact NE-OE1 3Å; R429-E438 IonicContact NH2-OE1 3.81Å; R429-E438 PolarHBondContact NH2-OE1 3.26Å; R429-E438 IonicContact NH2-OE2 2.85Å; R429-E438 PolarHBondContact NH2-OE2 3.11Å; G434-E438 WeakPolarHBondContact O-CB 3.22Å; G434-E438 PolarHBondContact O-N 2.99Å; E436-E438 VanDerWaalsContact C-N 3.29Å; E436-E438 PolarHBondContact O-N 2.82Å; E438-E440 PolarHBondContact O-N 3.11Å; E438-K441 PolarHBondContact O-N 3.24Å; E438-K441 VanDerWaalsContact O-N 3.15Å; E438-E442 WeakPolarHBondContact O-CB 3.24Å; E438-E442 WeakPolarHBondContact O-CG 3.47Å; E438-E442 PolarHBondContact O-N 3.48Å
439	K	51	Low	54.9	Low	147 Å²	147	111.3 Å²	111.3	64%	0.639	54%	0.537	S	S	*	.	H	α-helix	trans	-63.3	-28.7	178	-74.5	178.8	175.8	178.3	0	112.9	E436 R443	E436-K439 PolarHBondContact O-N 3.03Å; E436-K439 VanDerWaalsContact O-N 3.15Å; K439-R443 WeakPolarHBondContact O-CG 3.32Å
440	E	46.7	Very low	54.4	Low	130 Å²	130	115.3 Å²	115.3	61%	0.607	56%	0.558	S	S	*	*	H	α-helix	trans	-75.5	-45.7	172.2	-66.4	176.9	150.4	0	0	111.5	E436 E438 E442 R443	E436-E440 PolarHBondContact O-N 2.69Å; E438-E440 PolarHBondContact O-N 3.11Å; E440-E442 PolarHBondContact O-N 3.4Å; E440-R443 PolarHBondContact O-N 3.32Å
441	K	48.8	Very low	54.5	Low	107 Å²	107	111.3 Å²	111.3	47%	0.465	54%	0.543	S	S	.	.	H	α-helix	trans	-63.9	-36.6	177	-76.1	175.8	172.7	-171.5	0	113.5	R437 E438 R443 F444 G445 S451	R437-K441 WeakPolarHBondContact O-CB 3.02Å; R437-K441 VanDerWaalsContact O-CG 3.29Å; R437-K441 WeakPolarHBondContact O-CG 3.28Å; R437-K441 PolarHBondContact O-N 2.96Å; E438-K441 PolarHBondContact O-N 3.24Å; E438-K441 VanDerWaalsContact O-N 3.15Å; K441-R443 PolarHBondContact O-N 2.8Å; K441-F444 PolarHBondContact O-N 3.13Å; K441-G445 PolarHBondContact O-N 3.49Å; K441-S451 PolarHBondContact NZ-OG 2.9Å; K441-S451 VanDerWaalsContact NZ-OG 3.12Å
442	E	48.9	Very low	54.8	Low	104 Å²	104	102.2 Å²	102.2	49%	0.486	51%	0.511	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.1	-22.8	177.2	-76.6	-173.2	145.2	0	0	113.1	R402 E438 E440	R402-E442 IonicContact NH2-OE1 2.8Å; R402-E442 PolarHBondContact NH2-OE1 3.28Å; E438-E442 WeakPolarHBondContact O-CB 3.24Å; E438-E442 WeakPolarHBondContact O-CG 3.47Å; E438-E442 PolarHBondContact O-N 3.48Å; E440-E442 PolarHBondContact O-N 3.4Å
443	R	49.2	Very low	55.9	Low	208 Å²	208	97 Å²	97	79%	0.785	48%	0.482	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.5	-18.3	178.5	-72.8	174.4	177.3	-156.2	-2.4	114.5	K439 E440 K441	K439-R443 WeakPolarHBondContact O-CG 3.32Å; E440-R443 PolarHBondContact O-N 3.32Å; K441-R443 PolarHBondContact O-N 2.8Å
444	F	44.5	Very low	57.2	Low	187 Å²	187	97.2 Å²	97.2	82%	0.82	47%	0.474	S	S	*	.	T	Hydrogen-bonded Turn	trans	-126.8	-6.1	-169	-72.7	-79.4	0	0	0	115.5	K441 S446	K441-F444 PolarHBondContact O-N 3.13Å; F444-S446 PolarHBondContact O-N 3.36Å
445	G	42.9	Very low	58.8	Low	32 Å²	32	99.5 Å²	99.5	33%	0.33	48%	0.483	S	S	.	.			trans	-92.4	92.5	-176.4	0	0	0	0	0	115.3	K441 L447	K441-G445 PolarHBondContact O-N 3.49Å; G445-L447 CarbonylContact C-O 3.45Å
446	S	44.9	Very low	60.7	Low	128 Å²	128	93.3 Å²	93.3	90%	0.895	45%	0.454	S	S	*	.	S	Bend	trans	-78.1	-34.3	165.2	177.1	0	0	0	0	112.2	F444	F444-S446 PolarHBondContact O-N 3.36Å
447	L	49.3	Very low	62.9	Low	155 Å²	155	87.2 Å²	87.2	81%	0.812	43%	0.426	S	S	*	.	S	Bend	trans	-83.6	157	167.5	-64.2	167.9	0	0	0	109.6	G445 P449	G445-L447 CarbonylContact C-O 3.45Å; L447-P449 WeakPolarHBondContact O-CD 3.3Å; L447-P449 VanDerWaalsContact O-N 3.17Å
448	L	53	Low	64.9	Low	56 Å²	56	83.3 Å²	83.3	29%	0.293	42%	0.417	S	S	.	.			trans	-39.3	122.9	169.8	-98.3	173.5	0	0	0	110.2	H401 E450	H401-L448 HydrophobicContact CB-CD1 3.7Å; H401-L448 HydrophobicContact CB-CD2 3.74Å; H401-L448 HydrophobicContact CB-CG 3.72Å; H401-L448 WeakPolarHBondContact ND1-CD1 3.12Å; L448-E450 VanDerWaalsContact C-N 3.34Å; L448-E450 PolarHBondContact O-N 2.96Å
449	P	62.1	Low	67	Low	26 Å²	26	81.1 Å²	81.1	17%	0.169	41%	0.407	C	S	.	.			trans	-64.8	103.9	164	-14.7	28.9	0	0	0	106.2	L447 S451 L452 F453	L447-P449 WeakPolarHBondContact O-CD 3.3Å; L447-P449 VanDerWaalsContact O-N 3.17Å; P449-S451 CarbonylContact O-C 3.6Å; P449-S451 PolarHBondContact O-N 3.43Å; P449-L452 HydrophobicContact CB-CB 4.16Å; P449-L452 HydrophobicContact CG-CB 4.5Å; P449-L452 WeakPolarHBondContact O-CB 3.25Å; P449-L452 PolarHBondContact O-N 2.98Å; P449-F453 PolarHBondContact O-N 3.21Å
450	E	66.3	Low	69.1	Low	137 Å²	137	74.1 Å²	74.1	64%	0.64	38%	0.376	S	S	*	.	H	α-helix	trans	-48.2	-33.5	-179.5	-172.2	65.6	-166.6	0	0	111.6	L448 T454	L448-E450 VanDerWaalsContact C-N 3.34Å; L448-E450 PolarHBondContact O-N 2.96Å; E450-T454 VanDerWaalsContact O-CB 3.25Å; E450-T454 WeakPolarHBondContact O-CB 3.24Å; E450-T454 PolarHBondContact O-N 3.31Å; E450-T454 PolarHBondContact O-OG1 2.92Å
451	S	78.4	Confident	71.3	Confident	37 Å²	37	70.6 Å²	70.6	26%	0.259	36%	0.361	S	S	.	.	H	α-helix	trans	-62.4	-44.9	172	55.3	0	0	0	0	114	K441 P449 F453 T454 D455	K441-S451 PolarHBondContact NZ-OG 2.9Å; K441-S451 VanDerWaalsContact NZ-OG 3.12Å; P449-S451 CarbonylContact O-C 3.6Å; P449-S451 PolarHBondContact O-N 3.43Å; S451-F453 PolarHBondContact O-N 3.49Å; S451-T454 PolarHBondContact O-N 3.29Å; S451-D455 VanDerWaalsContact O-CB 3.26Å; S451-D455 WeakPolarHBondContact O-CB 3.32Å; S451-D455 PolarHBondContact O-N 3.03Å; S451-D455 VanDerWaalsContact O-OD2 3.12Å
452	L	83.9	Confident	73.4	Confident	20 Å²	20	71.1 Å²	71.1	11%	0.105	36%	0.36	C	S	.	.	H	α-helix	trans	-63	-44.4	-179.1	176.3	65	0	0	0	111.5	R402 C405 E406 P449 D455 V456	R402-L452 HydrophobicContact CG-CD2 4.24Å; C405-L452 HydrophobicContact CB-CD2 4.23Å; C405-L452 HydrophobicContact CB-CG 4.2Å; E406-L452 HydrophobicContact CG-CD2 4.07Å; P449-L452 HydrophobicContact CB-CB 4.16Å; P449-L452 HydrophobicContact CG-CB 4.5Å; P449-L452 WeakPolarHBondContact O-CB 3.25Å; P449-L452 PolarHBondContact O-N 2.98Å; L452-D455 PolarHBondContact O-N 3.35Å; L452-V456 HydrophobicContact CD1-CG2 4.18Å; L452-V456 WeakPolarHBondContact O-CG2 3.46Å; L452-V456 PolarHBondContact O-N 2.86Å
453	F	87.4	Confident	75.6	Confident	13 Å²	13	66.2 Å²	66.2	6%	0.057	34%	0.338	C	S	.	.	H	α-helix	trans	-61.1	-50.5	175.7	176	-95.2	0	0	0	110.6	P449 S451 D455 V456 Q457 L482 L485	P449-F453 PolarHBondContact O-N 3.21Å; S451-F453 PolarHBondContact O-N 3.49Å; F453-D455 VanDerWaalsContact C-N 3.32Å; F453-D455 PolarHBondContact O-N 3.07Å; F453-V456 PolarHBondContact O-N 3.12Å; F453-Q457 HydrophobicContact CE1-CB 4.32Å; F453-Q457 HydrophobicContact CZ-CB 4.45Å; F453-Q457 HydrophobicContact CZ-CG 4.5Å; F453-Q457 WeakPolarHBondContact O-CB 3.27Å; F453-Q457 PolarHBondContact O-N 3.18Å; F453-L482 HydrophobicContact CD2-CD2 4.33Å; F453-L482 HydrophobicContact CE2-CB 4.27Å; F453-L482 HydrophobicContact CE2-CD2 3.96Å; F453-L482 WeakPolarHBondContact CE2-O 3.47Å; F453-L482 WeakPolarHBondContact CZ-O 3.31Å; F453-L485 HydrophobicContact CE2-CB 3.92Å
454	T	88.3	Confident	77.6	Confident	50 Å²	50	57.5 Å²	57.5	31%	0.307	31%	0.31	S	S	.	.	H	α-helix	trans	-58.8	-41	178.7	-61.1	0	0	0	0	112.3	E450 S451 N458	E450-T454 VanDerWaalsContact O-CB 3.25Å; E450-T454 WeakPolarHBondContact O-CB 3.24Å; E450-T454 PolarHBondContact O-N 3.31Å; E450-T454 PolarHBondContact O-OG1 2.92Å; S451-T454 PolarHBondContact O-N 3.29Å; T454-N458 WeakPolarHBondContact CG2-ND2 3.38Å; T454-N458 VanDerWaalsContact O-CB 3.29Å; T454-N458 WeakPolarHBondContact O-CB 3.4Å; T454-N458 PolarHBondContact O-N 3.29Å; T454-N458 PolarHBondContact O-ND2 3.39Å
455	D	89.1	Confident	79.9	Confident	60 Å²	60	54 Å²	54	32%	0.321	30%	0.3	S	S	.	.	H	α-helix	trans	-65.5	-45.8	179.2	-71.8	-27.5	0	0	0	111.1	S451 L452 F453 N458 L459	S451-D455 VanDerWaalsContact O-CB 3.26Å; S451-D455 WeakPolarHBondContact O-CB 3.32Å; S451-D455 PolarHBondContact O-N 3.03Å; S451-D455 VanDerWaalsContact O-OD2 3.12Å; L452-D455 PolarHBondContact O-N 3.35Å; F453-D455 VanDerWaalsContact C-N 3.32Å; F453-D455 PolarHBondContact O-N 3.07Å; D455-N458 PolarHBondContact O-N 3.26Å; D455-L459 VanDerWaalsContact O-CB 3.31Å; D455-L459 WeakPolarHBondContact O-CB 3.35Å; D455-L459 PolarHBondContact O-N 3.14Å
456	V	93.1	Very high	82.1	Confident	1 Å²	1	55.7 Å²	55.7	1%	0.006	31%	0.306	C	S	.	.	H	α-helix	trans	-68.6	-41.9	178.2	177.7	0	0	0	0	110.9	C405 L408 R409 L452 F453 N458 L459 F460 L482	C405-V456 HydrophobicContact CB-CG2 4.49Å; L408-V456 HydrophobicContact CB-CG1 4.16Å; R409-V456 HydrophobicContact CB-CG2 3.94Å; R409-V456 HydrophobicContact CG-CG2 4.44Å; L452-V456 HydrophobicContact CD1-CG2 4.18Å; L452-V456 WeakPolarHBondContact O-CG2 3.46Å; L452-V456 PolarHBondContact O-N 2.86Å; F453-V456 PolarHBondContact O-N 3.12Å; V456-N458 PolarHBondContact O-N 3.29Å; V456-L459 WeakPolarHBondContact O-CB 3.39Å; V456-L459 PolarHBondContact O-N 3.41Å; V456-L459 VanDerWaalsContact O-N 3.16Å; V456-F460 HydrophobicContact CG1-CD2 3.89Å; V456-F460 HydrophobicContact CG1-CE2 3.94Å; V456-F460 WeakPolarHBondContact O-CD2 3.44Å; V456-F460 PolarHBondContact O-N 2.9Å; V456-L482 HydrophobicContact CG1-CD1 4.02Å; V456-L482 HydrophobicContact CG1-CD2 3.91Å
457	Q	92.8	Very high	84	Confident	29 Å²	29	52.8 Å²	52.8	14%	0.136	28%	0.281	C	S	.	.	H	α-helix	trans	-59.2	-48	174.6	-165.9	-171.7	54.4	0	0	111.2	F453 L459 F460 L461 F483 E488	F453-Q457 HydrophobicContact CE1-CB 4.32Å; F453-Q457 HydrophobicContact CZ-CB 4.45Å; F453-Q457 HydrophobicContact CZ-CG 4.5Å; F453-Q457 WeakPolarHBondContact O-CB 3.27Å; F453-Q457 PolarHBondContact O-N 3.18Å; Q457-L459 VanDerWaalsContact C-N 3.3Å; Q457-L459 PolarHBondContact O-N 2.97Å; Q457-F460 PolarHBondContact O-N 2.67Å; Q457-L461 HydrophobicContact CG-CD1 4.3Å; Q457-L461 WeakPolarHBondContact O-CB 3.31Å; Q457-L461 VanDerWaalsContact O-CG 3.31Å; Q457-L461 WeakPolarHBondContact O-CG 3.44Å; Q457-L461 PolarHBondContact O-N 2.92Å; Q457-F483 VanDerWaalsContact NE2-CE1 3.28Å; Q457-E488 PolarHBondContact NE2-OE1 3.19Å; Q457-E488 VanDerWaalsContact NE2-OE1 3.07Å
458	N	92.1	Very high	85.7	Confident	73 Å²	73	50.7 Å²	50.7	39%	0.39	28%	0.277	S	S	.	.	H	α-helix	trans	-61.7	-36.8	174.9	-81.3	-59.8	0	0	0	112.5	T454 D455 V456 L461 R462	T454-N458 WeakPolarHBondContact CG2-ND2 3.38Å; T454-N458 VanDerWaalsContact O-CB 3.29Å; T454-N458 WeakPolarHBondContact O-CB 3.4Å; T454-N458 PolarHBondContact O-N 3.29Å; T454-N458 PolarHBondContact O-ND2 3.39Å; D455-N458 PolarHBondContact O-N 3.26Å; V456-N458 PolarHBondContact O-N 3.29Å; N458-L461 PolarHBondContact O-N 3.42Å; N458-R462 WeakPolarHBondContact O-CB 3.47Å; N458-R462 VanDerWaalsContact O-CG 3.28Å; N458-R462 WeakPolarHBondContact O-CG 3.37Å; N458-R462 PolarHBondContact O-N 2.85Å
459	L	93.6	Very high	87.2	Confident	3 Å²	3	52.8 Å²	52.8	2%	0.016	30%	0.296	C	S	.	.	H	α-helix	trans	-66.2	-44.4	177.7	-171.2	68	0	0	0	111.9	L412 V421 W422 Y425 D455 V456 Q457 R462 A463	L412-L459 HydrophobicContact CB-CD2 4.32Å; L412-L459 HydrophobicContact CD1-CB 4.29Å; L412-L459 HydrophobicContact CD1-CD2 3.78Å; L412-L459 HydrophobicContact CD1-CG 3.66Å; V421-L459 HydrophobicContact CG1-CD1 4.18Å; W422-L459 HydrophobicContact CE3-CD2 3.98Å; W422-L459 HydrophobicContact CZ3-CD2 4.01Å; Y425-L459 HydrophobicContact CD1-CD1 4.31Å; Y425-L459 HydrophobicContact CD2-CD1 3.96Å; Y425-L459 HydrophobicContact CG-CD1 3.68Å; D455-L459 VanDerWaalsContact O-CB 3.31Å; D455-L459 WeakPolarHBondContact O-CB 3.35Å; D455-L459 PolarHBondContact O-N 3.14Å; V456-L459 WeakPolarHBondContact O-CB 3.39Å; V456-L459 PolarHBondContact O-N 3.41Å; V456-L459 VanDerWaalsContact O-N 3.16Å; Q457-L459 VanDerWaalsContact C-N 3.3Å; Q457-L459 PolarHBondContact O-N 2.97Å; L459-R462 PolarHBondContact O-N 3.23Å; L459-A463 WeakPolarHBondContact O-CB 3.28Å; L459-A463 PolarHBondContact O-N 3.17Å
460	F	95.5	Very high	88.4	Confident	0 Å²	0	58.5 Å²	58.5	0%	0	32%	0.321	C	S	.	.	H	α-helix	trans	-64.5	-39.7	173.7	-88.5	-101.2	0	0	0	112.1	L408 W411 L412 V456 Q457 A463 A464 L475 L479 L482	L408-F460 HydrophobicContact CB-CE2 3.81Å; L408-F460 HydrophobicContact CB-CZ 3.96Å; L408-F460 HydrophobicContact CD2-CZ 4.03Å; L408-F460 WeakPolarHBondContact O-CE2 3.37Å; W411-F460 HydrophobicContact CE3-CE1 4.13Å; W411-F460 AromaticContact CE3-CZ 3.97Å; W411-F460 HydrophobicContact CE3-CZ 3.97Å; W411-F460 HydrophobicContact CZ3-CE1 4.18Å; W411-F460 HydrophobicContact CZ3-CZ 4.47Å; L412-F460 HydrophobicContact CD1-CB 4.5Å; L412-F460 HydrophobicContact CD1-CD1 4.28Å; L412-F460 HydrophobicContact CD1-CD2 3.32Å; L412-F460 HydrophobicContact CD1-CE1 4.33Å; L412-F460 HydrophobicContact CD1-CE2 3.38Å; L412-F460 HydrophobicContact CD1-CG 3.8Å; L412-F460 HydrophobicContact CD1-CZ 3.91Å; L412-F460 HydrophobicContact CG-CD2 4.11Å; L412-F460 HydrophobicContact CG-CE1 4.23Å; L412-F460 HydrophobicContact CG-CE2 3.68Å; L412-F460 HydrophobicContact CG-CZ 3.75Å; V456-F460 HydrophobicContact CG1-CD2 3.89Å; V456-F460 HydrophobicContact CG1-CE2 3.94Å; V456-F460 WeakPolarHBondContact O-CD2 3.44Å; V456-F460 PolarHBondContact O-N 2.9Å; Q457-F460 PolarHBondContact O-N 2.67Å; F460-A463 WeakPolarHBondContact O-CB 3.37Å; F460-A463 PolarHBondContact O-N 3.17Å; F460-A464 WeakPolarHBondContact O-CB 3.5Å; F460-A464 PolarHBondContact O-N 2.96Å; F460-L475 HydrophobicContact CD1-CD1 3.59Å; F460-L475 HydrophobicContact CD1-CG 4.39Å; F460-L475 HydrophobicContact CE1-CD1 3.9Å; F460-L475 HydrophobicContact CG-CD1 4.44Å; F460-L479 HydrophobicContact CB-CD1 4.05Å; F460-L479 HydrophobicContact CD1-CB 4.43Å; F460-L482 HydrophobicContact CB-CD1 3.93Å; F460-L482 HydrophobicContact CD1-CD1 4.29Å; F460-L482 HydrophobicContact CD2-CD1 3.52Å; F460-L482 HydrophobicContact CE2-CD1 4.1Å; F460-L482 HydrophobicContact CG-CD1 3.64Å
461	L	94.1	Very high	89.6	Confident	56 Å²	56	54.9 Å²	54.9	29%	0.293	31%	0.308	S	S	.	.	H	α-helix	trans	-66	-39.4	174.7	-70.3	171.4	0	0	0	112.3	Q457 N458 A463 A464 N465 L479 F483	Q457-L461 HydrophobicContact CG-CD1 4.3Å; Q457-L461 WeakPolarHBondContact O-CB 3.31Å; Q457-L461 VanDerWaalsContact O-CG 3.31Å; Q457-L461 WeakPolarHBondContact O-CG 3.44Å; Q457-L461 PolarHBondContact O-N 2.92Å; N458-L461 PolarHBondContact O-N 3.42Å; L461-A463 VanDerWaalsContact C-N 3.34Å; L461-A464 PolarHBondContact O-N 3.29Å; L461-N465 WeakPolarHBondContact O-CB 3.34Å; L461-N465 PolarHBondContact O-N 3.46Å; L461-N465 PolarHBondContact O-ND2 3.47Å; L461-L479 HydrophobicContact CD2-CD1 3.94Å; L461-L479 HydrophobicContact CD2-CD2 3.96Å; L461-L479 HydrophobicContact CG-CD1 4.13Å; L461-F483 HydrophobicContact CD2-CZ 4.43Å
462	R	93	Very high	90.4	Very high	119 Å²	119	53.8 Å²	53.8	45%	0.449	30%	0.299	S	S	.	.	H	α-helix	trans	-62.2	-41.7	171.6	-74.7	177.2	-173.2	-155.9	6.4	111.2	V421 D428 N458 L459 N465 S466	V421-R462 HydrophobicContact CG1-CB 3.86Å; D428-R462 IonicContact OD2-CZ 2.72Å; D428-R462 IonicContact OD2-NH1 3.77Å; D428-R462 PolarHBondContact OD2-NH1 3.47Å; D428-R462 IonicContact OD2-NH2 3.76Å; N458-R462 WeakPolarHBondContact O-CB 3.47Å; N458-R462 VanDerWaalsContact O-CG 3.28Å; N458-R462 WeakPolarHBondContact O-CG 3.37Å; N458-R462 PolarHBondContact O-N 2.85Å; L459-R462 PolarHBondContact O-N 3.23Å; R462-N465 PolarHBondContact O-N 3.25Å; R462-S466 PolarHBondContact O-N 2.87Å
463	A	93.7	Very high	91	Very high	1 Å²	1	53.6 Å²	53.6	1%	0.008	30%	0.299	C	S	.	.	H	α-helix	trans	-63.2	-42.1	175.4	0	0	0	0	0	112.1	L412 Y418 L459 F460 L461 N465 S466 L475	L412-A463 HydrophobicContact CD2-CB 4.1Å; Y418-A463 HydrophobicContact CD1-CB 3.71Å; Y418-A463 HydrophobicContact CE1-CB 4.1Å; Y418-A463 HydrophobicContact CG-CB 4.11Å; L459-A463 WeakPolarHBondContact O-CB 3.28Å; L459-A463 PolarHBondContact O-N 3.17Å; F460-A463 WeakPolarHBondContact O-CB 3.37Å; F460-A463 PolarHBondContact O-N 3.17Å; L461-A463 VanDerWaalsContact C-N 3.34Å; A463-N465 VanDerWaalsContact C-N 3.34Å; A463-N465 PolarHBondContact O-N 2.94Å; A463-S466 WeakPolarHBondContact O-CB 3.48Å; A463-S466 PolarHBondContact O-N 3.19Å; A463-S466 VanDerWaalsContact O-N 3.14Å; A463-S466 PolarHBondContact O-OG 3.37Å; A463-L475 HydrophobicContact CB-CD1 3.8Å; A463-L475 HydrophobicContact CB-CD2 4.05Å
464	A	92.4	Very high	91.3	Very high	25 Å²	25	57.5 Å²	57.5	21%	0.207	32%	0.317	C	S	.	.	H	α-helix	trans	-67.4	-35.4	178.9	0	0	0	0	0	112.3	F460 L461 S466 L475	F460-A464 WeakPolarHBondContact O-CB 3.5Å; F460-A464 PolarHBondContact O-N 2.96Å; L461-A464 PolarHBondContact O-N 3.29Å; A464-S466 VanDerWaalsContact C-N 3.25Å; A464-S466 PolarHBondContact O-N 2.93Å; A464-L475 HydrophobicContact CB-CD2 3.93Å
465	N	91	Very high	91.7	Very high	114 Å²	114	55.3 Å²	55.3	61%	0.61	30%	0.303	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.6	-4.3	175.1	-73.3	-62.9	0	0	0	113.9	L461 R462 A463	L461-N465 WeakPolarHBondContact O-CB 3.34Å; L461-N465 PolarHBondContact O-N 3.46Å; L461-N465 PolarHBondContact O-ND2 3.47Å; R462-N465 PolarHBondContact O-N 3.25Å; A463-N465 VanDerWaalsContact C-N 3.34Å; A463-N465 PolarHBondContact O-N 2.94Å
466	S	89.6	Confident	92	Very high	66 Å²	66	53.9 Å²	53.9	46%	0.462	30%	0.295	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.1	-31.9	-178	70.7	0	0	0	0	113.4	R462 A463 A464	R462-S466 PolarHBondContact O-N 2.87Å; A463-S466 WeakPolarHBondContact O-CB 3.48Å; A463-S466 PolarHBondContact O-N 3.19Å; A463-S466 VanDerWaalsContact O-N 3.14Å; A463-S466 PolarHBondContact O-OG 3.37Å; A464-S466 VanDerWaalsContact C-N 3.25Å; A464-S466 PolarHBondContact O-N 2.93Å
467	D	86.1	Confident	92.2	Very high	67 Å²	67	54.2 Å²	54.2	36%	0.358	30%	0.297	S	S	.	.			trans	-135.3	86.3	166.7	-175.2	-4.1	0	0	0	110.4	S469 Q470	D467-S469 PolarHBondContact O-N 3.49Å; D467-S469 WeakPolarHBondContact OD1-CA 3.41Å; D467-S469 WeakPolarHBondContact OD1-CB 3.33Å; D467-S469 PolarHBondContact OD1-N 3.33Å; D467-S469 PolarHBondContact OD1-OG 3.11Å; D467-Q470 PolarHBondContact O-N 3.26Å; D467-Q470 PolarHBondContact OD1-N 3.36Å
468	P	84.5	Confident	92.3	Very high	112 Å²	112	52.9 Å²	52.9	73%	0.727	29%	0.291	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.1	-4.1	177.2	-20.9	34.1	0	0	0	114.4
469	S	83.4	Confident	92.5	Very high	100 Å²	100	49.7 Å²	49.7	70%	0.699	27%	0.274	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.4	-17.6	-178.7	79.1	0	0	0	0	113.6	D467	D467-S469 PolarHBondContact O-N 3.49Å; D467-S469 WeakPolarHBondContact OD1-CA 3.41Å; D467-S469 WeakPolarHBondContact OD1-CB 3.33Å; D467-S469 PolarHBondContact OD1-N 3.33Å; D467-S469 PolarHBondContact OD1-OG 3.11Å
470	Q	88.6	Confident	92.7	Very high	146 Å²	146	49.6 Å²	49.6	68%	0.682	27%	0.273	S	S	*	.	S	Bend	trans	-127.6	121.8	178.6	-60.2	-163.9	20.4	0	0	111.4	D467 D472	D467-Q470 PolarHBondContact O-N 3.26Å; D467-Q470 PolarHBondContact OD1-N 3.36Å; Q470-D472 PolarHBondContact O-N 3.02Å
471	V	91.9	Very high	92.7	Very high	61 Å²	61	49.9 Å²	49.9	37%	0.37	28%	0.275	S	S	.	.			trans	-80.6	112.4	173.4	-177.6	0	0	0	0	108.8	P473 Q476 A498 V502	V471-P473 WeakPolarHBondContact O-CD 3.12Å; V471-Q476 HydrophobicContact CG1-CG 3.68Å; V471-A498 HydrophobicContact CG1-CB 4.03Å; V471-V502 HydrophobicContact CB-CG2 3.9Å; V471-V502 HydrophobicContact CG1-CG2 4.19Å
472	D	94.8	Very high	92.7	Very high	14 Å²	14	47.2 Å²	47.2	8%	0.075	26%	0.261	C	S	.	.			trans	-83.4	115.1	170.8	-176	-58.1	0	0	0	109.8	K417 Y418 Q470 Q474 L475 Q476	K417-D472 IonicContact NZ-OD2 2.69Å; K417-D472 PolarHBondContact NZ-OD2 3.16Å; Y418-D472 WeakPolarHBondContact OH-CB 3.48Å; Y418-D472 PolarHBondContact OH-OD2 2.82Å; Y418-D472 VanDerWaalsContact OH-OD2 3.13Å; Q470-D472 PolarHBondContact O-N 3.02Å; D472-Q474 VanDerWaalsContact C-N 3.34Å; D472-Q474 PolarHBondContact O-N 3.24Å; D472-Q474 PolarHBondContact OD1-N 2.66Å; D472-Q474 PolarHBondContact OD1-OE1 2.98Å; D472-L475 HydrophobicContact CB-CB 3.86Å; D472-L475 PolarHBondContact O-N 2.88Å; D472-L475 PolarHBondContact OD1-N 3.31Å; D472-Q476 WeakPolarHBondContact O-CG 3.4Å; D472-Q476 PolarHBondContact O-N 3.42Å
473	P	95.4	Very high	92.8	Very high	15 Å²	15	42.2 Å²	42.2	10%	0.097	24%	0.243	C	C	.	.	H	α-helix	trans	-66.3	-33.2	-174.1	-22.7	35.5	0	0	0	113.5	V471 C477 A499 V502 T503	V471-P473 WeakPolarHBondContact O-CD 3.12Å; P473-C477 VanDerWaalsContact O-CB 3.31Å; P473-C477 WeakPolarHBondContact O-CB 3.43Å; P473-C477 PolarHBondContact O-N 2.71Å; P473-A499 HydrophobicContact CB-CB 4.09Å; P473-V502 HydrophobicContact CG-CB 3.84Å; P473-V502 HydrophobicContact CG-CG1 3.75Å; P473-V502 HydrophobicContact CG-CG2 4.46Å; P473-T503 HydrophobicContact CG-CG2 4.18Å
474	Q	94.3	Very high	92.7	Very high	95 Å²	95	43.3 Å²	43.3	44%	0.444	25%	0.249	S	C	.	.	H	α-helix	trans	-75.8	-37	-179.8	-66.7	79	26.1	0	0	111.3	M389 W411 D472 C477 G478	M389-Q474 WeakPolarHBondContact CE-O 3.28Å; W411-Q474 HydrophobicContact CH2-CB 4.13Å; W411-Q474 HydrophobicContact CZ2-CB 3.68Å; D472-Q474 VanDerWaalsContact C-N 3.34Å; D472-Q474 PolarHBondContact O-N 3.24Å; D472-Q474 PolarHBondContact OD1-N 2.66Å; D472-Q474 PolarHBondContact OD1-OE1 2.98Å; Q474-C477 WeakPolarHBondContact O-CB 3.12Å; Q474-C477 PolarHBondContact O-N 3.17Å; Q474-G478 PolarHBondContact O-N 3.07Å
475	L	95.9	Very high	92.6	Very high	4 Å²	4	43 Å²	43	2%	0.021	24%	0.243	C	C	.	.	H	α-helix	trans	-63.3	-46.4	171.7	-175.6	73.5	0	0	0	111.2	W411 L412 Y418 F460 A463 A464 D472 C477 G478 L479	W411-L475 HydrophobicContact CH2-CB 4.4Å; W411-L475 HydrophobicContact CZ3-CD1 3.98Å; L412-L475 HydrophobicContact CD2-CD1 3.84Å; Y418-L475 HydrophobicContact CD2-CD1 4.45Å; Y418-L475 HydrophobicContact CE1-CD2 4.06Å; Y418-L475 HydrophobicContact CE2-CB 4.3Å; Y418-L475 HydrophobicContact CE2-CD1 4.04Å; Y418-L475 HydrophobicContact CE2-CD2 4.49Å; F460-L475 HydrophobicContact CD1-CD1 3.59Å; F460-L475 HydrophobicContact CD1-CG 4.39Å; F460-L475 HydrophobicContact CE1-CD1 3.9Å; F460-L475 HydrophobicContact CG-CD1 4.44Å; A463-L475 HydrophobicContact CB-CD1 3.8Å; A463-L475 HydrophobicContact CB-CD2 4.05Å; A464-L475 HydrophobicContact CB-CD2 3.93Å; D472-L475 HydrophobicContact CB-CB 3.86Å; D472-L475 PolarHBondContact O-N 2.88Å; D472-L475 PolarHBondContact OD1-N 3.31Å; L475-C477 VanDerWaalsContact C-N 3.3Å; L475-C477 PolarHBondContact O-N 2.61Å; L475-G478 PolarHBondContact O-N 3.45Å; L475-L479 PolarHBondContact O-N 3.27Å
476	Q	96.6	Very high	92.6	Very high	31 Å²	31	39.8 Å²	39.8	15%	0.145	23%	0.23	C	C	.	.	H	α-helix	trans	-62.9	-36.4	175.9	-70.6	-62.1	-17.2	0	0	111.9	V471 D472 L479 G480 C495 A498 A499	V471-Q476 HydrophobicContact CG1-CG 3.68Å; D472-Q476 WeakPolarHBondContact O-CG 3.4Å; D472-Q476 PolarHBondContact O-N 3.42Å; Q476-L479 PolarHBondContact O-N 2.81Å; Q476-G480 PolarHBondContact O-N 2.94Å; Q476-C495 WeakPolarHBondContact O-CB 3.49Å; Q476-A498 HydrophobicContact CG-CB 4.33Å; Q476-A499 HydrophobicContact CB-CB 4.03Å
477	C	96.6	Very high	92.5	Very high	8 Å²	8	38.2 Å²	38.2	5%	0.054	22%	0.224	C	C	.	.	H	α-helix	trans	-59.9	-46.2	172	-177.6	0	0	0	0	111.7	M389 P473 Q474 L475 G480 V481 F496 L509	M389-C477 HydrophobicContact SD-CB 4.45Å; P473-C477 VanDerWaalsContact O-CB 3.31Å; P473-C477 WeakPolarHBondContact O-CB 3.43Å; P473-C477 PolarHBondContact O-N 2.71Å; Q474-C477 WeakPolarHBondContact O-CB 3.12Å; Q474-C477 PolarHBondContact O-N 3.17Å; L475-C477 VanDerWaalsContact C-N 3.3Å; L475-C477 PolarHBondContact O-N 2.61Å; C477-G480 PolarHBondContact O-N 3.44Å; C477-V481 WeakPolarHBondContact O-CG2 3.44Å; C477-V481 PolarHBondContact O-N 3.29Å; C477-F496 HydrophobicContact CB-CE1 4.42Å; C477-L509 HydrophobicContact CB-CD2 4.17Å
478	G	96.1	Very high	92.9	Very high	0 Å²	0	37.8 Å²	37.8	0%	0	22%	0.22	C	C	.	.	H	α-helix	trans	-64.9	-39.9	176.9	0	0	0	0	0	113.4	Q474 L475 V481 L482	Q474-G478 PolarHBondContact O-N 3.07Å; L475-G478 PolarHBondContact O-N 3.45Å; G478-V481 PolarHBondContact O-N 3.1Å; G478-L482 WeakPolarHBondContact O-CG 3.07Å; G478-L482 PolarHBondContact O-N 3.35Å
479	L	96.1	Very high	93.5	Very high	7 Å²	7	36.1 Å²	36.1	4%	0.037	20%	0.199	C	C	.	.	H	α-helix	trans	-66.5	-39	175	-175.6	62	0	0	0	112	F460 L461 L475 Q476 L482 F483	F460-L479 HydrophobicContact CB-CD1 4.05Å; F460-L479 HydrophobicContact CD1-CB 4.43Å; L461-L479 HydrophobicContact CD2-CD1 3.94Å; L461-L479 HydrophobicContact CD2-CD2 3.96Å; L461-L479 HydrophobicContact CG-CD1 4.13Å; L475-L479 PolarHBondContact O-N 3.27Å; Q476-L479 PolarHBondContact O-N 2.81Å; L479-L482 PolarHBondContact O-N 3.36Å; L479-F483 HydrophobicContact CD1-CD2 4.19Å; L479-F483 HydrophobicContact CD1-CE2 3.66Å; L479-F483 HydrophobicContact CD1-CZ 4.02Å; L479-F483 HydrophobicContact CD2-CE2 4Å; L479-F483 HydrophobicContact CG-CD2 3.94Å; L479-F483 HydrophobicContact CG-CE2 3.56Å; L479-F483 HydrophobicContact CG-CZ 4.39Å; L479-F483 WeakPolarHBondContact O-CD2 3.38Å; L479-F483 PolarHBondContact O-N 3.39Å
480	G	96.5	Very high	94.1	Very high	0 Å²	0	36.2 Å²	36.2	0%	0	19%	0.192	C	C	.	.	H	α-helix	trans	-62.2	-39.4	172.2	0	0	0	0	0	112.6	Q476 C477 F483 N484 A492	Q476-G480 PolarHBondContact O-N 2.94Å; C477-G480 PolarHBondContact O-N 3.44Å; G480-F483 PolarHBondContact O-N 3.26Å; G480-N484 PolarHBondContact O-N 2.68Å; G480-N484 PolarHBondContact O-ND2 3.46Å; G480-A492 WeakPolarHBondContact O-CB 3.26Å
481	V	95.3	Very high	94.5	Very high	7 Å²	7	34.2 Å²	34.2	4%	0.042	18%	0.181	C	C	.	.	H	α-helix	trans	-62.1	-44.8	172.5	171.1	0	0	0	0	111.2	V393 T396 L408 C477 G478 F483 N484 L485 F496	V393-V481 HydrophobicContact CG2-CG2 3.75Å; T396-V481 HydrophobicContact CG2-CG1 4.25Å; T396-V481 WeakPolarHBondContact OG1-CG1 3.3Å; L408-V481 HydrophobicContact CD1-CB 4.5Å; L408-V481 HydrophobicContact CD1-CG1 4.03Å; C477-V481 WeakPolarHBondContact O-CG2 3.44Å; C477-V481 PolarHBondContact O-N 3.29Å; G478-V481 PolarHBondContact O-N 3.1Å; V481-F483 PolarHBondContact O-N 2.79Å; V481-N484 PolarHBondContact O-N 3.42Å; V481-N484 VanDerWaalsContact O-N 3.14Å; V481-L485 HydrophobicContact CG1-CD1 4.4Å; V481-L485 PolarHBondContact O-N 3.28Å; V481-L485 VanDerWaalsContact O-N 3.08Å; V481-F496 HydrophobicContact CG2-CZ 4.48Å
482	L	94.9	Very high	94.7	Very high	0 Å²	0	31.3 Å²	31.3	0%	0	16%	0.164	C	C	.	.	H	α-helix	trans	-60.7	-41.6	176.1	-69.4	162.5	0	0	0	112.5	L408 F453 V456 F460 G478 L479 N484 L485 S486	L408-L482 HydrophobicContact CD1-CD1 4.33Å; L408-L482 HydrophobicContact CD1-CD2 3.68Å; L408-L482 HydrophobicContact CD1-CG 3.71Å; F453-L482 HydrophobicContact CD2-CD2 4.33Å; F453-L482 HydrophobicContact CE2-CB 4.27Å; F453-L482 HydrophobicContact CE2-CD2 3.96Å; F453-L482 WeakPolarHBondContact CE2-O 3.47Å; F453-L482 WeakPolarHBondContact CZ-O 3.31Å; V456-L482 HydrophobicContact CG1-CD1 4.02Å; V456-L482 HydrophobicContact CG1-CD2 3.91Å; F460-L482 HydrophobicContact CB-CD1 3.93Å; F460-L482 HydrophobicContact CD1-CD1 4.29Å; F460-L482 HydrophobicContact CD2-CD1 3.52Å; F460-L482 HydrophobicContact CE2-CD1 4.1Å; F460-L482 HydrophobicContact CG-CD1 3.64Å; G478-L482 WeakPolarHBondContact O-CG 3.07Å; G478-L482 PolarHBondContact O-N 3.35Å; L479-L482 PolarHBondContact O-N 3.36Å; L482-N484 VanDerWaalsContact C-N 3.33Å; L482-N484 PolarHBondContact O-N 3.32Å; L482-L485 HydrophobicContact CD2-CD1 4.43Å; L482-L485 WeakPolarHBondContact O-CB 3.48Å; L482-L485 PolarHBondContact O-N 3.03Å; L482-S486 PolarHBondContact O-N 3.2Å; L482-S486 VanDerWaalsContact O-N 3.14Å; L482-S486 PolarHBondContact O-OG 3.44Å
483	F	95.4	Very high	94.9	Very high	13 Å²	13	31.3 Å²	31.3	6%	0.057	16%	0.164	C	C	.	.	H	α-helix	trans	-70.7	-23.6	176	-73	-48.3	0	0	0	113.8	Q457 L461 L479 G480 V481 S486 G487 E488 K491 A492	Q457-F483 VanDerWaalsContact NE2-CE1 3.28Å; L461-F483 HydrophobicContact CD2-CZ 4.43Å; L479-F483 HydrophobicContact CD1-CD2 4.19Å; L479-F483 HydrophobicContact CD1-CE2 3.66Å; L479-F483 HydrophobicContact CD1-CZ 4.02Å; L479-F483 HydrophobicContact CD2-CE2 4Å; L479-F483 HydrophobicContact CG-CD2 3.94Å; L479-F483 HydrophobicContact CG-CE2 3.56Å; L479-F483 HydrophobicContact CG-CZ 4.39Å; L479-F483 WeakPolarHBondContact O-CD2 3.38Å; L479-F483 PolarHBondContact O-N 3.39Å; G480-F483 PolarHBondContact O-N 3.26Å; V481-F483 PolarHBondContact O-N 2.79Å; F483-S486 PolarHBondContact O-OG 3.45Å; F483-G487 PolarHBondContact O-N 3.42Å; F483-E488 HydrophobicContact CB-CB 4.22Å; F483-E488 HydrophobicContact CD1-CB 3.86Å; F483-E488 HydrophobicContact CD1-CG 4.42Å; F483-E488 WeakPolarHBondContact CD1-OE1 3.49Å; F483-E488 HydrophobicContact CG-CB 4.39Å; F483-E488 PolarHBondContact O-N 3.42Å; F483-K491 HydrophobicContact CB-CB 4.31Å; F483-K491 HydrophobicContact CD1-CB 3.98Å; F483-K491 HydrophobicContact CD1-CD 3.95Å; F483-K491 HydrophobicContact CD2-CB 3.6Å; F483-K491 HydrophobicContact CE1-CB 4.14Å; F483-K491 HydrophobicContact CE1-CD 3.52Å; F483-K491 HydrophobicContact CE2-CB 3.76Å; F483-K491 HydrophobicContact CE2-CD 4.3Å; F483-K491 HydrophobicContact CG-CB 3.72Å; F483-K491 HydrophobicContact CZ-CB 4.05Å; F483-K491 HydrophobicContact CZ-CD 3.73Å; F483-A492 HydrophobicContact CB-CB 3.69Å
484	N	92.2	Very high	95	Very high	25 Å²	25	36 Å²	36	13%	0.134	19%	0.189	C	C	.	.	H	α-helix	trans	-69.9	-40.1	167.2	-78.6	-90.5	0	0	0	111.4	G480 V481 L482 S486 G487 A492 T516	G480-N484 PolarHBondContact O-N 2.68Å; G480-N484 PolarHBondContact O-ND2 3.46Å; V481-N484 PolarHBondContact O-N 3.42Å; V481-N484 VanDerWaalsContact O-N 3.14Å; L482-N484 VanDerWaalsContact C-N 3.33Å; L482-N484 PolarHBondContact O-N 3.32Å; N484-S486 VanDerWaalsContact C-N 3.3Å; N484-S486 PolarHBondContact O-N 3.39Å; N484-G487 PolarHBondContact O-N 3.01Å; N484-G487 VanDerWaalsContact O-N 3.09Å; N484-A492 WeakPolarHBondContact ND2-CB 3.43Å; N484-T516 VanDerWaalsContact CG-OG1 3.28Å; N484-T516 PolarHBondContact ND2-OG1 2.81Å; N484-T516 PolarHBondContact OD1-OG1 3.03Å
485	L	89.9	Confident	95.1	Very high	18 Å²	18	31.9 Å²	31.9	9%	0.094	17%	0.17	C	C	.	.	H	α-helix	trans	-63.2	-31.9	177.9	-71.7	167.1	0	0	0	113	T396 H401 A404 F453 V481 L482	T396-L485 HydrophobicContact CG2-CD2 3.74Å; T396-L485 HydrophobicContact CG2-CG 3.91Å; H401-L485 HydrophobicContact CB-CD2 4.08Å; H401-L485 WeakPolarHBondContact CD2-CD2 3.4Å; A404-L485 HydrophobicContact CB-CD1 3.98Å; F453-L485 HydrophobicContact CE2-CB 3.92Å; V481-L485 HydrophobicContact CG1-CD1 4.4Å; V481-L485 PolarHBondContact O-N 3.28Å; V481-L485 VanDerWaalsContact O-N 3.08Å; L482-L485 HydrophobicContact CD2-CD1 4.43Å; L482-L485 WeakPolarHBondContact O-CB 3.48Å; L482-L485 PolarHBondContact O-N 3.03Å
486	S	89.8	Confident	95.2	Very high	46 Å²	46	31.8 Å²	31.8	32%	0.322	17%	0.169	S	C	.	.	T	Hydrogen-bonded Turn	trans	-89.1	-1.1	172.5	55.2	0	0	0	0	115	L482 F483 N484 E488	L482-S486 PolarHBondContact O-N 3.2Å; L482-S486 VanDerWaalsContact O-N 3.14Å; L482-S486 PolarHBondContact O-OG 3.44Å; F483-S486 PolarHBondContact O-OG 3.45Å; N484-S486 VanDerWaalsContact C-N 3.3Å; N484-S486 PolarHBondContact O-N 3.39Å; S486-E488 WeakPolarHBondContact CB-OE1 2.93Å; S486-E488 PolarHBondContact O-N 3.04Å; S486-E488 WeakPolarHBondContact OG-CG 3.22Å; S486-E488 PolarHBondContact OG-OE1 3.06Å
487	G	89.4	Confident	95.3	Very high	33 Å²	33	32.7 Å²	32.7	34%	0.34	18%	0.179	S	C	.	.	T	Hydrogen-bonded Turn	trans	70.4	13.3	-175.6	0	0	0	0	0	114.7	F483 N484 Y489	F483-G487 PolarHBondContact O-N 3.42Å; N484-G487 PolarHBondContact O-N 3.01Å; N484-G487 VanDerWaalsContact O-N 3.09Å; G487-Y489 VanDerWaalsContact O-CD2 3.24Å; G487-Y489 WeakPolarHBondContact O-CD2 3.39Å; G487-Y489 PolarHBondContact O-N 3.1Å
488	E	93.9	Very high	95.2	Very high	59 Å²	59	33.6 Å²	33.6	28%	0.276	19%	0.187	S	C	.	.			trans	-82	54.7	178.4	-64.3	177.4	-90.1	0	0	111.2	Q457 F483 S486 D490 K491 A492	Q457-E488 PolarHBondContact NE2-OE1 3.19Å; Q457-E488 VanDerWaalsContact NE2-OE1 3.07Å; F483-E488 HydrophobicContact CB-CB 4.22Å; F483-E488 HydrophobicContact CD1-CB 3.86Å; F483-E488 HydrophobicContact CD1-CG 4.42Å; F483-E488 WeakPolarHBondContact CD1-OE1 3.49Å; F483-E488 HydrophobicContact CG-CB 4.39Å; F483-E488 PolarHBondContact O-N 3.42Å; S486-E488 WeakPolarHBondContact CB-OE1 2.93Å; S486-E488 PolarHBondContact O-N 3.04Å; S486-E488 WeakPolarHBondContact OG-CG 3.22Å; S486-E488 PolarHBondContact OG-OE1 3.06Å; E488-D490 VanDerWaalsContact C-N 3.31Å; E488-D490 PolarHBondContact O-N 2.99Å; E488-D490 VanDerWaalsContact O-N 3.15Å; E488-K491 HydrophobicContact CB-CB 4.45Å; E488-K491 HydrophobicContact CB-CD 4.27Å; E488-K491 WeakPolarHBondContact O-CB 3.43Å; E488-K491 PolarHBondContact O-N 3.44Å; E488-K491 WeakPolarHBondContact OE2-CD 3.46Å; E488-K491 WeakPolarHBondContact OE2-CE 3.42Å; E488-K491 IonicContact OE2-NZ 3.82Å; E488-K491 PolarHBondContact OE2-NZ 3.22Å; E488-A492 PolarHBondContact O-N 2.98Å
489	Y	95.9	Very high	95.3	Very high	76 Å²	76	33.6 Å²	33.6	30%	0.298	19%	0.187	S	C	.	.	H	α-helix	trans	-56.2	-36.7	-166	-57.2	-62.7	0	0	0	114.6	G487 K491 A492 V493 T516 N519	G487-Y489 VanDerWaalsContact O-CD2 3.24Å; G487-Y489 WeakPolarHBondContact O-CD2 3.39Å; G487-Y489 PolarHBondContact O-N 3.1Å; Y489-K491 VanDerWaalsContact C-N 3.33Å; Y489-K491 PolarHBondContact O-N 2.96Å; Y489-A492 WeakPolarHBondContact O-CB 3.23Å; Y489-A492 PolarHBondContact O-N 3.41Å; Y489-A492 VanDerWaalsContact O-N 3.17Å; Y489-V493 WeakPolarHBondContact O-CG2 3.5Å; Y489-V493 PolarHBondContact O-N 3.02Å; Y489-T516 HydrophobicContact CD1-CG2 4.28Å; Y489-T516 WeakPolarHBondContact O-CG2 3.49Å; Y489-N519 HydrophobicContact CD1-CB 3.96Å; Y489-N519 HydrophobicContact CE1-CB 3.55Å
490	D	96.4	Very high	95.4	Very high	103 Å²	103	33.8 Å²	33.8	55%	0.551	19%	0.188	S	C	*	.	H	α-helix	trans	-63.2	-37.9	177.1	-69	-43.1	0	0	0	112.4	E488 V493 D494 R522	E488-D490 VanDerWaalsContact C-N 3.31Å; E488-D490 PolarHBondContact O-N 2.99Å; E488-D490 VanDerWaalsContact O-N 3.15Å; D490-V493 WeakPolarHBondContact O-CB 3.27Å; D490-V493 PolarHBondContact O-N 3.02Å; D490-D494 PolarHBondContact O-N 3.28Å; D490-R522 IonicContact OD1-NH1 3.97Å; D490-R522 PolarHBondContact OD1-NH1 3.4Å
491	K	96.8	Very high	95.4	Very high	103 Å²	103	38 Å²	38	45%	0.448	22%	0.218	S	C	.	.	H	α-helix	trans	-69.6	-35.5	174.6	-62.1	-176.9	-176	171.9	0	111.5	F483 E488 Y489 D494 C495	F483-K491 HydrophobicContact CB-CB 4.31Å; F483-K491 HydrophobicContact CD1-CB 3.98Å; F483-K491 HydrophobicContact CD1-CD 3.95Å; F483-K491 HydrophobicContact CD2-CB 3.6Å; F483-K491 HydrophobicContact CE1-CB 4.14Å; F483-K491 HydrophobicContact CE1-CD 3.52Å; F483-K491 HydrophobicContact CE2-CB 3.76Å; F483-K491 HydrophobicContact CE2-CD 4.3Å; F483-K491 HydrophobicContact CG-CB 3.72Å; F483-K491 HydrophobicContact CZ-CB 4.05Å; F483-K491 HydrophobicContact CZ-CD 3.73Å; E488-K491 HydrophobicContact CB-CB 4.45Å; E488-K491 HydrophobicContact CB-CD 4.27Å; E488-K491 WeakPolarHBondContact O-CB 3.43Å; E488-K491 PolarHBondContact O-N 3.44Å; E488-K491 WeakPolarHBondContact OE2-CD 3.46Å; E488-K491 WeakPolarHBondContact OE2-CE 3.42Å; E488-K491 IonicContact OE2-NZ 3.82Å; E488-K491 PolarHBondContact OE2-NZ 3.22Å; Y489-K491 VanDerWaalsContact C-N 3.33Å; Y489-K491 PolarHBondContact O-N 2.96Å; K491-D494 PolarHBondContact O-N 3.01Å; K491-C495 PolarHBondContact O-N 2.84Å; K491-C495 PolarHBondContact O-SG 2.81Å
492	A	97.6	Very high	95.4	Very high	0 Å²	0	41.3 Å²	41.3	0%	0	24%	0.238	C	C	.	.	H	α-helix	trans	-65	-40.2	172.9	0	0	0	0	0	111.9	G480 F483 N484 E488 Y489 C495 F496 T516	G480-A492 WeakPolarHBondContact O-CB 3.26Å; F483-A492 HydrophobicContact CB-CB 3.69Å; N484-A492 WeakPolarHBondContact ND2-CB 3.43Å; E488-A492 PolarHBondContact O-N 2.98Å; Y489-A492 WeakPolarHBondContact O-CB 3.23Å; Y489-A492 PolarHBondContact O-N 3.41Å; Y489-A492 VanDerWaalsContact O-N 3.17Å; A492-C495 PolarHBondContact O-N 3.38Å; A492-F496 HydrophobicContact CB-CE2 4.33Å; A492-F496 WeakPolarHBondContact O-CD2 3.18Å; A492-F496 PolarHBondContact O-N 2.86Å; A492-T516 HydrophobicContact CB-CG2 3.39Å
493	V	98.1	Very high	95.4	Very high	15 Å²	15	43.4 Å²	43.4	9%	0.091	25%	0.25	C	S	.	.	H	α-helix	trans	-58.7	-46	172.6	166.6	0	0	0	0	110.9	Y489 D490 C495 F496 S497 L513 T516 L517	Y489-V493 WeakPolarHBondContact O-CG2 3.5Å; Y489-V493 PolarHBondContact O-N 3.02Å; D490-V493 WeakPolarHBondContact O-CB 3.27Å; D490-V493 PolarHBondContact O-N 3.02Å; V493-C495 VanDerWaalsContact C-N 3.33Å; V493-C495 PolarHBondContact O-N 3.5Å; V493-F496 PolarHBondContact O-N 2.7Å; V493-S497 WeakPolarHBondContact O-CB 2.91Å; V493-S497 PolarHBondContact O-N 3.24Å; V493-S497 PolarHBondContact O-OG 3.12Å; V493-L513 HydrophobicContact CB-CD1 4.29Å; V493-L513 HydrophobicContact CG1-CD1 3.94Å; V493-L513 HydrophobicContact CG2-CD1 4.15Å; V493-T516 HydrophobicContact CG2-CG2 3.79Å; V493-L517 HydrophobicContact CG1-CD2 4.43Å; V493-L517 HydrophobicContact CG2-CD2 3.65Å; V493-L517 HydrophobicContact CG2-CG 3.98Å
494	D	97.1	Very high	95.5	Very high	114 Å²	114	45.8 Å²	45.8	61%	0.61	27%	0.267	S	S	*	.	H	α-helix	trans	-59.1	-43.4	175.6	-77.1	-20	0	0	0	111.7	D490 K491 S497 A498	D490-D494 PolarHBondContact O-N 3.28Å; K491-D494 PolarHBondContact O-N 3.01Å; D494-S497 PolarHBondContact O-N 2.62Å; D494-A498 VanDerWaalsContact O-CB 3.31Å; D494-A498 WeakPolarHBondContact O-CB 3.21Å; D494-A498 PolarHBondContact O-N 3.5Å
495	C	97.3	Very high	95.7	Very high	7 Å²	7	50.3 Å²	50.3	5%	0.047	29%	0.288	C	S	.	.	H	α-helix	trans	-63.7	-49.1	178.9	-64.7	0	0	0	0	112.2	Q476 K491 A492 V493 S497 A498 A499	Q476-C495 WeakPolarHBondContact O-CB 3.49Å; K491-C495 PolarHBondContact O-N 2.84Å; K491-C495 PolarHBondContact O-SG 2.81Å; A492-C495 PolarHBondContact O-N 3.38Å; V493-C495 VanDerWaalsContact C-N 3.33Å; V493-C495 PolarHBondContact O-N 3.5Å; C495-S497 VanDerWaalsContact C-N 3.34Å; C495-S497 PolarHBondContact O-N 3.31Å; C495-A498 PolarHBondContact O-N 3.36Å; C495-A499 PolarHBondContact O-N 3.2Å
496	F	97.9	Very high	96	Very high	3 Å²	3	51.9 Å²	51.9	1%	0.013	30%	0.296	C	S	.	.	H	α-helix	trans	-67.8	-34.2	177.9	-65.3	-56.5	0	0	0	112.4	C477 V481 A492 V493 A499 L500 L509 K512 L513 T516	C477-F496 HydrophobicContact CB-CE1 4.42Å; V481-F496 HydrophobicContact CG2-CZ 4.48Å; A492-F496 HydrophobicContact CB-CE2 4.33Å; A492-F496 WeakPolarHBondContact O-CD2 3.18Å; A492-F496 PolarHBondContact O-N 2.86Å; V493-F496 PolarHBondContact O-N 2.7Å; F496-A499 PolarHBondContact O-N 3.45Å; F496-L500 WeakPolarHBondContact O-CB 3.48Å; F496-L500 WeakPolarHBondContact O-CG 3.48Å; F496-L500 PolarHBondContact O-N 2.94Å; F496-L509 HydrophobicContact CD1-CD2 4.09Å; F496-K512 HydrophobicContact CD1-CB 3.93Å; F496-K512 HydrophobicContact CD1-CD 4.34Å; F496-K512 HydrophobicContact CD2-CB 4.37Å; F496-K512 HydrophobicContact CE1-CB 3.74Å; F496-K512 HydrophobicContact CE1-CD 3.68Å; F496-K512 HydrophobicContact CE1-CG 4.27Å; F496-K512 HydrophobicContact CE2-CB 4.19Å; F496-K512 HydrophobicContact CG-CB 4.26Å; F496-K512 HydrophobicContact CZ-CB 3.88Å; F496-K512 HydrophobicContact CZ-CD 4.22Å; F496-K512 HydrophobicContact CZ-CG 4.47Å; F496-L513 HydrophobicContact CB-CB 4.12Å; F496-L513 HydrophobicContact CB-CD1 4.39Å; F496-T516 WeakPolarHBondContact CE2-OG1 3.34Å
497	S	97.4	Very high	96.3	Very high	50 Å²	50	51.8 Å²	51.8	35%	0.35	29%	0.289	S	S	.	.	H	α-helix	trans	-65.6	-40	173.7	-59.2	0	0	0	0	111.7	V493 D494 C495 L500 S501	V493-S497 WeakPolarHBondContact O-CB 2.91Å; V493-S497 PolarHBondContact O-N 3.24Å; V493-S497 PolarHBondContact O-OG 3.12Å; D494-S497 PolarHBondContact O-N 2.62Å; C495-S497 VanDerWaalsContact C-N 3.34Å; C495-S497 PolarHBondContact O-N 3.31Å; S497-L500 PolarHBondContact O-N 3.44Å; S497-S501 PolarHBondContact O-N 3.5Å
498	A	96.2	Very high	96.7	Very high	27 Å²	27	53 Å²	53	22%	0.223	29%	0.287	C	S	.	.	H	α-helix	trans	-63.1	-44.2	173.1	0	0	0	0	0	111.5	V471 Q476 D494 C495 S501	V471-A498 HydrophobicContact CG1-CB 4.03Å; Q476-A498 HydrophobicContact CG-CB 4.33Å; D494-A498 VanDerWaalsContact O-CB 3.31Å; D494-A498 WeakPolarHBondContact O-CB 3.21Å; D494-A498 PolarHBondContact O-N 3.5Å; C495-A498 PolarHBondContact O-N 3.36Å; A498-S501 WeakPolarHBondContact O-CB 3.46Å; A498-S501 PolarHBondContact O-N 3.44Å; A498-S501 PolarHBondContact O-OG 3.01Å
499	A	97.1	Very high	96.8	Very high	0 Å²	0	50.5 Å²	50.5	0%	0	28%	0.276	C	S	.	.	H	α-helix	trans	-60.3	-47.6	174.3	0	0	0	0	0	112	P473 Q476 C495 F496 S501 V502 T503 L509	P473-A499 HydrophobicContact CB-CB 4.09Å; Q476-A499 HydrophobicContact CB-CB 4.03Å; C495-A499 PolarHBondContact O-N 3.2Å; F496-A499 PolarHBondContact O-N 3.45Å; A499-S501 VanDerWaalsContact C-N 3.25Å; A499-S501 PolarHBondContact O-N 2.77Å; A499-V502 PolarHBondContact O-N 3.23Å; A499-T503 PolarHBondContact O-N 2.9Å; A499-T503 PolarHBondContact O-OG1 3.26Å; A499-L509 HydrophobicContact CB-CD1 3.73Å; A499-L509 HydrophobicContact CB-CD2 4.05Å
500	L	97.5	Very high	96.9	Very high	11 Å²	11	49.7 Å²	49.7	6%	0.058	27%	0.272	C	S	.	.	H	α-helix	trans	-62.7	-27.1	176.9	-76.8	169	0	0	0	113.6	F496 S497 V502 T503 P504 L509 W510 L513	F496-L500 WeakPolarHBondContact O-CB 3.48Å; F496-L500 WeakPolarHBondContact O-CG 3.48Å; F496-L500 PolarHBondContact O-N 2.94Å; S497-L500 PolarHBondContact O-N 3.44Å; L500-V502 PolarHBondContact O-N 2.96Å; L500-T503 CarbonylContact O-C 3.43Å; L500-T503 PolarHBondContact O-N 2.78Å; L500-P504 WeakPolarHBondContact O-CA 3.29Å; L500-P504 WeakPolarHBondContact O-CB 3.43Å; L500-P504 WeakPolarHBondContact O-CD 3.38Å; L500-P504 VanDerWaalsContact O-N 3.09Å; L500-L509 HydrophobicContact CD2-CB 3.57Å; L500-L509 HydrophobicContact CD2-CD1 4.38Å; L500-L509 HydrophobicContact CG-CB 3.88Å; L500-W510 HydrophobicContact CD1-CD2 3.89Å; L500-W510 HydrophobicContact CD1-CE3 3.91Å; L500-W510 HydrophobicContact CD1-CG 4.42Å; L500-W510 HydrophobicContact CD1-CH2 4.32Å; L500-W510 HydrophobicContact CD1-CZ2 4.3Å; L500-W510 HydrophobicContact CD1-CZ3 4.13Å; L500-W510 HydrophobicContact CD2-CD2 4.01Å; L500-W510 HydrophobicContact CD2-CG 3.98Å; L500-W510 HydrophobicContact CD2-CZ2 4.34Å; L500-L513 HydrophobicContact CD1-CB 4.25Å; L500-L513 HydrophobicContact CD1-CD2 3.66Å
501	S	96.6	Very high	97	Very high	89 Å²	89	45.5 Å²	45.5	62%	0.622	25%	0.25	S	C	*	.	H	α-helix	trans	-63.1	-24.7	174.3	80.7	0	0	0	0	113.1	S497 A498 A499	S497-S501 PolarHBondContact O-N 3.5Å; A498-S501 WeakPolarHBondContact O-CB 3.46Å; A498-S501 PolarHBondContact O-N 3.44Å; A498-S501 PolarHBondContact O-OG 3.01Å; A499-S501 VanDerWaalsContact C-N 3.25Å; A499-S501 PolarHBondContact O-N 2.77Å
502	V	96.1	Very high	97.1	Very high	75 Å²	75	42.5 Å²	42.5	46%	0.455	24%	0.237	S	C	.	.	H	α-helix	trans	-96.6	-41.4	177.2	-177.2	0	0	0	0	111.1	V471 P473 A499 L500 P504	V471-V502 HydrophobicContact CB-CG2 3.9Å; V471-V502 HydrophobicContact CG1-CG2 4.19Å; P473-V502 HydrophobicContact CG-CB 3.84Å; P473-V502 HydrophobicContact CG-CG1 3.75Å; P473-V502 HydrophobicContact CG-CG2 4.46Å; A499-V502 PolarHBondContact O-N 3.23Å; L500-V502 PolarHBondContact O-N 2.96Å; V502-P504 VanDerWaalsContact C-CD 3.43Å; V502-P504 WeakPolarHBondContact O-CD 3.23Å
503	T	95.6	Very high	97.1	Very high	44 Å²	44	43.1 Å²	43.1	27%	0.27	24%	0.24	S	C	.	.			trans	-121.4	69.2	-178.6	49.8	0	0	0	0	112.2	P473 A499 L500 Q505 D506 L509	P473-T503 HydrophobicContact CG-CG2 4.18Å; A499-T503 PolarHBondContact O-N 2.9Å; A499-T503 PolarHBondContact O-OG1 3.26Å; L500-T503 CarbonylContact O-C 3.43Å; L500-T503 PolarHBondContact O-N 2.78Å; T503-Q505 PolarHBondContact O-N 3Å; T503-Q505 VanDerWaalsContact O-N 3.15Å; T503-D506 WeakPolarHBondContact O-CB 3.24Å; T503-D506 PolarHBondContact O-N 2.83Å; T503-D506 VanDerWaalsContact O-N 3.14Å; T503-L509 VanDerWaalsContact OG1-CD1 3.27Å; T503-L509 WeakPolarHBondContact OG1-CD1 3.33Å
504	P	96.1	Very high	97	Very high	64 Å²	64	42.4 Å²	42.4	42%	0.416	24%	0.236	S	C	.	.	T	Hydrogen-bonded Turn	trans	-71.6	-9.7	-171.5	27.9	-36.9	0	0	0	115.2	L500 V502 W510	L500-P504 WeakPolarHBondContact O-CA 3.29Å; L500-P504 WeakPolarHBondContact O-CB 3.43Å; L500-P504 WeakPolarHBondContact O-CD 3.38Å; L500-P504 VanDerWaalsContact O-N 3.09Å; V502-P504 VanDerWaalsContact C-CD 3.43Å; V502-P504 WeakPolarHBondContact O-CD 3.23Å; P504-W510 PolarHBondContact O-NE1 3.26Å
505	Q	96.4	Very high	96.9	Very high	120 Å²	120	38.1 Å²	38.1	56%	0.561	22%	0.216	S	C	*	.	T	Hydrogen-bonded Turn	trans	-102.1	8.6	176.2	-49.1	-62	3.9	0	0	112.7	T503 Y507	T503-Q505 PolarHBondContact O-N 3Å; T503-Q505 VanDerWaalsContact O-N 3.15Å; Q505-Y507 PolarHBondContact O-N 2.76Å
506	D	96.4	Very high	96.9	Very high	50 Å²	50	37.9 Å²	37.9	27%	0.267	21%	0.214	S	C	.	.			trans	-80.3	103.2	175.4	-173.1	-32.7	0	0	0	109.9	T503 L508 L509 W510	T503-D506 WeakPolarHBondContact O-CB 3.24Å; T503-D506 PolarHBondContact O-N 2.83Å; T503-D506 VanDerWaalsContact O-N 3.14Å; D506-L508 VanDerWaalsContact C-N 3.27Å; D506-L508 PolarHBondContact O-N 3Å; D506-L508 WeakPolarHBondContact OD1-CA 3.14Å; D506-L508 VanDerWaalsContact OD1-CB 3.29Å; D506-L508 WeakPolarHBondContact OD1-CB 3.37Å; D506-L508 PolarHBondContact OD1-N 3.46Å; D506-L509 HydrophobicContact CB-CB 4.15Å; D506-L509 HydrophobicContact CB-CD1 3.9Å; D506-L509 HydrophobicContact CB-CG 4.11Å; D506-L509 PolarHBondContact O-N 3.25Å; D506-L509 PolarHBondContact OD1-N 2.75Å; D506-W510 PolarHBondContact O-N 3.22Å
507	Y	96.8	Very high	96.8	Very high	44 Å²	44	38.1 Å²	38.1	17%	0.173	22%	0.216	C	C	.	.	H	α-helix	trans	-67.5	-25.6	-179.7	66.6	-91.9	0	0	0	113.1	E363 Q505 W510 N511 Q537 F540	E363-Y507 PolarHBondContact OE2-OH 3.45Å; Q505-Y507 PolarHBondContact O-N 2.76Å; Y507-W510 PolarHBondContact O-N 3.43Å; Y507-N511 PolarHBondContact O-N 3.31Å; Y507-Q537 HydrophobicContact CD1-CB 4.04Å; Y507-Q537 HydrophobicContact CD2-CB 3.81Å; Y507-Q537 HydrophobicContact CD2-CG 4.14Å; Y507-Q537 HydrophobicContact CE1-CB 4.36Å; Y507-Q537 HydrophobicContact CE1-CG 4.4Å; Y507-Q537 HydrophobicContact CE2-CB 4.13Å; Y507-Q537 HydrophobicContact CE2-CG 3.95Å; Y507-Q537 HydrophobicContact CG-CB 3.76Å; Y507-Q537 HydrophobicContact CG-CG 4.45Å; Y507-F540 AromaticContact CD2-CD1 3.56Å; Y507-F540 HydrophobicContact CD2-CD1 3.56Å; Y507-F540 AromaticContact CD2-CE1 3.61Å; Y507-F540 HydrophobicContact CD2-CE1 3.61Å; Y507-F540 HydrophobicContact CD2-CG 4.17Å; Y507-F540 HydrophobicContact CD2-CZ 4.27Å; Y507-F540 HydrophobicContact CE2-CD1 4.16Å; Y507-F540 HydrophobicContact CE2-CE1 4.21Å; Y507-F540 HydrophobicContact CE2-CG 4.35Å; Y507-F540 HydrophobicContact CE2-CZ 4.47Å
508	L	96.5	Very high	96.5	Very high	58 Å²	58	36.1 Å²	36.1	30%	0.304	20%	0.203	S	C	.	.	H	α-helix	trans	-70	-41.4	176.7	-59.2	173.5	0	0	0	110.2	E363 D506 N511 K512 F540	E363-L508 HydrophobicContact CG-CD2 3.84Å; D506-L508 VanDerWaalsContact C-N 3.27Å; D506-L508 PolarHBondContact O-N 3Å; D506-L508 WeakPolarHBondContact OD1-CA 3.14Å; D506-L508 VanDerWaalsContact OD1-CB 3.29Å; D506-L508 WeakPolarHBondContact OD1-CB 3.37Å; D506-L508 PolarHBondContact OD1-N 3.46Å; L508-N511 PolarHBondContact O-N 3.47Å; L508-K512 WeakPolarHBondContact O-CG 3.19Å; L508-K512 PolarHBondContact O-N 3.47Å; L508-F540 HydrophobicContact CD2-CE1 4.35Å; L508-F540 HydrophobicContact CD2-CE2 4.2Å; L508-F540 HydrophobicContact CD2-CZ 3.77Å
509	L	97.5	Very high	96.3	Very high	7 Å²	7	39.2 Å²	39.2	4%	0.037	22%	0.215	C	C	.	.	H	α-helix	trans	-65.4	-38.9	173.9	-71.1	176.7	0	0	0	112.3	C477 F496 A499 L500 T503 D506 N511 K512 L513	C477-L509 HydrophobicContact CB-CD2 4.17Å; F496-L509 HydrophobicContact CD1-CD2 4.09Å; A499-L509 HydrophobicContact CB-CD1 3.73Å; A499-L509 HydrophobicContact CB-CD2 4.05Å; L500-L509 HydrophobicContact CD2-CB 3.57Å; L500-L509 HydrophobicContact CD2-CD1 4.38Å; L500-L509 HydrophobicContact CG-CB 3.88Å; T503-L509 VanDerWaalsContact OG1-CD1 3.27Å; T503-L509 WeakPolarHBondContact OG1-CD1 3.33Å; D506-L509 HydrophobicContact CB-CB 4.15Å; D506-L509 HydrophobicContact CB-CD1 3.9Å; D506-L509 HydrophobicContact CB-CG 4.11Å; D506-L509 PolarHBondContact O-N 3.25Å; D506-L509 PolarHBondContact OD1-N 2.75Å; L509-N511 PolarHBondContact O-N 3.46Å; L509-K512 HydrophobicContact CD2-CD 4.44Å; L509-K512 PolarHBondContact O-N 3.36Å; L509-L513 WeakPolarHBondContact O-CB 3.32Å; L509-L513 PolarHBondContact O-N 2.88Å
510	W	98.4	Very high	96	Very high	59 Å²	59	40.2 Å²	40.2	22%	0.223	23%	0.226	C	C	.	.	H	α-helix	trans	-60.8	-42.6	173.3	-79	111.1	0	0	0	112.4	L500 P504 D506 Y507 L513 G514 A529 R532 A533	L500-W510 HydrophobicContact CD1-CD2 3.89Å; L500-W510 HydrophobicContact CD1-CE3 3.91Å; L500-W510 HydrophobicContact CD1-CG 4.42Å; L500-W510 HydrophobicContact CD1-CH2 4.32Å; L500-W510 HydrophobicContact CD1-CZ2 4.3Å; L500-W510 HydrophobicContact CD1-CZ3 4.13Å; L500-W510 HydrophobicContact CD2-CD2 4.01Å; L500-W510 HydrophobicContact CD2-CG 3.98Å; L500-W510 HydrophobicContact CD2-CZ2 4.34Å; P504-W510 PolarHBondContact O-NE1 3.26Å; D506-W510 PolarHBondContact O-N 3.22Å; Y507-W510 PolarHBondContact O-N 3.43Å; W510-L513 HydrophobicContact CE3-CD2 4.06Å; W510-L513 HydrophobicContact CZ3-CD2 3.92Å; W510-L513 PolarHBondContact O-N 3.33Å; W510-G514 PolarHBondContact O-N 3.11Å; W510-A529 HydrophobicContact CE3-CB 4.2Å; W510-R532 HydrophobicContact CD2-CB 4.02Å; W510-R532 HydrophobicContact CD2-CG 3.58Å; W510-R532 HydrophobicContact CE3-CB 4.1Å; W510-R532 HydrophobicContact CE3-CG 4.04Å; W510-R532 HydrophobicContact CG-CB 4.33Å; W510-R532 HydrophobicContact CG-CG 3.93Å; W510-R532 HydrophobicContact CH2-CG 4.38Å; W510-R532 HydrophobicContact CZ2-CG 3.95Å; W510-R532 HydrophobicContact CZ3-CG 4.42Å; W510-A533 HydrophobicContact CB-CB 3.85Å
511	N	97.9	Very high	95.7	Very high	15 Å²	15	45 Å²	45	8%	0.08	26%	0.26	C	S	.	.	H	α-helix	trans	-67.9	-36.1	174.3	171.1	80.3	0	0	0	113	Y507 L508 L509 G514 A515 Y530 A533 F540 S543 N546	Y507-N511 PolarHBondContact O-N 3.31Å; L508-N511 PolarHBondContact O-N 3.47Å; L509-N511 PolarHBondContact O-N 3.46Å; N511-G514 PolarHBondContact O-N 3.49Å; N511-A515 WeakPolarHBondContact O-CB 3.49Å; N511-A515 PolarHBondContact O-N 2.85Å; N511-Y530 WeakPolarHBondContact OD1-CE1 3.44Å; N511-A533 HydrophobicContact CB-CB 4.3Å; N511-F540 HydrophobicContact CB-CD1 4.46Å; N511-F540 HydrophobicContact CB-CE1 3.37Å; N511-F540 HydrophobicContact CB-CZ 3.7Å; N511-S543 WeakPolarHBondContact OD1-CA 3.21Å; N511-N546 PolarHBondContact OD1-ND2 2.98Å
512	K	97.6	Very high	95.6	Very high	40 Å²	40	44.3 Å²	44.3	17%	0.174	24%	0.244	C	C	.	.	H	α-helix	trans	-64.4	-44.3	174	-71.5	175.8	-159	-55.8	0	111.9	V393 F496 L508 L509 G514 A515 T516	V393-K512 VanDerWaalsContact CG2-NZ 3.28Å; F496-K512 HydrophobicContact CD1-CB 3.93Å; F496-K512 HydrophobicContact CD1-CD 4.34Å; F496-K512 HydrophobicContact CD2-CB 4.37Å; F496-K512 HydrophobicContact CE1-CB 3.74Å; F496-K512 HydrophobicContact CE1-CD 3.68Å; F496-K512 HydrophobicContact CE1-CG 4.27Å; F496-K512 HydrophobicContact CE2-CB 4.19Å; F496-K512 HydrophobicContact CG-CB 4.26Å; F496-K512 HydrophobicContact CZ-CB 3.88Å; F496-K512 HydrophobicContact CZ-CD 4.22Å; F496-K512 HydrophobicContact CZ-CG 4.47Å; L508-K512 WeakPolarHBondContact O-CG 3.19Å; L508-K512 PolarHBondContact O-N 3.47Å; L509-K512 HydrophobicContact CD2-CD 4.44Å; L509-K512 PolarHBondContact O-N 3.36Å; K512-G514 VanDerWaalsContact C-N 3.33Å; K512-G514 PolarHBondContact O-N 2.99Å; K512-A515 PolarHBondContact O-N 2.86Å; K512-T516 PolarHBondContact O-N 3.48Å; K512-T516 PolarHBondContact O-OG1 2.81Å
513	L	98.1	Very high	95.4	Very high	13 Å²	13	41.3 Å²	41.3	7%	0.068	23%	0.226	C	C	.	.	H	α-helix	trans	-57.9	-46.1	172.9	175.6	61.7	0	0	0	111	V493 F496 L500 L509 W510 A515 T516 L517 A529	V493-L513 HydrophobicContact CB-CD1 4.29Å; V493-L513 HydrophobicContact CG1-CD1 3.94Å; V493-L513 HydrophobicContact CG2-CD1 4.15Å; F496-L513 HydrophobicContact CB-CB 4.12Å; F496-L513 HydrophobicContact CB-CD1 4.39Å; L500-L513 HydrophobicContact CD1-CB 4.25Å; L500-L513 HydrophobicContact CD1-CD2 3.66Å; L509-L513 WeakPolarHBondContact O-CB 3.32Å; L509-L513 PolarHBondContact O-N 2.88Å; W510-L513 HydrophobicContact CE3-CD2 4.06Å; W510-L513 HydrophobicContact CZ3-CD2 3.92Å; W510-L513 PolarHBondContact O-N 3.33Å; L513-A515 PolarHBondContact O-N 2.83Å; L513-T516 PolarHBondContact O-N 3.18Å; L513-L517 HydrophobicContact CD1-CD1 3.96Å; L513-L517 HydrophobicContact CD1-CG 4.19Å; L513-L517 HydrophobicContact CG-CD1 3.88Å; L513-L517 WeakPolarHBondContact O-CB 3.41Å; L513-L517 VanDerWaalsContact O-CG 3.27Å; L513-L517 WeakPolarHBondContact O-CG 3.38Å; L513-L517 PolarHBondContact O-N 2.89Å; L513-A529 HydrophobicContact CD2-CB 4.48Å; L513-A529 HydrophobicContact CG-CB 4.36Å
514	G	97.4	Very high	95.3	Very high	0 Å²	0	46.6 Å²	46.6	0%	0	25%	0.248	C	C	.	.	H	α-helix	trans	-57.9	-46.4	174.3	0	0	0	0	0	112.9	W510 N511 K512 T516 L517 A518 A526 Y530	W510-G514 PolarHBondContact O-N 3.11Å; N511-G514 PolarHBondContact O-N 3.49Å; K512-G514 VanDerWaalsContact C-N 3.33Å; K512-G514 PolarHBondContact O-N 2.99Å; G514-T516 PolarHBondContact O-N 3.18Å; G514-L517 PolarHBondContact O-N 3.09Å; G514-A518 WeakPolarHBondContact O-CB 3.41Å; G514-A518 PolarHBondContact O-N 3.31Å; G514-A526 VanDerWaalsContact O-CB 3.3Å; G514-A526 WeakPolarHBondContact O-CB 3.43Å; G514-Y530 PolarHBondContact O-OH 2.69Å; G514-Y530 VanDerWaalsContact O-OH 3.14Å
515	A	95.1	Very high	95.3	Very high	24 Å²	24	48.1 Å²	48.1	20%	0.198	25%	0.25	C	C	.	.	H	α-helix	trans	-61.3	-46.1	179.4	0	0	0	0	0	111.6	N511 K512 L513 L517 A518 N519 Y530	N511-A515 WeakPolarHBondContact O-CB 3.49Å; N511-A515 PolarHBondContact O-N 2.85Å; K512-A515 PolarHBondContact O-N 2.86Å; L513-A515 PolarHBondContact O-N 2.83Å; A515-L517 PolarHBondContact O-N 3.12Å; A515-A518 PolarHBondContact O-N 3.37Å; A515-N519 WeakPolarHBondContact O-CB 3.43Å; A515-N519 PolarHBondContact O-N 2.86Å; A515-N519 PolarHBondContact O-ND2 2.91Å; A515-N519 PolarHBondContact O-OD1 3.43Å; A515-Y530 WeakPolarHBondContact CA-OH 3.33Å; A515-Y530 PolarHBondContact N-OH 3.46Å
516	T	96.4	Very high	95.3	Very high	2 Å²	2	42.4 Å²	42.4	1%	0.012	22%	0.223	C	C	.	.	H	α-helix	trans	-63.9	-40	175.8	-62.3	0	0	0	0	112.7	N484 Y489 A492 V493 F496 K512 L513 G514 G520	N484-T516 VanDerWaalsContact CG-OG1 3.28Å; N484-T516 PolarHBondContact ND2-OG1 2.81Å; N484-T516 PolarHBondContact OD1-OG1 3.03Å; Y489-T516 HydrophobicContact CD1-CG2 4.28Å; Y489-T516 WeakPolarHBondContact O-CG2 3.49Å; A492-T516 HydrophobicContact CB-CG2 3.39Å; V493-T516 HydrophobicContact CG2-CG2 3.79Å; F496-T516 WeakPolarHBondContact CE2-OG1 3.34Å; K512-T516 PolarHBondContact O-N 3.48Å; K512-T516 PolarHBondContact O-OG1 2.81Å; L513-T516 PolarHBondContact O-N 3.18Å; G514-T516 PolarHBondContact O-N 3.18Å; T516-G520 PolarHBondContact O-N 3.31Å
517	L	96.4	Very high	95.3	Very high	8 Å²	8	40.8 Å²	40.8	4%	0.042	22%	0.215	C	C	.	.	H	α-helix	trans	-64.3	-44.4	175.2	-73.7	165.5	0	0	0	111.4	V493 L513 G514 A515 G520 S521 R522 E525 A526 A529	V493-L517 HydrophobicContact CG1-CD2 4.43Å; V493-L517 HydrophobicContact CG2-CD2 3.65Å; V493-L517 HydrophobicContact CG2-CG 3.98Å; L513-L517 HydrophobicContact CD1-CD1 3.96Å; L513-L517 HydrophobicContact CD1-CG 4.19Å; L513-L517 HydrophobicContact CG-CD1 3.88Å; L513-L517 WeakPolarHBondContact O-CB 3.41Å; L513-L517 VanDerWaalsContact O-CG 3.27Å; L513-L517 WeakPolarHBondContact O-CG 3.38Å; L513-L517 PolarHBondContact O-N 2.89Å; G514-L517 PolarHBondContact O-N 3.09Å; A515-L517 PolarHBondContact O-N 3.12Å; L517-G520 CarbonylContact O-C 3.54Å; L517-G520 PolarHBondContact O-N 2.6Å; L517-S521 PolarHBondContact O-N 3.16Å; L517-R522 HydrophobicContact CB-CB 4.36Å; L517-R522 HydrophobicContact CD2-CB 4.09Å; L517-R522 VanDerWaalsContact CD2-CZ 3.48Å; L517-R522 CarbonylContact O-C 3.6Å; L517-R522 WeakPolarHBondContact O-CA 3.41Å; L517-R522 WeakPolarHBondContact O-CB 3.18Å; L517-R522 PolarHBondContact O-N 2.94Å; L517-E525 HydrophobicContact CD1-CB 3.98Å; L517-E525 HydrophobicContact CD2-CB 4.2Å; L517-A526 HydrophobicContact CB-CB 3.81Å; L517-A529 HydrophobicContact CD1-CB 4.48Å
518	A	91.5	Very high	95.3	Very high	9 Å²	9	41.6 Å²	41.6	7%	0.074	23%	0.231	C	C	.	.	H	α-helix	trans	-63.3	-45.3	177.6	0	0	0	0	0	111.9	G514 A515 G520 S521 A526	G514-A518 WeakPolarHBondContact O-CB 3.41Å; G514-A518 PolarHBondContact O-N 3.31Å; A515-A518 PolarHBondContact O-N 3.37Å; A518-G520 VanDerWaalsContact C-N 3.3Å; A518-G520 PolarHBondContact O-N 3.46Å; A518-S521 PolarHBondContact O-N 3.09Å; A518-A526 HydrophobicContact CB-CB 3.92Å
519	N	90.1	Very high	95.3	Very high	91 Å²	91	39 Å²	39	49%	0.487	22%	0.218	S	C	.	.	H	α-helix	trans	-63.7	-35.8	175.9	-66.4	-10.8	0	0	0	112	Y489 A515 S521	Y489-N519 HydrophobicContact CD1-CB 3.96Å; Y489-N519 HydrophobicContact CE1-CB 3.55Å; A515-N519 WeakPolarHBondContact O-CB 3.43Å; A515-N519 PolarHBondContact O-N 2.86Å; A515-N519 PolarHBondContact O-ND2 2.91Å; A515-N519 PolarHBondContact O-OD1 3.43Å; N519-S521 PolarHBondContact O-N 2.98Å
520	G	91.6	Very high	95.4	Very high	22 Å²	22	38.9 Å²	38.9	23%	0.227	22%	0.217	C	C	.	.	T	Hydrogen-bonded Turn	trans	-76.4	17.9	171.2	0	0	0	0	0	115	T516 L517 A518 R522	T516-G520 PolarHBondContact O-N 3.31Å; L517-G520 CarbonylContact O-C 3.54Å; L517-G520 PolarHBondContact O-N 2.6Å; A518-G520 VanDerWaalsContact C-N 3.3Å; A518-G520 PolarHBondContact O-N 3.46Å; G520-R522 PolarHBondContact O-N 2.88Å; G520-R522 VanDerWaalsContact O-N 3.16Å
521	S	91.3	Very high	95.3	Very high	111 Å²	111	42.9 Å²	42.9	78%	0.776	23%	0.232	S	C	*	.	T	Hydrogen-bonded Turn	trans	61	16.9	-179.3	-57.5	0	0	0	0	115.7	L517 A518 N519 S523	L517-S521 PolarHBondContact O-N 3.16Å; A518-S521 PolarHBondContact O-N 3.09Å; N519-S521 PolarHBondContact O-N 2.98Å; S521-S523 PolarHBondContact O-N 3.44Å
522	R	93.9	Very high	95.3	Very high	75 Å²	75	45.9 Å²	45.9	28%	0.283	24%	0.242	S	C	.	.			trans	-101.9	49.8	179.8	-66.6	163.6	63.5	-172.3	-6.4	111.2	D490 L517 G520 E524 E525 A526	D490-R522 IonicContact OD1-NH1 3.97Å; D490-R522 PolarHBondContact OD1-NH1 3.4Å; L517-R522 HydrophobicContact CB-CB 4.36Å; L517-R522 HydrophobicContact CD2-CB 4.09Å; L517-R522 VanDerWaalsContact CD2-CZ 3.48Å; L517-R522 CarbonylContact O-C 3.6Å; L517-R522 WeakPolarHBondContact O-CA 3.41Å; L517-R522 WeakPolarHBondContact O-CB 3.18Å; L517-R522 PolarHBondContact O-N 2.94Å; G520-R522 PolarHBondContact O-N 2.88Å; G520-R522 VanDerWaalsContact O-N 3.16Å; R522-E524 VanDerWaalsContact C-N 3.29Å; R522-E524 PolarHBondContact O-N 3.09Å; R522-E525 IonicContact CZ-OE1 3.01Å; R522-E525 IonicContact CZ-OE2 3.8Å; R522-E525 IonicContact NE-OE1 2.7Å; R522-E525 PolarHBondContact NE-OE1 3.45Å; R522-E525 IonicContact NE-OE2 3.3Å; R522-E525 VanDerWaalsContact NH2-CD 3.29Å; R522-E525 IonicContact NH2-OE1 3.5Å; R522-E525 PolarHBondContact NH2-OE1 3.13Å; R522-E525 VanDerWaalsContact NH2-OE1 3.07Å; R522-E525 IonicContact NH2-OE2 2.66Å; R522-E525 PolarHBondContact NH2-OE2 2.89Å; R522-E525 PolarHBondContact O-N 3.19Å; R522-E525 VanDerWaalsContact O-N 3.12Å; R522-A526 PolarHBondContact O-N 2.97Å; R522-A526 VanDerWaalsContact O-N 3.08Å
523	S	93.4	Very high	95.3	Very high	11 Å²	11	44 Å²	44	8%	0.077	23%	0.233	C	C	.	.	H	α-helix	trans	-59.5	-31.2	-172.1	-59.8	0	0	0	0	114.3	S521 A526 V527 N553	S521-S523 PolarHBondContact O-N 3.44Å; S523-A526 WeakPolarHBondContact O-CB 3.46Å; S523-A526 PolarHBondContact O-N 3.39Å; S523-V527 WeakPolarHBondContact O-CG2 3.43Å; S523-V527 PolarHBondContact O-N 3.43Å; S523-V527 VanDerWaalsContact O-N 3.09Å; S523-N553 WeakPolarHBondContact OG-CB 3.45Å
524	E	93.6	Very high	95.2	Very high	156 Å²	156	44.3 Å²	44.3	73%	0.729	24%	0.235	S	C	*	.	H	α-helix	trans	-64.2	-41.6	175.7	-62.8	-171.9	170.8	0	0	112.5	R522 L554	R522-E524 VanDerWaalsContact C-N 3.29Å; R522-E524 PolarHBondContact O-N 3.09Å; E524-L554 HydrophobicContact CG-CD1 4.38Å; E524-L554 HydrophobicContact CG-CD2 3.62Å
525	E	95	Very high	95.1	Very high	96 Å²	96	50.4 Å²	50.4	45%	0.449	26%	0.264	S	S	.	.	H	α-helix	trans	-72	-35.6	176.4	-64.2	179.2	-102.2	0	0	111	L517 R522 V527 A528 A529	L517-E525 HydrophobicContact CD1-CB 3.98Å; L517-E525 HydrophobicContact CD2-CB 4.2Å; R522-E525 IonicContact CZ-OE1 3.01Å; R522-E525 IonicContact CZ-OE2 3.8Å; R522-E525 IonicContact NE-OE1 2.7Å; R522-E525 PolarHBondContact NE-OE1 3.45Å; R522-E525 IonicContact NE-OE2 3.3Å; R522-E525 VanDerWaalsContact NH2-CD 3.29Å; R522-E525 IonicContact NH2-OE1 3.5Å; R522-E525 PolarHBondContact NH2-OE1 3.13Å; R522-E525 VanDerWaalsContact NH2-OE1 3.07Å; R522-E525 IonicContact NH2-OE2 2.66Å; R522-E525 PolarHBondContact NH2-OE2 2.89Å; R522-E525 PolarHBondContact O-N 3.19Å; R522-E525 VanDerWaalsContact O-N 3.12Å; E525-V527 VanDerWaalsContact C-N 3.33Å; E525-V527 PolarHBondContact O-N 2.85Å; E525-A528 WeakPolarHBondContact O-CB 3.4Å; E525-A528 PolarHBondContact O-N 2.85Å; E525-A528 VanDerWaalsContact O-N 3.14Å; E525-A529 PolarHBondContact O-N 3.33Å
526	A	96.3	Very high	95.2	Very high	0 Å²	0	51.6 Å²	51.6	0%	0	27%	0.267	C	S	.	.	H	α-helix	trans	-58.3	-43.4	175.4	0	0	0	0	0	112	G514 L517 A518 R522 S523 A528 A529 Y530	G514-A526 VanDerWaalsContact O-CB 3.3Å; G514-A526 WeakPolarHBondContact O-CB 3.43Å; L517-A526 HydrophobicContact CB-CB 3.81Å; A518-A526 HydrophobicContact CB-CB 3.92Å; R522-A526 PolarHBondContact O-N 2.97Å; R522-A526 VanDerWaalsContact O-N 3.08Å; S523-A526 WeakPolarHBondContact O-CB 3.46Å; S523-A526 PolarHBondContact O-N 3.39Å; A526-A528 PolarHBondContact O-N 3.44Å; A526-A529 PolarHBondContact O-N 3.17Å; A526-Y530 HydrophobicContact CB-CD2 4.28Å; A526-Y530 HydrophobicContact CB-CE2 3.73Å; A526-Y530 WeakPolarHBondContact O-CD2 3.48Å; A526-Y530 PolarHBondContact O-N 3.25Å
527	V	96.8	Very high	95.1	Very high	16 Å²	16	52.3 Å²	52.3	10%	0.097	27%	0.27	C	S	.	.	H	α-helix	trans	-53.8	-40.4	175.1	167.3	0	0	0	0	111.9	S523 E525 R531 L547 L554	S523-V527 WeakPolarHBondContact O-CG2 3.43Å; S523-V527 PolarHBondContact O-N 3.43Å; S523-V527 VanDerWaalsContact O-N 3.09Å; E525-V527 VanDerWaalsContact C-N 3.33Å; E525-V527 PolarHBondContact O-N 2.85Å; V527-R531 WeakPolarHBondContact O-CB 3.36Å; V527-R531 VanDerWaalsContact O-CG 3.27Å; V527-R531 WeakPolarHBondContact O-CG 3.5Å; V527-R531 PolarHBondContact O-N 3.03Å; V527-L547 HydrophobicContact CB-CD1 4.12Å; V527-L547 HydrophobicContact CG1-CD1 3.92Å; V527-L547 HydrophobicContact CG2-CD1 3.86Å; V527-L554 HydrophobicContact CG2-CD1 3.99Å
528	A	96.5	Very high	94.9	Very high	61 Å²	61	55.5 Å²	55.5	50%	0.504	29%	0.291	S	S	.	.	H	α-helix	trans	-67.2	-41.1	177.4	0	0	0	0	0	112.1	E525 A526 R532	E525-A528 WeakPolarHBondContact O-CB 3.4Å; E525-A528 PolarHBondContact O-N 2.85Å; E525-A528 VanDerWaalsContact O-N 3.14Å; A526-A528 PolarHBondContact O-N 3.44Å; A528-R532 PolarHBondContact O-N 3.29Å
529	A	97.5	Very high	94.8	Very high	4 Å²	4	55.3 Å²	55.3	3%	0.033	29%	0.29	C	S	.	.	H	α-helix	trans	-65.7	-43.1	177	0	0	0	0	0	112.4	W510 L513 L517 E525 A526 R532 A533	W510-A529 HydrophobicContact CE3-CB 4.2Å; L513-A529 HydrophobicContact CD2-CB 4.48Å; L513-A529 HydrophobicContact CG-CB 4.36Å; L517-A529 HydrophobicContact CD1-CB 4.48Å; E525-A529 PolarHBondContact O-N 3.33Å; A526-A529 PolarHBondContact O-N 3.17Å; A529-R532 PolarHBondContact O-N 3.43Å; A529-A533 PolarHBondContact O-N 2.88Å
530	Y	98	Very high	95	Very high	4 Å²	4	51.1 Å²	51.1	2%	0.016	27%	0.268	C	S	.	.	H	α-helix	trans	-68	-39.7	175.7	-60.9	-56.9	0	0	0	112.9	N511 G514 A515 A526 R532 A533 L534 S543 N546 L547 S550	N511-Y530 WeakPolarHBondContact OD1-CE1 3.44Å; G514-Y530 PolarHBondContact O-OH 2.69Å; G514-Y530 VanDerWaalsContact O-OH 3.14Å; A515-Y530 WeakPolarHBondContact CA-OH 3.33Å; A515-Y530 PolarHBondContact N-OH 3.46Å; A526-Y530 HydrophobicContact CB-CD2 4.28Å; A526-Y530 HydrophobicContact CB-CE2 3.73Å; A526-Y530 WeakPolarHBondContact O-CD2 3.48Å; A526-Y530 PolarHBondContact O-N 3.25Å; Y530-R532 PolarHBondContact O-N 3.01Å; Y530-A533 PolarHBondContact O-N 3.4Å; Y530-A533 VanDerWaalsContact O-N 3.15Å; Y530-L534 WeakPolarHBondContact O-CG 3.4Å; Y530-L534 PolarHBondContact O-N 3.18Å; Y530-S543 WeakPolarHBondContact CD1-OG 3.48Å; Y530-N546 HydrophobicContact CD1-CB 4.03Å; Y530-N546 HydrophobicContact CE1-CB 3.4Å; Y530-N546 HydrophobicContact CE2-CB 4.2Å; Y530-N546 VanDerWaalsContact CZ-CB 3.47Å; Y530-L547 HydrophobicContact CD2-CB 4.31Å; Y530-L547 HydrophobicContact CD2-CD1 4.44Å; Y530-L547 HydrophobicContact CG-CB 4.32Å; Y530-S550 VanDerWaalsContact CE2-OG 3.22Å; Y530-S550 WeakPolarHBondContact CE2-OG 3.47Å
531	R	97.1	Very high	95.2	Very high	142 Å²	142	50.1 Å²	50.1	54%	0.536	26%	0.257	S	S	.	.	H	α-helix	trans	-57.7	-41.5	172	-77.4	176	-179.6	176.8	2.8	110.5	V527 L534 E535	V527-R531 WeakPolarHBondContact O-CB 3.36Å; V527-R531 VanDerWaalsContact O-CG 3.27Å; V527-R531 WeakPolarHBondContact O-CG 3.5Å; V527-R531 PolarHBondContact O-N 3.03Å; R531-L534 PolarHBondContact O-N 3.28Å; R531-E535 WeakPolarHBondContact O-CG 3.48Å; R531-E535 PolarHBondContact O-N 2.94Å
532	R	97.6	Very high	95.4	Very high	78 Å²	78	45.8 Å²	45.8	29%	0.294	22%	0.224	S	C	.	.	H	α-helix	trans	-66	-37.2	175.6	-173.8	57.7	-172.2	161.5	8.9	113.3	W510 A528 A529 Y530 E535 L536	W510-R532 HydrophobicContact CD2-CB 4.02Å; W510-R532 HydrophobicContact CD2-CG 3.58Å; W510-R532 HydrophobicContact CE3-CB 4.1Å; W510-R532 HydrophobicContact CE3-CG 4.04Å; W510-R532 HydrophobicContact CG-CB 4.33Å; W510-R532 HydrophobicContact CG-CG 3.93Å; W510-R532 HydrophobicContact CH2-CG 4.38Å; W510-R532 HydrophobicContact CZ2-CG 3.95Å; W510-R532 HydrophobicContact CZ3-CG 4.42Å; A528-R532 PolarHBondContact O-N 3.29Å; A529-R532 PolarHBondContact O-N 3.43Å; Y530-R532 PolarHBondContact O-N 3.01Å; R532-E535 VanDerWaalsContact CD-OE2 3.3Å; R532-E535 WeakPolarHBondContact CD-OE2 3.16Å; R532-E535 IonicContact CZ-OE2 2.61Å; R532-E535 IonicContact NE-OE2 3.81Å; R532-E535 IonicContact NH1-OE2 3.72Å; R532-E535 PolarHBondContact NH1-OE2 3.43Å; R532-L536 WeakPolarHBondContact O-CG 3.37Å; R532-L536 PolarHBondContact O-N 2.83Å
533	A	97.5	Very high	95.5	Very high	0 Å²	0	42.2 Å²	42.2	0%	0	21%	0.21	C	C	.	.	H	α-helix	trans	-64.3	-42.6	172.7	0	0	0	0	0	112	W510 N511 A529 Y530 L536 Q537 F540	W510-A533 HydrophobicContact CB-CB 3.85Å; N511-A533 HydrophobicContact CB-CB 4.3Å; A529-A533 PolarHBondContact O-N 2.88Å; Y530-A533 PolarHBondContact O-N 3.4Å; Y530-A533 VanDerWaalsContact O-N 3.15Å; A533-L536 PolarHBondContact O-N 3.04Å; A533-Q537 PolarHBondContact O-N 3.42Å; A533-F540 HydrophobicContact CB-CD1 4.27Å; A533-F540 HydrophobicContact CB-CE1 4.36Å
534	L	96.2	Very high	95.7	Very high	20 Å²	20	43.3 Å²	43.3	11%	0.105	21%	0.213	C	C	.	.	H	α-helix	trans	-74.1	-27.3	179.1	-67.2	169.3	0	0	0	113.6	Y530 R531 L536 Q537 P538 F540 R544 L547	Y530-L534 WeakPolarHBondContact O-CG 3.4Å; Y530-L534 PolarHBondContact O-N 3.18Å; R531-L534 PolarHBondContact O-N 3.28Å; L534-L536 VanDerWaalsContact C-N 3.27Å; L534-Q537 CarbonylContact O-C 3.59Å; L534-P538 VanDerWaalsContact O-CA 3.27Å; L534-P538 WeakPolarHBondContact O-CA 3.33Å; L534-P538 WeakPolarHBondContact O-CG 3.42Å; L534-F540 HydrophobicContact CD2-CB 4.33Å; L534-R544 HydrophobicContact CD1-CB 4.35Å; L534-R544 HydrophobicContact CD2-CB 4.15Å; L534-L547 HydrophobicContact CD1-CD2 3.82Å
535	E	96.4	Very high	95.8	Very high	129 Å²	129	37.3 Å²	37.3	60%	0.603	18%	0.183	S	C	*	.	H	α-helix	trans	-62.6	-35.2	167.7	-80.7	174.9	-172.7	0	0	112.1	R531 R532	R531-E535 WeakPolarHBondContact O-CG 3.48Å; R531-E535 PolarHBondContact O-N 2.94Å; R532-E535 VanDerWaalsContact CD-OE2 3.3Å; R532-E535 WeakPolarHBondContact CD-OE2 3.16Å; R532-E535 IonicContact CZ-OE2 2.61Å; R532-E535 IonicContact NE-OE2 3.81Å; R532-E535 IonicContact NH1-OE2 3.72Å; R532-E535 PolarHBondContact NH1-OE2 3.43Å
536	L	95.7	Very high	95.8	Very high	49 Å²	49	33.9 Å²	33.9	26%	0.257	17%	0.168	S	C	.	.	H	α-helix	trans	-82.7	-40.8	179.5	-68.4	169.9	0	0	0	111.9	R532 A533 L534	R532-L536 WeakPolarHBondContact O-CG 3.37Å; R532-L536 PolarHBondContact O-N 2.83Å; A533-L536 PolarHBondContact O-N 3.04Å; L534-L536 VanDerWaalsContact C-N 3.27Å
537	Q	94.8	Very high	95.8	Very high	17 Å²	17	34.1 Å²	34.1	8%	0.079	17%	0.169	C	C	.	.			trans	-137.7	87.3	-178.2	-172	69.9	-24	0	0	110.8	M328 Y507 A533 L534 G539 F540	M328-Q537 PolarHBondContact O-NE2 2.96Å; Y507-Q537 HydrophobicContact CD1-CB 4.04Å; Y507-Q537 HydrophobicContact CD2-CB 3.81Å; Y507-Q537 HydrophobicContact CD2-CG 4.14Å; Y507-Q537 HydrophobicContact CE1-CB 4.36Å; Y507-Q537 HydrophobicContact CE1-CG 4.4Å; Y507-Q537 HydrophobicContact CE2-CB 4.13Å; Y507-Q537 HydrophobicContact CE2-CG 3.95Å; Y507-Q537 HydrophobicContact CG-CB 3.76Å; Y507-Q537 HydrophobicContact CG-CG 4.45Å; A533-Q537 PolarHBondContact O-N 3.42Å; L534-Q537 CarbonylContact O-C 3.59Å; Q537-G539 VanDerWaalsContact C-N 3.28Å; Q537-G539 PolarHBondContact O-N 3.34Å; Q537-F540 HydrophobicContact CB-CB 4.17Å; Q537-F540 HydrophobicContact CG-CB 3.96Å; Q537-F540 WeakPolarHBondContact O-CB 3.46Å; Q537-F540 PolarHBondContact O-N 3Å; Q537-F540 VanDerWaalsContact O-N 3.1Å
538	P	91.9	Very high	95.6	Very high	74 Å²	74	33.3 Å²	33.3	48%	0.481	17%	0.165	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.7	-28.2	-173	-27.1	35.5	0	0	0	115.6	L534 F540 R544	L534-P538 VanDerWaalsContact O-CA 3.27Å; L534-P538 WeakPolarHBondContact O-CA 3.33Å; L534-P538 WeakPolarHBondContact O-CG 3.42Å; P538-F540 VanDerWaalsContact C-N 3.32Å; P538-R544 PolarHBondContact O-NH2 3.07Å
539	G	90.1	Very high	95.4	Very high	6 Å²	6	32.5 Å²	32.5	6%	0.062	15%	0.151	C	C	.	.	T	Hydrogen-bonded Turn	trans	-88	12	177.6	0	0	0	0	0	115.1	G331 Q537 V541	G331-G539 WeakPolarHBondContact O-CA 3.35Å; Q537-G539 VanDerWaalsContact C-N 3.28Å; Q537-G539 PolarHBondContact O-N 3.34Å; G539-V541 PolarHBondContact O-N 2.89Å
540	F	94.5	Very high	95.2	Very high	3 Å²	3	32.3 Å²	32.3	1%	0.013	15%	0.15	C	C	.	.			trans	-74.1	86.1	177.8	-173	-166.1	0	0	0	111.1	E363 Y507 L508 N511 A533 L534 Q537 P538 R542 S543 R544	E363-F540 HydrophobicContact CB-CD2 3.92Å; E363-F540 HydrophobicContact CB-CE2 3.86Å; E363-F540 HydrophobicContact CG-CD2 4.15Å; E363-F540 HydrophobicContact CG-CE2 3.72Å; Y507-F540 AromaticContact CD2-CD1 3.56Å; Y507-F540 HydrophobicContact CD2-CD1 3.56Å; Y507-F540 AromaticContact CD2-CE1 3.61Å; Y507-F540 HydrophobicContact CD2-CE1 3.61Å; Y507-F540 HydrophobicContact CD2-CG 4.17Å; Y507-F540 HydrophobicContact CD2-CZ 4.27Å; Y507-F540 HydrophobicContact CE2-CD1 4.16Å; Y507-F540 HydrophobicContact CE2-CE1 4.21Å; Y507-F540 HydrophobicContact CE2-CG 4.35Å; Y507-F540 HydrophobicContact CE2-CZ 4.47Å; L508-F540 HydrophobicContact CD2-CE1 4.35Å; L508-F540 HydrophobicContact CD2-CE2 4.2Å; L508-F540 HydrophobicContact CD2-CZ 3.77Å; N511-F540 HydrophobicContact CB-CD1 4.46Å; N511-F540 HydrophobicContact CB-CE1 3.37Å; N511-F540 HydrophobicContact CB-CZ 3.7Å; A533-F540 HydrophobicContact CB-CD1 4.27Å; A533-F540 HydrophobicContact CB-CE1 4.36Å; L534-F540 HydrophobicContact CD2-CB 4.33Å; Q537-F540 HydrophobicContact CB-CB 4.17Å; Q537-F540 HydrophobicContact CG-CB 3.96Å; Q537-F540 WeakPolarHBondContact O-CB 3.46Å; Q537-F540 PolarHBondContact O-N 3Å; Q537-F540 VanDerWaalsContact O-N 3.1Å; P538-F540 VanDerWaalsContact C-N 3.32Å; F540-R542 HydrophobicContact CD2-CB 3.98Å; F540-R542 HydrophobicContact CE2-CB 3.61Å; F540-R542 HydrophobicContact CE2-CG 4.1Å; F540-R542 HydrophobicContact CZ-CB 4.4Å; F540-R542 HydrophobicContact CZ-CG 4.47Å; F540-R542 PolarHBondContact O-N 3.18Å; F540-S543 PolarHBondContact O-N 3.01Å; F540-S543 VanDerWaalsContact O-N 3.12Å; F540-R544 PolarHBondContact O-N 2.84Å
541	V	95.1	Very high	94.9	Very high	0 Å²	0	32.3 Å²	32.3	0%	0	15%	0.15	C	C	.	.	H	α-helix	trans	-53.9	-48.8	-173.8	-177.8	0	0	0	0	111.8	P334 E363 E365 G539 S543 R544 Y545 A567 L570 Q571 I597	P334-V541 HydrophobicContact CG-CG2 3.77Å; E363-V541 PolarHBondContact O-N 2.82Å; E365-V541 HydrophobicContact CB-CG1 4.16Å; G539-V541 PolarHBondContact O-N 2.89Å; V541-S543 VanDerWaalsContact C-N 3.34Å; V541-S543 PolarHBondContact O-N 3.42Å; V541-R544 WeakPolarHBondContact O-CB 3.48Å; V541-R544 PolarHBondContact O-N 3.2Å; V541-Y545 PolarHBondContact O-N 3.17Å; V541-A567 HydrophobicContact CG1-CB 4.08Å; V541-L570 HydrophobicContact CG2-CB 4.35Å; V541-Q571 HydrophobicContact CG1-CG 4.14Å; V541-Q571 HydrophobicContact CG2-CG 4.24Å; V541-I597 HydrophobicContact CG1-CD1 3.82Å
542	R	95.5	Very high	94.6	Very high	21 Å²	21	26.4 Å²	26.4	8%	0.079	13%	0.13	C	C	.	.	H	α-helix	trans	-50.2	-47.8	175.3	175.1	70.2	65.9	168.6	14.8	113	A362 E363 E365 E367 F540 R544 Y545 N546	A362-R542 PolarHBondContact O-NE 3.43Å; A362-R542 PolarHBondContact O-NH2 3.28Å; A362-R542 VanDerWaalsContact O-NH2 3.09Å; E363-R542 WeakPolarHBondContact O-CB 3.37Å; E363-R542 PolarHBondContact O-N 3.29Å; E365-R542 IonicContact OE1-CZ 2.95Å; E365-R542 IonicContact OE1-NH1 3.75Å; E365-R542 PolarHBondContact OE1-NH1 3.04Å; E365-R542 WeakPolarHBondContact OE2-CD 3.5Å; E365-R542 IonicContact OE2-CZ 2.75Å; E365-R542 IonicContact OE2-NE 3.89Å; E365-R542 PolarHBondContact OE2-NE 2.96Å; E365-R542 IonicContact OE2-NH1 2.77Å; E365-R542 PolarHBondContact OE2-NH1 3.12Å; E367-R542 VanDerWaalsContact CD-NH2 3.25Å; E367-R542 IonicContact OE1-NH2 3.23Å; E367-R542 IonicContact OE2-CZ 2.64Å; E367-R542 IonicContact OE2-NH1 2.67Å; E367-R542 IonicContact OE2-NH2 2.87Å; E367-R542 PolarHBondContact OE2-NH2 3.29Å; F540-R542 HydrophobicContact CD2-CB 3.98Å; F540-R542 HydrophobicContact CE2-CB 3.61Å; F540-R542 HydrophobicContact CE2-CG 4.1Å; F540-R542 HydrophobicContact CZ-CB 4.4Å; F540-R542 HydrophobicContact CZ-CG 4.47Å; F540-R542 PolarHBondContact O-N 3.18Å; R542-R544 VanDerWaalsContact C-N 3.3Å; R542-R544 PolarHBondContact O-N 2.86Å; R542-Y545 PolarHBondContact O-N 2.95Å; R542-N546 WeakPolarHBondContact O-CB 3.29Å; R542-N546 PolarHBondContact O-N 3.45Å; R542-N546 PolarHBondContact O-ND2 3.35Å
543	S	96.6	Very high	94.1	Very high	0 Å²	0	27.1 Å²	27.1	0%	0	14%	0.14	C	C	.	.	H	α-helix	trans	-71.1	-25.6	-179.9	-175.6	0	0	0	0	113	N511 Y530 F540 V541 L547	N511-S543 WeakPolarHBondContact OD1-CA 3.21Å; Y530-S543 WeakPolarHBondContact CD1-OG 3.48Å; F540-S543 PolarHBondContact O-N 3.01Å; F540-S543 VanDerWaalsContact O-N 3.12Å; V541-S543 VanDerWaalsContact C-N 3.34Å; V541-S543 PolarHBondContact O-N 3.42Å; S543-L547 WeakPolarHBondContact O-CB 3.38Å; S543-L547 PolarHBondContact O-N 2.81Å; S543-L547 VanDerWaalsContact O-N 3.09Å
544	R	96.6	Very high	93.8	Very high	34 Å²	34	30.9 Å²	30.9	13%	0.128	16%	0.159	C	C	.	.	H	α-helix	trans	-77.3	-39.8	174.7	-164.1	176.2	-62.7	-97.2	-1.3	111.6	L534 P538 F540 V541 R542 L547 G548 H563 E566 A567	L534-R544 HydrophobicContact CD1-CB 4.35Å; L534-R544 HydrophobicContact CD2-CB 4.15Å; P538-R544 PolarHBondContact O-NH2 3.07Å; F540-R544 PolarHBondContact O-N 2.84Å; V541-R544 WeakPolarHBondContact O-CB 3.48Å; V541-R544 PolarHBondContact O-N 3.2Å; R542-R544 VanDerWaalsContact C-N 3.3Å; R542-R544 PolarHBondContact O-N 2.86Å; R544-L547 PolarHBondContact O-N 3.49Å; R544-G548 PolarHBondContact O-N 3.31Å; R544-H563 HydrophobicContact CG-CB 4.25Å; R544-E566 IonicContact CZ-OE2 2.68Å; R544-E566 IonicContact NH1-OE1 2.78Å; R544-E566 PolarHBondContact NH1-OE1 3.09Å; R544-E566 IonicContact NH1-OE2 3.76Å; R544-E566 PolarHBondContact NH1-OE2 3.49Å; R544-A567 HydrophobicContact CB-CB 4.41Å; R544-A567 HydrophobicContact CG-CB 4.43Å
545	Y	95.7	Very high	93.4	Very high	30 Å²	30	32 Å²	32	12%	0.118	18%	0.176	C	C	.	.	H	α-helix	trans	-58.9	-51	169.5	170.1	-107.9	0	0	0	111.4	E365 V541 R542 L547 G548 I549 F564 I597 T600	E365-Y545 HydrophobicContact CG-CD1 4.21Å; E365-Y545 HydrophobicContact CG-CG 4.26Å; E365-Y545 WeakPolarHBondContact OE2-CD1 3.37Å; V541-Y545 PolarHBondContact O-N 3.17Å; R542-Y545 PolarHBondContact O-N 2.95Å; Y545-L547 VanDerWaalsContact C-N 3.3Å; Y545-L547 PolarHBondContact O-N 3.1Å; Y545-G548 CarbonylContact O-C 3.58Å; Y545-G548 WeakPolarHBondContact O-CA 3.35Å; Y545-G548 PolarHBondContact O-N 3.21Å; Y545-I549 HydrophobicContact CE1-CG1 4.14Å; Y545-I549 HydrophobicContact CE2-CD1 4.16Å; Y545-I549 HydrophobicContact CE2-CG1 4.22Å; Y545-I549 PolarHBondContact O-N 3.07Å; Y545-F564 AromaticContact CD2-CD1 3.84Å; Y545-F564 HydrophobicContact CD2-CD1 3.84Å; Y545-F564 AromaticContact CD2-CE1 3.57Å; Y545-F564 HydrophobicContact CD2-CE1 3.57Å; Y545-F564 HydrophobicContact CE2-CD1 4.46Å; Y545-F564 AromaticContact CE2-CE1 3.96Å; Y545-F564 HydrophobicContact CE2-CE1 3.96Å; Y545-F564 HydrophobicContact CG-CE1 4.48Å; Y545-F564 WeakPolarHBondContact O-CE1 3.31Å; Y545-I597 HydrophobicContact CD2-CB 4.36Å; Y545-I597 HydrophobicContact CD2-CG1 3.73Å; Y545-I597 HydrophobicContact CD2-CG2 4.44Å; Y545-I597 HydrophobicContact CE2-CG1 4.29Å; Y545-I597 HydrophobicContact CG-CG1 4.23Å; Y545-T600 HydrophobicContact CE2-CG2 4.06Å; Y545-T600 PolarHBondContact OH-OG1 3.37Å
546	N	95.4	Very high	93.2	Very high	24 Å²	24	27.1 Å²	27.1	13%	0.128	16%	0.157	C	C	.	.	H	α-helix	trans	-62.1	-33.6	178.2	-72.3	-17.6	0	0	0	113.6	N511 Y530 R542 I549 S550	N511-N546 PolarHBondContact OD1-ND2 2.98Å; Y530-N546 HydrophobicContact CD1-CB 4.03Å; Y530-N546 HydrophobicContact CE1-CB 3.4Å; Y530-N546 HydrophobicContact CE2-CB 4.2Å; Y530-N546 VanDerWaalsContact CZ-CB 3.47Å; R542-N546 WeakPolarHBondContact O-CB 3.29Å; R542-N546 PolarHBondContact O-N 3.45Å; R542-N546 PolarHBondContact O-ND2 3.35Å; N546-I549 PolarHBondContact O-N 3.3Å; N546-S550 PolarHBondContact O-N 3.1Å; N546-S550 PolarHBondContact O-OG 3.3Å
547	L	96.1	Very high	93.1	Very high	4 Å²	4	27 Å²	27	2%	0.021	16%	0.155	C	C	.	.	H	α-helix	trans	-64.1	-43.9	170.1	177.6	59.7	0	0	0	111.1	V527 Y530 L534 S543 R544 Y545 I549 S550 C551 H563	V527-L547 HydrophobicContact CB-CD1 4.12Å; V527-L547 HydrophobicContact CG1-CD1 3.92Å; V527-L547 HydrophobicContact CG2-CD1 3.86Å; Y530-L547 HydrophobicContact CD2-CB 4.31Å; Y530-L547 HydrophobicContact CD2-CD1 4.44Å; Y530-L547 HydrophobicContact CG-CB 4.32Å; L534-L547 HydrophobicContact CD1-CD2 3.82Å; S543-L547 WeakPolarHBondContact O-CB 3.38Å; S543-L547 PolarHBondContact O-N 2.81Å; S543-L547 VanDerWaalsContact O-N 3.09Å; R544-L547 PolarHBondContact O-N 3.49Å; Y545-L547 VanDerWaalsContact C-N 3.3Å; Y545-L547 PolarHBondContact O-N 3.1Å; L547-I549 PolarHBondContact O-N 2.94Å; L547-S550 WeakPolarHBondContact O-CB 3.46Å; L547-S550 PolarHBondContact O-N 2.87Å; L547-S550 VanDerWaalsContact O-N 3.12Å; L547-C551 PolarHBondContact O-N 2.91Å; L547-C551 PolarHBondContact O-SG 2.83Å; L547-H563 WeakPolarHBondContact CD2-NE2 3.25Å
548	G	93.8	Very high	92.9	Very high	0 Å²	0	30.9 Å²	30.9	0%	0	17%	0.169	C	C	.	.	H	α-helix	trans	-59.2	-43.2	173.4	0	0	0	0	0	113.3	R544 Y545 S550 C551 V552 A560 F564	R544-G548 PolarHBondContact O-N 3.31Å; Y545-G548 CarbonylContact O-C 3.58Å; Y545-G548 WeakPolarHBondContact O-CA 3.35Å; Y545-G548 PolarHBondContact O-N 3.21Å; G548-S550 VanDerWaalsContact C-N 3.3Å; G548-S550 PolarHBondContact O-N 3.44Å; G548-C551 WeakPolarHBondContact O-CB 3.46Å; G548-C551 PolarHBondContact O-N 3.33Å; G548-V552 PolarHBondContact O-N 3.4Å; G548-A560 VanDerWaalsContact O-CB 3.22Å; G548-A560 WeakPolarHBondContact O-CB 3.38Å; G548-F564 VanDerWaalsContact C-CZ 3.42Å
549	I	91	Very high	93	Very high	43 Å²	43	32 Å²	32	22%	0.221	17%	0.168	C	C	.	.	H	α-helix	trans	-57.9	-42.6	171.9	-65.1	-71.2	0	0	0	111.1	Y545 N546 L547 C551 V552 N553 F564 T600	Y545-I549 HydrophobicContact CE1-CG1 4.14Å; Y545-I549 HydrophobicContact CE2-CD1 4.16Å; Y545-I549 HydrophobicContact CE2-CG1 4.22Å; Y545-I549 PolarHBondContact O-N 3.07Å; N546-I549 PolarHBondContact O-N 3.3Å; L547-I549 PolarHBondContact O-N 2.94Å; I549-C551 PolarHBondContact O-N 3.01Å; I549-V552 WeakPolarHBondContact O-CB 3.49Å; I549-V552 PolarHBondContact O-N 2.84Å; I549-V552 VanDerWaalsContact O-N 3.16Å; I549-N553 PolarHBondContact O-N 3.37Å; I549-N553 PolarHBondContact O-OD1 3.37Å; I549-F564 HydrophobicContact CD1-CZ 4.33Å; I549-F564 HydrophobicContact CG1-CE1 4.48Å; I549-F564 HydrophobicContact CG1-CZ 4.48Å; I549-T600 HydrophobicContact CD1-CG2 3.44Å; I549-T600 VanDerWaalsContact CD1-CG2 3.44Å
550	S	92.9	Very high	93.1	Very high	0 Å²	0	31.7 Å²	31.7	0%	0	17%	0.165	C	C	.	.	H	α-helix	trans	-67	-37.6	178.8	-55.6	0	0	0	0	112	Y530 N546 L547 G548 N553 L554	Y530-S550 VanDerWaalsContact CE2-OG 3.22Å; Y530-S550 WeakPolarHBondContact CE2-OG 3.47Å; N546-S550 PolarHBondContact O-N 3.1Å; N546-S550 PolarHBondContact O-OG 3.3Å; L547-S550 WeakPolarHBondContact O-CB 3.46Å; L547-S550 PolarHBondContact O-N 2.87Å; L547-S550 VanDerWaalsContact O-N 3.12Å; G548-S550 VanDerWaalsContact C-N 3.3Å; G548-S550 PolarHBondContact O-N 3.44Å; S550-N553 PolarHBondContact O-N 2.86Å; S550-L554 VanDerWaalsContact O-CG 3.29Å; S550-L554 WeakPolarHBondContact O-CG 3.41Å; S550-L554 PolarHBondContact O-N 3.5Å; S550-L554 VanDerWaalsContact O-N 3.09Å
551	C	92.9	Very high	93.1	Very high	5 Å²	5	31.6 Å²	31.6	3%	0.034	16%	0.164	C	C	.	.	H	α-helix	trans	-63.6	-37.9	171	-70.2	0	0	0	0	112	L547 G548 I549 L554 G555 A556 E559 A560	L547-C551 PolarHBondContact O-N 2.91Å; L547-C551 PolarHBondContact O-SG 2.83Å; G548-C551 WeakPolarHBondContact O-CB 3.46Å; G548-C551 PolarHBondContact O-N 3.33Å; I549-C551 PolarHBondContact O-N 3.01Å; C551-L554 PolarHBondContact O-N 3.35Å; C551-G555 PolarHBondContact O-N 3.25Å; C551-A556 HydrophobicContact CB-CB 4.13Å; C551-A556 CarbonylContact O-C 3.57Å; C551-A556 WeakPolarHBondContact O-CA 3.41Å; C551-A556 WeakPolarHBondContact O-CB 3.2Å; C551-A556 PolarHBondContact O-N 3.25Å; C551-E559 HydrophobicContact CB-CB 4.43Å; C551-A560 HydrophobicContact CB-CB 3.74Å
552	V	89.5	Confident	93	Very high	17 Å²	17	34 Å²	34	10%	0.103	18%	0.176	C	C	.	.	H	α-helix	trans	-58.5	-49.3	170.6	166.7	0	0	0	0	111.1	G548 I549 L554 G555 A560 F564 A604 M607	G548-V552 PolarHBondContact O-N 3.4Å; I549-V552 WeakPolarHBondContact O-CB 3.49Å; I549-V552 PolarHBondContact O-N 2.84Å; I549-V552 VanDerWaalsContact O-N 3.16Å; V552-L554 PolarHBondContact O-N 2.68Å; V552-G555 PolarHBondContact O-N 3.18Å; V552-A560 HydrophobicContact CG2-CB 3.62Å; V552-F564 HydrophobicContact CG2-CE2 4.23Å; V552-F564 HydrophobicContact CG2-CZ 4.41Å; V552-A604 HydrophobicContact CG2-CB 4.22Å; V552-M607 HydrophobicContact CB-CE 4.35Å; V552-M607 HydrophobicContact CG1-CE 3.43Å; V552-M607 VanDerWaalsContact CG1-CE 3.43Å; V552-M607 HydrophobicContact CG1-SD 4.09Å; V552-M607 HydrophobicContact CG2-CE 3.98Å
553	N	87.8	Confident	93	Very high	94 Å²	94	34.7 Å²	34.7	50%	0.503	18%	0.18	S	C	.	.	H	α-helix	trans	-62.5	-26.4	-179	-66.6	-9.1	0	0	0	113.2	S523 I549 S550	S523-N553 WeakPolarHBondContact OG-CB 3.45Å; I549-N553 PolarHBondContact O-N 3.37Å; I549-N553 PolarHBondContact O-OD1 3.37Å; S550-N553 PolarHBondContact O-N 2.86Å
554	L	91.1	Very high	92.8	Very high	79 Å²	79	34.7 Å²	34.7	41%	0.414	18%	0.18	S	C	.	.	T	Hydrogen-bonded Turn	trans	-88.9	0.5	176.2	-65.1	171.3	0	0	0	113.6	E524 V527 S550 C551 V552 A556	E524-L554 HydrophobicContact CG-CD1 4.38Å; E524-L554 HydrophobicContact CG-CD2 3.62Å; V527-L554 HydrophobicContact CG2-CD1 3.99Å; S550-L554 VanDerWaalsContact O-CG 3.29Å; S550-L554 WeakPolarHBondContact O-CG 3.41Å; S550-L554 PolarHBondContact O-N 3.5Å; S550-L554 VanDerWaalsContact O-N 3.09Å; C551-L554 PolarHBondContact O-N 3.35Å; V552-L554 PolarHBondContact O-N 2.68Å; L554-A556 PolarHBondContact O-N 3.29Å
555	G	88.3	Confident	92.7	Very high	44 Å²	44	33.3 Å²	33.3	45%	0.454	18%	0.175	S	C	.	.	T	Hydrogen-bonded Turn	trans	76.5	2.7	-174.5	0	0	0	0	0	114.6	C551 V552 H557	C551-G555 PolarHBondContact O-N 3.25Å; V552-G555 PolarHBondContact O-N 3.18Å; G555-H557 PolarHBondContact O-CD2 2.85Å; G555-H557 PolarHBondContact O-N 3.21Å
556	A	92.8	Very high	92.5	Very high	25 Å²	25	35.7 Å²	35.7	21%	0.207	19%	0.187	C	C	.	.			trans	-80.1	55.3	178.3	0	0	0	0	0	111.5	C551 L554 R558 E559 A560	C551-A556 HydrophobicContact CB-CB 4.13Å; C551-A556 CarbonylContact O-C 3.57Å; C551-A556 WeakPolarHBondContact O-CA 3.41Å; C551-A556 WeakPolarHBondContact O-CB 3.2Å; C551-A556 PolarHBondContact O-N 3.25Å; L554-A556 PolarHBondContact O-N 3.29Å; A556-R558 VanDerWaalsContact C-N 3.26Å; A556-R558 PolarHBondContact O-N 3.07Å; A556-R558 VanDerWaalsContact O-N 3.17Å; A556-E559 HydrophobicContact CB-CB 4.37Å; A556-E559 PolarHBondContact O-N 2.96Å; A556-A560 PolarHBondContact O-N 3Å
557	H	91.9	Very high	92.4	Very high	47 Å²	47	34.6 Å²	34.6	22%	0.218	18%	0.181	C	C	.	.	H	α-helix	trans	-61.7	-28.5	-169.5	-53.6	-50.6	0	0	0	114.2	G555 V561 M608	G555-H557 PolarHBondContact O-CD2 2.85Å; G555-H557 PolarHBondContact O-N 3.21Å; H557-V561 WeakPolarHBondContact O-CG2 3.4Å; H557-V561 PolarHBondContact O-N 2.77Å; H557-V561 VanDerWaalsContact O-N 3.09Å; H557-M608 HydrophobicContact CB-CG 3.55Å
558	R	92.2	Very high	92.1	Very high	98 Å²	98	34.4 Å²	34.4	37%	0.37	18%	0.18	S	C	.	.	H	α-helix	trans	-65.4	-52.8	174.7	171.5	179.2	-70.3	-97.2	5.4	111.8	A556 A560 V561 E562 M608	A556-R558 VanDerWaalsContact C-N 3.26Å; A556-R558 PolarHBondContact O-N 3.07Å; A556-R558 VanDerWaalsContact O-N 3.17Å; R558-A560 PolarHBondContact O-N 3.34Å; R558-V561 WeakPolarHBondContact O-CB 3.41Å; R558-V561 PolarHBondContact O-N 3Å; R558-V561 VanDerWaalsContact O-N 3.09Å; R558-E562 WeakPolarHBondContact CG-OE1 3.49Å; R558-E562 PolarHBondContact O-N 2.95Å; R558-M608 HydrophobicContact CB-CE 3.96Å; R558-M608 HydrophobicContact CB-SD 4.39Å; R558-M608 HydrophobicContact CG-CE 4.49Å
559	E	92.8	Very high	91.9	Very high	98 Å²	98	35.2 Å²	35.2	46%	0.458	19%	0.186	S	C	.	.	H	α-helix	trans	-62.9	-35	180	-64.5	161.4	-157.8	0	0	110.5	C551 A556 E562 H563	C551-E559 HydrophobicContact CB-CB 4.43Å; A556-E559 HydrophobicContact CB-CB 4.37Å; A556-E559 PolarHBondContact O-N 2.96Å; E559-E562 PolarHBondContact O-N 2.92Å; E559-H563 PolarHBondContact O-CD2 2.76Å; E559-H563 VanDerWaalsContact O-CD2 3.25Å; E559-H563 PolarHBondContact O-N 3.17Å
560	A	92.7	Very high	91.8	Very high	0 Å²	0	35.2 Å²	35.2	0%	0	19%	0.186	C	C	.	.	H	α-helix	trans	-59.9	-49.7	170.5	0	0	0	0	0	112.7	G548 C551 V552 A556 R558 E562 H563 F564	G548-A560 VanDerWaalsContact O-CB 3.22Å; G548-A560 WeakPolarHBondContact O-CB 3.38Å; C551-A560 HydrophobicContact CB-CB 3.74Å; V552-A560 HydrophobicContact CG2-CB 3.62Å; A556-A560 PolarHBondContact O-N 3Å; R558-A560 PolarHBondContact O-N 3.34Å; A560-E562 VanDerWaalsContact C-N 3.33Å; A560-E562 PolarHBondContact O-N 3.31Å; A560-H563 PolarHBondContact O-N 2.93Å; A560-F564 HydrophobicContact CB-CE2 3.96Å; A560-F564 WeakPolarHBondContact O-CD2 3.32Å; A560-F564 VanDerWaalsContact O-CG 3.28Å; A560-F564 WeakPolarHBondContact O-CG 3.47Å; A560-F564 PolarHBondContact O-N 3.41Å
561	V	93.8	Very high	91.5	Very high	0 Å²	0	35.5 Å²	35.5	0%	0	19%	0.188	C	C	.	.	H	α-helix	trans	-59.9	-43.5	176.9	167.9	0	0	0	0	111.2	H557 R558 H563 F564 L565 L601 A604 L605 M608 F629	H557-V561 WeakPolarHBondContact O-CG2 3.4Å; H557-V561 PolarHBondContact O-N 2.77Å; H557-V561 VanDerWaalsContact O-N 3.09Å; R558-V561 WeakPolarHBondContact O-CB 3.41Å; R558-V561 PolarHBondContact O-N 3Å; R558-V561 VanDerWaalsContact O-N 3.09Å; V561-H563 PolarHBondContact O-N 2.94Å; V561-F564 PolarHBondContact O-N 3.28Å; V561-L565 HydrophobicContact CG1-CD1 3.72Å; V561-L565 HydrophobicContact CG1-CG 4.15Å; V561-L565 WeakPolarHBondContact O-CB 3.33Å; V561-L565 VanDerWaalsContact O-CG 3.24Å; V561-L565 WeakPolarHBondContact O-CG 3.4Å; V561-L565 PolarHBondContact O-N 2.7Å; V561-L601 HydrophobicContact CB-CD1 4.19Å; V561-L601 HydrophobicContact CG1-CD1 3.69Å; V561-L601 HydrophobicContact CG2-CD1 4.01Å; V561-A604 HydrophobicContact CG2-CB 3.68Å; V561-L605 HydrophobicContact CG1-CD2 4.13Å; V561-L605 HydrophobicContact CG2-CD2 4.06Å; V561-L605 HydrophobicContact CG2-CG 4.19Å; V561-M608 HydrophobicContact CB-SD 4.29Å; V561-M608 HydrophobicContact CG2-SD 3.76Å; V561-F629 HydrophobicContact CB-CE1 4.27Å; V561-F629 HydrophobicContact CB-CZ 4.19Å; V561-F629 HydrophobicContact CG1-CD1 4.26Å; V561-F629 HydrophobicContact CG1-CD2 4.11Å; V561-F629 HydrophobicContact CG1-CE1 3.74Å; V561-F629 HydrophobicContact CG1-CE2 3.57Å; V561-F629 HydrophobicContact CG1-CG 4.45Å; V561-F629 HydrophobicContact CG1-CZ 3.38Å
562	E	94.1	Very high	91.1	Very high	52 Å²	52	37.7 Å²	37.7	24%	0.243	20%	0.195	C	C	.	.	H	α-helix	trans	-58.1	-47.8	176.5	-73.3	156.5	-169.1	0	0	111.2	R558 E559 A560 F564 L565 E566 F629	R558-E562 WeakPolarHBondContact CG-OE1 3.49Å; R558-E562 PolarHBondContact O-N 2.95Å; E559-E562 PolarHBondContact O-N 2.92Å; A560-E562 VanDerWaalsContact C-N 3.33Å; A560-E562 PolarHBondContact O-N 3.31Å; E562-F564 PolarHBondContact O-N 2.99Å; E562-L565 PolarHBondContact O-N 2.91Å; E562-E566 WeakPolarHBondContact O-CG 3.44Å; E562-E566 PolarHBondContact O-N 2.8Å; E562-F629 HydrophobicContact CG-CD1 4.19Å
563	H	94.7	Very high	90.6	Very high	35 Å²	35	43.4 Å²	43.4	16%	0.162	22%	0.221	C	C	.	.	H	α-helix	trans	-64.1	-36.7	176	-70.4	-36.1	0	0	0	114.3	R544 L547 E559 A560 V561 E566 A567	R544-H563 HydrophobicContact CG-CB 4.25Å; L547-H563 WeakPolarHBondContact CD2-NE2 3.25Å; E559-H563 PolarHBondContact O-CD2 2.76Å; E559-H563 VanDerWaalsContact O-CD2 3.25Å; E559-H563 PolarHBondContact O-N 3.17Å; A560-H563 PolarHBondContact O-N 2.93Å; V561-H563 PolarHBondContact O-N 2.94Å; H563-E566 IonicContact CE1-OE2 3.34Å; H563-E566 IonicContact ND1-OE2 3.07Å; H563-E566 PolarHBondContact ND1-OE2 3Å; H563-A567 WeakPolarHBondContact O-CB 3.47Å; H563-A567 PolarHBondContact O-N 3.26Å
564	F	93.9	Very high	89.8	Confident	0 Å²	0	39.7 Å²	39.7	0%	0	20%	0.203	C	C	.	.	H	α-helix	trans	-67.4	-40.9	173.8	-60.7	-44	0	0	0	111.9	Y545 G548 I549 V552 A560 V561 E562 A567 L568 I597 T600 L601 A604	Y545-F564 AromaticContact CD2-CD1 3.84Å; Y545-F564 HydrophobicContact CD2-CD1 3.84Å; Y545-F564 AromaticContact CD2-CE1 3.57Å; Y545-F564 HydrophobicContact CD2-CE1 3.57Å; Y545-F564 HydrophobicContact CE2-CD1 4.46Å; Y545-F564 AromaticContact CE2-CE1 3.96Å; Y545-F564 HydrophobicContact CE2-CE1 3.96Å; Y545-F564 HydrophobicContact CG-CE1 4.48Å; Y545-F564 WeakPolarHBondContact O-CE1 3.31Å; G548-F564 VanDerWaalsContact C-CZ 3.42Å; I549-F564 HydrophobicContact CD1-CZ 4.33Å; I549-F564 HydrophobicContact CG1-CE1 4.48Å; I549-F564 HydrophobicContact CG1-CZ 4.48Å; V552-F564 HydrophobicContact CG2-CE2 4.23Å; V552-F564 HydrophobicContact CG2-CZ 4.41Å; A560-F564 HydrophobicContact CB-CE2 3.96Å; A560-F564 WeakPolarHBondContact O-CD2 3.32Å; A560-F564 VanDerWaalsContact O-CG 3.28Å; A560-F564 WeakPolarHBondContact O-CG 3.47Å; A560-F564 PolarHBondContact O-N 3.41Å; V561-F564 PolarHBondContact O-N 3.28Å; E562-F564 PolarHBondContact O-N 2.99Å; F564-A567 PolarHBondContact O-N 3.24Å; F564-L568 VanDerWaalsContact O-CG 3.3Å; F564-L568 WeakPolarHBondContact O-CG 3.33Å; F564-L568 PolarHBondContact O-N 2.77Å; F564-I597 HydrophobicContact CB-CG2 3.97Å; F564-I597 HydrophobicContact CD1-CG2 4.17Å; F564-I597 HydrophobicContact CG-CG2 4.41Å; F564-T600 HydrophobicContact CE1-CG2 3.82Å; F564-T600 HydrophobicContact CE2-CG2 3.68Å; F564-T600 HydrophobicContact CZ-CG2 3.27Å; F564-L601 HydrophobicContact CB-CB 4.1Å; F564-L601 HydrophobicContact CB-CD1 4.21Å; F564-L601 HydrophobicContact CD2-CB 4.3Å; F564-L601 HydrophobicContact CG-CB 4.45Å; F564-A604 HydrophobicContact CD2-CB 4.27Å; F564-A604 HydrophobicContact CE2-CB 3.94Å
565	L	93.6	Very high	88.4	Confident	4 Å²	4	36.6 Å²	36.6	2%	0.021	19%	0.189	C	C	.	.	H	α-helix	trans	-66.1	-38.3	176.6	-68.3	173.1	0	0	0	112.1	V561 E562 S569 L601 L622 L625 L626 F629	V561-L565 HydrophobicContact CG1-CD1 3.72Å; V561-L565 HydrophobicContact CG1-CG 4.15Å; V561-L565 WeakPolarHBondContact O-CB 3.33Å; V561-L565 VanDerWaalsContact O-CG 3.24Å; V561-L565 WeakPolarHBondContact O-CG 3.4Å; V561-L565 PolarHBondContact O-N 2.7Å; E562-L565 PolarHBondContact O-N 2.91Å; L565-S569 VanDerWaalsContact O-CB 3.29Å; L565-S569 WeakPolarHBondContact O-CB 3.4Å; L565-S569 PolarHBondContact O-N 2.94Å; L565-L601 HydrophobicContact CD2-CD1 4.4Å; L565-L601 HydrophobicContact CD2-CD2 3.81Å; L565-L601 HydrophobicContact CG-CD1 4.4Å; L565-L622 HydrophobicContact CD2-CD1 3.55Å; L565-L625 HydrophobicContact CD1-CB 4.47Å; L565-L625 HydrophobicContact CD2-CB 3.62Å; L565-L625 HydrophobicContact CD2-CD1 4.16Å; L565-L625 HydrophobicContact CD2-CG 4.49Å; L565-L626 HydrophobicContact CB-CD2 3.96Å; L565-F629 HydrophobicContact CD1-CB 4.19Å; L565-F629 HydrophobicContact CD1-CD2 3.63Å; L565-F629 HydrophobicContact CD1-CE2 4.27Å; L565-F629 HydrophobicContact CD1-CG 3.97Å
566	E	92.1	Very high	87	Confident	81 Å²	81	36 Å²	36	38%	0.379	18%	0.183	S	C	.	.	H	α-helix	trans	-61.8	-45.9	170.8	-73.8	-178.3	133.2	0	0	111.8	R544 E562 H563 S569 L570	R544-E566 IonicContact CZ-OE2 2.68Å; R544-E566 IonicContact NH1-OE1 2.78Å; R544-E566 PolarHBondContact NH1-OE1 3.09Å; R544-E566 IonicContact NH1-OE2 3.76Å; R544-E566 PolarHBondContact NH1-OE2 3.49Å; E562-E566 WeakPolarHBondContact O-CG 3.44Å; E562-E566 PolarHBondContact O-N 2.8Å; H563-E566 IonicContact CE1-OE2 3.34Å; H563-E566 IonicContact ND1-OE2 3.07Å; H563-E566 PolarHBondContact ND1-OE2 3Å; E566-S569 CarbonylContact O-C 3.51Å; E566-S569 WeakPolarHBondContact O-CB 3.5Å; E566-S569 PolarHBondContact O-N 2.86Å; E566-S569 VanDerWaalsContact O-N 3.15Å; E566-L570 WeakPolarHBondContact O-CG 3.33Å; E566-L570 PolarHBondContact O-N 2.89Å
567	A	91.9	Very high	84.7	Confident	0 Å²	0	40.4 Å²	40.4	0%	0	20%	0.203	C	C	.	.	H	α-helix	trans	-61	-47.9	179.2	0	0	0	0	0	111.8	V541 R544 H563 F564 S569 L570 Q571 I597	V541-A567 HydrophobicContact CG1-CB 4.08Å; R544-A567 HydrophobicContact CB-CB 4.41Å; R544-A567 HydrophobicContact CG-CB 4.43Å; H563-A567 WeakPolarHBondContact O-CB 3.47Å; H563-A567 PolarHBondContact O-N 3.26Å; F564-A567 PolarHBondContact O-N 3.24Å; A567-S569 VanDerWaalsContact C-N 3.29Å; A567-S569 PolarHBondContact O-N 3.46Å; A567-L570 PolarHBondContact O-N 3.23Å; A567-Q571 PolarHBondContact O-N 3.39Å; A567-I597 HydrophobicContact CB-CD1 4.14Å
568	L	91.2	Very high	82.4	Confident	0 Å²	0	40.9 Å²	40.9	0%	0	22%	0.221	C	C	.	.	H	α-helix	trans	-61.8	-36.7	172.8	-67.4	170.4	0	0	0	112	F564 R572 M593 I597 W598 L601 L622	F564-L568 VanDerWaalsContact O-CG 3.3Å; F564-L568 WeakPolarHBondContact O-CG 3.33Å; F564-L568 PolarHBondContact O-N 2.77Å; L568-R572 WeakPolarHBondContact O-CB 3.36Å; L568-R572 PolarHBondContact O-N 2.96Å; L568-M593 HydrophobicContact CB-SD 4.28Å; L568-M593 HydrophobicContact CD2-CB 3.83Å; L568-M593 HydrophobicContact CD2-CG 4.35Å; L568-M593 HydrophobicContact CD2-SD 4.1Å; L568-I597 HydrophobicContact CD1-CG2 4.14Å; L568-I597 HydrophobicContact CD2-CB 3.95Å; L568-I597 HydrophobicContact CD2-CG2 3.84Å; L568-I597 HydrophobicContact CG-CB 4.35Å; L568-I597 HydrophobicContact CG-CG2 3.67Å; L568-W598 HydrophobicContact CD1-CD2 3.92Å; L568-W598 HydrophobicContact CD1-CE3 4.08Å; L568-W598 HydrophobicContact CD1-CH2 3.98Å; L568-W598 HydrophobicContact CD1-CZ2 3.84Å; L568-W598 HydrophobicContact CD1-CZ3 4.1Å; L568-W598 HydrophobicContact CD2-CD2 4.28Å; L568-W598 HydrophobicContact CD2-CG 4.27Å; L568-W598 HydrophobicContact CD2-CZ2 4.36Å; L568-L601 HydrophobicContact CD1-CD2 3.55Å; L568-L622 HydrophobicContact CB-CD1 3.96Å; L568-L622 HydrophobicContact CB-CD2 3.83Å; L568-L622 HydrophobicContact CD1-CD1 4.17Å
569	S	89.8	Confident	80.1	Confident	18 Å²	18	37.1 Å²	37.1	13%	0.126	21%	0.211	C	C	.	.	H	α-helix	trans	-67.3	-35.5	175.9	-175.9	0	0	0	0	112.6	L565 E566 A567 R572 Q573	L565-S569 VanDerWaalsContact O-CB 3.29Å; L565-S569 WeakPolarHBondContact O-CB 3.4Å; L565-S569 PolarHBondContact O-N 2.94Å; E566-S569 CarbonylContact O-C 3.51Å; E566-S569 WeakPolarHBondContact O-CB 3.5Å; E566-S569 PolarHBondContact O-N 2.86Å; E566-S569 VanDerWaalsContact O-N 3.15Å; A567-S569 VanDerWaalsContact C-N 3.29Å; A567-S569 PolarHBondContact O-N 3.46Å; S569-R572 PolarHBondContact O-N 3.25Å; S569-Q573 WeakPolarHBondContact O-CB 3.41Å; S569-Q573 WeakPolarHBondContact O-CG 3.42Å; S569-Q573 PolarHBondContact O-N 3.39Å; S569-Q573 PolarHBondContact OG-NE2 3.41Å; S569-Q573 VanDerWaalsContact OG-NE2 3.1Å
570	L	88.1	Confident	77.7	Confident	42 Å²	42	41 Å²	41	22%	0.22	22%	0.221	C	C	.	.	H	α-helix	trans	-64.9	-47.5	175.8	-72.7	166	0	0	0	110.7	V541 E566 A567 R572 Q573 A574	V541-L570 HydrophobicContact CG2-CB 4.35Å; E566-L570 WeakPolarHBondContact O-CG 3.33Å; E566-L570 PolarHBondContact O-N 2.89Å; A567-L570 PolarHBondContact O-N 3.23Å; L570-R572 VanDerWaalsContact C-N 3.33Å; L570-R572 PolarHBondContact O-N 3.38Å; L570-Q573 PolarHBondContact O-N 2.86Å; L570-A574 PolarHBondContact O-N 3.12Å
571	Q	86.6	Confident	75	Confident	7 Å²	7	45.1 Å²	45.1	3%	0.033	26%	0.255	C	S	.	.	H	α-helix	trans	-56.5	-45.8	173.4	-67.8	-177	-32.6	0	0	111.6	N364 V541 A567 Q573 A574 A575 M593 S594	N364-Q571 PolarHBondContact O-NE2 3.47Å; N364-Q571 PolarHBondContact OD1-NE2 2.9Å; V541-Q571 HydrophobicContact CG1-CG 4.14Å; V541-Q571 HydrophobicContact CG2-CG 4.24Å; A567-Q571 PolarHBondContact O-N 3.39Å; Q571-Q573 PolarHBondContact O-N 2.94Å; Q571-A574 PolarHBondContact O-N 2.92Å; Q571-A575 PolarHBondContact O-N 3.27Å; Q571-M593 HydrophobicContact CB-CG 4.3Å; Q571-M593 VanDerWaalsContact OE1-CA 3.3Å; Q571-S594 PolarHBondContact NE2-OG 3.35Å
572	R	84.5	Confident	72.5	Confident	50 Å²	50	47.1 Å²	47.1	19%	0.189	27%	0.272	C	S	.	.	H	α-helix	trans	-66	-36	178.2	-171.2	173.9	65.2	164.2	1.3	114	L568 S569 L570 A574 A575 G576 A579 M593 L622 D623 L626	L568-R572 WeakPolarHBondContact O-CB 3.36Å; L568-R572 PolarHBondContact O-N 2.96Å; S569-R572 PolarHBondContact O-N 3.25Å; L570-R572 VanDerWaalsContact C-N 3.33Å; L570-R572 PolarHBondContact O-N 3.38Å; R572-A574 VanDerWaalsContact C-N 3.33Å; R572-A575 WeakPolarHBondContact O-CB 3.3Å; R572-A575 PolarHBondContact O-N 3.08Å; R572-G576 PolarHBondContact O-N 3.34Å; R572-A579 HydrophobicContact CG-CB 4.08Å; R572-M593 HydrophobicContact CB-CE 3.85Å; R572-M593 HydrophobicContact CG-CE 3.93Å; R572-L622 HydrophobicContact CB-CD2 4.36Å; R572-D623 IonicContact CZ-OD1 2.78Å; R572-D623 IonicContact NH1-OD1 3.33Å; R572-D623 PolarHBondContact NH1-OD1 3.47Å; R572-D623 IonicContact NH1-OD2 3.11Å; R572-D623 IonicContact NH2-OD1 3.41Å; R572-D623 PolarHBondContact NH2-OD1 3.21Å; R572-L626 VanDerWaalsContact NH2-CD1 3.28Å
573	Q	79.3	Confident	70.1	Confident	137 Å²	137	55.5 Å²	55.5	64%	0.64	30%	0.301	S	S	*	.	H	α-helix	trans	-64.3	-41.1	179.1	-78.3	172	38.3	0	0	111	S569 L570 Q571 A575 G576	S569-Q573 WeakPolarHBondContact O-CB 3.41Å; S569-Q573 WeakPolarHBondContact O-CG 3.42Å; S569-Q573 PolarHBondContact O-N 3.39Å; S569-Q573 PolarHBondContact OG-NE2 3.41Å; S569-Q573 VanDerWaalsContact OG-NE2 3.1Å; L570-Q573 PolarHBondContact O-N 2.86Å; Q571-Q573 PolarHBondContact O-N 2.94Å; Q573-A575 VanDerWaalsContact C-N 3.34Å; Q573-G576 PolarHBondContact O-N 3.36Å
574	A	69.8	Low	67.3	Low	17 Å²	17	55.7 Å²	55.7	14%	0.14	31%	0.312	C	S	.	.	H	α-helix	trans	-66.8	-32.1	171.4	0	0	0	0	0	113.7	P334 G335 R338 L570 Q571 R572 G576	P334-A574 VanDerWaalsContact C-CB 3.43Å; P334-A574 HydrophobicContact CB-CB 3.59Å; G335-A574 VanDerWaalsContact N-CB 3.29Å; R338-A574 PolarHBondContact NH1-O 2.73Å; L570-A574 PolarHBondContact O-N 3.12Å; Q571-A574 PolarHBondContact O-N 2.92Å; R572-A574 VanDerWaalsContact C-N 3.33Å; A574-G576 PolarHBondContact O-N 3.48Å
575	A	62.9	Low	64.3	Low	13 Å²	13	61.2 Å²	61.2	11%	0.107	35%	0.348	C	S	.	.	H	α-helix	trans	-60.6	-24.1	175.6	0	0	0	0	0	113	R338 Q571 R572 Q573 A579 L592	R338-A575 VanDerWaalsContact NH1-CA 3.27Å; R338-A575 PolarHBondContact NH1-O 3.05Å; Q571-A575 PolarHBondContact O-N 3.27Å; R572-A575 WeakPolarHBondContact O-CB 3.3Å; R572-A575 PolarHBondContact O-N 3.08Å; Q573-A575 VanDerWaalsContact C-N 3.34Å; A575-A579 HydrophobicContact CB-CB 4.17Å; A575-L592 HydrophobicContact CB-CD1 4.39Å
576	G	59	Low	61.8	Low	32 Å²	32	64.7 Å²	64.7	33%	0.33	39%	0.385	S	S	.	.			trans	80	173.9	176.4	0	0	0	0	0	113.9	R572 Q573 A574 G578 A579	R572-G576 PolarHBondContact O-N 3.34Å; Q573-G576 PolarHBondContact O-N 3.36Å; A574-G576 PolarHBondContact O-N 3.48Å; G576-G578 PolarHBondContact O-N 3.3Å; G576-A579 WeakPolarHBondContact O-CB 3.5Å; G576-A579 PolarHBondContact O-N 2.81Å
577	D	44	Very low	59.1	Low	117 Å²	117	61.9 Å²	61.9	63%	0.626	38%	0.378	S	S	*	.	G	3₁₀ helix	trans	-59.6	-16	-174.1	-90.1	-41.9	0	0	0	114.7	A579 R580	D577-A579 PolarHBondContact O-N 3.5Å; D577-R580 WeakPolarHBondContact O-CB 3.29Å; D577-R580 PolarHBondContact O-N 3.01Å; D577-R580 VanDerWaalsContact O-N 3.07Å; D577-R580 WeakPolarHBondContact OD1-CD 3.24Å; D577-R580 IonicContact OD1-CZ 3.56Å; D577-R580 IonicContact OD1-NE 3.82Å; D577-R580 IonicContact OD1-NH1 2.67Å; D577-R580 PolarHBondContact OD1-NH1 3.16Å
578	G	44.6	Very low	56.5	Low	58 Å²	58	65.1 Å²	65.1	60%	0.598	41%	0.405	S	S	*	.	G	3₁₀ helix	trans	-57.1	-31.5	170.5	0	0	0	0	0	113.2	G576 R580 A581	G576-G578 PolarHBondContact O-N 3.3Å; G578-R580 PolarHBondContact O-N 3.05Å; G578-A581 WeakPolarHBondContact O-CB 3.46Å; G578-A581 PolarHBondContact O-N 3Å; G578-A581 VanDerWaalsContact O-N 3.1Å
579	A	42.2	Very low	53.8	Low	19 Å²	19	65.9 Å²	65.9	16%	0.157	41%	0.411	C	S	.	.	G	3₁₀ helix	trans	-65.5	-24	176.4	0	0	0	0	0	113.6	R572 A575 G576 D577 A581 A589	R572-A579 HydrophobicContact CG-CB 4.08Å; A575-A579 HydrophobicContact CB-CB 4.17Å; G576-A579 WeakPolarHBondContact O-CB 3.5Å; G576-A579 PolarHBondContact O-N 2.81Å; D577-A579 PolarHBondContact O-N 3.5Å; A579-A581 VanDerWaalsContact C-N 3.27Å; A579-A581 PolarHBondContact O-N 2.9Å; A579-A589 HydrophobicContact CB-CB 3.91Å
580	R	42.3	Very low	51.3	Low	179 Å²	179	66.1 Å²	66.1	68%	0.675	41%	0.414	S	S	*	.	G	3₁₀ helix	trans	-71.6	-20.8	174.1	-73.4	180	161.5	146.4	-9.4	113.3	D577 G578	D577-R580 WeakPolarHBondContact O-CB 3.29Å; D577-R580 PolarHBondContact O-N 3.01Å; D577-R580 VanDerWaalsContact O-N 3.07Å; D577-R580 WeakPolarHBondContact OD1-CD 3.24Å; D577-R580 IonicContact OD1-CZ 3.56Å; D577-R580 IonicContact OD1-NE 3.82Å; D577-R580 IonicContact OD1-NH1 2.67Å; D577-R580 PolarHBondContact OD1-NH1 3.16Å; G578-R580 PolarHBondContact O-N 3.05Å
581	A	36	Very low	49.4	Very low	87 Å²	87	69.3 Å²	69.3	72%	0.719	44%	0.435	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.4	-24.1	-178.6	0	0	0	0	0	113	G578 A579 R583	G578-A581 WeakPolarHBondContact O-CB 3.46Å; G578-A581 PolarHBondContact O-N 3Å; G578-A581 VanDerWaalsContact O-N 3.1Å; A579-A581 VanDerWaalsContact C-N 3.27Å; A579-A581 PolarHBondContact O-N 2.9Å; A581-R583 PolarHBondContact O-N 3.17Å
582	A	42.8	Very low	47.9	Very low	41 Å²	41	71.1 Å²	71.1	34%	0.339	45%	0.445	S	S	.	.			trans	-79.1	55.1	-177.1	0	0	0	0	0	113.2	G584 A589	A582-G584 VanDerWaalsContact C-N 3.35Å; A582-G584 PolarHBondContact O-N 3.28Å; A582-A589 HydrophobicContact CB-CB 3.63Å
583	R	42.4	Very low	47.1	Very low	229 Å²	229	69.4 Å²	69.4	86%	0.864	44%	0.439	S	S	*	.			trans	-75.5	83.7	171.3	-81.6	-175	169.5	148.8	-0.5	111.1	A581	A581-R583 PolarHBondContact O-N 3.17Å
584	G	35.6	Very low	47	Very low	38 Å²	38	63 Å²	63	39%	0.392	41%	0.409	S	S	.	.	S	Bend	trans	178.6	148.5	168.3	0	0	0	0	0	112.6	A582 G586 G587	A582-G584 VanDerWaalsContact C-N 3.35Å; A582-G584 PolarHBondContact O-N 3.28Å; G584-G586 PolarHBondContact O-N 3.24Å; G584-G587 PolarHBondContact O-N 3.27Å
585	P	32.2	Very low	47.5	Very low	117 Å²	117	66.2 Å²	66.2	76%	0.76	42%	0.424	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.2	124.2	169.8	27.7	-32.9	0	0	0	108.8
586	G	40.5	Very low	48.6	Very low	77 Å²	77	68.6 Å²	68.6	79%	0.794	44%	0.435	S	S	*	.	T	Hydrogen-bonded Turn	trans	90.5	9.2	-178.1	0	0	0	0	0	116.5	G584	G584-G586 PolarHBondContact O-N 3.24Å
587	G	35.5	Very low	50	Low	22 Å²	22	67 Å²	67	23%	0.227	42%	0.419	C	S	.	.			trans	-71.6	141.3	166.3	0	0	0	0	0	111.5	G584 A589 A590	G584-G587 PolarHBondContact O-N 3.27Å; G587-A589 PolarHBondContact O-N 3.27Å; G587-A590 VanDerWaalsContact O-CB 3.22Å; G587-A590 WeakPolarHBondContact O-CB 3.46Å; G587-A590 PolarHBondContact O-N 2.92Å
588	A	37.5	Very low	52.1	Low	68 Å²	68	62 Å²	62	56%	0.562	39%	0.391	S	S	*	.	G	3₁₀ helix	trans	-54.1	-23.8	-172.8	0	0	0	0	0	115.8	A590 T591	A588-A590 PolarHBondContact O-N 3.09Å; A588-T591 WeakPolarHBondContact O-CB 3.46Å; A588-T591 PolarHBondContact O-N 3.3Å; A588-T591 PolarHBondContact O-OG1 2.95Å
589	A	34.8	Very low	54.1	Low	16 Å²	16	62.6 Å²	62.6	13%	0.132	39%	0.387	C	S	.	.	G	3₁₀ helix	trans	-68.1	-19.4	173	0	0	0	0	0	114.3	A579 A582 G587 T591	A579-A589 HydrophobicContact CB-CB 3.91Å; A582-A589 HydrophobicContact CB-CB 3.63Å; G587-A589 PolarHBondContact O-N 3.27Å; A589-T591 VanDerWaalsContact C-N 3.34Å
590	A	36.5	Very low	56.2	Low	23 Å²	23	62.3 Å²	62.3	19%	0.19	38%	0.383	C	S	.	.	G	3₁₀ helix	trans	-74.9	-26.2	174.7	0	0	0	0	0	112.3	G587 A588 L592 R620	G587-A590 VanDerWaalsContact O-CB 3.22Å; G587-A590 WeakPolarHBondContact O-CB 3.46Å; G587-A590 PolarHBondContact O-N 2.92Å; A588-A590 PolarHBondContact O-N 3.09Å; A590-L592 VanDerWaalsContact C-N 3.32Å; A590-R620 PolarHBondContact O-NH1 3.28Å
591	T	48.5	Very low	58.5	Low	109 Å²	109	53.8 Å²	53.8	67%	0.669	35%	0.351	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.3	-14.1	178.2	-34	0	0	0	0	113	A588 A589	A588-T591 WeakPolarHBondContact O-CB 3.46Å; A588-T591 PolarHBondContact O-N 3.3Å; A588-T591 PolarHBondContact O-OG1 2.95Å; A589-T591 VanDerWaalsContact C-N 3.34Å
592	L	55.9	Low	61	Low	44 Å²	44	52.9 Å²	52.9	23%	0.23	33%	0.329	C	S	.	.	T	Hydrogen-bonded Turn	trans	-82.3	-16.6	-178.2	-95	147	0	0	0	114.2	E309 A575 A590	E309-L592 HydrophobicContact CG-CD2 4.26Å; E309-L592 WeakPolarHBondContact OE1-CD2 3.3Å; A575-L592 HydrophobicContact CB-CD1 4.39Å; A590-L592 VanDerWaalsContact C-N 3.32Å
593	M	67.2	Low	63.1	Low	15 Å²	15	55.4 Å²	55.4	7%	0.074	34%	0.335	C	S	.	.	S	Bend	trans	-101.5	145.2	179.1	-61.8	-179.5	-143.1	0	0	110	L568 Q571 R572 D595 W598 L622	L568-M593 HydrophobicContact CB-SD 4.28Å; L568-M593 HydrophobicContact CD2-CB 3.83Å; L568-M593 HydrophobicContact CD2-CG 4.35Å; L568-M593 HydrophobicContact CD2-SD 4.1Å; Q571-M593 HydrophobicContact CB-CG 4.3Å; Q571-M593 VanDerWaalsContact OE1-CA 3.3Å; R572-M593 HydrophobicContact CB-CE 3.85Å; R572-M593 HydrophobicContact CG-CE 3.93Å; M593-D595 PolarHBondContact O-N 3.49Å; M593-W598 HydrophobicContact SD-CZ2 3.93Å; M593-L622 HydrophobicContact CE-CD2 4.44Å; M593-L622 HydrophobicContact SD-CD2 4.16Å
594	S	76.3	Confident	65.3	Low	1 Å²	1	44.5 Å²	44.5	1%	0.007	29%	0.293	C	S	.	.			trans	-64.8	123.3	-175.5	-59.6	0	0	0	0	112.2	N364 E365 Q366 Q571 N596 I597 W598	N364-S594 PolarHBondContact O-OG 3.29Å; E365-S594 VanDerWaalsContact O-CB 3.3Å; E365-S594 WeakPolarHBondContact O-CB 3.35Å; E365-S594 PolarHBondContact O-OG 3.25Å; Q366-S594 PolarHBondContact NE2-OG 3.36Å; Q571-S594 PolarHBondContact NE2-OG 3.35Å; S594-N596 PolarHBondContact O-N 3.3Å; S594-I597 PolarHBondContact O-N 3.27Å; S594-W598 PolarHBondContact O-N 2.94Å
595	D	81.4	Confident	67.8	Low	86 Å²	86	42.7 Å²	42.7	46%	0.46	28%	0.275	S	S	.	.	H	α-helix	trans	-57.1	-38.6	175.8	-70	-10.4	0	0	0	111.6	M593 I597 W598 S599 R620	M593-D595 PolarHBondContact O-N 3.49Å; D595-I597 VanDerWaalsContact C-N 3.3Å; D595-I597 PolarHBondContact O-N 3.35Å; D595-W598 PolarHBondContact O-N 3.03Å; D595-W598 VanDerWaalsContact O-N 3.16Å; D595-S599 PolarHBondContact O-N 3.01Å; D595-S599 PolarHBondContact O-OG 2.62Å; D595-R620 VanDerWaalsContact CG-NH2 3.35Å; D595-R620 IonicContact OD1-CZ 3.03Å; D595-R620 IonicContact OD1-NH1 3.37Å; D595-R620 PolarHBondContact OD1-NH1 3.35Å; D595-R620 IonicContact OD1-NH2 3.06Å; D595-R620 PolarHBondContact OD1-NH2 3.35Å; D595-R620 IonicContact OD2-NH2 3.57Å
596	N	84.9	Confident	70.5	Confident	62 Å²	62	39.3 Å²	39.3	33%	0.332	25%	0.254	S	S	.	.	H	α-helix	trans	-57.6	-37.1	174.6	-67.1	-3.3	0	0	0	113.3	S594 S599 T600	S594-N596 PolarHBondContact O-N 3.3Å; N596-S599 PolarHBondContact O-OG 3.17Å; N596-S599 VanDerWaalsContact O-OG 3.11Å; N596-T600 VanDerWaalsContact O-CB 3.25Å; N596-T600 WeakPolarHBondContact O-CB 3.44Å; N596-T600 PolarHBondContact O-N 3.42Å; N596-T600 VanDerWaalsContact O-N 3.16Å; N596-T600 PolarHBondContact O-OG1 3.06Å
597	I	88.6	Confident	72.6	Confident	0 Å²	0	39.1 Å²	39.1	0%	0	23%	0.233	C	C	.	.	H	α-helix	trans	-74.7	-39.9	178.4	-55.4	172.3	0	0	0	109.5	E365 V541 Y545 F564 A567 L568 S594 D595 L601	E365-I597 HydrophobicContact CB-CD1 4.04Å; E365-I597 HydrophobicContact CB-CG1 4.45Å; E365-I597 HydrophobicContact CG-CD1 3.85Å; E365-I597 HydrophobicContact CG-CG1 3.71Å; V541-I597 HydrophobicContact CG1-CD1 3.82Å; Y545-I597 HydrophobicContact CD2-CB 4.36Å; Y545-I597 HydrophobicContact CD2-CG1 3.73Å; Y545-I597 HydrophobicContact CD2-CG2 4.44Å; Y545-I597 HydrophobicContact CE2-CG1 4.29Å; Y545-I597 HydrophobicContact CG-CG1 4.23Å; F564-I597 HydrophobicContact CB-CG2 3.97Å; F564-I597 HydrophobicContact CD1-CG2 4.17Å; F564-I597 HydrophobicContact CG-CG2 4.41Å; A567-I597 HydrophobicContact CB-CD1 4.14Å; L568-I597 HydrophobicContact CD1-CG2 4.14Å; L568-I597 HydrophobicContact CD2-CB 3.95Å; L568-I597 HydrophobicContact CD2-CG2 3.84Å; L568-I597 HydrophobicContact CG-CB 4.35Å; L568-I597 HydrophobicContact CG-CG2 3.67Å; S594-I597 PolarHBondContact O-N 3.27Å; D595-I597 VanDerWaalsContact C-N 3.3Å; D595-I597 PolarHBondContact O-N 3.35Å; I597-L601 WeakPolarHBondContact O-CB 3.5Å; I597-L601 PolarHBondContact O-N 2.96Å
598	W	88.1	Confident	75	Confident	10 Å²	10	40.4 Å²	40.4	4%	0.038	23%	0.234	C	C	.	.	H	α-helix	trans	-64.1	-45.3	176.6	-82.6	112.6	0	0	0	113.1	L568 M593 S594 D595 L601 R602 R620 L622 L625	L568-W598 HydrophobicContact CD1-CD2 3.92Å; L568-W598 HydrophobicContact CD1-CE3 4.08Å; L568-W598 HydrophobicContact CD1-CH2 3.98Å; L568-W598 HydrophobicContact CD1-CZ2 3.84Å; L568-W598 HydrophobicContact CD1-CZ3 4.1Å; L568-W598 HydrophobicContact CD2-CD2 4.28Å; L568-W598 HydrophobicContact CD2-CG 4.27Å; L568-W598 HydrophobicContact CD2-CZ2 4.36Å; M593-W598 HydrophobicContact SD-CZ2 3.93Å; S594-W598 PolarHBondContact O-N 2.94Å; D595-W598 PolarHBondContact O-N 3.03Å; D595-W598 VanDerWaalsContact O-N 3.16Å; W598-L601 HydrophobicContact CE3-CD2 3.94Å; W598-L601 HydrophobicContact CZ3-CD2 3.85Å; W598-L601 PolarHBondContact O-N 3.37Å; W598-R602 VanDerWaalsContact O-CB 3.3Å; W598-R602 WeakPolarHBondContact O-CB 3.24Å; W598-R602 PolarHBondContact O-N 3.5Å; W598-R620 HydrophobicContact CD2-CB 4.12Å; W598-R620 HydrophobicContact CD2-CG 3.84Å; W598-R620 HydrophobicContact CE3-CB 4.4Å; W598-R620 HydrophobicContact CE3-CG 4.26Å; W598-R620 HydrophobicContact CG-CG 4.11Å; W598-R620 VanDerWaalsContact CH2-C 3.41Å; W598-R620 VanDerWaalsContact CH2-CA 3.48Å; W598-R620 HydrophobicContact CH2-CB 4.04Å; W598-R620 WeakPolarHBondContact CH2-O 3.48Å; W598-R620 HydrophobicContact CZ2-CB 3.69Å; W598-R620 HydrophobicContact CZ2-CG 4.33Å; W598-R620 HydrophobicContact CZ3-CB 4.37Å; W598-L622 HydrophobicContact CH2-CB 3.92Å; W598-L622 HydrophobicContact CH2-CD1 4.3Å; W598-L622 HydrophobicContact CZ2-CB 4.16Å; W598-L625 HydrophobicContact CH2-CD1 4.12Å; W598-L625 HydrophobicContact CZ3-CD1 3.68Å
599	S	87.8	Confident	77.4	Confident	71 Å²	71	39.5 Å²	39.5	50%	0.497	23%	0.231	S	C	.	.	H	α-helix	trans	-64.9	-43.6	178	62	0	0	0	0	111.6	D595 N596 R602 M603	D595-S599 PolarHBondContact O-N 3.01Å; D595-S599 PolarHBondContact O-OG 2.62Å; N596-S599 PolarHBondContact O-OG 3.17Å; N596-S599 VanDerWaalsContact O-OG 3.11Å; S599-R602 WeakPolarHBondContact O-CB 3.5Å; S599-R602 PolarHBondContact O-N 3.21Å; S599-M603 PolarHBondContact O-N 3.46Å
600	T	86.3	Confident	79.7	Confident	13 Å²	13	40.6 Å²	40.6	8%	0.08	23%	0.234	C	C	.	.	H	α-helix	trans	-66.7	-40.9	176.9	-56.7	0	0	0	0	112.3	Y545 I549 F564 N596 R602 M603 A604	Y545-T600 HydrophobicContact CE2-CG2 4.06Å; Y545-T600 PolarHBondContact OH-OG1 3.37Å; I549-T600 HydrophobicContact CD1-CG2 3.44Å; I549-T600 VanDerWaalsContact CD1-CG2 3.44Å; F564-T600 HydrophobicContact CE1-CG2 3.82Å; F564-T600 HydrophobicContact CE2-CG2 3.68Å; F564-T600 HydrophobicContact CZ-CG2 3.27Å; N596-T600 VanDerWaalsContact O-CB 3.25Å; N596-T600 WeakPolarHBondContact O-CB 3.44Å; N596-T600 PolarHBondContact O-N 3.42Å; N596-T600 VanDerWaalsContact O-N 3.16Å; N596-T600 PolarHBondContact O-OG1 3.06Å; T600-R602 VanDerWaalsContact C-N 3.32Å; T600-R602 PolarHBondContact O-N 3.08Å; T600-M603 HydrophobicContact CG2-CE 4.13Å; T600-M603 WeakPolarHBondContact O-CB 3.48Å; T600-M603 PolarHBondContact O-N 3.37Å; T600-A604 WeakPolarHBondContact O-CB 3.43Å; T600-A604 PolarHBondContact O-N 2.93Å
601	L	89.9	Confident	82.1	Confident	0 Å²	0	43.6 Å²	43.6	0%	0	25%	0.253	C	S	.	.	H	α-helix	trans	-59	-43.8	172	170.7	58.3	0	0	0	111.3	V561 F564 L565 L568 I597 W598 M603 A604 L605 L625	V561-L601 HydrophobicContact CB-CD1 4.19Å; V561-L601 HydrophobicContact CG1-CD1 3.69Å; V561-L601 HydrophobicContact CG2-CD1 4.01Å; F564-L601 HydrophobicContact CB-CB 4.1Å; F564-L601 HydrophobicContact CB-CD1 4.21Å; F564-L601 HydrophobicContact CD2-CB 4.3Å; F564-L601 HydrophobicContact CG-CB 4.45Å; L565-L601 HydrophobicContact CD2-CD1 4.4Å; L565-L601 HydrophobicContact CD2-CD2 3.81Å; L565-L601 HydrophobicContact CG-CD1 4.4Å; L568-L601 HydrophobicContact CD1-CD2 3.55Å; I597-L601 WeakPolarHBondContact O-CB 3.5Å; I597-L601 PolarHBondContact O-N 2.96Å; W598-L601 HydrophobicContact CE3-CD2 3.94Å; W598-L601 HydrophobicContact CZ3-CD2 3.85Å; W598-L601 PolarHBondContact O-N 3.37Å; L601-M603 VanDerWaalsContact C-N 3.3Å; L601-M603 PolarHBondContact O-N 2.89Å; L601-A604 PolarHBondContact O-N 3.08Å; L601-L605 HydrophobicContact CD1-CD1 4.1Å; L601-L605 HydrophobicContact CD1-CG 4.12Å; L601-L605 HydrophobicContact CG-CD1 4.21Å; L601-L605 WeakPolarHBondContact O-CG 3.45Å; L601-L605 PolarHBondContact O-N 3.44Å; L601-L625 HydrophobicContact CD2-CD1 4.2Å
602	R	89.3	Confident	84.1	Confident	69 Å²	69	42.4 Å²	42.4	26%	0.26	25%	0.25	S	C	.	.	H	α-helix	trans	-64	-33.1	177.2	178.8	58.9	-179	75.8	5.3	112.8	W598 S599 T600 S606 A617 D618	W598-R602 VanDerWaalsContact O-CB 3.3Å; W598-R602 WeakPolarHBondContact O-CB 3.24Å; W598-R602 PolarHBondContact O-N 3.5Å; S599-R602 WeakPolarHBondContact O-CB 3.5Å; S599-R602 PolarHBondContact O-N 3.21Å; T600-R602 VanDerWaalsContact C-N 3.32Å; T600-R602 PolarHBondContact O-N 3.08Å; R602-S606 PolarHBondContact NH1-OG 3.45Å; R602-S606 PolarHBondContact O-N 3.28Å; R602-S606 PolarHBondContact O-OG 3.44Å; R602-A617 HydrophobicContact CB-CB 4.34Å; R602-D618 WeakPolarHBondContact CD-OD1 3.45Å; R602-D618 IonicContact CZ-OD1 2.7Å; R602-D618 IonicContact NE-OD1 2.88Å; R602-D618 PolarHBondContact NE-OD1 2.86Å; R602-D618 IonicContact NE-OD2 2.79Å; R602-D618 PolarHBondContact NE-OD2 3.3Å; R602-D618 IonicContact NH2-OD1 3.18Å; R602-D618 IonicContact NH2-OD2 2.73Å
603	M	86.6	Confident	85.6	Confident	93 Å²	93	40.8 Å²	40.8	46%	0.458	24%	0.241	S	C	.	.	H	α-helix	trans	-69.9	-47.8	170.4	-177.2	-174.6	61.7	0	0	111.6	S599 T600 L601 L605 S606 M607	S599-M603 PolarHBondContact O-N 3.46Å; T600-M603 HydrophobicContact CG2-CE 4.13Å; T600-M603 WeakPolarHBondContact O-CB 3.48Å; T600-M603 PolarHBondContact O-N 3.37Å; L601-M603 VanDerWaalsContact C-N 3.3Å; L601-M603 PolarHBondContact O-N 2.89Å; M603-L605 PolarHBondContact O-N 2.91Å; M603-S606 WeakPolarHBondContact O-CA 2.9Å; M603-S606 VanDerWaalsContact O-CB 3.26Å; M603-S606 WeakPolarHBondContact O-CB 3.42Å; M603-S606 PolarHBondContact O-N 2.98Å; M603-M607 HydrophobicContact CE-CE 4.12Å; M603-M607 HydrophobicContact CG-CE 3.91Å; M603-M607 PolarHBondContact O-N 3.48Å; M603-M607 HydrophobicContact SD-CE 4.45Å
604	A	88.8	Confident	86.6	Confident	0 Å²	0	42.7 Å²	42.7	0%	0	25%	0.248	C	C	.	.	H	α-helix	trans	-60.5	-42.7	179.8	0	0	0	0	0	112.8	V552 V561 F564 T600 L601 S606 M607 M608	V552-A604 HydrophobicContact CG2-CB 4.22Å; V561-A604 HydrophobicContact CG2-CB 3.68Å; F564-A604 HydrophobicContact CD2-CB 4.27Å; F564-A604 HydrophobicContact CE2-CB 3.94Å; T600-A604 WeakPolarHBondContact O-CB 3.43Å; T600-A604 PolarHBondContact O-N 2.93Å; L601-A604 PolarHBondContact O-N 3.08Å; A604-S606 PolarHBondContact O-N 2.93Å; A604-M607 HydrophobicContact CB-CE 4.36Å; A604-M607 PolarHBondContact O-N 3.28Å; A604-M608 WeakPolarHBondContact O-CG 3.29Å; A604-M608 PolarHBondContact O-N 3.26Å
605	L	88.4	Confident	87.1	Confident	0 Å²	0	45.1 Å²	45.1	0%	0	27%	0.268	C	S	.	.	H	α-helix	trans	-58.8	-33.4	171.7	-72	169.7	0	0	0	112.6	V561 L601 M603 M608 G609 E610 L613 Y614 A617 L625 F629	V561-L605 HydrophobicContact CG1-CD2 4.13Å; V561-L605 HydrophobicContact CG2-CD2 4.06Å; V561-L605 HydrophobicContact CG2-CG 4.19Å; L601-L605 HydrophobicContact CD1-CD1 4.1Å; L601-L605 HydrophobicContact CD1-CG 4.12Å; L601-L605 HydrophobicContact CG-CD1 4.21Å; L601-L605 WeakPolarHBondContact O-CG 3.45Å; L601-L605 PolarHBondContact O-N 3.44Å; M603-L605 PolarHBondContact O-N 2.91Å; L605-M608 PolarHBondContact O-N 2.99Å; L605-G609 PolarHBondContact O-N 3.43Å; L605-E610 PolarHBondContact O-N 3.49Å; L605-L613 HydrophobicContact CD1-CB 4.31Å; L605-L613 HydrophobicContact CD2-CB 4.24Å; L605-L613 HydrophobicContact CD2-CD1 3.81Å; L605-Y614 HydrophobicContact CB-CD1 4.35Å; L605-Y614 HydrophobicContact CB-CE1 4.33Å; L605-A617 HydrophobicContact CD1-CB 3.76Å; L605-L625 HydrophobicContact CD1-CD2 4.09Å; L605-F629 HydrophobicContact CD2-CE2 4.06Å; L605-F629 HydrophobicContact CD2-CZ 4.01Å
606	S	88.8	Confident	87.3	Confident	46 Å²	46	41.6 Å²	41.6	32%	0.322	25%	0.251	S	S	.	.	H	α-helix	trans	-71.2	-39.9	177	-53	0	0	0	0	112.2	R602 M603 A604 M608 G609	R602-S606 PolarHBondContact NH1-OG 3.45Å; R602-S606 PolarHBondContact O-N 3.28Å; R602-S606 PolarHBondContact O-OG 3.44Å; M603-S606 WeakPolarHBondContact O-CA 2.9Å; M603-S606 VanDerWaalsContact O-CB 3.26Å; M603-S606 WeakPolarHBondContact O-CB 3.42Å; M603-S606 PolarHBondContact O-N 2.98Å; A604-S606 PolarHBondContact O-N 2.93Å; S606-M608 VanDerWaalsContact C-N 3.27Å; S606-M608 PolarHBondContact O-N 3.14Å; S606-G609 PolarHBondContact O-N 3.35Å
607	M	82.9	Confident	87.3	Confident	74 Å²	74	38.9 Å²	38.9	37%	0.365	24%	0.237	S	C	.	.	H	α-helix	trans	-67	-28	174.2	-67.9	-179.7	-71.1	0	0	112.4	V552 M603 A604 G609	V552-M607 HydrophobicContact CB-CE 4.35Å; V552-M607 HydrophobicContact CG1-CE 3.43Å; V552-M607 VanDerWaalsContact CG1-CE 3.43Å; V552-M607 HydrophobicContact CG1-SD 4.09Å; V552-M607 HydrophobicContact CG2-CE 3.98Å; M603-M607 HydrophobicContact CE-CE 4.12Å; M603-M607 HydrophobicContact CG-CE 3.91Å; M603-M607 PolarHBondContact O-N 3.48Å; M603-M607 HydrophobicContact SD-CE 4.45Å; A604-M607 HydrophobicContact CB-CE 4.36Å; A604-M607 PolarHBondContact O-N 3.28Å; M607-G609 VanDerWaalsContact C-N 3.33Å
608	M	87.8	Confident	87.1	Confident	48 Å²	48	43.6 Å²	43.6	24%	0.236	26%	0.262	C	S	.	.	T	Hydrogen-bonded Turn	trans	-74.1	-18.6	168.6	-67.6	-174.8	67.8	0	0	114.3	H557 R558 V561 A604 L605 S606 E610 F629	H557-M608 HydrophobicContact CB-CG 3.55Å; R558-M608 HydrophobicContact CB-CE 3.96Å; R558-M608 HydrophobicContact CB-SD 4.39Å; R558-M608 HydrophobicContact CG-CE 4.49Å; V561-M608 HydrophobicContact CB-SD 4.29Å; V561-M608 HydrophobicContact CG2-SD 3.76Å; A604-M608 WeakPolarHBondContact O-CG 3.29Å; A604-M608 PolarHBondContact O-N 3.26Å; L605-M608 PolarHBondContact O-N 2.99Å; S606-M608 VanDerWaalsContact C-N 3.27Å; S606-M608 PolarHBondContact O-N 3.14Å; M608-E610 VanDerWaalsContact C-N 3.3Å; M608-E610 HydrophobicContact CB-CG 4.16Å; M608-E610 HydrophobicContact CE-CG 4.35Å; M608-E610 PolarHBondContact O-N 2.96Å; M608-F629 HydrophobicContact CE-CE1 4.04Å; M608-F629 HydrophobicContact CE-CZ 4.23Å; M608-F629 HydrophobicContact SD-CE1 4.29Å; M608-F629 HydrophobicContact SD-CZ 4.2Å
609	G	86.3	Confident	86.9	Confident	49 Å²	49	51.6 Å²	51.6	51%	0.505	29%	0.292	S	S	.	.	T	Hydrogen-bonded Turn	trans	73.8	11.8	-174.4	0	0	0	0	0	115.4	L605 S606 M607 S611	L605-G609 PolarHBondContact O-N 3.43Å; S606-G609 PolarHBondContact O-N 3.35Å; M607-G609 VanDerWaalsContact C-N 3.33Å; G609-S611 PolarHBondContact O-N 3.45Å
610	E	84.4	Confident	86.8	Confident	39 Å²	39	52.2 Å²	52.2	18%	0.182	28%	0.284	C	S	.	.			trans	-79.5	66.3	-176.6	-72.5	-76.7	-161.7	0	0	111.7	L605 M608 S612 L613 Y614 R632	L605-E610 PolarHBondContact O-N 3.49Å; M608-E610 VanDerWaalsContact C-N 3.3Å; M608-E610 HydrophobicContact CB-CG 4.16Å; M608-E610 HydrophobicContact CE-CG 4.35Å; M608-E610 PolarHBondContact O-N 2.96Å; E610-S612 PolarHBondContact O-N 3.45Å; E610-S612 VanDerWaalsContact O-N 3.1Å; E610-L613 HydrophobicContact CB-CD1 4.04Å; E610-L613 HydrophobicContact CB-CG 4.45Å; E610-L613 PolarHBondContact O-N 3.44Å; E610-Y614 WeakPolarHBondContact O-CD1 3.45Å; E610-Y614 WeakPolarHBondContact O-CE1 3.3Å; E610-R632 IonicContact OE1-CZ 3.54Å; E610-R632 VanDerWaalsContact OE1-CZ 3.3Å; E610-R632 IonicContact OE1-NH1 3.91Å; E610-R632 PolarHBondContact OE1-NH1 3.34Å; E610-R632 IonicContact OE1-NH2 2.67Å; E610-R632 PolarHBondContact OE1-NH2 3.09Å
611	S	87	Confident	86.8	Confident	87 Å²	87	54.6 Å²	54.6	61%	0.608	30%	0.296	S	S	*	.	G	3₁₀ helix	trans	-61.2	-20	-174	60.9	0	0	0	0	115.4	G609 L613 Y614	G609-S611 PolarHBondContact O-N 3.45Å; S611-L613 PolarHBondContact O-N 2.83Å; S611-Y614 VanDerWaalsContact CA-CZ 3.49Å
612	S	89	Confident	86.7	Confident	84 Å²	84	54.7 Å²	54.7	59%	0.587	30%	0.297	S	S	*	.	G	3₁₀ helix	trans	-61.2	-27.5	171.6	55.9	0	0	0	0	113.2	E610	E610-S612 PolarHBondContact O-N 3.45Å; E610-S612 VanDerWaalsContact O-N 3.1Å
613	L	88.9	Confident	86.6	Confident	9 Å²	9	54.8 Å²	54.8	5%	0.047	30%	0.302	C	S	.	.	G	3₁₀ helix	trans	-98.4	-10	-173.4	-57.6	175.3	0	0	0	113.9	L605 E610 S611 A615 A616 A617 L625 H628 F629	L605-L613 HydrophobicContact CD1-CB 4.31Å; L605-L613 HydrophobicContact CD2-CB 4.24Å; L605-L613 HydrophobicContact CD2-CD1 3.81Å; E610-L613 HydrophobicContact CB-CD1 4.04Å; E610-L613 HydrophobicContact CB-CG 4.45Å; E610-L613 PolarHBondContact O-N 3.44Å; S611-L613 PolarHBondContact O-N 2.83Å; L613-A615 VanDerWaalsContact C-N 3.34Å; L613-A615 PolarHBondContact O-N 3.17Å; L613-A616 WeakPolarHBondContact O-CB 3.05Å; L613-A616 PolarHBondContact O-N 3.04Å; L613-A617 PolarHBondContact O-N 3.25Å; L613-L625 HydrophobicContact CB-CD2 3.88Å; L613-L625 HydrophobicContact CD1-CD2 4.37Å; L613-L625 HydrophobicContact CD2-CD2 4.22Å; L613-L625 HydrophobicContact CG-CD2 4.38Å; L613-H628 HydrophobicContact CD2-CB 4.1Å; L613-F629 HydrophobicContact CD1-CE2 3.71Å; L613-F629 HydrophobicContact CD1-CZ 4.23Å
614	Y	87.1	Confident	86.7	Confident	56 Å²	56	53.5 Å²	53.5	22%	0.22	30%	0.3	C	S	.	.	H	α-helix	trans	-57	-49.5	-178.4	-63.1	-4.5	0	0	0	110.7	L605 E610 S611 A616 A617 D618	L605-Y614 HydrophobicContact CB-CD1 4.35Å; L605-Y614 HydrophobicContact CB-CE1 4.33Å; E610-Y614 WeakPolarHBondContact O-CD1 3.45Å; E610-Y614 WeakPolarHBondContact O-CE1 3.3Å; S611-Y614 VanDerWaalsContact CA-CZ 3.49Å; Y614-A616 PolarHBondContact O-N 2.91Å; Y614-A617 PolarHBondContact O-N 3.31Å; Y614-A617 VanDerWaalsContact O-N 3.11Å; Y614-D618 WeakPolarHBondContact O-CB 3.47Å; Y614-D618 PolarHBondContact O-N 2.67Å; Y614-D618 VanDerWaalsContact O-OD2 3.07Å
615	A	86.7	Confident	86.7	Confident	52 Å²	52	53.6 Å²	53.6	43%	0.43	30%	0.3	S	S	.	.	H	α-helix	trans	-64.8	-20.7	178.1	0	0	0	0	0	114.3	L613 R619	L613-A615 VanDerWaalsContact C-N 3.34Å; L613-A615 PolarHBondContact O-N 3.17Å; A615-R619 WeakPolarHBondContact O-CB 3.46Å; A615-R619 VanDerWaalsContact O-CD 3.24Å; A615-R619 WeakPolarHBondContact O-CD 3.23Å; A615-R619 WeakPolarHBondContact O-CG 3.49Å; A615-R619 PolarHBondContact O-N 3.21Å
616	A	86.8	Confident	86.8	Confident	12 Å²	12	55.5 Å²	55.5	10%	0.099	31%	0.31	C	S	.	.	H	α-helix	trans	-78.9	-43	172.7	0	0	0	0	0	110.8	L613 Y614 R619 R620 D621 T624 L625	L613-A616 WeakPolarHBondContact O-CB 3.05Å; L613-A616 PolarHBondContact O-N 3.04Å; Y614-A616 PolarHBondContact O-N 2.91Å; A616-R619 CarbonylContact O-C 3.52Å; A616-R619 PolarHBondContact O-N 2.92Å; A616-R620 PolarHBondContact O-N 3.47Å; A616-R620 VanDerWaalsContact O-N 3.12Å; A616-D621 HydrophobicContact CB-CB 4.4Å; A616-D621 PolarHBondContact O-N 3.45Å; A616-T624 HydrophobicContact CB-CG2 4.08Å; A616-L625 HydrophobicContact CB-CD2 4.03Å; A616-L625 HydrophobicContact CB-CG 4.09Å
617	A	83.6	Confident	86.7	Confident	5 Å²	5	55.2 Å²	55.2	4%	0.041	31%	0.311	C	S	.	.	H	α-helix	trans	-64.9	-45.1	174.1	0	0	0	0	0	112.4	R602 L605 L613 Y614 R619 R620 L625	R602-A617 HydrophobicContact CB-CB 4.34Å; L605-A617 HydrophobicContact CD1-CB 3.76Å; L613-A617 PolarHBondContact O-N 3.25Å; Y614-A617 PolarHBondContact O-N 3.31Å; Y614-A617 VanDerWaalsContact O-N 3.11Å; A617-R619 PolarHBondContact O-N 3.22Å; A617-R620 PolarHBondContact O-N 2.84Å; A617-L625 HydrophobicContact CB-CD1 4.33Å
618	D	83.9	Confident	87	Confident	98 Å²	98	53.9 Å²	53.9	52%	0.524	30%	0.303	S	S	.	.	H	α-helix	trans	-60.3	-28.8	177.1	-61.8	-29.2	0	0	0	112.1	R602 Y614	R602-D618 WeakPolarHBondContact CD-OD1 3.45Å; R602-D618 IonicContact CZ-OD1 2.7Å; R602-D618 IonicContact NE-OD1 2.88Å; R602-D618 PolarHBondContact NE-OD1 2.86Å; R602-D618 IonicContact NE-OD2 2.79Å; R602-D618 PolarHBondContact NE-OD2 3.3Å; R602-D618 IonicContact NH2-OD1 3.18Å; R602-D618 IonicContact NH2-OD2 2.73Å; Y614-D618 WeakPolarHBondContact O-CB 3.47Å; Y614-D618 PolarHBondContact O-N 2.67Å; Y614-D618 VanDerWaalsContact O-OD2 3.07Å
619	R	84.6	Confident	86.9	Confident	179 Å²	179	52 Å²	52	68%	0.675	29%	0.294	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.7	1.5	176.1	-67.1	175.1	-173.2	-170.9	1.6	114	A615 A616 A617 D621	A615-R619 WeakPolarHBondContact O-CB 3.46Å; A615-R619 VanDerWaalsContact O-CD 3.24Å; A615-R619 WeakPolarHBondContact O-CD 3.23Å; A615-R619 WeakPolarHBondContact O-CG 3.49Å; A615-R619 PolarHBondContact O-N 3.21Å; A616-R619 CarbonylContact O-C 3.52Å; A616-R619 PolarHBondContact O-N 2.92Å; A617-R619 PolarHBondContact O-N 3.22Å; R619-D621 PolarHBondContact O-N 3.46Å
620	R	85.5	Confident	86.5	Confident	83 Å²	83	52.7 Å²	52.7	31%	0.313	29%	0.291	S	S	.	.	T	Hydrogen-bonded Turn	trans	55.7	32.3	-174.4	-55	-177.7	-175.7	-154.3	-4.3	114.1	A590 D595 W598 A616 A617 L622	A590-R620 PolarHBondContact O-NH1 3.28Å; D595-R620 VanDerWaalsContact CG-NH2 3.35Å; D595-R620 IonicContact OD1-CZ 3.03Å; D595-R620 IonicContact OD1-NH1 3.37Å; D595-R620 PolarHBondContact OD1-NH1 3.35Å; D595-R620 IonicContact OD1-NH2 3.06Å; D595-R620 PolarHBondContact OD1-NH2 3.35Å; D595-R620 IonicContact OD2-NH2 3.57Å; W598-R620 HydrophobicContact CD2-CB 4.12Å; W598-R620 HydrophobicContact CD2-CG 3.84Å; W598-R620 HydrophobicContact CE3-CB 4.4Å; W598-R620 HydrophobicContact CE3-CG 4.26Å; W598-R620 HydrophobicContact CG-CG 4.11Å; W598-R620 VanDerWaalsContact CH2-C 3.41Å; W598-R620 VanDerWaalsContact CH2-CA 3.48Å; W598-R620 HydrophobicContact CH2-CB 4.04Å; W598-R620 WeakPolarHBondContact CH2-O 3.48Å; W598-R620 HydrophobicContact CZ2-CB 3.69Å; W598-R620 HydrophobicContact CZ2-CG 4.33Å; W598-R620 HydrophobicContact CZ3-CB 4.37Å; A616-R620 PolarHBondContact O-N 3.47Å; A616-R620 VanDerWaalsContact O-N 3.12Å; A617-R620 PolarHBondContact O-N 2.84Å; R620-L622 PolarHBondContact O-N 2.89Å
621	D	87.3	Confident	85.3	Confident	63 Å²	63	57 Å²	57	34%	0.337	31%	0.312	S	S	.	.			trans	-80.7	81.5	178.6	-175.3	-1.3	0	0	0	111.6	A616 R619 D623 T624 L625	A616-D621 HydrophobicContact CB-CB 4.4Å; A616-D621 PolarHBondContact O-N 3.45Å; R619-D621 PolarHBondContact O-N 3.46Å; D621-D623 VanDerWaalsContact C-N 3.27Å; D621-D623 PolarHBondContact O-N 2.93Å; D621-D623 PolarHBondContact OD1-N 3.39Å; D621-T624 VanDerWaalsContact CG-OG1 3.28Å; D621-T624 PolarHBondContact OD1-N 2.9Å; D621-T624 VanDerWaalsContact OD1-N 3.11Å; D621-T624 PolarHBondContact OD1-OG1 3.4Å; D621-T624 VanDerWaalsContact OD2-CB 3.27Å; D621-T624 WeakPolarHBondContact OD2-CB 3.15Å; D621-T624 PolarHBondContact OD2-OG1 3.11Å; D621-L625 WeakPolarHBondContact O-CG 3.3Å; D621-L625 PolarHBondContact O-N 3.25Å
622	L	87.3	Confident	83.7	Confident	3 Å²	3	57 Å²	57	2%	0.016	30%	0.298	C	S	.	.	H	α-helix	trans	-65.1	-26.5	179.7	-172.8	58.8	0	0	0	113.3	L565 L568 R572 M593 W598 R620 L626	L565-L622 HydrophobicContact CD2-CD1 3.55Å; L568-L622 HydrophobicContact CB-CD1 3.96Å; L568-L622 HydrophobicContact CB-CD2 3.83Å; L568-L622 HydrophobicContact CD1-CD1 4.17Å; R572-L622 HydrophobicContact CB-CD2 4.36Å; M593-L622 HydrophobicContact CE-CD2 4.44Å; M593-L622 HydrophobicContact SD-CD2 4.16Å; W598-L622 HydrophobicContact CH2-CB 3.92Å; W598-L622 HydrophobicContact CH2-CD1 4.3Å; W598-L622 HydrophobicContact CZ2-CB 4.16Å; R620-L622 PolarHBondContact O-N 2.89Å; L622-L626 HydrophobicContact CD1-CD1 4.21Å; L622-L626 HydrophobicContact CD1-CG 4.07Å; L622-L626 HydrophobicContact CD2-CD1 4.42Å; L622-L626 HydrophobicContact CG-CD1 3.82Å; L622-L626 HydrophobicContact CG-CG 4.17Å; L622-L626 VanDerWaalsContact O-CB 3.32Å; L622-L626 WeakPolarHBondContact O-CB 3.33Å; L622-L626 VanDerWaalsContact O-CG 3.24Å; L622-L626 WeakPolarHBondContact O-CG 3.32Å; L622-L626 PolarHBondContact O-N 3.44Å
623	D	87.4	Confident	81.7	Confident	70 Å²	70	59.8 Å²	59.8	37%	0.374	30%	0.302	S	S	.	.	H	α-helix	trans	-71.4	-44.3	179.8	-79.4	-21.6	0	0	0	111.4	R572 D621 L625 A627	R572-D623 IonicContact CZ-OD1 2.78Å; R572-D623 IonicContact NH1-OD1 3.33Å; R572-D623 PolarHBondContact NH1-OD1 3.47Å; R572-D623 IonicContact NH1-OD2 3.11Å; R572-D623 IonicContact NH2-OD1 3.41Å; R572-D623 PolarHBondContact NH2-OD1 3.21Å; D621-D623 VanDerWaalsContact C-N 3.27Å; D621-D623 PolarHBondContact O-N 2.93Å; D621-D623 PolarHBondContact OD1-N 3.39Å; D623-L625 VanDerWaalsContact C-N 3.33Å; D623-L625 PolarHBondContact O-N 3.42Å; D623-A627 VanDerWaalsContact O-CB 3.28Å; D623-A627 WeakPolarHBondContact O-CB 3.33Å; D623-A627 PolarHBondContact O-N 3.09Å
624	T	88.5	Confident	79.4	Confident	67 Å²	67	64.9 Å²	64.9	41%	0.411	33%	0.333	S	S	.	.	H	α-helix	trans	-63.1	-40.3	175.9	-67.2	0	0	0	0	111.5	A616 D621 H628	A616-T624 HydrophobicContact CB-CG2 4.08Å; D621-T624 VanDerWaalsContact CG-OG1 3.28Å; D621-T624 PolarHBondContact OD1-N 2.9Å; D621-T624 VanDerWaalsContact OD1-N 3.11Å; D621-T624 PolarHBondContact OD1-OG1 3.4Å; D621-T624 VanDerWaalsContact OD2-CB 3.27Å; D621-T624 WeakPolarHBondContact OD2-CB 3.15Å; D621-T624 PolarHBondContact OD2-OG1 3.11Å; T624-H628 PolarHBondContact O-N 3.21Å; T624-H628 VanDerWaalsContact O-N 3.17Å
625	L	89.1	Confident	77.3	Confident	1 Å²	1	69 Å²	69	1%	0.005	35%	0.354	C	S	.	.	H	α-helix	trans	-67.6	-49.8	178.1	-66	167.7	0	0	0	111.9	L565 W598 L601 L605 L613 A616 A617 D621 D623 A627 H628 F629	L565-L625 HydrophobicContact CD1-CB 4.47Å; L565-L625 HydrophobicContact CD2-CB 3.62Å; L565-L625 HydrophobicContact CD2-CD1 4.16Å; L565-L625 HydrophobicContact CD2-CG 4.49Å; W598-L625 HydrophobicContact CH2-CD1 4.12Å; W598-L625 HydrophobicContact CZ3-CD1 3.68Å; L601-L625 HydrophobicContact CD2-CD1 4.2Å; L605-L625 HydrophobicContact CD1-CD2 4.09Å; L613-L625 HydrophobicContact CB-CD2 3.88Å; L613-L625 HydrophobicContact CD1-CD2 4.37Å; L613-L625 HydrophobicContact CD2-CD2 4.22Å; L613-L625 HydrophobicContact CG-CD2 4.38Å; A616-L625 HydrophobicContact CB-CD2 4.03Å; A616-L625 HydrophobicContact CB-CG 4.09Å; A617-L625 HydrophobicContact CB-CD1 4.33Å; D621-L625 WeakPolarHBondContact O-CG 3.3Å; D621-L625 PolarHBondContact O-N 3.25Å; D623-L625 VanDerWaalsContact C-N 3.33Å; D623-L625 PolarHBondContact O-N 3.42Å; L625-A627 VanDerWaalsContact C-N 3.31Å; L625-A627 PolarHBondContact O-N 2.97Å; L625-H628 PolarHBondContact O-N 3.06Å; L625-H628 VanDerWaalsContact O-N 3.17Å; L625-F629 WeakPolarHBondContact O-CD2 3.39Å; L625-F629 PolarHBondContact O-N 3.3Å
626	L	89.6	Confident	75.1	Confident	40 Å²	40	69.5 Å²	69.5	21%	0.209	36%	0.364	C	S	.	.	H	α-helix	trans	-58.1	-43.4	176.1	-75	169.8	0	0	0	111.5	L565 R572 L622 H628 F629 S630	L565-L626 HydrophobicContact CB-CD2 3.96Å; R572-L626 VanDerWaalsContact NH2-CD1 3.28Å; L622-L626 HydrophobicContact CD1-CD1 4.21Å; L622-L626 HydrophobicContact CD1-CG 4.07Å; L622-L626 HydrophobicContact CD2-CD1 4.42Å; L622-L626 HydrophobicContact CG-CD1 3.82Å; L622-L626 HydrophobicContact CG-CG 4.17Å; L622-L626 VanDerWaalsContact O-CB 3.32Å; L622-L626 WeakPolarHBondContact O-CB 3.33Å; L622-L626 VanDerWaalsContact O-CG 3.24Å; L622-L626 WeakPolarHBondContact O-CG 3.32Å; L622-L626 PolarHBondContact O-N 3.44Å; L626-H628 VanDerWaalsContact C-N 3.31Å; L626-H628 PolarHBondContact O-N 3.32Å; L626-F629 PolarHBondContact O-N 3.25Å; L626-S630 WeakPolarHBondContact O-CB 3.36Å; L626-S630 PolarHBondContact O-N 3.49Å; L626-S630 PolarHBondContact O-OG 3.24Å
627	A	88	Confident	72.6	Confident	41 Å²	41	72.3 Å²	72.3	34%	0.339	40%	0.395	S	S	.	.	H	α-helix	trans	-58.8	-41	177.6	0	0	0	0	0	112.6	D623 L625 Q631	D623-A627 VanDerWaalsContact O-CB 3.28Å; D623-A627 WeakPolarHBondContact O-CB 3.33Å; D623-A627 PolarHBondContact O-N 3.09Å; L625-A627 VanDerWaalsContact C-N 3.31Å; L625-A627 PolarHBondContact O-N 2.97Å; A627-Q631 WeakPolarHBondContact O-CB 3.24Å; A627-Q631 VanDerWaalsContact O-CD 3.27Å; A627-Q631 WeakPolarHBondContact O-CG 3.25Å; A627-Q631 PolarHBondContact O-N 2.88Å; A627-Q631 PolarHBondContact O-NE2 3.24Å
628	H	87.9	Confident	70.1	Confident	45 Å²	45	76.7 Å²	76.7	21%	0.208	43%	0.425	C	S	.	.	H	α-helix	trans	-65.6	-43.7	179.1	-177.7	-93.8	0	0	0	113	L613 T624 L625 L626	L613-H628 HydrophobicContact CD2-CB 4.1Å; T624-H628 PolarHBondContact O-N 3.21Å; T624-H628 VanDerWaalsContact O-N 3.17Å; L625-H628 PolarHBondContact O-N 3.06Å; L625-H628 VanDerWaalsContact O-N 3.17Å; L626-H628 VanDerWaalsContact C-N 3.31Å; L626-H628 PolarHBondContact O-N 3.32Å
629	F	85.5	Confident	67.6	Low	8 Å²	8	84.6 Å²	84.6	4%	0.035	46%	0.459	C	S	.	.	H	α-helix	trans	-77.8	-40.2	-178.4	-76.3	-91.2	0	0	0	112.4	V561 E562 L565 L605 M608 L613 L625 L626 Q631 R632	V561-F629 HydrophobicContact CB-CE1 4.27Å; V561-F629 HydrophobicContact CB-CZ 4.19Å; V561-F629 HydrophobicContact CG1-CD1 4.26Å; V561-F629 HydrophobicContact CG1-CD2 4.11Å; V561-F629 HydrophobicContact CG1-CE1 3.74Å; V561-F629 HydrophobicContact CG1-CE2 3.57Å; V561-F629 HydrophobicContact CG1-CG 4.45Å; V561-F629 HydrophobicContact CG1-CZ 3.38Å; E562-F629 HydrophobicContact CG-CD1 4.19Å; L565-F629 HydrophobicContact CD1-CB 4.19Å; L565-F629 HydrophobicContact CD1-CD2 3.63Å; L565-F629 HydrophobicContact CD1-CE2 4.27Å; L565-F629 HydrophobicContact CD1-CG 3.97Å; L605-F629 HydrophobicContact CD2-CE2 4.06Å; L605-F629 HydrophobicContact CD2-CZ 4.01Å; M608-F629 HydrophobicContact CE-CE1 4.04Å; M608-F629 HydrophobicContact CE-CZ 4.23Å; M608-F629 HydrophobicContact SD-CE1 4.29Å; M608-F629 HydrophobicContact SD-CZ 4.2Å; L613-F629 HydrophobicContact CD1-CE2 3.71Å; L613-F629 HydrophobicContact CD1-CZ 4.23Å; L625-F629 WeakPolarHBondContact O-CD2 3.39Å; L625-F629 PolarHBondContact O-N 3.3Å; L626-F629 PolarHBondContact O-N 3.25Å; F629-Q631 VanDerWaalsContact C-N 3.32Å; F629-Q631 PolarHBondContact O-N 3.4Å; F629-R632 PolarHBondContact O-N 3.42Å
630	S	78.1	Confident	66.7	Low	65 Å²	65	79.9 Å²	79.9	46%	0.455	45%	0.448	S	S	.	.	H	α-helix	trans	-66.6	-27	176.6	-57.9	0	0	0	0	114.2	L626	L626-S630 WeakPolarHBondContact O-CB 3.36Å; L626-S630 PolarHBondContact O-N 3.49Å; L626-S630 PolarHBondContact O-OG 3.24Å
631	Q	59.4	Low	65.8	Low	130 Å²	130	79.7 Å²	79.7	61%	0.607	46%	0.455	S	S	*	.	H	α-helix	trans	-75.1	-34.8	178.6	-75.7	169.7	26.3	0	0	112.4	A627 F629 E633 V634	A627-Q631 WeakPolarHBondContact O-CB 3.24Å; A627-Q631 VanDerWaalsContact O-CD 3.27Å; A627-Q631 WeakPolarHBondContact O-CG 3.25Å; A627-Q631 PolarHBondContact O-N 2.88Å; A627-Q631 PolarHBondContact O-NE2 3.24Å; F629-Q631 VanDerWaalsContact C-N 3.32Å; F629-Q631 PolarHBondContact O-N 3.4Å; Q631-E633 PolarHBondContact O-N 3Å; Q631-V634 PolarHBondContact O-N 3.38Å
632	R	53	Low	64.6	Low	86 Å²	86	80.7 Å²	80.7	33%	0.325	46%	0.462	S	S	.	.	H	α-helix	trans	-72.4	-24.1	-178.4	-83.5	-179	169.6	175.2	0.5	114.2	E610 F629 V634 E635 G636	E610-R632 IonicContact OE1-CZ 3.54Å; E610-R632 VanDerWaalsContact OE1-CZ 3.3Å; E610-R632 IonicContact OE1-NH1 3.91Å; E610-R632 PolarHBondContact OE1-NH1 3.34Å; E610-R632 IonicContact OE1-NH2 2.67Å; E610-R632 PolarHBondContact OE1-NH2 3.09Å; F629-R632 PolarHBondContact O-N 3.42Å; R632-V634 PolarHBondContact O-N 2.84Å; R632-E635 PolarHBondContact O-N 3.49Å; R632-G636 PolarHBondContact O-N 2.93Å
633	E	47.2	Very low	63.2	Low	142 Å²	142	85.2 Å²	85.2	66%	0.664	49%	0.488	S	S	*	.	H	α-helix	trans	-61.6	-32.3	171.5	-68.1	-168.7	128.9	0	0	112.3	Q631	Q631-E633 PolarHBondContact O-N 3Å
634	V	42	Very low	61.7	Low	117 Å²	117	86.2 Å²	86.2	71%	0.709	50%	0.495	S	S	*	.	H	α-helix	trans	-76	-33.5	-179.2	-176.3	0	0	0	0	111.7	Q631 R632	Q631-V634 PolarHBondContact O-N 3.38Å; R632-V634 PolarHBondContact O-N 2.84Å
635	E	42	Very low	59.9	Low	142 Å²	142	87.5 Å²	87.5	66%	0.664	50%	0.501	S	S	*	.	H	α-helix	trans	-82.8	-37.4	178.2	-63.4	-174.4	151.3	0	0	112	R632 G637 S638	R632-E635 PolarHBondContact O-N 3.49Å; E635-G637 PolarHBondContact O-N 3.31Å; E635-S638 PolarHBondContact O-N 3.11Å; E635-S638 PolarHBondContact O-OG 2.76Å
636	G	40.2	Very low	57.8	Low	62 Å²	62	93.6 Å²	93.6	64%	0.639	54%	0.536	S	S	*	.	H	α-helix	trans	-69.9	-11.4	179.4	0	0	0	0	0	115.6	R632 S638	R632-G636 PolarHBondContact O-N 2.93Å; G636-S638 PolarHBondContact O-N 3.11Å
637	G	34	Very low	55.4	Low	72 Å²	72	97.8 Å²	97.8	74%	0.742	56%	0.561	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.4	11.3	172.3	0	0	0	0	0	114.7	E635	E635-G637 PolarHBondContact O-N 3.31Å
638	S	32.5	Very low	52.7	Low	96 Å²	96	102.5 Å²	102.5	67%	0.671	58%	0.58	S	S	*	*	T	Hydrogen-bonded Turn	trans	-138.2	28.5	-169.9	61.4	0	0	0	0	116.3	E635 G636	E635-S638 PolarHBondContact O-N 3.11Å; E635-S638 PolarHBondContact O-OG 2.76Å; G636-S638 PolarHBondContact O-N 3.11Å
639	E	30.6	Very low	49.5	Very low	265 Å²	265	107.7 Å²	107.7	100%	1.238	61%	0.614	S	S	*	*			trans	-119.7	0	163.5	-66.9	-161.5	140.4	0	0	112.4

Retrieved 639 of 639 residues in 399 ms (Link to these results)

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