A0A087YPH9_POEFO Loading...

Transcription factor RFX3

AlphaFold DB , UniProt , Accession A0A087YPH9, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 761 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	33.1	Very low	35.3	Very low	233 Å²	233	136.3 Å²	136.3	100%	1.148	83%	0.828	S	S	*	*				0	154	0	-79.4	175.9	167.4	0	0	108
2	Q	33.2	Very low	34.7	Very low	190 Å²	190	133.8 Å²	133.8	89%	0.888	82%	0.821	S	S	*	*			trans	58.9	108.6	162	-72.1	166.1	-23.3	0	0	118.7
3	T	39.3	Very low	34.1	Very low	131 Å²	131	133.1 Å²	133.1	80%	0.804	82%	0.817	S	S	*	*			trans	-77.4	-175.6	147.8	48.8	0	0	0	0	109.9
4	P	63.5	Low	33.5	Very low	108 Å²	108	133.9 Å²	133.9	70%	0.701	82%	0.821	S	S	*	*			cis	-117.9	-140.6	-5.4	41.3	-23.6	0	0	0	110.7
5	E	35.2	Very low	33.7	Very low	180 Å²	180	132.2 Å²	132.2	84%	0.841	81%	0.813	S	S	*	*			cis	-159.8	171.7	-0.8	-120.7	-178	99.4	0	0	105
6	A	35.7	Very low	33.3	Very low	91 Å²	91	133.9 Å²	133.9	75%	0.752	81%	0.814	S	S	*	*			cis	-172.5	163.3	-42.1	0	0	0	0	0	108.3
7	G	29.8	Very low	32.9	Very low	81 Å²	81	136.2 Å²	136.2	84%	0.835	81%	0.814	S	S	*	*			trans	147.3	122.2	169.6	0	0	0	0	0	117.1
8	A	31.5	Very low	32.4	Very low	89 Å²	89	136.2 Å²	136.2	74%	0.736	82%	0.815	S	S	*	*			trans	-51	163.1	168	0	0	0	0	0	115.7
9	D	28.8	Very low	32.2	Very low	153 Å²	153	136.1 Å²	136.1	82%	0.818	82%	0.815	S	S	*	*			cis	-156.1	156.6	-1	-106	-26.8	0	0	0	109.8
10	S	29.7	Very low	31.9	Very low	111 Å²	111	135.6 Å²	135.6	78%	0.776	81%	0.813	S	S	*	*			trans	-159.9	127.4	173.8	-77.4	0	0	0	0	116.6
11	T	29	Very low	31.9	Very low	132 Å²	132	134.9 Å²	134.9	81%	0.81	81%	0.812	S	S	*	*			trans	26.5	120.1	143.8	60.2	0	0	0	0	123.1
12	S	27.1	Very low	31.7	Very low	106 Å²	106	130.3 Å²	130.3	74%	0.741	80%	0.796	S	S	*	*			trans	82.3	155.2	132.3	-144	0	0	0	0	122.6
13	T	27	Very low	31.5	Very low	125 Å²	125	130.2 Å²	130.2	77%	0.767	80%	0.796	S	S	*	*			trans	54.3	120	162.4	48.6	0	0	0	0	121.6
14	V	26.5	Very low	31.4	Very low	145 Å²	145	128.8 Å²	128.8	88%	0.879	79%	0.789	S	S	*	*			trans	-147.4	133.1	147	-176	0	0	0	0	110.5
15	P	36.6	Very low	29.7	Very low	108 Å²	108	130.1 Å²	130.1	70%	0.701	80%	0.795	S	S	*	*			trans	-117.3	150.7	167.8	37.9	-28.3	0	0	0	115.5
16	L	27.3	Very low	29.2	Very low	159 Å²	159	125.1 Å²	125.1	83%	0.832	79%	0.792	S	S	*	*			trans	70.3	155.3	154.5	-107.3	88.9	0	0	0	123.2
17	Q	25.3	Very low	28.7	Very low	174 Å²	174	126.1 Å²	126.1	81%	0.813	79%	0.794	S	S	*	*			trans	70.2	141.5	174.4	-59.4	-169.4	5.6	0	0	115.6
18	T	25.5	Very low	28.5	Very low	135 Å²	135	128.4 Å²	128.4	83%	0.828	79%	0.791	S	S	*	*				-145.8	179.4	50.6	-52.6	0	0	0	0	113.5
19	T	27.2	Very low	28.2	Very low	134 Å²	134	132.1 Å²	132.1	82%	0.822	79%	0.794	S	S	*	*			trans	-97.7	174.8	-159.2	44.3	0	0	0	0	117.9
20	V	27.4	Very low	28	Very low	127 Å²	127	132.7 Å²	132.7	77%	0.77	79%	0.791	S	S	*	*			trans	-71.5	146.2	179.6	176.9	0	0	0	0	113.6
21	P	31.4	Very low	27.8	Very low	121 Å²	121	133.1 Å²	133.1	79%	0.786	79%	0.789	S	S	*	*			trans	-91.7	147.1	170.8	35.7	-34.3	0	0	0	114.5
22	V	29	Very low	27.7	Very low	136 Å²	136	133 Å²	133	82%	0.824	79%	0.791	S	S	*	*			trans	-145.1	133.7	173.6	175	0	0	0	0	109.6
23	Q	29.1	Very low	27.7	Very low	189 Å²	189	133.5 Å²	133.5	88%	0.883	79%	0.789	S	S	*	*			trans	-165.1	170.1	165.9	-113.6	-175.2	13	0	0	112.1
24	P	36.6	Very low	27.6	Very low	101 Å²	101	137 Å²	137	66%	0.656	80%	0.796	S	S	*	*				-135.5	-173.5	-114.9	43.8	-24.8	0	0	0	117.9
25	T	27.5	Very low	27.6	Very low	136 Å²	136	138.1 Å²	138.1	83%	0.834	79%	0.792	S	S	*	*			trans	3	143.4	154.1	57.5	0	0	0	0	120.7
26	G	25.7	Very low	27.1	Very low	75 Å²	75	141.6 Å²	141.6	77%	0.773	80%	0.799	S	S	*	*			cis	134.3	133.7	-2.6	0	0	0	0	0	114.3
27	S	24.9	Very low	27	Very low	112 Å²	112	142 Å²	142	78%	0.783	80%	0.797	S	S	*	*			trans	-167.5	126.2	172.1	60.2	0	0	0	0	117.2
28	T	25.9	Very low	27	Very low	128 Å²	128	138.3 Å²	138.3	79%	0.785	80%	0.796	S	S	*	*			trans	21.5	126.2	148.5	58.3	0	0	0	0	123.3
29	Q	25.5	Very low	26.9	Very low	168 Å²	168	141 Å²	141	79%	0.785	80%	0.799	S	S	*	*				179.7	140.9	98	-95.8	-166.7	1.6	0	0	116.3
30	Q	24.9	Very low	26.8	Very low	164 Å²	164	140.6 Å²	140.6	77%	0.766	80%	0.797	S	S	*	*			trans	51.5	110.2	145.7	-61.4	-173.8	-1.6	0	0	124.9
31	V	24.3	Very low	26.6	Very low	120 Å²	120	140.9 Å²	140.9	73%	0.727	80%	0.798	S	S	*	*			trans	-2.9	142.1	137.3	-152.3	0	0	0	0	119.2	V33	V31-V33 HydrophobicContact CG1-CG2 3.73Å
32	P	28.1	Very low	26.2	Very low	130 Å²	130	143.2 Å²	143.2	84%	0.844	80%	0.799	S	S	*	*				-125.9	152.5	110.9	37	-33.7	0	0	0	114.3
33	V	25.3	Very low	26	Very low	116 Å²	116	145.6 Å²	145.6	70%	0.703	80%	0.801	S	S	*	*			trans	-95.4	144.5	179.1	173.2	0	0	0	0	110.5	V31 Q35	V31-V33 HydrophobicContact CG1-CG2 3.73Å; V33-Q35 HydrophobicContact CG1-CG 4.38Å
34	Q	26.8	Very low	25.8	Very low	199 Å²	199	143.3 Å²	143.3	93%	0.93	80%	0.8	S	S	*	*			trans	-127.7	135.1	158.3	-113.2	178.1	1	0	0	111.2
35	Q	25.6	Very low	25.2	Very low	168 Å²	168	145.4 Å²	145.4	79%	0.785	80%	0.8	S	S	*	*			trans	-103.5	133.5	-179	-64.1	173.2	-27.1	0	0	110.5	V33	V33-Q35 HydrophobicContact CG1-CG 4.38Å
36	Q	26.6	Very low	25.1	Very low	181 Å²	181	146.1 Å²	146.1	85%	0.846	79%	0.794	S	S	*	*			trans	-178.8	144.3	153.4	-101.6	150.3	53.2	0	0	108.8
37	Q	24.8	Very low	25.1	Very low	168 Å²	168	149.4 Å²	149.4	79%	0.785	80%	0.799	S	S	*	*			cis	-157.9	140.9	-25.7	-152.6	168.5	5.5	0	0	107.3
38	A	24.4	Very low	25.2	Very low	97 Å²	97	154 Å²	154	80%	0.802	80%	0.8	S	S	*	*			trans	-76	128.5	176.4	0	0	0	0	0	110.6
39	Q	24.6	Very low	25.3	Very low	192 Å²	192	152.9 Å²	152.9	90%	0.897	80%	0.796	S	S	*	*			trans	-112	119.6	165.1	-76.5	-171.3	-16.1	0	0	109.8
40	T	23.8	Very low	25.2	Very low	125 Å²	125	149.6 Å²	149.6	77%	0.767	80%	0.797	S	S	*	*			trans	-104.4	166.6	168.2	48.9	0	0	0	0	109.6
41	V	22.9	Very low	25.2	Very low	132 Å²	132	150.2 Å²	150.2	80%	0.8	80%	0.8	S	S	*	*			trans	74.6	130.8	-175.5	-167.2	0	0	0	0	110.4
42	Q	23.1	Very low	25.3	Very low	171 Å²	171	150.5 Å²	150.5	80%	0.799	80%	0.802	S	S	*	*			cis	-138.1	145.2	34.3	-157	164.3	29.9	0	0	113.9
43	Q	25.6	Very low	25	Very low	186 Å²	186	152 Å²	152	87%	0.869	80%	0.797	S	S	*	*			trans	-75.8	135.8	165.2	-71.6	175.2	-48.3	0	0	110
44	V	25	Very low	24.9	Very low	141 Å²	141	155.8 Å²	155.8	86%	0.855	80%	0.8	S	S	*	*			trans	-128	139.5	158.8	-178.6	0	0	0	0	107.3
45	Q	24	Very low	24.8	Very low	144 Å²	144	152.9 Å²	152.9	67%	0.673	80%	0.796	S	S	*	*			trans	-123.1	142.9	-160.4	-172.2	-179.9	-35.7	0	0	111.3
46	H	25.8	Very low	24.8	Very low	152 Å²	152	152.8 Å²	152.8	70%	0.704	80%	0.796	S	S	*	*			trans	66.7	106.4	179.1	-57.1	-56.2	0	0	0	117.4
47	V	25.2	Very low	24.8	Very low	144 Å²	144	153.6 Å²	153.6	87%	0.873	80%	0.8	S	S	*	*			trans	-116.1	137.8	144.3	178.1	0	0	0	0	106.6
48	Y	26.4	Very low	24.9	Very low	207 Å²	207	152.2 Å²	152.2	81%	0.812	80%	0.798	S	S	*	*			trans	-73.1	150	-177.9	-88.8	-106.9	0	0	0	112
49	P	28.4	Very low	24.9	Very low	106 Å²	106	153.4 Å²	153.4	69%	0.688	80%	0.8	S	S	*	*			trans	-67.6	132.5	170.8	29.4	-34	0	0	0	110.4	Q51	P49-Q51 PolarHBondContact O-N 2.86Å; P49-Q51 VanDerWaalsContact O-N 3.09Å
50	A	24.1	Very low	25	Very low	99 Å²	99	147.1 Å²	147.1	82%	0.818	79%	0.787	S	S	*	*			trans	-71.6	101.2	167.4	0	0	0	0	0	109.1	V52	A50-V52 PolarHBondContact O-N 3.38Å
51	Q	23.8	Very low	25.1	Very low	177 Å²	177	146.9 Å²	146.9	83%	0.827	79%	0.785	S	S	*	*			trans	-68.1	114.9	173.4	-70	-178.7	-51.8	0	0	109.5	P49 Q53	P49-Q51 PolarHBondContact O-N 2.86Å; P49-Q51 VanDerWaalsContact O-N 3.09Å; Q51-Q53 PolarHBondContact O-N 3.23Å; Q51-Q53 VanDerWaalsContact O-N 3.07Å
52	V	26.2	Very low	25.1	Very low	125 Å²	125	151.4 Å²	151.4	76%	0.758	79%	0.789	S	S	*	*			trans	-76.1	94.1	169.3	-178.8	0	0	0	0	107.8	A50 Y54	A50-V52 PolarHBondContact O-N 3.38Å; V52-Y54 PolarHBondContact O-N 3.2Å
53	Q	22.5	Very low	25.2	Very low	161 Å²	161	149.2 Å²	149.2	75%	0.752	79%	0.788	S	S	*	*			trans	-68.1	109.8	172.2	-174.1	75.4	39.4	0	0	108.8	Q51	Q51-Q53 PolarHBondContact O-N 3.23Å; Q51-Q53 VanDerWaalsContact O-N 3.07Å
54	Y	24.3	Very low	25.2	Very low	196 Å²	196	148.6 Å²	148.6	77%	0.769	79%	0.79	S	S	*	*			trans	-64.3	136.1	167.5	-77.8	-107.1	0	0	0	109.4	V52	V52-Y54 PolarHBondContact O-N 3.2Å
55	V	23.7	Very low	25.1	Very low	139 Å²	139	145.6 Å²	145.6	84%	0.842	79%	0.788	S	S	*	*			trans	-105.9	96.3	160	178.7	0	0	0	0	106.2
56	E	26.3	Very low	25.2	Very low	166 Å²	166	146.9 Å²	146.9	78%	0.776	80%	0.799	S	S	*	*			trans	-91.7	114.6	177.3	-173.3	172.2	-145.6	0	0	108.2	N58	E56-N58 PolarHBondContact O-N 3.37Å
57	E	25.3	Very low	25.1	Very low	198 Å²	198	146.8 Å²	146.8	93%	0.925	80%	0.802	S	S	*	*			trans	-75.3	106.1	169.3	-80.3	-165.6	128.5	0	0	109.1
58	N	27.4	Very low	25.2	Very low	139 Å²	139	151 Å²	151	74%	0.743	80%	0.803	S	S	*	*			trans	-138.4	145.5	164.8	-161.7	4.5	0	0	0	111.2	E56	E56-N58 PolarHBondContact O-N 3.37Å
59	S	24.3	Very low	25	Very low	121 Å²	121	146.3 Å²	146.3	85%	0.846	80%	0.795	S	S	*	*			trans	-100.5	127.5	179.8	-65.2	0	0	0	0	109.9
60	G	26.2	Very low	24.8	Very low	61 Å²	61	151.9 Å²	151.9	63%	0.629	80%	0.804	S	S	*	*			cis	164.5	-122.4	-0	0	0	0	0	0	109.9
61	V	25.8	Very low	24.7	Very low	120 Å²	120	152.9 Å²	152.9	73%	0.727	80%	0.801	S	S	*	*			trans	77.7	142.3	165.4	-142.5	0	0	0	0	118.3
62	Y	24.6	Very low	24.8	Very low	226 Å²	226	155.2 Å²	155.2	89%	0.886	80%	0.803	S	S	*	*			trans	72	127.4	168.9	-62.1	-63.1	0	0	0	120.7
63	T	23.8	Very low	24.7	Very low	125 Å²	125	154.4 Å²	154.4	77%	0.767	80%	0.803	S	S	*	*			trans	-102.2	129.7	171.2	46.7	0	0	0	0	111.1
64	N	25.3	Very low	24.8	Very low	174 Å²	174	154.9 Å²	154.9	93%	0.93	81%	0.805	S	S	*	*			trans	167.2	130.1	137.9	-90.7	-42	0	0	0	111.1
65	G	24.2	Very low	24.9	Very low	77 Å²	77	151.2 Å²	151.2	79%	0.794	81%	0.805	S	S	*	*			trans	163.4	114.6	173.5	0	0	0	0	0	114.3
66	N	25.1	Very low	25	Very low	171 Å²	171	152.9 Å²	152.9	91%	0.914	80%	0.804	S	S	*	*			trans	-53.1	139.6	-174.3	-70.8	-33.3	0	0	0	115.9
67	I	25	Very low	25	Very low	151 Å²	151	153 Å²	153	77%	0.774	81%	0.809	S	S	*	*			trans	-71.4	142.7	170.6	-66.4	165.7	0	0	0	111.3
68	R	26.6	Very low	25	Very low	233 Å²	233	154.7 Å²	154.7	88%	0.879	81%	0.809	S	S	*	*			trans	-124.1	129.9	149.8	-81.1	-170	172.5	-166.4	-0.9	109.6
69	T	22.4	Very low	24.8	Very low	107 Å²	107	153.3 Å²	153.3	66%	0.656	81%	0.81	S	S	*	*			trans	-85.3	136.1	-173.2	-48.7	0	0	0	0	112.2
70	Y	24.1	Very low	25	Very low	223 Å²	223	156.1 Å²	156.1	88%	0.875	81%	0.81	S	S	*	*			trans	-133.8	136	152.5	-75.5	-75	0	0	0	109.6
71	T	22.8	Very low	24.9	Very low	121 Å²	121	160.8 Å²	160.8	74%	0.742	82%	0.82	S	S	*	*			trans	-103	140.6	-175.9	-50.6	0	0	0	0	109.8
72	Y	24.6	Very low	25	Very low	226 Å²	226	160.1 Å²	160.1	89%	0.886	82%	0.821	S	S	*	*			trans	-137.5	155.6	164.1	-113.7	-87.9	0	0	0	111.6
73	S	24.6	Very low	25	Very low	107 Å²	107	153.5 Å²	153.5	75%	0.748	82%	0.822	S	S	*	*	P	Polyproline II helix	trans	-99.2	150.8	-167.7	41.4	0	0	0	0	114
74	E	23.5	Very low	25.1	Very low	172 Å²	172	151.4 Å²	151.4	80%	0.804	83%	0.825	S	S	*	*	P	Polyproline II helix	trans	-101.9	129.2	-177	-179.2	-176.5	-125	0	0	111.5
75	P	28.4	Very low	25	Very low	118 Å²	118	148.5 Å²	148.5	77%	0.766	82%	0.818	S	S	*	*	P	Polyproline II helix	trans	-101.4	124.2	169	33.6	-26.2	0	0	0	111.9
76	Q	25.6	Very low	25	Very low	174 Å²	174	154.4 Å²	154.4	81%	0.813	82%	0.818	S	S	*	*	P	Polyproline II helix	trans	-80.4	145.9	172.7	-66.7	-168.7	-3.1	0	0	112.3
77	L	25.1	Very low	25.1	Very low	170 Å²	170	155.3 Å²	155.3	89%	0.89	81%	0.814	S	S	*	*			trans	-133.2	99.6	166.4	-89.6	171.3	0	0	0	111.5
78	Y	25	Very low	25	Very low	232 Å²	232	154.3 Å²	154.3	91%	0.91	81%	0.81	S	S	*	*			trans	-134.6	115.6	155	-130.4	-86.6	0	0	0	106.7
79	S	24.6	Very low	24.9	Very low	111 Å²	111	149.8 Å²	149.8	78%	0.776	81%	0.809	S	S	*	*			trans	-102.1	123	178.6	-173.8	0	0	0	0	109.7
80	Q	28.8	Very low	25	Very low	180 Å²	180	153.6 Å²	153.6	84%	0.841	82%	0.819	S	S	*	*			trans	-118.3	115.1	178.1	-175.8	178.3	13.1	0	0	108.5
81	N	24.2	Very low	25.1	Very low	158 Å²	158	146.8 Å²	146.8	85%	0.845	82%	0.817	S	S	*	*			trans	-109.9	106.5	-171.8	-157.2	29	0	0	0	111.6
82	S	27.8	Very low	25.1	Very low	107 Å²	107	147 Å²	147	75%	0.748	82%	0.823	S	S	*	*			trans	-139.3	113.4	171.7	-72.2	0	0	0	0	108.4
83	G	24.6	Very low	25.1	Very low	87 Å²	87	141.4 Å²	141.4	90%	0.897	82%	0.817	S	S	*	*			trans	-78.9	137.6	-169.2	0	0	0	0	0	115.1
84	G	24.9	Very low	25.2	Very low	81 Å²	81	142.1 Å²	142.1	84%	0.835	82%	0.822	S	S	*	*			trans	-151.8	148.5	166.1	0	0	0	0	0	108.1
85	S	24	Very low	25.2	Very low	112 Å²	112	142.7 Å²	142.7	78%	0.783	83%	0.825	S	S	*	*			trans	-117.2	155.4	-160.3	-159.5	0	0	0	0	115.1
86	Y	23	Very low	24.9	Very low	201 Å²	201	143.7 Å²	143.7	79%	0.788	83%	0.828	S	S	*	*			trans	96.7	135.7	152	-107.2	-75.2	0	0	0	122
87	F	27	Very low	24.7	Very low	191 Å²	191	140.2 Å²	140.2	84%	0.838	82%	0.823	S	S	*	*			trans	73.5	143.1	170.6	-96	-71.8	0	0	0	120.3
88	D	23.2	Very low	24.6	Very low	130 Å²	130	138.9 Å²	138.9	70%	0.695	82%	0.822	S	S	*	*			trans	-142	139.5	-167.4	167.9	32.4	0	0	0	108.7
89	T	25.8	Very low	24.4	Very low	138 Å²	138	134.3 Å²	134.3	85%	0.847	82%	0.818	S	S	*	*			trans	-156.5	142.7	165.1	-17.5	0	0	0	0	111.6
90	Q	23.8	Very low	24.3	Very low	187 Å²	187	135.2 Å²	135.2	87%	0.874	82%	0.819	S	S	*	*			trans	-84.3	154.5	-170.3	-59.9	172.4	-9.2	0	0	114.3
91	G	25.7	Very low	24	Very low	80 Å²	80	132.1 Å²	132.1	83%	0.825	81%	0.812	S	S	*	*			trans	-159.6	124.9	172.3	0	0	0	0	0	113.7
92	S	24.2	Very low	24.2	Very low	124 Å²	124	129.5 Å²	129.5	87%	0.867	81%	0.806	S	S	*	*			trans	-69.3	152.5	-169.2	-173.2	0	0	0	0	115.9
93	S	24.4	Very low	24.1	Very low	110 Å²	110	133.7 Å²	133.7	77%	0.769	81%	0.814	S	S	*	*			trans	-80.5	154.6	170.1	57.7	0	0	0	0	114.5
94	S	25.9	Very low	24.1	Very low	121 Å²	121	133 Å²	133	85%	0.846	81%	0.806	S	S	*	*			trans	-157.5	153.8	151.7	53.8	0	0	0	0	111.2
95	Q	23.1	Very low	24.1	Very low	185 Å²	185	138.3 Å²	138.3	86%	0.864	81%	0.811	S	S	*	*			trans	-126.8	153.6	178.6	-71.2	-167.6	1.6	0	0	111.6
96	V	22.4	Very low	24.2	Very low	139 Å²	139	139.1 Å²	139.1	84%	0.842	81%	0.812	S	S	*	*			trans	-143.1	147.9	163.9	-177.2	0	0	0	0	109.1
97	S	21.4	Very low	24.5	Very low	101 Å²	101	136.5 Å²	136.5	71%	0.706	81%	0.811	S	S	*	*			trans	-142.6	150.8	176.9	-57.9	0	0	0	0	111.4
98	T	22.3	Very low	24.5	Very low	141 Å²	141	134.3 Å²	134.3	87%	0.865	81%	0.809	S	S	*	*			trans	-153	170.3	170.4	10	0	0	0	0	112.4
99	V	20.6	Very low	24.7	Very low	136 Å²	136	131.7 Å²	131.7	82%	0.824	81%	0.812	S	S	*	*			trans	-138.2	-174.6	-153.1	-169.4	0	0	0	0	111.3
100	V	22.6	Very low	24.6	Very low	130 Å²	130	129.2 Å²	129.2	79%	0.788	81%	0.814	S	S	*	*			trans	95.2	136.9	162.5	179.8	0	0	0	0	116.1
101	T	22.9	Very low	24.7	Very low	115 Å²	115	124.2 Å²	124.2	71%	0.706	81%	0.813	S	S	*	*			cis	-165.4	155.1	-23.4	-87.4	0	0	0	0	109.2
102	S	28.1	Very low	24.6	Very low	103 Å²	103	125.4 Å²	125.4	72%	0.72	81%	0.809	S	S	*	*			trans	-88	155.5	178	56	0	0	0	0	115.9
103	H	26	Very low	24.8	Very low	196 Å²	196	126 Å²	126	91%	0.907	81%	0.807	S	S	*	*			trans	-150.2	165.1	161.4	-98	64.2	0	0	0	110.7
104	G	24.9	Very low	24.8	Very low	71 Å²	71	124.3 Å²	124.3	73%	0.732	81%	0.807	S	S	*	*			trans	-163.3	172.5	179.4	0	0	0	0	0	114.2
105	M	24.6	Very low	24.8	Very low	193 Å²	193	121.8 Å²	121.8	95%	0.951	80%	0.8	S	S	*	*			trans	-154.7	172.1	-175.1	-100.2	159.6	173	0	0	112.9
106	T	26.1	Very low	24.9	Very low	129 Å²	129	121.7 Å²	121.7	79%	0.791	80%	0.802	S	S	*	*			trans	-143.1	157.2	-151.5	51.5	0	0	0	0	117.6
107	N	28.9	Very low	25	Very low	146 Å²	146	120.3 Å²	120.3	78%	0.781	80%	0.798	S	S	*	*			trans	67.4	153.3	163.2	-78.4	39.3	0	0	0	118.4
108	N	28.3	Very low	25.1	Very low	146 Å²	146	123.5 Å²	123.5	78%	0.781	80%	0.804	S	S	*	*			cis	-137.1	175.3	4.6	-91.4	-31.8	0	0	0	109.6
109	G	26.3	Very low	25.2	Very low	75 Å²	75	120.1 Å²	120.1	77%	0.773	80%	0.797	S	S	*	*			cis	125.9	107.9	-7.1	0	0	0	0	0	115.8
110	G	24.3	Very low	25.4	Very low	85 Å²	85	122.5 Å²	122.5	88%	0.876	80%	0.802	S	S	*	*			trans	166.8	115.9	166.1	0	0	0	0	0	120.1
111	G	25	Very low	25.5	Very low	83 Å²	83	121.4 Å²	121.4	86%	0.856	81%	0.806	S	S	*	*			trans	74.4	152.3	158.5	0	0	0	0	0	119.3
112	S	24.9	Very low	25.6	Very low	105 Å²	105	119.8 Å²	119.8	73%	0.734	81%	0.813	S	S	*	*			cis	-161.6	144.5	-14.9	-170.6	0	0	0	0	111.4
113	T	27.6	Very low	25.5	Very low	136 Å²	136	118.9 Å²	118.9	83%	0.834	82%	0.819	S	S	*	*			trans	26.2	137	153.7	53.3	0	0	0	0	122.1
114	G	25.4	Very low	25.5	Very low	74 Å²	74	118.3 Å²	118.3	76%	0.763	82%	0.817	S	S	*	*			cis	158.3	163	-2.9	0	0	0	0	0	113.9
115	G	24.5	Very low	25.5	Very low	68 Å²	68	121.4 Å²	121.4	70%	0.701	82%	0.822	S	S	*	*			trans	74.7	-179.9	176.2	0	0	0	0	0	115
116	M	25.7	Very low	25.6	Very low	183 Å²	183	119.6 Å²	119.6	90%	0.901	81%	0.814	S	S	*	*			cis	-161.2	150.6	-20.5	-86.9	-42.7	-176.9	0	0	106
117	S	23.9	Very low	25.5	Very low	111 Å²	111	118.6 Å²	118.6	78%	0.776	81%	0.812	S	S	*	*			cis	-158.8	-171.9	-13.6	-168.9	0	0	0	0	108
118	M	23.5	Very low	25.3	Very low	168 Å²	168	117.6 Å²	117.6	83%	0.828	82%	0.817	S	S	*	*			trans	-138.3	139	175.6	-101.1	-75.4	-77.5	0	0	111.9
119	G	24.4	Very low	25.2	Very low	70 Å²	70	115.7 Å²	115.7	72%	0.722	82%	0.815	S	S	*	*			trans	-116.5	129.3	175.6	0	0	0	0	0	111.6
120	M	25.7	Very low	25.2	Very low	185 Å²	185	118.8 Å²	118.8	91%	0.911	83%	0.825	S	S	*	*			trans	-108.2	124.5	179.3	-76.9	-177.5	65.3	0	0	112.5
121	A	25	Very low	25.3	Very low	107 Å²	107	117.2 Å²	117.2	88%	0.884	81%	0.808	S	S	*	*			trans	-159	145.4	147.1	0	0	0	0	0	107.4
122	G	24	Very low	25.3	Very low	82 Å²	82	118.3 Å²	118.3	85%	0.845	81%	0.809	S	S	*	*			cis	149.7	113.5	-4	0	0	0	0	0	110.3
123	G	27.6	Very low	25.4	Very low	83 Å²	83	123.8 Å²	123.8	86%	0.856	82%	0.815	S	S	*	*			trans	123.7	117.3	177.5	0	0	0	0	0	113.8
124	Q	25	Very low	25.2	Very low	184 Å²	184	125.5 Å²	125.5	86%	0.86	82%	0.819	S	S	*	*			trans	-91.3	144.9	156.8	-74.8	-173.9	-57.2	0	0	108.9
125	V	26.1	Very low	25.2	Very low	137 Å²	137	130.5 Å²	130.5	83%	0.83	82%	0.824	S	S	*	*			trans	-131	132.4	155.4	-164.8	0	0	0	0	106.9
126	I	24.9	Very low	25.1	Very low	155 Å²	155	134.2 Å²	134.2	80%	0.795	83%	0.828	S	S	*	*			trans	-95.1	122.5	179.6	-61.1	169.8	0	0	0	107.7
127	S	24.6	Very low	25	Very low	107 Å²	107	132.8 Å²	132.8	75%	0.748	82%	0.824	S	S	*	*			trans	-139.1	133	170.8	-71.3	0	0	0	0	110.5
128	S	25.8	Very low	25.2	Very low	125 Å²	125	131.9 Å²	131.9	87%	0.874	82%	0.824	S	S	*	*			trans	-103.9	103.3	-171.8	52	0	0	0	0	112
129	S	25.9	Very low	25.4	Very low	107 Å²	107	126.5 Å²	126.5	75%	0.748	81%	0.811	S	S	*	*			trans	-152.6	102.8	172.7	57.9	0	0	0	0	111.8	G131	S129-G131 PolarHBondContact O-N 2.92Å
130	S	26.5	Very low	25.6	Very low	139 Å²	139	129.4 Å²	129.4	97%	0.972	82%	0.817	S	S	*	*			trans	-83.6	60.5	177.3	-61.6	0	0	0	0	112.5
131	G	26.1	Very low	25.8	Very low	52 Å²	52	129.1 Å²	129.1	54%	0.536	81%	0.813	S	S	.	*			trans	-86.4	114.9	170.6	0	0	0	0	0	111.3	S129 Y133	S129-G131 PolarHBondContact O-N 2.92Å; G131-Y133 PolarHBondContact O-N 3.37Å
132	A	25	Very low	25.9	Very low	106 Å²	106	129.8 Å²	129.8	88%	0.876	81%	0.808	S	S	*	*			trans	-89.9	88.3	-179.8	0	0	0	0	0	111.4
133	Y	25.4	Very low	26	Very low	220 Å²	220	130.7 Å²	130.7	86%	0.863	81%	0.808	S	S	*	*			trans	-84.8	134.4	171.6	-71.2	-77.3	0	0	0	111.7	G131	G131-Y133 PolarHBondContact O-N 3.37Å
134	L	25.2	Very low	26.1	Very low	172 Å²	172	133.5 Å²	133.5	90%	0.901	81%	0.808	S	S	*	*			trans	-72.9	133.3	168.9	-71.8	162.5	0	0	0	109.4
135	M	23.7	Very low	26.3	Very low	180 Å²	180	133.6 Å²	133.6	89%	0.887	81%	0.809	S	S	*	*			trans	-130.5	105.9	161.6	-101.2	-66.5	-165.4	0	0	108.2
136	D	22.9	Very low	26.5	Very low	145 Å²	145	134 Å²	134	78%	0.775	81%	0.812	S	S	*	*			trans	-75.6	140.8	160.8	179.7	26.6	0	0	0	108.7
137	N	24.8	Very low	27	Very low	153 Å²	153	131.3 Å²	131.3	82%	0.818	81%	0.813	S	S	*	*			trans	-158.5	90.9	170.4	-161.6	5.3	0	0	0	110.6	G139	N137-G139 PolarHBondContact O-N 2.85Å
138	A	26.9	Very low	27.8	Very low	93 Å²	93	137.8 Å²	137.8	77%	0.769	82%	0.821	S	S	*	*			trans	-75.9	115.5	179.2	0	0	0	0	0	112
139	G	27.1	Very low	28.5	Very low	54 Å²	54	134.3 Å²	134.3	56%	0.557	80%	0.8	S	S	*	*			trans	-138.5	134.5	172.6	0	0	0	0	0	111.3	N137	N137-G139 PolarHBondContact O-N 2.85Å
140	P	29.8	Very low	29.3	Very low	131 Å²	131	131.7 Å²	131.7	85%	0.851	78%	0.781	S	S	*	*	P	Polyproline II helix	trans	-82.6	125.8	-167.9	30.9	-34.6	0	0	0	113.3
141	H	28.8	Very low	30.2	Very low	180 Å²	180	129.8 Å²	129.8	83%	0.833	77%	0.766	S	S	*	*	P	Polyproline II helix	trans	-99.7	142.4	163.8	-70.2	-48.4	0	0	0	110.9
142	P	28	Very low	31.1	Very low	120 Å²	120	130.1 Å²	130.1	78%	0.779	76%	0.764	S	S	*	*	P	Polyproline II helix	trans	-73.4	145.8	-172.8	29.8	-35.6	0	0	0	112.7	T144	P142-T144 PolarHBondContact O-N 2.79Å
143	A	27.2	Very low	32.6	Very low	101 Å²	101	127.8 Å²	127.8	84%	0.835	74%	0.738	S	S	*	*			trans	-68.8	111.4	-176.8	0	0	0	0	0	112.8	Q145	A143-Q145 PolarHBondContact O-N 3.4Å
144	T	28.6	Very low	33.8	Very low	142 Å²	142	119.4 Å²	119.4	87%	0.871	71%	0.708	S	S	*	*			trans	-73.6	119.6	165.2	14.6	0	0	0	0	110.1	P142	P142-T144 PolarHBondContact O-N 2.79Å
145	Q	29.3	Very low	35.1	Very low	187 Å²	187	117.5 Å²	117.5	87%	0.874	70%	0.695	S	S	*	*			trans	-67.8	147.4	179.6	-64.1	-179.7	4.1	0	0	111.7	A143 A147	A143-Q145 PolarHBondContact O-N 3.4Å; Q145-A147 PolarHBondContact O-N 3.02Å
146	T	30.9	Very low	36.6	Very low	145 Å²	145	114.9 Å²	114.9	89%	0.89	68%	0.682	S	S	*	*			trans	-68.7	90.5	179.2	50.5	0	0	0	0	111.8	R148	T146-R148 PolarHBondContact O-N 3.33Å; T146-R148 VanDerWaalsContact O-N 3.16Å
147	A	33.9	Very low	38	Very low	99 Å²	99	108.8 Å²	108.8	82%	0.818	65%	0.651	S	S	*	*			trans	-67.5	109.2	171.2	0	0	0	0	0	110.4	Q145 A149	Q145-A147 PolarHBondContact O-N 3.02Å; A147-A149 PolarHBondContact O-N 3.44Å
148	R	41.6	Very low	39.4	Very low	242 Å²	242	102.8 Å²	102.8	91%	0.913	62%	0.619	S	S	*	*	P	Polyproline II helix	trans	-59.9	134.1	167.5	-144.2	178.8	-169.8	122.7	-3.5	108	T146 S150	T146-R148 PolarHBondContact O-N 3.33Å; T146-R148 VanDerWaalsContact O-N 3.16Å; R148-S150 PolarHBondContact O-N 3.28Å
149	A	41.8	Very low	40.6	Very low	52 Å²	52	103 Å²	103	43%	0.43	60%	0.604	S	S	.	*	P	Polyproline II helix	trans	-56.8	128	174.7	0	0	0	0	0	109.7	A147	A147-A149 PolarHBondContact O-N 3.44Å
150	S	41.7	Very low	41.9	Very low	52 Å²	52	104.8 Å²	104.8	36%	0.364	61%	0.605	S	S	.	*	P	Polyproline II helix	trans	-71.5	152	-177.8	77.3	0	0	0	0	110.9	R148 A152 T153 I154	R148-S150 PolarHBondContact O-N 3.28Å; S150-A152 PolarHBondContact O-N 2.96Å; S150-T153 WeakPolarHBondContact O-CB 3.49Å; S150-T153 PolarHBondContact O-N 3.21Å; S150-T153 PolarHBondContact OG-N 3.21Å; S150-T153 PolarHBondContact OG-OG1 3.3Å; S150-I154 PolarHBondContact O-N 3.47Å
151	P	46.2	Very low	42.8	Very low	100 Å²	100	100.4 Å²	100.4	65%	0.649	57%	0.574	S	S	*	*	H	α-helix	trans	-53	-37.2	174.2	-28.1	36.1	0	0	0	113.1	T153 I154 E155	P151-T153 VanDerWaalsContact C-N 3.34Å; P151-T153 PolarHBondContact O-N 2.88Å; P151-I154 WeakPolarHBondContact O-CB 3.41Å; P151-I154 PolarHBondContact O-N 3.01Å; P151-I154 VanDerWaalsContact O-N 3.11Å; P151-E155 PolarHBondContact O-N 3.38Å
152	A	45.4	Very low	43.8	Very low	59 Å²	59	95.5 Å²	95.5	49%	0.488	55%	0.551	S	S	.	*	H	α-helix	trans	-64.4	-33.4	175.9	0	0	0	0	0	113.5	S150 I154 M156	S150-A152 PolarHBondContact O-N 2.96Å; A152-I154 VanDerWaalsContact C-N 3.31Å; A152-M156 VanDerWaalsContact O-CB 3.28Å; A152-M156 WeakPolarHBondContact O-CB 3.39Å; A152-M156 PolarHBondContact O-N 3.05Å
153	T	54.8	Low	44.7	Very low	56 Å²	56	97 Å²	97	34%	0.344	55%	0.545	S	S	.	.	H	α-helix	trans	-66.4	-37.1	173.2	-48.1	0	0	0	0	111.1	S150 P151 A157 M229	S150-T153 WeakPolarHBondContact O-CB 3.49Å; S150-T153 PolarHBondContact O-N 3.21Å; S150-T153 PolarHBondContact OG-N 3.21Å; S150-T153 PolarHBondContact OG-OG1 3.3Å; P151-T153 VanDerWaalsContact C-N 3.34Å; P151-T153 PolarHBondContact O-N 2.88Å; T153-A157 PolarHBondContact O-N 3.16Å; T153-A157 VanDerWaalsContact O-N 3.12Å; T153-M229 HydrophobicContact CG2-CE 3.98Å
154	I	52.2	Low	45.8	Very low	45 Å²	45	95.8 Å²	95.8	23%	0.231	53%	0.531	C	S	.	.	H	α-helix	trans	-69.7	-47.2	178.1	-69.6	168.3	0	0	0	110.6	S150 P151 A152 M156 A157 I158 L179 L183	S150-I154 PolarHBondContact O-N 3.47Å; P151-I154 WeakPolarHBondContact O-CB 3.41Å; P151-I154 PolarHBondContact O-N 3.01Å; P151-I154 VanDerWaalsContact O-N 3.11Å; A152-I154 VanDerWaalsContact C-N 3.31Å; I154-M156 PolarHBondContact O-N 3.44Å; I154-A157 WeakPolarHBondContact O-CB 3.47Å; I154-A157 PolarHBondContact O-N 3Å; I154-I158 HydrophobicContact CG2-CD1 4.02Å; I154-I158 WeakPolarHBondContact O-CG1 3.32Å; I154-I158 PolarHBondContact O-N 3.43Å; I154-L179 HydrophobicContact CG2-CD1 4.32Å; I154-L179 HydrophobicContact CG2-CD2 3.52Å; I154-L179 HydrophobicContact CG2-CG 4.46Å; I154-L183 HydrophobicContact CD1-CD1 3.85Å
155	E	52.2	Low	46.6	Very low	132 Å²	132	94.7 Å²	94.7	62%	0.617	52%	0.516	S	S	*	.	H	α-helix	trans	-61	-41.9	175.7	-71.4	-179.9	158.6	0	0	112.1	P151 A157 I158 E159	P151-E155 PolarHBondContact O-N 3.38Å; E155-A157 VanDerWaalsContact C-N 3.34Å; E155-A157 PolarHBondContact O-N 3.37Å; E155-I158 WeakPolarHBondContact O-CB 3.45Å; E155-I158 PolarHBondContact O-N 2.89Å; E155-I158 VanDerWaalsContact O-N 3.16Å; E155-E159 PolarHBondContact O-N 3.5Å
156	M	54.9	Low	47.4	Very low	125 Å²	125	89.4 Å²	89.4	62%	0.616	51%	0.512	S	S	*	.	H	α-helix	trans	-64.2	-36.4	177	-168.8	178.6	-61.5	0	0	112.6	A152 I154 T160	A152-M156 VanDerWaalsContact O-CB 3.28Å; A152-M156 WeakPolarHBondContact O-CB 3.39Å; A152-M156 PolarHBondContact O-N 3.05Å; I154-M156 PolarHBondContact O-N 3.44Å; M156-T160 WeakPolarHBondContact O-CB 3.44Å; M156-T160 PolarHBondContact O-N 3.1Å; M156-T160 PolarHBondContact O-OG1 3.06Å
157	A	53	Low	48.1	Very low	16 Å²	16	85.5 Å²	85.5	13%	0.132	49%	0.485	C	S	.	.	H	α-helix	trans	-65.2	-40.7	172	0	0	0	0	0	112.2	T153 I154 E155 T160 L161	T153-A157 PolarHBondContact O-N 3.16Å; T153-A157 VanDerWaalsContact O-N 3.12Å; I154-A157 WeakPolarHBondContact O-CB 3.47Å; I154-A157 PolarHBondContact O-N 3Å; E155-A157 VanDerWaalsContact C-N 3.34Å; E155-A157 PolarHBondContact O-N 3.37Å; A157-T160 PolarHBondContact O-N 2.98Å; A157-L161 WeakPolarHBondContact O-CG 3.25Å; A157-L161 PolarHBondContact O-N 3.44Å
158	I	52.8	Low	48.9	Very low	28 Å²	28	84.3 Å²	84.3	14%	0.144	47%	0.471	C	S	.	.	H	α-helix	trans	-64.1	-48.9	176	-67.3	164.8	0	0	0	110.7	I154 E155 T160 L161 Q162 L179	I154-I158 HydrophobicContact CG2-CD1 4.02Å; I154-I158 WeakPolarHBondContact O-CG1 3.32Å; I154-I158 PolarHBondContact O-N 3.43Å; E155-I158 WeakPolarHBondContact O-CB 3.45Å; E155-I158 PolarHBondContact O-N 2.89Å; E155-I158 VanDerWaalsContact O-N 3.16Å; I158-T160 VanDerWaalsContact C-N 3.33Å; I158-T160 PolarHBondContact O-N 3.27Å; I158-L161 PolarHBondContact O-N 3.21Å; I158-Q162 HydrophobicContact CG2-CG 4.41Å; I158-Q162 WeakPolarHBondContact O-CG 3.5Å; I158-Q162 PolarHBondContact O-N 3.32Å; I158-L179 HydrophobicContact CD1-CD2 3.81Å; I158-L179 HydrophobicContact CG1-CD2 4.32Å
159	E	52.7	Low	49.1	Very low	96 Å²	96	77.7 Å²	77.7	45%	0.449	46%	0.461	S	S	.	.	H	α-helix	trans	-55.8	-45.2	175.2	-97.4	-137.7	117	0	0	112.4	E155 L161 Q162 K163	E155-E159 PolarHBondContact O-N 3.5Å; E159-L161 VanDerWaalsContact C-N 3.3Å; E159-L161 PolarHBondContact O-N 3.05Å; E159-Q162 PolarHBondContact O-N 2.62Å; E159-K163 WeakPolarHBondContact O-CB 3.5Å; E159-K163 PolarHBondContact O-N 2.78Å; E159-K163 VanDerWaalsContact OE1-CE 3.28Å; E159-K163 WeakPolarHBondContact OE1-CE 3.25Å; E159-K163 IonicContact OE1-NZ 3.2Å; E159-K163 PolarHBondContact OE1-NZ 3.34Å; E159-K163 IonicContact OE2-NZ 2.66Å; E159-K163 PolarHBondContact OE2-NZ 3.43Å
160	T	53.6	Low	49.2	Very low	93 Å²	93	82.9 Å²	82.9	57%	0.571	48%	0.477	S	S	*	.	H	α-helix	trans	-64	-37.9	-176.8	-59.6	0	0	0	0	111.4	M156 A157 I158	M156-T160 WeakPolarHBondContact O-CB 3.44Å; M156-T160 PolarHBondContact O-N 3.1Å; M156-T160 PolarHBondContact O-OG1 3.06Å; A157-T160 PolarHBondContact O-N 2.98Å; I158-T160 VanDerWaalsContact C-N 3.33Å; I158-T160 PolarHBondContact O-N 3.27Å
161	L	49.5	Very low	49.7	Very low	39 Å²	39	86.8 Å²	86.8	20%	0.204	48%	0.484	C	S	.	.	H	α-helix	trans	-70	-45.9	173.3	-68.5	168.2	0	0	0	111.4	A157 I158 E159 K163 S164 L223	A157-L161 WeakPolarHBondContact O-CG 3.25Å; A157-L161 PolarHBondContact O-N 3.44Å; I158-L161 PolarHBondContact O-N 3.21Å; E159-L161 VanDerWaalsContact C-N 3.3Å; E159-L161 PolarHBondContact O-N 3.05Å; L161-K163 VanDerWaalsContact C-N 3.35Å; L161-K163 PolarHBondContact O-N 2.85Å; L161-S164 PolarHBondContact O-N 2.81Å; L161-S164 VanDerWaalsContact O-N 3.09Å; L161-S164 PolarHBondContact O-OG 2.84Å; L161-L223 HydrophobicContact CD1-CD1 3.73Å
162	Q	50.5	Low	50	Low	77 Å²	77	84 Å²	84	36%	0.36	47%	0.466	S	S	.	.	H	α-helix	trans	-58.4	-41.8	179.2	-73.1	174.9	6.5	0	0	113.3	I158 E159 S164 G166	I158-Q162 HydrophobicContact CG2-CG 4.41Å; I158-Q162 WeakPolarHBondContact O-CG 3.5Å; I158-Q162 PolarHBondContact O-N 3.32Å; E159-Q162 PolarHBondContact O-N 2.62Å; Q162-S164 PolarHBondContact O-N 3.16Å; Q162-G166 PolarHBondContact O-N 2.86Å
163	K	46.9	Very low	50.7	Low	150 Å²	150	85.1 Å²	85.1	65%	0.652	47%	0.471	S	S	*	.	H	α-helix	trans	-66.4	-16.9	177.9	-78.6	166	179.2	158.9	0	113.9	E159 L161	E159-K163 WeakPolarHBondContact O-CB 3.5Å; E159-K163 PolarHBondContact O-N 2.78Å; E159-K163 VanDerWaalsContact OE1-CE 3.28Å; E159-K163 WeakPolarHBondContact OE1-CE 3.25Å; E159-K163 IonicContact OE1-NZ 3.2Å; E159-K163 PolarHBondContact OE1-NZ 3.34Å; E159-K163 IonicContact OE2-NZ 2.66Å; E159-K163 PolarHBondContact OE2-NZ 3.43Å; L161-K163 VanDerWaalsContact C-N 3.35Å; L161-K163 PolarHBondContact O-N 2.85Å
164	S	49.4	Very low	50.9	Low	76 Å²	76	85.8 Å²	85.8	53%	0.531	47%	0.472	S	S	.	.	H	α-helix	trans	-87.4	-23.5	-174.5	69.9	0	0	0	0	115.6	L161 Q162	L161-S164 PolarHBondContact O-N 2.81Å; L161-S164 VanDerWaalsContact O-N 3.09Å; L161-S164 PolarHBondContact O-OG 2.84Å; Q162-S164 PolarHBondContact O-N 3.16Å
165	E	46.5	Very low	51.5	Low	119 Å²	119	85.4 Å²	85.4	56%	0.556	47%	0.47	S	S	*	.	H	α-helix	trans	-135.9	4.9	-172.9	-70.5	-176.6	-175.5	0	0	115.1	L167	E165-L167 HydrophobicContact CB-CD1 3.95Å; E165-L167 HydrophobicContact CB-CD2 4.09Å; E165-L167 HydrophobicContact CB-CG 3.87Å; E165-L167 WeakPolarHBondContact O-CD2 3.48Å
166	G	46.1	Very low	52.3	Low	77 Å²	77	82.6 Å²	82.6	79%	0.794	46%	0.459	S	S	*	.	T	Hydrogen-bonded Turn	trans	64.8	46.8	169.2	0	0	0	0	0	115	Q162	Q162-G166 PolarHBondContact O-N 2.86Å
167	L	45.2	Very low	53.2	Low	63 Å²	63	78.8 Å²	78.8	33%	0.33	45%	0.445	S	S	.	.			trans	-98.6	146.7	-164.1	-56.9	173.8	0	0	0	113.9	E165 R171	E165-L167 HydrophobicContact CB-CD1 3.95Å; E165-L167 HydrophobicContact CB-CD2 4.09Å; E165-L167 HydrophobicContact CB-CG 3.87Å; E165-L167 WeakPolarHBondContact O-CD2 3.48Å; L167-R171 HydrophobicContact CB-CB 4.46Å
168	S	49.9	Very low	54.4	Low	73 Å²	73	78.5 Å²	78.5	51%	0.51	44%	0.441	S	S	.	.			trans	-80.2	159	-176.5	60.4	0	0	0	0	114.4	Q170 R171	S168-Q170 VanDerWaalsContact C-N 3.3Å; S168-Q170 PolarHBondContact O-N 3.42Å; S168-R171 PolarHBondContact O-N 2.99Å
169	S	45.1	Very low	55.7	Low	103 Å²	103	77.8 Å²	77.8	72%	0.72	44%	0.437	S	S	*	.	T	Hydrogen-bonded Turn	trans	-42.3	-44.8	-175.7	176.1	0	0	0	0	115.3	R171 S172	S169-R171 PolarHBondContact O-N 3.08Å; S169-R171 VanDerWaalsContact O-N 3.08Å; S169-S172 PolarHBondContact O-N 3.01Å; S169-S172 PolarHBondContact O-OG 3.34Å
170	Q	44.8	Very low	57.1	Low	161 Å²	161	78.1 Å²	78.1	75%	0.752	44%	0.439	S	S	*	.	H	α-helix	trans	-59.2	-25.5	-178.9	-73.2	173.6	-52	0	0	113.8	S168	S168-Q170 VanDerWaalsContact C-N 3.3Å; S168-Q170 PolarHBondContact O-N 3.42Å
171	R	51.3	Low	58.9	Low	135 Å²	135	75 Å²	75	51%	0.509	42%	0.417	S	S	.	.	H	α-helix	trans	-77.4	-16.9	176.4	-73.7	-179.8	168.7	140.4	-2	113.9	L167 S168 S169 L175	L167-R171 HydrophobicContact CB-CB 4.46Å; S168-R171 PolarHBondContact O-N 2.99Å; S169-R171 PolarHBondContact O-N 3.08Å; S169-R171 VanDerWaalsContact O-N 3.08Å; R171-L175 PolarHBondContact O-N 3.33Å; R171-L175 VanDerWaalsContact O-N 3.07Å
172	S	54.5	Low	60.8	Low	41 Å²	41	73.1 Å²	73.1	29%	0.287	41%	0.407	S	S	.	.	H	α-helix	trans	-71.6	-37.4	175.9	77.6	0	0	0	0	111.9	S169 L175 N176	S169-S172 PolarHBondContact O-N 3.01Å; S169-S172 PolarHBondContact O-OG 3.34Å; S172-L175 PolarHBondContact O-N 2.77Å; S172-N176 PolarHBondContact O-N 3.2Å; S172-N176 PolarHBondContact O-ND2 2.75Å
173	S	58.6	Low	62.6	Low	82 Å²	82	71.6 Å²	71.6	57%	0.573	40%	0.401	S	S	*	.	H	α-helix	trans	-58.8	-47	172.9	179.7	0	0	0	0	111.5	L175 N176 S177	S173-L175 PolarHBondContact O-N 3.18Å; S173-N176 PolarHBondContact O-N 2.79Å; S173-S177 PolarHBondContact O-N 3.46Å
174	L	60	Low	64.6	Low	71 Å²	71	68.2 Å²	68.2	37%	0.372	39%	0.39	S	S	.	.	H	α-helix	trans	-62.1	-43.2	177.7	-63.1	173.2	0	0	0	112.4	S177 H178 L212	L174-S177 PolarHBondContact O-N 3.16Å; L174-H178 PolarHBondContact O-N 3.07Å; L174-H178 VanDerWaalsContact O-N 3.12Å; L174-H178 PolarHBondContact O-ND1 3.47Å; L174-L212 HydrophobicContact CD2-CD1 4.19Å; L174-L212 HydrophobicContact CD2-CD2 3.65Å; L174-L212 HydrophobicContact CD2-CG 4.33Å
175	L	64.8	Low	66.6	Low	37 Å²	37	65.3 Å²	65.3	19%	0.194	37%	0.368	C	S	.	.	H	α-helix	trans	-63.1	-41.8	175.3	-82.1	165.4	0	0	0	112.3	R171 S172 S173 L179 L223	R171-L175 PolarHBondContact O-N 3.33Å; R171-L175 VanDerWaalsContact O-N 3.07Å; S172-L175 PolarHBondContact O-N 2.77Å; S173-L175 PolarHBondContact O-N 3.18Å; L175-L179 WeakPolarHBondContact O-CB 3.19Å; L175-L179 PolarHBondContact O-N 2.89Å; L175-L223 HydrophobicContact CD2-CD1 4.26Å
176	N	67.9	Low	68.8	Low	73 Å²	73	59.7 Å²	59.7	39%	0.39	34%	0.342	S	S	.	.	H	α-helix	trans	-65	-38.2	176.2	-80.6	-75.2	0	0	0	112.3	S172 S173 L179 Q180	S172-N176 PolarHBondContact O-N 3.2Å; S172-N176 PolarHBondContact O-ND2 2.75Å; S173-N176 PolarHBondContact O-N 2.79Å; N176-L179 PolarHBondContact O-N 3.39Å; N176-Q180 WeakPolarHBondContact O-CB 3.49Å; N176-Q180 PolarHBondContact O-N 3.04Å
177	S	74.5	Confident	70.9	Confident	45 Å²	45	58.7 Å²	58.7	32%	0.315	32%	0.317	S	S	.	.	H	α-helix	trans	-62.1	-50.7	175.6	-173.9	0	0	0	0	112.1	S173 L174 L179 Q180 W181	S173-S177 PolarHBondContact O-N 3.46Å; L174-S177 PolarHBondContact O-N 3.16Å; S177-L179 VanDerWaalsContact C-N 3.34Å; S177-L179 PolarHBondContact O-N 3.09Å; S177-Q180 PolarHBondContact O-N 3.31Å; S177-W181 PolarHBondContact O-N 2.93Å
178	H	78.8	Confident	73.1	Confident	10 Å²	10	60.1 Å²	60.1	5%	0.046	33%	0.328	C	S	.	.	H	α-helix	trans	-63.4	-37.8	177.8	-62.6	150.8	0	0	0	113	L174 L182 Y203 H206 C207 L212 L223	L174-H178 PolarHBondContact O-N 3.07Å; L174-H178 VanDerWaalsContact O-N 3.12Å; L174-H178 PolarHBondContact O-ND1 3.47Å; H178-L182 WeakPolarHBondContact O-CG 3.42Å; H178-L182 PolarHBondContact O-N 2.99Å; H178-L182 VanDerWaalsContact O-N 3.11Å; H178-Y203 HydrophobicContact CB-CE2 4.35Å; H178-Y203 AromaticContact CD2-CE2 3.66Å; H178-Y203 PolarHBondContact CE1-OH 3.05Å; H178-Y203 AromaticContact CG-CE2 3.84Å; H178-Y203 AromaticContact NE2-CE2 3.84Å; H178-H206 AromaticContact CD2-CD2 3.94Å; H178-H206 AromaticContact CD2-NE2 3.81Å; H178-C207 PolarHBondContact NE2-SG 2.88Å; H178-L212 WeakPolarHBondContact NE2-CD1 3.33Å; H178-L223 HydrophobicContact CB-CD2 4.35Å
179	L	80.1	Confident	75	Confident	13 Å²	13	57.1 Å²	57.1	7%	0.068	31%	0.308	C	S	.	.	H	α-helix	trans	-62.4	-50.3	174.8	164.1	69.4	0	0	0	111.7	I154 I158 L175 N176 S177 L182 L183 I227	I154-L179 HydrophobicContact CG2-CD1 4.32Å; I154-L179 HydrophobicContact CG2-CD2 3.52Å; I154-L179 HydrophobicContact CG2-CG 4.46Å; I158-L179 HydrophobicContact CD1-CD2 3.81Å; I158-L179 HydrophobicContact CG1-CD2 4.32Å; L175-L179 WeakPolarHBondContact O-CB 3.19Å; L175-L179 PolarHBondContact O-N 2.89Å; N176-L179 PolarHBondContact O-N 3.39Å; S177-L179 VanDerWaalsContact C-N 3.34Å; S177-L179 PolarHBondContact O-N 3.09Å; L179-L182 PolarHBondContact O-N 3.31Å; L179-L183 HydrophobicContact CD1-CD1 3.75Å; L179-L183 HydrophobicContact CD1-CG 4.23Å; L179-L183 HydrophobicContact CG-CD1 4.17Å; L179-L183 WeakPolarHBondContact O-CG 3.23Å; L179-L183 PolarHBondContact O-N 3.45Å; L179-I227 HydrophobicContact CB-CD1 4.47Å; L179-I227 HydrophobicContact CD1-CD1 3.63Å; L179-I227 HydrophobicContact CD1-CG1 3.62Å; L179-I227 HydrophobicContact CD1-CG2 4.21Å
180	Q	81.5	Confident	76.9	Confident	103 Å²	103	60.6 Å²	60.6	48%	0.481	31%	0.313	S	S	.	.	H	α-helix	trans	-62.8	-46.6	-179	-172.2	60.8	48.6	0	0	110.3	N176 S177 L182 L183 D184	N176-Q180 WeakPolarHBondContact O-CB 3.49Å; N176-Q180 PolarHBondContact O-N 3.04Å; S177-Q180 PolarHBondContact O-N 3.31Å; Q180-L182 VanDerWaalsContact C-N 3.3Å; Q180-L182 PolarHBondContact O-N 3.1Å; Q180-L183 CarbonylContact O-C 3.58Å; Q180-L183 PolarHBondContact O-N 2.92Å; Q180-L183 VanDerWaalsContact O-N 3.12Å; Q180-D184 PolarHBondContact NE2-OD1 3.47Å; Q180-D184 PolarHBondContact NE2-OD2 3.06Å; Q180-D184 WeakPolarHBondContact O-CB 3.16Å; Q180-D184 PolarHBondContact O-N 3Å
181	W	90.7	Very high	78.8	Confident	27 Å²	27	55.7 Å²	55.7	10%	0.102	31%	0.305	C	S	.	.	H	α-helix	trans	-57.9	-39.1	175.6	174	82.7	0	0	0	113.2	S177 N185 Y186 H202 Y203 H206 L257	S177-W181 PolarHBondContact O-N 2.93Å; W181-N185 VanDerWaalsContact CD1-ND2 3.29Å; W181-N185 PolarHBondContact NE1-ND2 2.86Å; W181-N185 WeakPolarHBondContact O-CB 3.21Å; W181-N185 PolarHBondContact O-N 3.01Å; W181-N185 VanDerWaalsContact O-N 3.12Å; W181-N185 PolarHBondContact O-ND2 3.28Å; W181-Y186 AromaticContact CH2-CE2 3.89Å; W181-Y186 HydrophobicContact CH2-CE2 3.89Å; W181-Y186 HydrophobicContact CZ2-CE2 4.38Å; W181-Y186 HydrophobicContact CZ3-CE2 4.2Å; W181-H202 VanDerWaalsContact CH2-C 3.49Å; W181-H202 HydrophobicContact CH2-CB 3.87Å; W181-H202 HydrophobicContact CZ2-CB 4.01Å; W181-H202 WeakPolarHBondContact CZ2-O 3.35Å; W181-Y203 HydrophobicContact CZ3-CD2 4.26Å; W181-H206 AromaticContact CD1-CE1 3.68Å; W181-H206 AromaticContact CD1-CG 3.67Å; W181-H206 AromaticContact CD1-ND1 3.29Å; W181-H206 VanDerWaalsContact CD1-ND1 3.29Å; W181-H206 HydrophobicContact CD2-CB 3.96Å; W181-H206 AromaticContact CD2-CD2 3.74Å; W181-H206 AromaticContact CD2-CG 3.64Å; W181-H206 AromaticContact CE2-CG 3.76Å; W181-H206 HydrophobicContact CG-CB 4.36Å; W181-H206 AromaticContact CG-CD2 3.73Å; W181-H206 AromaticContact CG-CE1 3.55Å; W181-H206 AromaticContact CG-CG 3.62Å; W181-H206 AromaticContact CG-ND1 3.51Å; W181-H206 AromaticContact CG-NE2 3.7Å; W181-H206 HydrophobicContact CH2-CB 4.48Å; W181-H206 HydrophobicContact CZ2-CB 3.91Å; W181-H206 AromaticContact NE1-CG 3.73Å; W181-H206 AromaticContact NE1-ND1 3.7Å; W181-L257 HydrophobicContact CH2-CD1 4.5Å; W181-L257 HydrophobicContact CZ2-CD1 3.83Å; W181-L257 HydrophobicContact CZ2-CD2 4.41Å
182	L	90.6	Very high	80.6	Confident	0 Å²	0	51.9 Å²	51.9	0%	0	30%	0.297	C	S	.	.	H	α-helix	trans	-65	-45.8	174.5	-82.3	172.4	0	0	0	112	H178 L179 Q180 D184 N185 Y186 L199 F220 I227 F228	H178-L182 WeakPolarHBondContact O-CG 3.42Å; H178-L182 PolarHBondContact O-N 2.99Å; H178-L182 VanDerWaalsContact O-N 3.11Å; L179-L182 PolarHBondContact O-N 3.31Å; Q180-L182 VanDerWaalsContact C-N 3.3Å; Q180-L182 PolarHBondContact O-N 3.1Å; L182-D184 VanDerWaalsContact C-N 3.31Å; L182-D184 PolarHBondContact O-N 2.99Å; L182-N185 PolarHBondContact O-N 3.47Å; L182-Y186 HydrophobicContact CD2-CD2 3.87Å; L182-Y186 HydrophobicContact CD2-CE2 4.02Å; L182-Y186 PolarHBondContact O-N 3.47Å; L182-L199 HydrophobicContact CD2-CD2 4.36Å; L182-F220 HydrophobicContact CD1-CE2 4.34Å; L182-F220 HydrophobicContact CD2-CZ 4.36Å; L182-I227 HydrophobicContact CB-CD1 4.39Å; L182-I227 HydrophobicContact CD1-CD1 3.55Å; L182-F228 HydrophobicContact CB-CE2 4.27Å
183	L	86.8	Confident	82.3	Confident	45 Å²	45	52 Å²	52	24%	0.236	30%	0.298	C	S	.	.	H	α-helix	trans	-70	-25.7	178.3	-71.4	174.3	0	0	0	113.3	I154 L179 Q180 I227 F228 K252	I154-L183 HydrophobicContact CD1-CD1 3.85Å; L179-L183 HydrophobicContact CD1-CD1 3.75Å; L179-L183 HydrophobicContact CD1-CG 4.23Å; L179-L183 HydrophobicContact CG-CD1 4.17Å; L179-L183 WeakPolarHBondContact O-CG 3.23Å; L179-L183 PolarHBondContact O-N 3.45Å; Q180-L183 CarbonylContact O-C 3.58Å; Q180-L183 PolarHBondContact O-N 2.92Å; Q180-L183 VanDerWaalsContact O-N 3.12Å; L183-I227 HydrophobicContact CD2-CG2 3.66Å; L183-I227 HydrophobicContact CG-CG2 4.04Å; L183-F228 HydrophobicContact CD2-CZ 4.44Å; L183-K252 VanDerWaalsContact O-CE 3.29Å; L183-K252 WeakPolarHBondContact O-CE 3.47Å; L183-K252 PolarHBondContact O-NZ 3.22Å
184	D	89.1	Confident	83.9	Confident	79 Å²	79	48.6 Å²	48.6	42%	0.422	27%	0.273	S	S	.	.	H	α-helix	trans	-76.4	-37.4	175.8	-71.4	-21.5	0	0	0	111.7	Q180 L182 K252	Q180-D184 PolarHBondContact NE2-OD1 3.47Å; Q180-D184 PolarHBondContact NE2-OD2 3.06Å; Q180-D184 WeakPolarHBondContact O-CB 3.16Å; Q180-D184 PolarHBondContact O-N 3Å; L182-D184 VanDerWaalsContact C-N 3.31Å; L182-D184 PolarHBondContact O-N 2.99Å; D184-K252 VanDerWaalsContact C-NZ 3.3Å; D184-K252 WeakPolarHBondContact O-CD 3.32Å; D184-K252 VanDerWaalsContact O-CE 3.25Å; D184-K252 WeakPolarHBondContact O-CE 3.37Å; D184-K252 PolarHBondContact O-NZ 2.94Å
185	N	90.9	Very high	85.4	Confident	14 Å²	14	46.7 Å²	46.7	8%	0.075	27%	0.265	C	S	.	.	H	α-helix	trans	-102.7	-18.3	-170.6	-70.9	-84.6	0	0	0	115.6	W181 L182 K252 S255 L257	W181-N185 VanDerWaalsContact CD1-ND2 3.29Å; W181-N185 PolarHBondContact NE1-ND2 2.86Å; W181-N185 WeakPolarHBondContact O-CB 3.21Å; W181-N185 PolarHBondContact O-N 3.01Å; W181-N185 VanDerWaalsContact O-N 3.12Å; W181-N185 PolarHBondContact O-ND2 3.28Å; L182-N185 PolarHBondContact O-N 3.47Å; N185-K252 PolarHBondContact O-N 3.42Å; N185-S255 PolarHBondContact OD1-OG 3.07Å; N185-L257 HydrophobicContact CB-CD1 3.67Å; N185-L257 HydrophobicContact CB-CG 4.39Å
186	Y	93.6	Very high	86.8	Confident	2 Å²	2	48.5 Å²	48.5	1%	0.008	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125	154.1	-177.9	-59.7	-88.1	0	0	0	112.3	W181 L182 L194 L199 H202 I249 R250 V251 K252 L257	W181-Y186 AromaticContact CH2-CE2 3.89Å; W181-Y186 HydrophobicContact CH2-CE2 3.89Å; W181-Y186 HydrophobicContact CZ2-CE2 4.38Å; W181-Y186 HydrophobicContact CZ3-CE2 4.2Å; L182-Y186 HydrophobicContact CD2-CD2 3.87Å; L182-Y186 HydrophobicContact CD2-CE2 4.02Å; L182-Y186 PolarHBondContact O-N 3.47Å; Y186-L194 HydrophobicContact CD1-CD2 3.99Å; Y186-L194 HydrophobicContact CE1-CD2 3.63Å; Y186-L199 HydrophobicContact CD1-CD1 3.82Å; Y186-L199 HydrophobicContact CD2-CD1 4.49Å; Y186-L199 HydrophobicContact CE1-CD1 3.59Å; Y186-L199 HydrophobicContact CE1-CG 3.87Å; Y186-L199 HydrophobicContact CE2-CD1 4.3Å; Y186-L199 HydrophobicContact CE2-CG 4.21Å; Y186-L199 HydrophobicContact CG-CD1 4.28Å; Y186-H202 WeakPolarHBondContact OH-CB 3.27Å; Y186-H202 PolarHBondContact OH-ND1 2.71Å; Y186-I249 HydrophobicContact CG-CD1 4.43Å; Y186-R250 VanDerWaalsContact CA-O 3.31Å; Y186-R250 WeakPolarHBondContact CA-O 3.48Å; Y186-V251 HydrophobicContact CD1-CG2 4.06Å; Y186-V251 HydrophobicContact CE1-CB 4.43Å; Y186-V251 HydrophobicContact CE1-CG2 3.54Å; Y186-K252 VanDerWaalsContact O-CE 3.29Å; Y186-K252 WeakPolarHBondContact O-CE 3.4Å; Y186-L257 HydrophobicContact CE2-CD1 3.93Å; Y186-L257 WeakPolarHBondContact OH-CD1 3.23Å
187	E	91	Very high	87.9	Confident	55 Å²	55	48 Å²	48	26%	0.257	27%	0.271	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.2	151	175.7	63	-177.6	175	0	0	112	A189 I249 R250 K252	E187-A189 PolarHBondContact O-N 3.34Å; E187-I249 WeakPolarHBondContact O-CA 3.41Å; E187-I249 WeakPolarHBondContact O-CG1 3.48Å; E187-R250 HydrophobicContact CG-CG 3.82Å; E187-R250 PolarHBondContact N-O 2.99Å; E187-R250 PolarHBondContact O-N 3.3Å; E187-R250 IonicContact OE1-CZ 3.89Å; E187-R250 IonicContact OE1-NE 3.16Å; E187-R250 PolarHBondContact OE1-NE 3.24Å; E187-R250 IonicContact OE1-NH2 3.94Å; E187-R250 PolarHBondContact OE1-NH2 3.47Å; E187-K252 HydrophobicContact CB-CG 3.93Å; E187-K252 HydrophobicContact CG-CG 3.86Å
188	T	90.4	Very high	88.7	Confident	94 Å²	94	46.8 Å²	46.8	58%	0.577	26%	0.262	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-68.2	127.6	171.5	-50.9	0	0	0	0	109.5	G248	T188-G248 VanDerWaalsContact CA-O 3.32Å; T188-G248 WeakPolarHBondContact CA-O 3.27Å; T188-G248 WeakPolarHBondContact CG2-O 3.39Å
189	A	89.2	Confident	89.3	Confident	9 Å²	9	46.3 Å²	46.3	7%	0.074	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.7	131.8	177.7	0	0	0	0	0	110.3	E187 V192 G248 R250	E187-A189 PolarHBondContact O-N 3.34Å; A189-V192 HydrophobicContact CB-CG2 3.61Å; A189-V192 VanDerWaalsContact O-CG2 3.23Å; A189-V192 WeakPolarHBondContact O-CG2 3.46Å; A189-G248 PolarHBondContact N-O 3.11Å; A189-G248 CarbonylContact O-C 3.07Å; A189-G248 WeakPolarHBondContact O-CA 3.4Å; A189-R250 HydrophobicContact CB-CG 3.81Å
190	E	85.2	Confident	89.9	Confident	177 Å²	177	48.1 Å²	48.1	83%	0.827	27%	0.266	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-78.4	164.9	178.6	-56.9	-152.9	142.9	0	0	112.2	V192	E190-V192 PolarHBondContact O-N 3Å
191	G	84.6	Confident	90.3	Very high	58 Å²	58	46.5 Å²	46.5	60%	0.598	26%	0.261	S	S	*	.	E	Extended strand (participates in β ladder)	trans	72.6	-30.2	-176.3	0	0	0	0	0	115.6	Y247	G191-Y247 WeakPolarHBondContact CA-OH 3.35Å; G191-Y247 WeakPolarHBondContact O-CE2 3.41Å
192	V	89.3	Confident	90.4	Very high	54 Å²	54	45.4 Å²	45.4	33%	0.327	26%	0.257	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91	155.2	-172.5	-64.1	0	0	0	0	114.4	A189 E190 Y247 G248 R250	A189-V192 HydrophobicContact CB-CG2 3.61Å; A189-V192 VanDerWaalsContact O-CG2 3.23Å; A189-V192 WeakPolarHBondContact O-CG2 3.46Å; E190-V192 PolarHBondContact O-N 3Å; V192-Y247 WeakPolarHBondContact O-CD2 3.48Å; V192-G248 PolarHBondContact O-N 3.44Å; V192-G248 VanDerWaalsContact O-N 3.12Å; V192-R250 HydrophobicContact CG2-CB 4.11Å
193	S	90.3	Very high	90.4	Very high	44 Å²	44	45.4 Å²	45.4	31%	0.308	26%	0.257	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.4	144.1	173.2	86.8	0	0	0	0	112.1	H245 Y246	S193-H245 PolarHBondContact OG-ND1 2.94Å; S193-Y246 CarbonylContact C-O 3.58Å; S193-Y246 VanDerWaalsContact CA-O 3.25Å; S193-Y246 WeakPolarHBondContact CA-O 3.35Å
194	L	91.8	Very high	90.5	Very high	10 Å²	10	46.1 Å²	46.1	5%	0.052	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	131.7	-179.3	-174.4	70.2	0	0	0	110	Y186 R196 L199 H245 Y246 I249 V251	Y186-L194 HydrophobicContact CD1-CD2 3.99Å; Y186-L194 HydrophobicContact CE1-CD2 3.63Å; L194-R196 PolarHBondContact O-N 3.05Å; L194-L199 HydrophobicContact CD2-CB 3.91Å; L194-L199 HydrophobicContact CD2-CD1 3.61Å; L194-L199 HydrophobicContact CD2-CG 4.25Å; L194-H245 CarbonylContact O-C 3.53Å; L194-H245 VanDerWaalsContact O-CA 3.28Å; L194-H245 WeakPolarHBondContact O-CA 3.45Å; L194-H245 WeakPolarHBondContact O-CB 3.43Å; L194-Y246 PolarHBondContact N-O 3.06Å; L194-Y246 PolarHBondContact O-N 3.06Å; L194-I249 HydrophobicContact CB-CG2 4.27Å; L194-V251 HydrophobicContact CD1-CG2 4.44Å
195	P	93.1	Very high	90.4	Very high	32 Å²	32	47 Å²	47	21%	0.208	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.4	133.3	178.4	-18.6	30.2	0	0	0	111.3	S197 T198 L199	P195-S197 PolarHBondContact O-N 3.48Å; P195-T198 PolarHBondContact O-N 3.26Å; P195-T198 VanDerWaalsContact O-N 3.12Å; P195-L199 PolarHBondContact O-N 3.45Å
196	R	93.5	Very high	90.2	Very high	75 Å²	75	46.9 Å²	46.9	28%	0.283	26%	0.257	S	S	.	.	H	α-helix	trans	-58.3	-34.9	179.7	-72.1	-167.2	176.9	176	-7.1	112.5	L194 Y200 T233 Y244 Y246	L194-R196 PolarHBondContact O-N 3.05Å; R196-Y200 WeakPolarHBondContact O-CB 3.18Å; R196-Y200 PolarHBondContact O-N 2.99Å; R196-Y200 VanDerWaalsContact O-N 3.07Å; R196-T233 PolarHBondContact NH2-OG1 3.12Å; R196-Y244 WeakPolarHBondContact CB-O 3.43Å; R196-Y244 WeakPolarHBondContact CG-O 3.43Å; R196-Y244 PolarHBondContact N-O 3.34Å; R196-Y246 HydrophobicContact CB-CE2 4.27Å; R196-Y246 HydrophobicContact CG-CD1 4.33Å; R196-Y246 HydrophobicContact CG-CD2 3.83Å; R196-Y246 HydrophobicContact CG-CE1 4.15Å; R196-Y246 HydrophobicContact CG-CE2 3.66Å; R196-Y246 HydrophobicContact CG-CG 4.15Å
197	S	90.1	Very high	89.9	Confident	61 Å²	61	46.9 Å²	46.9	43%	0.427	26%	0.257	S	S	.	.	H	α-helix	trans	-64.7	-40.7	177.7	50.6	0	0	0	0	112.7	P195 Y200 N201	P195-S197 PolarHBondContact O-N 3.48Å; S197-Y200 PolarHBondContact O-N 3.48Å; S197-N201 WeakPolarHBondContact O-CB 3.22Å; S197-N201 PolarHBondContact O-N 3.12Å; S197-N201 PolarHBondContact O-OD1 3.02Å
198	T	91.4	Very high	89.6	Confident	20 Å²	20	51.7 Å²	51.7	12%	0.123	28%	0.28	C	S	.	.	H	α-helix	trans	-64.8	-49.3	-179.6	-54	0	0	0	0	110.6	P195 Y200 N201 H202	P195-T198 PolarHBondContact O-N 3.26Å; P195-T198 VanDerWaalsContact O-N 3.12Å; T198-Y200 PolarHBondContact O-N 3.04Å; T198-N201 PolarHBondContact O-N 2.91Å; T198-H202 PolarHBondContact O-CD2 3.11Å; T198-H202 VanDerWaalsContact O-CG 3.29Å; T198-H202 PolarHBondContact O-N 2.82Å
199	L	92.3	Very high	89.4	Confident	0 Å²	0	53.1 Å²	53.1	0%	0	28%	0.28	C	S	.	.	H	α-helix	trans	-64.6	-38.7	179	-170.1	153.5	0	0	0	111.9	L182 Y186 L194 P195 H202 Y203 F220 I224 I249	L182-L199 HydrophobicContact CD2-CD2 4.36Å; Y186-L199 HydrophobicContact CD1-CD1 3.82Å; Y186-L199 HydrophobicContact CD2-CD1 4.49Å; Y186-L199 HydrophobicContact CE1-CD1 3.59Å; Y186-L199 HydrophobicContact CE1-CG 3.87Å; Y186-L199 HydrophobicContact CE2-CD1 4.3Å; Y186-L199 HydrophobicContact CE2-CG 4.21Å; Y186-L199 HydrophobicContact CG-CD1 4.28Å; L194-L199 HydrophobicContact CD2-CB 3.91Å; L194-L199 HydrophobicContact CD2-CD1 3.61Å; L194-L199 HydrophobicContact CD2-CG 4.25Å; P195-L199 PolarHBondContact O-N 3.45Å; L199-H202 PolarHBondContact O-N 3.09Å; L199-Y203 PolarHBondContact O-N 3.26Å; L199-F220 HydrophobicContact CD2-CE1 3.33Å; L199-F220 HydrophobicContact CD2-CZ 3.37Å; L199-I224 HydrophobicContact CD1-CD1 3.54Å; L199-I224 HydrophobicContact CD2-CD1 3.74Å; L199-I224 HydrophobicContact CG-CD1 4.34Å; L199-I249 HydrophobicContact CD1-CD1 4.29Å
200	Y	92.5	Very high	89	Confident	51 Å²	51	57.8 Å²	57.8	20%	0.2	30%	0.3	C	S	.	.	H	α-helix	trans	-68.6	-37.4	174.8	-171.4	-115.8	0	0	0	112.6	R196 S197 T198 H202 Y203 L204 V215 A217 F220	R196-Y200 WeakPolarHBondContact O-CB 3.18Å; R196-Y200 PolarHBondContact O-N 2.99Å; R196-Y200 VanDerWaalsContact O-N 3.07Å; S197-Y200 PolarHBondContact O-N 3.48Å; T198-Y200 PolarHBondContact O-N 3.04Å; Y200-H202 VanDerWaalsContact C-N 3.33Å; Y200-H202 PolarHBondContact O-N 3.44Å; Y200-Y203 AromaticContact CD2-CD1 3.87Å; Y200-Y203 HydrophobicContact CD2-CD1 3.87Å; Y200-Y203 AromaticContact CE2-CD1 3.79Å; Y200-Y203 HydrophobicContact CE2-CD1 3.79Å; Y200-Y203 HydrophobicContact CE2-CE1 4.18Å; Y200-Y203 WeakPolarHBondContact O-CB 3.5Å; Y200-Y203 PolarHBondContact O-N 3.06Å; Y200-Y203 VanDerWaalsContact O-N 3.16Å; Y200-L204 HydrophobicContact CD1-CD1 4.02Å; Y200-L204 HydrophobicContact CD1-CG 4.26Å; Y200-L204 HydrophobicContact CE1-CD1 3.8Å; Y200-L204 HydrophobicContact CE1-CD2 4.12Å; Y200-L204 HydrophobicContact CE1-CG 4.04Å; Y200-L204 HydrophobicContact CE2-CD2 4.46Å; Y200-L204 WeakPolarHBondContact O-CG 3.33Å; Y200-L204 PolarHBondContact O-N 3.33Å; Y200-V215 PolarHBondContact OH-O 3.45Å; Y200-A217 HydrophobicContact CD1-CB 4.35Å; Y200-A217 HydrophobicContact CD2-CB 4.41Å; Y200-A217 HydrophobicContact CE1-CB 3.96Å; Y200-A217 HydrophobicContact CE2-CB 4.01Å; Y200-A217 PolarHBondContact OH-N 3.48Å; Y200-F220 HydrophobicContact CD2-CB 4.21Å; Y200-F220 AromaticContact CD2-CD1 3.52Å; Y200-F220 HydrophobicContact CD2-CD1 3.52Å; Y200-F220 HydrophobicContact CD2-CE1 4Å; Y200-F220 AromaticContact CD2-CG 3.88Å; Y200-F220 HydrophobicContact CD2-CG 3.88Å; Y200-F220 HydrophobicContact CE2-CB 4.01Å; Y200-F220 HydrophobicContact CE2-CD1 4.19Å; Y200-F220 HydrophobicContact CE2-CG 4.11Å
201	N	90.1	Very high	88.8	Confident	69 Å²	69	58.5 Å²	58.5	37%	0.369	30%	0.3	S	S	.	.	H	α-helix	trans	-63.1	-38.8	173.5	-73.6	-2.1	0	0	0	111.9	S197 T198 Y203 L204 R205	S197-N201 WeakPolarHBondContact O-CB 3.22Å; S197-N201 PolarHBondContact O-N 3.12Å; S197-N201 PolarHBondContact O-OD1 3.02Å; T198-N201 PolarHBondContact O-N 2.91Å; N201-Y203 VanDerWaalsContact C-N 3.33Å; N201-L204 PolarHBondContact O-N 3.36Å; N201-R205 PolarHBondContact O-N 3.46Å; N201-R205 VanDerWaalsContact O-N 3.07Å
202	H	92.4	Very high	88.5	Confident	4 Å²	4	57.4 Å²	57.4	2%	0.019	28%	0.281	C	S	.	.	H	α-helix	trans	-63.2	-39.6	173	-64.4	173.9	0	0	0	111.6	W181 Y186 T198 L199 Y200 R205 H206 L257	W181-H202 VanDerWaalsContact CH2-C 3.49Å; W181-H202 HydrophobicContact CH2-CB 3.87Å; W181-H202 HydrophobicContact CZ2-CB 4.01Å; W181-H202 WeakPolarHBondContact CZ2-O 3.35Å; Y186-H202 WeakPolarHBondContact OH-CB 3.27Å; Y186-H202 PolarHBondContact OH-ND1 2.71Å; T198-H202 PolarHBondContact O-CD2 3.11Å; T198-H202 VanDerWaalsContact O-CG 3.29Å; T198-H202 PolarHBondContact O-N 2.82Å; L199-H202 PolarHBondContact O-N 3.09Å; Y200-H202 VanDerWaalsContact C-N 3.33Å; Y200-H202 PolarHBondContact O-N 3.44Å; H202-R205 PolarHBondContact O-N 2.73Å; H202-H206 PolarHBondContact O-N 3.15Å; H202-L257 HydrophobicContact CB-CD1 4.1Å; H202-L257 HydrophobicContact CB-CD2 4.34Å
203	Y	91	Very high	87.9	Confident	0 Å²	0	62.1 Å²	62.1	0%	0	30%	0.304	C	S	.	.	H	α-helix	trans	-63.7	-45.9	174.3	170.5	-111	0	0	0	112.3	H178 W181 L199 Y200 N201 R205 H206 C207 P214 V215 F220	H178-Y203 HydrophobicContact CB-CE2 4.35Å; H178-Y203 AromaticContact CD2-CE2 3.66Å; H178-Y203 PolarHBondContact CE1-OH 3.05Å; H178-Y203 AromaticContact CG-CE2 3.84Å; H178-Y203 AromaticContact NE2-CE2 3.84Å; W181-Y203 HydrophobicContact CZ3-CD2 4.26Å; L199-Y203 PolarHBondContact O-N 3.26Å; Y200-Y203 AromaticContact CD2-CD1 3.87Å; Y200-Y203 HydrophobicContact CD2-CD1 3.87Å; Y200-Y203 AromaticContact CE2-CD1 3.79Å; Y200-Y203 HydrophobicContact CE2-CD1 3.79Å; Y200-Y203 HydrophobicContact CE2-CE1 4.18Å; Y200-Y203 WeakPolarHBondContact O-CB 3.5Å; Y200-Y203 PolarHBondContact O-N 3.06Å; Y200-Y203 VanDerWaalsContact O-N 3.16Å; N201-Y203 VanDerWaalsContact C-N 3.33Å; Y203-R205 VanDerWaalsContact C-N 3.3Å; Y203-R205 PolarHBondContact O-N 3.35Å; Y203-H206 PolarHBondContact O-N 3.23Å; Y203-C207 WeakPolarHBondContact CE2-SG 3.29Å; Y203-C207 PolarHBondContact O-N 3.29Å; Y203-C207 PolarHBondContact O-SG 3.43Å; Y203-C207 VanDerWaalsContact O-SG 3.4Å; Y203-P214 HydrophobicContact CE1-CB 3.99Å; Y203-V215 HydrophobicContact CE1-CG2 4.22Å; Y203-V215 PolarHBondContact OH-N 3.38Å; Y203-F220 AromaticContact CD1-CD2 3.53Å; Y203-F220 HydrophobicContact CD1-CD2 3.53Å; Y203-F220 AromaticContact CD1-CE2 3.66Å; Y203-F220 HydrophobicContact CD1-CE2 3.66Å; Y203-F220 HydrophobicContact CD1-CG 4.05Å; Y203-F220 HydrophobicContact CD1-CZ 4.25Å; Y203-F220 AromaticContact CD2-CD2 3.92Å; Y203-F220 HydrophobicContact CD2-CD2 3.92Å; Y203-F220 AromaticContact CD2-CE2 3.43Å; Y203-F220 HydrophobicContact CD2-CE2 3.43Å; Y203-F220 VanDerWaalsContact CD2-CE2 3.43Å; Y203-F220 HydrophobicContact CD2-CZ 4.26Å; Y203-F220 AromaticContact CE1-CD2 3.66Å; Y203-F220 HydrophobicContact CE1-CD2 3.66Å; Y203-F220 HydrophobicContact CE1-CE2 4.15Å; Y203-F220 HydrophobicContact CE1-CG 4.26Å; Y203-F220 HydrophobicContact CE2-CD2 4.04Å; Y203-F220 AromaticContact CE2-CE2 3.95Å; Y203-F220 HydrophobicContact CE2-CE2 3.95Å; Y203-F220 AromaticContact CG-CD2 3.68Å; Y203-F220 HydrophobicContact CG-CD2 3.68Å; Y203-F220 AromaticContact CG-CE2 3.28Å; Y203-F220 HydrophobicContact CG-CE2 3.28Å; Y203-F220 HydrophobicContact CG-CG 4.49Å; Y203-F220 AromaticContact CG-CZ 3.79Å; Y203-F220 HydrophobicContact CG-CZ 3.79Å; Y203-F220 AromaticContact CZ-CD2 3.94Å
204	L	88.5	Confident	87.6	Confident	60 Å²	60	63.1 Å²	63.1	31%	0.314	31%	0.309	S	S	.	.	H	α-helix	trans	-58.7	-40.7	176.2	-68.5	178.5	0	0	0	112.2	Y200 N201 C207 Q208 P214	Y200-L204 HydrophobicContact CD1-CD1 4.02Å; Y200-L204 HydrophobicContact CD1-CG 4.26Å; Y200-L204 HydrophobicContact CE1-CD1 3.8Å; Y200-L204 HydrophobicContact CE1-CD2 4.12Å; Y200-L204 HydrophobicContact CE1-CG 4.04Å; Y200-L204 HydrophobicContact CE2-CD2 4.46Å; Y200-L204 WeakPolarHBondContact O-CG 3.33Å; Y200-L204 PolarHBondContact O-N 3.33Å; N201-L204 PolarHBondContact O-N 3.36Å; L204-C207 PolarHBondContact O-N 3.45Å; L204-Q208 PolarHBondContact O-N 3.29Å; L204-P214 HydrophobicContact CD2-CB 3.52Å; L204-P214 HydrophobicContact CD2-CG 3.86Å
205	R	87.4	Confident	87.2	Confident	97 Å²	97	65.3 Å²	65.3	37%	0.366	32%	0.323	S	S	.	.	H	α-helix	trans	-64.4	-45.9	174.4	174.5	173.9	-75.2	144.7	-8.3	111.9	N201 H202 Y203 C207 Q208 E209	N201-R205 PolarHBondContact O-N 3.46Å; N201-R205 VanDerWaalsContact O-N 3.07Å; H202-R205 PolarHBondContact O-N 2.73Å; Y203-R205 VanDerWaalsContact C-N 3.3Å; Y203-R205 PolarHBondContact O-N 3.35Å; R205-C207 VanDerWaalsContact C-N 3.34Å; R205-C207 PolarHBondContact O-N 3.47Å; R205-Q208 WeakPolarHBondContact O-CB 3.5Å; R205-Q208 PolarHBondContact O-N 3.47Å; R205-Q208 VanDerWaalsContact O-N 3.12Å; R205-E209 WeakPolarHBondContact CD-OE1 3.47Å; R205-E209 HydrophobicContact CG-CG 4.34Å; R205-E209 WeakPolarHBondContact CG-OE1 3.49Å; R205-E209 WeakPolarHBondContact O-CG 3.45Å; R205-E209 PolarHBondContact O-N 3.05Å
206	H	86.4	Confident	86.6	Confident	13 Å²	13	68.1 Å²	68.1	6%	0.06	34%	0.336	C	S	.	.	H	α-helix	trans	-58.7	-43.9	175.9	167.8	67.2	0	0	0	112.2	H178 W181 H202 Y203 Q208 E209 Q210	H178-H206 AromaticContact CD2-CD2 3.94Å; H178-H206 AromaticContact CD2-NE2 3.81Å; W181-H206 AromaticContact CD1-CE1 3.68Å; W181-H206 AromaticContact CD1-CG 3.67Å; W181-H206 AromaticContact CD1-ND1 3.29Å; W181-H206 VanDerWaalsContact CD1-ND1 3.29Å; W181-H206 HydrophobicContact CD2-CB 3.96Å; W181-H206 AromaticContact CD2-CD2 3.74Å; W181-H206 AromaticContact CD2-CG 3.64Å; W181-H206 AromaticContact CE2-CG 3.76Å; W181-H206 HydrophobicContact CG-CB 4.36Å; W181-H206 AromaticContact CG-CD2 3.73Å; W181-H206 AromaticContact CG-CE1 3.55Å; W181-H206 AromaticContact CG-CG 3.62Å; W181-H206 AromaticContact CG-ND1 3.51Å; W181-H206 AromaticContact CG-NE2 3.7Å; W181-H206 HydrophobicContact CH2-CB 4.48Å; W181-H206 HydrophobicContact CZ2-CB 3.91Å; W181-H206 AromaticContact NE1-CG 3.73Å; W181-H206 AromaticContact NE1-ND1 3.7Å; H202-H206 PolarHBondContact O-N 3.15Å; Y203-H206 PolarHBondContact O-N 3.23Å; H206-Q208 PolarHBondContact O-N 2.77Å; H206-E209 PolarHBondContact O-N 3.2Å; H206-Q210 WeakPolarHBondContact O-CB 3.38Å; H206-Q210 WeakPolarHBondContact O-CG 3.26Å; H206-Q210 PolarHBondContact O-N 2.73Å
207	C	86.6	Confident	86.2	Confident	1 Å²	1	67.2 Å²	67.2	1%	0.007	35%	0.345	C	S	.	.	H	α-helix	trans	-59.5	-43.5	172.9	-70.2	0	0	0	0	112.1	H178 Y203 L204 R205 Q210 K211 L212 P214	H178-C207 PolarHBondContact NE2-SG 2.88Å; Y203-C207 WeakPolarHBondContact CE2-SG 3.29Å; Y203-C207 PolarHBondContact O-N 3.29Å; Y203-C207 PolarHBondContact O-SG 3.43Å; Y203-C207 VanDerWaalsContact O-SG 3.4Å; L204-C207 PolarHBondContact O-N 3.45Å; R205-C207 VanDerWaalsContact C-N 3.34Å; R205-C207 PolarHBondContact O-N 3.47Å; C207-Q210 PolarHBondContact O-N 2.83Å; C207-K211 CarbonylContact O-C 3.59Å; C207-K211 WeakPolarHBondContact O-CA 3.31Å; C207-K211 PolarHBondContact O-N 3.45Å; C207-L212 WeakPolarHBondContact CB-O 3.45Å; C207-L212 PolarHBondContact O-N 3.21Å; C207-P214 HydrophobicContact CB-CB 4.04Å
208	Q	86.6	Confident	85.9	Confident	157 Å²	157	67.5 Å²	67.5	73%	0.734	35%	0.351	S	S	*	.	H	α-helix	trans	-62.6	-44	176.5	-173.1	179.8	9.9	0	0	112.6	L204 R205 H206 K211	L204-Q208 PolarHBondContact O-N 3.29Å; R205-Q208 WeakPolarHBondContact O-CB 3.5Å; R205-Q208 PolarHBondContact O-N 3.47Å; R205-Q208 VanDerWaalsContact O-N 3.12Å; H206-Q208 PolarHBondContact O-N 2.77Å; Q208-K211 PolarHBondContact O-N 3.09Å
209	E	85.1	Confident	85.4	Confident	123 Å²	123	68.2 Å²	68.2	58%	0.575	36%	0.357	S	S	*	.	H	α-helix	trans	-65.1	-41.6	179.1	-72.9	167.2	-174.7	0	0	112.1	R205 H206 K211	R205-E209 WeakPolarHBondContact CD-OE1 3.47Å; R205-E209 HydrophobicContact CG-CG 4.34Å; R205-E209 WeakPolarHBondContact CG-OE1 3.49Å; R205-E209 WeakPolarHBondContact O-CG 3.45Å; R205-E209 PolarHBondContact O-N 3.05Å; H206-E209 PolarHBondContact O-N 3.2Å; E209-K211 VanDerWaalsContact C-N 3.33Å
210	Q	80	Confident	85.2	Confident	108 Å²	108	68.4 Å²	68.4	51%	0.505	36%	0.357	S	S	.	.	H	α-helix	trans	-86.5	-0.3	178.7	-60.6	-54.6	-52.7	0	0	113.7	H206 C207 L212	H206-Q210 WeakPolarHBondContact O-CB 3.38Å; H206-Q210 WeakPolarHBondContact O-CG 3.26Å; H206-Q210 PolarHBondContact O-N 2.73Å; C207-Q210 PolarHBondContact O-N 2.83Å; Q210-L212 VanDerWaalsContact C-N 3.32Å; Q210-L212 HydrophobicContact CB-CD1 3.87Å; Q210-L212 HydrophobicContact CB-CD2 4.3Å; Q210-L212 HydrophobicContact CB-CG 3.68Å; Q210-L212 VanDerWaalsContact O-CD2 3.28Å; Q210-L212 WeakPolarHBondContact O-CD2 3.47Å; Q210-L212 PolarHBondContact O-N 3.35Å
211	K	81.1	Confident	85	Confident	192 Å²	192	66 Å²	66	84%	0.835	35%	0.349	S	S	*	.	T	Hydrogen-bonded Turn	trans	55.9	41	-176.3	-54.5	178.6	-176.7	175.6	0	113.6	C207 Q208 E209	C207-K211 CarbonylContact O-C 3.59Å; C207-K211 WeakPolarHBondContact O-CA 3.31Å; C207-K211 PolarHBondContact O-N 3.45Å; Q208-K211 PolarHBondContact O-N 3.09Å; E209-K211 VanDerWaalsContact C-N 3.33Å
212	L	80	Confident	84.7	Confident	35 Å²	35	68.1 Å²	68.1	18%	0.183	36%	0.355	C	S	.	.			trans	-104.6	145.5	178.8	-44.9	-177.7	0	0	0	110	L174 H178 C207 Q210 P214	L174-L212 HydrophobicContact CD2-CD1 4.19Å; L174-L212 HydrophobicContact CD2-CD2 3.65Å; L174-L212 HydrophobicContact CD2-CG 4.33Å; H178-L212 WeakPolarHBondContact NE2-CD1 3.33Å; C207-L212 WeakPolarHBondContact CB-O 3.45Å; C207-L212 PolarHBondContact O-N 3.21Å; Q210-L212 VanDerWaalsContact C-N 3.32Å; Q210-L212 HydrophobicContact CB-CD1 3.87Å; Q210-L212 HydrophobicContact CB-CD2 4.3Å; Q210-L212 HydrophobicContact CB-CG 3.68Å; Q210-L212 VanDerWaalsContact O-CD2 3.28Å; Q210-L212 WeakPolarHBondContact O-CD2 3.47Å; Q210-L212 PolarHBondContact O-N 3.35Å; L212-P214 WeakPolarHBondContact O-CD 3.42Å
213	D	76.7	Confident	84.4	Confident	152 Å²	152	68.6 Å²	68.6	81%	0.813	36%	0.357	S	S	*	.	P	Polyproline II helix	trans	-72	122.5	173.1	-65.2	-51.6	0	0	0	110.4
214	P	83.1	Confident	84.3	Confident	65 Å²	65	68.6 Å²	68.6	42%	0.422	36%	0.357	S	S	.	.	P	Polyproline II helix	trans	-73.5	133.2	-179.5	28.6	-33.5	0	0	0	111.5	Y203 L204 C207 L212	Y203-P214 HydrophobicContact CE1-CB 3.99Å; L204-P214 HydrophobicContact CD2-CB 3.52Å; L204-P214 HydrophobicContact CD2-CG 3.86Å; C207-P214 HydrophobicContact CB-CB 4.04Å; L212-P214 WeakPolarHBondContact O-CD 3.42Å
215	V	82.4	Confident	84.3	Confident	57 Å²	57	70.5 Å²	70.5	35%	0.345	36%	0.36	S	S	.	.	P	Polyproline II helix	trans	-73.2	148.1	171.9	-49.9	0	0	0	0	110.5	Y200 Y203 F220	Y200-V215 PolarHBondContact OH-O 3.45Å; Y203-V215 HydrophobicContact CE1-CG2 4.22Å; Y203-V215 PolarHBondContact OH-N 3.38Å; V215-F220 HydrophobicContact CG2-CB 3.81Å; V215-F220 HydrophobicContact CG2-CD2 4.5Å
216	N	82.6	Confident	83.9	Confident	90 Å²	90	67.5 Å²	67.5	48%	0.481	35%	0.354	S	S	.	.	P	Polyproline II helix	trans	-58.8	155.8	-178.6	75.3	68.4	0	0	0	112.7	A218 S219 F220	N216-A218 PolarHBondContact O-N 3.34Å; N216-A218 VanDerWaalsContact O-N 3.08Å; N216-A218 WeakPolarHBondContact OD1-CA 3.38Å; N216-A218 WeakPolarHBondContact OD1-CB 3.43Å; N216-A218 PolarHBondContact OD1-N 3Å; N216-S219 PolarHBondContact ND2-OG 3.23Å; N216-S219 PolarHBondContact O-N 3.42Å; N216-S219 VanDerWaalsContact O-N 3.14Å; N216-S219 PolarHBondContact OD1-N 3.01Å; N216-F220 WeakPolarHBondContact O-CB 3.12Å; N216-F220 PolarHBondContact O-N 2.94Å
217	A	83.6	Confident	83.9	Confident	56 Å²	56	67.9 Å²	67.9	46%	0.463	36%	0.356	S	S	.	.	H	α-helix	trans	-58.6	-25.6	-174.6	0	0	0	0	0	115	Y200 G221	Y200-A217 HydrophobicContact CD1-CB 4.35Å; Y200-A217 HydrophobicContact CD2-CB 4.41Å; Y200-A217 HydrophobicContact CE1-CB 3.96Å; Y200-A217 HydrophobicContact CE2-CB 4.01Å; Y200-A217 PolarHBondContact OH-N 3.48Å; A217-G221 PolarHBondContact O-N 2.99Å
218	A	83.2	Confident	84	Confident	68 Å²	68	68.2 Å²	68.2	56%	0.562	36%	0.358	S	S	*	.	H	α-helix	trans	-77.5	-46.6	176.4	0	0	0	0	0	111.5	N216 G221 K222	N216-A218 PolarHBondContact O-N 3.34Å; N216-A218 VanDerWaalsContact O-N 3.08Å; N216-A218 WeakPolarHBondContact OD1-CA 3.38Å; N216-A218 WeakPolarHBondContact OD1-CB 3.43Å; N216-A218 PolarHBondContact OD1-N 3Å; A218-G221 CarbonylContact O-C 3.6Å; A218-G221 WeakPolarHBondContact O-CA 3.42Å; A218-G221 PolarHBondContact O-N 3.31Å; A218-G221 VanDerWaalsContact O-N 3.15Å; A218-K222 PolarHBondContact O-N 3.08Å; A218-K222 VanDerWaalsContact O-N 3.07Å
219	S	82.3	Confident	83.9	Confident	34 Å²	34	67.1 Å²	67.1	24%	0.238	35%	0.354	C	S	.	.	H	α-helix	trans	-64.5	-42.5	174.3	-64.3	0	0	0	0	111.8	N216 G221 K222 L223	N216-S219 PolarHBondContact ND2-OG 3.23Å; N216-S219 PolarHBondContact O-N 3.42Å; N216-S219 VanDerWaalsContact O-N 3.14Å; N216-S219 PolarHBondContact OD1-N 3.01Å; S219-G221 VanDerWaalsContact C-N 3.25Å; S219-G221 PolarHBondContact O-N 3.01Å; S219-K222 WeakPolarHBondContact O-CB 3.47Å; S219-K222 PolarHBondContact O-N 2.99Å; S219-L223 PolarHBondContact O-N 3.37Å; S219-L223 VanDerWaalsContact O-N 3.09Å
220	F	88.1	Confident	83.7	Confident	4 Å²	4	64.3 Å²	64.3	2%	0.018	36%	0.359	C	S	.	.	H	α-helix	trans	-59.3	-38.7	170.7	-178.6	-102.4	0	0	0	111.8	L182 L199 Y200 Y203 V215 N216 K222 L223 I224	L182-F220 HydrophobicContact CD1-CE2 4.34Å; L182-F220 HydrophobicContact CD2-CZ 4.36Å; L199-F220 HydrophobicContact CD2-CE1 3.33Å; L199-F220 HydrophobicContact CD2-CZ 3.37Å; Y200-F220 HydrophobicContact CD2-CB 4.21Å; Y200-F220 AromaticContact CD2-CD1 3.52Å; Y200-F220 HydrophobicContact CD2-CD1 3.52Å; Y200-F220 HydrophobicContact CD2-CE1 4Å; Y200-F220 AromaticContact CD2-CG 3.88Å; Y200-F220 HydrophobicContact CD2-CG 3.88Å; Y200-F220 HydrophobicContact CE2-CB 4.01Å; Y200-F220 HydrophobicContact CE2-CD1 4.19Å; Y200-F220 HydrophobicContact CE2-CG 4.11Å; Y203-F220 AromaticContact CD1-CD2 3.53Å; Y203-F220 HydrophobicContact CD1-CD2 3.53Å; Y203-F220 AromaticContact CD1-CE2 3.66Å; Y203-F220 HydrophobicContact CD1-CE2 3.66Å; Y203-F220 HydrophobicContact CD1-CG 4.05Å; Y203-F220 HydrophobicContact CD1-CZ 4.25Å; Y203-F220 AromaticContact CD2-CD2 3.92Å; Y203-F220 HydrophobicContact CD2-CD2 3.92Å; Y203-F220 AromaticContact CD2-CE2 3.43Å; Y203-F220 HydrophobicContact CD2-CE2 3.43Å; Y203-F220 VanDerWaalsContact CD2-CE2 3.43Å; Y203-F220 HydrophobicContact CD2-CZ 4.26Å; Y203-F220 AromaticContact CE1-CD2 3.66Å; Y203-F220 HydrophobicContact CE1-CD2 3.66Å; Y203-F220 HydrophobicContact CE1-CE2 4.15Å; Y203-F220 HydrophobicContact CE1-CG 4.26Å; Y203-F220 HydrophobicContact CE2-CD2 4.04Å; Y203-F220 AromaticContact CE2-CE2 3.95Å; Y203-F220 HydrophobicContact CE2-CE2 3.95Å; Y203-F220 AromaticContact CG-CD2 3.68Å; Y203-F220 HydrophobicContact CG-CD2 3.68Å; Y203-F220 AromaticContact CG-CE2 3.28Å; Y203-F220 HydrophobicContact CG-CE2 3.28Å; Y203-F220 HydrophobicContact CG-CG 4.49Å; Y203-F220 AromaticContact CG-CZ 3.79Å; Y203-F220 HydrophobicContact CG-CZ 3.79Å; Y203-F220 AromaticContact CZ-CD2 3.94Å; V215-F220 HydrophobicContact CG2-CB 3.81Å; V215-F220 HydrophobicContact CG2-CD2 4.5Å; N216-F220 WeakPolarHBondContact O-CB 3.12Å; N216-F220 PolarHBondContact O-N 2.94Å; F220-K222 VanDerWaalsContact C-N 3.28Å; F220-K222 PolarHBondContact O-N 3.42Å; F220-L223 PolarHBondContact O-N 2.85Å; F220-I224 PolarHBondContact O-N 3.41Å
221	G	88.1	Confident	84.2	Confident	2 Å²	2	60.2 Å²	60.2	2%	0.021	34%	0.34	C	S	.	.	H	α-helix	trans	-60.7	-31.3	172.1	0	0	0	0	0	114	A217 A218 S219 R225	A217-G221 PolarHBondContact O-N 2.99Å; A218-G221 CarbonylContact O-C 3.6Å; A218-G221 WeakPolarHBondContact O-CA 3.42Å; A218-G221 PolarHBondContact O-N 3.31Å; A218-G221 VanDerWaalsContact O-N 3.15Å; S219-G221 VanDerWaalsContact C-N 3.25Å; S219-G221 PolarHBondContact O-N 3.01Å; G221-R225 PolarHBondContact O-NE 3.15Å; G221-R225 PolarHBondContact O-NH1 3.13Å; G221-R225 PolarHBondContact O-NH2 2.98Å; G221-R225 VanDerWaalsContact O-NH2 3.12Å
222	K	84.2	Confident	84.6	Confident	113 Å²	113	59 Å²	59	49%	0.491	33%	0.33	S	S	.	.	H	α-helix	trans	-68.7	-52	170.3	-58.8	176.3	-175.4	174.8	0	110.1	A218 S219 F220 I224 R225 S226	A218-K222 PolarHBondContact O-N 3.08Å; A218-K222 VanDerWaalsContact O-N 3.07Å; S219-K222 WeakPolarHBondContact O-CB 3.47Å; S219-K222 PolarHBondContact O-N 2.99Å; F220-K222 VanDerWaalsContact C-N 3.28Å; F220-K222 PolarHBondContact O-N 3.42Å; K222-I224 PolarHBondContact O-N 3.23Å; K222-R225 PolarHBondContact O-N 2.78Å; K222-S226 PolarHBondContact O-N 3.5Å; K222-S226 VanDerWaalsContact O-N 3.13Å; K222-S226 PolarHBondContact O-OG 3.31Å
223	L	84.5	Confident	85	Confident	14 Å²	14	60.3 Å²	60.3	7%	0.073	34%	0.34	C	S	.	.	H	α-helix	trans	-53.8	-48.8	-177	179.6	63.6	0	0	0	113	L161 L175 H178 S219 F220 R225 S226 I227	L161-L223 HydrophobicContact CD1-CD1 3.73Å; L175-L223 HydrophobicContact CD2-CD1 4.26Å; H178-L223 HydrophobicContact CB-CD2 4.35Å; S219-L223 PolarHBondContact O-N 3.37Å; S219-L223 VanDerWaalsContact O-N 3.09Å; F220-L223 PolarHBondContact O-N 2.85Å; L223-R225 VanDerWaalsContact C-N 3.29Å; L223-R225 PolarHBondContact O-N 3.43Å; L223-S226 PolarHBondContact O-N 2.93Å; L223-S226 PolarHBondContact O-OG 2.97Å; L223-I227 HydrophobicContact CD1-CD1 3.89Å; L223-I227 HydrophobicContact CG-CD1 3.92Å; L223-I227 WeakPolarHBondContact O-CD1 3.3Å; L223-I227 VanDerWaalsContact O-CG1 3.31Å; L223-I227 WeakPolarHBondContact O-CG1 2.93Å; L223-I227 PolarHBondContact O-N 2.86Å
224	I	89.1	Confident	85.7	Confident	0 Å²	0	58.8 Å²	58.8	0%	0	32%	0.323	C	S	.	.	H	α-helix	trans	-63.3	-34.3	179	-166.3	-173.8	0	0	0	112.5	L199 F220 K222 I227 F228 L231 Y246 I249	L199-I224 HydrophobicContact CD1-CD1 3.54Å; L199-I224 HydrophobicContact CD2-CD1 3.74Å; L199-I224 HydrophobicContact CG-CD1 4.34Å; F220-I224 PolarHBondContact O-N 3.41Å; K222-I224 PolarHBondContact O-N 3.23Å; I224-I227 PolarHBondContact O-N 2.89Å; I224-F228 HydrophobicContact CG1-CD2 3.76Å; I224-F228 HydrophobicContact CG1-CE2 4.3Å; I224-F228 PolarHBondContact O-N 3.18Å; I224-L231 HydrophobicContact CD1-CD1 3.9Å; I224-L231 HydrophobicContact CG1-CD1 3.81Å; I224-L231 HydrophobicContact CG2-CD1 4.49Å; I224-Y246 HydrophobicContact CD1-CD2 3.76Å; I224-Y246 HydrophobicContact CD1-CE2 3.73Å; I224-Y246 HydrophobicContact CD1-CG 4.42Å; I224-Y246 HydrophobicContact CG2-CE1 4.28Å; I224-Y246 HydrophobicContact CG2-CE2 3.98Å; I224-I249 HydrophobicContact CD1-CD1 4.15Å
225	R	88.4	Confident	86.1	Confident	100 Å²	100	62.9 Å²	62.9	38%	0.377	33%	0.33	S	S	.	.	H	α-helix	trans	-74.3	-24.6	178.9	-78.6	-171.2	-73.9	-76.9	5.3	113.6	G221 K222 L223 L231 Y246	G221-R225 PolarHBondContact O-NE 3.15Å; G221-R225 PolarHBondContact O-NH1 3.13Å; G221-R225 PolarHBondContact O-NH2 2.98Å; G221-R225 VanDerWaalsContact O-NH2 3.12Å; K222-R225 PolarHBondContact O-N 2.78Å; L223-R225 VanDerWaalsContact C-N 3.29Å; L223-R225 PolarHBondContact O-N 3.43Å; R225-L231 HydrophobicContact CG-CB 4.41Å; R225-Y246 PolarHBondContact NH1-OH 3.49Å
226	S	80.8	Confident	86.3	Confident	33 Å²	33	63.4 Å²	63.4	23%	0.231	33%	0.33	C	S	.	.	H	α-helix	trans	-80.9	-17.1	170.8	49.9	0	0	0	0	113.7	K222 L223	K222-S226 PolarHBondContact O-N 3.5Å; K222-S226 VanDerWaalsContact O-N 3.13Å; K222-S226 PolarHBondContact O-OG 3.31Å; L223-S226 PolarHBondContact O-N 2.93Å; L223-S226 PolarHBondContact O-OG 2.97Å
227	I	84.7	Confident	86.5	Confident	21 Å²	21	61.8 Å²	61.8	11%	0.108	34%	0.335	C	S	.	.	H	α-helix	trans	-91.9	-51.1	178.2	-63.7	167.1	0	0	0	110.8	L179 L182 L183 L223 I224 M229	L179-I227 HydrophobicContact CB-CD1 4.47Å; L179-I227 HydrophobicContact CD1-CD1 3.63Å; L179-I227 HydrophobicContact CD1-CG1 3.62Å; L179-I227 HydrophobicContact CD1-CG2 4.21Å; L182-I227 HydrophobicContact CB-CD1 4.39Å; L182-I227 HydrophobicContact CD1-CD1 3.55Å; L183-I227 HydrophobicContact CD2-CG2 3.66Å; L183-I227 HydrophobicContact CG-CG2 4.04Å; L223-I227 HydrophobicContact CD1-CD1 3.89Å; L223-I227 HydrophobicContact CG-CD1 3.92Å; L223-I227 WeakPolarHBondContact O-CD1 3.3Å; L223-I227 VanDerWaalsContact O-CG1 3.31Å; L223-I227 WeakPolarHBondContact O-CG1 2.93Å; L223-I227 PolarHBondContact O-N 2.86Å; I224-I227 PolarHBondContact O-N 2.89Å; I227-M229 PolarHBondContact O-N 3.41Å
228	F	89.4	Confident	86.2	Confident	9 Å²	9	64.1 Å²	64.1	4%	0.039	34%	0.344	C	S	.	.	S	Bend	trans	-100.8	86.3	-179	-61.4	-85.7	0	0	0	109.8	L182 L183 I224 L231 I249	L182-F228 HydrophobicContact CB-CE2 4.27Å; L183-F228 HydrophobicContact CD2-CZ 4.44Å; I224-F228 HydrophobicContact CG1-CD2 3.76Å; I224-F228 HydrophobicContact CG1-CE2 4.3Å; I224-F228 PolarHBondContact O-N 3.18Å; F228-L231 HydrophobicContact CB-CD1 3.7Å; F228-L231 HydrophobicContact CB-CG 3.75Å; F228-L231 WeakPolarHBondContact O-CB 3.4Å; F228-L231 WeakPolarHBondContact O-CG 3.36Å; F228-L231 PolarHBondContact O-N 3.16Å; F228-I249 HydrophobicContact CB-CD1 4.35Å; F228-I249 HydrophobicContact CD1-CD1 3.83Å; F228-I249 HydrophobicContact CD1-CG1 4.31Å; F228-I249 HydrophobicContact CD2-CD1 3.62Å; F228-I249 HydrophobicContact CE1-CD1 4Å; F228-I249 HydrophobicContact CE1-CG1 4.46Å; F228-I249 HydrophobicContact CE2-CD1 3.79Å; F228-I249 HydrophobicContact CG-CD1 3.65Å; F228-I249 HydrophobicContact CZ-CD1 3.99Å
229	M	83.9	Confident	85.6	Confident	133 Å²	133	72.8 Å²	72.8	66%	0.655	36%	0.361	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.2	138.3	-178.9	-153.5	66.1	67.9	0	0	111.4	T153 I227 L231	T153-M229 HydrophobicContact CG2-CE 3.98Å; I227-M229 PolarHBondContact O-N 3.41Å; M229-L231 VanDerWaalsContact C-N 3.31Å; M229-L231 PolarHBondContact O-N 3.2Å
230	G	82.2	Confident	85.3	Confident	65 Å²	65	74.5 Å²	74.5	67%	0.67	39%	0.385	S	S	*	.	T	Hydrogen-bonded Turn	trans	79.9	2.3	179.9	0	0	0	0	0	115.9	R232	G230-R232 WeakPolarHBondContact O-CG 3.42Å; G230-R232 PolarHBondContact O-N 3.5Å
231	L	89.3	Confident	84.9	Confident	21 Å²	21	80 Å²	80	11%	0.11	42%	0.415	C	S	.	.			trans	-51	111.9	176.7	-103.7	-174.4	0	0	0	112.9	I224 R225 F228 M229 Y246 Y247 I249	I224-L231 HydrophobicContact CD1-CD1 3.9Å; I224-L231 HydrophobicContact CG1-CD1 3.81Å; I224-L231 HydrophobicContact CG2-CD1 4.49Å; R225-L231 HydrophobicContact CG-CB 4.41Å; F228-L231 HydrophobicContact CB-CD1 3.7Å; F228-L231 HydrophobicContact CB-CG 3.75Å; F228-L231 WeakPolarHBondContact O-CB 3.4Å; F228-L231 WeakPolarHBondContact O-CG 3.36Å; F228-L231 PolarHBondContact O-N 3.16Å; M229-L231 VanDerWaalsContact C-N 3.31Å; M229-L231 PolarHBondContact O-N 3.2Å; L231-Y246 HydrophobicContact CD1-CD1 4.27Å; L231-Y246 HydrophobicContact CD1-CG 4.43Å; L231-Y246 HydrophobicContact CD2-CD1 4.47Å; L231-Y246 HydrophobicContact CD2-CG 4.42Å; L231-Y247 WeakPolarHBondContact CD2-O 3.37Å; L231-I249 HydrophobicContact CD2-CB 3.9Å; L231-I249 HydrophobicContact CD2-CG2 3.75Å
232	R	89.4	Confident	84.8	Confident	166 Å²	166	81.1 Å²	81.1	63%	0.626	42%	0.422	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-87.3	148.6	177	-54.7	-170.2	-168.1	-172.9	7.1	110	G230 Y247	G230-R232 WeakPolarHBondContact O-CG 3.42Å; G230-R232 PolarHBondContact O-N 3.5Å; R232-Y247 HydrophobicContact CB-CD1 4.27Å; R232-Y247 PolarHBondContact N-O 2.65Å; R232-Y247 VanDerWaalsContact N-O 3.09Å; R232-Y247 PolarHBondContact O-N 3.46Å
233	T	89.9	Confident	85.1	Confident	64 Å²	64	82.4 Å²	82.4	39%	0.393	43%	0.428	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.2	129.4	169.6	-63.5	0	0	0	0	109	R196 Y244	R196-T233 PolarHBondContact NH2-OG1 3.12Å; T233-Y244 HydrophobicContact CG2-CD1 4.04Å
234	R	91.5	Very high	85.6	Confident	119 Å²	119	87.7 Å²	87.7	45%	0.449	45%	0.448	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	153.7	169.4	-72.7	-174.9	169.3	-178	-4.3	109.5	L236 H245 Y247	R234-L236 HydrophobicContact CB-CD1 3.53Å; R234-H245 PolarHBondContact N-O 3.34Å; R234-H245 VanDerWaalsContact N-O 3.15Å; R234-H245 PolarHBondContact O-N 2.96Å; R234-Y247 VanDerWaalsContact NH1-CE2 3.28Å
235	R	91.2	Very high	85.8	Confident	151 Å²	151	89.1 Å²	89.1	57%	0.57	45%	0.454	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-110.4	115.8	171.4	-160.6	-175.5	177.7	-174.2	-4.5	107.2	S242 K243 Y244	R235-S242 PolarHBondContact NE-O 3.47Å; R235-S242 PolarHBondContact NH2-O 3.21Å; R235-K243 CarbonylContact C-O 3.57Å; R235-K243 VanDerWaalsContact CA-O 3.29Å; R235-K243 WeakPolarHBondContact CA-O 3.33Å; R235-Y244 HydrophobicContact CB-CD1 4.48Å; R235-Y244 HydrophobicContact CG-CD1 4.37Å; R235-Y244 HydrophobicContact CG-CE1 4.34Å
236	L	86.8	Confident	86.1	Confident	69 Å²	69	84.7 Å²	84.7	36%	0.361	44%	0.437	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121	148.7	-174.3	-71.2	100.6	0	0	0	111.3	R234 S242 K243 H245	R234-L236 HydrophobicContact CB-CD1 3.53Å; L236-S242 CarbonylContact O-C 3.55Å; L236-S242 VanDerWaalsContact O-CA 3.22Å; L236-S242 WeakPolarHBondContact O-CA 3.45Å; L236-K243 PolarHBondContact N-O 3.25Å; L236-K243 PolarHBondContact O-N 2.82Å; L236-H245 HydrophobicContact CD1-CB 3.68Å
237	G	86.1	Confident	86.7	Confident	56 Å²	56	85.5 Å²	85.5	58%	0.577	44%	0.436	S	S	*	.	S	Bend	trans	109.6	160.2	-174.6	0	0	0	0	0	112.7	S242	G237-S242 VanDerWaalsContact O-CB 3.32Å; G237-S242 WeakPolarHBondContact O-CB 3.4Å; G237-S242 PolarHBondContact O-OG 3.37Å
238	T	76.3	Confident	87	Confident	105 Å²	105	85.2 Å²	85.2	64%	0.644	44%	0.438	S	S	*	.	S	Bend	trans	-62.8	158.1	-175.4	49.7	0	0	0	0	113.2	G240 N241 S242	T238-G240 PolarHBondContact O-N 3.19Å; T238-N241 CarbonylContact O-C 3.59Å; T238-N241 WeakPolarHBondContact O-CA 3.26Å; T238-N241 PolarHBondContact O-N 2.82Å; T238-S242 PolarHBondContact O-N 2.91Å; T238-S242 PolarHBondContact O-OG 3.24Å
239	R	72.1	Confident	87.1	Confident	249 Å²	249	84.8 Å²	84.8	94%	0.94	44%	0.436	S	S	*	.	T	Hydrogen-bonded Turn	trans	-49.6	129.2	-179.7	-172.2	175.5	-179.9	172.7	-1.1	110.4	N241	R239-N241 VanDerWaalsContact C-N 3.3Å; R239-N241 PolarHBondContact O-N 3.24Å
240	G	75.2	Confident	87.5	Confident	71 Å²	71	83.6 Å²	83.6	73%	0.732	42%	0.424	S	S	*	.	T	Hydrogen-bonded Turn	trans	88.9	-39.8	-172.1	0	0	0	0	0	114.3	T238	T238-G240 PolarHBondContact O-N 3.19Å
241	N	79.5	Confident	88.1	Confident	120 Å²	120	81 Å²	81	64%	0.642	40%	0.396	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.3	-3.4	-178.3	-73	-60.7	0	0	0	114.7	T238 R239 K243	T238-N241 CarbonylContact O-C 3.59Å; T238-N241 WeakPolarHBondContact O-CA 3.26Å; T238-N241 PolarHBondContact O-N 2.82Å; R239-N241 VanDerWaalsContact C-N 3.3Å; R239-N241 PolarHBondContact O-N 3.24Å; N241-K243 PolarHBondContact O-N 3.39Å; N241-K243 VanDerWaalsContact O-N 3.16Å
242	S	86.3	Confident	88.2	Confident	25 Å²	25	82 Å²	82	18%	0.175	40%	0.399	C	S	.	.			trans	-63.8	113.5	-171.7	-34.7	0	0	0	0	113.1	R235 L236 G237 T238	R235-S242 PolarHBondContact NE-O 3.47Å; R235-S242 PolarHBondContact NH2-O 3.21Å; L236-S242 CarbonylContact O-C 3.55Å; L236-S242 VanDerWaalsContact O-CA 3.22Å; L236-S242 WeakPolarHBondContact O-CA 3.45Å; G237-S242 VanDerWaalsContact O-CB 3.32Å; G237-S242 WeakPolarHBondContact O-CB 3.4Å; G237-S242 PolarHBondContact O-OG 3.37Å; T238-S242 PolarHBondContact O-N 2.91Å; T238-S242 PolarHBondContact O-OG 3.24Å
243	K	90.8	Very high	88	Confident	140 Å²	140	79.1 Å²	79.1	61%	0.609	40%	0.402	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-93.7	158.9	-179.7	-65.5	179.2	-176	176	0	111.6	R235 L236 N241	R235-K243 CarbonylContact C-O 3.57Å; R235-K243 VanDerWaalsContact CA-O 3.29Å; R235-K243 WeakPolarHBondContact CA-O 3.33Å; L236-K243 PolarHBondContact N-O 3.25Å; L236-K243 PolarHBondContact O-N 2.82Å; N241-K243 PolarHBondContact O-N 3.39Å; N241-K243 VanDerWaalsContact O-N 3.16Å
244	Y	93.8	Very high	87.8	Confident	125 Å²	125	82.2 Å²	82.2	49%	0.49	42%	0.416	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.3	132.1	176.5	-67.6	-81.5	0	0	0	112	R196 T233 R235	R196-Y244 WeakPolarHBondContact CB-O 3.43Å; R196-Y244 WeakPolarHBondContact CG-O 3.43Å; R196-Y244 PolarHBondContact N-O 3.34Å; T233-Y244 HydrophobicContact CG2-CD1 4.04Å; R235-Y244 HydrophobicContact CB-CD1 4.48Å; R235-Y244 HydrophobicContact CG-CD1 4.37Å; R235-Y244 HydrophobicContact CG-CE1 4.34Å
245	H	94.2	Very high	87.7	Confident	29 Å²	29	76.9 Å²	76.9	13%	0.134	40%	0.397	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121	150.8	177.5	-72.4	-138.7	0	0	0	110.5	S193 L194 R234 L236	S193-H245 PolarHBondContact OG-ND1 2.94Å; L194-H245 CarbonylContact O-C 3.53Å; L194-H245 VanDerWaalsContact O-CA 3.28Å; L194-H245 WeakPolarHBondContact O-CA 3.45Å; L194-H245 WeakPolarHBondContact O-CB 3.43Å; R234-H245 PolarHBondContact N-O 3.34Å; R234-H245 VanDerWaalsContact N-O 3.15Å; R234-H245 PolarHBondContact O-N 2.96Å; L236-H245 HydrophobicContact CD1-CB 3.68Å
246	Y	94.7	Very high	87.3	Confident	8 Å²	8	74 Å²	74	3%	0.031	40%	0.398	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.7	129.6	159.2	-69.6	-52.5	0	0	0	108.6	S193 L194 R196 I224 R225 L231	S193-Y246 CarbonylContact C-O 3.58Å; S193-Y246 VanDerWaalsContact CA-O 3.25Å; S193-Y246 WeakPolarHBondContact CA-O 3.35Å; L194-Y246 PolarHBondContact N-O 3.06Å; L194-Y246 PolarHBondContact O-N 3.06Å; R196-Y246 HydrophobicContact CB-CE2 4.27Å; R196-Y246 HydrophobicContact CG-CD1 4.33Å; R196-Y246 HydrophobicContact CG-CD2 3.83Å; R196-Y246 HydrophobicContact CG-CE1 4.15Å; R196-Y246 HydrophobicContact CG-CE2 3.66Å; R196-Y246 HydrophobicContact CG-CG 4.15Å; I224-Y246 HydrophobicContact CD1-CD2 3.76Å; I224-Y246 HydrophobicContact CD1-CE2 3.73Å; I224-Y246 HydrophobicContact CD1-CG 4.42Å; I224-Y246 HydrophobicContact CG2-CE1 4.28Å; I224-Y246 HydrophobicContact CG2-CE2 3.98Å; R225-Y246 PolarHBondContact NH1-OH 3.49Å; L231-Y246 HydrophobicContact CD1-CD1 4.27Å; L231-Y246 HydrophobicContact CD1-CG 4.43Å; L231-Y246 HydrophobicContact CD2-CD1 4.47Å; L231-Y246 HydrophobicContact CD2-CG 4.42Å
247	Y	93.5	Very high	87.3	Confident	50 Å²	50	71.3 Å²	71.3	20%	0.196	38%	0.384	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	133	178.6	178.4	-86.5	0	0	0	109	G191 V192 L231 R232 R234	G191-Y247 WeakPolarHBondContact CA-OH 3.35Å; G191-Y247 WeakPolarHBondContact O-CE2 3.41Å; V192-Y247 WeakPolarHBondContact O-CD2 3.48Å; L231-Y247 WeakPolarHBondContact CD2-O 3.37Å; R232-Y247 HydrophobicContact CB-CD1 4.27Å; R232-Y247 PolarHBondContact N-O 2.65Å; R232-Y247 VanDerWaalsContact N-O 3.09Å; R232-Y247 PolarHBondContact O-N 3.46Å; R234-Y247 VanDerWaalsContact NH1-CE2 3.28Å
248	G	90.1	Very high	87	Confident	15 Å²	15	71.5 Å²	71.5	16%	0.155	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	101.7	10.2	-170.4	0	0	0	0	0	114.9	T188 A189 V192	T188-G248 VanDerWaalsContact CA-O 3.32Å; T188-G248 WeakPolarHBondContact CA-O 3.27Å; T188-G248 WeakPolarHBondContact CG2-O 3.39Å; A189-G248 PolarHBondContact N-O 3.11Å; A189-G248 CarbonylContact O-C 3.07Å; A189-G248 WeakPolarHBondContact O-CA 3.4Å; V192-G248 PolarHBondContact O-N 3.44Å; V192-G248 VanDerWaalsContact O-N 3.12Å
249	I	93.3	Very high	86.9	Confident	0 Å²	0	75.7 Å²	75.7	0%	0	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.7	146.4	-177.7	-164.7	173.4	0	0	0	111.6	Y186 E187 L194 L199 I224 F228 L231	Y186-I249 HydrophobicContact CG-CD1 4.43Å; E187-I249 WeakPolarHBondContact O-CA 3.41Å; E187-I249 WeakPolarHBondContact O-CG1 3.48Å; L194-I249 HydrophobicContact CB-CG2 4.27Å; L199-I249 HydrophobicContact CD1-CD1 4.29Å; I224-I249 HydrophobicContact CD1-CD1 4.15Å; F228-I249 HydrophobicContact CB-CD1 4.35Å; F228-I249 HydrophobicContact CD1-CD1 3.83Å; F228-I249 HydrophobicContact CD1-CG1 4.31Å; F228-I249 HydrophobicContact CD2-CD1 3.62Å; F228-I249 HydrophobicContact CE1-CD1 4Å; F228-I249 HydrophobicContact CE1-CG1 4.46Å; F228-I249 HydrophobicContact CE2-CD1 3.79Å; F228-I249 HydrophobicContact CG-CD1 3.65Å; F228-I249 HydrophobicContact CZ-CD1 3.99Å; L231-I249 HydrophobicContact CD2-CB 3.9Å; L231-I249 HydrophobicContact CD2-CG2 3.75Å
250	R	92	Very high	86.6	Confident	107 Å²	107	66 Å²	66	40%	0.404	34%	0.342	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.3	163.4	169.6	62.2	-176.9	-174.5	-141	-2.8	112	Y186 E187 A189 V192	Y186-R250 VanDerWaalsContact CA-O 3.31Å; Y186-R250 WeakPolarHBondContact CA-O 3.48Å; E187-R250 HydrophobicContact CG-CG 3.82Å; E187-R250 PolarHBondContact N-O 2.99Å; E187-R250 PolarHBondContact O-N 3.3Å; E187-R250 IonicContact OE1-CZ 3.89Å; E187-R250 IonicContact OE1-NE 3.16Å; E187-R250 PolarHBondContact OE1-NE 3.24Å; E187-R250 IonicContact OE1-NH2 3.94Å; E187-R250 PolarHBondContact OE1-NH2 3.47Å; A189-R250 HydrophobicContact CB-CG 3.81Å; V192-R250 HydrophobicContact CG2-CB 4.11Å
251	V	93.3	Very high	85.8	Confident	12 Å²	12	65.6 Å²	65.6	7%	0.073	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65	138.4	160.1	-178.7	0	0	0	0	107.5	Y186 L194 L257 N258	Y186-V251 HydrophobicContact CD1-CG2 4.06Å; Y186-V251 HydrophobicContact CE1-CB 4.43Å; Y186-V251 HydrophobicContact CE1-CG2 3.54Å; L194-V251 HydrophobicContact CD1-CG2 4.44Å; V251-L257 HydrophobicContact CG1-CB 4.03Å; V251-N258 VanDerWaalsContact CG1-OD1 3.29Å; V251-N258 WeakPolarHBondContact CG1-OD1 3.4Å
252	K	91.8	Very high	84.3	Confident	41 Å²	41	65.9 Å²	65.9	18%	0.178	32%	0.318	C	S	.	.			trans	-70.4	151.3	176.9	-60.1	-175.5	-168.7	161.1	0	111.7	L183 D184 N185 Y186 E187 D254 S255 N258	L183-K252 VanDerWaalsContact O-CE 3.29Å; L183-K252 WeakPolarHBondContact O-CE 3.47Å; L183-K252 PolarHBondContact O-NZ 3.22Å; D184-K252 VanDerWaalsContact C-NZ 3.3Å; D184-K252 WeakPolarHBondContact O-CD 3.32Å; D184-K252 VanDerWaalsContact O-CE 3.25Å; D184-K252 WeakPolarHBondContact O-CE 3.37Å; D184-K252 PolarHBondContact O-NZ 2.94Å; N185-K252 PolarHBondContact O-N 3.42Å; Y186-K252 VanDerWaalsContact O-CE 3.29Å; Y186-K252 WeakPolarHBondContact O-CE 3.4Å; E187-K252 HydrophobicContact CB-CG 3.93Å; E187-K252 HydrophobicContact CG-CG 3.86Å; K252-D254 VanDerWaalsContact C-N 3.26Å; K252-D254 WeakPolarHBondContact CB-OD1 3.28Å; K252-D254 PolarHBondContact O-N 2.62Å; K252-S255 WeakPolarHBondContact O-CB 3.38Å; K252-S255 PolarHBondContact O-N 2.93Å; K252-S255 VanDerWaalsContact O-N 3.13Å; K252-N258 PolarHBondContact O-ND2 2.94Å
253	P	85.1	Confident	82.5	Confident	105 Å²	105	69.1 Å²	69.1	68%	0.682	33%	0.334	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.2	-31.9	178.8	-24.7	34.9	0	0	0	114.8	N258	P253-N258 PolarHBondContact O-ND2 3.42Å
254	D	86.4	Confident	80.5	Confident	129 Å²	129	65.5 Å²	65.5	69%	0.69	32%	0.32	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.3	-8.6	180	62.3	-28.6	0	0	0	113.9	K252	K252-D254 VanDerWaalsContact C-N 3.26Å; K252-D254 WeakPolarHBondContact CB-OD1 3.28Å; K252-D254 PolarHBondContact O-N 2.62Å
255	S	89.4	Confident	78.3	Confident	8 Å²	8	65.8 Å²	65.8	6%	0.056	33%	0.326	C	S	.	.			trans	-68.6	136.8	-178.9	174.4	0	0	0	0	112.2	N185 K252 L257 N258	N185-S255 PolarHBondContact OD1-OG 3.07Å; K252-S255 WeakPolarHBondContact O-CB 3.38Å; K252-S255 PolarHBondContact O-N 2.93Å; K252-S255 VanDerWaalsContact O-N 3.13Å; S255-L257 PolarHBondContact O-N 2.95Å; S255-L257 VanDerWaalsContact O-N 3.14Å; S255-L257 WeakPolarHBondContact OG-CB 3.34Å; S255-L257 WeakPolarHBondContact OG-CG 3.45Å; S255-L257 PolarHBondContact OG-N 3.33Å; S255-L257 VanDerWaalsContact OG-N 3.15Å; S255-N258 PolarHBondContact O-N 2.62Å; S255-N258 PolarHBondContact O-ND2 3.12Å
256	P	83.1	Confident	75.8	Confident	90 Å²	90	73 Å²	73	58%	0.584	35%	0.353	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64	-15.9	172.6	27.9	-35.9	0	0	0	113.2	N258 R259	P256-N258 PolarHBondContact O-N 3.19Å; P256-R259 PolarHBondContact O-N 3.46Å
257	L	85.8	Confident	73.3	Confident	12 Å²	12	78.2 Å²	78.2	6%	0.063	38%	0.379	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66.1	-20.9	-179.9	-59.3	-178.2	0	0	0	113.4	W181 N185 Y186 H202 V251 S255 R259 L260 Q261	W181-L257 HydrophobicContact CH2-CD1 4.5Å; W181-L257 HydrophobicContact CZ2-CD1 3.83Å; W181-L257 HydrophobicContact CZ2-CD2 4.41Å; N185-L257 HydrophobicContact CB-CD1 3.67Å; N185-L257 HydrophobicContact CB-CG 4.39Å; Y186-L257 HydrophobicContact CE2-CD1 3.93Å; Y186-L257 WeakPolarHBondContact OH-CD1 3.23Å; H202-L257 HydrophobicContact CB-CD1 4.1Å; H202-L257 HydrophobicContact CB-CD2 4.34Å; V251-L257 HydrophobicContact CG1-CB 4.03Å; S255-L257 PolarHBondContact O-N 2.95Å; S255-L257 VanDerWaalsContact O-N 3.14Å; S255-L257 WeakPolarHBondContact OG-CB 3.34Å; S255-L257 WeakPolarHBondContact OG-CG 3.45Å; S255-L257 PolarHBondContact OG-N 3.33Å; S255-L257 VanDerWaalsContact OG-N 3.15Å; L257-R259 VanDerWaalsContact C-N 3.3Å; L257-R259 PolarHBondContact O-N 2.7Å; L257-L260 HydrophobicContact CD2-CD1 3.88Å; L257-L260 WeakPolarHBondContact O-CB 3.48Å; L257-L260 PolarHBondContact O-N 2.98Å; L257-Q261 PolarHBondContact O-N 3.3Å
258	N	81.1	Confident	71.2	Confident	60 Å²	60	79 Å²	79	32%	0.321	40%	0.396	S	S	.	.	H	α-helix	trans	-58.8	-41.4	179.1	-68.8	-54	0	0	0	112.2	V251 K252 P253 S255 P256 L260 Q261	V251-N258 VanDerWaalsContact CG1-OD1 3.29Å; V251-N258 WeakPolarHBondContact CG1-OD1 3.4Å; K252-N258 PolarHBondContact O-ND2 2.94Å; P253-N258 PolarHBondContact O-ND2 3.42Å; S255-N258 PolarHBondContact O-N 2.62Å; S255-N258 PolarHBondContact O-ND2 3.12Å; P256-N258 PolarHBondContact O-N 3.19Å; N258-L260 PolarHBondContact O-N 3.5Å; N258-Q261 PolarHBondContact O-N 3Å
259	R	74.2	Confident	68.9	Low	194 Å²	194	85.5 Å²	85.5	73%	0.732	43%	0.426	S	S	*	.	H	α-helix	trans	-62.3	-25.1	176.3	-62.4	-179.5	-177.8	168.2	1.6	113.1	P256 L257	P256-R259 PolarHBondContact O-N 3.46Å; L257-R259 VanDerWaalsContact C-N 3.3Å; L257-R259 PolarHBondContact O-N 2.7Å
260	L	65.5	Low	66.3	Low	44 Å²	44	96.5 Å²	96.5	23%	0.23	47%	0.468	C	S	.	.	H	α-helix	trans	-87.3	-15.3	-177.2	-54.6	174.6	0	0	0	112.4	L257 N258 M264	L257-L260 HydrophobicContact CD2-CD1 3.88Å; L257-L260 WeakPolarHBondContact O-CB 3.48Å; L257-L260 PolarHBondContact O-N 2.98Å; N258-L260 PolarHBondContact O-N 3.5Å; L260-M264 PolarHBondContact O-N 3.06Å
261	Q	58.3	Low	63.6	Low	64 Å²	64	98.6 Å²	98.6	30%	0.299	48%	0.482	S	S	.	.	H	α-helix	trans	-77.9	-30.9	175.5	-167	162.8	-61.9	0	0	111.7	L257 N258 M264 Q265	L257-Q261 PolarHBondContact O-N 3.3Å; N258-Q261 PolarHBondContact O-N 3Å; Q261-M264 PolarHBondContact O-N 3.33Å; Q261-Q265 PolarHBondContact O-N 3.34Å; Q261-Q265 VanDerWaalsContact O-N 3.09Å
262	E	48.3	Very low	60.5	Low	125 Å²	125	105.6 Å²	105.6	58%	0.584	51%	0.514	S	S	*	.	H	α-helix	trans	-63.2	-50.3	174.6	-62.1	178.5	134.1	0	0	111.2	M264 Q265 Y266	E262-M264 VanDerWaalsContact C-N 3.28Å; E262-M264 PolarHBondContact O-N 3.42Å; E262-Q265 WeakPolarHBondContact O-CA 3.41Å; E262-Q265 WeakPolarHBondContact O-CB 3.43Å; E262-Q265 PolarHBondContact O-N 3.28Å; E262-Y266 VanDerWaalsContact O-CD2 3.24Å; E262-Y266 WeakPolarHBondContact O-CD2 3.27Å; E262-Y266 PolarHBondContact O-N 3.18Å
263	D	47.9	Very low	57.8	Low	94 Å²	94	108.9 Å²	108.9	50%	0.503	54%	0.54	S	S	.	.	H	α-helix	trans	-55.2	-40.4	174.4	-85.5	-19.3	0	0	0	112.9	Q265 Y266 M267	D263-Q265 VanDerWaalsContact C-N 3.33Å; D263-Y266 PolarHBondContact O-N 3.03Å; D263-M267 WeakPolarHBondContact O-CG 3.23Å; D263-M267 PolarHBondContact O-N 3.33Å
264	M	48.4	Very low	55.1	Low	63 Å²	63	110.7 Å²	110.7	31%	0.31	55%	0.549	S	S	.	.	H	α-helix	trans	-66	-35.3	176.1	-87.8	-98.3	60.3	0	0	112.2	L260 Q261 E262 M267 A268	L260-M264 PolarHBondContact O-N 3.06Å; Q261-M264 PolarHBondContact O-N 3.33Å; E262-M264 VanDerWaalsContact C-N 3.28Å; E262-M264 PolarHBondContact O-N 3.42Å; M264-M267 HydrophobicContact CE-CB 4.49Å; M264-A268 VanDerWaalsContact O-CB 3.23Å; M264-A268 WeakPolarHBondContact O-CB 3.42Å; M264-A268 PolarHBondContact O-N 2.99Å
265	Q	48	Very low	52.5	Low	132 Å²	132	113 Å²	113	62%	0.617	56%	0.555	S	S	*	*	H	α-helix	trans	-63.3	-47.5	172.7	-130	83.8	-26.9	0	0	110.8	Q261 E262 D263 A268 L269	Q261-Q265 PolarHBondContact O-N 3.34Å; Q261-Q265 VanDerWaalsContact O-N 3.09Å; E262-Q265 WeakPolarHBondContact O-CA 3.41Å; E262-Q265 WeakPolarHBondContact O-CB 3.43Å; E262-Q265 PolarHBondContact O-N 3.28Å; D263-Q265 VanDerWaalsContact C-N 3.33Å; Q265-A268 PolarHBondContact O-N 3Å; Q265-L269 PolarHBondContact O-N 2.74Å
266	Y	40.8	Very low	49.8	Very low	181 Å²	181	121.5 Å²	121.5	71%	0.71	59%	0.594	S	S	*	*	H	α-helix	trans	-64.6	-40.3	177.4	-77	-70.7	0	0	0	113	E262 D263	E262-Y266 VanDerWaalsContact O-CD2 3.24Å; E262-Y266 WeakPolarHBondContact O-CD2 3.27Å; E262-Y266 PolarHBondContact O-N 3.18Å; D263-Y266 PolarHBondContact O-N 3.03Å
267	M	43.1	Very low	47.5	Very low	117 Å²	117	127.1 Å²	127.1	58%	0.576	61%	0.609	S	S	*	*	H	α-helix	trans	-70.6	-34.4	176.1	-72.3	-161.8	-175	0	0	113.1	D263 M264 L269 R270	D263-M267 WeakPolarHBondContact O-CG 3.23Å; D263-M267 PolarHBondContact O-N 3.33Å; M264-M267 HydrophobicContact CE-CB 4.49Å; M267-L269 VanDerWaalsContact C-N 3.29Å; M267-L269 PolarHBondContact O-N 3.49Å; M267-R270 PolarHBondContact O-N 2.98Å
268	A	48.3	Very low	44.8	Very low	67 Å²	67	135 Å²	135	55%	0.554	65%	0.646	S	S	*	*	H	α-helix	trans	-64.5	-33.8	178.1	0	0	0	0	0	112.4	M264 Q265 R270 Q271	M264-A268 VanDerWaalsContact O-CB 3.23Å; M264-A268 WeakPolarHBondContact O-CB 3.42Å; M264-A268 PolarHBondContact O-N 2.99Å; Q265-A268 PolarHBondContact O-N 3Å; A268-R270 PolarHBondContact O-N 3.23Å; A268-Q271 PolarHBondContact O-N 3.44Å
269	L	43.5	Very low	42.3	Very low	151 Å²	151	143.1 Å²	143.1	79%	0.791	67%	0.672	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65	-21.3	176.5	-162.2	68.1	0	0	0	113	Q265 M267	Q265-L269 PolarHBondContact O-N 2.74Å; M267-L269 VanDerWaalsContact C-N 3.29Å; M267-L269 PolarHBondContact O-N 3.49Å
270	R	38.6	Very low	40.1	Very low	230 Å²	230	143.1 Å²	143.1	87%	0.868	68%	0.678	S	S	*	*	T	Hydrogen-bonded Turn	trans	-98.4	-3.7	-175	-152.5	179.7	-179	-168.6	0.9	114.6	M267 A268	M267-R270 PolarHBondContact O-N 2.98Å; A268-R270 PolarHBondContact O-N 3.23Å
271	Q	35.3	Very low	38.2	Very low	152 Å²	152	149.7 Å²	149.7	71%	0.71	70%	0.704	S	S	*	*			trans	-110.4	72.4	-173.6	-68.6	-170.7	49.1	0	0	113.6	A268	A268-Q271 PolarHBondContact O-N 3.44Å
272	Q	28.2	Very low	36.7	Very low	158 Å²	158	152.7 Å²	152.7	74%	0.738	73%	0.73	S	S	*	*			trans	-88.2	146.4	150.7	-72.5	-72.2	8.1	0	0	109.3	V274	Q272-V274 PolarHBondContact O-N 2.92Å; Q272-V274 VanDerWaalsContact O-N 3.16Å
273	P	33.6	Very low	35.8	Very low	110 Å²	110	153.2 Å²	153.2	71%	0.714	74%	0.741	S	S	*	*			trans	-78	102.3	-172	30.3	-34.2	0	0	0	112.6	Q275	P273-Q275 PolarHBondContact O-N 3.28Å
274	V	28.8	Very low	35	Very low	144 Å²	144	157.7 Å²	157.7	87%	0.873	76%	0.759	S	S	*	*			trans	-79.2	109.4	170.8	-179.1	0	0	0	0	109.8	Q272	Q272-V274 PolarHBondContact O-N 2.92Å; Q272-V274 VanDerWaalsContact O-N 3.16Å
275	Q	32.7	Very low	34.1	Very low	176 Å²	176	164.6 Å²	164.6	82%	0.822	79%	0.787	S	S	*	*			trans	-90.4	131.7	174.2	-71.9	-162.7	-3.5	0	0	112.9	P273	P273-Q275 PolarHBondContact O-N 3.28Å
276	Q	32.5	Very low	33.2	Very low	188 Å²	188	167.6 Å²	167.6	88%	0.879	80%	0.798	S	S	*	*			trans	56.5	132.2	165.6	-75.3	-175.5	-14.5	0	0	120.5
277	K	34.5	Very low	32.7	Very low	207 Å²	207	165.5 Å²	165.5	90%	0.9	80%	0.799	S	S	*	*			trans	-81.5	126.5	175.8	-65.2	168	175.8	171.9	0	110.7
278	Q	28.9	Very low	32.1	Very low	177 Å²	177	164.9 Å²	164.9	83%	0.827	81%	0.807	S	S	*	*			trans	-96.9	135.2	150.1	-82.6	-69.9	1.9	0	0	109.5	F280	Q278-F280 PolarHBondContact O-N 3.35Å
279	R	29.4	Very low	31.2	Very low	232 Å²	232	164.7 Å²	164.7	88%	0.875	81%	0.811	S	S	*	*			trans	-100.6	85.8	-167.4	-175.7	-170.6	177.7	-177.5	0.7	111.7
280	F	28	Very low	30.6	Very low	194 Å²	194	163.9 Å²	163.9	85%	0.851	82%	0.818	S	S	*	*	P	Polyproline II helix	trans	-74.5	143.6	168.5	-85.8	-89.4	0	0	0	112.1	Q278	Q278-F280 PolarHBondContact O-N 3.35Å
281	K	24.6	Very low	30.2	Very low	181 Å²	181	156.7 Å²	156.7	79%	0.787	82%	0.816	S	S	*	*	P	Polyproline II helix	trans	-88.6	142.1	172.4	-64.1	176.6	-179.4	175.7	0	109.1	V283	K281-V283 PolarHBondContact O-N 2.98Å
282	P	27.5	Very low	30	Very low	128 Å²	128	156.5 Å²	156.5	83%	0.831	82%	0.819	S	S	*	*	P	Polyproline II helix	trans	-69.4	128.2	169.7	29.4	-32.8	0	0	0	109.9
283	V	28.7	Very low	30.2	Very low	136 Å²	136	155.1 Å²	155.1	82%	0.824	82%	0.817	S	S	*	*	P	Polyproline II helix	trans	-86	127.9	166.1	175.6	0	0	0	0	107.6	K281	K281-V283 PolarHBondContact O-N 2.98Å
284	Q	30.6	Very low	30	Very low	188 Å²	188	159.5 Å²	159.5	88%	0.879	82%	0.821	S	S	*	*	P	Polyproline II helix	trans	-66.6	134.5	175.5	-67.6	168	-36.2	0	0	109.8
285	K	30.6	Very low	30.1	Very low	208 Å²	208	159.7 Å²	159.7	90%	0.904	82%	0.823	S	S	*	*	P	Polyproline II helix	trans	-104	142.9	159.2	-82.2	-168.8	172	-174.3	0	109.4
286	F	28.4	Very low	30.3	Very low	194 Å²	194	157.6 Å²	157.6	85%	0.851	83%	0.827	S	S	*	*	P	Polyproline II helix	trans	-80.6	147.5	-174.6	-173.7	-97.7	0	0	0	110.8
287	D	30.7	Very low	30.1	Very low	137 Å²	137	151.7 Å²	151.7	73%	0.733	82%	0.817	S	S	*	*	P	Polyproline II helix	trans	-92.6	146	-178.7	179.3	25.6	0	0	0	111.6
288	S	30.1	Very low	30.1	Very low	105 Å²	105	145.7 Å²	145.7	73%	0.734	81%	0.814	S	S	*	*			trans	-166.5	83	171.7	-76.5	0	0	0	0	113.4
289	G	29.8	Very low	30.4	Very low	62 Å²	62	144.9 Å²	144.9	64%	0.639	81%	0.81	S	S	*	*				81.3	100.5	126.3	0	0	0	0	0	121.4
290	S	32.2	Very low	30.8	Very low	135 Å²	135	142.7 Å²	142.7	94%	0.944	81%	0.809	S	S	*	*			trans	47.3	131.5	133	-52.2	0	0	0	0	122.8
291	G	29.5	Very low	31.4	Very low	79 Å²	79	140.7 Å²	140.7	81%	0.814	80%	0.802	S	S	*	*			trans	173.1	57.5	169	0	0	0	0	0	118
292	D	31.1	Very low	32.4	Very low	147 Å²	147	134.7 Å²	134.7	79%	0.786	78%	0.782	S	S	*	*			trans	-2.6	138.3	168.8	-66.2	-8.1	0	0	0	123.7
293	N	31.8	Very low	33.5	Very low	129 Å²	129	130.2 Å²	130.2	69%	0.69	76%	0.759	S	S	*	*			trans	95	122	131.8	-81	-26.6	0	0	0	124.6
294	Y	30.7	Very low	34.7	Very low	203 Å²	203	127.6 Å²	127.6	80%	0.796	75%	0.752	S	S	*	*			trans	48.9	109.2	150.4	-65.4	-72.9	0	0	0	122.2
295	T	29.1	Very low	35.5	Very low	148 Å²	148	121.7 Å²	121.7	91%	0.908	74%	0.735	S	S	*	*				-154.7	145.4	109	0.3	0	0	0	0	111.1
296	S	37.6	Very low	36.4	Very low	132 Å²	132	117.1 Å²	117.1	92%	0.923	72%	0.717	S	S	*	*			trans	-95.3	111.5	175.8	-172.9	0	0	0	0	109.9
297	G	29.1	Very low	37.6	Very low	63 Å²	63	113.1 Å²	113.1	65%	0.649	70%	0.701	S	S	*	*			trans	-133.5	124.1	171.9	0	0	0	0	0	109.2	Q299	G297-Q299 PolarHBondContact O-N 3.4Å
298	G	33.6	Very low	39	Very low	82 Å²	82	110.5 Å²	110.5	85%	0.845	69%	0.69	S	S	*	*			trans	-72.7	83.4	-172.5	0	0	0	0	0	113.3	H300	G298-H300 PolarHBondContact O-N 3.02Å
299	Q	34.5	Very low	40.5	Very low	160 Å²	160	110.2 Å²	110.2	75%	0.748	68%	0.683	S	S	*	*			trans	-69.7	116.4	165.9	-71	-170.4	-6.1	0	0	109.8	G297 H301	G297-Q299 PolarHBondContact O-N 3.4Å; Q299-H301 PolarHBondContact O-N 3.01Å
300	H	38.6	Very low	42.1	Very low	185 Å²	185	111 Å²	111	86%	0.856	67%	0.672	S	S	*	*			trans	-64.1	100	160.9	-90.3	-102.6	0	0	0	108.5	G298 P302	G298-H300 PolarHBondContact O-N 3.02Å; H300-P302 WeakPolarHBondContact O-CD 3.42Å
301	H	40.5	Very low	43.6	Very low	152 Å²	152	107.2 Å²	107.2	70%	0.704	65%	0.649	S	S	*	*	P	Polyproline II helix	trans	-66.2	122.9	163.8	-81.7	-29.7	0	0	0	108.6	Q299 G303	Q299-H301 PolarHBondContact O-N 3.01Å; H301-G303 PolarHBondContact O-N 3.24Å
302	P	44.9	Very low	45.2	Very low	55 Å²	55	108.7 Å²	108.7	36%	0.357	64%	0.635	S	S	.	*	P	Polyproline II helix	trans	-61.8	138.3	176.2	25.5	-33.2	0	0	0	109.6	H300 E306 Q307	H300-P302 WeakPolarHBondContact O-CD 3.42Å; P302-E306 VanDerWaalsContact CA-OE2 3.24Å; P302-E306 WeakPolarHBondContact CA-OE2 3.44Å; P302-E306 HydrophobicContact CB-CB 3.99Å; P302-Q307 HydrophobicContact CG-CG 4.26Å; P302-Q307 PolarHBondContact O-NE2 3.18Å
303	G	52.2	Low	46.9	Very low	35 Å²	35	103.1 Å²	103.1	36%	0.361	61%	0.607	S	S	.	*	P	Polyproline II helix	trans	-63.1	159	-175.9	0	0	0	0	0	112.3	H301 A305 E306 Q307	H301-G303 PolarHBondContact O-N 3.24Å; G303-A305 PolarHBondContact O-N 3.42Å; G303-E306 PolarHBondContact N-OE2 2.73Å; G303-E306 WeakPolarHBondContact O-CB 3.23Å; G303-E306 PolarHBondContact O-N 2.87Å; G303-Q307 PolarHBondContact O-N 3.38Å
304	A	52.3	Low	48.7	Very low	80 Å²	80	102.8 Å²	102.8	66%	0.661	60%	0.602	S	S	*	*	H	α-helix	trans	-55.9	-27.4	-178.1	0	0	0	0	0	113.7	T308	A304-T308 PolarHBondContact O-N 3.35Å; A304-T308 PolarHBondContact O-OG1 2.84Å
305	A	48	Very low	50.7	Low	64 Å²	64	98.5 Å²	98.5	53%	0.529	59%	0.588	S	S	.	*	H	α-helix	trans	-69.3	-46.2	172.6	0	0	0	0	0	112.5	G303 Q307 T308 V309	G303-A305 PolarHBondContact O-N 3.42Å; A305-Q307 VanDerWaalsContact C-N 3.34Å; A305-Q307 PolarHBondContact O-N 3.41Å; A305-T308 WeakPolarHBondContact CA-OG1 3.49Å; A305-T308 PolarHBondContact O-N 3.49Å; A305-T308 VanDerWaalsContact O-N 3.16Å; A305-T308 PolarHBondContact O-OG1 2.94Å; A305-V309 PolarHBondContact O-N 3.27Å
306	E	49.3	Very low	53	Low	113 Å²	113	92.7 Å²	92.7	53%	0.528	55%	0.551	S	S	.	*	H	α-helix	trans	-63.9	-40.8	177.3	-62.4	172.7	132.6	0	0	110.7	P302 G303 T308 V309 I310	P302-E306 VanDerWaalsContact CA-OE2 3.24Å; P302-E306 WeakPolarHBondContact CA-OE2 3.44Å; P302-E306 HydrophobicContact CB-CB 3.99Å; G303-E306 PolarHBondContact N-OE2 2.73Å; G303-E306 WeakPolarHBondContact O-CB 3.23Å; G303-E306 PolarHBondContact O-N 2.87Å; E306-T308 VanDerWaalsContact C-N 3.31Å; E306-T308 PolarHBondContact O-N 3.02Å; E306-V309 PolarHBondContact O-N 3.06Å; E306-I310 VanDerWaalsContact O-CG1 3.32Å; E306-I310 WeakPolarHBondContact O-CG1 3.43Å; E306-I310 PolarHBondContact O-N 3.39Å
307	Q	53.3	Low	54.9	Low	110 Å²	110	89.4 Å²	89.4	51%	0.514	52%	0.521	S	S	.	.	H	α-helix	trans	-59.1	-39	172.9	-64.8	-179.6	20.8	0	0	112.4	P302 G303 A305 A311	P302-Q307 HydrophobicContact CG-CG 4.26Å; P302-Q307 PolarHBondContact O-NE2 3.18Å; G303-Q307 PolarHBondContact O-N 3.38Å; A305-Q307 VanDerWaalsContact C-N 3.34Å; A305-Q307 PolarHBondContact O-N 3.41Å; Q307-A311 WeakPolarHBondContact O-CB 3.46Å; Q307-A311 PolarHBondContact O-N 2.96Å
308	T	61.8	Low	57.3	Low	82 Å²	82	91.5 Å²	91.5	50%	0.503	51%	0.514	S	S	.	.	H	α-helix	trans	-69.4	-31.4	172.2	37.9	0	0	0	0	114.1	A304 A305 E306 Q312	A304-T308 PolarHBondContact O-N 3.35Å; A304-T308 PolarHBondContact O-OG1 2.84Å; A305-T308 WeakPolarHBondContact CA-OG1 3.49Å; A305-T308 PolarHBondContact O-N 3.49Å; A305-T308 VanDerWaalsContact O-N 3.16Å; A305-T308 PolarHBondContact O-OG1 2.94Å; E306-T308 VanDerWaalsContact C-N 3.31Å; E306-T308 PolarHBondContact O-N 3.02Å; T308-Q312 WeakPolarHBondContact O-CB 3.47Å; T308-Q312 WeakPolarHBondContact O-CG 3.49Å; T308-Q312 PolarHBondContact O-N 2.99Å
309	V	60.9	Low	59.4	Low	98 Å²	98	89.9 Å²	89.9	59%	0.594	48%	0.484	S	S	*	.	H	α-helix	trans	-70	-43.4	174.9	174	0	0	0	0	110.6	A305 E306 Q312 S313	A305-V309 PolarHBondContact O-N 3.27Å; E306-V309 PolarHBondContact O-N 3.06Å; V309-Q312 PolarHBondContact O-N 3.17Å; V309-S313 PolarHBondContact O-N 3.31Å
310	I	63.7	Low	61.6	Low	79 Å²	79	83.1 Å²	83.1	41%	0.405	45%	0.453	S	S	.	.	H	α-helix	trans	-63.5	-42.8	175.9	-65.5	162.3	0	0	0	111	E306 Q312 S313 Q314	E306-I310 VanDerWaalsContact O-CG1 3.32Å; E306-I310 WeakPolarHBondContact O-CG1 3.43Å; E306-I310 PolarHBondContact O-N 3.39Å; I310-Q312 VanDerWaalsContact C-N 3.28Å; I310-Q312 PolarHBondContact O-N 3.5Å; I310-S313 PolarHBondContact O-N 2.93Å; I310-S313 PolarHBondContact O-OG 2.88Å; I310-Q314 WeakPolarHBondContact O-CB 3.48Å; I310-Q314 WeakPolarHBondContact O-CG 3.36Å; I310-Q314 PolarHBondContact O-N 2.87Å
311	A	62.2	Low	63.3	Low	55 Å²	55	75.4 Å²	75.4	46%	0.455	42%	0.421	S	S	.	.	H	α-helix	trans	-64.2	-32.6	174.6	0	0	0	0	0	112.5	Q307 H315	Q307-A311 WeakPolarHBondContact O-CB 3.46Å; Q307-A311 PolarHBondContact O-N 2.96Å; A311-H315 WeakPolarHBondContact O-CB 3.45Å; A311-H315 PolarHBondContact O-N 3.29Å; A311-H315 VanDerWaalsContact O-N 3.16Å
312	Q	64.3	Low	64.7	Low	111 Å²	111	73.4 Å²	73.4	52%	0.519	42%	0.415	S	S	.	.	H	α-helix	trans	-73.9	-39.8	173.9	-77.3	-178.5	14	0	0	112.7	T308 V309 I310 H315 H316	T308-Q312 WeakPolarHBondContact O-CB 3.47Å; T308-Q312 WeakPolarHBondContact O-CG 3.49Å; T308-Q312 PolarHBondContact O-N 2.99Å; V309-Q312 PolarHBondContact O-N 3.17Å; I310-Q312 VanDerWaalsContact C-N 3.28Å; I310-Q312 PolarHBondContact O-N 3.5Å; Q312-H315 PolarHBondContact O-N 3.27Å; Q312-H316 VanDerWaalsContact O-CG 3.29Å; Q312-H316 PolarHBondContact O-N 3.41Å; Q312-H316 PolarHBondContact O-ND1 3.08Å
313	S	66.3	Low	65.3	Low	30 Å²	30	74 Å²	74	21%	0.21	43%	0.426	C	S	.	.	H	α-helix	trans	-65.1	-42.4	175.9	61.9	0	0	0	0	111.4	V309 I310 H315 H316 Q317	V309-S313 PolarHBondContact O-N 3.31Å; I310-S313 PolarHBondContact O-N 2.93Å; I310-S313 PolarHBondContact O-OG 2.88Å; S313-H315 VanDerWaalsContact C-N 3.32Å; S313-H315 PolarHBondContact O-N 3.26Å; S313-H316 CarbonylContact O-C 3.29Å; S313-H316 WeakPolarHBondContact O-CA 3.23Å; S313-H316 PolarHBondContact O-N 2.97Å; S313-Q317 WeakPolarHBondContact O-CG 3.44Å; S313-Q317 PolarHBondContact O-N 2.93Å
314	Q	70.1	Confident	65.7	Low	122 Å²	122	77 Å²	77	57%	0.57	44%	0.44	S	S	*	.	H	α-helix	trans	-57.4	-41.9	172	-72.4	175.3	-11.2	0	0	112.5	I310 H316 Q317	I310-Q314 WeakPolarHBondContact O-CB 3.48Å; I310-Q314 WeakPolarHBondContact O-CG 3.36Å; I310-Q314 PolarHBondContact O-N 2.87Å; Q314-H316 VanDerWaalsContact C-N 3.26Å; Q314-H316 PolarHBondContact O-N 3.35Å; Q314-Q317 PolarHBondContact O-N 2.86Å
315	H	73.1	Confident	66.4	Low	112 Å²	112	79 Å²	79	52%	0.519	43%	0.431	S	S	.	.	H	α-helix	trans	-71.6	-16.7	174.9	-170.7	-83.6	0	0	0	113.6	A311 Q312 S313 Q318	A311-H315 WeakPolarHBondContact O-CB 3.45Å; A311-H315 PolarHBondContact O-N 3.29Å; A311-H315 VanDerWaalsContact O-N 3.16Å; Q312-H315 PolarHBondContact O-N 3.27Å; S313-H315 VanDerWaalsContact C-N 3.32Å; S313-H315 PolarHBondContact O-N 3.26Å; H315-Q318 PolarHBondContact CD2-NE2 2.84Å; H315-Q318 VanDerWaalsContact CD2-NE2 3.25Å; H315-Q318 PolarHBondContact CE1-NE2 3.35Å; H315-Q318 VanDerWaalsContact CE1-NE2 3.31Å; H315-Q318 PolarHBondContact NE2-NE2 3.49Å; H315-Q318 VanDerWaalsContact NE2-NE2 3.16Å; H315-Q318 WeakPolarHBondContact O-CG 3.36Å; H315-Q318 PolarHBondContact O-NE2 3.47Å
316	H	77.5	Confident	67.7	Low	26 Å²	26	79.5 Å²	79.5	12%	0.12	44%	0.435	C	S	.	.	H	α-helix	trans	-88.9	-29	173.2	-69.5	136.5	0	0	0	113	Q312 S313 Q314 Q318 F319 L369 L453	Q312-H316 VanDerWaalsContact O-CG 3.29Å; Q312-H316 PolarHBondContact O-N 3.41Å; Q312-H316 PolarHBondContact O-ND1 3.08Å; S313-H316 CarbonylContact O-C 3.29Å; S313-H316 WeakPolarHBondContact O-CA 3.23Å; S313-H316 PolarHBondContact O-N 2.97Å; Q314-H316 VanDerWaalsContact C-N 3.26Å; Q314-H316 PolarHBondContact O-N 3.35Å; H316-Q318 VanDerWaalsContact C-N 3.28Å; H316-Q318 PolarHBondContact O-N 3.03Å; H316-F319 WeakPolarHBondContact O-CB 3.48Å; H316-F319 PolarHBondContact O-N 3.14Å; H316-L369 HydrophobicContact CB-CD1 3.57Å; H316-L453 HydrophobicContact CB-CD1 4.33Å; H316-L453 HydrophobicContact CB-CD2 4.21Å
317	Q	76.8	Confident	69.3	Low	64 Å²	64	74.5 Å²	74.5	30%	0.299	41%	0.412	S	S	.	.	H	α-helix	trans	-58.2	-34.5	180	-77.8	169	-22.3	0	0	113.6	S313 Q314 F319 L320 V367	S313-Q317 WeakPolarHBondContact O-CG 3.44Å; S313-Q317 PolarHBondContact O-N 2.93Å; Q314-Q317 PolarHBondContact O-N 2.86Å; Q317-F319 PolarHBondContact O-N 2.78Å; Q317-L320 HydrophobicContact CG-CD1 4.23Å; Q317-L320 WeakPolarHBondContact O-CB 3.25Å; Q317-L320 PolarHBondContact O-N 2.72Å; Q317-V367 PolarHBondContact NE2-O 3.16Å
318	Q	79.8	Confident	70.8	Confident	107 Å²	107	72.1 Å²	72.1	50%	0.5	41%	0.406	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.2	-4.9	173.8	56.6	168.4	-8.1	0	0	115.7	H315 H316 R447	H315-Q318 PolarHBondContact CD2-NE2 2.84Å; H315-Q318 VanDerWaalsContact CD2-NE2 3.25Å; H315-Q318 PolarHBondContact CE1-NE2 3.35Å; H315-Q318 VanDerWaalsContact CE1-NE2 3.31Å; H315-Q318 PolarHBondContact NE2-NE2 3.49Å; H315-Q318 VanDerWaalsContact NE2-NE2 3.16Å; H315-Q318 WeakPolarHBondContact O-CG 3.36Å; H315-Q318 PolarHBondContact O-NE2 3.47Å; H316-Q318 VanDerWaalsContact C-N 3.28Å; H316-Q318 PolarHBondContact O-N 3.03Å; Q318-R447 PolarHBondContact O-NH2 2.82Å
319	F	77.2	Confident	71.9	Confident	48 Å²	48	74.6 Å²	74.6	21%	0.211	42%	0.416	C	S	.	.	T	Hydrogen-bonded Turn	trans	-102.2	-8.3	172.7	-67.3	-89.7	0	0	0	113.4	H316 Q317 P450 L453	H316-F319 WeakPolarHBondContact O-CB 3.48Å; H316-F319 PolarHBondContact O-N 3.14Å; Q317-F319 PolarHBondContact O-N 2.78Å; F319-P450 HydrophobicContact CD1-CG 4.11Å; F319-P450 HydrophobicContact CD2-CG 3.7Å; F319-P450 HydrophobicContact CE1-CG 3.89Å; F319-P450 HydrophobicContact CE2-CG 3.48Å; F319-P450 VanDerWaalsContact CE2-CG 3.48Å; F319-P450 HydrophobicContact CG-CG 4.02Å; F319-P450 HydrophobicContact CZ-CG 3.58Å; F319-L453 HydrophobicContact CB-CD2 4.03Å
320	L	81.2	Confident	73.2	Confident	17 Å²	17	71.3 Å²	71.3	9%	0.089	39%	0.394	C	S	.	.	S	Bend	trans	-79.8	172	175.9	-54.1	179.9	0	0	0	110.9	Q317 L369 I440 L441 L453	Q317-L320 HydrophobicContact CG-CD1 4.23Å; Q317-L320 WeakPolarHBondContact O-CB 3.25Å; Q317-L320 PolarHBondContact O-N 2.72Å; L320-L369 HydrophobicContact CD1-CD2 4.24Å; L320-L369 HydrophobicContact CD1-CG 4.37Å; L320-L369 HydrophobicContact CD2-CD2 4.33Å; L320-I440 VanDerWaalsContact CA-O 3.26Å; L320-I440 WeakPolarHBondContact CA-O 3.48Å; L320-I440 HydrophobicContact CB-CG2 4.44Å; L320-I440 WeakPolarHBondContact CB-O 3.39Å; L320-I440 WeakPolarHBondContact CD2-O 3.46Å; L320-L441 HydrophobicContact CD2-CD2 4.1Å; L320-L453 HydrophobicContact CD2-CD2 4.48Å
321	A	74.9	Confident	74.3	Confident	24 Å²	24	73 Å²	73	20%	0.198	40%	0.403	C	S	.	.	S	Bend	trans	-66.5	176.9	162.8	0	0	0	0	0	111.6	A323 I440 P443	A321-A323 PolarHBondContact O-N 3.26Å; A321-A323 VanDerWaalsContact O-N 3.14Å; A321-I440 HydrophobicContact CB-CG1 4.2Å; A321-I440 PolarHBondContact N-O 3.34Å; A321-I440 VanDerWaalsContact N-O 3.08Å; A321-P443 HydrophobicContact CB-CB 4.17Å
322	D	69.2	Low	75.4	Confident	109 Å²	109	78.5 Å²	78.5	58%	0.583	42%	0.419	S	S	*	.			trans	-56.5	118.5	174.3	-166.4	-37.4	0	0	0	111.1	S324 R325	D322-S324 VanDerWaalsContact CG-OG 3.23Å; D322-S324 PolarHBondContact O-N 3.33Å; D322-S324 VanDerWaalsContact O-N 3.15Å; D322-S324 WeakPolarHBondContact OD1-CB 3.46Å; D322-S324 PolarHBondContact OD1-N 3.02Å; D322-S324 PolarHBondContact OD1-OG 3.27Å; D322-R325 VanDerWaalsContact O-CB 3.27Å; D322-R325 WeakPolarHBondContact O-CB 3.36Å; D322-R325 PolarHBondContact O-N 3.11Å; D322-R325 VanDerWaalsContact O-N 3.16Å
323	A	58.3	Low	76.4	Confident	69 Å²	69	73.9 Å²	73.9	57%	0.57	40%	0.398	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.8	-11.8	-178	0	0	0	0	0	113.8	A321 R325 V367	A321-A323 PolarHBondContact O-N 3.26Å; A321-A323 VanDerWaalsContact O-N 3.14Å; A323-R325 VanDerWaalsContact C-N 3.3Å; A323-V367 HydrophobicContact CB-CG1 3.65Å
324	S	59.2	Low	77	Confident	96 Å²	96	78.6 Å²	78.6	67%	0.671	42%	0.421	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.4	-2.4	174.6	67.2	0	0	0	0	114.2	D322 A326	D322-S324 VanDerWaalsContact CG-OG 3.23Å; D322-S324 PolarHBondContact O-N 3.33Å; D322-S324 VanDerWaalsContact O-N 3.15Å; D322-S324 WeakPolarHBondContact OD1-CB 3.46Å; D322-S324 PolarHBondContact OD1-N 3.02Å; D322-S324 PolarHBondContact OD1-OG 3.27Å; S324-A326 PolarHBondContact O-N 2.86Å
325	R	66.9	Low	77.3	Confident	123 Å²	123	74.2 Å²	74.2	46%	0.464	40%	0.401	S	S	.	.			trans	-73.2	93.7	-175	-162.4	173.5	-173.6	-151.9	-4.1	111.8	D322 A323 E439	D322-R325 VanDerWaalsContact O-CB 3.27Å; D322-R325 WeakPolarHBondContact O-CB 3.36Å; D322-R325 PolarHBondContact O-N 3.11Å; D322-R325 VanDerWaalsContact O-N 3.16Å; A323-R325 VanDerWaalsContact C-N 3.3Å; R325-E439 IonicContact CZ-OE2 3.53Å; R325-E439 IonicContact NH1-OE2 2.99Å; R325-E439 PolarHBondContact NH1-OE2 3.2Å; R325-E439 IonicContact NH2-OE2 3.49Å; R325-E439 PolarHBondContact NH2-OE2 3.16Å
326	A	74.9	Confident	77	Confident	75 Å²	75	71.1 Å²	71.1	62%	0.62	40%	0.399	S	S	*	.	P	Polyproline II helix	trans	-59	159	174.9	0	0	0	0	0	113	S324	S324-A326 PolarHBondContact O-N 2.86Å
327	L	83.9	Confident	76.1	Confident	8 Å²	8	79.6 Å²	79.6	4%	0.042	44%	0.439	C	S	.	.	P	Polyproline II helix	trans	-63	141	172.1	-67.7	-177.7	0	0	0	111.3	F330 C359 E360 L363 M433 A436	L327-F330 HydrophobicContact CD1-CZ 4.17Å; L327-C359 HydrophobicContact CD1-CB 3.46Å; L327-C359 VanDerWaalsContact CD1-CB 3.46Å; L327-E360 HydrophobicContact CD1-CG 4.2Å; L327-L363 HydrophobicContact CD2-CB 4.33Å; L327-L363 HydrophobicContact CD2-CD2 3.95Å; L327-L363 HydrophobicContact CG-CB 4.46Å; L327-L363 HydrophobicContact CG-CD2 3.82Å; L327-M433 HydrophobicContact CD2-CB 4.48Å; L327-M433 HydrophobicContact CD2-CG 4.33Å; L327-A436 HydrophobicContact CD2-CB 4.17Å
328	P	84.1	Confident	75	Confident	59 Å²	59	79.2 Å²	79.2	38%	0.383	44%	0.443	S	S	.	.	P	Polyproline II helix	trans	-53.6	150	168.1	-23.1	33.3	0	0	0	111.7	F330	P328-F330 WeakPolarHBondContact O-CD1 3.24Å; P328-F330 PolarHBondContact O-N 2.98Å
329	D	84.8	Confident	73.6	Confident	134 Å²	134	79.4 Å²	79.4	72%	0.717	46%	0.456	S	S	*	.	P	Polyproline II helix	trans	-63.6	129.3	175.1	-76.2	-53.1	0	0	0	111.6	R356	D329-R356 IonicContact OD1-CZ 3.98Å; D329-R356 IonicContact OD1-NH2 2.93Å; D329-R356 PolarHBondContact OD1-NH2 3.08Å
330	F	89.3	Confident	72.7	Confident	29 Å²	29	79.9 Å²	79.9	13%	0.127	46%	0.46	C	S	.	.	P	Polyproline II helix	trans	-76.1	140	175.3	-65	-8	0	0	0	109.5	L327 P328 Y355 R356 C359 C429 L432	L327-F330 HydrophobicContact CD1-CZ 4.17Å; P328-F330 WeakPolarHBondContact O-CD1 3.24Å; P328-F330 PolarHBondContact O-N 2.98Å; F330-Y355 HydrophobicContact CE2-CD1 4.21Å; F330-Y355 HydrophobicContact CE2-CE1 4.2Å; F330-R356 HydrophobicContact CD2-CB 4.46Å; F330-R356 HydrophobicContact CD2-CG 4.43Å; F330-R356 HydrophobicContact CE2-CB 4.45Å; F330-R356 HydrophobicContact CE2-CG 4.42Å; F330-C359 HydrophobicContact CE2-CB 4.17Å; F330-C359 HydrophobicContact CZ-CB 3.84Å; F330-C429 HydrophobicContact CD1-CB 4.26Å; F330-C429 HydrophobicContact CD2-CB 3.99Å; F330-C429 HydrophobicContact CE1-CB 4.22Å; F330-C429 HydrophobicContact CE2-CB 3.95Å; F330-C429 HydrophobicContact CG-CB 4.15Å; F330-C429 VanDerWaalsContact CG-SG 3.59Å; F330-C429 HydrophobicContact CZ-CB 4.07Å; F330-L432 HydrophobicContact CD1-CD1 4.39Å
331	I	85.8	Confident	71.6	Confident	116 Å²	116	87.8 Å²	87.8	60%	0.595	50%	0.496	S	S	*	.	P	Polyproline II helix	trans	-61.4	140.2	173.6	-55.4	173.5	0	0	0	108.5	W425 T428	I331-W425 PolarHBondContact O-NE1 3.19Å; I331-T428 HydrophobicContact CD1-CG2 4.29Å
332	E	85.7	Confident	71.2	Confident	169 Å²	169	92.8 Å²	92.8	79%	0.79	52%	0.52	S	S	*	.	P	Polyproline II helix	trans	-63.6	139.3	175.4	-68.2	-164.1	142.7	0	0	111.6	D334	E332-D334 PolarHBondContact O-N 3.24Å
333	L	85.7	Confident	71.8	Confident	15 Å²	15	89 Å²	89	8%	0.079	50%	0.5	C	S	.	.			trans	-81.5	99.5	176.6	173.4	57.6	0	0	0	110.4	L335 V348 L351 Q352 A421 V422 W425	L333-L335 HydrophobicContact CD1-CD2 3.77Å; L333-L335 HydrophobicContact CD2-CD2 4.44Å; L333-L335 HydrophobicContact CG-CD2 4.07Å; L333-V348 HydrophobicContact CB-CG1 4.32Å; L333-V348 HydrophobicContact CD2-CG1 3.73Å; L333-V348 HydrophobicContact CG-CG1 3.85Å; L333-L351 HydrophobicContact CD2-CD2 4.24Å; L333-Q352 HydrophobicContact CB-CG 3.93Å; L333-Q352 HydrophobicContact CD2-CG 4.49Å; L333-A421 HydrophobicContact CD1-CB 4.47Å; L333-V422 HydrophobicContact CD1-CG2 4.34Å; L333-V422 HydrophobicContact CD2-CG2 4.11Å; L333-W425 HydrophobicContact CB-CD2 3.99Å; L333-W425 HydrophobicContact CB-CG 4Å; L333-W425 HydrophobicContact CD1-CB 3.79Å; L333-W425 HydrophobicContact CD1-CD2 4.3Å; L333-W425 HydrophobicContact CD1-CG 3.9Å; L333-W425 HydrophobicContact CD2-CD2 4.14Å; L333-W425 HydrophobicContact CD2-CE3 3.95Å; L333-W425 HydrophobicContact CD2-CZ3 4.32Å; L333-W425 HydrophobicContact CG-CD2 4.37Å; L333-W425 HydrophobicContact CG-CG 4.37Å
334	D	79.1	Confident	73	Confident	128 Å²	128	87.9 Å²	87.9	68%	0.684	49%	0.487	S	S	*	.			trans	-88.7	132.6	162.5	-172.4	14.5	0	0	0	110.5	E332 G336	E332-D334 PolarHBondContact O-N 3.24Å; D334-G336 PolarHBondContact OD1-N 3.09Å
335	L	76.5	Confident	74.2	Confident	30 Å²	30	88 Å²	88	16%	0.157	49%	0.486	C	S	.	.			trans	-97.6	-4.6	173.5	-60.3	-177.3	0	0	0	112.3	L333 S338 M340 V348 L416 A421 V422	L333-L335 HydrophobicContact CD1-CD2 3.77Å; L333-L335 HydrophobicContact CD2-CD2 4.44Å; L333-L335 HydrophobicContact CG-CD2 4.07Å; L335-S338 WeakPolarHBondContact O-CB 3.41Å; L335-S338 PolarHBondContact O-OG 3.24Å; L335-M340 HydrophobicContact CD1-CE 3.71Å; L335-V348 HydrophobicContact CD1-CG1 4.34Å; L335-V348 HydrophobicContact CD1-CG2 3.51Å; L335-V348 HydrophobicContact CG-CG1 4.39Å; L335-V348 HydrophobicContact CG-CG2 4.37Å; L335-L416 HydrophobicContact CD1-CD2 4.41Å; L335-A421 HydrophobicContact CD2-CB 4.14Å; L335-V422 HydrophobicContact CD2-CG2 3.69Å
336	G	66.9	Low	75.2	Confident	47 Å²	47	89.4 Å²	89.4	49%	0.485	50%	0.498	S	S	.	.	T	Hydrogen-bonded Turn	trans	59.2	-157.7	-173.5	0	0	0	0	0	112.7	D334 S338	D334-G336 PolarHBondContact OD1-N 3.09Å; G336-S338 PolarHBondContact O-N 3.33Å
337	Q	57.1	Low	75.9	Confident	205 Å²	205	86.7 Å²	86.7	96%	0.958	47%	0.473	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.5	27.2	177.5	-61.3	-177.8	-0.3	0	0	113.2	S339	Q337-S339 PolarHBondContact O-N 3.2Å
338	S	54.4	Low	76.2	Confident	55 Å²	55	87 Å²	87	39%	0.385	48%	0.475	S	S	.	.			trans	-76.1	89.7	178.5	64.4	0	0	0	0	111	L335 G336 M340	L335-S338 WeakPolarHBondContact O-CB 3.41Å; L335-S338 PolarHBondContact O-OG 3.24Å; G336-S338 PolarHBondContact O-N 3.33Å; S338-M340 PolarHBondContact O-N 3.48Å
339	S	49.6	Very low	76.6	Confident	111 Å²	111	91.2 Å²	91.2	78%	0.776	49%	0.487	S	S	*	.			trans	-62.1	93	-177.8	179.7	0	0	0	0	112.6	Q337	Q337-S339 PolarHBondContact O-N 3.2Å
340	M	58.3	Low	77	Confident	59 Å²	59	85.7 Å²	85.7	29%	0.291	46%	0.46	S	S	.	.			trans	-97.9	107.7	169.9	-67.4	-174.5	-69.1	0	0	109.2	L335 S338 N342 I343 N419	L335-M340 HydrophobicContact CD1-CE 3.71Å; S338-M340 PolarHBondContact O-N 3.48Å; M340-N342 PolarHBondContact O-N 2.89Å; M340-I343 HydrophobicContact CB-CB 4.31Å; M340-I343 HydrophobicContact CB-CD1 4.23Å; M340-I343 HydrophobicContact CB-CG1 4.35Å; M340-I343 HydrophobicContact CE-CD1 3.75Å; M340-I343 PolarHBondContact O-N 2.94Å; M340-I343 HydrophobicContact SD-CD1 3.77Å; M340-N419 HydrophobicContact CE-CB 4.36Å; M340-N419 VanDerWaalsContact CE-ND2 3.26Å; M340-N419 WeakPolarHBondContact CE-ND2 3.35Å; M340-N419 HydrophobicContact SD-CB 4.27Å
341	E	58.4	Low	77.2	Confident	182 Å²	182	84.4 Å²	84.4	85%	0.85	45%	0.454	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.6	-1.9	-168.4	-61	-177.9	126.8	0	0	116.3
342	N	67.7	Low	77.6	Confident	130 Å²	130	80.7 Å²	80.7	70%	0.695	44%	0.435	S	S	*	.	T	Hydrogen-bonded Turn	trans	-134.7	2.9	-175.6	-68.3	-88.8	0	0	0	114.6	M340 Q412	M340-N342 PolarHBondContact O-N 2.89Å; N342-Q412 PolarHBondContact O-NE2 2.58Å; N342-Q412 PolarHBondContact O-OE1 3.07Å
343	I	80.3	Confident	78	Confident	30 Å²	30	75.2 Å²	75.2	15%	0.154	42%	0.415	C	S	.	.			trans	-111	123.1	-176.6	-62.4	179.3	0	0	0	109.9	M340 D347 V348 A415 L416	M340-I343 HydrophobicContact CB-CB 4.31Å; M340-I343 HydrophobicContact CB-CD1 4.23Å; M340-I343 HydrophobicContact CB-CG1 4.35Å; M340-I343 HydrophobicContact CE-CD1 3.75Å; M340-I343 PolarHBondContact O-N 2.94Å; M340-I343 HydrophobicContact SD-CD1 3.77Å; I343-D347 HydrophobicContact CG2-CB 4.15Å; I343-V348 HydrophobicContact CG2-CG2 4.21Å; I343-A415 HydrophobicContact CD1-CB 3.81Å; I343-A415 HydrophobicContact CG1-CB 4.37Å; I343-L416 HydrophobicContact CD1-CD2 4.05Å; I343-L416 HydrophobicContact CD1-CG 4.09Å; I343-L416 HydrophobicContact CG2-CD2 3.85Å; I343-L416 HydrophobicContact CG2-CG 4.41Å
344	S	84.2	Confident	78.4	Confident	44 Å²	44	74.9 Å²	74.9	31%	0.308	41%	0.413	S	S	.	.			trans	-86.7	157.4	177.4	75.3	0	0	0	0	111.7	E346 D347 V348	S344-E346 PolarHBondContact O-N 3.46Å; S344-E346 PolarHBondContact OG-N 2.78Å; S344-D347 VanDerWaalsContact CB-OD2 3.29Å; S344-D347 WeakPolarHBondContact CB-OD2 3.45Å; S344-D347 PolarHBondContact N-OD2 2.93Å; S344-D347 WeakPolarHBondContact O-CB 3.4Å; S344-D347 PolarHBondContact O-N 3.48Å; S344-D347 VanDerWaalsContact OG-CG 3.31Å; S344-D347 PolarHBondContact OG-N 3.37Å; S344-D347 PolarHBondContact OG-OD2 2.88Å; S344-V348 PolarHBondContact O-N 2.96Å
345	P	84.8	Confident	79.2	Confident	100 Å²	100	68.9 Å²	68.9	65%	0.649	38%	0.381	S	S	*	.	H	α-helix	trans	-64.6	-14.3	169.3	28.7	-36.1	0	0	0	113	K349	P345-K349 WeakPolarHBondContact O-CG 3.43Å; P345-K349 PolarHBondContact O-N 3.05Å
346	E	87.8	Confident	80.1	Confident	151 Å²	151	70.5 Å²	70.5	71%	0.706	39%	0.385	S	S	*	.	H	α-helix	trans	-77.3	-39.8	174.2	-60.6	-175.7	172.4	0	0	110.9	S344 V348 K349 A350	S344-E346 PolarHBondContact O-N 3.46Å; S344-E346 PolarHBondContact OG-N 2.78Å; E346-V348 VanDerWaalsContact C-N 3.26Å; E346-V348 PolarHBondContact O-N 3.21Å; E346-K349 PolarHBondContact O-N 3.48Å; E346-K349 VanDerWaalsContact O-N 3.16Å; E346-A350 WeakPolarHBondContact O-CB 3.35Å; E346-A350 PolarHBondContact O-N 2.94Å
347	D	89.9	Confident	81.4	Confident	18 Å²	18	71.6 Å²	71.6	10%	0.096	38%	0.377	C	S	.	.	H	α-helix	trans	-57.3	-39.8	171.9	-63.9	-75.4	0	0	0	111.5	I343 S344 A350 L351 L408 Q412 L416	I343-D347 HydrophobicContact CG2-CB 4.15Å; S344-D347 VanDerWaalsContact CB-OD2 3.29Å; S344-D347 WeakPolarHBondContact CB-OD2 3.45Å; S344-D347 PolarHBondContact N-OD2 2.93Å; S344-D347 WeakPolarHBondContact O-CB 3.4Å; S344-D347 PolarHBondContact O-N 3.48Å; S344-D347 VanDerWaalsContact OG-CG 3.31Å; S344-D347 PolarHBondContact OG-N 3.37Å; S344-D347 PolarHBondContact OG-OD2 2.88Å; D347-A350 PolarHBondContact O-N 3.26Å; D347-L351 WeakPolarHBondContact O-CB 3.31Å; D347-L351 PolarHBondContact O-N 3.42Å; D347-L408 HydrophobicContact CB-CD1 3.89Å; D347-Q412 WeakPolarHBondContact OD1-CG 3.43Å; D347-Q412 PolarHBondContact OD2-NE2 3.2Å; D347-L416 HydrophobicContact CB-CD1 4.36Å
348	V	90.6	Very high	83.2	Confident	14 Å²	14	62.6 Å²	62.6	9%	0.085	34%	0.336	C	S	.	.	H	α-helix	trans	-67.9	-37.2	179	-171.2	0	0	0	0	111.6	L333 L335 I343 S344 E346 Q352 L416	L333-V348 HydrophobicContact CB-CG1 4.32Å; L333-V348 HydrophobicContact CD2-CG1 3.73Å; L333-V348 HydrophobicContact CG-CG1 3.85Å; L335-V348 HydrophobicContact CD1-CG1 4.34Å; L335-V348 HydrophobicContact CD1-CG2 3.51Å; L335-V348 HydrophobicContact CG-CG1 4.39Å; L335-V348 HydrophobicContact CG-CG2 4.37Å; I343-V348 HydrophobicContact CG2-CG2 4.21Å; S344-V348 PolarHBondContact O-N 2.96Å; E346-V348 VanDerWaalsContact C-N 3.26Å; E346-V348 PolarHBondContact O-N 3.21Å; V348-Q352 WeakPolarHBondContact O-CG 3.49Å; V348-Q352 PolarHBondContact O-N 3.06Å; V348-Q352 PolarHBondContact O-NE2 2.67Å; V348-L416 HydrophobicContact CG2-CD2 4.33Å
349	K	91.3	Very high	85.2	Confident	149 Å²	149	60 Å²	60	65%	0.648	32%	0.317	S	S	*	.	H	α-helix	trans	-74.5	-38.8	175.1	-73.2	177.8	177	-176.5	0	112	P345 E346 L351 Q352 S353	P345-K349 WeakPolarHBondContact O-CG 3.43Å; P345-K349 PolarHBondContact O-N 3.05Å; E346-K349 PolarHBondContact O-N 3.48Å; E346-K349 VanDerWaalsContact O-N 3.16Å; K349-L351 VanDerWaalsContact C-N 3.35Å; K349-Q352 PolarHBondContact O-N 2.87Å; K349-S353 PolarHBondContact O-N 3.08Å
350	A	93.1	Very high	87.3	Confident	18 Å²	18	58.5 Å²	58.5	15%	0.149	30%	0.298	C	S	.	.	H	α-helix	trans	-60.3	-44.9	173.4	0	0	0	0	0	111	E346 D347 S353 L354 R407 L408	E346-A350 WeakPolarHBondContact O-CB 3.35Å; E346-A350 PolarHBondContact O-N 2.94Å; D347-A350 PolarHBondContact O-N 3.26Å; A350-S353 PolarHBondContact O-N 2.81Å; A350-L354 VanDerWaalsContact O-CB 3.25Å; A350-L354 WeakPolarHBondContact O-CB 3.33Å; A350-L354 WeakPolarHBondContact O-CD1 3.35Å; A350-L354 WeakPolarHBondContact O-CG 3.5Å; A350-L354 PolarHBondContact O-N 2.88Å; A350-R407 VanDerWaalsContact CB-O 3.27Å; A350-R407 WeakPolarHBondContact CB-O 3.44Å; A350-L408 HydrophobicContact CB-CB 4.31Å
351	L	94.6	Very high	89	Confident	1 Å²	1	57.4 Å²	57.4	1%	0.005	30%	0.298	C	S	.	.	H	α-helix	trans	-58.5	-48.3	174.3	-178.9	64.5	0	0	0	112	L333 D347 K349 S353 Y355 L408 L413 L416 V422 W425 M426	L333-L351 HydrophobicContact CD2-CD2 4.24Å; D347-L351 WeakPolarHBondContact O-CB 3.31Å; D347-L351 PolarHBondContact O-N 3.42Å; K349-L351 VanDerWaalsContact C-N 3.35Å; L351-S353 PolarHBondContact O-N 3.32Å; L351-Y355 WeakPolarHBondContact O-CB 3.5Å; L351-Y355 PolarHBondContact O-N 3.01Å; L351-L408 HydrophobicContact CB-CD2 4.06Å; L351-L408 HydrophobicContact CD1-CD2 3.94Å; L351-L413 HydrophobicContact CD1-CD1 3.75Å; L351-L416 HydrophobicContact CB-CD1 4.2Å; L351-L416 HydrophobicContact CD2-CB 4.19Å; L351-L416 HydrophobicContact CD2-CD1 3.95Å; L351-L416 HydrophobicContact CD2-CG 4.46Å; L351-V422 HydrophobicContact CD2-CG1 3.86Å; L351-W425 HydrophobicContact CD2-CZ3 4.27Å; L351-W425 HydrophobicContact CG-CZ3 4.29Å; L351-M426 HydrophobicContact CD1-CE 3.74Å; L351-M426 HydrophobicContact CD2-CE 4.09Å; L351-M426 HydrophobicContact CG-CE 4.26Å
352	Q	94	Very high	90.7	Very high	39 Å²	39	48.9 Å²	48.9	18%	0.182	26%	0.258	C	S	.	.	H	α-helix	trans	-59.3	-47.2	179.1	-75.7	173.1	96.8	0	0	112.2	L333 V348 K349 R356 W425	L333-Q352 HydrophobicContact CB-CG 3.93Å; L333-Q352 HydrophobicContact CD2-CG 4.49Å; V348-Q352 WeakPolarHBondContact O-CG 3.49Å; V348-Q352 PolarHBondContact O-N 3.06Å; V348-Q352 PolarHBondContact O-NE2 2.67Å; K349-Q352 PolarHBondContact O-N 2.87Å; Q352-R356 PolarHBondContact O-N 3Å; Q352-W425 HydrophobicContact CB-CH2 4.45Å; Q352-W425 HydrophobicContact CB-CZ2 4.29Å; Q352-W425 HydrophobicContact CG-CH2 3.93Å; Q352-W425 HydrophobicContact CG-CZ2 3.63Å
353	S	93.8	Very high	92	Very high	54 Å²	54	43.5 Å²	43.5	38%	0.378	23%	0.229	S	C	.	.	H	α-helix	trans	-62.5	-56.9	178	-161.8	0	0	0	0	111.5	K349 A350 L351 Y355 R356 E357 R407	K349-S353 PolarHBondContact O-N 3.08Å; A350-S353 PolarHBondContact O-N 2.81Å; L351-S353 PolarHBondContact O-N 3.32Å; S353-Y355 PolarHBondContact O-N 2.97Å; S353-Y355 VanDerWaalsContact O-N 3.14Å; S353-R356 PolarHBondContact O-N 3.4Å; S353-R356 VanDerWaalsContact O-N 3.13Å; S353-E357 WeakPolarHBondContact CB-OE1 3.4Å; S353-E357 WeakPolarHBondContact O-CB 3.33Å; S353-E357 VanDerWaalsContact O-CD 3.31Å; S353-E357 VanDerWaalsContact O-CG 3.25Å; S353-E357 WeakPolarHBondContact O-CG 3.5Å; S353-E357 PolarHBondContact O-N 3.11Å; S353-E357 VanDerWaalsContact O-OE1 3.06Å; S353-E357 PolarHBondContact OG-OE1 3.36Å; S353-R407 PolarHBondContact OG-NH2 3.17Å
354	L	95.1	Very high	92.5	Very high	7 Å²	7	46.5 Å²	46.5	4%	0.037	25%	0.246	C	C	.	.	H	α-helix	trans	-56.6	-33.5	-179.1	-73.7	169.2	0	0	0	112.7	A350 H358 F381 I404 R407 L408	A350-L354 VanDerWaalsContact O-CB 3.25Å; A350-L354 WeakPolarHBondContact O-CB 3.33Å; A350-L354 WeakPolarHBondContact O-CD1 3.35Å; A350-L354 WeakPolarHBondContact O-CG 3.5Å; A350-L354 PolarHBondContact O-N 2.88Å; L354-H358 VanDerWaalsContact O-CB 3.26Å; L354-H358 WeakPolarHBondContact O-CB 3.3Å; L354-H358 PolarHBondContact O-N 3.42Å; L354-F381 HydrophobicContact CB-CE2 4.37Å; L354-I404 HydrophobicContact CD2-CB 4.48Å; L354-I404 HydrophobicContact CD2-CG1 4.02Å; L354-I404 HydrophobicContact CD2-CG2 4.42Å; L354-R407 HydrophobicContact CD1-CB 4.14Å; L354-R407 HydrophobicContact CD2-CB 4.4Å; L354-R407 VanDerWaalsContact CD2-CZ 3.49Å; L354-L408 HydrophobicContact CD1-CB 3.63Å; L354-L408 HydrophobicContact CD1-CD2 4.34Å
355	Y	95.8	Very high	93	Very high	2 Å²	2	44.9 Å²	44.9	1%	0.008	23%	0.234	C	C	.	.	H	α-helix	trans	-82.6	-34.5	-179.6	-176.7	-112.1	0	0	0	112.8	F330 L351 S353 H358 C359 F381 W425 M426 C429 D430 K483	F330-Y355 HydrophobicContact CE2-CD1 4.21Å; F330-Y355 HydrophobicContact CE2-CE1 4.2Å; L351-Y355 WeakPolarHBondContact O-CB 3.5Å; L351-Y355 PolarHBondContact O-N 3.01Å; S353-Y355 PolarHBondContact O-N 2.97Å; S353-Y355 VanDerWaalsContact O-N 3.14Å; Y355-H358 PolarHBondContact O-N 3.5Å; Y355-C359 PolarHBondContact O-N 3.29Å; Y355-C359 PolarHBondContact O-SG 3.27Å; Y355-F381 HydrophobicContact CD2-CE1 4.11Å; Y355-F381 HydrophobicContact CD2-CE2 4.18Å; Y355-F381 AromaticContact CD2-CZ 3.65Å; Y355-F381 HydrophobicContact CD2-CZ 3.65Å; Y355-F381 HydrophobicContact CG-CZ 4.29Å; Y355-W425 AromaticContact CD1-CH2 3.37Å; Y355-W425 HydrophobicContact CD1-CH2 3.37Å; Y355-W425 HydrophobicContact CD1-CZ2 4.1Å; Y355-W425 AromaticContact CD1-CZ3 3.78Å; Y355-W425 HydrophobicContact CD1-CZ3 3.78Å; Y355-W425 HydrophobicContact CE1-CH2 4.12Å; Y355-W425 HydrophobicContact CE1-CZ3 4.26Å; Y355-W425 HydrophobicContact CG-CH2 4.1Å; Y355-W425 HydrophobicContact CG-CZ3 4.4Å; Y355-M426 HydrophobicContact CE1-CG 4.37Å; Y355-M426 PolarHBondContact OH-O 3.49Å; Y355-C429 HydrophobicContact CE1-CB 3.55Å; Y355-D430 PolarHBondContact OH-OD1 3.09Å; Y355-D430 VanDerWaalsContact OH-OD1 3.12Å; Y355-K483 PolarHBondContact OH-NZ 2.89Å
356	R	94.5	Very high	93.3	Very high	65 Å²	65	40.1 Å²	40.1	25%	0.245	20%	0.203	C	C	.	.	H	α-helix	trans	-60.9	-49.5	167.8	-162.6	-168.1	-145.4	-64.8	-2.6	110.4	D329 F330 Q352 S353 H358 C359 E360	D329-R356 IonicContact OD1-CZ 3.98Å; D329-R356 IonicContact OD1-NH2 2.93Å; D329-R356 PolarHBondContact OD1-NH2 3.08Å; F330-R356 HydrophobicContact CD2-CB 4.46Å; F330-R356 HydrophobicContact CD2-CG 4.43Å; F330-R356 HydrophobicContact CE2-CB 4.45Å; F330-R356 HydrophobicContact CE2-CG 4.42Å; Q352-R356 PolarHBondContact O-N 3Å; S353-R356 PolarHBondContact O-N 3.4Å; S353-R356 VanDerWaalsContact O-N 3.13Å; R356-H358 VanDerWaalsContact C-N 3.28Å; R356-H358 PolarHBondContact O-N 3.06Å; R356-C359 PolarHBondContact O-N 3.44Å; R356-C359 VanDerWaalsContact O-N 3.12Å; R356-E360 WeakPolarHBondContact CD-OE1 3.48Å; R356-E360 WeakPolarHBondContact CG-OE1 3.24Å; R356-E360 IonicContact CZ-OE1 3.08Å; R356-E360 IonicContact NE-OE1 2.78Å; R356-E360 IonicContact NH1-OE1 3.7Å; R356-E360 PolarHBondContact NH1-OE1 2.86Å; R356-E360 WeakPolarHBondContact O-CG 3.24Å; R356-E360 PolarHBondContact O-N 3.36Å
357	E	93.9	Very high	93.4	Very high	69 Å²	69	33.7 Å²	33.7	32%	0.322	17%	0.174	S	C	.	.	H	α-helix	trans	-56.5	-40.5	176.3	-68.5	157	-132.1	0	0	111.8	S353 E360 A361 R407	S353-E357 WeakPolarHBondContact CB-OE1 3.4Å; S353-E357 WeakPolarHBondContact O-CB 3.33Å; S353-E357 VanDerWaalsContact O-CD 3.31Å; S353-E357 VanDerWaalsContact O-CG 3.25Å; S353-E357 WeakPolarHBondContact O-CG 3.5Å; S353-E357 PolarHBondContact O-N 3.11Å; S353-E357 VanDerWaalsContact O-OE1 3.06Å; S353-E357 PolarHBondContact OG-OE1 3.36Å; E357-E360 PolarHBondContact O-N 3.04Å; E357-A361 WeakPolarHBondContact O-CB 3.12Å; E357-A361 PolarHBondContact O-N 3.14Å; E357-R407 IonicContact OE1-CZ 2.91Å; E357-R407 IonicContact OE1-NH1 2.65Å; E357-R407 IonicContact OE1-NH2 3.34Å; E357-R407 PolarHBondContact OE1-NH2 3.08Å; E357-R407 IonicContact OE2-CZ 3.83Å; E357-R407 IonicContact OE2-NH1 2.74Å; E357-R407 PolarHBondContact OE2-NH1 2.9Å; E357-R407 IonicContact OE2-NH2 3.08Å; E357-R407 PolarHBondContact OE2-NH2 3.46Å
358	H	95.1	Very high	93.3	Very high	17 Å²	17	35.2 Å²	35.2	8%	0.079	18%	0.183	C	C	.	.	H	α-helix	trans	-65.4	-43.7	175.5	176.6	50.4	0	0	0	112.8	L354 Y355 R356 A361 I362 L377 W378 F381	L354-H358 VanDerWaalsContact O-CB 3.26Å; L354-H358 WeakPolarHBondContact O-CB 3.3Å; L354-H358 PolarHBondContact O-N 3.42Å; Y355-H358 PolarHBondContact O-N 3.5Å; R356-H358 VanDerWaalsContact C-N 3.28Å; R356-H358 PolarHBondContact O-N 3.06Å; H358-A361 PolarHBondContact O-N 3.27Å; H358-I362 WeakPolarHBondContact O-CG1 3.35Å; H358-I362 PolarHBondContact O-N 3.49Å; H358-I362 VanDerWaalsContact O-N 3.08Å; H358-L377 PolarHBondContact CE1-O 2.92Å; H358-W378 AromaticContact CE1-CD1 3.61Å; H358-W378 AromaticContact NE2-CD1 3.36Å; H358-W378 AromaticContact NE2-NE1 3.9Å; H358-F381 HydrophobicContact CB-CD2 3.66Å; H358-F381 HydrophobicContact CB-CE2 4.06Å; H358-F381 HydrophobicContact CB-CG 4.29Å; H358-F381 AromaticContact CD2-CD1 3.95Å; H358-F381 AromaticContact CD2-CD2 3.86Å; H358-F381 AromaticContact CD2-CG 3.65Å; H358-F381 AromaticContact CG-CD2 3.66Å; H358-F381 AromaticContact CG-CG 3.76Å; H358-F381 AromaticContact NE2-CG 3.94Å
359	C	95.9	Very high	93.3	Very high	0 Å²	0	35.9 Å²	35.9	0%	0	19%	0.185	C	C	.	.	H	α-helix	trans	-66.3	-38.4	176.1	-67.1	0	0	0	0	112.1	L327 F330 Y355 R356 I362 L363 M433	L327-C359 HydrophobicContact CD1-CB 3.46Å; L327-C359 VanDerWaalsContact CD1-CB 3.46Å; F330-C359 HydrophobicContact CE2-CB 4.17Å; F330-C359 HydrophobicContact CZ-CB 3.84Å; Y355-C359 PolarHBondContact O-N 3.29Å; Y355-C359 PolarHBondContact O-SG 3.27Å; R356-C359 PolarHBondContact O-N 3.44Å; R356-C359 VanDerWaalsContact O-N 3.12Å; C359-I362 PolarHBondContact O-N 3.19Å; C359-L363 PolarHBondContact O-N 2.96Å; C359-M433 HydrophobicContact CB-CG 4.35Å; C359-M433 HydrophobicContact CB-SD 3.56Å; C359-M433 VanDerWaalsContact CB-SD 3.56Å
360	E	93.8	Very high	93.3	Very high	80 Å²	80	33.2 Å²	33.2	37%	0.374	18%	0.175	S	C	.	.	H	α-helix	trans	-63	-41	173.9	-72.6	168.8	-177.6	0	0	111.9	L327 R356 E357 I362 L363 D364	L327-E360 HydrophobicContact CD1-CG 4.2Å; R356-E360 WeakPolarHBondContact CD-OE1 3.48Å; R356-E360 WeakPolarHBondContact CG-OE1 3.24Å; R356-E360 IonicContact CZ-OE1 3.08Å; R356-E360 IonicContact NE-OE1 2.78Å; R356-E360 IonicContact NH1-OE1 3.7Å; R356-E360 PolarHBondContact NH1-OE1 2.86Å; R356-E360 WeakPolarHBondContact O-CG 3.24Å; R356-E360 PolarHBondContact O-N 3.36Å; E357-E360 PolarHBondContact O-N 3.04Å; E360-I362 VanDerWaalsContact C-N 3.34Å; E360-I362 PolarHBondContact O-N 2.79Å; E360-L363 WeakPolarHBondContact O-CB 3.48Å; E360-L363 PolarHBondContact O-N 3.35Å; E360-D364 PolarHBondContact O-N 2.8Å
361	A	94.1	Very high	93.4	Very high	35 Å²	35	33.3 Å²	33.3	29%	0.289	17%	0.172	S	C	.	.	H	α-helix	trans	-64.7	-35.6	174	0	0	0	0	0	112.7	E357 H358 V365 L377	E357-A361 WeakPolarHBondContact O-CB 3.12Å; E357-A361 PolarHBondContact O-N 3.14Å; H358-A361 PolarHBondContact O-N 3.27Å; A361-V365 WeakPolarHBondContact O-CB 3.35Å; A361-V365 WeakPolarHBondContact O-CG2 3.39Å; A361-V365 PolarHBondContact O-N 3.46Å; A361-L377 HydrophobicContact CB-CD1 4.03Å; A361-L377 HydrophobicContact CB-CD2 4.02Å; A361-L377 WeakPolarHBondContact O-CD1 3.46Å
362	I	95.8	Very high	93.2	Very high	3 Å²	3	37.1 Å²	37.1	2%	0.015	20%	0.199	C	C	.	.	H	α-helix	trans	-65.9	-42.7	172.3	-69.2	169.8	0	0	0	110.4	H358 C359 E360 V365 V366 L377 M433 L437	H358-I362 WeakPolarHBondContact O-CG1 3.35Å; H358-I362 PolarHBondContact O-N 3.49Å; H358-I362 VanDerWaalsContact O-N 3.08Å; C359-I362 PolarHBondContact O-N 3.19Å; E360-I362 VanDerWaalsContact C-N 3.34Å; E360-I362 PolarHBondContact O-N 2.79Å; I362-V365 PolarHBondContact O-N 2.66Å; I362-V366 HydrophobicContact CG2-CG2 4.43Å; I362-V366 WeakPolarHBondContact O-CB 3.47Å; I362-V366 WeakPolarHBondContact O-CG2 3.27Å; I362-V366 PolarHBondContact O-N 3.23Å; I362-L377 HydrophobicContact CB-CD1 4.49Å; I362-L377 HydrophobicContact CG1-CB 4.47Å; I362-L377 HydrophobicContact CG1-CD1 3.83Å; I362-M433 HydrophobicContact CB-SD 4.14Å; I362-M433 HydrophobicContact CD1-CE 4.44Å; I362-M433 HydrophobicContact CD1-SD 4.06Å; I362-M433 HydrophobicContact CG2-SD 4.08Å; I362-L437 HydrophobicContact CG2-CD1 3.91Å
363	L	93.5	Very high	93.2	Very high	17 Å²	17	38 Å²	38	9%	0.089	20%	0.204	C	C	.	.	H	α-helix	trans	-58.5	-52.4	177.2	171.9	63.9	0	0	0	111.8	L327 C359 E360 V365 V366 V367 L437 I440	L327-L363 HydrophobicContact CD2-CB 4.33Å; L327-L363 HydrophobicContact CD2-CD2 3.95Å; L327-L363 HydrophobicContact CG-CB 4.46Å; L327-L363 HydrophobicContact CG-CD2 3.82Å; C359-L363 PolarHBondContact O-N 2.96Å; E360-L363 WeakPolarHBondContact O-CB 3.48Å; E360-L363 PolarHBondContact O-N 3.35Å; L363-V365 VanDerWaalsContact C-N 3.34Å; L363-V365 PolarHBondContact O-N 3.42Å; L363-V366 PolarHBondContact O-N 3.07Å; L363-V366 VanDerWaalsContact O-N 3.14Å; L363-V367 HydrophobicContact CD1-CG2 3.93Å; L363-V367 HydrophobicContact CG-CG2 4.44Å; L363-V367 WeakPolarHBondContact O-CG2 3.45Å; L363-V367 PolarHBondContact O-N 2.9Å; L363-L437 HydrophobicContact CB-CD2 4.37Å; L363-L437 HydrophobicContact CD1-CD2 3.85Å; L363-I440 HydrophobicContact CD1-CD1 3.37Å
364	D	91.8	Very high	93.3	Very high	93 Å²	93	35.4 Å²	35.4	50%	0.497	19%	0.187	S	C	.	.	H	α-helix	trans	-58.7	-45.1	178.9	176.2	72.6	0	0	0	111.9	E360 V366 V367 N368	E360-D364 PolarHBondContact O-N 2.8Å; D364-V366 VanDerWaalsContact C-N 3.29Å; D364-V366 PolarHBondContact O-N 3.39Å; D364-V367 PolarHBondContact O-N 3.08Å; D364-N368 WeakPolarHBondContact O-CB 3.26Å; D364-N368 PolarHBondContact O-N 2.76Å; D364-N368 PolarHBondContact O-ND2 2.98Å; D364-N368 PolarHBondContact OD1-ND2 3.42Å; D364-N368 PolarHBondContact OD2-ND2 2.82Å
365	V	93.1	Very high	93.2	Very high	10 Å²	10	37.4 Å²	37.4	6%	0.061	20%	0.196	C	C	.	.	H	α-helix	trans	-61.6	-35.7	177.3	164.4	0	0	0	0	112.2	A361 I362 L363 L369 Q370 L373 I374 L377	A361-V365 WeakPolarHBondContact O-CB 3.35Å; A361-V365 WeakPolarHBondContact O-CG2 3.39Å; A361-V365 PolarHBondContact O-N 3.46Å; I362-V365 PolarHBondContact O-N 2.66Å; L363-V365 VanDerWaalsContact C-N 3.34Å; L363-V365 PolarHBondContact O-N 3.42Å; V365-L369 PolarHBondContact O-N 3.5Å; V365-Q370 HydrophobicContact CG1-CB 4.1Å; V365-Q370 VanDerWaalsContact CG1-O 3.27Å; V365-Q370 WeakPolarHBondContact CG1-O 3.4Å; V365-Q370 PolarHBondContact O-N 3.2Å; V365-L373 HydrophobicContact CG1-CB 3.89Å; V365-L373 HydrophobicContact CG2-CB 4.19Å; V365-L373 HydrophobicContact CG2-CD1 4.31Å; V365-I374 HydrophobicContact CG1-CD1 4.22Å; V365-I374 HydrophobicContact CG1-CG1 3.62Å; V365-L377 HydrophobicContact CB-CD1 4.35Å; V365-L377 HydrophobicContact CG2-CD1 3.97Å
366	V	92.8	Very high	93.1	Very high	0 Å²	0	43.3 Å²	43.3	0%	0	22%	0.221	C	C	.	.	H	α-helix	trans	-73.9	-42.9	176.3	167.5	0	0	0	0	112.2	I362 L363 D364 N368 L369 F371 I374 L437 L441 F460	I362-V366 HydrophobicContact CG2-CG2 4.43Å; I362-V366 WeakPolarHBondContact O-CB 3.47Å; I362-V366 WeakPolarHBondContact O-CG2 3.27Å; I362-V366 PolarHBondContact O-N 3.23Å; L363-V366 PolarHBondContact O-N 3.07Å; L363-V366 VanDerWaalsContact O-N 3.14Å; D364-V366 VanDerWaalsContact C-N 3.29Å; D364-V366 PolarHBondContact O-N 3.39Å; V366-N368 VanDerWaalsContact C-N 3.27Å; V366-N368 PolarHBondContact O-N 3.2Å; V366-L369 WeakPolarHBondContact O-CA 3.34Å; V366-L369 PolarHBondContact O-N 2.9Å; V366-F371 HydrophobicContact CG1-CE1 4.28Å; V366-F371 HydrophobicContact CG2-CD1 4.39Å; V366-F371 HydrophobicContact CG2-CE1 4.39Å; V366-I374 HydrophobicContact CG2-CD1 3.65Å; V366-L437 HydrophobicContact CB-CD2 4Å; V366-L437 HydrophobicContact CG1-CD2 3.98Å; V366-L437 HydrophobicContact CG2-CD1 4.23Å; V366-L437 HydrophobicContact CG2-CD2 4.21Å; V366-L441 HydrophobicContact CG1-CD1 3.92Å; V366-L441 HydrophobicContact CG1-CD2 3.93Å; V366-L441 HydrophobicContact CG1-CG 3.88Å; V366-F460 HydrophobicContact CG2-CZ 4.27Å
367	V	88.8	Confident	93.1	Very high	16 Å²	16	42.1 Å²	42.1	10%	0.097	22%	0.22	C	C	.	.	H	α-helix	trans	-60.5	-38.1	174.8	168.3	0	0	0	0	111.2	Q317 A323 L363 D364 L369 I440	Q317-V367 PolarHBondContact NE2-O 3.16Å; A323-V367 HydrophobicContact CB-CG1 3.65Å; L363-V367 HydrophobicContact CD1-CG2 3.93Å; L363-V367 HydrophobicContact CG-CG2 4.44Å; L363-V367 WeakPolarHBondContact O-CG2 3.45Å; L363-V367 PolarHBondContact O-N 2.9Å; D364-V367 PolarHBondContact O-N 3.08Å; V367-L369 PolarHBondContact O-N 3.38Å; V367-I440 HydrophobicContact CG2-CD1 4.33Å; V367-I440 HydrophobicContact CG2-CG2 4.04Å
368	N	88.9	Confident	93.1	Very high	51 Å²	51	39 Å²	39	27%	0.273	21%	0.205	S	C	.	.	T	Hydrogen-bonded Turn	trans	-79	-0.2	173.8	-72.4	-69.4	0	0	0	114.2	D364 V366 Q370	D364-N368 WeakPolarHBondContact O-CB 3.26Å; D364-N368 PolarHBondContact O-N 2.76Å; D364-N368 PolarHBondContact O-ND2 2.98Å; D364-N368 PolarHBondContact OD1-ND2 3.42Å; D364-N368 PolarHBondContact OD2-ND2 2.82Å; V366-N368 VanDerWaalsContact C-N 3.27Å; V366-N368 PolarHBondContact O-N 3.2Å; N368-Q370 HydrophobicContact CB-CG 3.97Å; N368-Q370 PolarHBondContact O-N 2.83Å
369	L	90.4	Very high	93	Very high	27 Å²	27	40.8 Å²	40.8	14%	0.141	21%	0.213	C	C	.	.	T	Hydrogen-bonded Turn	trans	58.7	23.7	-177.4	-57.8	171.2	0	0	0	114.2	H316 L320 V365 V366 V367 F371 L441 L453	H316-L369 HydrophobicContact CB-CD1 3.57Å; L320-L369 HydrophobicContact CD1-CD2 4.24Å; L320-L369 HydrophobicContact CD1-CG 4.37Å; L320-L369 HydrophobicContact CD2-CD2 4.33Å; V365-L369 PolarHBondContact O-N 3.5Å; V366-L369 WeakPolarHBondContact O-CA 3.34Å; V366-L369 PolarHBondContact O-N 2.9Å; V367-L369 PolarHBondContact O-N 3.38Å; L369-F371 HydrophobicContact CB-CE2 4.41Å; L369-F371 HydrophobicContact CD2-CE1 4.46Å; L369-F371 HydrophobicContact CD2-CE2 4.06Å; L369-F371 HydrophobicContact CD2-CZ 3.62Å; L369-F371 PolarHBondContact O-N 3.01Å; L369-F371 VanDerWaalsContact O-N 3.14Å; L369-L441 HydrophobicContact CD2-CD2 3.98Å; L369-L453 HydrophobicContact CD1-CD1 4.11Å; L369-L453 HydrophobicContact CD2-CD1 3.89Å
370	Q	91.6	Very high	92.8	Very high	93 Å²	93	42.5 Å²	42.5	44%	0.435	22%	0.224	S	C	.	.			trans	-87.9	41.7	-176.4	-64.7	-176.6	-0.8	0	0	112.5	V365 N368 S372 L373	V365-Q370 HydrophobicContact CG1-CB 4.1Å; V365-Q370 VanDerWaalsContact CG1-O 3.27Å; V365-Q370 WeakPolarHBondContact CG1-O 3.4Å; V365-Q370 PolarHBondContact O-N 3.2Å; N368-Q370 HydrophobicContact CB-CG 3.97Å; N368-Q370 PolarHBondContact O-N 2.83Å; Q370-S372 PolarHBondContact O-N 3.49Å; Q370-L373 HydrophobicContact CB-CD1 4.04Å; Q370-L373 HydrophobicContact CB-CG 4.34Å; Q370-L373 PolarHBondContact O-N 3.42Å
371	F	93.6	Very high	92.8	Very high	20 Å²	20	39.1 Å²	39.1	9%	0.088	21%	0.208	C	C	.	.	G	3₁₀ helix	trans	-47.6	-29.1	-168	-57.8	-59.4	0	0	0	116.2	V366 L369 L373 I374 L441 A456 I457 F460 W467	V366-F371 HydrophobicContact CG1-CE1 4.28Å; V366-F371 HydrophobicContact CG2-CD1 4.39Å; V366-F371 HydrophobicContact CG2-CE1 4.39Å; L369-F371 HydrophobicContact CB-CE2 4.41Å; L369-F371 HydrophobicContact CD2-CE1 4.46Å; L369-F371 HydrophobicContact CD2-CE2 4.06Å; L369-F371 HydrophobicContact CD2-CZ 3.62Å; L369-F371 PolarHBondContact O-N 3.01Å; L369-F371 VanDerWaalsContact O-N 3.14Å; F371-L373 PolarHBondContact O-N 3.45Å; F371-I374 HydrophobicContact CD1-CD1 4.29Å; F371-I374 PolarHBondContact O-N 3.46Å; F371-L441 HydrophobicContact CE1-CD1 4.26Å; F371-L441 HydrophobicContact CE1-CD2 4.06Å; F371-L441 HydrophobicContact CZ-CD2 3.84Å; F371-A456 HydrophobicContact CE2-CB 4.22Å; F371-I457 HydrophobicContact CZ-CG1 4.46Å; F371-F460 HydrophobicContact CB-CB 4.17Å; F371-F460 HydrophobicContact CB-CD2 3.77Å; F371-F460 HydrophobicContact CB-CE2 4.38Å; F371-F460 HydrophobicContact CB-CG 4.05Å; F371-F460 HydrophobicContact CD1-CB 4.11Å; F371-F460 AromaticContact CD1-CD1 3.52Å; F371-F460 HydrophobicContact CD1-CD1 3.52Å; F371-F460 AromaticContact CD1-CD2 3.74Å; F371-F460 HydrophobicContact CD1-CD2 3.74Å; F371-F460 AromaticContact CD1-CE1 3.74Å; F371-F460 HydrophobicContact CD1-CE1 3.74Å; F371-F460 AromaticContact CD1-CE2 3.96Å; F371-F460 HydrophobicContact CD1-CE2 3.96Å; F371-F460 AromaticContact CD1-CG 3.51Å; F371-F460 HydrophobicContact CD1-CG 3.51Å; F371-F460 AromaticContact CD1-CZ 3.95Å; F371-F460 HydrophobicContact CD1-CZ 3.95Å; F371-F460 HydrophobicContact CD2-CB 4.04Å; F371-F460 HydrophobicContact CD2-CG 4.34Å; F371-F460 AromaticContact CE1-CD1 3.53Å; F371-F460 HydrophobicContact CE1-CD1 3.53Å; F371-F460 AromaticContact CE1-CE1 3.76Å; F371-F460 HydrophobicContact CE1-CE1 3.76Å; F371-F460 AromaticContact CE1-CG 3.97Å; F371-F460 HydrophobicContact CE1-CG 3.97Å; F371-F460 HydrophobicContact CE1-CZ 4.37Å; F371-F460 HydrophobicContact CE2-CB 4.45Å; F371-F460 HydrophobicContact CG-CB 3.86Å; F371-F460 HydrophobicContact CG-CD1 4.16Å; F371-F460 AromaticContact CG-CD2 3.92Å; F371-F460 HydrophobicContact CG-CD2 3.92Å; F371-F460 AromaticContact CG-CG 3.72Å; F371-F460 HydrophobicContact CG-CG 3.72Å; F371-F460 HydrophobicContact CZ-CD1 4.18Å; F371-W467 WeakPolarHBondContact O-CZ3 3.14Å
372	S	90.9	Very high	92.7	Very high	82 Å²	82	37.7 Å²	37.7	57%	0.573	20%	0.195	S	C	*	.	G	3₁₀ helix	trans	-69.2	-9.5	177.7	52.1	0	0	0	0	115.1	Q370	Q370-S372 PolarHBondContact O-N 3.49Å
373	L	93.8	Very high	92.4	Very high	56 Å²	56	38 Å²	38	29%	0.293	20%	0.196	S	C	.	.	G	3₁₀ helix	trans	-86	-16.1	174	-59.5	-177.7	0	0	0	113.2	V365 Q370 F371 E375 K376 L377	V365-L373 HydrophobicContact CG1-CB 3.89Å; V365-L373 HydrophobicContact CG2-CB 4.19Å; V365-L373 HydrophobicContact CG2-CD1 4.31Å; Q370-L373 HydrophobicContact CB-CD1 4.04Å; Q370-L373 HydrophobicContact CB-CG 4.34Å; Q370-L373 PolarHBondContact O-N 3.42Å; F371-L373 PolarHBondContact O-N 3.45Å; L373-E375 VanDerWaalsContact C-N 3.35Å; L373-E375 PolarHBondContact O-N 3.04Å; L373-K376 HydrophobicContact CD2-CD 4.21Å; L373-K376 WeakPolarHBondContact O-CA 3.17Å; L373-K376 WeakPolarHBondContact O-CB 3.36Å; L373-K376 PolarHBondContact O-N 3.36Å; L373-L377 PolarHBondContact O-N 2.96Å
374	I	95.8	Very high	91.9	Very high	1 Å²	1	40.5 Å²	40.5	1%	0.005	21%	0.205	C	C	.	.	H	α-helix	trans	-65	-38.8	-175.4	-63.7	167.8	0	0	0	111.4	V365 V366 F371 K376 L377 W378 F460	V365-I374 HydrophobicContact CG1-CD1 4.22Å; V365-I374 HydrophobicContact CG1-CG1 3.62Å; V366-I374 HydrophobicContact CG2-CD1 3.65Å; F371-I374 HydrophobicContact CD1-CD1 4.29Å; F371-I374 PolarHBondContact O-N 3.46Å; I374-K376 VanDerWaalsContact C-N 3.26Å; I374-K376 PolarHBondContact O-N 3.33Å; I374-L377 PolarHBondContact O-N 3.14Å; I374-W378 HydrophobicContact CG2-CD2 4Å; I374-W378 HydrophobicContact CG2-CE3 4.01Å; I374-W378 HydrophobicContact CG2-CH2 4.13Å; I374-W378 HydrophobicContact CG2-CZ2 4.06Å; I374-W378 HydrophobicContact CG2-CZ3 4.07Å; I374-W378 PolarHBondContact O-N 3.04Å; I374-F460 HydrophobicContact CD1-CD2 4.3Å; I374-F460 HydrophobicContact CD1-CE2 3.32Å; I374-F460 HydrophobicContact CD1-CZ 3.58Å
375	E	94.4	Very high	91	Very high	48 Å²	48	39.5 Å²	39.5	22%	0.224	21%	0.205	C	C	.	.	H	α-helix	trans	-56.7	-40.2	171.6	-178.4	170.8	-147.6	0	0	111.8	L373 Q379 W467	L373-E375 VanDerWaalsContact C-N 3.35Å; L373-E375 PolarHBondContact O-N 3.04Å; E375-Q379 WeakPolarHBondContact O-CB 3.38Å; E375-Q379 VanDerWaalsContact O-CG 3.22Å; E375-Q379 WeakPolarHBondContact O-CG 3.13Å; E375-Q379 PolarHBondContact O-N 3.37Å; E375-W467 HydrophobicContact CB-CB 4.08Å; E375-W467 HydrophobicContact CB-CD2 3.99Å; E375-W467 HydrophobicContact CB-CG 3.79Å; E375-W467 HydrophobicContact CG-CB 4.14Å; E375-W467 HydrophobicContact CG-CG 4Å; E375-W467 VanDerWaalsContact OE2-CD1 3.26Å; E375-W467 PolarHBondContact OE2-NE1 3.08Å
376	K	92.1	Very high	89.7	Confident	126 Å²	126	41.9 Å²	41.9	55%	0.548	22%	0.221	S	C	.	.	H	α-helix	trans	-70.9	-38.2	177.8	-58	-176.1	-179.3	-178.6	0	112.3	L373 I374 Q379 T380	L373-K376 HydrophobicContact CD2-CD 4.21Å; L373-K376 WeakPolarHBondContact O-CA 3.17Å; L373-K376 WeakPolarHBondContact O-CB 3.36Å; L373-K376 PolarHBondContact O-N 3.36Å; I374-K376 VanDerWaalsContact C-N 3.26Å; I374-K376 PolarHBondContact O-N 3.33Å; K376-Q379 PolarHBondContact O-N 3.04Å; K376-T380 WeakPolarHBondContact O-CB 3.24Å; K376-T380 PolarHBondContact O-N 2.86Å; K376-T380 PolarHBondContact O-OG1 3.32Å
377	L	94.4	Very high	88.1	Confident	40 Å²	40	47.1 Å²	47.1	21%	0.209	26%	0.255	C	S	.	.	H	α-helix	trans	-61.7	-45.7	174.9	-68.4	178.6	0	0	0	110.8	H358 A361 I362 V365 L373 I374 T380 F381	H358-L377 PolarHBondContact CE1-O 2.92Å; A361-L377 HydrophobicContact CB-CD1 4.03Å; A361-L377 HydrophobicContact CB-CD2 4.02Å; A361-L377 WeakPolarHBondContact O-CD1 3.46Å; I362-L377 HydrophobicContact CB-CD1 4.49Å; I362-L377 HydrophobicContact CG1-CB 4.47Å; I362-L377 HydrophobicContact CG1-CD1 3.83Å; V365-L377 HydrophobicContact CB-CD1 4.35Å; V365-L377 HydrophobicContact CG2-CD1 3.97Å; L373-L377 PolarHBondContact O-N 2.96Å; I374-L377 PolarHBondContact O-N 3.14Å; L377-T380 PolarHBondContact O-N 3.29Å; L377-F381 PolarHBondContact O-N 3.13Å
378	W	95.6	Very high	86.2	Confident	5 Å²	5	53.1 Å²	53.1	2%	0.019	29%	0.286	C	S	.	.	H	α-helix	trans	-64	-45.9	175.2	-73.2	-32.2	0	0	0	112.5	H358 I374 T380 F381 W382 L464 W467 L468 A471 V487	H358-W378 AromaticContact CE1-CD1 3.61Å; H358-W378 AromaticContact NE2-CD1 3.36Å; H358-W378 AromaticContact NE2-NE1 3.9Å; I374-W378 HydrophobicContact CG2-CD2 4Å; I374-W378 HydrophobicContact CG2-CE3 4.01Å; I374-W378 HydrophobicContact CG2-CH2 4.13Å; I374-W378 HydrophobicContact CG2-CZ2 4.06Å; I374-W378 HydrophobicContact CG2-CZ3 4.07Å; I374-W378 PolarHBondContact O-N 3.04Å; W378-T380 VanDerWaalsContact C-N 3.27Å; W378-T380 PolarHBondContact O-N 2.64Å; W378-F381 PolarHBondContact O-N 2.9Å; W378-W382 WeakPolarHBondContact O-CB 3.21Å; W378-W382 VanDerWaalsContact O-CD1 3.23Å; W378-W382 PolarHBondContact O-N 3.25Å; W378-L464 HydrophobicContact CH2-CB 4.47Å; W378-L464 HydrophobicContact CH2-CD2 3.5Å; W378-L464 HydrophobicContact CZ2-CD2 4.34Å; W378-L464 HydrophobicContact CZ3-CD2 4.17Å; W378-L464 WeakPolarHBondContact CZ3-O 3.26Å; W378-W467 HydrophobicContact CE3-CB 3.94Å; W378-W467 HydrophobicContact CZ3-CB 3.74Å; W378-L468 HydrophobicContact CD2-CB 4.42Å; W378-L468 HydrophobicContact CD2-CD1 3.87Å; W378-L468 HydrophobicContact CE3-CB 3.96Å; W378-L468 HydrophobicContact CE3-CD1 4.27Å; W378-L468 HydrophobicContact CG-CD1 4.09Å; W378-L468 HydrophobicContact CH2-CB 3.98Å; W378-L468 HydrophobicContact CZ2-CB 4.48Å; W378-L468 HydrophobicContact CZ2-CD1 4.24Å; W378-L468 HydrophobicContact CZ3-CB 3.73Å; W378-A471 HydrophobicContact CB-CB 3.69Å; W378-V487 HydrophobicContact CH2-CG2 4.25Å; W378-V487 HydrophobicContact CZ2-CG2 4.17Å
379	Q	92.3	Very high	84.5	Confident	54 Å²	54	54.3 Å²	54.3	25%	0.252	30%	0.296	S	S	.	.	H	α-helix	trans	-58.5	-39.6	175.7	-75.2	170.8	2.5	0	0	112.1	E375 K376 R383 Y384 A471	E375-Q379 WeakPolarHBondContact O-CB 3.38Å; E375-Q379 VanDerWaalsContact O-CG 3.22Å; E375-Q379 WeakPolarHBondContact O-CG 3.13Å; E375-Q379 PolarHBondContact O-N 3.37Å; K376-Q379 PolarHBondContact O-N 3.04Å; Q379-R383 PolarHBondContact O-N 2.91Å; Q379-Y384 HydrophobicContact CB-CD1 4.37Å; Q379-Y384 HydrophobicContact CG-CD1 3.91Å; Q379-Y384 HydrophobicContact CG-CG 4.11Å; Q379-Y384 PolarHBondContact O-N 2.84Å; Q379-A471 HydrophobicContact CG-CB 4Å
380	T	91.6	Very high	82.4	Confident	35 Å²	35	58.5 Å²	58.5	22%	0.215	32%	0.322	C	S	.	.	H	α-helix	trans	-66.2	-51.7	177.1	-55.7	0	0	0	0	111.3	K376 L377 W378 R383 I401 I404	K376-T380 WeakPolarHBondContact O-CB 3.24Å; K376-T380 PolarHBondContact O-N 2.86Å; K376-T380 PolarHBondContact O-OG1 3.32Å; L377-T380 PolarHBondContact O-N 3.29Å; W378-T380 VanDerWaalsContact C-N 3.27Å; W378-T380 PolarHBondContact O-N 2.64Å; T380-R383 PolarHBondContact O-N 2.82Å; T380-I401 HydrophobicContact CG2-CG1 4.03Å; T380-I404 HydrophobicContact CG2-CD1 4Å
381	F	93.5	Very high	80	Confident	9 Å²	9	63.5 Å²	63.5	4%	0.039	35%	0.345	C	S	.	.	H	α-helix	trans	-63.6	-46.3	-178.6	-178.5	-94.6	0	0	0	112.4	L354 Y355 H358 L377 W378 R383	L354-F381 HydrophobicContact CB-CE2 4.37Å; Y355-F381 HydrophobicContact CD2-CE1 4.11Å; Y355-F381 HydrophobicContact CD2-CE2 4.18Å; Y355-F381 AromaticContact CD2-CZ 3.65Å; Y355-F381 HydrophobicContact CD2-CZ 3.65Å; Y355-F381 HydrophobicContact CG-CZ 4.29Å; H358-F381 HydrophobicContact CB-CD2 3.66Å; H358-F381 HydrophobicContact CB-CE2 4.06Å; H358-F381 HydrophobicContact CB-CG 4.29Å; H358-F381 AromaticContact CD2-CD1 3.95Å; H358-F381 AromaticContact CD2-CD2 3.86Å; H358-F381 AromaticContact CD2-CG 3.65Å; H358-F381 AromaticContact CG-CD2 3.66Å; H358-F381 AromaticContact CG-CG 3.76Å; H358-F381 AromaticContact NE2-CG 3.94Å; L377-F381 PolarHBondContact O-N 3.13Å; W378-F381 PolarHBondContact O-N 2.9Å; F381-R383 PolarHBondContact O-N 2.83Å; F381-R383 PolarHBondContact O-NH1 3.41Å
382	W	92.8	Very high	77.6	Confident	5 Å²	5	66.2 Å²	66.2	2%	0.019	38%	0.379	C	S	.	.	T	Hydrogen-bonded Turn	trans	-79.1	3	179.9	-64.2	116.7	0	0	0	114.4	W378 Y384 L413 M426 A471 M472 I475 M479 K483	W378-W382 WeakPolarHBondContact O-CB 3.21Å; W378-W382 VanDerWaalsContact O-CD1 3.23Å; W378-W382 PolarHBondContact O-N 3.25Å; W382-Y384 VanDerWaalsContact C-N 3.28Å; W382-Y384 PolarHBondContact O-N 3.25Å; W382-L413 HydrophobicContact CE3-CD2 4.41Å; W382-M426 HydrophobicContact CH2-CE 4.38Å; W382-M426 HydrophobicContact CH2-SD 4Å; W382-A471 WeakPolarHBondContact CB-O 3.48Å; W382-M472 HydrophobicContact CD2-CE 4.35Å; W382-M472 HydrophobicContact CD2-CG 3.98Å; W382-M472 HydrophobicContact CG-CG 3.83Å; W382-M472 HydrophobicContact CH2-CE 3.98Å; W382-M472 HydrophobicContact CZ2-CE 3.76Å; W382-M472 HydrophobicContact CZ2-SD 4.13Å; W382-M472 HydrophobicContact CZ3-CE 4.37Å; W382-I475 HydrophobicContact CB-CD1 4.49Å; W382-I475 HydrophobicContact CB-CG1 4.43Å; W382-I475 HydrophobicContact CD2-CD1 4.47Å; W382-I475 HydrophobicContact CD2-CG1 4.24Å; W382-I475 HydrophobicContact CE3-CD1 3.66Å; W382-I475 HydrophobicContact CE3-CG1 3.75Å; W382-I475 HydrophobicContact CE3-CG2 4.27Å; W382-I475 HydrophobicContact CZ3-CD1 4.33Å; W382-I475 HydrophobicContact CZ3-CG1 4.39Å; W382-I475 HydrophobicContact CZ3-CG2 4.07Å; W382-M479 HydrophobicContact CH2-CG 4.09Å; W382-M479 HydrophobicContact CH2-SD 4.35Å; W382-M479 HydrophobicContact CZ3-CG 4.5Å; W382-K483 HydrophobicContact CZ2-CD 4.23Å; W382-K483 HydrophobicContact CZ2-CG 4.29Å
383	R	89.6	Confident	75.3	Confident	10 Å²	10	65.5 Å²	65.5	4%	0.038	38%	0.378	C	S	.	.	T	Hydrogen-bonded Turn	trans	54.8	44.2	179.1	-58	146.4	172.2	76.4	-8.9	111.7	Q379 T380 F381 S385 I404 E405 L408 R410	Q379-R383 PolarHBondContact O-N 2.91Å; T380-R383 PolarHBondContact O-N 2.82Å; F381-R383 PolarHBondContact O-N 2.83Å; F381-R383 PolarHBondContact O-NH1 3.41Å; R383-S385 PolarHBondContact O-N 3.39Å; R383-I404 VanDerWaalsContact NH2-CG2 3.31Å; R383-I404 PolarHBondContact NH2-O 3.17Å; R383-E405 WeakPolarHBondContact CD-OE2 3.08Å; R383-E405 IonicContact CZ-OE2 3.14Å; R383-E405 IonicContact NE-OE2 2.72Å; R383-E405 PolarHBondContact NE-OE2 3.01Å; R383-E405 IonicContact NH2-OE2 2.71Å; R383-L408 PolarHBondContact NH2-O 3.28Å; R383-R410 PolarHBondContact O-NH1 2.96Å; R383-R410 PolarHBondContact O-NH2 3.06Å
384	Y	82	Confident	72.7	Confident	70 Å²	70	69.4 Å²	69.4	28%	0.275	40%	0.404	S	S	.	.			trans	-63.6	125.8	175.4	176.9	-100.3	0	0	0	109.9	Q379 W382 P386 N470	Q379-Y384 HydrophobicContact CB-CD1 4.37Å; Q379-Y384 HydrophobicContact CG-CD1 3.91Å; Q379-Y384 HydrophobicContact CG-CG 4.11Å; Q379-Y384 PolarHBondContact O-N 2.84Å; W382-Y384 VanDerWaalsContact C-N 3.28Å; W382-Y384 PolarHBondContact O-N 3.25Å; Y384-P386 HydrophobicContact CE1-CG 4.03Å; Y384-N470 VanDerWaalsContact CD2-O 3.23Å; Y384-N470 WeakPolarHBondContact CD2-O 3.37Å; Y384-N470 VanDerWaalsContact CE2-O 3.31Å; Y384-N470 WeakPolarHBondContact CE2-O 3.19Å
385	S	72.6	Confident	70.3	Confident	71 Å²	71	74.3 Å²	74.3	50%	0.497	43%	0.434	S	S	.	.			trans	-115.4	128.3	169.5	-168.9	0	0	0	0	108.1	R383	R383-S385 PolarHBondContact O-N 3.39Å
386	P	67.2	Low	68	Low	61 Å²	61	77.6 Å²	77.6	40%	0.396	46%	0.458	S	S	.	.			trans	-58.2	147.2	168.4	-21.2	32.4	0	0	0	110.9	Y384 D388 T389	Y384-P386 HydrophobicContact CE1-CG 4.03Å; P386-D388 VanDerWaalsContact C-N 3.25Å; P386-D388 PolarHBondContact O-N 3.07Å; P386-T389 HydrophobicContact CB-CG2 4.47Å; P386-T389 PolarHBondContact O-OG1 3.37Å
387	P	58.4	Low	66	Low	110 Å²	110	78.8 Å²	78.8	71%	0.714	47%	0.465	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.2	-21.6	176.2	28.8	-34.9	0	0	0	113.2	T389	P387-T389 PolarHBondContact O-N 2.82Å
388	D	49.8	Very low	64.4	Low	142 Å²	142	81.3 Å²	81.3	76%	0.759	48%	0.479	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.4	15.5	-172.7	-61.2	-50	0	0	0	114.6	P386 V390	P386-D388 VanDerWaalsContact C-N 3.25Å; P386-D388 PolarHBondContact O-N 3.07Å; D388-V390 VanDerWaalsContact C-N 3.29Å; D388-V390 PolarHBondContact O-N 3.33Å
389	T	51.9	Low	63	Low	76 Å²	76	85.7 Å²	85.7	47%	0.466	51%	0.51	S	S	.	.			trans	-74.2	83.3	172.2	53.1	0	0	0	0	110.8	P386 P387 E391	P386-T389 HydrophobicContact CB-CG2 4.47Å; P386-T389 PolarHBondContact O-OG1 3.37Å; P387-T389 PolarHBondContact O-N 2.82Å; T389-E391 PolarHBondContact O-N 3.46Å
390	V	45.8	Very low	62	Low	115 Å²	115	85.5 Å²	85.5	70%	0.697	52%	0.515	S	S	*	.			trans	-54.2	128.7	175.8	-177.2	0	0	0	0	110.9	D388 G392 A393	D388-V390 VanDerWaalsContact C-N 3.29Å; D388-V390 PolarHBondContact O-N 3.33Å; V390-G392 PolarHBondContact O-N 3.08Å; V390-A393 PolarHBondContact O-N 3.22Å; V390-A393 VanDerWaalsContact O-N 3.15Å
391	E	42.4	Very low	61.5	Low	198 Å²	198	86.4 Å²	86.4	93%	0.925	52%	0.518	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.3	112.1	173.8	-63.1	-177.3	133.2	0	0	110.4	T389	T389-E391 PolarHBondContact O-N 3.46Å
392	G	43.5	Very low	60.8	Low	77 Å²	77	89 Å²	89	79%	0.794	54%	0.537	S	S	*	.	T	Hydrogen-bonded Turn	trans	118.4	-10.4	-179.2	0	0	0	0	0	115.4	V390 T394	V390-G392 PolarHBondContact O-N 3.08Å; G392-T394 PolarHBondContact O-N 3.35Å
393	A	40.8	Very low	60.4	Low	67 Å²	67	94.3 Å²	94.3	55%	0.554	56%	0.562	S	S	*	*	S	Bend	trans	-65.8	129.4	159.4	0	0	0	0	0	109	V390 V395	V390-A393 PolarHBondContact O-N 3.22Å; V390-A393 VanDerWaalsContact O-N 3.15Å; A393-V395 VanDerWaalsContact C-N 3.32Å; A393-V395 PolarHBondContact O-N 3.01Å
394	T	40	Very low	60.3	Low	138 Å²	138	95.2 Å²	95.2	85%	0.847	57%	0.567	S	S	*	*			trans	-69.8	91	174.7	51.4	0	0	0	0	109.4	G392 T396	G392-T394 PolarHBondContact O-N 3.35Å; T394-T396 PolarHBondContact O-N 3.04Å
395	V	46.2	Very low	60.5	Low	104 Å²	104	95.1 Å²	95.1	63%	0.63	57%	0.569	S	S	*	*			trans	-59.7	108.9	167	-179.2	0	0	0	0	106.8	A393 E397	A393-V395 VanDerWaalsContact C-N 3.32Å; A393-V395 PolarHBondContact O-N 3.01Å; V395-E397 VanDerWaalsContact C-N 3.26Å; V395-E397 PolarHBondContact O-N 2.92Å
396	T	45.7	Very low	61.3	Low	117 Å²	117	95.9 Å²	95.9	72%	0.718	58%	0.58	S	S	*	*			trans	-63.4	99.7	155.5	47.9	0	0	0	0	105.5	T394 N398	T394-T396 PolarHBondContact O-N 3.04Å; T396-N398 PolarHBondContact O-N 2.73Å
397	E	50.9	Low	62.5	Low	151 Å²	151	97.2 Å²	97.2	71%	0.706	58%	0.577	S	S	*	*			trans	-53.3	113.6	177.1	-67.9	-174.6	161.6	0	0	107.9	V395 S399	V395-E397 VanDerWaalsContact C-N 3.26Å; V395-E397 PolarHBondContact O-N 2.92Å; E397-S399 PolarHBondContact O-N 2.7Å
398	N	59.7	Low	64.1	Low	93 Å²	93	92 Å²	92	50%	0.497	54%	0.543	S	S	.	.			trans	-60.8	111.8	175.6	-73.4	-26.5	0	0	0	106.2	T396 S400 I401 S402	T396-N398 PolarHBondContact O-N 2.73Å; N398-S400 PolarHBondContact O-N 3.29Å; N398-S400 VanDerWaalsContact O-N 3.08Å; N398-I401 HydrophobicContact CB-CB 4.35Å; N398-I401 HydrophobicContact CB-CD1 3.96Å; N398-I401 HydrophobicContact CB-CG1 3.95Å; N398-I401 WeakPolarHBondContact O-CA 3.49Å; N398-I401 WeakPolarHBondContact O-CB 3.46Å; N398-I401 PolarHBondContact O-N 2.77Å; N398-S402 PolarHBondContact O-N 3.32Å
399	S	66.4	Low	66.1	Low	97 Å²	97	88 Å²	88	68%	0.678	53%	0.525	S	S	*	.	H	α-helix	trans	-55	-34.6	-171.7	50.6	0	0	0	0	112.3	E397 I401 S402 E403	E397-S399 PolarHBondContact O-N 2.7Å; S399-I401 PolarHBondContact O-N 3.3Å; S399-S402 PolarHBondContact O-N 3.02Å; S399-E403 WeakPolarHBondContact O-CB 3.41Å; S399-E403 PolarHBondContact O-N 2.81Å
400	S	72.2	Confident	67.8	Low	49 Å²	49	88 Å²	88	34%	0.343	52%	0.516	S	S	.	.	H	α-helix	trans	-59.1	-40.9	172	52.6	0	0	0	0	113.9	N398 I404	N398-S400 PolarHBondContact O-N 3.29Å; N398-S400 VanDerWaalsContact O-N 3.08Å; S400-I404 VanDerWaalsContact O-CB 3.23Å; S400-I404 WeakPolarHBondContact O-CB 3.4Å; S400-I404 VanDerWaalsContact O-CD1 3.29Å; S400-I404 WeakPolarHBondContact O-CD1 3.44Å; S400-I404 WeakPolarHBondContact O-CG1 3.42Å; S400-I404 PolarHBondContact O-N 3.19Å
401	I	80	Confident	69.9	Low	54 Å²	54	85.9 Å²	85.9	28%	0.277	51%	0.511	S	S	.	.	H	α-helix	trans	-68.3	-40.9	176.9	-61.1	-179.7	0	0	0	110	T380 N398 S399 I404 E405	T380-I401 HydrophobicContact CG2-CG1 4.03Å; N398-I401 HydrophobicContact CB-CB 4.35Å; N398-I401 HydrophobicContact CB-CD1 3.96Å; N398-I401 HydrophobicContact CB-CG1 3.95Å; N398-I401 WeakPolarHBondContact O-CA 3.49Å; N398-I401 WeakPolarHBondContact O-CB 3.46Å; N398-I401 PolarHBondContact O-N 2.77Å; S399-I401 PolarHBondContact O-N 3.3Å; I401-I404 PolarHBondContact O-N 3.35Å; I401-E405 VanDerWaalsContact O-CB 3.26Å; I401-E405 WeakPolarHBondContact O-CB 3.25Å; I401-E405 PolarHBondContact O-N 3.35Å
402	S	79.3	Confident	72.2	Confident	64 Å²	64	78.5 Å²	78.5	45%	0.448	48%	0.477	S	S	.	.	H	α-helix	trans	-63	-43.7	177.2	-165.8	0	0	0	0	111.7	N398 S399 E405 A406	N398-S402 PolarHBondContact O-N 3.32Å; S399-S402 PolarHBondContact O-N 3.02Å; S402-E405 PolarHBondContact O-N 3.42Å; S402-A406 VanDerWaalsContact O-CB 3.31Å; S402-A406 WeakPolarHBondContact O-CB 3.25Å; S402-A406 PolarHBondContact O-N 3.38Å
403	E	84	Confident	74.5	Confident	117 Å²	117	74.9 Å²	74.9	55%	0.547	44%	0.439	S	S	.	.	H	α-helix	trans	-64.6	-44.3	175	-175.6	178.3	177.1	0	0	112.8	S399 A406 R407	S399-E403 WeakPolarHBondContact O-CB 3.41Å; S399-E403 PolarHBondContact O-N 2.81Å; E403-A406 PolarHBondContact O-N 3.07Å; E403-R407 WeakPolarHBondContact O-CG 3.31Å; E403-R407 PolarHBondContact O-N 3.42Å
404	I	86.8	Confident	76.9	Confident	28 Å²	28	73.7 Å²	73.7	14%	0.144	42%	0.423	C	S	.	.	H	α-helix	trans	-66.2	-37.8	178.8	-72.1	166.9	0	0	0	111.4	L354 T380 R383 S400 I401 R407 L408	L354-I404 HydrophobicContact CD2-CB 4.48Å; L354-I404 HydrophobicContact CD2-CG1 4.02Å; L354-I404 HydrophobicContact CD2-CG2 4.42Å; T380-I404 HydrophobicContact CG2-CD1 4Å; R383-I404 VanDerWaalsContact NH2-CG2 3.31Å; R383-I404 PolarHBondContact NH2-O 3.17Å; S400-I404 VanDerWaalsContact O-CB 3.23Å; S400-I404 WeakPolarHBondContact O-CB 3.4Å; S400-I404 VanDerWaalsContact O-CD1 3.29Å; S400-I404 WeakPolarHBondContact O-CD1 3.44Å; S400-I404 WeakPolarHBondContact O-CG1 3.42Å; S400-I404 PolarHBondContact O-N 3.19Å; I401-I404 PolarHBondContact O-N 3.35Å; I404-R407 PolarHBondContact O-N 3.37Å; I404-L408 PolarHBondContact O-N 3.27Å
405	E	87.6	Confident	79.3	Confident	69 Å²	69	68.6 Å²	68.6	32%	0.322	40%	0.395	S	S	.	.	H	α-helix	trans	-72.9	-35.2	176.7	-169.8	66.6	-173.9	0	0	112.2	R383 I401 S402 R407 L408 R410	R383-E405 WeakPolarHBondContact CD-OE2 3.08Å; R383-E405 IonicContact CZ-OE2 3.14Å; R383-E405 IonicContact NE-OE2 2.72Å; R383-E405 PolarHBondContact NE-OE2 3.01Å; R383-E405 IonicContact NH2-OE2 2.71Å; I401-E405 VanDerWaalsContact O-CB 3.26Å; I401-E405 WeakPolarHBondContact O-CB 3.25Å; I401-E405 PolarHBondContact O-N 3.35Å; S402-E405 PolarHBondContact O-N 3.42Å; E405-R407 VanDerWaalsContact C-N 3.33Å; E405-L408 CarbonylContact O-C 3.55Å; E405-L408 VanDerWaalsContact O-C 3.29Å; E405-R410 VanDerWaalsContact CD-N 3.26Å; E405-R410 VanDerWaalsContact OE1-CB 3.26Å; E405-R410 WeakPolarHBondContact OE1-CB 3.29Å; E405-R410 PolarHBondContact OE1-N 3.19Å; E405-R410 PolarHBondContact OE2-N 3.39Å; E405-R410 VanDerWaalsContact OE2-N 3.12Å
406	A	88.8	Confident	81.5	Confident	87 Å²	87	63.6 Å²	63.6	72%	0.719	37%	0.365	S	S	*	.	H	α-helix	trans	-67.9	-30.4	173.3	0	0	0	0	0	113.1	S402 E403	S402-A406 VanDerWaalsContact O-CB 3.31Å; S402-A406 WeakPolarHBondContact O-CB 3.25Å; S402-A406 PolarHBondContact O-N 3.38Å; E403-A406 PolarHBondContact O-N 3.07Å
407	R	92.3	Very high	83.7	Confident	88 Å²	88	58 Å²	58	33%	0.332	33%	0.331	S	S	.	.	H	α-helix	trans	-82.4	-31.8	176.6	-72.8	173.5	64.4	-165.5	-4.4	113.5	A350 S353 L354 E357 E403 I404 E405	A350-R407 VanDerWaalsContact CB-O 3.27Å; A350-R407 WeakPolarHBondContact CB-O 3.44Å; S353-R407 PolarHBondContact OG-NH2 3.17Å; L354-R407 HydrophobicContact CD1-CB 4.14Å; L354-R407 HydrophobicContact CD2-CB 4.4Å; L354-R407 VanDerWaalsContact CD2-CZ 3.49Å; E357-R407 IonicContact OE1-CZ 2.91Å; E357-R407 IonicContact OE1-NH1 2.65Å; E357-R407 IonicContact OE1-NH2 3.34Å; E357-R407 PolarHBondContact OE1-NH2 3.08Å; E357-R407 IonicContact OE2-CZ 3.83Å; E357-R407 IonicContact OE2-NH1 2.74Å; E357-R407 PolarHBondContact OE2-NH1 2.9Å; E357-R407 IonicContact OE2-NH2 3.08Å; E357-R407 PolarHBondContact OE2-NH2 3.46Å; E403-R407 WeakPolarHBondContact O-CG 3.31Å; E403-R407 PolarHBondContact O-N 3.42Å; I404-R407 PolarHBondContact O-N 3.37Å; E405-R407 VanDerWaalsContact C-N 3.33Å
408	L	91.8	Very high	85.6	Confident	2 Å²	2	59.7 Å²	59.7	1%	0.01	33%	0.33	C	S	.	.	S	Bend	trans	-150.8	108.9	174.5	179.3	66.3	0	0	0	109.4	D347 A350 L351 L354 R383 I404 E405 Q412 L413 L416	D347-L408 HydrophobicContact CB-CD1 3.89Å; A350-L408 HydrophobicContact CB-CB 4.31Å; L351-L408 HydrophobicContact CB-CD2 4.06Å; L351-L408 HydrophobicContact CD1-CD2 3.94Å; L354-L408 HydrophobicContact CD1-CB 3.63Å; L354-L408 HydrophobicContact CD1-CD2 4.34Å; R383-L408 PolarHBondContact NH2-O 3.28Å; I404-L408 PolarHBondContact O-N 3.27Å; E405-L408 CarbonylContact O-C 3.55Å; E405-L408 VanDerWaalsContact O-C 3.29Å; L408-Q412 HydrophobicContact CD1-CB 3.8Å; L408-L413 HydrophobicContact CD2-CB 4.13Å; L408-L413 HydrophobicContact CD2-CD1 4.25Å; L408-L413 HydrophobicContact CG-CB 4.46Å; L408-L416 HydrophobicContact CD1-CD1 4.12Å; L408-L416 HydrophobicContact CD2-CD1 4.4Å
409	P	91.4	Very high	87	Confident	56 Å²	56	56.3 Å²	56.3	36%	0.364	31%	0.312	S	S	.	.			trans	-62	143.9	178.8	-25.7	35.5	0	0	0	112.5	A411 Q412 L413	P409-A411 PolarHBondContact O-N 3.01Å; P409-A411 VanDerWaalsContact O-N 3.11Å; P409-Q412 HydrophobicContact CB-CG 4.32Å; P409-Q412 HydrophobicContact CG-CG 4.45Å; P409-Q412 WeakPolarHBondContact O-CB 3.35Å; P409-Q412 PolarHBondContact O-N 3.3Å; P409-L413 PolarHBondContact O-N 3.21Å; P409-L413 VanDerWaalsContact O-N 3.1Å
410	R	88.9	Confident	88.2	Confident	76 Å²	76	56.5 Å²	56.5	29%	0.287	30%	0.302	S	S	.	.	H	α-helix	trans	-53.2	-36.1	-179.6	-174.5	176.9	-178.2	145.4	8.6	112.9	R383 E405 Q412 L413 L414	R383-R410 PolarHBondContact O-NH1 2.96Å; R383-R410 PolarHBondContact O-NH2 3.06Å; E405-R410 VanDerWaalsContact CD-N 3.26Å; E405-R410 VanDerWaalsContact OE1-CB 3.26Å; E405-R410 WeakPolarHBondContact OE1-CB 3.29Å; E405-R410 PolarHBondContact OE1-N 3.19Å; E405-R410 PolarHBondContact OE2-N 3.39Å; E405-R410 VanDerWaalsContact OE2-N 3.12Å; R410-Q412 VanDerWaalsContact C-N 3.34Å; R410-Q412 PolarHBondContact O-N 2.83Å; R410-L413 PolarHBondContact O-N 2.99Å; R410-L414 HydrophobicContact CG-CD1 4.13Å; R410-L414 HydrophobicContact CG-CG 4.45Å; R410-L414 WeakPolarHBondContact O-CB 3.42Å; R410-L414 VanDerWaalsContact O-CG 3.25Å; R410-L414 WeakPolarHBondContact O-CG 3.33Å; R410-L414 PolarHBondContact O-N 2.89Å
411	A	88.9	Confident	89.1	Confident	72 Å²	72	55.9 Å²	55.9	60%	0.595	30%	0.3	S	S	*	.	H	α-helix	trans	-61.1	-41.4	176.2	0	0	0	0	0	112.3	P409 L414 A415	P409-A411 PolarHBondContact O-N 3.01Å; P409-A411 VanDerWaalsContact O-N 3.11Å; A411-L414 PolarHBondContact O-N 3.37Å; A411-A415 PolarHBondContact O-N 3.47Å
412	Q	91.2	Very high	89.7	Confident	42 Å²	42	53.3 Å²	53.3	20%	0.196	29%	0.287	C	S	.	.	H	α-helix	trans	-71.9	-40.7	178.5	-59.2	-69.1	59.1	0	0	111.3	N342 D347 L408 P409 R410 L414 A415 L416	N342-Q412 PolarHBondContact O-NE2 2.58Å; N342-Q412 PolarHBondContact O-OE1 3.07Å; D347-Q412 WeakPolarHBondContact OD1-CG 3.43Å; D347-Q412 PolarHBondContact OD2-NE2 3.2Å; L408-Q412 HydrophobicContact CD1-CB 3.8Å; P409-Q412 HydrophobicContact CB-CG 4.32Å; P409-Q412 HydrophobicContact CG-CG 4.45Å; P409-Q412 WeakPolarHBondContact O-CB 3.35Å; P409-Q412 PolarHBondContact O-N 3.3Å; R410-Q412 VanDerWaalsContact C-N 3.34Å; R410-Q412 PolarHBondContact O-N 2.83Å; Q412-L414 VanDerWaalsContact C-N 3.33Å; Q412-L414 PolarHBondContact O-N 3.32Å; Q412-A415 PolarHBondContact O-N 3.17Å; Q412-A415 VanDerWaalsContact O-N 3.16Å; Q412-L416 WeakPolarHBondContact O-CB 3.49Å; Q412-L416 WeakPolarHBondContact O-CG 3.35Å; Q412-L416 PolarHBondContact O-N 2.76Å
413	L	91.9	Very high	90.4	Very high	2 Å²	2	50.5 Å²	50.5	1%	0.01	27%	0.267	C	S	.	.	H	α-helix	trans	-57	-46.8	171	177.9	63.1	0	0	0	111.4	L351 W382 L408 P409 R410 A415 L416 C417	L351-L413 HydrophobicContact CD1-CD1 3.75Å; W382-L413 HydrophobicContact CE3-CD2 4.41Å; L408-L413 HydrophobicContact CD2-CB 4.13Å; L408-L413 HydrophobicContact CD2-CD1 4.25Å; L408-L413 HydrophobicContact CG-CB 4.46Å; P409-L413 PolarHBondContact O-N 3.21Å; P409-L413 VanDerWaalsContact O-N 3.1Å; R410-L413 PolarHBondContact O-N 2.99Å; L413-A415 VanDerWaalsContact C-N 3.25Å; L413-A415 PolarHBondContact O-N 2.98Å; L413-L416 PolarHBondContact O-N 3.23Å; L413-C417 WeakPolarHBondContact O-CB 3.07Å; L413-C417 PolarHBondContact O-N 3.33Å; L413-C417 PolarHBondContact O-SG 2.67Å
414	L	91.4	Very high	90.7	Very high	42 Å²	42	52.3 Å²	52.3	22%	0.22	27%	0.273	C	S	.	.	H	α-helix	trans	-66.3	-24.7	178.7	-71.1	173.2	0	0	0	113.6	R410 A411 Q412 R418 A474 I475	R410-L414 HydrophobicContact CG-CD1 4.13Å; R410-L414 HydrophobicContact CG-CG 4.45Å; R410-L414 WeakPolarHBondContact O-CB 3.42Å; R410-L414 VanDerWaalsContact O-CG 3.25Å; R410-L414 WeakPolarHBondContact O-CG 3.33Å; R410-L414 PolarHBondContact O-N 2.89Å; A411-L414 PolarHBondContact O-N 3.37Å; Q412-L414 VanDerWaalsContact C-N 3.33Å; Q412-L414 PolarHBondContact O-N 3.32Å; L414-R418 WeakPolarHBondContact O-CG 3.47Å; L414-R418 PolarHBondContact O-NE 2.87Å; L414-A474 WeakPolarHBondContact CD2-O 3.34Å; L414-I475 HydrophobicContact CD2-CD1 3.93Å
415	A	90.6	Very high	91.1	Very high	30 Å²	30	51.8 Å²	51.8	25%	0.248	27%	0.269	C	S	.	.	H	α-helix	trans	-78.2	-46.8	172.1	0	0	0	0	0	111.4	I343 A411 Q412 L413 C417 R418	I343-A415 HydrophobicContact CD1-CB 3.81Å; I343-A415 HydrophobicContact CG1-CB 4.37Å; A411-A415 PolarHBondContact O-N 3.47Å; Q412-A415 PolarHBondContact O-N 3.17Å; Q412-A415 VanDerWaalsContact O-N 3.16Å; L413-A415 VanDerWaalsContact C-N 3.25Å; L413-A415 PolarHBondContact O-N 2.98Å; A415-C417 VanDerWaalsContact C-N 3.34Å; A415-C417 PolarHBondContact O-N 3.22Å; A415-R418 WeakPolarHBondContact O-CB 3.13Å; A415-R418 PolarHBondContact O-N 3.14Å; A415-R418 VanDerWaalsContact O-N 3.08Å
416	L	91.1	Very high	91.5	Very high	0 Å²	0	48.5 Å²	48.5	0%	0	25%	0.254	C	S	.	.	H	α-helix	trans	-56.9	-43.8	174.3	-73.4	163.8	0	0	0	111.7	L335 I343 D347 V348 L351 L408 Q412 L413 R418 N419 V422	L335-L416 HydrophobicContact CD1-CD2 4.41Å; I343-L416 HydrophobicContact CD1-CD2 4.05Å; I343-L416 HydrophobicContact CD1-CG 4.09Å; I343-L416 HydrophobicContact CG2-CD2 3.85Å; I343-L416 HydrophobicContact CG2-CG 4.41Å; D347-L416 HydrophobicContact CB-CD1 4.36Å; V348-L416 HydrophobicContact CG2-CD2 4.33Å; L351-L416 HydrophobicContact CB-CD1 4.2Å; L351-L416 HydrophobicContact CD2-CB 4.19Å; L351-L416 HydrophobicContact CD2-CD1 3.95Å; L351-L416 HydrophobicContact CD2-CG 4.46Å; L408-L416 HydrophobicContact CD1-CD1 4.12Å; L408-L416 HydrophobicContact CD2-CD1 4.4Å; Q412-L416 WeakPolarHBondContact O-CB 3.49Å; Q412-L416 WeakPolarHBondContact O-CG 3.35Å; Q412-L416 PolarHBondContact O-N 2.76Å; L413-L416 PolarHBondContact O-N 3.23Å; L416-R418 PolarHBondContact O-N 2.97Å; L416-N419 WeakPolarHBondContact O-CB 3.45Å; L416-N419 PolarHBondContact O-N 3.48Å; L416-V422 HydrophobicContact CB-CG2 4.44Å; L416-V422 HydrophobicContact CD2-CG2 4.23Å; L416-V422 WeakPolarHBondContact O-CB 3.19Å; L416-V422 WeakPolarHBondContact O-CG2 3.49Å
417	C	92.3	Very high	91.8	Very high	0 Å²	0	45.4 Å²	45.4	0%	0	23%	0.227	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.9	1.1	177.1	-66.7	0	0	0	0	115.4	L413 A415 I475 P476 M479	L413-C417 WeakPolarHBondContact O-CB 3.07Å; L413-C417 PolarHBondContact O-N 3.33Å; L413-C417 PolarHBondContact O-SG 2.67Å; A415-C417 VanDerWaalsContact C-N 3.34Å; A415-C417 PolarHBondContact O-N 3.22Å; C417-I475 HydrophobicContact CB-CG2 4.47Å; C417-P476 HydrophobicContact CB-CG 4.04Å; C417-M479 HydrophobicContact CB-CB 4.25Å; C417-M479 HydrophobicContact CB-CE 4.08Å; C417-M479 HydrophobicContact CB-CG 4.2Å
418	R	91.1	Very high	91.8	Very high	186 Å²	186	43.7 Å²	43.7	70%	0.702	23%	0.226	S	C	*	.	T	Hydrogen-bonded Turn	trans	-101.5	-6.8	171.1	-62.8	171.6	-177.3	-172.1	-1.5	113.3	L414 A415 L416 P476	L414-R418 WeakPolarHBondContact O-CG 3.47Å; L414-R418 PolarHBondContact O-NE 2.87Å; A415-R418 WeakPolarHBondContact O-CB 3.13Å; A415-R418 PolarHBondContact O-N 3.14Å; A415-R418 VanDerWaalsContact O-N 3.08Å; L416-R418 PolarHBondContact O-N 2.97Å; R418-P476 HydrophobicContact CG-CB 4.25Å; R418-P476 HydrophobicContact CG-CG 3.87Å
419	N	89.8	Confident	91.9	Very high	21 Å²	21	43.7 Å²	43.7	11%	0.112	23%	0.226	C	C	.	.			trans	-90.7	130.6	-179	-176.4	-60.3	0	0	0	110.6	M340 L416 A421 V422 L423	M340-N419 HydrophobicContact CE-CB 4.36Å; M340-N419 VanDerWaalsContact CE-ND2 3.26Å; M340-N419 WeakPolarHBondContact CE-ND2 3.35Å; M340-N419 HydrophobicContact SD-CB 4.27Å; L416-N419 WeakPolarHBondContact O-CB 3.45Å; L416-N419 PolarHBondContact O-N 3.48Å; N419-A421 VanDerWaalsContact C-N 3.32Å; N419-A421 PolarHBondContact O-N 3.38Å; N419-A421 VanDerWaalsContact OD1-CB 3.3Å; N419-A421 WeakPolarHBondContact OD1-CB 3.45Å; N419-A421 PolarHBondContact OD1-N 2.92Å; N419-V422 HydrophobicContact CB-CB 4.36Å; N419-V422 HydrophobicContact CB-CG2 3.88Å; N419-V422 WeakPolarHBondContact O-CB 3.49Å; N419-V422 PolarHBondContact O-N 2.97Å; N419-V422 VanDerWaalsContact O-N 3.14Å; N419-L423 PolarHBondContact O-N 3.42Å
420	E	90.3	Very high	92.2	Very high	101 Å²	101	41.1 Å²	41.1	47%	0.472	21%	0.21	S	C	.	.	H	α-helix	trans	-66.1	-28.9	-175.8	-60.1	-61.3	147.3	0	0	113.5	L423 K424 R478	E420-L423 PolarHBondContact O-N 3.01Å; E420-L423 WeakPolarHBondContact OE2-CD1 3.18Å; E420-K424 WeakPolarHBondContact O-CB 3.41Å; E420-K424 PolarHBondContact O-N 2.85Å; E420-R478 IonicContact OE1-CZ 2.74Å; E420-R478 IonicContact OE1-NH1 2.97Å; E420-R478 PolarHBondContact OE1-NH1 3.5Å
421	A	91.3	Very high	92.4	Very high	36 Å²	36	39 Å²	39	30%	0.298	20%	0.203	S	C	.	.	H	α-helix	trans	-68.1	-39.7	172.8	0	0	0	0	0	111.2	L333 L335 N419 K424 W425	L333-A421 HydrophobicContact CD1-CB 4.47Å; L335-A421 HydrophobicContact CD2-CB 4.14Å; N419-A421 VanDerWaalsContact C-N 3.32Å; N419-A421 PolarHBondContact O-N 3.38Å; N419-A421 VanDerWaalsContact OD1-CB 3.3Å; N419-A421 WeakPolarHBondContact OD1-CB 3.45Å; N419-A421 PolarHBondContact OD1-N 2.92Å; A421-K424 PolarHBondContact O-N 2.67Å; A421-W425 WeakPolarHBondContact O-CB 3.33Å; A421-W425 PolarHBondContact O-N 3.5Å
422	V	93.3	Very high	92.7	Very high	0 Å²	0	37.5 Å²	37.5	0%	0	19%	0.185	C	C	.	.	H	α-helix	trans	-66.2	-41.3	174.9	-176.9	0	0	0	0	111.1	L333 L335 L351 L416 N419 M426 M479	L333-V422 HydrophobicContact CD1-CG2 4.34Å; L333-V422 HydrophobicContact CD2-CG2 4.11Å; L335-V422 HydrophobicContact CD2-CG2 3.69Å; L351-V422 HydrophobicContact CD2-CG1 3.86Å; L416-V422 HydrophobicContact CB-CG2 4.44Å; L416-V422 HydrophobicContact CD2-CG2 4.23Å; L416-V422 WeakPolarHBondContact O-CB 3.19Å; L416-V422 WeakPolarHBondContact O-CG2 3.49Å; N419-V422 HydrophobicContact CB-CB 4.36Å; N419-V422 HydrophobicContact CB-CG2 3.88Å; N419-V422 WeakPolarHBondContact O-CB 3.49Å; N419-V422 PolarHBondContact O-N 2.97Å; N419-V422 VanDerWaalsContact O-N 3.14Å; V422-M426 HydrophobicContact CG1-CE 4.33Å; V422-M426 HydrophobicContact CG1-CG 4.43Å; V422-M426 WeakPolarHBondContact O-CB 3.38Å; V422-M426 WeakPolarHBondContact O-CG 3.33Å; V422-M426 PolarHBondContact O-N 3.3Å; V422-M479 HydrophobicContact CG1-CE 4.2Å
423	L	92.9	Very high	92.9	Very high	5 Å²	5	35.6 Å²	35.6	3%	0.026	18%	0.176	C	C	.	.	H	α-helix	trans	-58.3	-51.6	174.5	-75.2	162.8	0	0	0	111.4	N419 E420 S427 R478 M479	N419-L423 PolarHBondContact O-N 3.42Å; E420-L423 PolarHBondContact O-N 3.01Å; E420-L423 WeakPolarHBondContact OE2-CD1 3.18Å; L423-S427 WeakPolarHBondContact O-CB 3.3Å; L423-S427 PolarHBondContact O-N 3.35Å; L423-S427 VanDerWaalsContact O-N 3.14Å; L423-R478 HydrophobicContact CD1-CB 4.04Å; L423-R478 HydrophobicContact CD2-CB 4.27Å; L423-M479 HydrophobicContact CD2-CB 3.73Å; L423-M479 HydrophobicContact CD2-CE 3.6Å; L423-M479 HydrophobicContact CD2-CG 4.4Å; L423-M479 HydrophobicContact CD2-SD 3.89Å; L423-M479 HydrophobicContact CG-CE 4.1Å
424	K	92.1	Very high	93.1	Very high	155 Å²	155	35.6 Å²	35.6	67%	0.674	18%	0.176	S	C	*	.	H	α-helix	trans	-63.5	-48.5	178.6	-174.7	172.4	-177.9	174	0	112	E420 A421 M426 S427 T428	E420-K424 WeakPolarHBondContact O-CB 3.41Å; E420-K424 PolarHBondContact O-N 2.85Å; A421-K424 PolarHBondContact O-N 2.67Å; K424-M426 PolarHBondContact O-N 3.15Å; K424-S427 WeakPolarHBondContact O-CB 3.33Å; K424-S427 PolarHBondContact O-N 3.28Å; K424-T428 PolarHBondContact O-N 2.82Å; K424-T428 PolarHBondContact O-OG1 3.23Å
425	W	94.8	Very high	93.3	Very high	18 Å²	18	34.2 Å²	34.2	7%	0.068	17%	0.168	C	C	.	.	H	α-helix	trans	-59.4	-46.4	179.9	170.5	82.8	0	0	0	112.4	I331 L333 L351 Q352 Y355 A421 S427 T428 C429	I331-W425 PolarHBondContact O-NE1 3.19Å; L333-W425 HydrophobicContact CB-CD2 3.99Å; L333-W425 HydrophobicContact CB-CG 4Å; L333-W425 HydrophobicContact CD1-CB 3.79Å; L333-W425 HydrophobicContact CD1-CD2 4.3Å; L333-W425 HydrophobicContact CD1-CG 3.9Å; L333-W425 HydrophobicContact CD2-CD2 4.14Å; L333-W425 HydrophobicContact CD2-CE3 3.95Å; L333-W425 HydrophobicContact CD2-CZ3 4.32Å; L333-W425 HydrophobicContact CG-CD2 4.37Å; L333-W425 HydrophobicContact CG-CG 4.37Å; L351-W425 HydrophobicContact CD2-CZ3 4.27Å; L351-W425 HydrophobicContact CG-CZ3 4.29Å; Q352-W425 HydrophobicContact CB-CH2 4.45Å; Q352-W425 HydrophobicContact CB-CZ2 4.29Å; Q352-W425 HydrophobicContact CG-CH2 3.93Å; Q352-W425 HydrophobicContact CG-CZ2 3.63Å; Y355-W425 AromaticContact CD1-CH2 3.37Å; Y355-W425 HydrophobicContact CD1-CH2 3.37Å; Y355-W425 HydrophobicContact CD1-CZ2 4.1Å; Y355-W425 AromaticContact CD1-CZ3 3.78Å; Y355-W425 HydrophobicContact CD1-CZ3 3.78Å; Y355-W425 HydrophobicContact CE1-CH2 4.12Å; Y355-W425 HydrophobicContact CE1-CZ3 4.26Å; Y355-W425 HydrophobicContact CG-CH2 4.1Å; Y355-W425 HydrophobicContact CG-CZ3 4.4Å; A421-W425 WeakPolarHBondContact O-CB 3.33Å; A421-W425 PolarHBondContact O-N 3.5Å; W425-S427 VanDerWaalsContact C-N 3.33Å; W425-S427 PolarHBondContact O-N 3.21Å; W425-T428 PolarHBondContact O-N 3.39Å; W425-C429 PolarHBondContact O-N 3.05Å; W425-C429 VanDerWaalsContact O-N 3.07Å; W425-C429 PolarHBondContact O-SG 3.29Å
426	M	95.4	Very high	93.4	Very high	0 Å²	0	33.4 Å²	33.4	0%	0	16%	0.161	C	C	.	.	H	α-helix	trans	-59.2	-44.9	175.8	-82.6	-159.1	178.8	0	0	111.5	L351 Y355 W382 V422 K424 C429 D430 M479 K483	L351-M426 HydrophobicContact CD1-CE 3.74Å; L351-M426 HydrophobicContact CD2-CE 4.09Å; L351-M426 HydrophobicContact CG-CE 4.26Å; Y355-M426 HydrophobicContact CE1-CG 4.37Å; Y355-M426 PolarHBondContact OH-O 3.49Å; W382-M426 HydrophobicContact CH2-CE 4.38Å; W382-M426 HydrophobicContact CH2-SD 4Å; V422-M426 HydrophobicContact CG1-CE 4.33Å; V422-M426 HydrophobicContact CG1-CG 4.43Å; V422-M426 WeakPolarHBondContact O-CB 3.38Å; V422-M426 WeakPolarHBondContact O-CG 3.33Å; V422-M426 PolarHBondContact O-N 3.3Å; K424-M426 PolarHBondContact O-N 3.15Å; M426-C429 CarbonylContact O-C 3.53Å; M426-C429 WeakPolarHBondContact O-CB 3.5Å; M426-C429 PolarHBondContact O-N 3.44Å; M426-D430 PolarHBondContact O-N 3.31Å; M426-M479 HydrophobicContact CB-CE 4.48Å; M426-M479 HydrophobicContact CB-SD 4.5Å; M426-M479 HydrophobicContact CE-CE 4.5Å; M426-M479 HydrophobicContact CG-CE 4.29Å; M426-M479 HydrophobicContact SD-CE 3.53Å; M426-M479 VanDerWaalsContact SD-CE 3.53Å; M426-M479 HydrophobicContact SD-SD 3.65Å; M426-M479 VanDerWaalsContact SD-SD 3.65Å; M426-K483 VanDerWaalsContact SD-CE 3.59Å
427	S	94.3	Very high	93.6	Very high	22 Å²	22	33.4 Å²	33.4	15%	0.154	16%	0.161	C	C	.	.	H	α-helix	trans	-59.4	-46.6	177.8	-172.8	0	0	0	0	112.5	L423 K424 W425 C429 D430 H431	L423-S427 WeakPolarHBondContact O-CB 3.3Å; L423-S427 PolarHBondContact O-N 3.35Å; L423-S427 VanDerWaalsContact O-N 3.14Å; K424-S427 WeakPolarHBondContact O-CB 3.33Å; K424-S427 PolarHBondContact O-N 3.28Å; W425-S427 VanDerWaalsContact C-N 3.33Å; W425-S427 PolarHBondContact O-N 3.21Å; S427-C429 VanDerWaalsContact C-N 3.29Å; S427-C429 PolarHBondContact O-N 3Å; S427-D430 WeakPolarHBondContact O-CB 3.47Å; S427-D430 PolarHBondContact O-N 3.44Å; S427-H431 VanDerWaalsContact O-CG 3.23Å; S427-H431 PolarHBondContact O-N 3.26Å; S427-H431 PolarHBondContact O-ND1 2.85Å; S427-H431 PolarHBondContact OG-CE1 3.23Å
428	T	92.9	Very high	93.8	Very high	52 Å²	52	33.4 Å²	33.4	32%	0.319	16%	0.162	S	C	.	.	H	α-helix	trans	-58.2	-42.4	174.8	-58.4	0	0	0	0	111.6	I331 K424 W425 H431 L432	I331-T428 HydrophobicContact CD1-CG2 4.29Å; K424-T428 PolarHBondContact O-N 2.82Å; K424-T428 PolarHBondContact O-OG1 3.23Å; W425-T428 PolarHBondContact O-N 3.39Å; T428-H431 PolarHBondContact O-N 3.03Å; T428-L432 HydrophobicContact CG2-CD1 4.31Å; T428-L432 WeakPolarHBondContact O-CG 3.44Å; T428-L432 PolarHBondContact O-N 3.46Å
429	C	95.1	Very high	93.8	Very high	1 Å²	1	27.5 Å²	27.5	1%	0.007	14%	0.142	C	C	.	.	H	α-helix	trans	-70.5	-35.9	177.9	-62.3	0	0	0	0	113.1	F330 Y355 W425 M426 S427 L432 M433	F330-C429 HydrophobicContact CD1-CB 4.26Å; F330-C429 HydrophobicContact CD2-CB 3.99Å; F330-C429 HydrophobicContact CE1-CB 4.22Å; F330-C429 HydrophobicContact CE2-CB 3.95Å; F330-C429 HydrophobicContact CG-CB 4.15Å; F330-C429 VanDerWaalsContact CG-SG 3.59Å; F330-C429 HydrophobicContact CZ-CB 4.07Å; Y355-C429 HydrophobicContact CE1-CB 3.55Å; W425-C429 PolarHBondContact O-N 3.05Å; W425-C429 VanDerWaalsContact O-N 3.07Å; W425-C429 PolarHBondContact O-SG 3.29Å; M426-C429 CarbonylContact O-C 3.53Å; M426-C429 WeakPolarHBondContact O-CB 3.5Å; M426-C429 PolarHBondContact O-N 3.44Å; S427-C429 VanDerWaalsContact C-N 3.29Å; S427-C429 PolarHBondContact O-N 3Å; C429-L432 PolarHBondContact O-N 3.37Å; C429-M433 WeakPolarHBondContact O-CB 3.47Å; C429-M433 PolarHBondContact O-N 3.19Å
430	D	95.9	Very high	94	Very high	3 Å²	3	26.5 Å²	26.5	2%	0.016	14%	0.137	C	C	.	.	H	α-helix	trans	-59	-48.6	169.8	-70	-61.2	0	0	0	110.3	Y355 M426 S427 L432 M433 Y434 K483 A486	Y355-D430 PolarHBondContact OH-OD1 3.09Å; Y355-D430 VanDerWaalsContact OH-OD1 3.12Å; M426-D430 PolarHBondContact O-N 3.31Å; S427-D430 WeakPolarHBondContact O-CB 3.47Å; S427-D430 PolarHBondContact O-N 3.44Å; D430-L432 VanDerWaalsContact C-N 3.31Å; D430-L432 PolarHBondContact O-N 2.85Å; D430-M433 PolarHBondContact O-N 3.08Å; D430-Y434 HydrophobicContact CB-CD2 4.04Å; D430-Y434 HydrophobicContact CB-CE2 3.65Å; D430-Y434 VanDerWaalsContact O-CB 3.32Å; D430-Y434 WeakPolarHBondContact O-CB 3.44Å; D430-Y434 WeakPolarHBondContact O-CD2 3.45Å; D430-Y434 VanDerWaalsContact O-CG 3.24Å; D430-Y434 PolarHBondContact O-N 2.86Å; D430-Y434 PolarHBondContact OD1-OH 3.22Å; D430-K483 IonicContact OD1-NZ 2.72Å; D430-K483 PolarHBondContact OD1-NZ 3.32Å; D430-K483 VanDerWaalsContact OD2-CD 3.3Å; D430-K483 WeakPolarHBondContact OD2-CD 3.48Å; D430-K483 WeakPolarHBondContact OD2-CE 3.18Å; D430-K483 IonicContact OD2-NZ 3.18Å; D430-K483 PolarHBondContact OD2-NZ 3.41Å; D430-A486 HydrophobicContact CB-CB 3.84Å
431	H	94.7	Very high	94.1	Very high	31 Å²	31	21.8 Å²	21.8	14%	0.144	11%	0.114	C	C	.	.	H	α-helix	trans	-63.8	-32.7	-179.9	-64.8	158.9	0	0	0	113.1	S427 T428 Q435 T647	S427-H431 VanDerWaalsContact O-CG 3.23Å; S427-H431 PolarHBondContact O-N 3.26Å; S427-H431 PolarHBondContact O-ND1 2.85Å; S427-H431 PolarHBondContact OG-CE1 3.23Å; T428-H431 PolarHBondContact O-N 3.03Å; H431-Q435 VanDerWaalsContact O-CB 3.23Å; H431-Q435 WeakPolarHBondContact O-CB 3.15Å; H431-Q435 PolarHBondContact O-N 2.66Å; H431-T647 PolarHBondContact O-OG1 3.49Å; H431-T647 VanDerWaalsContact O-OG1 3.08Å
432	L	93.9	Very high	94.3	Very high	40 Å²	40	20.4 Å²	20.4	21%	0.209	10%	0.102	C	C	.	.	H	α-helix	trans	-71	-49.1	172	-73.5	168.1	0	0	0	112	F330 T428 C429 D430 Q435 A436 T647	F330-L432 HydrophobicContact CD1-CD1 4.39Å; T428-L432 HydrophobicContact CG2-CD1 4.31Å; T428-L432 WeakPolarHBondContact O-CG 3.44Å; T428-L432 PolarHBondContact O-N 3.46Å; C429-L432 PolarHBondContact O-N 3.37Å; D430-L432 VanDerWaalsContact C-N 3.31Å; D430-L432 PolarHBondContact O-N 2.85Å; L432-Q435 PolarHBondContact O-N 3.32Å; L432-A436 PolarHBondContact O-N 2.89Å; L432-T647 HydrophobicContact CD2-CG2 3.93Å
433	M	95.5	Very high	94.2	Very high	2 Å²	2	23.1 Å²	23.1	1%	0.01	12%	0.12	C	C	.	.	H	α-helix	trans	-59.3	-55.6	177.5	173.2	-177.1	47.5	0	0	110.7	L327 C359 I362 C429 D430 Q435 A436 L437	L327-M433 HydrophobicContact CD2-CB 4.48Å; L327-M433 HydrophobicContact CD2-CG 4.33Å; C359-M433 HydrophobicContact CB-CG 4.35Å; C359-M433 HydrophobicContact CB-SD 3.56Å; C359-M433 VanDerWaalsContact CB-SD 3.56Å; I362-M433 HydrophobicContact CB-SD 4.14Å; I362-M433 HydrophobicContact CD1-CE 4.44Å; I362-M433 HydrophobicContact CD1-SD 4.06Å; I362-M433 HydrophobicContact CG2-SD 4.08Å; C429-M433 WeakPolarHBondContact O-CB 3.47Å; C429-M433 PolarHBondContact O-N 3.19Å; D430-M433 PolarHBondContact O-N 3.08Å; M433-Q435 VanDerWaalsContact C-N 3.26Å; M433-Q435 PolarHBondContact O-N 3.12Å; M433-A436 WeakPolarHBondContact O-CB 3.36Å; M433-A436 PolarHBondContact O-N 2.71Å; M433-A436 VanDerWaalsContact O-N 3.08Å; M433-L437 HydrophobicContact CG-CD1 4.28Å; M433-L437 HydrophobicContact CG-CG 4.37Å; M433-L437 WeakPolarHBondContact O-CG 3.49Å; M433-L437 PolarHBondContact O-N 2.65Å
434	Y	96.2	Very high	94.2	Very high	3 Å²	3	26 Å²	26	1%	0.012	14%	0.135	C	C	.	.	H	α-helix	trans	-61.4	-34	-177	-64.5	-33.1	0	0	0	112.4	D430 L437 V438 A486 V487 F490 I649	D430-Y434 HydrophobicContact CB-CD2 4.04Å; D430-Y434 HydrophobicContact CB-CE2 3.65Å; D430-Y434 VanDerWaalsContact O-CB 3.32Å; D430-Y434 WeakPolarHBondContact O-CB 3.44Å; D430-Y434 WeakPolarHBondContact O-CD2 3.45Å; D430-Y434 VanDerWaalsContact O-CG 3.24Å; D430-Y434 PolarHBondContact O-N 2.86Å; D430-Y434 PolarHBondContact OD1-OH 3.22Å; Y434-L437 HydrophobicContact CD1-CD1 4.08Å; Y434-L437 PolarHBondContact O-N 2.85Å; Y434-V438 WeakPolarHBondContact O-CG2 3.28Å; Y434-V438 PolarHBondContact O-N 3.06Å; Y434-A486 HydrophobicContact CD2-CB 4.34Å; Y434-A486 HydrophobicContact CE2-CB 3.99Å; Y434-V487 HydrophobicContact CE1-CG2 4.47Å; Y434-V487 HydrophobicContact CE2-CG2 3.75Å; Y434-V487 WeakPolarHBondContact OH-CG2 3.21Å; Y434-F490 HydrophobicContact CD1-CB 4.27Å; Y434-F490 AromaticContact CD1-CD1 3.4Å; Y434-F490 HydrophobicContact CD1-CD1 3.4Å; Y434-F490 HydrophobicContact CD1-CD2 4.33Å; Y434-F490 AromaticContact CD1-CE1 3.69Å; Y434-F490 HydrophobicContact CD1-CE1 3.69Å; Y434-F490 AromaticContact CD1-CG 3.76Å; Y434-F490 HydrophobicContact CD1-CG 3.76Å; Y434-F490 HydrophobicContact CD1-CZ 4.26Å; Y434-F490 HydrophobicContact CD2-CB 3.79Å; Y434-F490 HydrophobicContact CD2-CD1 4.34Å; Y434-F490 HydrophobicContact CD2-CG 4.2Å; Y434-F490 AromaticContact CE1-CD1 3.86Å; Y434-F490 HydrophobicContact CE1-CD1 3.86Å; Y434-F490 HydrophobicContact CE1-CE1 4.14Å; Y434-F490 HydrophobicContact CG-CB 3.67Å; Y434-F490 AromaticContact CG-CD1 3.73Å; Y434-F490 HydrophobicContact CG-CD1 3.73Å; Y434-F490 HydrophobicContact CG-CD2 4.15Å; Y434-F490 HydrophobicContact CG-CE1 4.38Å; Y434-F490 AromaticContact CG-CG 3.59Å; Y434-F490 HydrophobicContact CG-CG 3.59Å; Y434-I649 WeakPolarHBondContact O-CD1 3.39Å
435	Q	95.1	Very high	94.3	Very high	12 Å²	12	18.8 Å²	18.8	6%	0.056	10%	0.104	C	C	.	.	H	α-helix	trans	-62.7	-46.9	173.8	178.7	62.5	29.3	0	0	111	H431 L432 M433 L437 V438 E439 T647 I649	H431-Q435 VanDerWaalsContact O-CB 3.23Å; H431-Q435 WeakPolarHBondContact O-CB 3.15Å; H431-Q435 PolarHBondContact O-N 2.66Å; L432-Q435 PolarHBondContact O-N 3.32Å; M433-Q435 VanDerWaalsContact C-N 3.26Å; M433-Q435 PolarHBondContact O-N 3.12Å; Q435-L437 VanDerWaalsContact C-N 3.31Å; Q435-L437 PolarHBondContact O-N 2.99Å; Q435-V438 PolarHBondContact O-N 2.62Å; Q435-E439 WeakPolarHBondContact CG-OE1 3.47Å; Q435-E439 PolarHBondContact NE2-OE1 3.06Å; Q435-E439 PolarHBondContact O-N 3.42Å; Q435-T647 HydrophobicContact CB-CG2 3.93Å; Q435-T647 HydrophobicContact CG-CG2 4.11Å; Q435-I649 HydrophobicContact CB-CD1 4.41Å
436	A	94.1	Very high	94.4	Very high	13 Å²	13	18.4 Å²	18.4	11%	0.107	10%	0.103	C	C	.	.	H	α-helix	trans	-60.2	-39.7	175.3	0	0	0	0	0	112	L327 L432 M433 E439 I440	L327-A436 HydrophobicContact CD2-CB 4.17Å; L432-A436 PolarHBondContact O-N 2.89Å; M433-A436 WeakPolarHBondContact O-CB 3.36Å; M433-A436 PolarHBondContact O-N 2.71Å; M433-A436 VanDerWaalsContact O-N 3.08Å; A436-E439 PolarHBondContact O-N 3.16Å; A436-I440 WeakPolarHBondContact O-CB 3.3Å; A436-I440 WeakPolarHBondContact O-CD1 3.49Å; A436-I440 VanDerWaalsContact O-CG1 3.26Å; A436-I440 WeakPolarHBondContact O-CG1 3.45Å; A436-I440 PolarHBondContact O-N 3.36Å
437	L	95.6	Very high	94.3	Very high	0 Å²	0	23.7 Å²	23.7	0%	0	12%	0.123	C	C	.	.	H	α-helix	trans	-65	-38.2	175.7	-58.2	-176.3	0	0	0	112.6	I362 L363 V366 M433 Y434 Q435 I440 L441 F490	I362-L437 HydrophobicContact CG2-CD1 3.91Å; L363-L437 HydrophobicContact CB-CD2 4.37Å; L363-L437 HydrophobicContact CD1-CD2 3.85Å; V366-L437 HydrophobicContact CB-CD2 4Å; V366-L437 HydrophobicContact CG1-CD2 3.98Å; V366-L437 HydrophobicContact CG2-CD1 4.23Å; V366-L437 HydrophobicContact CG2-CD2 4.21Å; M433-L437 HydrophobicContact CG-CD1 4.28Å; M433-L437 HydrophobicContact CG-CG 4.37Å; M433-L437 WeakPolarHBondContact O-CG 3.49Å; M433-L437 PolarHBondContact O-N 2.65Å; Y434-L437 HydrophobicContact CD1-CD1 4.08Å; Y434-L437 PolarHBondContact O-N 2.85Å; Q435-L437 VanDerWaalsContact C-N 3.31Å; Q435-L437 PolarHBondContact O-N 2.99Å; L437-I440 PolarHBondContact O-N 2.97Å; L437-L441 WeakPolarHBondContact O-CB 3.23Å; L437-L441 VanDerWaalsContact O-CG 3.28Å; L437-L441 WeakPolarHBondContact O-CG 3.42Å; L437-L441 PolarHBondContact O-N 3.4Å; L437-F490 HydrophobicContact CB-CE2 3.88Å; L437-F490 HydrophobicContact CB-CZ 3.83Å; L437-F490 HydrophobicContact CD1-CE1 4.18Å; L437-F490 HydrophobicContact CD1-CZ 3.77Å; L437-F490 HydrophobicContact CG-CZ 4.47Å
438	V	95	Very high	94.1	Very high	1 Å²	1	26 Å²	26	1%	0.006	14%	0.138	C	C	.	.	H	α-helix	trans	-64.1	-47.9	174.4	171.6	0	0	0	0	110.7	Y434 Q435 I440 L441 I442 F490 T493 L494 Y497 I649	Y434-V438 WeakPolarHBondContact O-CG2 3.28Å; Y434-V438 PolarHBondContact O-N 3.06Å; Q435-V438 PolarHBondContact O-N 2.62Å; V438-I440 VanDerWaalsContact C-N 3.26Å; V438-I440 PolarHBondContact O-N 3.47Å; V438-L441 PolarHBondContact O-N 3.28Å; V438-I442 PolarHBondContact O-N 3.14Å; V438-F490 HydrophobicContact CG2-CD2 3.67Å; V438-F490 HydrophobicContact CG2-CE2 3.71Å; V438-T493 HydrophobicContact CG1-CG2 4Å; V438-T493 HydrophobicContact CG2-CG2 3.98Å; V438-L494 HydrophobicContact CG2-CD2 3.93Å; V438-L494 HydrophobicContact CG2-CG 4.28Å; V438-Y497 HydrophobicContact CG1-CD2 3.52Å; V438-Y497 HydrophobicContact CG1-CE2 3.48Å; V438-Y497 VanDerWaalsContact CG1-CE2 3.48Å; V438-I649 HydrophobicContact CG2-CD1 3.83Å
439	E	92.4	Very high	94.1	Very high	61 Å²	61	24.7 Å²	24.7	29%	0.285	13%	0.128	S	C	.	.	H	α-helix	trans	-64.3	-29.9	179.1	-70.7	178.6	-144.1	0	0	112.9	R325 Q435 A436 P443	R325-E439 IonicContact CZ-OE2 3.53Å; R325-E439 IonicContact NH1-OE2 2.99Å; R325-E439 PolarHBondContact NH1-OE2 3.2Å; R325-E439 IonicContact NH2-OE2 3.49Å; R325-E439 PolarHBondContact NH2-OE2 3.16Å; Q435-E439 WeakPolarHBondContact CG-OE1 3.47Å; Q435-E439 PolarHBondContact NE2-OE1 3.06Å; Q435-E439 PolarHBondContact O-N 3.42Å; A436-E439 PolarHBondContact O-N 3.16Å; E439-P443 WeakPolarHBondContact O-CA 3.49Å; E439-P443 WeakPolarHBondContact O-CB 3.35Å
440	I	92.4	Very high	93.9	Very high	1 Å²	1	26.1 Å²	26.1	1%	0.005	14%	0.138	C	C	.	.	H	α-helix	trans	-74.5	-43.9	174.6	-72.3	167.1	0	0	0	111.6	L320 A321 L363 V367 A436 L437 V438	L320-I440 VanDerWaalsContact CA-O 3.26Å; L320-I440 WeakPolarHBondContact CA-O 3.48Å; L320-I440 HydrophobicContact CB-CG2 4.44Å; L320-I440 WeakPolarHBondContact CB-O 3.39Å; L320-I440 WeakPolarHBondContact CD2-O 3.46Å; A321-I440 HydrophobicContact CB-CG1 4.2Å; A321-I440 PolarHBondContact N-O 3.34Å; A321-I440 VanDerWaalsContact N-O 3.08Å; L363-I440 HydrophobicContact CD1-CD1 3.37Å; V367-I440 HydrophobicContact CG2-CD1 4.33Å; V367-I440 HydrophobicContact CG2-CG2 4.04Å; A436-I440 WeakPolarHBondContact O-CB 3.3Å; A436-I440 WeakPolarHBondContact O-CD1 3.49Å; A436-I440 VanDerWaalsContact O-CG1 3.26Å; A436-I440 WeakPolarHBondContact O-CG1 3.45Å; A436-I440 PolarHBondContact O-N 3.36Å; L437-I440 PolarHBondContact O-N 2.97Å; V438-I440 VanDerWaalsContact C-N 3.26Å; V438-I440 PolarHBondContact O-N 3.47Å
441	L	93.9	Very high	93.6	Very high	1 Å²	1	31 Å²	31	1%	0.005	17%	0.172	C	C	.	.	H	α-helix	trans	-76.6	-28.8	-177.9	-71.2	174	0	0	0	113.7	L320 V366 L369 F371 L437 V438 I457 F460 L494	L320-L441 HydrophobicContact CD2-CD2 4.1Å; V366-L441 HydrophobicContact CG1-CD1 3.92Å; V366-L441 HydrophobicContact CG1-CD2 3.93Å; V366-L441 HydrophobicContact CG1-CG 3.88Å; L369-L441 HydrophobicContact CD2-CD2 3.98Å; F371-L441 HydrophobicContact CE1-CD1 4.26Å; F371-L441 HydrophobicContact CE1-CD2 4.06Å; F371-L441 HydrophobicContact CZ-CD2 3.84Å; L437-L441 WeakPolarHBondContact O-CB 3.23Å; L437-L441 VanDerWaalsContact O-CG 3.28Å; L437-L441 WeakPolarHBondContact O-CG 3.42Å; L437-L441 PolarHBondContact O-N 3.4Å; V438-L441 PolarHBondContact O-N 3.28Å; L441-I457 HydrophobicContact CB-CD1 4.15Å; L441-I457 HydrophobicContact CD2-CD1 4.38Å; L441-I457 HydrophobicContact CD2-CG1 4.26Å; L441-F460 HydrophobicContact CD1-CD1 4.36Å; L441-F460 HydrophobicContact CD1-CE1 4.06Å; L441-L494 HydrophobicContact CB-CD2 4.39Å; L441-L494 HydrophobicContact CD1-CD1 4.38Å; L441-L494 HydrophobicContact CD1-CD2 4.01Å
442	I	94.4	Very high	93.3	Very high	7 Å²	7	32.2 Å²	32.2	4%	0.036	19%	0.187	C	C	.	.			trans	-142.2	68.3	-175.1	-44.6	174.2	0	0	0	109.2	V438 D444 V445 I449 I457 L494 T498	V438-I442 PolarHBondContact O-N 3.14Å; I442-D444 VanDerWaalsContact C-N 3.28Å; I442-D444 PolarHBondContact O-N 2.99Å; I442-V445 HydrophobicContact CG2-CG1 4.12Å; I442-I449 HydrophobicContact CG2-CD1 3.96Å; I442-I457 HydrophobicContact CG1-CD1 4.48Å; I442-L494 HydrophobicContact CD1-CD2 4Å; I442-T498 HydrophobicContact CD1-CG2 3.72Å
443	P	90.9	Very high	93.2	Very high	58 Å²	58	30.4 Å²	30.4	38%	0.377	18%	0.178	S	C	.	.	S	Bend	trans	-67.9	-23.5	-175.2	25.9	-35.8	0	0	0	114.5	A321 E439	A321-P443 HydrophobicContact CB-CB 4.17Å; E439-P443 WeakPolarHBondContact O-CA 3.49Å; E439-P443 WeakPolarHBondContact O-CB 3.35Å
444	D	92.6	Very high	93	Very high	66 Å²	66	31.1 Å²	31.1	35%	0.353	18%	0.182	S	C	.	.			trans	-144.2	116.6	175	173.8	3.5	0	0	0	108.3	I442 L446 R447	I442-D444 VanDerWaalsContact C-N 3.28Å; I442-D444 PolarHBondContact O-N 2.99Å; D444-L446 PolarHBondContact O-N 3.08Å; D444-L446 WeakPolarHBondContact OD1-CA 3.39Å; D444-L446 WeakPolarHBondContact OD1-CB 3.49Å; D444-L446 PolarHBondContact OD1-N 3Å; D444-R447 HydrophobicContact CB-CB 3.82Å; D444-R447 PolarHBondContact O-N 2.98Å; D444-R447 PolarHBondContact OD1-N 3.3Å; D444-R447 WeakPolarHBondContact OD2-CB 3.35Å; D444-R447 PolarHBondContact OD2-N 2.91Å
445	V	95.6	Very high	92.9	Very high	2 Å²	2	35.8 Å²	35.8	1%	0.012	20%	0.204	C	C	.	.	S	Bend	trans	-68.2	-16.6	179.4	-63.1	0	0	0	0	113	I442 Y497 L500 N501 Y631 Y634	I442-V445 HydrophobicContact CG2-CG1 4.12Å; V445-Y497 HydrophobicContact CG1-CD2 4.15Å; V445-Y497 HydrophobicContact CG1-CG 4.12Å; V445-L500 HydrophobicContact CB-CD2 3.98Å; V445-L500 HydrophobicContact CB-CG 4.12Å; V445-L500 HydrophobicContact CG1-CD2 4.2Å; V445-L500 HydrophobicContact CG2-CD2 3.88Å; V445-L500 HydrophobicContact CG2-CG 4.26Å; V445-N501 WeakPolarHBondContact O-CA 3.49Å; V445-N501 WeakPolarHBondContact O-CB 3.24Å; V445-N501 PolarHBondContact O-ND2 2.8Å; V445-Y631 HydrophobicContact CG2-CD2 4.23Å; V445-Y631 HydrophobicContact CG2-CE2 3.85Å; V445-Y634 HydrophobicContact CG1-CD2 4.29Å; V445-Y634 HydrophobicContact CG1-CE2 3.8Å; V445-Y634 HydrophobicContact CG2-CD1 4.38Å; V445-Y634 HydrophobicContact CG2-CE1 4.03Å; V445-Y634 HydrophobicContact CG2-CE2 4.3Å
446	L	95.9	Very high	92.9	Very high	11 Å²	11	36.9 Å²	36.9	6%	0.058	22%	0.215	C	C	.	.	S	Bend	trans	-92.8	-30.8	178.3	-52.8	176.9	0	0	0	112.6	D444 A504 Q505 R508 L564 A568 Y631	D444-L446 PolarHBondContact O-N 3.08Å; D444-L446 WeakPolarHBondContact OD1-CA 3.39Å; D444-L446 WeakPolarHBondContact OD1-CB 3.49Å; D444-L446 PolarHBondContact OD1-N 3Å; L446-A504 HydrophobicContact CD2-CB 4.05Å; L446-Q505 PolarHBondContact O-NE2 3.22Å; L446-R508 PolarHBondContact O-NH1 2.82Å; L446-R508 PolarHBondContact O-NH2 3.32Å; L446-L564 HydrophobicContact CD2-CD2 4.37Å; L446-L564 HydrophobicContact CD2-CG 4.47Å; L446-A568 HydrophobicContact CD1-CB 3.41Å; L446-A568 VanDerWaalsContact CD1-CB 3.41Å; L446-Y631 HydrophobicContact CD2-CD2 4.27Å; L446-Y631 HydrophobicContact CD2-CE2 4.04Å; L446-Y631 HydrophobicContact CG-CE2 4.39Å
447	R	93.1	Very high	93	Very high	111 Å²	111	36.2 Å²	36.2	42%	0.419	21%	0.21	S	C	.	.	S	Bend	trans	-62	137.1	-178.1	-175.7	170	174.7	-165.8	-8.9	111.9	Q318 D444 I449 N501	Q318-R447 PolarHBondContact O-NH2 2.82Å; D444-R447 HydrophobicContact CB-CB 3.82Å; D444-R447 PolarHBondContact O-N 2.98Å; D444-R447 PolarHBondContact OD1-N 3.3Å; D444-R447 WeakPolarHBondContact OD2-CB 3.35Å; D444-R447 PolarHBondContact OD2-N 2.91Å; R447-I449 PolarHBondContact O-N 3.4Å; R447-N501 PolarHBondContact O-ND2 2.9Å
448	P	91.5	Very high	93	Very high	70 Å²	70	39.5 Å²	39.5	46%	0.455	22%	0.222	S	C	.	.	P	Polyproline II helix	trans	-62.4	119.9	178.7	-19.7	29.7	0	0	0	112.8
449	I	91.4	Very high	93	Very high	24 Å²	24	43.7 Å²	43.7	12%	0.123	25%	0.245	C	C	.	.	P	Polyproline II helix	trans	-101.2	134.8	175.4	-55.8	178.5	0	0	0	109.6	I442 R447 S451 L453 T454	I442-I449 HydrophobicContact CG2-CD1 3.96Å; R447-I449 PolarHBondContact O-N 3.4Å; I449-S451 PolarHBondContact O-N 2.87Å; I449-L453 HydrophobicContact CG2-CB 4.23Å; I449-L453 HydrophobicContact CG2-CD2 3.97Å; I449-L453 HydrophobicContact CG2-CG 4.12Å; I449-T454 VanDerWaalsContact CG2-OG1 3.3Å; I449-T454 WeakPolarHBondContact CG2-OG1 3.43Å
450	P	91.3	Very high	93.2	Very high	32 Å²	32	41.1 Å²	41.1	21%	0.208	23%	0.232	C	C	.	.	P	Polyproline II helix	trans	-58	131.7	176.1	-25.6	35.1	0	0	0	112.2	F319 A452 L453 T454	F319-P450 HydrophobicContact CD1-CG 4.11Å; F319-P450 HydrophobicContact CD2-CG 3.7Å; F319-P450 HydrophobicContact CE1-CG 3.89Å; F319-P450 HydrophobicContact CE2-CG 3.48Å; F319-P450 VanDerWaalsContact CE2-CG 3.48Å; F319-P450 HydrophobicContact CG-CG 4.02Å; F319-P450 HydrophobicContact CZ-CG 3.58Å; P450-A452 PolarHBondContact O-N 2.93Å; P450-L453 HydrophobicContact CB-CB 4.43Å; P450-L453 WeakPolarHBondContact O-CB 3.34Å; P450-L453 PolarHBondContact O-N 2.96Å; P450-T454 PolarHBondContact O-N 3.06Å; P450-T454 PolarHBondContact O-OG1 3.2Å
451	S	88.9	Confident	93.4	Very high	106 Å²	106	41 Å²	41	74%	0.741	23%	0.232	S	C	*	.	H	α-helix	trans	-58	-28.1	-175.6	56.9	0	0	0	0	114.3	I449 Q455	I449-S451 PolarHBondContact O-N 2.87Å; S451-Q455 WeakPolarHBondContact O-CB 3.35Å; S451-Q455 PolarHBondContact O-N 2.99Å
452	A	89.5	Confident	93.6	Very high	55 Å²	55	49 Å²	49	46%	0.455	27%	0.267	S	S	.	.	H	α-helix	trans	-66.3	-45.8	172.5	0	0	0	0	0	112.4	P450 Q455 A456	P450-A452 PolarHBondContact O-N 2.93Å; A452-Q455 PolarHBondContact O-N 2.93Å; A452-A456 WeakPolarHBondContact O-CB 3.45Å; A452-A456 PolarHBondContact O-N 2.65Å
453	L	91	Very high	93.7	Very high	2 Å²	2	50.8 Å²	50.8	1%	0.01	28%	0.28	C	S	.	.	H	α-helix	trans	-65.3	-45.4	174.8	178.4	57.8	0	0	0	110.9	H316 F319 L320 L369 I449 P450 Q455 A456 I457	H316-L453 HydrophobicContact CB-CD1 4.33Å; H316-L453 HydrophobicContact CB-CD2 4.21Å; F319-L453 HydrophobicContact CB-CD2 4.03Å; L320-L453 HydrophobicContact CD2-CD2 4.48Å; L369-L453 HydrophobicContact CD1-CD1 4.11Å; L369-L453 HydrophobicContact CD2-CD1 3.89Å; I449-L453 HydrophobicContact CG2-CB 4.23Å; I449-L453 HydrophobicContact CG2-CD2 3.97Å; I449-L453 HydrophobicContact CG2-CG 4.12Å; P450-L453 HydrophobicContact CB-CB 4.43Å; P450-L453 WeakPolarHBondContact O-CB 3.34Å; P450-L453 PolarHBondContact O-N 2.96Å; L453-Q455 VanDerWaalsContact C-N 3.28Å; L453-Q455 PolarHBondContact O-N 3.14Å; L453-A456 WeakPolarHBondContact O-CB 3.44Å; L453-A456 PolarHBondContact O-N 2.82Å; L453-A456 VanDerWaalsContact O-N 3.08Å; L453-I457 HydrophobicContact CD1-CD1 4.02Å; L453-I457 HydrophobicContact CD1-CG1 4.2Å; L453-I457 HydrophobicContact CG-CD1 3.94Å; L453-I457 WeakPolarHBondContact O-CG1 3.26Å; L453-I457 PolarHBondContact O-N 3.42Å
454	T	93	Very high	94	Very high	17 Å²	17	48.1 Å²	48.1	10%	0.104	26%	0.262	C	S	.	.	H	α-helix	trans	-57.9	-40.3	175.3	-49.7	0	0	0	0	111.8	I449 P450 R458 T498	I449-T454 VanDerWaalsContact CG2-OG1 3.3Å; I449-T454 WeakPolarHBondContact CG2-OG1 3.43Å; P450-T454 PolarHBondContact O-N 3.06Å; P450-T454 PolarHBondContact O-OG1 3.2Å; T454-R458 WeakPolarHBondContact O-CB 3.33Å; T454-R458 VanDerWaalsContact O-CG 3.25Å; T454-R458 WeakPolarHBondContact O-CG 3.27Å; T454-R458 PolarHBondContact O-N 3.47Å; T454-T498 HydrophobicContact CG2-CG2 3.97Å
455	Q	93.4	Very high	94.1	Very high	102 Å²	102	47.9 Å²	47.9	48%	0.477	26%	0.259	S	S	.	.	H	α-helix	trans	-71.9	-35.1	175.6	-170.9	62.5	63.8	0	0	112.5	S451 A452 L453 R458 N459	S451-Q455 WeakPolarHBondContact O-CB 3.35Å; S451-Q455 PolarHBondContact O-N 2.99Å; A452-Q455 PolarHBondContact O-N 2.93Å; L453-Q455 VanDerWaalsContact C-N 3.28Å; L453-Q455 PolarHBondContact O-N 3.14Å; Q455-R458 PolarHBondContact O-N 2.98Å; Q455-N459 PolarHBondContact NE2-OD1 3.41Å; Q455-N459 WeakPolarHBondContact O-CB 3.45Å; Q455-N459 PolarHBondContact O-N 2.86Å; Q455-N459 PolarHBondContact O-ND2 2.75Å; Q455-N459 PolarHBondContact O-OD1 3.33Å
456	A	94.1	Very high	94.1	Very high	34 Å²	34	49.5 Å²	49.5	28%	0.281	28%	0.277	S	S	.	.	H	α-helix	trans	-62.9	-48	174.2	0	0	0	0	0	111.3	F371 A452 L453 R458 N459 F460	F371-A456 HydrophobicContact CE2-CB 4.22Å; A452-A456 WeakPolarHBondContact O-CB 3.45Å; A452-A456 PolarHBondContact O-N 2.65Å; L453-A456 WeakPolarHBondContact O-CB 3.44Å; L453-A456 PolarHBondContact O-N 2.82Å; L453-A456 VanDerWaalsContact O-N 3.08Å; A456-R458 PolarHBondContact O-N 3.45Å; A456-N459 PolarHBondContact O-N 3.26Å; A456-F460 WeakPolarHBondContact O-CB 3.44Å; A456-F460 PolarHBondContact O-N 3.12Å
457	I	96.2	Very high	94.1	Very high	0 Å²	0	51.1 Å²	51.1	0%	0	28%	0.282	C	S	.	.	H	α-helix	trans	-59.1	-44.2	175.2	-66.5	165.6	0	0	0	110.9	F371 L441 I442 L453 N459 F460 A461 L494 T498	F371-I457 HydrophobicContact CZ-CG1 4.46Å; L441-I457 HydrophobicContact CB-CD1 4.15Å; L441-I457 HydrophobicContact CD2-CD1 4.38Å; L441-I457 HydrophobicContact CD2-CG1 4.26Å; I442-I457 HydrophobicContact CG1-CD1 4.48Å; L453-I457 HydrophobicContact CD1-CD1 4.02Å; L453-I457 HydrophobicContact CD1-CG1 4.2Å; L453-I457 HydrophobicContact CG-CD1 3.94Å; L453-I457 WeakPolarHBondContact O-CG1 3.26Å; L453-I457 PolarHBondContact O-N 3.42Å; I457-N459 PolarHBondContact O-N 3.06Å; I457-F460 PolarHBondContact O-N 3Å; I457-A461 VanDerWaalsContact O-CB 3.23Å; I457-A461 WeakPolarHBondContact O-CB 3.49Å; I457-A461 PolarHBondContact O-N 2.97Å; I457-L494 HydrophobicContact CG2-CB 4.17Å; I457-L494 HydrophobicContact CG2-CD1 4.37Å; I457-L494 HydrophobicContact CG2-CD2 3.97Å; I457-L494 HydrophobicContact CG2-CG 4.41Å; I457-T498 HydrophobicContact CB-CG2 4.28Å; I457-T498 HydrophobicContact CG2-CG2 3.79Å
458	R	96.1	Very high	94.2	Very high	68 Å²	68	45.9 Å²	45.9	26%	0.257	26%	0.262	S	S	.	.	H	α-helix	trans	-66.8	-34	176.8	-73	175.6	-178.6	-78.4	12.4	113.7	T454 Q455 A456 K462 R495 T498 S499	T454-R458 WeakPolarHBondContact O-CB 3.33Å; T454-R458 VanDerWaalsContact O-CG 3.25Å; T454-R458 WeakPolarHBondContact O-CG 3.27Å; T454-R458 PolarHBondContact O-N 3.47Å; Q455-R458 PolarHBondContact O-N 2.98Å; A456-R458 PolarHBondContact O-N 3.45Å; R458-K462 PolarHBondContact O-N 3.03Å; R458-R495 PolarHBondContact NH1-O 3.08Å; R458-T498 HydrophobicContact CG-CG2 4.45Å; R458-T498 WeakPolarHBondContact CG-OG1 3.19Å; R458-T498 PolarHBondContact NE-OG1 3.22Å; R458-T498 PolarHBondContact NH1-OG1 2.97Å; R458-T498 PolarHBondContact NH2-O 3.47Å; R458-S499 PolarHBondContact NH1-OG 3.36Å; R458-S499 VanDerWaalsContact NH2-N 3.14Å; R458-S499 PolarHBondContact NH2-OG 2.99Å
459	N	95.4	Very high	94.3	Very high	90 Å²	90	44.7 Å²	44.7	48%	0.481	26%	0.256	S	S	.	.	H	α-helix	trans	-70.5	-46	175.2	-72.2	-8.3	0	0	0	110.8	Q455 A456 I457 K462 S463	Q455-N459 PolarHBondContact NE2-OD1 3.41Å; Q455-N459 WeakPolarHBondContact O-CB 3.45Å; Q455-N459 PolarHBondContact O-N 2.86Å; Q455-N459 PolarHBondContact O-ND2 2.75Å; Q455-N459 PolarHBondContact O-OD1 3.33Å; A456-N459 PolarHBondContact O-N 3.26Å; I457-N459 PolarHBondContact O-N 3.06Å; N459-K462 WeakPolarHBondContact O-CB 3.36Å; N459-K462 PolarHBondContact O-N 2.76Å; N459-S463 PolarHBondContact O-N 2.94Å; N459-S463 PolarHBondContact O-OG 3.03Å
460	F	96.7	Very high	94.3	Very high	6 Å²	6	47.2 Å²	47.2	3%	0.026	27%	0.269	C	S	.	.	H	α-helix	trans	-53.9	-53.5	172.7	167.2	-131.9	0	0	0	110.9	V366 F371 I374 L441 A456 I457 K462 S463 L464 W467 F490 L494	V366-F460 HydrophobicContact CG2-CZ 4.27Å; F371-F460 HydrophobicContact CB-CB 4.17Å; F371-F460 HydrophobicContact CB-CD2 3.77Å; F371-F460 HydrophobicContact CB-CE2 4.38Å; F371-F460 HydrophobicContact CB-CG 4.05Å; F371-F460 HydrophobicContact CD1-CB 4.11Å; F371-F460 AromaticContact CD1-CD1 3.52Å; F371-F460 HydrophobicContact CD1-CD1 3.52Å; F371-F460 AromaticContact CD1-CD2 3.74Å; F371-F460 HydrophobicContact CD1-CD2 3.74Å; F371-F460 AromaticContact CD1-CE1 3.74Å; F371-F460 HydrophobicContact CD1-CE1 3.74Å; F371-F460 AromaticContact CD1-CE2 3.96Å; F371-F460 HydrophobicContact CD1-CE2 3.96Å; F371-F460 AromaticContact CD1-CG 3.51Å; F371-F460 HydrophobicContact CD1-CG 3.51Å; F371-F460 AromaticContact CD1-CZ 3.95Å; F371-F460 HydrophobicContact CD1-CZ 3.95Å; F371-F460 HydrophobicContact CD2-CB 4.04Å; F371-F460 HydrophobicContact CD2-CG 4.34Å; F371-F460 AromaticContact CE1-CD1 3.53Å; F371-F460 HydrophobicContact CE1-CD1 3.53Å; F371-F460 AromaticContact CE1-CE1 3.76Å; F371-F460 HydrophobicContact CE1-CE1 3.76Å; F371-F460 AromaticContact CE1-CG 3.97Å; F371-F460 HydrophobicContact CE1-CG 3.97Å; F371-F460 HydrophobicContact CE1-CZ 4.37Å; F371-F460 HydrophobicContact CE2-CB 4.45Å; F371-F460 HydrophobicContact CG-CB 3.86Å; F371-F460 HydrophobicContact CG-CD1 4.16Å; F371-F460 AromaticContact CG-CD2 3.92Å; F371-F460 HydrophobicContact CG-CD2 3.92Å; F371-F460 AromaticContact CG-CG 3.72Å; F371-F460 HydrophobicContact CG-CG 3.72Å; F371-F460 HydrophobicContact CZ-CD1 4.18Å; I374-F460 HydrophobicContact CD1-CD2 4.3Å; I374-F460 HydrophobicContact CD1-CE2 3.32Å; I374-F460 HydrophobicContact CD1-CZ 3.58Å; L441-F460 HydrophobicContact CD1-CD1 4.36Å; L441-F460 HydrophobicContact CD1-CE1 4.06Å; A456-F460 WeakPolarHBondContact O-CB 3.44Å; A456-F460 PolarHBondContact O-N 3.12Å; I457-F460 PolarHBondContact O-N 3Å; F460-K462 PolarHBondContact O-N 2.81Å; F460-S463 PolarHBondContact O-N 3.48Å; F460-L464 HydrophobicContact CD2-CD2 4.19Å; F460-L464 HydrophobicContact CD2-CG 4.23Å; F460-L464 HydrophobicContact CE2-CD1 4.41Å; F460-L464 HydrophobicContact CE2-CD2 3.41Å; F460-L464 VanDerWaalsContact CE2-CD2 3.41Å; F460-L464 HydrophobicContact CE2-CG 3.91Å; F460-L464 HydrophobicContact CZ-CD1 4.35Å; F460-L464 HydrophobicContact CZ-CD2 3.75Å; F460-L464 HydrophobicContact CZ-CG 4.3Å; F460-L464 PolarHBondContact O-N 2.91Å; F460-W467 AromaticContact CD2-CZ3 3.96Å; F460-W467 HydrophobicContact CD2-CZ3 3.96Å; F460-W467 HydrophobicContact CE2-CZ3 4.31Å; F460-F490 HydrophobicContact CE1-CE1 4.28Å; F460-F490 HydrophobicContact CE1-CZ 4.03Å; F460-F490 HydrophobicContact CZ-CE1 4.11Å; F460-F490 HydrophobicContact CZ-CZ 4.24Å; F460-L494 HydrophobicContact CD1-CD1 4.04Å; F460-L494 HydrophobicContact CE1-CD1 3.97Å
461	A	97.3	Very high	94.4	Very high	0 Å²	0	45.8 Å²	45.8	0%	0	26%	0.26	C	S	.	.	H	α-helix	trans	-64.5	-3.2	176	0	0	0	0	0	115	I457 L494 R495	I457-A461 VanDerWaalsContact O-CB 3.23Å; I457-A461 WeakPolarHBondContact O-CB 3.49Å; I457-A461 PolarHBondContact O-N 2.97Å; A461-L494 HydrophobicContact CB-CB 3.8Å; A461-L494 HydrophobicContact CB-CD1 3.98Å; A461-R495 HydrophobicContact CB-CG 4.24Å; A461-R495 VanDerWaalsContact O-CZ 3.31Å; A461-R495 PolarHBondContact O-NE 2.84Å; A461-R495 PolarHBondContact O-NH2 3.33Å
462	K	96.6	Very high	94.6	Very high	167 Å²	167	40.7 Å²	40.7	73%	0.726	23%	0.225	S	C	*	.	H	α-helix	trans	-94.9	-29.9	170	-173.8	-179.9	174.9	-172.2	0	112.4	R458 N459 F460	R458-K462 PolarHBondContact O-N 3.03Å; N459-K462 WeakPolarHBondContact O-CB 3.36Å; N459-K462 PolarHBondContact O-N 2.76Å; F460-K462 PolarHBondContact O-N 2.81Å
463	S	96.7	Very high	94.3	Very high	46 Å²	46	43 Å²	43	32%	0.322	23%	0.23	S	C	.	.	H	α-helix	trans	-89.4	-26.5	-173.8	-54.3	0	0	0	0	114.1	N459 F460 E465 G466 W467	N459-S463 PolarHBondContact O-N 2.94Å; N459-S463 PolarHBondContact O-OG 3.03Å; F460-S463 PolarHBondContact O-N 3.48Å; S463-E465 PolarHBondContact O-N 3.46Å; S463-G466 PolarHBondContact O-N 3.27Å; S463-W467 VanDerWaalsContact CB-CE2 3.41Å; S463-W467 PolarHBondContact O-N 3.17Å
464	L	96.8	Very high	94	Very high	1 Å²	1	45.6 Å²	45.6	1%	0.005	25%	0.252	C	S	.	.	H	α-helix	trans	-42.2	-56.5	-175	-79.3	170.4	0	0	0	114.7	W378 F460 G466 W467 L468 V487 F490 A491	W378-L464 HydrophobicContact CH2-CB 4.47Å; W378-L464 HydrophobicContact CH2-CD2 3.5Å; W378-L464 HydrophobicContact CZ2-CD2 4.34Å; W378-L464 HydrophobicContact CZ3-CD2 4.17Å; W378-L464 WeakPolarHBondContact CZ3-O 3.26Å; F460-L464 HydrophobicContact CD2-CD2 4.19Å; F460-L464 HydrophobicContact CD2-CG 4.23Å; F460-L464 HydrophobicContact CE2-CD1 4.41Å; F460-L464 HydrophobicContact CE2-CD2 3.41Å; F460-L464 VanDerWaalsContact CE2-CD2 3.41Å; F460-L464 HydrophobicContact CE2-CG 3.91Å; F460-L464 HydrophobicContact CZ-CD1 4.35Å; F460-L464 HydrophobicContact CZ-CD2 3.75Å; F460-L464 HydrophobicContact CZ-CG 4.3Å; F460-L464 PolarHBondContact O-N 2.91Å; L464-G466 PolarHBondContact O-N 3.49Å; L464-W467 PolarHBondContact O-N 3.24Å; L464-L468 PolarHBondContact O-N 2.92Å; L464-V487 HydrophobicContact CB-CG1 3.7Å; L464-F490 HydrophobicContact CD1-CD1 3.61Å; L464-F490 HydrophobicContact CD1-CE1 3.63Å; L464-F490 HydrophobicContact CD2-CD1 4.48Å; L464-F490 HydrophobicContact CD2-CE1 4.14Å; L464-A491 HydrophobicContact CD1-CB 3.91Å
465	E	95.3	Very high	94	Very high	61 Å²	61	45.3 Å²	45.3	29%	0.285	25%	0.249	S	C	.	.	H	α-helix	trans	-59.3	-43.3	-175.3	-64.5	161.4	-138.6	0	0	112.2	S463 S469 I484 V487 R495	S463-E465 PolarHBondContact O-N 3.46Å; E465-S469 WeakPolarHBondContact O-CB 3.47Å; E465-S469 PolarHBondContact O-N 2.67Å; E465-S469 PolarHBondContact O-OG 3.32Å; E465-I484 WeakPolarHBondContact O-CD1 3.39Å; E465-V487 HydrophobicContact CG-CG1 4.23Å; E465-R495 IonicContact OE1-CZ 3.64Å; E465-R495 IonicContact OE1-NH1 3.35Å; E465-R495 IonicContact OE1-NH2 2.67Å; E465-R495 PolarHBondContact OE1-NH2 3.4Å
466	G	94.9	Very high	94	Very high	37 Å²	37	41.8 Å²	41.8	38%	0.381	24%	0.235	S	C	.	.	H	α-helix	trans	-72.1	-41.2	179.2	0	0	0	0	0	112.9	S463 L464 S469 N470	S463-G466 PolarHBondContact O-N 3.27Å; L464-G466 PolarHBondContact O-N 3.49Å; G466-S469 PolarHBondContact O-N 3.36Å; G466-N470 WeakPolarHBondContact O-CB 3.49Å; G466-N470 PolarHBondContact O-N 3.15Å; G466-N470 PolarHBondContact O-ND2 3.02Å
467	W	95.9	Very high	93.9	Very high	44 Å²	44	46.1 Å²	46.1	17%	0.167	25%	0.25	C	C	.	.	H	α-helix	trans	-60	-45.2	175	-73.4	-21	0	0	0	112.2	F371 E375 W378 F460 S463 L464 A471	F371-W467 WeakPolarHBondContact O-CZ3 3.14Å; E375-W467 HydrophobicContact CB-CB 4.08Å; E375-W467 HydrophobicContact CB-CD2 3.99Å; E375-W467 HydrophobicContact CB-CG 3.79Å; E375-W467 HydrophobicContact CG-CB 4.14Å; E375-W467 HydrophobicContact CG-CG 4Å; E375-W467 VanDerWaalsContact OE2-CD1 3.26Å; E375-W467 PolarHBondContact OE2-NE1 3.08Å; W378-W467 HydrophobicContact CE3-CB 3.94Å; W378-W467 HydrophobicContact CZ3-CB 3.74Å; F460-W467 AromaticContact CD2-CZ3 3.96Å; F460-W467 HydrophobicContact CD2-CZ3 3.96Å; F460-W467 HydrophobicContact CE2-CZ3 4.31Å; S463-W467 VanDerWaalsContact CB-CE2 3.41Å; S463-W467 PolarHBondContact O-N 3.17Å; L464-W467 PolarHBondContact O-N 3.24Å; W467-A471 PolarHBondContact O-N 2.95Å; W467-A471 VanDerWaalsContact O-N 3.15Å
468	L	96.2	Very high	93.8	Very high	1 Å²	1	53.6 Å²	53.6	1%	0.005	28%	0.278	C	S	.	.	H	α-helix	trans	-66.4	-46.3	177	-176.9	68	0	0	0	111.2	W378 L464 N470 A471 M472 K483 I484 V487	W378-L468 HydrophobicContact CD2-CB 4.42Å; W378-L468 HydrophobicContact CD2-CD1 3.87Å; W378-L468 HydrophobicContact CE3-CB 3.96Å; W378-L468 HydrophobicContact CE3-CD1 4.27Å; W378-L468 HydrophobicContact CG-CD1 4.09Å; W378-L468 HydrophobicContact CH2-CB 3.98Å; W378-L468 HydrophobicContact CZ2-CB 4.48Å; W378-L468 HydrophobicContact CZ2-CD1 4.24Å; W378-L468 HydrophobicContact CZ3-CB 3.73Å; L464-L468 PolarHBondContact O-N 2.92Å; L468-N470 VanDerWaalsContact C-N 3.31Å; L468-N470 PolarHBondContact O-N 2.67Å; L468-A471 PolarHBondContact O-N 3.05Å; L468-M472 HydrophobicContact CD1-CG 3.99Å; L468-M472 HydrophobicContact CD1-SD 3.6Å; L468-M472 HydrophobicContact CD2-SD 4.19Å; L468-M472 HydrophobicContact CG-CG 4.31Å; L468-M472 HydrophobicContact CG-SD 3.75Å; L468-M472 WeakPolarHBondContact O-CB 3.32Å; L468-M472 WeakPolarHBondContact O-CG 3.39Å; L468-M472 PolarHBondContact O-N 3.25Å; L468-K483 HydrophobicContact CD2-CB 3.74Å; L468-K483 WeakPolarHBondContact CD2-O 3.33Å; L468-I484 HydrophobicContact CB-CD1 4.04Å; L468-I484 HydrophobicContact CD2-CD1 3.69Å; L468-I484 HydrophobicContact CD2-CG1 4.17Å; L468-I484 HydrophobicContact CG-CD1 4.04Å; L468-V487 HydrophobicContact CD2-CB 3.99Å; L468-V487 HydrophobicContact CD2-CG2 3.5Å; L468-V487 VanDerWaalsContact CD2-CG2 3.5Å
469	S	93.9	Very high	93.7	Very high	45 Å²	45	50.4 Å²	50.4	32%	0.315	27%	0.266	S	S	.	.	H	α-helix	trans	-54.2	-49.1	177.9	-61.2	0	0	0	0	111.2	E465 G466 A471 M472 N473 I484	E465-S469 WeakPolarHBondContact O-CB 3.47Å; E465-S469 PolarHBondContact O-N 2.67Å; E465-S469 PolarHBondContact O-OG 3.32Å; G466-S469 PolarHBondContact O-N 3.36Å; S469-A471 PolarHBondContact O-N 2.88Å; S469-M472 PolarHBondContact O-N 3.31Å; S469-N473 PolarHBondContact O-N 3.28Å; S469-I484 VanDerWaalsContact OG-CD1 3.25Å; S469-I484 WeakPolarHBondContact OG-CD1 3.25Å
470	N	91.8	Very high	93.7	Very high	77 Å²	77	47.1 Å²	47.1	41%	0.412	25%	0.248	S	C	.	.	H	α-helix	trans	-59.8	-44.5	178.8	-71.4	-15.5	0	0	0	112.5	Y384 G466 L468 M472 N473	Y384-N470 VanDerWaalsContact CD2-O 3.23Å; Y384-N470 WeakPolarHBondContact CD2-O 3.37Å; Y384-N470 VanDerWaalsContact CE2-O 3.31Å; Y384-N470 WeakPolarHBondContact CE2-O 3.19Å; G466-N470 WeakPolarHBondContact O-CB 3.49Å; G466-N470 PolarHBondContact O-N 3.15Å; G466-N470 PolarHBondContact O-ND2 3.02Å; L468-N470 VanDerWaalsContact C-N 3.31Å; L468-N470 PolarHBondContact O-N 2.67Å; N470-M472 VanDerWaalsContact C-N 3.32Å; N470-M472 PolarHBondContact O-N 3.16Å; N470-N473 PolarHBondContact O-ND2 3.25Å
471	A	92.6	Very high	93.6	Very high	2 Å²	2	53 Å²	53	2%	0.017	28%	0.276	C	S	.	.	H	α-helix	trans	-66.2	-33.5	179.6	0	0	0	0	0	112.8	W378 Q379 W382 W467 L468 S469	W378-A471 HydrophobicContact CB-CB 3.69Å; Q379-A471 HydrophobicContact CG-CB 4Å; W382-A471 WeakPolarHBondContact CB-O 3.48Å; W467-A471 PolarHBondContact O-N 2.95Å; W467-A471 VanDerWaalsContact O-N 3.15Å; L468-A471 PolarHBondContact O-N 3.05Å; S469-A471 PolarHBondContact O-N 2.88Å
472	M	93.3	Very high	93.4	Very high	0 Å²	0	54.7 Å²	54.7	0%	0	29%	0.286	C	S	.	.	T	Hydrogen-bonded Turn	trans	-92.7	7	-173.9	-66.8	-172.6	72.6	0	0	115.3	W382 L468 S469 N470 A474 I475 M479 I480 K483	W382-M472 HydrophobicContact CD2-CE 4.35Å; W382-M472 HydrophobicContact CD2-CG 3.98Å; W382-M472 HydrophobicContact CG-CG 3.83Å; W382-M472 HydrophobicContact CH2-CE 3.98Å; W382-M472 HydrophobicContact CZ2-CE 3.76Å; W382-M472 HydrophobicContact CZ2-SD 4.13Å; W382-M472 HydrophobicContact CZ3-CE 4.37Å; L468-M472 HydrophobicContact CD1-CG 3.99Å; L468-M472 HydrophobicContact CD1-SD 3.6Å; L468-M472 HydrophobicContact CD2-SD 4.19Å; L468-M472 HydrophobicContact CG-CG 4.31Å; L468-M472 HydrophobicContact CG-SD 3.75Å; L468-M472 WeakPolarHBondContact O-CB 3.32Å; L468-M472 WeakPolarHBondContact O-CG 3.39Å; L468-M472 PolarHBondContact O-N 3.25Å; S469-M472 PolarHBondContact O-N 3.31Å; N470-M472 VanDerWaalsContact C-N 3.32Å; N470-M472 PolarHBondContact O-N 3.16Å; M472-A474 PolarHBondContact O-N 3.18Å; M472-I475 HydrophobicContact CB-CB 4.38Å; M472-I475 HydrophobicContact CB-CG1 4.16Å; M472-I475 HydrophobicContact CE-CB 4.19Å; M472-I475 HydrophobicContact CE-CG1 4.48Å; M472-I475 HydrophobicContact CE-CG2 3.76Å; M472-I475 WeakPolarHBondContact O-CB 3.28Å; M472-I475 WeakPolarHBondContact O-CG1 3.48Å; M472-I475 PolarHBondContact O-N 3.33Å; M472-M479 HydrophobicContact CE-CG 3.82Å; M472-I480 HydrophobicContact CB-CD1 4.46Å; M472-I480 HydrophobicContact CB-CG1 4.06Å; M472-I480 HydrophobicContact CE-CG1 4.05Å; M472-I480 WeakPolarHBondContact O-CD1 3.43Å; M472-K483 HydrophobicContact CE-CB 4Å; M472-K483 HydrophobicContact CE-CG 3.73Å; M472-K483 HydrophobicContact SD-CB 3.68Å; M472-K483 HydrophobicContact SD-CG 3.91Å
473	N	84.2	Confident	93.4	Very high	103 Å²	103	47 Å²	47	55%	0.551	25%	0.252	S	S	*	.	T	Hydrogen-bonded Turn	trans	-49.3	-19.4	-174.1	-85.5	-38.9	0	0	0	117.1	S469 N470	S469-N473 PolarHBondContact O-N 3.28Å; N470-N473 PolarHBondContact O-ND2 3.25Å
474	A	84.3	Confident	93.3	Very high	57 Å²	57	46.5 Å²	46.5	47%	0.471	25%	0.246	S	C	.	.	T	Hydrogen-bonded Turn	trans	-113.2	13.7	-179.5	0	0	0	0	0	114.5	L414 M472	L414-A474 WeakPolarHBondContact CD2-O 3.34Å; M472-A474 PolarHBondContact O-N 3.18Å
475	I	92.4	Very high	93.1	Very high	10 Å²	10	48.2 Å²	48.2	5%	0.051	26%	0.26	C	S	.	.	S	Bend	trans	-100.5	154	-175.1	-54.5	-57.2	0	0	0	110.1	W382 L414 C417 M472 Q477 M479 I480	W382-I475 HydrophobicContact CB-CD1 4.49Å; W382-I475 HydrophobicContact CB-CG1 4.43Å; W382-I475 HydrophobicContact CD2-CD1 4.47Å; W382-I475 HydrophobicContact CD2-CG1 4.24Å; W382-I475 HydrophobicContact CE3-CD1 3.66Å; W382-I475 HydrophobicContact CE3-CG1 3.75Å; W382-I475 HydrophobicContact CE3-CG2 4.27Å; W382-I475 HydrophobicContact CZ3-CD1 4.33Å; W382-I475 HydrophobicContact CZ3-CG1 4.39Å; W382-I475 HydrophobicContact CZ3-CG2 4.07Å; L414-I475 HydrophobicContact CD2-CD1 3.93Å; C417-I475 HydrophobicContact CB-CG2 4.47Å; M472-I475 HydrophobicContact CB-CB 4.38Å; M472-I475 HydrophobicContact CB-CG1 4.16Å; M472-I475 HydrophobicContact CE-CB 4.19Å; M472-I475 HydrophobicContact CE-CG1 4.48Å; M472-I475 HydrophobicContact CE-CG2 3.76Å; M472-I475 WeakPolarHBondContact O-CB 3.28Å; M472-I475 WeakPolarHBondContact O-CG1 3.48Å; M472-I475 PolarHBondContact O-N 3.33Å; I475-Q477 PolarHBondContact O-N 3.46Å; I475-M479 HydrophobicContact CG2-CB 3.97Å; I475-M479 HydrophobicContact CG2-CG 3.8Å; I475-I480 HydrophobicContact CB-CG1 4.26Å; I475-I480 WeakPolarHBondContact O-CD1 3.35Å
476	P	93.5	Very high	93.2	Very high	28 Å²	28	45.3 Å²	45.3	18%	0.182	25%	0.247	C	C	.	.			trans	-57.6	136.4	178.3	-27.1	36.8	0	0	0	113.1	C417 R418 R478 M479 I480	C417-P476 HydrophobicContact CB-CG 4.04Å; R418-P476 HydrophobicContact CG-CB 4.25Å; R418-P476 HydrophobicContact CG-CG 3.87Å; P476-R478 VanDerWaalsContact C-N 3.3Å; P476-R478 PolarHBondContact O-N 2.98Å; P476-R478 VanDerWaalsContact O-N 3.17Å; P476-M479 WeakPolarHBondContact O-CB 3.26Å; P476-M479 PolarHBondContact O-N 2.99Å; P476-I480 PolarHBondContact O-N 2.81Å
477	Q	92.8	Very high	93.2	Very high	126 Å²	126	43.6 Å²	43.6	59%	0.589	23%	0.229	S	C	*	.	H	α-helix	trans	-58.3	-34.1	-170.1	-69.5	-67.2	-38.2	0	0	114.4	I475 M479 I480 Q481	I475-Q477 PolarHBondContact O-N 3.46Å; Q477-M479 PolarHBondContact O-N 3.31Å; Q477-I480 PolarHBondContact O-N 3.16Å; Q477-Q481 WeakPolarHBondContact O-CG 3.3Å; Q477-Q481 PolarHBondContact O-N 3.13Å
478	R	93.3	Very high	93.2	Very high	157 Å²	157	42.9 Å²	42.9	59%	0.592	23%	0.231	S	C	*	.	H	α-helix	trans	-59.1	-45.1	172.7	-75.4	-171.4	176.3	-179.2	-2.3	111.9	E420 L423 P476 I480 Q481 T482	E420-R478 IonicContact OE1-CZ 2.74Å; E420-R478 IonicContact OE1-NH1 2.97Å; E420-R478 PolarHBondContact OE1-NH1 3.5Å; L423-R478 HydrophobicContact CD1-CB 4.04Å; L423-R478 HydrophobicContact CD2-CB 4.27Å; P476-R478 VanDerWaalsContact C-N 3.3Å; P476-R478 PolarHBondContact O-N 2.98Å; P476-R478 VanDerWaalsContact O-N 3.17Å; R478-I480 VanDerWaalsContact C-N 3.34Å; R478-I480 PolarHBondContact O-N 3.43Å; R478-Q481 PolarHBondContact O-N 2.88Å; R478-T482 PolarHBondContact O-N 3.49Å; R478-T482 PolarHBondContact O-OG1 2.94Å
479	M	94.5	Very high	93.2	Very high	0 Å²	0	42.9 Å²	42.9	0%	0	23%	0.231	C	C	.	.	H	α-helix	trans	-65	-37.9	177.8	-178	59.6	76.2	0	0	111.5	W382 C417 V422 L423 M426 M472 I475 P476 Q477 K483	W382-M479 HydrophobicContact CH2-CG 4.09Å; W382-M479 HydrophobicContact CH2-SD 4.35Å; W382-M479 HydrophobicContact CZ3-CG 4.5Å; C417-M479 HydrophobicContact CB-CB 4.25Å; C417-M479 HydrophobicContact CB-CE 4.08Å; C417-M479 HydrophobicContact CB-CG 4.2Å; V422-M479 HydrophobicContact CG1-CE 4.2Å; L423-M479 HydrophobicContact CD2-CB 3.73Å; L423-M479 HydrophobicContact CD2-CE 3.6Å; L423-M479 HydrophobicContact CD2-CG 4.4Å; L423-M479 HydrophobicContact CD2-SD 3.89Å; L423-M479 HydrophobicContact CG-CE 4.1Å; M426-M479 HydrophobicContact CB-CE 4.48Å; M426-M479 HydrophobicContact CB-SD 4.5Å; M426-M479 HydrophobicContact CE-CE 4.5Å; M426-M479 HydrophobicContact CG-CE 4.29Å; M426-M479 HydrophobicContact SD-CE 3.53Å; M426-M479 VanDerWaalsContact SD-CE 3.53Å; M426-M479 HydrophobicContact SD-SD 3.65Å; M426-M479 VanDerWaalsContact SD-SD 3.65Å; M472-M479 HydrophobicContact CE-CG 3.82Å; I475-M479 HydrophobicContact CG2-CB 3.97Å; I475-M479 HydrophobicContact CG2-CG 3.8Å; P476-M479 WeakPolarHBondContact O-CB 3.26Å; P476-M479 PolarHBondContact O-N 2.99Å; Q477-M479 PolarHBondContact O-N 3.31Å; M479-K483 HydrophobicContact CG-CG 4.38Å; M479-K483 VanDerWaalsContact O-CB 3.27Å; M479-K483 WeakPolarHBondContact O-CB 3.42Å; M479-K483 WeakPolarHBondContact O-CG 3.33Å; M479-K483 PolarHBondContact O-N 2.95Å; M479-K483 HydrophobicContact SD-CG 3.94Å
480	I	94.9	Very high	93.3	Very high	22 Å²	22	40.8 Å²	40.8	11%	0.113	22%	0.216	C	C	.	.	H	α-helix	trans	-61.5	-49.2	172.9	-57.3	178.1	0	0	0	110.4	M472 I475 P476 Q477 R478 T482 K483 I484	M472-I480 HydrophobicContact CB-CD1 4.46Å; M472-I480 HydrophobicContact CB-CG1 4.06Å; M472-I480 HydrophobicContact CE-CG1 4.05Å; M472-I480 WeakPolarHBondContact O-CD1 3.43Å; I475-I480 HydrophobicContact CB-CG1 4.26Å; I475-I480 WeakPolarHBondContact O-CD1 3.35Å; P476-I480 PolarHBondContact O-N 2.81Å; Q477-I480 PolarHBondContact O-N 3.16Å; R478-I480 VanDerWaalsContact C-N 3.34Å; R478-I480 PolarHBondContact O-N 3.43Å; I480-T482 PolarHBondContact O-N 3.32Å; I480-K483 PolarHBondContact O-N 3.21Å; I480-I484 HydrophobicContact CG2-CG1 4.06Å; I480-I484 WeakPolarHBondContact O-CB 3.3Å; I480-I484 VanDerWaalsContact O-CG1 3.23Å; I480-I484 WeakPolarHBondContact O-CG1 3.47Å; I480-I484 PolarHBondContact O-N 3.14Å
481	Q	94	Very high	93.5	Very high	129 Å²	129	37.1 Å²	37.1	60%	0.603	20%	0.196	S	C	*	.	H	α-helix	trans	-59.4	-48	179.5	-72.3	168.1	-17.9	0	0	112	Q477 R478 I484 A485	Q477-Q481 WeakPolarHBondContact O-CG 3.3Å; Q477-Q481 PolarHBondContact O-N 3.13Å; R478-Q481 PolarHBondContact O-N 2.88Å; Q481-I484 PolarHBondContact O-N 2.94Å; Q481-A485 WeakPolarHBondContact O-CB 3.46Å; Q481-A485 PolarHBondContact O-N 3.01Å
482	T	94.4	Very high	93.7	Very high	36 Å²	36	40.7 Å²	40.7	22%	0.221	21%	0.213	C	C	.	.	H	α-helix	trans	-58.7	-48.2	176	-57.7	0	0	0	0	112	R478 I480 A485 A486	R478-T482 PolarHBondContact O-N 3.49Å; R478-T482 PolarHBondContact O-OG1 2.94Å; I480-T482 PolarHBondContact O-N 3.32Å; T482-A485 PolarHBondContact O-N 3.12Å; T482-A486 PolarHBondContact O-N 3.46Å
483	K	95.4	Very high	93.8	Very high	4 Å²	4	40.7 Å²	40.7	2%	0.017	21%	0.213	C	C	.	.	H	α-helix	trans	-65.9	-40.9	-179.5	-72.8	-74.6	178.3	-170.9	0	112.6	Y355 W382 M426 D430 L468 M472 M479 I480 V487	Y355-K483 PolarHBondContact OH-NZ 2.89Å; W382-K483 HydrophobicContact CZ2-CD 4.23Å; W382-K483 HydrophobicContact CZ2-CG 4.29Å; M426-K483 VanDerWaalsContact SD-CE 3.59Å; D430-K483 IonicContact OD1-NZ 2.72Å; D430-K483 PolarHBondContact OD1-NZ 3.32Å; D430-K483 VanDerWaalsContact OD2-CD 3.3Å; D430-K483 WeakPolarHBondContact OD2-CD 3.48Å; D430-K483 WeakPolarHBondContact OD2-CE 3.18Å; D430-K483 IonicContact OD2-NZ 3.18Å; D430-K483 PolarHBondContact OD2-NZ 3.41Å; L468-K483 HydrophobicContact CD2-CB 3.74Å; L468-K483 WeakPolarHBondContact CD2-O 3.33Å; M472-K483 HydrophobicContact CE-CB 4Å; M472-K483 HydrophobicContact CE-CG 3.73Å; M472-K483 HydrophobicContact SD-CB 3.68Å; M472-K483 HydrophobicContact SD-CG 3.91Å; M479-K483 HydrophobicContact CG-CG 4.38Å; M479-K483 VanDerWaalsContact O-CB 3.27Å; M479-K483 WeakPolarHBondContact O-CB 3.42Å; M479-K483 WeakPolarHBondContact O-CG 3.33Å; M479-K483 PolarHBondContact O-N 2.95Å; M479-K483 HydrophobicContact SD-CG 3.94Å; I480-K483 PolarHBondContact O-N 3.21Å; K483-V487 WeakPolarHBondContact O-CB 3.46Å; K483-V487 WeakPolarHBondContact O-CG2 3.33Å; K483-V487 PolarHBondContact O-N 3.26Å
484	I	95	Very high	94.4	Very high	37 Å²	37	35.8 Å²	35.8	19%	0.19	19%	0.186	C	C	.	.	H	α-helix	trans	-68.4	-38.5	177.8	-68.8	-71.1	0	0	0	111.1	E465 L468 S469 I480 Q481 V487 S488	E465-I484 WeakPolarHBondContact O-CD1 3.39Å; L468-I484 HydrophobicContact CB-CD1 4.04Å; L468-I484 HydrophobicContact CD2-CD1 3.69Å; L468-I484 HydrophobicContact CD2-CG1 4.17Å; L468-I484 HydrophobicContact CG-CD1 4.04Å; S469-I484 VanDerWaalsContact OG-CD1 3.25Å; S469-I484 WeakPolarHBondContact OG-CD1 3.25Å; I480-I484 HydrophobicContact CG2-CG1 4.06Å; I480-I484 WeakPolarHBondContact O-CB 3.3Å; I480-I484 VanDerWaalsContact O-CG1 3.23Å; I480-I484 WeakPolarHBondContact O-CG1 3.47Å; I480-I484 PolarHBondContact O-N 3.14Å; Q481-I484 PolarHBondContact O-N 2.94Å; I484-V487 PolarHBondContact O-N 2.86Å; I484-S488 WeakPolarHBondContact O-CB 3.17Å; I484-S488 PolarHBondContact O-N 2.9Å; I484-S488 PolarHBondContact O-OG 3.37Å; I484-S488 VanDerWaalsContact O-OG 3.08Å
485	A	93.6	Very high	95	Very high	37 Å²	37	36.3 Å²	36.3	31%	0.306	18%	0.176	S	C	.	.	H	α-helix	trans	-59.3	-49	174.9	0	0	0	0	0	112	Q481 T482 V487 S488 A489	Q481-A485 WeakPolarHBondContact O-CB 3.46Å; Q481-A485 PolarHBondContact O-N 3.01Å; T482-A485 PolarHBondContact O-N 3.12Å; A485-V487 PolarHBondContact O-N 2.97Å; A485-S488 PolarHBondContact O-N 3.21Å; A485-A489 PolarHBondContact O-N 3.25Å
486	A	95.4	Very high	95.1	Very high	0 Å²	0	37.2 Å²	37.2	0%	0	18%	0.179	C	C	.	.	H	α-helix	trans	-61.9	-40.8	177	0	0	0	0	0	112.5	D430 Y434 T482 F490	D430-A486 HydrophobicContact CB-CB 3.84Å; Y434-A486 HydrophobicContact CD2-CB 4.34Å; Y434-A486 HydrophobicContact CE2-CB 3.99Å; T482-A486 PolarHBondContact O-N 3.46Å; A486-F490 WeakPolarHBondContact O-CB 3.27Å; A486-F490 PolarHBondContact O-N 2.98Å
487	V	96.4	Very high	95.3	Very high	0 Å²	0	36.2 Å²	36.2	0%	0	17%	0.172	C	C	.	.	H	α-helix	trans	-68.4	-38.3	176.4	164.8	0	0	0	0	112.7	W378 Y434 L464 E465 L468 K483 I484 A485 F490 A491	W378-V487 HydrophobicContact CH2-CG2 4.25Å; W378-V487 HydrophobicContact CZ2-CG2 4.17Å; Y434-V487 HydrophobicContact CE1-CG2 4.47Å; Y434-V487 HydrophobicContact CE2-CG2 3.75Å; Y434-V487 WeakPolarHBondContact OH-CG2 3.21Å; L464-V487 HydrophobicContact CB-CG1 3.7Å; E465-V487 HydrophobicContact CG-CG1 4.23Å; L468-V487 HydrophobicContact CD2-CB 3.99Å; L468-V487 HydrophobicContact CD2-CG2 3.5Å; L468-V487 VanDerWaalsContact CD2-CG2 3.5Å; K483-V487 WeakPolarHBondContact O-CB 3.46Å; K483-V487 WeakPolarHBondContact O-CG2 3.33Å; K483-V487 PolarHBondContact O-N 3.26Å; I484-V487 PolarHBondContact O-N 2.86Å; A485-V487 PolarHBondContact O-N 2.97Å; V487-F490 PolarHBondContact O-N 3.24Å; V487-A491 WeakPolarHBondContact O-CB 3.48Å; V487-A491 PolarHBondContact O-N 3.18Å
488	S	95.8	Very high	95.5	Very high	30 Å²	30	30.2 Å²	30.2	21%	0.21	14%	0.144	C	C	.	.	H	α-helix	trans	-65.1	-43.4	175.5	-71	0	0	0	0	111.5	I484 A485 A491 Q492	I484-S488 WeakPolarHBondContact O-CB 3.17Å; I484-S488 PolarHBondContact O-N 2.9Å; I484-S488 PolarHBondContact O-OG 3.37Å; I484-S488 VanDerWaalsContact O-OG 3.08Å; A485-S488 PolarHBondContact O-N 3.21Å; S488-A491 PolarHBondContact O-N 2.97Å; S488-Q492 VanDerWaalsContact O-CB 3.24Å; S488-Q492 WeakPolarHBondContact O-CB 3.49Å; S488-Q492 PolarHBondContact O-N 3.5Å
489	A	95.2	Very high	95.6	Very high	1 Å²	1	24.8 Å²	24.8	1%	0.008	13%	0.13	C	C	.	.	H	α-helix	trans	-59.2	-49.6	173.9	0	0	0	0	0	111	A485 A491 Q492 T493 I649 M652	A485-A489 PolarHBondContact O-N 3.25Å; A489-A491 PolarHBondContact O-N 2.99Å; A489-Q492 PolarHBondContact O-N 3.44Å; A489-T493 WeakPolarHBondContact O-CB 3.44Å; A489-T493 PolarHBondContact O-N 3.44Å; A489-T493 PolarHBondContact O-OG1 2.87Å; A489-I649 HydrophobicContact CB-CG2 3.8Å; A489-M652 HydrophobicContact CB-CB 4.46Å
490	F	96.7	Very high	95.7	Very high	1 Å²	1	24.9 Å²	24.9	0%	0.004	13%	0.13	C	C	.	.	H	α-helix	trans	-56.8	-49.1	174.5	171.6	-135	0	0	0	113.3	Y434 L437 V438 F460 L464 A486 V487 Q492 T493 L494 I649	Y434-F490 HydrophobicContact CD1-CB 4.27Å; Y434-F490 AromaticContact CD1-CD1 3.4Å; Y434-F490 HydrophobicContact CD1-CD1 3.4Å; Y434-F490 HydrophobicContact CD1-CD2 4.33Å; Y434-F490 AromaticContact CD1-CE1 3.69Å; Y434-F490 HydrophobicContact CD1-CE1 3.69Å; Y434-F490 AromaticContact CD1-CG 3.76Å; Y434-F490 HydrophobicContact CD1-CG 3.76Å; Y434-F490 HydrophobicContact CD1-CZ 4.26Å; Y434-F490 HydrophobicContact CD2-CB 3.79Å; Y434-F490 HydrophobicContact CD2-CD1 4.34Å; Y434-F490 HydrophobicContact CD2-CG 4.2Å; Y434-F490 AromaticContact CE1-CD1 3.86Å; Y434-F490 HydrophobicContact CE1-CD1 3.86Å; Y434-F490 HydrophobicContact CE1-CE1 4.14Å; Y434-F490 HydrophobicContact CG-CB 3.67Å; Y434-F490 AromaticContact CG-CD1 3.73Å; Y434-F490 HydrophobicContact CG-CD1 3.73Å; Y434-F490 HydrophobicContact CG-CD2 4.15Å; Y434-F490 HydrophobicContact CG-CE1 4.38Å; Y434-F490 AromaticContact CG-CG 3.59Å; Y434-F490 HydrophobicContact CG-CG 3.59Å; L437-F490 HydrophobicContact CB-CE2 3.88Å; L437-F490 HydrophobicContact CB-CZ 3.83Å; L437-F490 HydrophobicContact CD1-CE1 4.18Å; L437-F490 HydrophobicContact CD1-CZ 3.77Å; L437-F490 HydrophobicContact CG-CZ 4.47Å; V438-F490 HydrophobicContact CG2-CD2 3.67Å; V438-F490 HydrophobicContact CG2-CE2 3.71Å; F460-F490 HydrophobicContact CE1-CE1 4.28Å; F460-F490 HydrophobicContact CE1-CZ 4.03Å; F460-F490 HydrophobicContact CZ-CE1 4.11Å; F460-F490 HydrophobicContact CZ-CZ 4.24Å; L464-F490 HydrophobicContact CD1-CD1 3.61Å; L464-F490 HydrophobicContact CD1-CE1 3.63Å; L464-F490 HydrophobicContact CD2-CD1 4.48Å; L464-F490 HydrophobicContact CD2-CE1 4.14Å; A486-F490 WeakPolarHBondContact O-CB 3.27Å; A486-F490 PolarHBondContact O-N 2.98Å; V487-F490 PolarHBondContact O-N 3.24Å; F490-Q492 VanDerWaalsContact C-N 3.31Å; F490-Q492 PolarHBondContact O-N 2.81Å; F490-T493 PolarHBondContact O-N 2.87Å; F490-L494 HydrophobicContact CD2-CD1 4.18Å; F490-L494 HydrophobicContact CD2-CG 4.17Å; F490-L494 HydrophobicContact CE1-CD1 4.3Å; F490-L494 HydrophobicContact CE2-CD1 3.61Å; F490-L494 HydrophobicContact CE2-CD2 4.21Å; F490-L494 HydrophobicContact CE2-CG 3.85Å; F490-L494 HydrophobicContact CZ-CD1 3.68Å; F490-L494 HydrophobicContact CZ-CG 4.43Å; F490-L494 PolarHBondContact O-N 3.45Å; F490-I649 HydrophobicContact CB-CD1 4.38Å; F490-I649 HydrophobicContact CD2-CD1 4.13Å
491	A	96.9	Very high	95.8	Very high	0 Å²	0	24 Å²	24	0%	0	13%	0.126	C	C	.	.	H	α-helix	trans	-60.6	-41.4	178.5	0	0	0	0	0	111.6	L464 V487 S488 A489 R495	L464-A491 HydrophobicContact CD1-CB 3.91Å; V487-A491 WeakPolarHBondContact O-CB 3.48Å; V487-A491 PolarHBondContact O-N 3.18Å; S488-A491 PolarHBondContact O-N 2.97Å; A489-A491 PolarHBondContact O-N 2.99Å; A491-R495 WeakPolarHBondContact O-CD 3.18Å; A491-R495 WeakPolarHBondContact O-CG 3.44Å; A491-R495 PolarHBondContact O-N 3.39Å; A491-R495 VanDerWaalsContact O-N 3.08Å
492	Q	95.3	Very high	95.9	Very high	76 Å²	76	24 Å²	24	36%	0.355	13%	0.126	S	C	.	.	H	α-helix	trans	-69.5	-40	177.4	-174.2	64.3	-6.6	0	0	112.3	S488 A489 F490 L494 R495 R496	S488-Q492 VanDerWaalsContact O-CB 3.24Å; S488-Q492 WeakPolarHBondContact O-CB 3.49Å; S488-Q492 PolarHBondContact O-N 3.5Å; A489-Q492 PolarHBondContact O-N 3.44Å; F490-Q492 VanDerWaalsContact C-N 3.31Å; F490-Q492 PolarHBondContact O-N 2.81Å; Q492-L494 PolarHBondContact O-N 3.08Å; Q492-R495 PolarHBondContact O-N 2.95Å; Q492-R496 WeakPolarHBondContact O-CB 3.32Å; Q492-R496 WeakPolarHBondContact O-CG 3.48Å; Q492-R496 PolarHBondContact O-N 2.89Å
493	T	96	Very high	96	Very high	0 Å²	0	23.9 Å²	23.9	0%	0	12%	0.123	C	C	.	.	H	α-helix	trans	-58.9	-47.3	173.4	-59.9	0	0	0	0	111.2	V438 A489 F490 R495 R496 Y497 I649	V438-T493 HydrophobicContact CG1-CG2 4Å; V438-T493 HydrophobicContact CG2-CG2 3.98Å; A489-T493 WeakPolarHBondContact O-CB 3.44Å; A489-T493 PolarHBondContact O-N 3.44Å; A489-T493 PolarHBondContact O-OG1 2.87Å; F490-T493 PolarHBondContact O-N 2.87Å; T493-R495 VanDerWaalsContact C-N 3.35Å; T493-R495 PolarHBondContact O-N 2.89Å; T493-R496 PolarHBondContact O-N 3.2Å; T493-Y497 HydrophobicContact CG2-CD1 4.11Å; T493-Y497 HydrophobicContact CG2-CD2 4.03Å; T493-Y497 HydrophobicContact CG2-CE1 3.71Å; T493-Y497 HydrophobicContact CG2-CE2 3.64Å; T493-Y497 HydrophobicContact CG2-CG 4.24Å; T493-Y497 VanDerWaalsContact CG2-CZ 3.44Å; T493-Y497 WeakPolarHBondContact O-CB 3.49Å; T493-Y497 PolarHBondContact O-N 3.06Å; T493-I649 HydrophobicContact CG2-CG1 4.42Å
494	L	96.9	Very high	96.1	Very high	0 Å²	0	23.7 Å²	23.7	0%	0	12%	0.122	C	C	.	.	H	α-helix	trans	-59.3	-42	174	-70.6	178.2	0	0	0	112.5	V438 L441 I442 I457 F460 A461 F490 Q492 T498	V438-L494 HydrophobicContact CG2-CD2 3.93Å; V438-L494 HydrophobicContact CG2-CG 4.28Å; L441-L494 HydrophobicContact CB-CD2 4.39Å; L441-L494 HydrophobicContact CD1-CD1 4.38Å; L441-L494 HydrophobicContact CD1-CD2 4.01Å; I442-L494 HydrophobicContact CD1-CD2 4Å; I457-L494 HydrophobicContact CG2-CB 4.17Å; I457-L494 HydrophobicContact CG2-CD1 4.37Å; I457-L494 HydrophobicContact CG2-CD2 3.97Å; I457-L494 HydrophobicContact CG2-CG 4.41Å; F460-L494 HydrophobicContact CD1-CD1 4.04Å; F460-L494 HydrophobicContact CE1-CD1 3.97Å; A461-L494 HydrophobicContact CB-CB 3.8Å; A461-L494 HydrophobicContact CB-CD1 3.98Å; F490-L494 HydrophobicContact CD2-CD1 4.18Å; F490-L494 HydrophobicContact CD2-CG 4.17Å; F490-L494 HydrophobicContact CE1-CD1 4.3Å; F490-L494 HydrophobicContact CE2-CD1 3.61Å; F490-L494 HydrophobicContact CE2-CD2 4.21Å; F490-L494 HydrophobicContact CE2-CG 3.85Å; F490-L494 HydrophobicContact CZ-CD1 3.68Å; F490-L494 HydrophobicContact CZ-CG 4.43Å; F490-L494 PolarHBondContact O-N 3.45Å; Q492-L494 PolarHBondContact O-N 3.08Å; L494-T498 WeakPolarHBondContact O-CB 3.45Å; L494-T498 WeakPolarHBondContact O-CG2 3.21Å; L494-T498 PolarHBondContact O-N 2.92Å; L494-T498 VanDerWaalsContact O-N 3.15Å; L494-T498 PolarHBondContact O-OG1 3.32Å
495	R	95.8	Very high	96.1	Very high	69 Å²	69	24.4 Å²	24.4	26%	0.26	13%	0.125	S	C	.	.	H	α-helix	trans	-65.7	-36.9	176.9	-67.6	163.3	-159.8	161.1	1.1	112.3	R458 A461 E465 A491 Q492 T493 T498 S499	R458-R495 PolarHBondContact NH1-O 3.08Å; A461-R495 HydrophobicContact CB-CG 4.24Å; A461-R495 VanDerWaalsContact O-CZ 3.31Å; A461-R495 PolarHBondContact O-NE 2.84Å; A461-R495 PolarHBondContact O-NH2 3.33Å; E465-R495 IonicContact OE1-CZ 3.64Å; E465-R495 IonicContact OE1-NH1 3.35Å; E465-R495 IonicContact OE1-NH2 2.67Å; E465-R495 PolarHBondContact OE1-NH2 3.4Å; A491-R495 WeakPolarHBondContact O-CD 3.18Å; A491-R495 WeakPolarHBondContact O-CG 3.44Å; A491-R495 PolarHBondContact O-N 3.39Å; A491-R495 VanDerWaalsContact O-N 3.08Å; Q492-R495 PolarHBondContact O-N 2.95Å; T493-R495 VanDerWaalsContact C-N 3.35Å; T493-R495 PolarHBondContact O-N 2.89Å; R495-T498 PolarHBondContact O-OG1 3.34Å; R495-S499 PolarHBondContact O-N 3.38Å; R495-S499 PolarHBondContact O-OG 3.04Å
496	R	95.7	Very high	96.3	Very high	29 Å²	29	24.2 Å²	24.2	11%	0.109	12%	0.123	C	C	.	.	H	α-helix	trans	-72.4	-54.3	177.6	-78.3	179.2	56	-125.1	-7.7	111.6	Q492 T493 T498 S499 L500 E637 M652	Q492-R496 WeakPolarHBondContact O-CB 3.32Å; Q492-R496 WeakPolarHBondContact O-CG 3.48Å; Q492-R496 PolarHBondContact O-N 2.89Å; T493-R496 PolarHBondContact O-N 3.2Å; R496-T498 VanDerWaalsContact C-N 3.33Å; R496-T498 PolarHBondContact O-N 3.31Å; R496-S499 CarbonylContact O-C 3.41Å; R496-S499 WeakPolarHBondContact O-CA 3.23Å; R496-S499 VanDerWaalsContact O-CB 3.3Å; R496-S499 WeakPolarHBondContact O-CB 3.32Å; R496-S499 PolarHBondContact O-N 3.33Å; R496-L500 PolarHBondContact O-N 3.27Å; R496-E637 IonicContact CZ-OE1 3.53Å; R496-E637 IonicContact NH1-OE1 3.52Å; R496-E637 PolarHBondContact NH1-OE1 3.4Å; R496-E637 IonicContact NH1-OE2 2.71Å; R496-E637 IonicContact NH2-OE1 2.67Å; R496-E637 PolarHBondContact NH2-OE1 3.01Å; R496-E637 VanDerWaalsContact NH2-OE1 3.08Å; R496-E637 IonicContact NH2-OE2 3.64Å; R496-M652 PolarHBondContact NH1-SD 3.34Å
497	Y	96.7	Very high	96.3	Very high	6 Å²	6	24.2 Å²	24.2	2%	0.024	12%	0.123	C	C	.	.	H	α-helix	trans	-64.6	-35.9	-176.1	-69.8	12.6	0	0	0	111.9	V438 V445 T493 S499 N501 Y634 E637 H638	V438-Y497 HydrophobicContact CG1-CD2 3.52Å; V438-Y497 HydrophobicContact CG1-CE2 3.48Å; V438-Y497 VanDerWaalsContact CG1-CE2 3.48Å; V445-Y497 HydrophobicContact CG1-CD2 4.15Å; V445-Y497 HydrophobicContact CG1-CG 4.12Å; T493-Y497 HydrophobicContact CG2-CD1 4.11Å; T493-Y497 HydrophobicContact CG2-CD2 4.03Å; T493-Y497 HydrophobicContact CG2-CE1 3.71Å; T493-Y497 HydrophobicContact CG2-CE2 3.64Å; T493-Y497 HydrophobicContact CG2-CG 4.24Å; T493-Y497 VanDerWaalsContact CG2-CZ 3.44Å; T493-Y497 WeakPolarHBondContact O-CB 3.49Å; T493-Y497 PolarHBondContact O-N 3.06Å; Y497-S499 PolarHBondContact O-N 3.33Å; Y497-N501 WeakPolarHBondContact O-CB 3.37Å; Y497-N501 PolarHBondContact O-N 2.83Å; Y497-Y634 HydrophobicContact CD1-CD2 4.21Å; Y497-Y634 HydrophobicContact CD2-CE2 4.43Å; Y497-Y634 AromaticContact CE1-CD2 3.71Å; Y497-Y634 HydrophobicContact CE1-CD2 3.71Å; Y497-Y634 HydrophobicContact CE1-CE2 4.27Å; Y497-Y634 HydrophobicContact CE2-CD2 4.24Å; Y497-Y634 AromaticContact CE2-CE2 3.95Å; Y497-Y634 HydrophobicContact CE2-CE2 3.95Å; Y497-Y634 AromaticContact CZ-CD2 3.75Å; Y497-Y634 AromaticContact CZ-CE2 3.89Å; Y497-E637 WeakPolarHBondContact CE1-OE2 3.47Å; Y497-E637 PolarHBondContact OH-OE2 3.49Å; Y497-H638 AromaticContact CZ-CE1 3.98Å; Y497-H638 PolarHBondContact OH-CE1 3.24Å
498	T	96.9	Very high	96.3	Very high	1 Å²	1	25.7 Å²	25.7	1%	0.006	13%	0.129	C	C	.	.	H	α-helix	trans	-67.9	-16.9	170.5	53.5	0	0	0	0	114	I442 T454 I457 R458 L494 R495 R496	I442-T498 HydrophobicContact CD1-CG2 3.72Å; T454-T498 HydrophobicContact CG2-CG2 3.97Å; I457-T498 HydrophobicContact CB-CG2 4.28Å; I457-T498 HydrophobicContact CG2-CG2 3.79Å; R458-T498 HydrophobicContact CG-CG2 4.45Å; R458-T498 WeakPolarHBondContact CG-OG1 3.19Å; R458-T498 PolarHBondContact NE-OG1 3.22Å; R458-T498 PolarHBondContact NH1-OG1 2.97Å; R458-T498 PolarHBondContact NH2-O 3.47Å; L494-T498 WeakPolarHBondContact O-CB 3.45Å; L494-T498 WeakPolarHBondContact O-CG2 3.21Å; L494-T498 PolarHBondContact O-N 2.92Å; L494-T498 VanDerWaalsContact O-N 3.15Å; L494-T498 PolarHBondContact O-OG1 3.32Å; R495-T498 PolarHBondContact O-OG1 3.34Å; R496-T498 VanDerWaalsContact C-N 3.33Å; R496-T498 PolarHBondContact O-N 3.31Å
499	S	96.3	Very high	96.3	Very high	42 Å²	42	27.3 Å²	27.3	29%	0.294	14%	0.144	S	C	.	.	H	α-helix	trans	-89.9	-43.9	175.5	-55.4	0	0	0	0	111.5	R458 R495 R496 Y497 N501 H502 L503	R458-S499 PolarHBondContact NH1-OG 3.36Å; R458-S499 VanDerWaalsContact NH2-N 3.14Å; R458-S499 PolarHBondContact NH2-OG 2.99Å; R495-S499 PolarHBondContact O-N 3.38Å; R495-S499 PolarHBondContact O-OG 3.04Å; R496-S499 CarbonylContact O-C 3.41Å; R496-S499 WeakPolarHBondContact O-CA 3.23Å; R496-S499 VanDerWaalsContact O-CB 3.3Å; R496-S499 WeakPolarHBondContact O-CB 3.32Å; R496-S499 PolarHBondContact O-N 3.33Å; Y497-S499 PolarHBondContact O-N 3.33Å; S499-N501 PolarHBondContact O-N 3.35Å; S499-H502 WeakPolarHBondContact O-CB 3.45Å; S499-H502 PolarHBondContact O-N 3Å; S499-L503 PolarHBondContact O-N 3.48Å
500	L	97.4	Very high	96.3	Very high	2 Å²	2	27.9 Å²	27.9	1%	0.01	15%	0.148	C	C	.	.	H	α-helix	trans	-52.9	-43.9	166.7	174.9	53.6	0	0	0	110.9	V445 R496 H502 L503 A504 L627 E630 Y631 Y634	V445-L500 HydrophobicContact CB-CD2 3.98Å; V445-L500 HydrophobicContact CB-CG 4.12Å; V445-L500 HydrophobicContact CG1-CD2 4.2Å; V445-L500 HydrophobicContact CG2-CD2 3.88Å; V445-L500 HydrophobicContact CG2-CG 4.26Å; R496-L500 PolarHBondContact O-N 3.27Å; L500-H502 PolarHBondContact O-N 3.46Å; L500-L503 PolarHBondContact O-N 3.45Å; L500-A504 WeakPolarHBondContact O-CB 3.35Å; L500-A504 PolarHBondContact O-N 3.18Å; L500-L627 HydrophobicContact CD1-CD1 3.69Å; L500-E630 HydrophobicContact CB-CB 4.4Å; L500-E630 HydrophobicContact CD1-CB 3.87Å; L500-Y631 HydrophobicContact CD1-CD2 4.17Å; L500-Y631 HydrophobicContact CD2-CD2 4.2Å; L500-Y634 HydrophobicContact CD2-CD2 4.16Å; L500-Y634 HydrophobicContact CD2-CG 3.92Å
501	N	96.7	Very high	96.2	Very high	4 Å²	4	28.3 Å²	28.3	2%	0.021	15%	0.15	C	C	.	.	H	α-helix	trans	-61.2	-39.2	174.6	-173.2	-104.6	0	0	0	113.9	V445 R447 Y497 S499 A504 Q505	V445-N501 WeakPolarHBondContact O-CA 3.49Å; V445-N501 WeakPolarHBondContact O-CB 3.24Å; V445-N501 PolarHBondContact O-ND2 2.8Å; R447-N501 PolarHBondContact O-ND2 2.9Å; Y497-N501 WeakPolarHBondContact O-CB 3.37Å; Y497-N501 PolarHBondContact O-N 2.83Å; S499-N501 PolarHBondContact O-N 3.35Å; N501-A504 WeakPolarHBondContact O-CB 3.42Å; N501-A504 PolarHBondContact O-N 3.4Å; N501-Q505 PolarHBondContact ND2-NE2 2.86Å; N501-Q505 VanDerWaalsContact O-CG 3.28Å; N501-Q505 WeakPolarHBondContact O-CG 3.37Å; N501-Q505 PolarHBondContact O-N 3.17Å; N501-Q505 PolarHBondContact O-NE2 3.04Å; N501-Q505 VanDerWaalsContact O-NE2 3.17Å
502	H	95.3	Very high	96	Very high	130 Å²	130	35.3 Å²	35.3	60%	0.602	18%	0.182	S	C	*	.	H	α-helix	trans	-69.3	-39.4	176.2	-178.4	-79.7	0	0	0	111.9	S499 L500 Q505 A506	S499-H502 WeakPolarHBondContact O-CB 3.45Å; S499-H502 PolarHBondContact O-N 3Å; L500-H502 PolarHBondContact O-N 3.46Å; H502-Q505 PolarHBondContact O-N 3.26Å; H502-A506 WeakPolarHBondContact O-CB 3.47Å; H502-A506 PolarHBondContact O-N 2.71Å; H502-A506 VanDerWaalsContact O-N 3.07Å
503	L	97.1	Very high	96	Very high	32 Å²	32	34.2 Å²	34.2	17%	0.168	18%	0.179	C	C	.	.	H	α-helix	trans	-62.1	-43	172	-71.1	169.3	0	0	0	111.1	S499 L500 Q505 A506 A507 L623 L626 L627 E630	S499-L503 PolarHBondContact O-N 3.48Å; L500-L503 PolarHBondContact O-N 3.45Å; L503-Q505 PolarHBondContact O-N 3.01Å; L503-A506 PolarHBondContact O-N 2.84Å; L503-A507 WeakPolarHBondContact O-CB 3.48Å; L503-A507 PolarHBondContact O-N 3.36Å; L503-L623 HydrophobicContact CD2-CD1 3.98Å; L503-L626 HydrophobicContact CD2-CB 4.21Å; L503-L627 HydrophobicContact CB-CB 4.28Å; L503-L627 HydrophobicContact CB-CD1 4.09Å; L503-E630 HydrophobicContact CD1-CB 4.39Å; L503-E630 HydrophobicContact CD1-CG 3.92Å
504	A	97.4	Very high	96	Very high	0 Å²	0	37.3 Å²	37.3	0%	0	20%	0.198	C	C	.	.	H	α-helix	trans	-59.2	-45.8	175.6	0	0	0	0	0	111.8	L446 L500 N501 A506 A507 R508 L564 L627	L446-A504 HydrophobicContact CD2-CB 4.05Å; L500-A504 WeakPolarHBondContact O-CB 3.35Å; L500-A504 PolarHBondContact O-N 3.18Å; N501-A504 WeakPolarHBondContact O-CB 3.42Å; N501-A504 PolarHBondContact O-N 3.4Å; A504-A506 PolarHBondContact O-N 3.04Å; A504-A507 PolarHBondContact O-N 2.71Å; A504-R508 WeakPolarHBondContact O-CB 3.1Å; A504-R508 PolarHBondContact O-N 3.42Å; A504-L564 HydrophobicContact CB-CD2 3.83Å; A504-L564 VanDerWaalsContact O-CD2 3.25Å; A504-L564 WeakPolarHBondContact O-CD2 3.49Å; A504-L627 HydrophobicContact CB-CD1 4.21Å
505	Q	95.6	Very high	95.9	Very high	53 Å²	53	41.3 Å²	41.3	25%	0.248	23%	0.226	C	C	.	.	H	α-helix	trans	-63.5	-40.9	176.2	-57.4	-29.2	-57.5	0	0	112.5	L446 N501 H502 L503 R508 A509	L446-Q505 PolarHBondContact O-NE2 3.22Å; N501-Q505 PolarHBondContact ND2-NE2 2.86Å; N501-Q505 VanDerWaalsContact O-CG 3.28Å; N501-Q505 WeakPolarHBondContact O-CG 3.37Å; N501-Q505 PolarHBondContact O-N 3.17Å; N501-Q505 PolarHBondContact O-NE2 3.04Å; N501-Q505 VanDerWaalsContact O-NE2 3.17Å; H502-Q505 PolarHBondContact O-N 3.26Å; L503-Q505 PolarHBondContact O-N 3.01Å; Q505-R508 PolarHBondContact O-N 3.37Å; Q505-A509 PolarHBondContact O-N 2.93Å
506	A	96.1	Very high	95.9	Very high	33 Å²	33	41.1 Å²	41.1	27%	0.273	23%	0.228	S	C	.	.	H	α-helix	trans	-67.2	-43.3	178.7	0	0	0	0	0	112	H502 L503 A504 A509 V510 L623	H502-A506 WeakPolarHBondContact O-CB 3.47Å; H502-A506 PolarHBondContact O-N 2.71Å; H502-A506 VanDerWaalsContact O-N 3.07Å; L503-A506 PolarHBondContact O-N 2.84Å; A504-A506 PolarHBondContact O-N 3.04Å; A506-A509 PolarHBondContact O-N 3.29Å; A506-V510 PolarHBondContact O-N 3.26Å; A506-L623 HydrophobicContact CB-CD1 4.06Å; A506-L623 HydrophobicContact CB-CD2 3.92Å
507	A	96.9	Very high	95.9	Very high	0 Å²	0	39.9 Å²	39.9	0%	0	22%	0.223	C	C	.	.	H	α-helix	trans	-67	-37.3	176.3	0	0	0	0	0	112.2	L503 A504 A509 V510 L511 L627	L503-A507 WeakPolarHBondContact O-CB 3.48Å; L503-A507 PolarHBondContact O-N 3.36Å; A504-A507 PolarHBondContact O-N 2.71Å; A507-A509 PolarHBondContact O-N 3.49Å; A507-V510 WeakPolarHBondContact O-CB 3.41Å; A507-V510 PolarHBondContact O-N 2.93Å; A507-L511 WeakPolarHBondContact O-CG 3.49Å; A507-L511 PolarHBondContact O-N 2.92Å; A507-L627 HydrophobicContact CB-CD2 3.47Å; A507-L627 VanDerWaalsContact CB-CD2 3.47Å
508	R	95.9	Very high	95.8	Very high	31 Å²	31	43.8 Å²	43.8	12%	0.117	25%	0.245	C	C	.	.	H	α-helix	trans	-57.5	-35.7	174.9	-170.9	177.2	-78.7	110.8	-6.6	111.7	L446 A504 Q505 L511 Q512 L564 E565	L446-R508 PolarHBondContact O-NH1 2.82Å; L446-R508 PolarHBondContact O-NH2 3.32Å; A504-R508 WeakPolarHBondContact O-CB 3.1Å; A504-R508 PolarHBondContact O-N 3.42Å; Q505-R508 PolarHBondContact O-N 3.37Å; R508-L511 PolarHBondContact O-N 2.58Å; R508-Q512 WeakPolarHBondContact O-CB 3.43Å; R508-Q512 VanDerWaalsContact O-CG 3.24Å; R508-Q512 WeakPolarHBondContact O-CG 3.36Å; R508-Q512 PolarHBondContact O-N 2.71Å; R508-L564 HydrophobicContact CB-CD2 4.07Å; R508-E565 IonicContact CZ-OE1 3.26Å; R508-E565 IonicContact NE-OE1 3.43Å; R508-E565 PolarHBondContact NE-OE1 3.37Å; R508-E565 IonicContact NH2-OE1 2.71Å; R508-E565 PolarHBondContact NH2-OE1 3.2Å
509	A	94.9	Very high	95.8	Very high	64 Å²	64	47.3 Å²	47.3	53%	0.529	26%	0.261	S	S	.	.	H	α-helix	trans	-70.7	-26.8	175.5	0	0	0	0	0	114.1	Q505 A506 A507	Q505-A509 PolarHBondContact O-N 2.93Å; A506-A509 PolarHBondContact O-N 3.29Å; A507-A509 PolarHBondContact O-N 3.49Å
510	V	95.3	Very high	95.9	Very high	13 Å²	13	45.3 Å²	45.3	8%	0.079	25%	0.247	C	C	.	.	H	α-helix	trans	-76.1	-47.4	170.9	170.3	0	0	0	0	110.4	A506 A507 Q512 N513 M520 L623	A506-V510 PolarHBondContact O-N 3.26Å; A507-V510 WeakPolarHBondContact O-CB 3.41Å; A507-V510 PolarHBondContact O-N 2.93Å; V510-Q512 PolarHBondContact O-N 3.14Å; V510-N513 WeakPolarHBondContact O-CB 3.33Å; V510-N513 PolarHBondContact O-N 2.71Å; V510-M520 HydrophobicContact CG1-SD 3.97Å; V510-L623 HydrophobicContact CG2-CD2 3.95Å
511	L	94.3	Very high	95.8	Very high	9 Å²	9	46.3 Å²	46.3	5%	0.047	25%	0.253	C	S	.	.	H	α-helix	trans	-71.2	-7.5	-178.6	-66	172.9	0	0	0	114.1	A507 R508 I517 L564 W567 I624	A507-L511 WeakPolarHBondContact O-CG 3.49Å; A507-L511 PolarHBondContact O-N 2.92Å; R508-L511 PolarHBondContact O-N 2.58Å; L511-I517 WeakPolarHBondContact O-CD1 3.46Å; L511-L564 HydrophobicContact CD1-CB 4.32Å; L511-L564 HydrophobicContact CD1-CD1 4.01Å; L511-W567 HydrophobicContact CD1-CG 4.4Å; L511-I624 HydrophobicContact CD2-CD1 3.85Å; L511-I624 HydrophobicContact CG-CD1 4.38Å
512	Q	93.6	Very high	95.8	Very high	147 Å²	147	49 Å²	49	69%	0.687	27%	0.272	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.7	0.1	168.5	-73	174.9	-11.2	0	0	112.9	R508 V510	R508-Q512 WeakPolarHBondContact O-CB 3.43Å; R508-Q512 VanDerWaalsContact O-CG 3.24Å; R508-Q512 WeakPolarHBondContact O-CG 3.36Å; R508-Q512 PolarHBondContact O-N 2.71Å; V510-Q512 PolarHBondContact O-N 3.14Å
513	N	95.1	Very high	95.9	Very high	54 Å²	54	43.2 Å²	43.2	29%	0.289	25%	0.245	S	C	.	.			trans	-107.1	91.3	-176	-169.8	-16.5	0	0	0	111.8	V510 S515 Q516 I517	V510-N513 WeakPolarHBondContact O-CB 3.33Å; V510-N513 PolarHBondContact O-N 2.71Å; N513-S515 PolarHBondContact O-N 2.99Å; N513-S515 VanDerWaalsContact O-N 3.08Å; N513-S515 PolarHBondContact OD1-N 2.87Å; N513-S515 PolarHBondContact OD1-OG 3.47Å; N513-Q516 HydrophobicContact CB-CB 4.18Å; N513-Q516 HydrophobicContact CB-CG 4.28Å; N513-Q516 PolarHBondContact ND2-NE2 3.2Å; N513-Q516 PolarHBondContact O-N 3.39Å; N513-I517 PolarHBondContact O-N 2.98Å
514	T	95.2	Very high	95.8	Very high	64 Å²	64	41.9 Å²	41.9	39%	0.393	24%	0.238	S	C	.	.	H	α-helix	trans	-50.6	-33.7	-180	-53	0	0	0	0	114.3	I517 N518 Q561	T514-I517 PolarHBondContact O-N 3.4Å; T514-N518 WeakPolarHBondContact O-CB 3.34Å; T514-N518 VanDerWaalsContact O-CG 3.23Å; T514-N518 PolarHBondContact O-N 3.34Å; T514-N518 PolarHBondContact O-ND2 3.38Å; T514-Q561 VanDerWaalsContact CG2-OE1 3.27Å; T514-Q561 PolarHBondContact OG1-OE1 3.01Å
515	S	95.4	Very high	95.7	Very high	84 Å²	84	46.9 Å²	46.9	59%	0.587	27%	0.265	S	S	*	.	H	α-helix	trans	-75.1	-34.4	178.8	69.6	0	0	0	0	112.6	N513 Q519	N513-S515 PolarHBondContact O-N 2.99Å; N513-S515 VanDerWaalsContact O-N 3.08Å; N513-S515 PolarHBondContact OD1-N 2.87Å; N513-S515 PolarHBondContact OD1-OG 3.47Å; S515-Q519 PolarHBondContact O-N 2.94Å; S515-Q519 VanDerWaalsContact O-N 3.13Å
516	Q	95.2	Very high	95.7	Very high	66 Å²	66	51.8 Å²	51.8	31%	0.308	28%	0.281	S	S	.	.	H	α-helix	trans	-67.7	-42.8	169.7	-70.5	-174.6	22.7	0	0	111.2	N513 N518 Q519 M520 S620	N513-Q516 HydrophobicContact CB-CB 4.18Å; N513-Q516 HydrophobicContact CB-CG 4.28Å; N513-Q516 PolarHBondContact ND2-NE2 3.2Å; N513-Q516 PolarHBondContact O-N 3.39Å; Q516-N518 VanDerWaalsContact C-N 3.35Å; Q516-N518 PolarHBondContact O-N 2.91Å; Q516-Q519 CarbonylContact O-C 3.59Å; Q516-Q519 PolarHBondContact O-N 3.26Å; Q516-Q519 VanDerWaalsContact O-N 3.15Å; Q516-M520 WeakPolarHBondContact O-CB 3.23Å; Q516-M520 VanDerWaalsContact O-CG 3.27Å; Q516-M520 WeakPolarHBondContact O-CG 3.32Å; Q516-M520 PolarHBondContact O-N 3.4Å; Q516-S620 PolarHBondContact OE1-OG 3.43Å
517	I	95.7	Very high	95.7	Very high	2 Å²	2	50.8 Å²	50.8	1%	0.01	27%	0.272	C	S	.	.	H	α-helix	trans	-58.8	-45.6	177.1	-67.1	167.1	0	0	0	111.3	L511 N513 T514 Q519 M520 L521 L558 Q561	L511-I517 WeakPolarHBondContact O-CD1 3.46Å; N513-I517 PolarHBondContact O-N 2.98Å; T514-I517 PolarHBondContact O-N 3.4Å; I517-Q519 VanDerWaalsContact C-N 3.34Å; I517-Q519 PolarHBondContact O-N 3.25Å; I517-M520 WeakPolarHBondContact O-CB 3.45Å; I517-M520 PolarHBondContact O-N 3.46Å; I517-L521 HydrophobicContact CG2-CD1 3.97Å; I517-L521 WeakPolarHBondContact O-CG 3.44Å; I517-L521 PolarHBondContact O-N 3.33Å; I517-L558 HydrophobicContact CG1-CD1 4.36Å; I517-L558 HydrophobicContact CG2-CD1 3.86Å; I517-L558 HydrophobicContact CG2-CG 4.08Å; I517-L558 VanDerWaalsContact CG2-O 3.23Å; I517-L558 WeakPolarHBondContact CG2-O 3.46Å; I517-Q561 HydrophobicContact CD1-CB 4.21Å; I517-Q561 HydrophobicContact CD1-CG 4.05Å; I517-Q561 HydrophobicContact CG2-CG 4.13Å
518	N	96.1	Very high	95.5	Very high	89 Å²	89	54 Å²	54	48%	0.476	29%	0.288	S	S	.	.	H	α-helix	trans	-63.3	-37.8	176.4	-71.9	-24.7	0	0	0	112.5	T514 Q516 S522	T514-N518 WeakPolarHBondContact O-CB 3.34Å; T514-N518 VanDerWaalsContact O-CG 3.23Å; T514-N518 PolarHBondContact O-N 3.34Å; T514-N518 PolarHBondContact O-ND2 3.38Å; Q516-N518 VanDerWaalsContact C-N 3.35Å; Q516-N518 PolarHBondContact O-N 2.91Å; N518-S522 WeakPolarHBondContact O-CB 3.43Å; N518-S522 PolarHBondContact O-N 3.29Å
519	Q	96.9	Very high	95.4	Very high	75 Å²	75	53.7 Å²	53.7	35%	0.35	29%	0.288	S	S	.	.	H	α-helix	trans	-68	-38.6	173.3	-175.6	57.6	50.4	0	0	111.9	S515 Q516 I517 S522 D523 A616	S515-Q519 PolarHBondContact O-N 2.94Å; S515-Q519 VanDerWaalsContact O-N 3.13Å; Q516-Q519 CarbonylContact O-C 3.59Å; Q516-Q519 PolarHBondContact O-N 3.26Å; Q516-Q519 VanDerWaalsContact O-N 3.15Å; I517-Q519 VanDerWaalsContact C-N 3.34Å; I517-Q519 PolarHBondContact O-N 3.25Å; Q519-S522 WeakPolarHBondContact O-CB 3.43Å; Q519-S522 PolarHBondContact O-N 3.16Å; Q519-D523 PolarHBondContact NE2-OD1 2.59Å; Q519-D523 PolarHBondContact NE2-OD2 3.32Å; Q519-D523 PolarHBondContact O-N 3.39Å; Q519-A616 HydrophobicContact CG-CB 4.19Å
520	M	97.4	Very high	95.2	Very high	0 Å²	0	54.1 Å²	54.1	0%	0	29%	0.291	C	S	.	.	H	α-helix	trans	-63.3	-44.8	175.9	-73.7	177	78.4	0	0	111.7	V510 Q516 I517 S522 D523 L524 L558 S617 S620 F621 I624	V510-M520 HydrophobicContact CG1-SD 3.97Å; Q516-M520 WeakPolarHBondContact O-CB 3.23Å; Q516-M520 VanDerWaalsContact O-CG 3.27Å; Q516-M520 WeakPolarHBondContact O-CG 3.32Å; Q516-M520 PolarHBondContact O-N 3.4Å; I517-M520 WeakPolarHBondContact O-CB 3.45Å; I517-M520 PolarHBondContact O-N 3.46Å; M520-S522 VanDerWaalsContact C-N 3.32Å; M520-S522 PolarHBondContact O-N 2.99Å; M520-D523 PolarHBondContact O-N 3.01Å; M520-L524 WeakPolarHBondContact O-CB 3.41Å; M520-L524 PolarHBondContact O-N 3.38Å; M520-L558 HydrophobicContact CB-CD2 3.99Å; M520-S617 VanDerWaalsContact CG-CB 3.46Å; M520-S620 VanDerWaalsContact SD-CB 3.53Å; M520-F621 HydrophobicContact CB-CE2 3.7Å; M520-F621 HydrophobicContact CB-CZ 3.67Å; M520-F621 HydrophobicContact CE-CD1 3.65Å; M520-F621 HydrophobicContact CE-CD2 4.01Å; M520-F621 HydrophobicContact CE-CE1 3.62Å; M520-F621 HydrophobicContact CE-CE2 4.01Å; M520-F621 HydrophobicContact CE-CG 3.83Å; M520-F621 HydrophobicContact CE-CZ 3.79Å; M520-F621 HydrophobicContact CG-CD2 4.23Å; M520-F621 HydrophobicContact CG-CE2 3.79Å; M520-F621 HydrophobicContact CG-CZ 4.1Å; M520-F621 WeakPolarHBondContact O-CZ 3.46Å; M520-I624 HydrophobicContact CE-CD1 3.71Å
521	L	96.2	Very high	95	Very high	23 Å²	23	55.9 Å²	55.9	12%	0.12	30%	0.301	C	S	.	.	H	α-helix	trans	-60.4	-41.1	173.1	-72.4	161	0	0	0	111.9	I517 N525 L558 Q559	I517-L521 HydrophobicContact CG2-CD1 3.97Å; I517-L521 WeakPolarHBondContact O-CG 3.44Å; I517-L521 PolarHBondContact O-N 3.33Å; L521-N525 WeakPolarHBondContact O-CB 3.35Å; L521-N525 VanDerWaalsContact O-CG 3.28Å; L521-N525 PolarHBondContact O-N 2.88Å; L521-N525 PolarHBondContact O-ND2 2.85Å; L521-L558 HydrophobicContact CD1-CG 4.46Å; L521-L558 HydrophobicContact CD2-CB 3.98Å; L521-L558 HydrophobicContact CD2-CD2 3.76Å; L521-L558 HydrophobicContact CD2-CG 3.82Å; L521-L558 HydrophobicContact CG-CD2 3.82Å; L521-L558 HydrophobicContact CG-CG 3.84Å; L521-Q559 HydrophobicContact CD1-CB 4.41Å; L521-Q559 HydrophobicContact CD2-CB 4.26Å
522	S	96.8	Very high	94.9	Very high	60 Å²	60	55.5 Å²	55.5	42%	0.42	30%	0.298	S	S	.	.	H	α-helix	trans	-63.2	-46.7	177.3	-170	0	0	0	0	112.4	N518 Q519 M520 R526	N518-S522 WeakPolarHBondContact O-CB 3.43Å; N518-S522 PolarHBondContact O-N 3.29Å; Q519-S522 WeakPolarHBondContact O-CB 3.43Å; Q519-S522 PolarHBondContact O-N 3.16Å; M520-S522 VanDerWaalsContact C-N 3.32Å; M520-S522 PolarHBondContact O-N 2.99Å; S522-R526 WeakPolarHBondContact O-CD 3.38Å; S522-R526 WeakPolarHBondContact O-CG 3.4Å
523	D	96.9	Very high	94.7	Very high	8 Å²	8	50.2 Å²	50.2	4%	0.043	27%	0.274	C	S	.	.	H	α-helix	trans	-71	-39.1	178.6	-69.1	-37	0	0	0	112	Q519 M520 N525 R526 V527 L610 A615 A616 S617	Q519-D523 PolarHBondContact NE2-OD1 2.59Å; Q519-D523 PolarHBondContact NE2-OD2 3.32Å; Q519-D523 PolarHBondContact O-N 3.39Å; M520-D523 PolarHBondContact O-N 3.01Å; D523-N525 PolarHBondContact O-N 2.91Å; D523-R526 WeakPolarHBondContact O-CB 3.41Å; D523-R526 PolarHBondContact O-N 2.84Å; D523-V527 PolarHBondContact O-N 3.16Å; D523-L610 HydrophobicContact CB-CD2 4.27Å; D523-A615 HydrophobicContact CB-CB 3.93Å; D523-A616 PolarHBondContact OD2-N 3.03Å; D523-S617 WeakPolarHBondContact CB-OG 3.32Å; D523-S617 WeakPolarHBondContact OD2-CB 3.4Å; D523-S617 PolarHBondContact OD2-N 3.03Å; D523-S617 PolarHBondContact OD2-OG 3.29Å
524	L	95.8	Very high	94.3	Very high	4 Å²	4	53.1 Å²	53.1	2%	0.021	29%	0.286	C	S	.	.	H	α-helix	trans	-63.7	-39.4	178.1	-170.8	72.2	0	0	0	112.5	M520 R526 V527 F529 F554 K555 L558 F621	M520-L524 WeakPolarHBondContact O-CB 3.41Å; M520-L524 PolarHBondContact O-N 3.38Å; L524-R526 PolarHBondContact O-N 3.08Å; L524-R526 VanDerWaalsContact O-N 3.12Å; L524-V527 WeakPolarHBondContact O-CB 3.42Å; L524-V527 PolarHBondContact O-N 3.43Å; L524-V527 VanDerWaalsContact O-N 3.12Å; L524-F529 HydrophobicContact CD1-CE2 4.2Å; L524-F529 HydrophobicContact CD1-CZ 3.75Å; L524-F529 HydrophobicContact CG-CE2 4.32Å; L524-F529 HydrophobicContact CG-CZ 4.29Å; L524-F554 HydrophobicContact CD1-CE1 4.37Å; L524-F554 HydrophobicContact CD2-CD1 3.76Å; L524-F554 HydrophobicContact CD2-CE1 3.75Å; L524-K555 HydrophobicContact CD2-CG 3.64Å; L524-L558 HydrophobicContact CD2-CD2 4.28Å; L524-F621 HydrophobicContact CB-CZ 3.94Å; L524-F621 HydrophobicContact CD1-CE1 4.05Å; L524-F621 HydrophobicContact CD1-CZ 4.02Å; L524-F621 HydrophobicContact CG-CZ 4.43Å
525	N	94.9	Very high	94	Very high	106 Å²	106	53.3 Å²	53.3	57%	0.567	28%	0.282	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.7	-1	175.2	-72.8	-32.7	0	0	0	113.4	L521 D523	L521-N525 WeakPolarHBondContact O-CB 3.35Å; L521-N525 VanDerWaalsContact O-CG 3.28Å; L521-N525 PolarHBondContact O-N 2.88Å; L521-N525 PolarHBondContact O-ND2 2.85Å; D523-N525 PolarHBondContact O-N 2.91Å
526	R	95.6	Very high	93.7	Very high	156 Å²	156	49.4 Å²	49.4	59%	0.589	26%	0.255	S	S	*	.	T	Hydrogen-bonded Turn	trans	-107.7	-2.3	173.3	-59.5	170.6	78.4	-152.1	2.4	112.7	S522 D523 L524 R613	S522-R526 WeakPolarHBondContact O-CD 3.38Å; S522-R526 WeakPolarHBondContact O-CG 3.4Å; D523-R526 WeakPolarHBondContact O-CB 3.41Å; D523-R526 PolarHBondContact O-N 2.84Å; L524-R526 PolarHBondContact O-N 3.08Å; L524-R526 VanDerWaalsContact O-N 3.12Å; R526-R613 WeakPolarHBondContact O-CD 3.37Å; R526-R613 PolarHBondContact O-NE 3.14Å; R526-R613 PolarHBondContact O-NH1 2.82Å
527	V	95	Very high	93.2	Very high	12 Å²	12	48.8 Å²	48.8	7%	0.073	26%	0.258	C	S	.	.	S	Bend	trans	-72.3	136.8	173	169.8	0	0	0	0	109.9	D523 L524 F529 V606 D609 L610	D523-V527 PolarHBondContact O-N 3.16Å; L524-V527 WeakPolarHBondContact O-CB 3.42Å; L524-V527 PolarHBondContact O-N 3.43Å; L524-V527 VanDerWaalsContact O-N 3.12Å; V527-F529 HydrophobicContact CB-CD2 4.02Å; V527-F529 HydrophobicContact CB-CE2 3.64Å; V527-F529 HydrophobicContact CB-CZ 4.13Å; V527-F529 HydrophobicContact CG1-CD1 4.27Å; V527-F529 HydrophobicContact CG1-CD2 3.83Å; V527-F529 HydrophobicContact CG1-CE1 4.1Å; V527-F529 HydrophobicContact CG1-CE2 3.65Å; V527-F529 HydrophobicContact CG1-CG 4.15Å; V527-F529 HydrophobicContact CG1-CZ 3.79Å; V527-F529 PolarHBondContact O-N 3.1Å; V527-F529 VanDerWaalsContact O-N 3.16Å; V527-V606 HydrophobicContact CG1-CG1 4.47Å; V527-D609 VanDerWaalsContact CA-OD1 3.26Å; V527-D609 WeakPolarHBondContact CA-OD1 3.25Å; V527-D609 HydrophobicContact CG1-CB 4.46Å; V527-D609 WeakPolarHBondContact CG1-OD1 3.36Å; V527-L610 HydrophobicContact CG2-CD2 3.52Å; V527-L610 HydrophobicContact CG2-CG 3.76Å
528	D	93.7	Very high	92.7	Very high	66 Å²	66	58.4 Å²	58.4	35%	0.353	29%	0.294	S	S	.	.			trans	-86.9	82.8	176.8	-170.3	-20.5	0	0	0	110.6	A530 N531 V532 D609	D528-A530 VanDerWaalsContact C-N 3.27Å; D528-A530 PolarHBondContact O-N 2.85Å; D528-A530 PolarHBondContact OD1-N 3.16Å; D528-N531 HydrophobicContact CB-CB 4.29Å; D528-N531 PolarHBondContact O-N 2.93Å; D528-N531 WeakPolarHBondContact OD1-CB 3.43Å; D528-N531 PolarHBondContact OD1-N 3.25Å; D528-V532 WeakPolarHBondContact O-CG2 3.48Å; D528-V532 PolarHBondContact O-N 2.79Å; D528-D609 PolarHBondContact N-OD1 2.79Å
529	F	92.6	Very high	92.2	Very high	26 Å²	26	58.7 Å²	58.7	11%	0.114	30%	0.299	C	S	.	.	H	α-helix	trans	-65.3	-27	-180	-77.1	-78.1	0	0	0	113.5	L524 V527 V532 Q533 E551 V606	L524-F529 HydrophobicContact CD1-CE2 4.2Å; L524-F529 HydrophobicContact CD1-CZ 3.75Å; L524-F529 HydrophobicContact CG-CE2 4.32Å; L524-F529 HydrophobicContact CG-CZ 4.29Å; V527-F529 HydrophobicContact CB-CD2 4.02Å; V527-F529 HydrophobicContact CB-CE2 3.64Å; V527-F529 HydrophobicContact CB-CZ 4.13Å; V527-F529 HydrophobicContact CG1-CD1 4.27Å; V527-F529 HydrophobicContact CG1-CD2 3.83Å; V527-F529 HydrophobicContact CG1-CE1 4.1Å; V527-F529 HydrophobicContact CG1-CE2 3.65Å; V527-F529 HydrophobicContact CG1-CG 4.15Å; V527-F529 HydrophobicContact CG1-CZ 3.79Å; V527-F529 PolarHBondContact O-N 3.1Å; V527-F529 VanDerWaalsContact O-N 3.16Å; F529-V532 PolarHBondContact O-N 3.45Å; F529-Q533 WeakPolarHBondContact O-CB 3.37Å; F529-Q533 PolarHBondContact O-N 3.43Å; F529-E551 VanDerWaalsContact CB-OE2 3.23Å; F529-E551 WeakPolarHBondContact CB-OE2 3.41Å; F529-E551 HydrophobicContact CD1-CG 3.83Å; F529-E551 WeakPolarHBondContact CD1-OE2 3.45Å; F529-E551 HydrophobicContact CD2-CG 4.28Å; F529-E551 WeakPolarHBondContact CD2-OE1 3.43Å; F529-E551 HydrophobicContact CE1-CG 3.75Å; F529-E551 HydrophobicContact CE2-CG 4.19Å; F529-E551 HydrophobicContact CG-CG 4.1Å; F529-E551 WeakPolarHBondContact CG-OE2 3.27Å; F529-E551 HydrophobicContact CZ-CG 3.94Å; F529-V606 HydrophobicContact CE1-CG2 4.08Å
530	A	91	Very high	91.6	Very high	72 Å²	72	55.9 Å²	55.9	60%	0.595	29%	0.287	S	S	*	.	H	α-helix	trans	-66.1	-49.8	176	0	0	0	0	0	110.9	D528 V532 Q533 E534	D528-A530 VanDerWaalsContact C-N 3.27Å; D528-A530 PolarHBondContact O-N 2.85Å; D528-A530 PolarHBondContact OD1-N 3.16Å; A530-V532 VanDerWaalsContact C-N 3.35Å; A530-V532 PolarHBondContact O-N 2.9Å; A530-Q533 PolarHBondContact O-N 3.5Å; A530-E534 WeakPolarHBondContact O-CB 3.38Å; A530-E534 PolarHBondContact O-N 3.35Å
531	N	90.9	Very high	90.8	Very high	51 Å²	51	63.4 Å²	63.4	27%	0.273	32%	0.322	S	S	.	.	H	α-helix	trans	-66.1	-33.2	174.9	167.7	69.4	0	0	0	112.8	D528 Q535	D528-N531 HydrophobicContact CB-CB 4.29Å; D528-N531 PolarHBondContact O-N 2.93Å; D528-N531 WeakPolarHBondContact OD1-CB 3.43Å; D528-N531 PolarHBondContact OD1-N 3.25Å; N531-Q535 PolarHBondContact ND2-NE2 3.38Å; N531-Q535 WeakPolarHBondContact O-CB 3.32Å; N531-Q535 WeakPolarHBondContact O-CG 3.22Å; N531-Q535 PolarHBondContact O-N 3.45Å; N531-Q535 VanDerWaalsContact O-N 3.08Å; N531-Q535 PolarHBondContact OD1-NE2 2.96Å
532	V	92.1	Very high	90	Very high	0 Å²	0	64 Å²	64	0%	0	33%	0.328	C	S	.	.	H	α-helix	trans	-66.6	-44.4	172.5	169.2	0	0	0	0	111.3	D528 F529 A530 A536 Y602 M605 V606 D609	D528-V532 WeakPolarHBondContact O-CG2 3.48Å; D528-V532 PolarHBondContact O-N 2.79Å; F529-V532 PolarHBondContact O-N 3.45Å; A530-V532 VanDerWaalsContact C-N 3.35Å; A530-V532 PolarHBondContact O-N 2.9Å; V532-A536 VanDerWaalsContact O-CB 3.23Å; V532-A536 WeakPolarHBondContact O-CB 3.25Å; V532-A536 PolarHBondContact O-N 3.41Å; V532-Y602 HydrophobicContact CG1-CE1 4.17Å; V532-Y602 HydrophobicContact CG1-CE2 4Å; V532-M605 HydrophobicContact CG1-CB 3.9Å; V532-M605 HydrophobicContact CG2-CB 4.49Å; V532-V606 HydrophobicContact CG1-CG2 4.06Å; V532-D609 HydrophobicContact CG2-CB 4.39Å
533	Q	89.6	Confident	89.4	Confident	36 Å²	36	67.9 Å²	67.9	17%	0.168	34%	0.34	C	S	.	.	H	α-helix	trans	-64.7	-43.8	177.9	-170.6	-167	-69.6	0	0	111.3	F529 A530 A536 S537 E544 V547	F529-Q533 WeakPolarHBondContact O-CB 3.37Å; F529-Q533 PolarHBondContact O-N 3.43Å; A530-Q533 PolarHBondContact O-N 3.5Å; Q533-A536 PolarHBondContact O-N 3.2Å; Q533-S537 WeakPolarHBondContact O-CB 3.47Å; Q533-S537 PolarHBondContact O-N 3.3Å; Q533-E544 PolarHBondContact NE2-OE1 2.99Å; Q533-V547 HydrophobicContact CG-CG1 4.31Å
534	E	88.3	Confident	88.8	Confident	116 Å²	116	72.7 Å²	72.7	54%	0.542	36%	0.362	S	S	.	.	H	α-helix	trans	-58.8	-55.5	175.5	-174.3	-176.2	174.5	0	0	110.8	A530 A536 S537 W538	A530-E534 WeakPolarHBondContact O-CB 3.38Å; A530-E534 PolarHBondContact O-N 3.35Å; E534-A536 PolarHBondContact O-N 3.37Å; E534-S537 PolarHBondContact O-N 2.98Å; E534-S537 PolarHBondContact O-OG 2.95Å; E534-W538 PolarHBondContact O-N 3.15Å
535	Q	88.4	Confident	88.4	Confident	68 Å²	68	74.6 Å²	74.6	32%	0.318	38%	0.383	S	S	.	.	H	α-helix	trans	-62.8	-28.8	-179.5	-68.7	-175.1	33.6	0	0	113	N531	N531-Q535 PolarHBondContact ND2-NE2 3.38Å; N531-Q535 WeakPolarHBondContact O-CB 3.32Å; N531-Q535 WeakPolarHBondContact O-CG 3.22Å; N531-Q535 PolarHBondContact O-N 3.45Å; N531-Q535 VanDerWaalsContact O-N 3.08Å; N531-Q535 PolarHBondContact OD1-NE2 2.96Å
536	A	88.4	Confident	88	Confident	1 Å²	1	72 Å²	72	1%	0.008	37%	0.371	C	S	.	.	H	α-helix	trans	-83.5	-26.4	177.3	0	0	0	0	0	114.3	V532 Q533 E534 V539 C540 F601 Y602	V532-A536 VanDerWaalsContact O-CB 3.23Å; V532-A536 WeakPolarHBondContact O-CB 3.25Å; V532-A536 PolarHBondContact O-N 3.41Å; Q533-A536 PolarHBondContact O-N 3.2Å; E534-A536 PolarHBondContact O-N 3.37Å; A536-V539 PolarHBondContact O-N 3.33Å; A536-C540 WeakPolarHBondContact O-CB 3.48Å; A536-C540 PolarHBondContact O-N 3.03Å; A536-F601 HydrophobicContact CB-CD1 4.44Å; A536-F601 HydrophobicContact CB-CE1 4.18Å; A536-Y602 HydrophobicContact CB-CD2 3.46Å; A536-Y602 VanDerWaalsContact CB-CD2 3.46Å; A536-Y602 HydrophobicContact CB-CE2 3.8Å
537	S	86.1	Confident	87.7	Confident	53 Å²	53	65.3 Å²	65.3	37%	0.371	35%	0.347	S	S	.	.	H	α-helix	trans	-67.1	-42.1	175.8	71	0	0	0	0	110.9	Q533 E534 V539 Q541	Q533-S537 WeakPolarHBondContact O-CB 3.47Å; Q533-S537 PolarHBondContact O-N 3.3Å; E534-S537 PolarHBondContact O-N 2.98Å; E534-S537 PolarHBondContact O-OG 2.95Å; S537-V539 VanDerWaalsContact C-N 3.28Å; S537-V539 PolarHBondContact O-N 3.28Å; S537-Q541 WeakPolarHBondContact O-CA 3.39Å; S537-Q541 PolarHBondContact O-N 3.41Å
538	W	84.2	Confident	87.5	Confident	205 Å²	205	68.1 Å²	68.1	78%	0.777	36%	0.359	S	S	*	.	H	α-helix	trans	-55.9	-35.4	174.5	-76.6	109.6	0	0	0	114.2	E534	E534-W538 PolarHBondContact O-N 3.15Å
539	V	86.3	Confident	87.4	Confident	94 Å²	94	69.1 Å²	69.1	57%	0.57	36%	0.362	S	S	*	.	H	α-helix	trans	-100.3	-44.4	-173.7	-179.8	0	0	0	0	112.6	A536 S537 F601	A536-V539 PolarHBondContact O-N 3.33Å; S537-V539 VanDerWaalsContact C-N 3.28Å; S537-V539 PolarHBondContact O-N 3.28Å; V539-F601 HydrophobicContact CB-CE1 4.04Å; V539-F601 HydrophobicContact CB-CE2 4.37Å; V539-F601 HydrophobicContact CB-CZ 3.85Å; V539-F601 HydrophobicContact CG1-CD2 4.25Å; V539-F601 HydrophobicContact CG1-CE1 4.26Å; V539-F601 HydrophobicContact CG1-CE2 3.83Å; V539-F601 HydrophobicContact CG1-CZ 3.84Å; V539-F601 HydrophobicContact CG2-CE1 4.42Å; V539-F601 HydrophobicContact CG2-CZ 3.88Å
540	C	82.9	Confident	87.4	Confident	17 Å²	17	69.6 Å²	69.6	12%	0.115	37%	0.365	C	S	.	.	H	α-helix	trans	-104.9	-13.9	-170.8	-71.3	0	0	0	0	114	A536 C542 K598 F601	A536-C540 WeakPolarHBondContact O-CB 3.48Å; A536-C540 PolarHBondContact O-N 3.03Å; C540-C542 VanDerWaalsContact C-N 3.31Å; C540-C542 PolarHBondContact O-N 2.93Å; C540-K598 HydrophobicContact CB-CB 4.35Å; C540-K598 HydrophobicContact CB-CD 4.36Å; C540-K598 HydrophobicContact CB-CG 3.97Å; C540-K598 VanDerWaalsContact O-CD 3.3Å; C540-K598 WeakPolarHBondContact O-CD 3.47Å; C540-K598 WeakPolarHBondContact O-CE 3.44Å; C540-K598 PolarHBondContact O-NZ 3.4Å; C540-F601 WeakPolarHBondContact SG-CD1 3.43Å; C540-F601 VanDerWaalsContact SG-CG 3.59Å
541	Q	81.4	Confident	87.4	Confident	157 Å²	157	68 Å²	68	73%	0.734	35%	0.345	S	S	*	.			trans	45.5	58	-174.5	-61.1	177.8	-3.1	0	0	110.9	S537 K598	S537-Q541 WeakPolarHBondContact O-CA 3.39Å; S537-Q541 PolarHBondContact O-N 3.41Å; Q541-K598 PolarHBondContact O-NZ 2.99Å
542	C	79.6	Confident	87.5	Confident	36 Å²	36	71.4 Å²	71.4	24%	0.243	36%	0.359	C	S	.	.			trans	-82.6	142.5	173.7	-64	0	0	0	0	109.5	C540 E544 V547	C540-C542 VanDerWaalsContact C-N 3.31Å; C540-C542 PolarHBondContact O-N 2.93Å; C542-E544 PolarHBondContact O-N 2.81Å; C542-V547 HydrophobicContact CB-CG2 3.57Å
543	E	83.5	Confident	87.7	Confident	142 Å²	142	73.5 Å²	73.5	66%	0.664	37%	0.371	S	S	*	.			trans	-67.5	124	173.1	-173.4	-176.8	159.4	0	0	110.2	G545 V546 V547	E543-G545 PolarHBondContact O-N 3.44Å; E543-V546 HydrophobicContact CB-CB 4.29Å; E543-V546 HydrophobicContact CB-CG2 4.02Å; E543-V546 HydrophobicContact CG-CG2 4.19Å; E543-V546 PolarHBondContact O-N 2.88Å; E543-V547 WeakPolarHBondContact O-CG2 3.47Å; E543-V547 PolarHBondContact O-N 2.97Å
544	E	84	Confident	87.9	Confident	109 Å²	109	73.3 Å²	73.3	51%	0.509	37%	0.369	S	S	.	.	H	α-helix	trans	-57.2	-45.7	-175.1	171.7	163.2	-152.2	0	0	112.7	Q533 C542 V546 V547 Q548	Q533-E544 PolarHBondContact NE2-OE1 2.99Å; C542-E544 PolarHBondContact O-N 2.81Å; E544-V546 VanDerWaalsContact C-N 3.32Å; E544-V546 PolarHBondContact O-N 3.38Å; E544-V547 PolarHBondContact O-N 3.47Å; E544-Q548 HydrophobicContact CG-CG 4.38Å; E544-Q548 VanDerWaalsContact CG-NE2 3.28Å; E544-Q548 WeakPolarHBondContact O-CG 3.29Å; E544-Q548 PolarHBondContact O-N 3.26Å; E544-Q548 PolarHBondContact OE1-NE2 2.81Å
545	G	87.1	Confident	88.1	Confident	44 Å²	44	70 Å²	70	45%	0.454	35%	0.353	S	S	.	.	H	α-helix	trans	-60.7	-39.2	179.3	0	0	0	0	0	113.1	E543 H549	E543-G545 PolarHBondContact O-N 3.44Å; G545-H549 VanDerWaalsContact O-CB 3.32Å; G545-H549 WeakPolarHBondContact O-CB 3.41Å; G545-H549 PolarHBondContact O-N 3.19Å
546	V	87.1	Confident	88.4	Confident	52 Å²	52	68.5 Å²	68.5	32%	0.315	35%	0.352	S	S	.	.	H	α-helix	trans	-66.3	-47	175.5	178	0	0	0	0	110.4	E543 E544 Q548 H549 L550 V578	E543-V546 HydrophobicContact CB-CB 4.29Å; E543-V546 HydrophobicContact CB-CG2 4.02Å; E543-V546 HydrophobicContact CG-CG2 4.19Å; E543-V546 PolarHBondContact O-N 2.88Å; E544-V546 VanDerWaalsContact C-N 3.32Å; E544-V546 PolarHBondContact O-N 3.38Å; V546-Q548 PolarHBondContact O-N 3.37Å; V546-H549 PolarHBondContact O-N 2.95Å; V546-L550 HydrophobicContact CG1-CD1 4.01Å; V546-L550 HydrophobicContact CG1-CG 4.38Å; V546-L550 VanDerWaalsContact O-CG 3.25Å; V546-L550 WeakPolarHBondContact O-CG 3.27Å; V546-L550 PolarHBondContact O-N 3.4Å; V546-V578 HydrophobicContact CG1-CG2 4.48Å
547	V	89.3	Confident	88.7	Confident	14 Å²	14	69.3 Å²	69.3	9%	0.085	36%	0.357	C	S	.	.	H	α-helix	trans	-59.9	-45.8	179.3	171.8	0	0	0	0	111.6	Q533 C542 E543 E544 L550 E551 Y602	Q533-V547 HydrophobicContact CG-CG1 4.31Å; C542-V547 HydrophobicContact CB-CG2 3.57Å; E543-V547 WeakPolarHBondContact O-CG2 3.47Å; E543-V547 PolarHBondContact O-N 2.97Å; E544-V547 PolarHBondContact O-N 3.47Å; V547-L550 PolarHBondContact O-N 3.02Å; V547-E551 PolarHBondContact O-N 3.37Å; V547-Y602 HydrophobicContact CG1-CE1 4.2Å; V547-Y602 HydrophobicContact CG1-CE2 3.6Å; V547-Y602 WeakPolarHBondContact CG1-OH 3.23Å; V547-Y602 HydrophobicContact CG2-CE2 4.41Å
548	Q	90.3	Very high	89	Confident	71 Å²	71	66.9 Å²	66.9	33%	0.332	34%	0.34	S	S	.	.	H	α-helix	trans	-68	-36.4	179.6	-70.5	176.3	5.3	0	0	112.5	E544 V546 E551 Q552	E544-Q548 HydrophobicContact CG-CG 4.38Å; E544-Q548 VanDerWaalsContact CG-NE2 3.28Å; E544-Q548 WeakPolarHBondContact O-CG 3.29Å; E544-Q548 PolarHBondContact O-N 3.26Å; E544-Q548 PolarHBondContact OE1-NE2 2.81Å; V546-Q548 PolarHBondContact O-N 3.37Å; Q548-E551 PolarHBondContact O-N 3.16Å; Q548-Q552 WeakPolarHBondContact O-CB 3.47Å; Q548-Q552 VanDerWaalsContact O-CG 3.25Å; Q548-Q552 WeakPolarHBondContact O-CG 3.21Å; Q548-Q552 PolarHBondContact O-N 2.91Å; Q548-Q552 VanDerWaalsContact O-N 3.1Å; Q548-Q552 PolarHBondContact O-NE2 3.17Å
549	H	92.1	Very high	89.5	Confident	88 Å²	88	64 Å²	64	41%	0.407	34%	0.335	S	S	.	.	H	α-helix	trans	-64.6	-44.7	173.9	-174.4	5.2	0	0	0	111.4	G545 V546 E551 Q552 D553	G545-H549 VanDerWaalsContact O-CB 3.32Å; G545-H549 WeakPolarHBondContact O-CB 3.41Å; G545-H549 PolarHBondContact O-N 3.19Å; V546-H549 PolarHBondContact O-N 2.95Å; H549-E551 VanDerWaalsContact C-N 3.34Å; H549-E551 PolarHBondContact O-N 2.85Å; H549-Q552 PolarHBondContact O-N 3.15Å; H549-D553 VanDerWaalsContact CE1-CG 3.49Å; H549-D553 IonicContact CE1-OD1 3.38Å; H549-D553 PolarHBondContact CE1-OD1 3.12Å; H549-D553 IonicContact CE1-OD2 2.86Å; H549-D553 PolarHBondContact CE1-OD2 3.29Å; H549-D553 IonicContact ND1-OD1 2.66Å; H549-D553 PolarHBondContact ND1-OD1 3.05Å; H549-D553 IonicContact ND1-OD2 3.72Å; H549-D553 WeakPolarHBondContact O-CB 3.25Å; H549-D553 PolarHBondContact O-N 2.8Å
550	L	92.8	Very high	89.9	Confident	36 Å²	36	66.1 Å²	66.1	19%	0.188	34%	0.339	C	S	.	.	H	α-helix	trans	-63.5	-36.7	177.9	-67.7	176.1	0	0	0	112.9	V546 V547 F554 W570 V574	V546-L550 HydrophobicContact CG1-CD1 4.01Å; V546-L550 HydrophobicContact CG1-CG 4.38Å; V546-L550 VanDerWaalsContact O-CG 3.25Å; V546-L550 WeakPolarHBondContact O-CG 3.27Å; V546-L550 PolarHBondContact O-N 3.4Å; V547-L550 PolarHBondContact O-N 3.02Å; L550-F554 VanDerWaalsContact O-CB 3.31Å; L550-F554 WeakPolarHBondContact O-CB 3.26Å; L550-F554 PolarHBondContact O-N 3.39Å; L550-W570 HydrophobicContact CB-CZ2 4.49Å; L550-W570 HydrophobicContact CD2-CZ2 3.94Å; L550-V574 HydrophobicContact CD1-CG1 4.21Å; L550-V574 HydrophobicContact CD2-CB 4.16Å; L550-V574 HydrophobicContact CD2-CG1 3.71Å; L550-V574 HydrophobicContact CD2-CG2 3.33Å
551	E	92.2	Very high	90.3	Very high	38 Å²	38	69.5 Å²	69.5	18%	0.178	35%	0.353	C	S	.	.	H	α-helix	trans	-65	-45.8	174.1	-170.2	-159.3	131.7	0	0	111.9	F529 V547 Q548 H549 F554 K555	F529-E551 VanDerWaalsContact CB-OE2 3.23Å; F529-E551 WeakPolarHBondContact CB-OE2 3.41Å; F529-E551 HydrophobicContact CD1-CG 3.83Å; F529-E551 WeakPolarHBondContact CD1-OE2 3.45Å; F529-E551 HydrophobicContact CD2-CG 4.28Å; F529-E551 WeakPolarHBondContact CD2-OE1 3.43Å; F529-E551 HydrophobicContact CE1-CG 3.75Å; F529-E551 HydrophobicContact CE2-CG 4.19Å; F529-E551 HydrophobicContact CG-CG 4.1Å; F529-E551 WeakPolarHBondContact CG-OE2 3.27Å; F529-E551 HydrophobicContact CZ-CG 3.94Å; V547-E551 PolarHBondContact O-N 3.37Å; Q548-E551 PolarHBondContact O-N 3.16Å; H549-E551 VanDerWaalsContact C-N 3.34Å; H549-E551 PolarHBondContact O-N 2.85Å; E551-F554 PolarHBondContact O-N 3.05Å; E551-K555 HydrophobicContact CG-CD 4.37Å; E551-K555 WeakPolarHBondContact O-CB 3.45Å; E551-K555 WeakPolarHBondContact O-CG 3.44Å; E551-K555 PolarHBondContact O-N 3.04Å; E551-K555 WeakPolarHBondContact OE1-CE 3.32Å; E551-K555 IonicContact OE1-NZ 2.7Å; E551-K555 PolarHBondContact OE1-NZ 2.87Å
552	Q	92.9	Very high	90.9	Very high	122 Å²	122	62.3 Å²	62.3	57%	0.57	32%	0.32	S	S	*	.	H	α-helix	trans	-64.3	-44.4	178.9	-72.3	171.1	54.7	0	0	111.5	Q548 H549 K555 A556	Q548-Q552 WeakPolarHBondContact O-CB 3.47Å; Q548-Q552 VanDerWaalsContact O-CG 3.25Å; Q548-Q552 WeakPolarHBondContact O-CG 3.21Å; Q548-Q552 PolarHBondContact O-N 2.91Å; Q548-Q552 VanDerWaalsContact O-N 3.1Å; Q548-Q552 PolarHBondContact O-NE2 3.17Å; H549-Q552 PolarHBondContact O-N 3.15Å; Q552-K555 PolarHBondContact O-N 3.49Å; Q552-A556 WeakPolarHBondContact O-CB 3.25Å; Q552-A556 PolarHBondContact O-N 3.42Å
553	D	94.7	Very high	91.7	Very high	44 Å²	44	62.9 Å²	62.9	24%	0.235	32%	0.324	C	S	.	.	H	α-helix	trans	-62	-44.9	175.9	-81.5	12.9	0	0	0	112.1	H549 K555 A556 T557 W570	H549-D553 VanDerWaalsContact CE1-CG 3.49Å; H549-D553 IonicContact CE1-OD1 3.38Å; H549-D553 PolarHBondContact CE1-OD1 3.12Å; H549-D553 IonicContact CE1-OD2 2.86Å; H549-D553 PolarHBondContact CE1-OD2 3.29Å; H549-D553 IonicContact ND1-OD1 2.66Å; H549-D553 PolarHBondContact ND1-OD1 3.05Å; H549-D553 IonicContact ND1-OD2 3.72Å; H549-D553 WeakPolarHBondContact O-CB 3.25Å; H549-D553 PolarHBondContact O-N 2.8Å; D553-K555 VanDerWaalsContact C-N 3.34Å; D553-K555 PolarHBondContact O-N 2.9Å; D553-A556 PolarHBondContact O-N 2.94Å; D553-T557 VanDerWaalsContact O-CB 3.28Å; D553-T557 WeakPolarHBondContact O-CB 3.4Å; D553-T557 PolarHBondContact O-N 2.78Å; D553-T557 PolarHBondContact O-OG1 3.11Å; D553-W570 HydrophobicContact CB-CZ2 4.01Å; D553-W570 VanDerWaalsContact CB-NE1 3.3Å; D553-W570 PolarHBondContact OD2-NE1 2.95Å; D553-W570 VanDerWaalsContact OD2-NE1 3.09Å
554	F	94.3	Very high	92.3	Very high	33 Å²	33	56.3 Å²	56.3	15%	0.145	29%	0.294	C	S	.	.	H	α-helix	trans	-61.6	-44.3	177.5	-177.2	-82.6	0	0	0	110.8	L524 L550 E551 L558 W567 W570 F621 Y628	L524-F554 HydrophobicContact CD1-CE1 4.37Å; L524-F554 HydrophobicContact CD2-CD1 3.76Å; L524-F554 HydrophobicContact CD2-CE1 3.75Å; L550-F554 VanDerWaalsContact O-CB 3.31Å; L550-F554 WeakPolarHBondContact O-CB 3.26Å; L550-F554 PolarHBondContact O-N 3.39Å; E551-F554 PolarHBondContact O-N 3.05Å; F554-L558 HydrophobicContact CE1-CD2 4.08Å; F554-L558 VanDerWaalsContact O-CB 3.27Å; F554-L558 WeakPolarHBondContact O-CB 3.42Å; F554-L558 PolarHBondContact O-N 3.49Å; F554-W567 HydrophobicContact CD1-CH2 4.41Å; F554-W567 AromaticContact CD2-CH2 3.65Å; F554-W567 HydrophobicContact CD2-CH2 3.65Å; F554-W567 AromaticContact CD2-CZ3 3.42Å; F554-W567 HydrophobicContact CD2-CZ3 3.42Å; F554-W567 VanDerWaalsContact CD2-CZ3 3.42Å; F554-W567 HydrophobicContact CE1-CH2 4.41Å; F554-W567 AromaticContact CE2-CH2 3.64Å; F554-W567 HydrophobicContact CE2-CH2 3.64Å; F554-W567 AromaticContact CE2-CZ3 3.67Å; F554-W567 HydrophobicContact CE2-CZ3 3.67Å; F554-W567 HydrophobicContact CG-CH2 4.04Å; F554-W567 HydrophobicContact CG-CZ3 4.08Å; F554-W567 HydrophobicContact CZ-CH2 4.04Å; F554-W567 WeakPolarHBondContact O-CH2 3.41Å; F554-W570 HydrophobicContact CB-CH2 4.02Å; F554-W570 HydrophobicContact CB-CZ2 4.33Å; F554-W570 HydrophobicContact CD2-CH2 4.06Å; F554-W570 HydrophobicContact CD2-CZ3 4.07Å; F554-F621 AromaticContact CE1-CE1 3.95Å; F554-F621 HydrophobicContact CE1-CE1 3.95Å; F554-F621 AromaticContact CZ-CE1 4Å; F554-F621 HydrophobicContact CZ-CE1 4Å; F554-Y628 HydrophobicContact CD2-CE2 4.31Å; F554-Y628 AromaticContact CE2-CE2 3.85Å; F554-Y628 HydrophobicContact CE2-CE2 3.85Å
555	K	93.5	Very high	92.9	Very high	46 Å²	46	55.1 Å²	55.1	20%	0.2	29%	0.288	C	S	.	.	H	α-helix	trans	-60.4	-46	174.5	-78.7	172.2	173.4	175.8	0	111.8	L524 E551 Q552 D553 Q559	L524-K555 HydrophobicContact CD2-CG 3.64Å; E551-K555 HydrophobicContact CG-CD 4.37Å; E551-K555 WeakPolarHBondContact O-CB 3.45Å; E551-K555 WeakPolarHBondContact O-CG 3.44Å; E551-K555 PolarHBondContact O-N 3.04Å; E551-K555 WeakPolarHBondContact OE1-CE 3.32Å; E551-K555 IonicContact OE1-NZ 2.7Å; E551-K555 PolarHBondContact OE1-NZ 2.87Å; Q552-K555 PolarHBondContact O-N 3.49Å; D553-K555 VanDerWaalsContact C-N 3.34Å; D553-K555 PolarHBondContact O-N 2.9Å; K555-Q559 WeakPolarHBondContact O-CB 3.33Å; K555-Q559 PolarHBondContact O-N 3.19Å
556	A	94.4	Very high	93.3	Very high	36 Å²	36	58.1 Å²	58.1	30%	0.298	29%	0.291	S	S	.	.	H	α-helix	trans	-66	-42.8	-179.9	0	0	0	0	0	112.7	Q552 D553 Q559 Q560	Q552-A556 WeakPolarHBondContact O-CB 3.25Å; Q552-A556 PolarHBondContact O-N 3.42Å; D553-A556 PolarHBondContact O-N 2.94Å; A556-Q559 PolarHBondContact O-N 3.39Å; A556-Q560 WeakPolarHBondContact O-CB 3.44Å; A556-Q560 VanDerWaalsContact O-CG 3.26Å; A556-Q560 WeakPolarHBondContact O-CG 3.38Å; A556-Q560 PolarHBondContact O-N 3.04Å; A556-Q560 PolarHBondContact O-NE2 2.71Å
557	T	93.9	Very high	93.7	Very high	19 Å²	19	55.8 Å²	55.8	12%	0.117	28%	0.276	C	S	.	.	H	α-helix	trans	-68	-38.5	179.8	-53.1	0	0	0	0	111.1	D553 Q560 Q561 S562 W567	D553-T557 VanDerWaalsContact O-CB 3.28Å; D553-T557 WeakPolarHBondContact O-CB 3.4Å; D553-T557 PolarHBondContact O-N 2.78Å; D553-T557 PolarHBondContact O-OG1 3.11Å; T557-Q560 PolarHBondContact O-N 2.68Å; T557-Q561 PolarHBondContact O-N 2.9Å; T557-S562 PolarHBondContact O-N 3.12Å; T557-S562 PolarHBondContact O-OG 2.84Å; T557-W567 HydrophobicContact CG2-CD2 3.53Å; T557-W567 HydrophobicContact CG2-CE3 3.57Å; T557-W567 HydrophobicContact CG2-CG 4.23Å; T557-W567 HydrophobicContact CG2-CH2 3.91Å; T557-W567 HydrophobicContact CG2-CZ2 3.82Å; T557-W567 HydrophobicContact CG2-CZ3 3.75Å
558	L	93	Very high	94.1	Very high	1 Å²	1	55.3 Å²	55.3	1%	0.005	27%	0.274	C	S	.	.	H	α-helix	trans	-67.4	-40.1	172.8	-170.9	63.8	0	0	0	111.9	I517 M520 L521 L524 F554 Q560 Q561 W567	I517-L558 HydrophobicContact CG1-CD1 4.36Å; I517-L558 HydrophobicContact CG2-CD1 3.86Å; I517-L558 HydrophobicContact CG2-CG 4.08Å; I517-L558 VanDerWaalsContact CG2-O 3.23Å; I517-L558 WeakPolarHBondContact CG2-O 3.46Å; M520-L558 HydrophobicContact CB-CD2 3.99Å; L521-L558 HydrophobicContact CD1-CG 4.46Å; L521-L558 HydrophobicContact CD2-CB 3.98Å; L521-L558 HydrophobicContact CD2-CD2 3.76Å; L521-L558 HydrophobicContact CD2-CG 3.82Å; L521-L558 HydrophobicContact CG-CD2 3.82Å; L521-L558 HydrophobicContact CG-CG 3.84Å; L524-L558 HydrophobicContact CD2-CD2 4.28Å; F554-L558 HydrophobicContact CE1-CD2 4.08Å; F554-L558 VanDerWaalsContact O-CB 3.27Å; F554-L558 WeakPolarHBondContact O-CB 3.42Å; F554-L558 PolarHBondContact O-N 3.49Å; L558-Q560 VanDerWaalsContact C-N 3.34Å; L558-Q560 PolarHBondContact O-N 2.74Å; L558-Q561 PolarHBondContact O-N 3.44Å; L558-W567 HydrophobicContact CB-CH2 3.95Å; L558-W567 HydrophobicContact CB-CZ2 3.81Å; L558-W567 HydrophobicContact CD1-CZ2 4.04Å
559	Q	93.8	Very high	94.4	Very high	145 Å²	145	54.4 Å²	54.4	68%	0.678	28%	0.279	S	S	*	.	H	α-helix	trans	-66.3	-33.4	176	-172.6	176.7	3.8	0	0	113	L521 K555 A556 Q561	L521-Q559 HydrophobicContact CD1-CB 4.41Å; L521-Q559 HydrophobicContact CD2-CB 4.26Å; K555-Q559 WeakPolarHBondContact O-CB 3.33Å; K555-Q559 PolarHBondContact O-N 3.19Å; A556-Q559 PolarHBondContact O-N 3.39Å; Q559-Q561 PolarHBondContact O-N 2.99Å
560	Q	94.3	Very high	94.6	Very high	139 Å²	139	51.6 Å²	51.6	65%	0.65	26%	0.264	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.7	-8.8	175.4	-75	171.8	59.1	0	0	113.8	A556 T557 L558 S562	A556-Q560 WeakPolarHBondContact O-CB 3.44Å; A556-Q560 VanDerWaalsContact O-CG 3.26Å; A556-Q560 WeakPolarHBondContact O-CG 3.38Å; A556-Q560 PolarHBondContact O-N 3.04Å; A556-Q560 PolarHBondContact O-NE2 2.71Å; T557-Q560 PolarHBondContact O-N 2.68Å; L558-Q560 VanDerWaalsContact C-N 3.34Å; L558-Q560 PolarHBondContact O-N 2.74Å; Q560-S562 PolarHBondContact O-N 3.28Å
561	Q	93.1	Very high	94.9	Very high	88 Å²	88	50 Å²	50	41%	0.411	26%	0.256	S	S	.	.	T	Hydrogen-bonded Turn	trans	55.2	39.2	-173	-57.5	179.6	57.3	0	0	112.1	T514 I517 T557 L558 Q559	T514-Q561 VanDerWaalsContact CG2-OE1 3.27Å; T514-Q561 PolarHBondContact OG1-OE1 3.01Å; I517-Q561 HydrophobicContact CD1-CB 4.21Å; I517-Q561 HydrophobicContact CD1-CG 4.05Å; I517-Q561 HydrophobicContact CG2-CG 4.13Å; T557-Q561 PolarHBondContact O-N 2.9Å; L558-Q561 PolarHBondContact O-N 3.44Å; Q559-Q561 PolarHBondContact O-N 2.99Å
562	S	93.7	Very high	95.1	Very high	6 Å²	6	50.3 Å²	50.3	4%	0.042	26%	0.259	C	S	.	.			trans	-61.4	145.6	-175.6	-58.3	0	0	0	0	112.9	T557 Q560 Q566 W567	T557-S562 PolarHBondContact O-N 3.12Å; T557-S562 PolarHBondContact O-OG 2.84Å; Q560-S562 PolarHBondContact O-N 3.28Å; S562-Q566 VanDerWaalsContact CA-OE1 3.26Å; S562-W567 VanDerWaalsContact O-CD1 3.29Å; S562-W567 PolarHBondContact O-NE1 3.49Å
563	S	95.4	Very high	95.2	Very high	47 Å²	47	48.6 Å²	48.6	33%	0.329	25%	0.253	S	S	.	.			trans	-68.9	162.1	-179.5	88.1	0	0	0	0	111.9	E565 Q566 W567	S563-E565 WeakPolarHBondContact CB-OE2 3.31Å; S563-E565 PolarHBondContact O-N 3.36Å; S563-E565 PolarHBondContact OG-N 3.37Å; S563-E565 PolarHBondContact OG-OE2 2.93Å; S563-Q566 WeakPolarHBondContact O-CB 3.23Å; S563-Q566 PolarHBondContact O-N 3.21Å; S563-W567 VanDerWaalsContact O-CD1 3.26Å; S563-W567 PolarHBondContact O-N 3.07Å
564	L	96.1	Very high	95.3	Very high	5 Å²	5	46.7 Å²	46.7	3%	0.026	24%	0.243	C	C	.	.	H	α-helix	trans	-58.7	-32.9	-179.7	176.9	59.2	0	0	0	112.3	L446 A504 R508 L511 W567 A568 L627	L446-L564 HydrophobicContact CD2-CD2 4.37Å; L446-L564 HydrophobicContact CD2-CG 4.47Å; A504-L564 HydrophobicContact CB-CD2 3.83Å; A504-L564 VanDerWaalsContact O-CD2 3.25Å; A504-L564 WeakPolarHBondContact O-CD2 3.49Å; R508-L564 HydrophobicContact CB-CD2 4.07Å; L511-L564 HydrophobicContact CD1-CB 4.32Å; L511-L564 HydrophobicContact CD1-CD1 4.01Å; L564-W567 PolarHBondContact O-N 3.42Å; L564-A568 WeakPolarHBondContact O-CB 3.42Å; L564-A568 PolarHBondContact O-N 2.91Å; L564-L627 HydrophobicContact CD1-CD2 3.69Å
565	E	96.3	Very high	95.4	Very high	83 Å²	83	45.1 Å²	45.1	39%	0.388	24%	0.237	S	C	.	.	H	α-helix	trans	-70	-34.4	178.4	-53.8	72.2	-154.3	0	0	111.2	R508 S563 A569	R508-E565 IonicContact CZ-OE1 3.26Å; R508-E565 IonicContact NE-OE1 3.43Å; R508-E565 PolarHBondContact NE-OE1 3.37Å; R508-E565 IonicContact NH2-OE1 2.71Å; R508-E565 PolarHBondContact NH2-OE1 3.2Å; S563-E565 WeakPolarHBondContact CB-OE2 3.31Å; S563-E565 PolarHBondContact O-N 3.36Å; S563-E565 PolarHBondContact OG-N 3.37Å; S563-E565 PolarHBondContact OG-OE2 2.93Å; E565-A569 WeakPolarHBondContact O-CB 3.43Å; E565-A569 PolarHBondContact O-N 2.98Å
566	Q	96.2	Very high	95.4	Very high	108 Å²	108	44.9 Å²	44.9	51%	0.505	24%	0.239	S	C	.	.	H	α-helix	trans	-71.2	-40	172.7	-64.7	178.5	-60.8	0	0	111.6	S562 S563 A568 A569 W570	S562-Q566 VanDerWaalsContact CA-OE1 3.26Å; S563-Q566 WeakPolarHBondContact O-CB 3.23Å; S563-Q566 PolarHBondContact O-N 3.21Å; Q566-A568 VanDerWaalsContact C-N 3.34Å; Q566-A569 PolarHBondContact O-N 2.86Å; Q566-W570 PolarHBondContact O-N 2.85Å
567	W	96.4	Very high	95.4	Very high	2 Å²	2	48.7 Å²	48.7	1%	0.008	25%	0.251	C	S	.	.	H	α-helix	trans	-61.6	-41.2	171.4	-78.4	106.4	0	0	0	112.4	L511 F554 T557 L558 S562 S563 L564 W570 L571 Y628	L511-W567 HydrophobicContact CD1-CG 4.4Å; F554-W567 HydrophobicContact CD1-CH2 4.41Å; F554-W567 AromaticContact CD2-CH2 3.65Å; F554-W567 HydrophobicContact CD2-CH2 3.65Å; F554-W567 AromaticContact CD2-CZ3 3.42Å; F554-W567 HydrophobicContact CD2-CZ3 3.42Å; F554-W567 VanDerWaalsContact CD2-CZ3 3.42Å; F554-W567 HydrophobicContact CE1-CH2 4.41Å; F554-W567 AromaticContact CE2-CH2 3.64Å; F554-W567 HydrophobicContact CE2-CH2 3.64Å; F554-W567 AromaticContact CE2-CZ3 3.67Å; F554-W567 HydrophobicContact CE2-CZ3 3.67Å; F554-W567 HydrophobicContact CG-CH2 4.04Å; F554-W567 HydrophobicContact CG-CZ3 4.08Å; F554-W567 HydrophobicContact CZ-CH2 4.04Å; F554-W567 WeakPolarHBondContact O-CH2 3.41Å; T557-W567 HydrophobicContact CG2-CD2 3.53Å; T557-W567 HydrophobicContact CG2-CE3 3.57Å; T557-W567 HydrophobicContact CG2-CG 4.23Å; T557-W567 HydrophobicContact CG2-CH2 3.91Å; T557-W567 HydrophobicContact CG2-CZ2 3.82Å; T557-W567 HydrophobicContact CG2-CZ3 3.75Å; L558-W567 HydrophobicContact CB-CH2 3.95Å; L558-W567 HydrophobicContact CB-CZ2 3.81Å; L558-W567 HydrophobicContact CD1-CZ2 4.04Å; S562-W567 VanDerWaalsContact O-CD1 3.29Å; S562-W567 PolarHBondContact O-NE1 3.49Å; S563-W567 VanDerWaalsContact O-CD1 3.26Å; S563-W567 PolarHBondContact O-N 3.07Å; L564-W567 PolarHBondContact O-N 3.42Å; W567-W570 AromaticContact CE3-CE3 3.91Å; W567-W570 HydrophobicContact CE3-CE3 3.91Å; W567-W570 HydrophobicContact CE3-CZ3 4.31Å; W567-W570 HydrophobicContact CZ3-CE3 4.11Å; W567-W570 HydrophobicContact CZ3-CZ3 4.16Å; W567-W570 WeakPolarHBondContact O-CB 3.36Å; W567-W570 PolarHBondContact O-N 3.4Å; W567-L571 WeakPolarHBondContact O-CG 3.44Å; W567-L571 PolarHBondContact O-N 3.01Å; W567-Y628 VanDerWaalsContact CD2-OH 3.22Å; W567-Y628 WeakPolarHBondContact CZ3-OH 3.29Å
568	A	97.2	Very high	95.3	Very high	5 Å²	5	49.8 Å²	49.8	4%	0.041	26%	0.258	C	S	.	.	H	α-helix	trans	-63.8	-43.2	175.3	0	0	0	0	0	112.1	L446 L564 Q566 W570 L571 D572 Y631	L446-A568 HydrophobicContact CD1-CB 3.41Å; L446-A568 VanDerWaalsContact CD1-CB 3.41Å; L564-A568 WeakPolarHBondContact O-CB 3.42Å; L564-A568 PolarHBondContact O-N 2.91Å; Q566-A568 VanDerWaalsContact C-N 3.34Å; A568-W570 VanDerWaalsContact C-N 3.31Å; A568-W570 PolarHBondContact O-N 3.36Å; A568-L571 PolarHBondContact O-N 3.12Å; A568-D572 PolarHBondContact O-N 3.25Å; A568-Y631 HydrophobicContact CB-CE1 3.67Å
569	A	97.1	Very high	95.3	Very high	52 Å²	52	50 Å²	50	43%	0.43	26%	0.258	S	S	.	.	H	α-helix	trans	-62.8	-35.9	173.7	0	0	0	0	0	112.4	E565 Q566 N573	E565-A569 WeakPolarHBondContact O-CB 3.43Å; E565-A569 PolarHBondContact O-N 2.98Å; Q566-A569 PolarHBondContact O-N 2.86Å; A569-N573 PolarHBondContact O-N 2.94Å; A569-N573 VanDerWaalsContact O-N 3.09Å; A569-N573 PolarHBondContact O-ND2 2.96Å
570	W	96.3	Very high	95.3	Very high	28 Å²	28	49.5 Å²	49.5	11%	0.106	25%	0.254	C	S	.	.	H	α-helix	trans	-62.1	-50.2	171	175.5	70.2	0	0	0	111.2	L550 D553 F554 Q566 W567 A568 D572 N573 V574 Y628	L550-W570 HydrophobicContact CB-CZ2 4.49Å; L550-W570 HydrophobicContact CD2-CZ2 3.94Å; D553-W570 HydrophobicContact CB-CZ2 4.01Å; D553-W570 VanDerWaalsContact CB-NE1 3.3Å; D553-W570 PolarHBondContact OD2-NE1 2.95Å; D553-W570 VanDerWaalsContact OD2-NE1 3.09Å; F554-W570 HydrophobicContact CB-CH2 4.02Å; F554-W570 HydrophobicContact CB-CZ2 4.33Å; F554-W570 HydrophobicContact CD2-CH2 4.06Å; F554-W570 HydrophobicContact CD2-CZ3 4.07Å; Q566-W570 PolarHBondContact O-N 2.85Å; W567-W570 AromaticContact CE3-CE3 3.91Å; W567-W570 HydrophobicContact CE3-CE3 3.91Å; W567-W570 HydrophobicContact CE3-CZ3 4.31Å; W567-W570 HydrophobicContact CZ3-CE3 4.11Å; W567-W570 HydrophobicContact CZ3-CZ3 4.16Å; W567-W570 WeakPolarHBondContact O-CB 3.36Å; W567-W570 PolarHBondContact O-N 3.4Å; A568-W570 VanDerWaalsContact C-N 3.31Å; A568-W570 PolarHBondContact O-N 3.36Å; W570-D572 VanDerWaalsContact C-N 3.32Å; W570-D572 PolarHBondContact O-N 3.15Å; W570-N573 WeakPolarHBondContact O-CA 3.34Å; W570-N573 WeakPolarHBondContact O-CB 3.36Å; W570-N573 PolarHBondContact O-N 3.07Å; W570-V574 HydrophobicContact CD2-CG2 4.2Å; W570-V574 HydrophobicContact CZ2-CG2 4.1Å; W570-V574 WeakPolarHBondContact O-CG2 3.46Å; W570-V574 PolarHBondContact O-N 3.2Å; W570-Y628 HydrophobicContact CZ3-CE2 4.2Å
571	L	97.3	Very high	95.3	Very high	2 Å²	2	46.5 Å²	46.5	1%	0.01	25%	0.247	C	C	.	.	H	α-helix	trans	-58.2	-40	178.7	-65.1	167.5	0	0	0	112.6	W567 A568 V574 V575 W599 Y628 Y631 M632 L635	W567-L571 WeakPolarHBondContact O-CG 3.44Å; W567-L571 PolarHBondContact O-N 3.01Å; A568-L571 PolarHBondContact O-N 3.12Å; L571-V574 WeakPolarHBondContact O-CB 3.33Å; L571-V574 PolarHBondContact O-N 3.12Å; L571-V575 WeakPolarHBondContact O-CG2 3.23Å; L571-V575 PolarHBondContact O-N 3.09Å; L571-W599 HydrophobicContact CD2-CH2 3.92Å; L571-W599 HydrophobicContact CD2-CZ2 4.17Å; L571-Y628 HydrophobicContact CD1-CD1 3.62Å; L571-Y628 HydrophobicContact CD1-CD2 4.36Å; L571-Y628 HydrophobicContact CD1-CE1 3.75Å; L571-Y628 HydrophobicContact CD1-CE2 4.46Å; L571-Y628 HydrophobicContact CD1-CG 3.95Å; L571-Y628 HydrophobicContact CD2-CD2 3.93Å; L571-Y628 HydrophobicContact CD2-CE2 4.1Å; L571-Y628 HydrophobicContact CD2-CG 4.2Å; L571-Y631 HydrophobicContact CB-CD1 4.1Å; L571-Y631 HydrophobicContact CB-CE1 4.31Å; L571-Y631 HydrophobicContact CD1-CD1 3.69Å; L571-Y631 HydrophobicContact CD1-CE1 4.43Å; L571-M632 HydrophobicContact CB-CE 4.08Å; L571-M632 HydrophobicContact CD2-CE 3.53Å; L571-M632 HydrophobicContact CG-CE 4.4Å; L571-L635 HydrophobicContact CB-CD1 3.99Å
572	D	96.9	Very high	95.3	Very high	45 Å²	45	46.6 Å²	46.6	24%	0.241	24%	0.244	C	C	.	.	H	α-helix	trans	-66.6	-37.2	174.7	-175.4	49.8	0	0	0	112.8	A568 W570 V574 V575 T576 L635 R639	A568-D572 PolarHBondContact O-N 3.25Å; W570-D572 VanDerWaalsContact C-N 3.32Å; W570-D572 PolarHBondContact O-N 3.15Å; D572-V574 VanDerWaalsContact C-N 3.32Å; D572-V574 PolarHBondContact O-N 3.37Å; D572-V575 PolarHBondContact O-N 2.85Å; D572-T576 VanDerWaalsContact O-CB 3.27Å; D572-T576 WeakPolarHBondContact O-CB 3.08Å; D572-T576 PolarHBondContact O-N 3.14Å; D572-T576 PolarHBondContact O-OG1 3.04Å; D572-L635 HydrophobicContact CB-CD1 4.17Å; D572-L635 HydrophobicContact CB-CD2 3.93Å; D572-R639 IonicContact OD1-CZ 2.82Å; D572-R639 IonicContact OD1-NE 3.98Å; D572-R639 PolarHBondContact OD1-NE 2.95Å; D572-R639 IonicContact OD1-NH2 2.71Å; D572-R639 PolarHBondContact OD1-NH2 3.19Å; D572-R639 IonicContact OD2-NH2 3.15Å; D572-R639 PolarHBondContact OD2-NH2 3Å
573	N	96.1	Very high	95.2	Very high	86 Å²	86	50.6 Å²	50.6	46%	0.46	26%	0.262	S	S	.	.	H	α-helix	trans	-63.3	-37.3	171.4	-80.8	-71.3	0	0	0	111.9	A569 W570 T576 Q577	A569-N573 PolarHBondContact O-N 2.94Å; A569-N573 VanDerWaalsContact O-N 3.09Å; A569-N573 PolarHBondContact O-ND2 2.96Å; W570-N573 WeakPolarHBondContact O-CA 3.34Å; W570-N573 WeakPolarHBondContact O-CB 3.36Å; W570-N573 PolarHBondContact O-N 3.07Å; N573-T576 PolarHBondContact O-N 3.08Å; N573-Q577 WeakPolarHBondContact O-CB 3.32Å; N573-Q577 VanDerWaalsContact O-CG 3.27Å; N573-Q577 WeakPolarHBondContact O-CG 3.26Å; N573-Q577 PolarHBondContact O-N 3.21Å
574	V	95.5	Very high	95	Very high	4 Å²	4	57.5 Å²	57.5	2%	0.024	29%	0.288	C	S	.	.	H	α-helix	trans	-64.3	-49.2	175.2	177	0	0	0	0	111.2	L550 W570 L571 D572 T576 Q577 V578 F595 M632	L550-V574 HydrophobicContact CD1-CG1 4.21Å; L550-V574 HydrophobicContact CD2-CB 4.16Å; L550-V574 HydrophobicContact CD2-CG1 3.71Å; L550-V574 HydrophobicContact CD2-CG2 3.33Å; W570-V574 HydrophobicContact CD2-CG2 4.2Å; W570-V574 HydrophobicContact CZ2-CG2 4.1Å; W570-V574 WeakPolarHBondContact O-CG2 3.46Å; W570-V574 PolarHBondContact O-N 3.2Å; L571-V574 WeakPolarHBondContact O-CB 3.33Å; L571-V574 PolarHBondContact O-N 3.12Å; D572-V574 VanDerWaalsContact C-N 3.32Å; D572-V574 PolarHBondContact O-N 3.37Å; V574-T576 VanDerWaalsContact C-N 3.31Å; V574-T576 PolarHBondContact O-N 2.85Å; V574-Q577 PolarHBondContact O-N 3.44Å; V574-V578 WeakPolarHBondContact O-CG2 3.39Å; V574-V578 PolarHBondContact O-N 3.36Å; V574-F595 HydrophobicContact CG1-CZ 4.14Å; V574-M632 HydrophobicContact CB-CE 4.01Å; V574-M632 HydrophobicContact CG1-CE 3.91Å
575	V	96.2	Very high	94.8	Very high	0 Å²	0	64.3 Å²	64.3	0%	0	31%	0.314	C	S	.	.	H	α-helix	trans	-57.8	-46.9	175.8	175.9	0	0	0	0	110.6	L571 D572 V578 L579 F595 M632 L635 V636 R639	L571-V575 WeakPolarHBondContact O-CG2 3.23Å; L571-V575 PolarHBondContact O-N 3.09Å; D572-V575 PolarHBondContact O-N 2.85Å; V575-V578 PolarHBondContact O-N 3.13Å; V575-L579 HydrophobicContact CG1-CD1 3.75Å; V575-L579 HydrophobicContact CG1-CG 4.31Å; V575-L579 WeakPolarHBondContact O-CB 3.34Å; V575-L579 WeakPolarHBondContact O-CG 3.37Å; V575-L579 PolarHBondContact O-N 3.01Å; V575-F595 HydrophobicContact CG2-CE1 4.04Å; V575-M632 HydrophobicContact CG2-CE 4.15Å; V575-M632 HydrophobicContact CG2-SD 3.34Å; V575-M632 WeakPolarHBondContact CG2-SD 3.29Å; V575-L635 HydrophobicContact CG2-CB 3.96Å; V575-L635 HydrophobicContact CG2-CD1 3.92Å; V575-V636 HydrophobicContact CG1-CG2 3.88Å; V575-V636 HydrophobicContact CG2-CG2 4.09Å; V575-R639 HydrophobicContact CG1-CG 3.89Å
576	T	94.8	Very high	94.5	Very high	42 Å²	42	66.8 Å²	66.8	26%	0.258	34%	0.337	S	S	.	.	H	α-helix	trans	-60.8	-49.2	-179.6	-58.7	0	0	0	0	111.2	D572 N573 V574 V578 K580 R639	D572-T576 VanDerWaalsContact O-CB 3.27Å; D572-T576 WeakPolarHBondContact O-CB 3.08Å; D572-T576 PolarHBondContact O-N 3.14Å; D572-T576 PolarHBondContact O-OG1 3.04Å; N573-T576 PolarHBondContact O-N 3.08Å; V574-T576 VanDerWaalsContact C-N 3.31Å; V574-T576 PolarHBondContact O-N 2.85Å; T576-V578 PolarHBondContact O-N 3.01Å; T576-K580 WeakPolarHBondContact O-CB 3.47Å; T576-K580 PolarHBondContact O-N 3.34Å; T576-R639 PolarHBondContact OG1-NH2 3.09Å
577	Q	93.1	Very high	94.3	Very high	115 Å²	115	64 Å²	64	54%	0.537	33%	0.33	S	S	.	.	H	α-helix	trans	-62.3	-43.7	-179.9	-74.7	-179.8	55.7	0	0	112.9	N573 V574	N573-Q577 WeakPolarHBondContact O-CB 3.32Å; N573-Q577 VanDerWaalsContact O-CG 3.27Å; N573-Q577 WeakPolarHBondContact O-CG 3.26Å; N573-Q577 PolarHBondContact O-N 3.21Å; V574-Q577 PolarHBondContact O-N 3.44Å
578	V	92.6	Very high	94.2	Very high	43 Å²	43	64.4 Å²	64.4	26%	0.261	33%	0.331	S	S	.	.	H	α-helix	trans	-75.1	-31.8	-176.2	178.1	0	0	0	0	112.6	V546 V574 V575 T576 P581 F595	V546-V578 HydrophobicContact CG1-CG2 4.48Å; V574-V578 WeakPolarHBondContact O-CG2 3.39Å; V574-V578 PolarHBondContact O-N 3.36Å; V575-V578 PolarHBondContact O-N 3.13Å; T576-V578 PolarHBondContact O-N 3.01Å; V578-P581 WeakPolarHBondContact O-CD 3.22Å; V578-F595 HydrophobicContact CB-CD2 4.2Å; V578-F595 HydrophobicContact CB-CE2 4.24Å; V578-F595 HydrophobicContact CG1-CB 4.49Å; V578-F595 HydrophobicContact CG1-CD2 3.58Å; V578-F595 HydrophobicContact CG1-CE2 4.07Å; V578-F595 HydrophobicContact CG1-CG 4.13Å; V578-F595 HydrophobicContact CG2-CD2 4.48Å; V578-F595 HydrophobicContact CG2-CE2 4.14Å
579	L	94.1	Very high	94	Very high	4 Å²	4	65.4 Å²	65.4	2%	0.021	34%	0.338	C	S	.	.	H	α-helix	trans	-89.9	-19.3	-179.8	-59.6	-173.5	0	0	0	114	V575 P581 Y582 E583 F588 A592 F595 V636 R639	V575-L579 HydrophobicContact CG1-CD1 3.75Å; V575-L579 HydrophobicContact CG1-CG 4.31Å; V575-L579 WeakPolarHBondContact O-CB 3.34Å; V575-L579 WeakPolarHBondContact O-CG 3.37Å; V575-L579 PolarHBondContact O-N 3.01Å; L579-P581 VanDerWaalsContact C-CD 3.4Å; L579-Y582 WeakPolarHBondContact O-CA 3.41Å; L579-Y582 WeakPolarHBondContact O-CB 3.42Å; L579-Y582 PolarHBondContact O-N 3.3Å; L579-E583 PolarHBondContact O-N 2.7Å; L579-F588 HydrophobicContact CB-CE2 3.75Å; L579-F588 HydrophobicContact CB-CZ 3.92Å; L579-F588 HydrophobicContact CD1-CE1 4.26Å; L579-F588 HydrophobicContact CD1-CE2 4.45Å; L579-F588 HydrophobicContact CD1-CZ 3.81Å; L579-F588 HydrophobicContact CG-CZ 4.47Å; L579-A592 HydrophobicContact CD1-CB 4.28Å; L579-A592 HydrophobicContact CD2-CB 4.45Å; L579-F595 HydrophobicContact CD2-CB 4.22Å; L579-V636 HydrophobicContact CD1-CG2 4.45Å; L579-R639 HydrophobicContact CD1-CB 4.47Å
580	K	93.3	Very high	93.7	Very high	136 Å²	136	69.2 Å²	69.2	59%	0.591	34%	0.341	S	S	*	.	G	3₁₀ helix	trans	-48.1	-41.8	178	-178.1	174.1	-173.9	178.9	0	115.6	T576 Y582 E583	T576-K580 WeakPolarHBondContact O-CB 3.47Å; T576-K580 PolarHBondContact O-N 3.34Å; K580-Y582 PolarHBondContact O-N 3.37Å; K580-E583 WeakPolarHBondContact O-CB 3.49Å; K580-E583 PolarHBondContact O-N 3.07Å; K580-E583 VanDerWaalsContact O-N 3.16Å
581	P	93.6	Very high	93.6	Very high	76 Å²	76	68.3 Å²	68.3	49%	0.494	34%	0.339	S	S	.	.	G	3₁₀ helix	trans	-62.8	-15.3	177.6	-23.1	35.4	0	0	0	114.6	V578 L579 R585	V578-P581 WeakPolarHBondContact O-CD 3.22Å; L579-P581 VanDerWaalsContact C-CD 3.4Å; P581-R585 VanDerWaalsContact O-CZ 3.26Å; P581-R585 PolarHBondContact O-NE 3.06Å; P581-R585 VanDerWaalsContact O-NE 3.16Å
582	Y	94.1	Very high	93.4	Very high	90 Å²	90	68.2 Å²	68.2	35%	0.353	34%	0.339	S	S	.	.	G	3₁₀ helix	trans	-105.3	-3.5	-178.7	-53.2	-88.4	0	0	0	113	L579 K580 H584 R585 F588 A591	L579-Y582 WeakPolarHBondContact O-CA 3.41Å; L579-Y582 WeakPolarHBondContact O-CB 3.42Å; L579-Y582 PolarHBondContact O-N 3.3Å; K580-Y582 PolarHBondContact O-N 3.37Å; Y582-H584 PolarHBondContact O-N 3.45Å; Y582-R585 VanDerWaalsContact O-CB 3.29Å; Y582-R585 WeakPolarHBondContact O-CB 3.28Å; Y582-R585 PolarHBondContact O-N 3.26Å; Y582-F588 WeakPolarHBondContact O-CD2 3.25Å; Y582-A591 HydrophobicContact CD1-CB 3.54Å; Y582-A591 HydrophobicContact CD2-CB 3.77Å; Y582-A591 HydrophobicContact CE1-CB 3.76Å; Y582-A591 HydrophobicContact CE2-CB 3.99Å; Y582-A591 HydrophobicContact CG-CB 3.55Å
583	E	91.8	Very high	93.2	Very high	90 Å²	90	71.2 Å²	71.2	42%	0.421	35%	0.347	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.9	137.9	179.1	-76.7	173.2	170	0	0	111.1	L579 K580 R585 F588	L579-E583 PolarHBondContact O-N 2.7Å; K580-E583 WeakPolarHBondContact O-CB 3.49Å; K580-E583 PolarHBondContact O-N 3.07Å; K580-E583 VanDerWaalsContact O-N 3.16Å; E583-R585 PolarHBondContact O-N 3.09Å; E583-R585 VanDerWaalsContact O-N 3.1Å; E583-F588 HydrophobicContact CG-CE2 4.2Å
584	H	90.7	Very high	93	Very high	191 Å²	191	71.6 Å²	71.6	88%	0.884	35%	0.345	S	S	*	.	T	Hydrogen-bonded Turn	trans	60	8.7	-174	-44.9	-67.7	0	0	0	116.2	Y582	Y582-H584 PolarHBondContact O-N 3.45Å
585	R	92.3	Very high	93	Very high	149 Å²	149	72.3 Å²	72.3	56%	0.562	35%	0.348	S	S	*	.	S	Bend	trans	-96.2	143	173.8	-53.5	-171.9	-175.8	-170	-2.1	111.3	P581 Y582 E583 S587 F588	P581-R585 VanDerWaalsContact O-CZ 3.26Å; P581-R585 PolarHBondContact O-NE 3.06Å; P581-R585 VanDerWaalsContact O-NE 3.16Å; Y582-R585 VanDerWaalsContact O-CB 3.29Å; Y582-R585 WeakPolarHBondContact O-CB 3.28Å; Y582-R585 PolarHBondContact O-N 3.26Å; E583-R585 PolarHBondContact O-N 3.09Å; E583-R585 VanDerWaalsContact O-N 3.1Å; R585-S587 PolarHBondContact O-N 3.45Å; R585-S587 VanDerWaalsContact O-N 3.08Å; R585-F588 WeakPolarHBondContact O-CB 3.4Å; R585-F588 PolarHBondContact O-N 3.44Å
586	P	88.9	Confident	92.9	Very high	135 Å²	135	73.9 Å²	73.9	88%	0.877	36%	0.356	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64	-15.8	175.2	27.6	-35.6	0	0	0	113.2	F588 P589	P586-F588 VanDerWaalsContact C-N 3.3Å; P586-F588 PolarHBondContact O-N 3.22Å; P586-P589 WeakPolarHBondContact O-CD 3.49Å
587	S	92.2	Very high	92.9	Very high	49 Å²	49	77.9 Å²	77.9	34%	0.343	38%	0.376	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.8	-8.3	173.1	53.3	0	0	0	0	114.4	R585 R590 A591	R585-S587 PolarHBondContact O-N 3.45Å; R585-S587 VanDerWaalsContact O-N 3.08Å; S587-R590 WeakPolarHBondContact O-CA 3.45Å; S587-R590 WeakPolarHBondContact O-CB 3.4Å; S587-R590 PolarHBondContact O-N 3.37Å; S587-A591 PolarHBondContact O-N 3.16Å
588	F	94.2	Very high	92.9	Very high	10 Å²	10	75.8 Å²	75.8	4%	0.044	37%	0.365	C	S	.	.	H	α-helix	trans	-51.3	-46.7	-178	-172.3	-81.2	0	0	0	113.4	L579 Y582 E583 R585 P586 R590 A591 A592 R639 V640 A643	L579-F588 HydrophobicContact CB-CE2 3.75Å; L579-F588 HydrophobicContact CB-CZ 3.92Å; L579-F588 HydrophobicContact CD1-CE1 4.26Å; L579-F588 HydrophobicContact CD1-CE2 4.45Å; L579-F588 HydrophobicContact CD1-CZ 3.81Å; L579-F588 HydrophobicContact CG-CZ 4.47Å; Y582-F588 WeakPolarHBondContact O-CD2 3.25Å; E583-F588 HydrophobicContact CG-CE2 4.2Å; R585-F588 WeakPolarHBondContact O-CB 3.4Å; R585-F588 PolarHBondContact O-N 3.44Å; P586-F588 VanDerWaalsContact C-N 3.3Å; P586-F588 PolarHBondContact O-N 3.22Å; F588-R590 VanDerWaalsContact C-N 3.33Å; F588-R590 PolarHBondContact O-N 2.96Å; F588-A591 PolarHBondContact O-N 3.49Å; F588-A592 VanDerWaalsContact O-CB 3.23Å; F588-A592 WeakPolarHBondContact O-CB 3.5Å; F588-A592 PolarHBondContact O-N 2.95Å; F588-R639 HydrophobicContact CE1-CB 4.25Å; F588-R639 WeakPolarHBondContact CE1-O 3.34Å; F588-R639 HydrophobicContact CZ-CB 4.07Å; F588-V640 HydrophobicContact CD1-CG2 4.24Å; F588-V640 HydrophobicContact CE1-CG2 4.05Å; F588-A643 HydrophobicContact CD1-CB 3.55Å; F588-A643 HydrophobicContact CE1-CB 3.78Å; F588-A643 HydrophobicContact CG-CB 3.99Å; F588-A643 HydrophobicContact CZ-CB 4.36Å
589	P	92.3	Very high	93	Very high	27 Å²	27	75.5 Å²	75.5	18%	0.175	36%	0.359	C	S	.	.	H	α-helix	trans	-67.9	-27.9	177.9	-20.2	35.1	0	0	0	113.6	P586 R593 V640 T644	P586-P589 WeakPolarHBondContact O-CD 3.49Å; P589-R593 WeakPolarHBondContact O-CG 3.45Å; P589-R593 VanDerWaalsContact O-CZ 3.31Å; P589-R593 PolarHBondContact O-N 2.91Å; P589-R593 PolarHBondContact O-NH1 3.23Å; P589-R593 VanDerWaalsContact O-NH1 3.16Å; P589-V640 HydrophobicContact CB-CG1 4.23Å; P589-V640 HydrophobicContact CG-CG1 4.34Å; P589-T644 HydrophobicContact CG-CG2 4.33Å
590	R	91.6	Very high	93	Very high	132 Å²	132	77.4 Å²	77.4	50%	0.498	37%	0.373	S	S	.	.	H	α-helix	trans	-71.2	-45.4	173.9	-171.6	176.8	-175.2	157.1	8	110.2	S587 F588 R593 Q594 E670	S587-R590 WeakPolarHBondContact O-CA 3.45Å; S587-R590 WeakPolarHBondContact O-CB 3.4Å; S587-R590 PolarHBondContact O-N 3.37Å; F588-R590 VanDerWaalsContact C-N 3.33Å; F588-R590 PolarHBondContact O-N 2.96Å; R590-R593 PolarHBondContact O-N 3.28Å; R590-Q594 WeakPolarHBondContact O-CG 3.34Å; R590-Q594 PolarHBondContact O-N 3.5Å; R590-E670 IonicContact CZ-OE1 2.75Å; R590-E670 IonicContact NH1-OE1 3.68Å; R590-E670 IonicContact NH2-OE1 3.33Å; R590-E670 PolarHBondContact NH2-OE1 2.82Å
591	A	93.5	Very high	93	Very high	8 Å²	8	73.9 Å²	73.9	7%	0.066	36%	0.358	C	S	.	.	H	α-helix	trans	-63.1	-44.2	176.5	0	0	0	0	0	112.1	Y582 S587 F588 R593 Q594 F595	Y582-A591 HydrophobicContact CD1-CB 3.54Å; Y582-A591 HydrophobicContact CD2-CB 3.77Å; Y582-A591 HydrophobicContact CE1-CB 3.76Å; Y582-A591 HydrophobicContact CE2-CB 3.99Å; Y582-A591 HydrophobicContact CG-CB 3.55Å; S587-A591 PolarHBondContact O-N 3.16Å; F588-A591 PolarHBondContact O-N 3.49Å; A591-R593 PolarHBondContact O-N 2.71Å; A591-Q594 PolarHBondContact O-N 3.26Å; A591-F595 WeakPolarHBondContact O-CB 3.45Å; A591-F595 PolarHBondContact O-N 3.38Å
592	A	94.6	Very high	93	Very high	0 Å²	0	72 Å²	72	0%	0	34%	0.341	C	S	.	.	H	α-helix	trans	-54.5	-49.4	173.6	0	0	0	0	0	112.9	L579 F588 F595 L596 V636 V640	L579-A592 HydrophobicContact CD1-CB 4.28Å; L579-A592 HydrophobicContact CD2-CB 4.45Å; F588-A592 VanDerWaalsContact O-CB 3.23Å; F588-A592 WeakPolarHBondContact O-CB 3.5Å; F588-A592 PolarHBondContact O-N 2.95Å; A592-F595 PolarHBondContact O-N 2.97Å; A592-L596 PolarHBondContact O-N 3.08Å; A592-V636 HydrophobicContact CB-CG1 3.65Å; A592-V640 HydrophobicContact CB-CG2 3.48Å; A592-V640 VanDerWaalsContact CB-CG2 3.48Å
593	R	92.1	Very high	93	Very high	109 Å²	109	68.7 Å²	68.7	41%	0.411	33%	0.331	S	S	.	.	H	α-helix	trans	-65.5	-41.3	176.3	-70.9	-173.5	-61.3	-92.5	10.1	112.2	P589 R590 A591 F595 L596 L597	P589-R593 WeakPolarHBondContact O-CG 3.45Å; P589-R593 VanDerWaalsContact O-CZ 3.31Å; P589-R593 PolarHBondContact O-N 2.91Å; P589-R593 PolarHBondContact O-NH1 3.23Å; P589-R593 VanDerWaalsContact O-NH1 3.16Å; R590-R593 PolarHBondContact O-N 3.28Å; A591-R593 PolarHBondContact O-N 2.71Å; R593-F595 PolarHBondContact O-N 2.88Å; R593-L596 PolarHBondContact O-N 3.16Å; R593-L597 WeakPolarHBondContact O-CG 3.42Å; R593-L597 PolarHBondContact O-N 3.19Å
594	Q	92.4	Very high	93.1	Very high	93 Å²	93	66.6 Å²	66.6	44%	0.435	33%	0.326	S	S	.	.	H	α-helix	trans	-63.6	-38.9	175.3	-77.3	-176	-19.3	0	0	112.3	R590 A591 L597 K598	R590-Q594 WeakPolarHBondContact O-CG 3.34Å; R590-Q594 PolarHBondContact O-N 3.5Å; A591-Q594 PolarHBondContact O-N 3.26Å; Q594-L597 PolarHBondContact O-N 3.43Å; Q594-K598 WeakPolarHBondContact O-CG 3.38Å; Q594-K598 PolarHBondContact O-N 3.31Å
595	F	93.9	Very high	93.3	Very high	20 Å²	20	58.8 Å²	58.8	9%	0.088	29%	0.291	C	S	.	.	H	α-helix	trans	-60.3	-46.1	175.4	170.2	-109.5	0	0	0	111.9	V574 V575 V578 L579 A591 A592 R593 L597 K598 W599 M632 V636	V574-F595 HydrophobicContact CG1-CZ 4.14Å; V575-F595 HydrophobicContact CG2-CE1 4.04Å; V578-F595 HydrophobicContact CB-CD2 4.2Å; V578-F595 HydrophobicContact CB-CE2 4.24Å; V578-F595 HydrophobicContact CG1-CB 4.49Å; V578-F595 HydrophobicContact CG1-CD2 3.58Å; V578-F595 HydrophobicContact CG1-CE2 4.07Å; V578-F595 HydrophobicContact CG1-CG 4.13Å; V578-F595 HydrophobicContact CG2-CD2 4.48Å; V578-F595 HydrophobicContact CG2-CE2 4.14Å; L579-F595 HydrophobicContact CD2-CB 4.22Å; A591-F595 WeakPolarHBondContact O-CB 3.45Å; A591-F595 PolarHBondContact O-N 3.38Å; A592-F595 PolarHBondContact O-N 2.97Å; R593-F595 PolarHBondContact O-N 2.88Å; F595-L597 VanDerWaalsContact C-N 3.29Å; F595-L597 PolarHBondContact O-N 2.99Å; F595-K598 PolarHBondContact O-N 3.41Å; F595-W599 HydrophobicContact CZ-CB 4.47Å; F595-W599 HydrophobicContact CZ-CE3 4.29Å; F595-W599 VanDerWaalsContact O-CB 3.25Å; F595-W599 WeakPolarHBondContact O-CB 3.13Å; F595-W599 PolarHBondContact O-N 3.25Å; F595-M632 HydrophobicContact CE1-CE 4.45Å; F595-M632 HydrophobicContact CE1-SD 3.69Å; F595-M632 HydrophobicContact CZ-CE 4.09Å; F595-M632 HydrophobicContact CZ-SD 3.92Å; F595-V636 HydrophobicContact CD1-CG2 4Å; F595-V636 HydrophobicContact CE1-CG2 4.22Å
596	L	95.1	Very high	93.4	Very high	32 Å²	32	52.7 Å²	52.7	17%	0.168	27%	0.27	C	S	.	.	H	α-helix	trans	-59.7	-37.8	175.7	-70.1	175.7	0	0	0	112.6	A592 R593 S600 M632 F633 V636	A592-L596 PolarHBondContact O-N 3.08Å; R593-L596 PolarHBondContact O-N 3.16Å; L596-S600 VanDerWaalsContact O-CB 3.23Å; L596-S600 WeakPolarHBondContact O-CB 3.35Å; L596-S600 PolarHBondContact O-N 3.09Å; L596-M632 HydrophobicContact CD2-CB 3.98Å; L596-F633 HydrophobicContact CD1-CD2 4.07Å; L596-F633 HydrophobicContact CD1-CG 4.39Å; L596-V636 HydrophobicContact CD1-CB 4.1Å; L596-V636 HydrophobicContact CD1-CG1 3.86Å; L596-V636 HydrophobicContact CD2-CB 4.17Å; L596-V636 HydrophobicContact CD2-CG2 3.86Å; L596-V636 HydrophobicContact CG-CB 4.22Å; L596-V636 HydrophobicContact CG-CG1 4.11Å; L596-V636 HydrophobicContact CG-CG2 4.14Å
597	L	93.7	Very high	93.8	Very high	126 Å²	126	47.4 Å²	47.4	66%	0.66	23%	0.234	S	C	*	.	H	α-helix	trans	-66.7	-48.1	174.9	-67.4	171.6	0	0	0	112.1	R593 Q594 F595 S600 F601	R593-L597 WeakPolarHBondContact O-CG 3.42Å; R593-L597 PolarHBondContact O-N 3.19Å; Q594-L597 PolarHBondContact O-N 3.43Å; F595-L597 VanDerWaalsContact C-N 3.29Å; F595-L597 PolarHBondContact O-N 2.99Å; L597-S600 PolarHBondContact O-N 3.16Å; L597-F601 WeakPolarHBondContact O-CB 3.26Å; L597-F601 PolarHBondContact O-N 3.49Å
598	K	93.1	Very high	94	Very high	72 Å²	72	49.5 Å²	49.5	31%	0.313	23%	0.234	S	C	.	.	H	α-helix	trans	-61.2	-45.1	177	-66.5	-168.7	-172.3	-156.6	0	111.5	C540 Q541 Q594 F595 Y602	C540-K598 HydrophobicContact CB-CB 4.35Å; C540-K598 HydrophobicContact CB-CD 4.36Å; C540-K598 HydrophobicContact CB-CG 3.97Å; C540-K598 VanDerWaalsContact O-CD 3.3Å; C540-K598 WeakPolarHBondContact O-CD 3.47Å; C540-K598 WeakPolarHBondContact O-CE 3.44Å; C540-K598 PolarHBondContact O-NZ 3.4Å; Q541-K598 PolarHBondContact O-NZ 2.99Å; Q594-K598 WeakPolarHBondContact O-CG 3.38Å; Q594-K598 PolarHBondContact O-N 3.31Å; F595-K598 PolarHBondContact O-N 3.41Å; K598-Y602 WeakPolarHBondContact O-CB 3.42Å; K598-Y602 PolarHBondContact O-N 3.32Å
599	W	94.6	Very high	94.1	Very high	36 Å²	36	49.4 Å²	49.4	14%	0.136	23%	0.234	C	C	.	.	H	α-helix	trans	-55.8	-52.6	174.5	173.9	-97	0	0	0	111.4	L571 F595 F601 Y602 S603 Y628 M632	L571-W599 HydrophobicContact CD2-CH2 3.92Å; L571-W599 HydrophobicContact CD2-CZ2 4.17Å; F595-W599 HydrophobicContact CZ-CB 4.47Å; F595-W599 HydrophobicContact CZ-CE3 4.29Å; F595-W599 VanDerWaalsContact O-CB 3.25Å; F595-W599 WeakPolarHBondContact O-CB 3.13Å; F595-W599 PolarHBondContact O-N 3.25Å; W599-F601 PolarHBondContact O-N 3.44Å; W599-Y602 PolarHBondContact O-N 2.87Å; W599-S603 WeakPolarHBondContact O-CB 3.32Å; W599-S603 PolarHBondContact O-N 3.46Å; W599-S603 VanDerWaalsContact O-N 3.11Å; W599-S603 PolarHBondContact O-OG 2.88Å; W599-Y628 HydrophobicContact CH2-CD2 4.41Å; W599-Y628 AromaticContact CZ2-CD2 3.99Å; W599-Y628 HydrophobicContact CZ2-CD2 3.99Å; W599-Y628 HydrophobicContact CZ2-CG 4.47Å; W599-M632 HydrophobicContact CD2-CE 4.26Å; W599-M632 HydrophobicContact CD2-CG 4.15Å; W599-M632 HydrophobicContact CE3-CE 3.98Å; W599-M632 HydrophobicContact CG-CG 4.44Å; W599-M632 HydrophobicContact CH2-CE 3.85Å; W599-M632 HydrophobicContact CZ2-CE 4.12Å; W599-M632 HydrophobicContact CZ2-CG 4.09Å; W599-M632 HydrophobicContact CZ3-CE 3.77Å
600	S	94.2	Very high	94.4	Very high	44 Å²	44	48.2 Å²	48.2	31%	0.308	23%	0.226	S	C	.	.	H	α-helix	trans	-67.2	-38.1	-175.3	-174.1	0	0	0	0	112.5	L596 L597 S603 S604 R625	L596-S600 VanDerWaalsContact O-CB 3.23Å; L596-S600 WeakPolarHBondContact O-CB 3.35Å; L596-S600 PolarHBondContact O-N 3.09Å; L597-S600 PolarHBondContact O-N 3.16Å; S600-S603 PolarHBondContact O-OG 3.3Å; S600-S604 VanDerWaalsContact O-CB 3.24Å; S600-S604 WeakPolarHBondContact O-CB 3.31Å; S600-S604 PolarHBondContact O-N 3.46Å; S600-S604 PolarHBondContact O-OG 3.05Å; S600-R625 PolarHBondContact O-NH2 3.4Å; S600-R625 PolarHBondContact OG-NH2 3.5Å; S600-R625 VanDerWaalsContact OG-NH2 3.16Å
601	F	94	Very high	94.6	Very high	63 Å²	63	45.4 Å²	45.4	28%	0.276	22%	0.224	S	C	.	.	H	α-helix	trans	-63.9	-54.8	173.6	-177.3	-86.7	0	0	0	111.9	A536 V539 C540 L597 W599 S603 S604 M605	A536-F601 HydrophobicContact CB-CD1 4.44Å; A536-F601 HydrophobicContact CB-CE1 4.18Å; V539-F601 HydrophobicContact CB-CE1 4.04Å; V539-F601 HydrophobicContact CB-CE2 4.37Å; V539-F601 HydrophobicContact CB-CZ 3.85Å; V539-F601 HydrophobicContact CG1-CD2 4.25Å; V539-F601 HydrophobicContact CG1-CE1 4.26Å; V539-F601 HydrophobicContact CG1-CE2 3.83Å; V539-F601 HydrophobicContact CG1-CZ 3.84Å; V539-F601 HydrophobicContact CG2-CE1 4.42Å; V539-F601 HydrophobicContact CG2-CZ 3.88Å; C540-F601 WeakPolarHBondContact SG-CD1 3.43Å; C540-F601 VanDerWaalsContact SG-CG 3.59Å; L597-F601 WeakPolarHBondContact O-CB 3.26Å; L597-F601 PolarHBondContact O-N 3.49Å; W599-F601 PolarHBondContact O-N 3.44Å; F601-S603 PolarHBondContact O-N 3Å; F601-S604 WeakPolarHBondContact O-CB 3.43Å; F601-S604 PolarHBondContact O-N 3.23Å; F601-S604 VanDerWaalsContact O-N 3.11Å; F601-M605 HydrophobicContact CD1-CG 4.2Å; F601-M605 HydrophobicContact CE1-CG 3.73Å; F601-M605 HydrophobicContact CE1-SD 4.23Å; F601-M605 HydrophobicContact CE2-CE 4.4Å; F601-M605 HydrophobicContact CZ-CE 4.29Å; F601-M605 HydrophobicContact CZ-CG 4.15Å; F601-M605 HydrophobicContact CZ-SD 4.05Å; F601-M605 PolarHBondContact O-N 3.05Å; F601-M605 VanDerWaalsContact O-N 3.09Å
602	Y	93.6	Very high	94.7	Very high	36 Å²	36	51.4 Å²	51.4	14%	0.141	25%	0.254	C	S	.	.	H	α-helix	trans	-59	-50.2	-174	-171.1	-85.5	0	0	0	111.9	V532 A536 V547 K598 W599 S604 M605 V606	V532-Y602 HydrophobicContact CG1-CE1 4.17Å; V532-Y602 HydrophobicContact CG1-CE2 4Å; A536-Y602 HydrophobicContact CB-CD2 3.46Å; A536-Y602 VanDerWaalsContact CB-CD2 3.46Å; A536-Y602 HydrophobicContact CB-CE2 3.8Å; V547-Y602 HydrophobicContact CG1-CE1 4.2Å; V547-Y602 HydrophobicContact CG1-CE2 3.6Å; V547-Y602 WeakPolarHBondContact CG1-OH 3.23Å; V547-Y602 HydrophobicContact CG2-CE2 4.41Å; K598-Y602 WeakPolarHBondContact O-CB 3.42Å; K598-Y602 PolarHBondContact O-N 3.32Å; W599-Y602 PolarHBondContact O-N 2.87Å; Y602-S604 VanDerWaalsContact C-N 3.26Å; Y602-S604 PolarHBondContact O-N 2.9Å; Y602-M605 WeakPolarHBondContact O-CB 3.4Å; Y602-M605 PolarHBondContact O-N 3.47Å; Y602-V606 HydrophobicContact CD1-CG2 4.39Å; Y602-V606 HydrophobicContact CE1-CG2 4.11Å; Y602-V606 PolarHBondContact O-N 3.42Å
603	S	94.2	Very high	94.7	Very high	20 Å²	20	56.5 Å²	56.5	14%	0.14	27%	0.274	C	S	.	.	H	α-helix	trans	-67.6	-25.4	179.4	56.5	0	0	0	0	113	W599 S600 F601 V606 I607 R625	W599-S603 WeakPolarHBondContact O-CB 3.32Å; W599-S603 PolarHBondContact O-N 3.46Å; W599-S603 VanDerWaalsContact O-N 3.11Å; W599-S603 PolarHBondContact O-OG 2.88Å; S600-S603 PolarHBondContact O-OG 3.3Å; F601-S603 PolarHBondContact O-N 3Å; S603-V606 PolarHBondContact O-N 3.4Å; S603-I607 WeakPolarHBondContact O-CG1 3.35Å; S603-I607 PolarHBondContact O-N 2.94Å; S603-I607 VanDerWaalsContact O-N 3.12Å; S603-R625 PolarHBondContact OG-NE 3.04Å; S603-R625 PolarHBondContact OG-NH1 2.83Å; S603-R625 PolarHBondContact OG-NH2 3.25Å
604	S	94.6	Very high	95	Very high	47 Å²	47	56.6 Å²	56.6	33%	0.329	29%	0.291	S	S	.	.	H	α-helix	trans	-71.1	-31.4	170.1	-60.1	0	0	0	0	112.8	S600 F601 Y602 I607 R608	S600-S604 VanDerWaalsContact O-CB 3.24Å; S600-S604 WeakPolarHBondContact O-CB 3.31Å; S600-S604 PolarHBondContact O-N 3.46Å; S600-S604 PolarHBondContact O-OG 3.05Å; F601-S604 WeakPolarHBondContact O-CB 3.43Å; F601-S604 PolarHBondContact O-N 3.23Å; F601-S604 VanDerWaalsContact O-N 3.11Å; Y602-S604 VanDerWaalsContact C-N 3.26Å; Y602-S604 PolarHBondContact O-N 2.9Å; S604-I607 PolarHBondContact O-N 3.25Å; S604-R608 WeakPolarHBondContact O-CB 3.39Å; S604-R608 PolarHBondContact O-N 2.99Å
605	M	94.4	Very high	95.2	Very high	27 Å²	27	52.6 Å²	52.6	13%	0.133	27%	0.274	C	S	.	.	H	α-helix	trans	-65.4	-38.5	171.4	-63.7	-62.7	97.2	0	0	111.9	V532 F601 Y602 R608 D609	V532-M605 HydrophobicContact CG1-CB 3.9Å; V532-M605 HydrophobicContact CG2-CB 4.49Å; F601-M605 HydrophobicContact CD1-CG 4.2Å; F601-M605 HydrophobicContact CE1-CG 3.73Å; F601-M605 HydrophobicContact CE1-SD 4.23Å; F601-M605 HydrophobicContact CE2-CE 4.4Å; F601-M605 HydrophobicContact CZ-CE 4.29Å; F601-M605 HydrophobicContact CZ-CG 4.15Å; F601-M605 HydrophobicContact CZ-SD 4.05Å; F601-M605 PolarHBondContact O-N 3.05Å; F601-M605 VanDerWaalsContact O-N 3.09Å; Y602-M605 WeakPolarHBondContact O-CB 3.4Å; Y602-M605 PolarHBondContact O-N 3.47Å; M605-R608 WeakPolarHBondContact O-CB 3.23Å; M605-R608 PolarHBondContact O-N 3.31Å; M605-R608 PolarHBondContact SD-NH2 2.73Å; M605-R608 VanDerWaalsContact SD-NH2 3.45Å; M605-D609 PolarHBondContact O-N 3.19Å
606	V	95.2	Very high	95.3	Very high	20 Å²	20	55.7 Å²	55.7	12%	0.121	30%	0.303	C	S	.	.	H	α-helix	trans	-63.2	-45.3	173.6	178.8	0	0	0	0	111.3	V527 F529 V532 Y602 S603 R608 D609 L610	V527-V606 HydrophobicContact CG1-CG1 4.47Å; F529-V606 HydrophobicContact CE1-CG2 4.08Å; V532-V606 HydrophobicContact CG1-CG2 4.06Å; Y602-V606 HydrophobicContact CD1-CG2 4.39Å; Y602-V606 HydrophobicContact CE1-CG2 4.11Å; Y602-V606 PolarHBondContact O-N 3.42Å; S603-V606 PolarHBondContact O-N 3.4Å; V606-R608 VanDerWaalsContact C-N 3.34Å; V606-R608 PolarHBondContact O-N 3.26Å; V606-D609 PolarHBondContact O-N 2.97Å; V606-L610 HydrophobicContact CG1-CD1 4.15Å; V606-L610 WeakPolarHBondContact O-CG 3.4Å; V606-L610 PolarHBondContact O-N 3.47Å
607	I	96.9	Very high	95.4	Very high	25 Å²	25	54.4 Å²	54.4	13%	0.128	30%	0.296	C	S	.	.	H	α-helix	trans	-64	-38.2	176.6	-66.8	-67.1	0	0	0	111.7	S603 S604 L610 T611 F618 F621 R625	S603-I607 WeakPolarHBondContact O-CG1 3.35Å; S603-I607 PolarHBondContact O-N 2.94Å; S603-I607 VanDerWaalsContact O-N 3.12Å; S604-I607 PolarHBondContact O-N 3.25Å; I607-L610 HydrophobicContact CD1-CD1 4.34Å; I607-L610 PolarHBondContact O-N 3.37Å; I607-T611 PolarHBondContact O-N 2.94Å; I607-T611 PolarHBondContact O-OG1 3.25Å; I607-F618 HydrophobicContact CG2-CE2 3.89Å; I607-F621 HydrophobicContact CD1-CB 3.94Å; I607-R625 HydrophobicContact CD1-CB 4.02Å; I607-R625 HydrophobicContact CD1-CG 4.33Å; I607-R625 HydrophobicContact CG1-CB 4.15Å; I607-R625 HydrophobicContact CG1-CG 3.9Å
608	R	96.2	Very high	95.6	Very high	92 Å²	92	51.8 Å²	51.8	35%	0.347	28%	0.28	S	S	.	.	H	α-helix	trans	-60.7	-45.8	173.9	-176.8	-169.5	64.9	169.2	0.8	111.8	S604 M605 V606 T611 L612	S604-R608 WeakPolarHBondContact O-CB 3.39Å; S604-R608 PolarHBondContact O-N 2.99Å; M605-R608 WeakPolarHBondContact O-CB 3.23Å; M605-R608 PolarHBondContact O-N 3.31Å; M605-R608 PolarHBondContact SD-NH2 2.73Å; M605-R608 VanDerWaalsContact SD-NH2 3.45Å; V606-R608 VanDerWaalsContact C-N 3.34Å; V606-R608 PolarHBondContact O-N 3.26Å; R608-T611 VanDerWaalsContact O-CB 3.31Å; R608-T611 WeakPolarHBondContact O-CB 3.43Å; R608-T611 PolarHBondContact O-N 3.12Å; R608-L612 HydrophobicContact CG-CD1 4.37Å; R608-L612 WeakPolarHBondContact O-CG 3.31Å; R608-L612 PolarHBondContact O-N 3.43Å
609	D	96.4	Very high	95.8	Very high	9 Å²	9	50.7 Å²	50.7	5%	0.048	29%	0.289	C	S	.	.	H	α-helix	trans	-66.9	-41.6	179	-171.8	-108.5	0	0	0	112.4	V527 D528 V532 M605 V606 T611 L612 R613	V527-D609 VanDerWaalsContact CA-OD1 3.26Å; V527-D609 WeakPolarHBondContact CA-OD1 3.25Å; V527-D609 HydrophobicContact CG1-CB 4.46Å; V527-D609 WeakPolarHBondContact CG1-OD1 3.36Å; D528-D609 PolarHBondContact N-OD1 2.79Å; V532-D609 HydrophobicContact CG2-CB 4.39Å; M605-D609 PolarHBondContact O-N 3.19Å; V606-D609 PolarHBondContact O-N 2.97Å; D609-T611 PolarHBondContact O-N 3.03Å; D609-L612 PolarHBondContact O-N 2.87Å; D609-R613 WeakPolarHBondContact O-CG 3.4Å; D609-R613 PolarHBondContact O-N 3.16Å; D609-R613 IonicContact OD1-CZ 2.62Å; D609-R613 IonicContact OD1-NE 3.84Å; D609-R613 PolarHBondContact OD1-NE 3.47Å; D609-R613 IonicContact OD1-NH2 3.33Å; D609-R613 PolarHBondContact OD1-NH2 3.01Å; D609-R613 IonicContact OD2-CZ 3.05Å; D609-R613 IonicContact OD2-NE 3.04Å; D609-R613 PolarHBondContact OD2-NE 2.73Å; D609-R613 VanDerWaalsContact OD2-NE 3.15Å; D609-R613 IonicContact OD2-NH2 3.39Å; D609-R613 PolarHBondContact OD2-NH2 2.91Å
610	L	97	Very high	95.9	Very high	1 Å²	1	49.8 Å²	49.8	1%	0.005	29%	0.288	C	S	.	.	H	α-helix	trans	-59	-33.1	170.4	-74.1	167.7	0	0	0	112.9	D523 V527 V606 I607 S614 A615 F621	D523-L610 HydrophobicContact CB-CD2 4.27Å; V527-L610 HydrophobicContact CG2-CD2 3.52Å; V527-L610 HydrophobicContact CG2-CG 3.76Å; V606-L610 HydrophobicContact CG1-CD1 4.15Å; V606-L610 WeakPolarHBondContact O-CG 3.4Å; V606-L610 PolarHBondContact O-N 3.47Å; I607-L610 HydrophobicContact CD1-CD1 4.34Å; I607-L610 PolarHBondContact O-N 3.37Å; L610-S614 PolarHBondContact O-N 3.04Å; L610-A615 HydrophobicContact CB-CB 4.19Å; L610-A615 HydrophobicContact CD2-CB 3.76Å; L610-A615 WeakPolarHBondContact O-CB 3.49Å; L610-A615 PolarHBondContact O-N 3.2Å; L610-F621 HydrophobicContact CD1-CB 3.87Å; L610-F621 HydrophobicContact CD1-CD1 4.15Å; L610-F621 HydrophobicContact CD1-CD2 3.74Å; L610-F621 HydrophobicContact CD1-CE2 4.33Å; L610-F621 HydrophobicContact CD1-CG 3.65Å; L610-F621 HydrophobicContact CD2-CD2 4.32Å; L610-F621 HydrophobicContact CD2-CE2 4.4Å
611	T	96.5	Very high	96.1	Very high	74 Å²	74	48.1 Å²	48.1	45%	0.454	28%	0.276	S	S	.	.	H	α-helix	trans	-69.6	-48.2	175.7	-52.6	0	0	0	0	110.6	I607 R608 D609 R613 S614 F618	I607-T611 PolarHBondContact O-N 2.94Å; I607-T611 PolarHBondContact O-OG1 3.25Å; R608-T611 VanDerWaalsContact O-CB 3.31Å; R608-T611 WeakPolarHBondContact O-CB 3.43Å; R608-T611 PolarHBondContact O-N 3.12Å; D609-T611 PolarHBondContact O-N 3.03Å; T611-R613 PolarHBondContact O-N 2.65Å; T611-S614 PolarHBondContact O-N 2.91Å; T611-F618 WeakPolarHBondContact OG1-CE2 3.33Å
612	L	95.9	Very high	96.2	Very high	134 Å²	134	49 Å²	49	70%	0.702	28%	0.281	S	S	*	.	H	α-helix	trans	-63.1	-28.2	179.6	-69.1	170.4	0	0	0	112.9	R608 D609 S614	R608-L612 HydrophobicContact CG-CD1 4.37Å; R608-L612 WeakPolarHBondContact O-CG 3.31Å; R608-L612 PolarHBondContact O-N 3.43Å; D609-L612 PolarHBondContact O-N 2.87Å; L612-S614 VanDerWaalsContact C-N 3.35Å
613	R	95.4	Very high	96.4	Very high	107 Å²	107	49.1 Å²	49.1	40%	0.404	28%	0.283	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.1	0.3	175.5	-63.7	177.3	-157.7	-99.4	-22.2	113.9	R526 D609 T611 A615	R526-R613 WeakPolarHBondContact O-CD 3.37Å; R526-R613 PolarHBondContact O-NE 3.14Å; R526-R613 PolarHBondContact O-NH1 2.82Å; D609-R613 WeakPolarHBondContact O-CG 3.4Å; D609-R613 PolarHBondContact O-N 3.16Å; D609-R613 IonicContact OD1-CZ 2.62Å; D609-R613 IonicContact OD1-NE 3.84Å; D609-R613 PolarHBondContact OD1-NE 3.47Å; D609-R613 IonicContact OD1-NH2 3.33Å; D609-R613 PolarHBondContact OD1-NH2 3.01Å; D609-R613 IonicContact OD2-CZ 3.05Å; D609-R613 IonicContact OD2-NE 3.04Å; D609-R613 PolarHBondContact OD2-NE 2.73Å; D609-R613 VanDerWaalsContact OD2-NE 3.15Å; D609-R613 IonicContact OD2-NH2 3.39Å; D609-R613 PolarHBondContact OD2-NH2 2.91Å; T611-R613 PolarHBondContact O-N 2.65Å; R613-A615 VanDerWaalsContact C-N 3.27Å; R613-A615 PolarHBondContact O-N 2.95Å
614	S	96.6	Very high	96.5	Very high	110 Å²	110	48.4 Å²	48.4	77%	0.769	28%	0.278	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.8	44.7	-175	-61.7	0	0	0	0	112.9	L610 T611 L612 A616	L610-S614 PolarHBondContact O-N 3.04Å; T611-S614 PolarHBondContact O-N 2.91Å; L612-S614 VanDerWaalsContact C-N 3.35Å; S614-A616 PolarHBondContact O-N 2.97Å
615	A	97.1	Very high	96.6	Very high	10 Å²	10	47.2 Å²	47.2	8%	0.083	27%	0.266	C	S	.	.			trans	-56.6	126.8	-175.6	0	0	0	0	0	112	D523 L610 R613 S617 F618	D523-A615 HydrophobicContact CB-CB 3.93Å; L610-A615 HydrophobicContact CB-CB 4.19Å; L610-A615 HydrophobicContact CD2-CB 3.76Å; L610-A615 WeakPolarHBondContact O-CB 3.49Å; L610-A615 PolarHBondContact O-N 3.2Å; R613-A615 VanDerWaalsContact C-N 3.27Å; R613-A615 PolarHBondContact O-N 2.95Å; A615-S617 PolarHBondContact O-N 3Å; A615-F618 HydrophobicContact CB-CB 4.43Å; A615-F618 WeakPolarHBondContact O-CB 3.45Å; A615-F618 PolarHBondContact O-N 3.39Å
616	A	96.9	Very high	96.7	Very high	84 Å²	84	49.3 Å²	49.3	69%	0.694	28%	0.277	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.2	-27.7	-176.9	0	0	0	0	0	112.4	Q519 D523 S614	Q519-A616 HydrophobicContact CG-CB 4.19Å; D523-A616 PolarHBondContact OD2-N 3.03Å; S614-A616 PolarHBondContact O-N 2.97Å
617	S	97.3	Very high	96.8	Very high	5 Å²	5	48.5 Å²	48.5	4%	0.035	27%	0.272	C	S	.	.	T	Hydrogen-bonded Turn	trans	-88.9	6.8	174.4	60.1	0	0	0	0	115.3	M520 D523 A615 G619 S620 F621	M520-S617 VanDerWaalsContact CG-CB 3.46Å; D523-S617 WeakPolarHBondContact CB-OG 3.32Å; D523-S617 WeakPolarHBondContact OD2-CB 3.4Å; D523-S617 PolarHBondContact OD2-N 3.03Å; D523-S617 PolarHBondContact OD2-OG 3.29Å; A615-S617 PolarHBondContact O-N 3Å; S617-G619 VanDerWaalsContact C-N 3.29Å; S617-G619 PolarHBondContact O-N 3.34Å; S617-G619 VanDerWaalsContact O-N 3.11Å; S617-S620 WeakPolarHBondContact O-CA 3.48Å; S617-S620 WeakPolarHBondContact O-CB 3.28Å; S617-S620 PolarHBondContact O-N 3.47Å; S617-F621 PolarHBondContact O-N 3.36Å; S617-F621 VanDerWaalsContact O-N 3.14Å; S617-F621 WeakPolarHBondContact OG-CD2 3.28Å; S617-F621 WeakPolarHBondContact OG-CE2 3.46Å
618	F	97.4	Very high	96.9	Very high	71 Å²	71	47.7 Å²	47.7	31%	0.311	27%	0.268	S	S	.	.	H	α-helix	trans	-46.6	-46.1	-176.6	169.2	-96.4	0	0	0	113.9	I607 T611 A615 S620 F621 H622	I607-F618 HydrophobicContact CG2-CE2 3.89Å; T611-F618 WeakPolarHBondContact OG1-CE2 3.33Å; A615-F618 HydrophobicContact CB-CB 4.43Å; A615-F618 WeakPolarHBondContact O-CB 3.45Å; A615-F618 PolarHBondContact O-N 3.39Å; F618-S620 PolarHBondContact O-N 3.4Å; F618-F621 PolarHBondContact O-N 3.07Å; F618-H622 HydrophobicContact CE1-CB 4.46Å; F618-H622 HydrophobicContact CZ-CB 4.41Å; F618-H622 WeakPolarHBondContact O-CB 3.24Å; F618-H622 PolarHBondContact O-N 3.41Å
619	G	97	Very high	96.9	Very high	49 Å²	49	45.4 Å²	45.4	51%	0.505	26%	0.263	S	S	.	.	H	α-helix	trans	-63.3	-28.9	179.9	0	0	0	0	0	114	S617 L623	S617-G619 VanDerWaalsContact C-N 3.29Å; S617-G619 PolarHBondContact O-N 3.34Å; S617-G619 VanDerWaalsContact O-N 3.11Å; G619-L623 WeakPolarHBondContact O-CB 3.49Å; G619-L623 PolarHBondContact O-N 3Å; G619-L623 VanDerWaalsContact O-N 3.11Å
620	S	97.1	Very high	96.8	Very high	17 Å²	17	48.2 Å²	48.2	12%	0.119	28%	0.275	C	S	.	.	H	α-helix	trans	-76.9	-43	176.5	-55.3	0	0	0	0	110.9	Q516 M520 S617 F618 L623 I624	Q516-S620 PolarHBondContact OE1-OG 3.43Å; M520-S620 VanDerWaalsContact SD-CB 3.53Å; S617-S620 WeakPolarHBondContact O-CA 3.48Å; S617-S620 WeakPolarHBondContact O-CB 3.28Å; S617-S620 PolarHBondContact O-N 3.47Å; F618-S620 PolarHBondContact O-N 3.4Å; S620-L623 PolarHBondContact O-N 3.49Å; S620-I624 WeakPolarHBondContact O-CG1 3.5Å; S620-I624 PolarHBondContact O-N 3.18Å
621	F	97.5	Very high	96.9	Very high	10 Å²	10	49.4 Å²	49.4	4%	0.044	28%	0.28	C	S	.	.	H	α-helix	trans	-61.7	-41.6	171.3	-83.1	-66.4	0	0	0	112.7	M520 L524 F554 I607 L610 S617 F618 L623 I624 R625	M520-F621 HydrophobicContact CB-CE2 3.7Å; M520-F621 HydrophobicContact CB-CZ 3.67Å; M520-F621 HydrophobicContact CE-CD1 3.65Å; M520-F621 HydrophobicContact CE-CD2 4.01Å; M520-F621 HydrophobicContact CE-CE1 3.62Å; M520-F621 HydrophobicContact CE-CE2 4.01Å; M520-F621 HydrophobicContact CE-CG 3.83Å; M520-F621 HydrophobicContact CE-CZ 3.79Å; M520-F621 HydrophobicContact CG-CD2 4.23Å; M520-F621 HydrophobicContact CG-CE2 3.79Å; M520-F621 HydrophobicContact CG-CZ 4.1Å; M520-F621 WeakPolarHBondContact O-CZ 3.46Å; L524-F621 HydrophobicContact CB-CZ 3.94Å; L524-F621 HydrophobicContact CD1-CE1 4.05Å; L524-F621 HydrophobicContact CD1-CZ 4.02Å; L524-F621 HydrophobicContact CG-CZ 4.43Å; F554-F621 AromaticContact CE1-CE1 3.95Å; F554-F621 HydrophobicContact CE1-CE1 3.95Å; F554-F621 AromaticContact CZ-CE1 4Å; F554-F621 HydrophobicContact CZ-CE1 4Å; I607-F621 HydrophobicContact CD1-CB 3.94Å; L610-F621 HydrophobicContact CD1-CB 3.87Å; L610-F621 HydrophobicContact CD1-CD1 4.15Å; L610-F621 HydrophobicContact CD1-CD2 3.74Å; L610-F621 HydrophobicContact CD1-CE2 4.33Å; L610-F621 HydrophobicContact CD1-CG 3.65Å; L610-F621 HydrophobicContact CD2-CD2 4.32Å; L610-F621 HydrophobicContact CD2-CE2 4.4Å; S617-F621 PolarHBondContact O-N 3.36Å; S617-F621 VanDerWaalsContact O-N 3.14Å; S617-F621 WeakPolarHBondContact OG-CD2 3.28Å; S617-F621 WeakPolarHBondContact OG-CE2 3.46Å; F618-F621 PolarHBondContact O-N 3.07Å; F621-L623 VanDerWaalsContact C-N 3.35Å; F621-L623 PolarHBondContact O-N 3.44Å; F621-I624 PolarHBondContact O-N 3.36Å; F621-R625 VanDerWaalsContact O-CB 3.26Å; F621-R625 WeakPolarHBondContact O-CB 3.44Å; F621-R625 PolarHBondContact O-N 3.02Å
622	H	97.2	Very high	96.9	Very high	82 Å²	82	45.9 Å²	45.9	38%	0.38	26%	0.258	S	S	.	.	H	α-helix	trans	-65	-37.2	176.8	-174.9	66.5	0	0	0	112.3	F618 R625 L626	F618-H622 HydrophobicContact CE1-CB 4.46Å; F618-H622 HydrophobicContact CZ-CB 4.41Å; F618-H622 WeakPolarHBondContact O-CB 3.24Å; F618-H622 PolarHBondContact O-N 3.41Å; H622-R625 WeakPolarHBondContact O-CB 3.24Å; H622-R625 PolarHBondContact O-N 3.4Å; H622-L626 WeakPolarHBondContact O-CG 3.48Å; H622-L626 PolarHBondContact O-N 2.92Å; H622-L626 VanDerWaalsContact O-N 3.08Å
623	L	97.6	Very high	96.9	Very high	38 Å²	38	43.8 Å²	43.8	20%	0.199	24%	0.244	C	C	.	.	H	α-helix	trans	-66.4	-43.6	173.8	179.2	60.5	0	0	0	112.4	L503 A506 V510 G619 S620 F621 L626 L627	L503-L623 HydrophobicContact CD2-CD1 3.98Å; A506-L623 HydrophobicContact CB-CD1 4.06Å; A506-L623 HydrophobicContact CB-CD2 3.92Å; V510-L623 HydrophobicContact CG2-CD2 3.95Å; G619-L623 WeakPolarHBondContact O-CB 3.49Å; G619-L623 PolarHBondContact O-N 3Å; G619-L623 VanDerWaalsContact O-N 3.11Å; S620-L623 PolarHBondContact O-N 3.49Å; F621-L623 VanDerWaalsContact C-N 3.35Å; F621-L623 PolarHBondContact O-N 3.44Å; L623-L626 PolarHBondContact O-N 3.18Å; L623-L627 PolarHBondContact O-N 3.36Å
624	I	96.4	Very high	97	Very high	4 Å²	4	40.7 Å²	40.7	2%	0.021	23%	0.232	C	C	.	.	H	α-helix	trans	-64.1	-42.2	175.1	-68.5	-170.5	0	0	0	110.8	L511 M520 S620 F621 L626 L627 Y628	L511-I624 HydrophobicContact CD2-CD1 3.85Å; L511-I624 HydrophobicContact CG-CD1 4.38Å; M520-I624 HydrophobicContact CE-CD1 3.71Å; S620-I624 WeakPolarHBondContact O-CG1 3.5Å; S620-I624 PolarHBondContact O-N 3.18Å; F621-I624 PolarHBondContact O-N 3.36Å; I624-L626 PolarHBondContact O-N 3.48Å; I624-L627 PolarHBondContact O-N 2.94Å; I624-Y628 HydrophobicContact CG2-CD1 3.91Å; I624-Y628 HydrophobicContact CG2-CD2 3.94Å; I624-Y628 HydrophobicContact CG2-CE1 3.55Å; I624-Y628 HydrophobicContact CG2-CE2 3.59Å; I624-Y628 HydrophobicContact CG2-CG 4.09Å; I624-Y628 WeakPolarHBondContact O-CB 3.2Å; I624-Y628 WeakPolarHBondContact O-CD1 3.35Å; I624-Y628 PolarHBondContact O-N 2.71Å
625	R	96.2	Very high	97	Very high	22 Å²	22	36 Å²	36	8%	0.083	20%	0.199	C	C	.	.	H	α-helix	trans	-53.6	-49.5	174.9	175.9	78.6	-162.8	86.7	6.1	111.9	S600 S603 I607 F621 H622 Y628 D629	S600-R625 PolarHBondContact O-NH2 3.4Å; S600-R625 PolarHBondContact OG-NH2 3.5Å; S600-R625 VanDerWaalsContact OG-NH2 3.16Å; S603-R625 PolarHBondContact OG-NE 3.04Å; S603-R625 PolarHBondContact OG-NH1 2.83Å; S603-R625 PolarHBondContact OG-NH2 3.25Å; I607-R625 HydrophobicContact CD1-CB 4.02Å; I607-R625 HydrophobicContact CD1-CG 4.33Å; I607-R625 HydrophobicContact CG1-CB 4.15Å; I607-R625 HydrophobicContact CG1-CG 3.9Å; F621-R625 VanDerWaalsContact O-CB 3.26Å; F621-R625 WeakPolarHBondContact O-CB 3.44Å; F621-R625 PolarHBondContact O-N 3.02Å; H622-R625 WeakPolarHBondContact O-CB 3.24Å; H622-R625 PolarHBondContact O-N 3.4Å; R625-Y628 PolarHBondContact O-N 2.72Å; R625-D629 VanDerWaalsContact CZ-CG 3.46Å; R625-D629 IonicContact CZ-OD1 2.82Å; R625-D629 IonicContact CZ-OD2 2.71Å; R625-D629 IonicContact NE-OD2 3.66Å; R625-D629 IonicContact NH1-OD1 2.67Å; R625-D629 PolarHBondContact NH1-OD1 3.5Å; R625-D629 IonicContact NH1-OD2 3.94Å; R625-D629 PolarHBondContact NH1-OD2 3.46Å; R625-D629 VanDerWaalsContact NH2-CG 3.26Å; R625-D629 IonicContact NH2-OD1 2.65Å; R625-D629 PolarHBondContact NH2-OD1 3.01Å; R625-D629 IonicContact NH2-OD2 3.78Å; R625-D629 PolarHBondContact NH2-OD2 3.49Å; R625-D629 PolarHBondContact O-N 2.99Å
626	L	97.3	Very high	96.9	Very high	71 Å²	71	35.8 Å²	35.8	37%	0.372	20%	0.196	S	C	.	.	H	α-helix	trans	-65.3	-41.7	179	-71.9	171	0	0	0	112.6	L503 H622 L623 I624 Y628 E630	L503-L626 HydrophobicContact CD2-CB 4.21Å; H622-L626 WeakPolarHBondContact O-CG 3.48Å; H622-L626 PolarHBondContact O-N 2.92Å; H622-L626 VanDerWaalsContact O-N 3.08Å; L623-L626 PolarHBondContact O-N 3.18Å; I624-L626 PolarHBondContact O-N 3.48Å; L626-Y628 VanDerWaalsContact C-N 3.31Å; L626-E630 PolarHBondContact O-N 3.42Å
627	L	97.8	Very high	96.8	Very high	3 Å²	3	32.3 Å²	32.3	2%	0.016	17%	0.165	C	C	.	.	H	α-helix	trans	-59.5	-45.2	172.5	169.5	64.7	0	0	0	111	L500 L503 A504 A507 L564 L623 I624 E630 Y631	L500-L627 HydrophobicContact CD1-CD1 3.69Å; L503-L627 HydrophobicContact CB-CB 4.28Å; L503-L627 HydrophobicContact CB-CD1 4.09Å; A504-L627 HydrophobicContact CB-CD1 4.21Å; A507-L627 HydrophobicContact CB-CD2 3.47Å; A507-L627 VanDerWaalsContact CB-CD2 3.47Å; L564-L627 HydrophobicContact CD1-CD2 3.69Å; L623-L627 PolarHBondContact O-N 3.36Å; I624-L627 PolarHBondContact O-N 2.94Å; L627-E630 PolarHBondContact O-N 3.29Å; L627-Y631 VanDerWaalsContact O-CB 3.31Å; L627-Y631 WeakPolarHBondContact O-CB 3.48Å; L627-Y631 PolarHBondContact O-N 3.47Å
628	Y	97.1	Very high	96.6	Very high	9 Å²	9	33.8 Å²	33.8	4%	0.035	17%	0.172	C	C	.	.	H	α-helix	trans	-72.6	-29.3	-174	-73.9	11.1	0	0	0	112.8	F554 W567 W570 L571 W599 I624 R625 L626 M632	F554-Y628 HydrophobicContact CD2-CE2 4.31Å; F554-Y628 AromaticContact CE2-CE2 3.85Å; F554-Y628 HydrophobicContact CE2-CE2 3.85Å; W567-Y628 VanDerWaalsContact CD2-OH 3.22Å; W567-Y628 WeakPolarHBondContact CZ3-OH 3.29Å; W570-Y628 HydrophobicContact CZ3-CE2 4.2Å; L571-Y628 HydrophobicContact CD1-CD1 3.62Å; L571-Y628 HydrophobicContact CD1-CD2 4.36Å; L571-Y628 HydrophobicContact CD1-CE1 3.75Å; L571-Y628 HydrophobicContact CD1-CE2 4.46Å; L571-Y628 HydrophobicContact CD1-CG 3.95Å; L571-Y628 HydrophobicContact CD2-CD2 3.93Å; L571-Y628 HydrophobicContact CD2-CE2 4.1Å; L571-Y628 HydrophobicContact CD2-CG 4.2Å; W599-Y628 HydrophobicContact CH2-CD2 4.41Å; W599-Y628 AromaticContact CZ2-CD2 3.99Å; W599-Y628 HydrophobicContact CZ2-CD2 3.99Å; W599-Y628 HydrophobicContact CZ2-CG 4.47Å; I624-Y628 HydrophobicContact CG2-CD1 3.91Å; I624-Y628 HydrophobicContact CG2-CD2 3.94Å; I624-Y628 HydrophobicContact CG2-CE1 3.55Å; I624-Y628 HydrophobicContact CG2-CE2 3.59Å; I624-Y628 HydrophobicContact CG2-CG 4.09Å; I624-Y628 WeakPolarHBondContact O-CB 3.2Å; I624-Y628 WeakPolarHBondContact O-CD1 3.35Å; I624-Y628 PolarHBondContact O-N 2.71Å; R625-Y628 PolarHBondContact O-N 2.72Å; L626-Y628 VanDerWaalsContact C-N 3.31Å; Y628-M632 WeakPolarHBondContact O-CB 3.35Å; Y628-M632 VanDerWaalsContact O-CG 3.24Å; Y628-M632 WeakPolarHBondContact O-CG 3.39Å; Y628-M632 PolarHBondContact O-N 3.11Å
629	D	96.3	Very high	96.5	Very high	44 Å²	44	33.7 Å²	33.7	24%	0.235	17%	0.169	C	C	.	.	H	α-helix	trans	-60.4	-56.5	168.1	-82.2	-37.1	0	0	0	111.2	R625 Y631 M632 F633	R625-D629 VanDerWaalsContact CZ-CG 3.46Å; R625-D629 IonicContact CZ-OD1 2.82Å; R625-D629 IonicContact CZ-OD2 2.71Å; R625-D629 IonicContact NE-OD2 3.66Å; R625-D629 IonicContact NH1-OD1 2.67Å; R625-D629 PolarHBondContact NH1-OD1 3.5Å; R625-D629 IonicContact NH1-OD2 3.94Å; R625-D629 PolarHBondContact NH1-OD2 3.46Å; R625-D629 VanDerWaalsContact NH2-CG 3.26Å; R625-D629 IonicContact NH2-OD1 2.65Å; R625-D629 PolarHBondContact NH2-OD1 3.01Å; R625-D629 IonicContact NH2-OD2 3.78Å; R625-D629 PolarHBondContact NH2-OD2 3.49Å; R625-D629 PolarHBondContact O-N 2.99Å; D629-Y631 VanDerWaalsContact C-N 3.29Å; D629-Y631 PolarHBondContact O-N 2.97Å; D629-M632 PolarHBondContact O-N 3.48Å; D629-F633 WeakPolarHBondContact O-CB 3.45Å; D629-F633 PolarHBondContact O-N 3.37Å
630	E	96.3	Very high	96.3	Very high	68 Å²	68	31.9 Å²	31.9	32%	0.318	15%	0.148	S	C	.	.	H	α-helix	trans	-64	-35.4	-176.9	-67.9	-68.3	145.4	0	0	111.7	L500 L503 L626 L627 Y634	L500-E630 HydrophobicContact CB-CB 4.4Å; L500-E630 HydrophobicContact CD1-CB 3.87Å; L503-E630 HydrophobicContact CD1-CB 4.39Å; L503-E630 HydrophobicContact CD1-CG 3.92Å; L626-E630 PolarHBondContact O-N 3.42Å; L627-E630 PolarHBondContact O-N 3.29Å; E630-Y634 VanDerWaalsContact O-CB 3.25Å; E630-Y634 WeakPolarHBondContact O-CB 3.43Å; E630-Y634 PolarHBondContact O-N 3.07Å
631	Y	97.9	Very high	96.2	Very high	26 Å²	26	31.1 Å²	31.1	10%	0.102	14%	0.144	C	C	.	.	H	α-helix	trans	-76.3	-39.5	177.1	-161.8	-108.7	0	0	0	112.9	V445 L446 L500 A568 L571 L627 D629 F633 Y634 L635	V445-Y631 HydrophobicContact CG2-CD2 4.23Å; V445-Y631 HydrophobicContact CG2-CE2 3.85Å; L446-Y631 HydrophobicContact CD2-CD2 4.27Å; L446-Y631 HydrophobicContact CD2-CE2 4.04Å; L446-Y631 HydrophobicContact CG-CE2 4.39Å; L500-Y631 HydrophobicContact CD1-CD2 4.17Å; L500-Y631 HydrophobicContact CD2-CD2 4.2Å; A568-Y631 HydrophobicContact CB-CE1 3.67Å; L571-Y631 HydrophobicContact CB-CD1 4.1Å; L571-Y631 HydrophobicContact CB-CE1 4.31Å; L571-Y631 HydrophobicContact CD1-CD1 3.69Å; L571-Y631 HydrophobicContact CD1-CE1 4.43Å; L627-Y631 VanDerWaalsContact O-CB 3.31Å; L627-Y631 WeakPolarHBondContact O-CB 3.48Å; L627-Y631 PolarHBondContact O-N 3.47Å; D629-Y631 VanDerWaalsContact C-N 3.29Å; D629-Y631 PolarHBondContact O-N 2.97Å; Y631-F633 VanDerWaalsContact C-N 3.35Å; Y631-Y634 AromaticContact CD2-CD1 3.92Å; Y631-Y634 HydrophobicContact CD2-CD1 3.92Å; Y631-Y634 AromaticContact CE2-CD1 3.68Å; Y631-Y634 HydrophobicContact CE2-CD1 3.68Å; Y631-Y634 AromaticContact CE2-CE1 3.89Å; Y631-Y634 HydrophobicContact CE2-CE1 3.89Å; Y631-Y634 PolarHBondContact O-N 2.98Å; Y631-L635 HydrophobicContact CD1-CD1 3.69Å; Y631-L635 HydrophobicContact CD1-CG 4.06Å; Y631-L635 HydrophobicContact CE1-CD1 3.54Å; Y631-L635 HydrophobicContact CE1-CD2 4.01Å; Y631-L635 HydrophobicContact CE1-CG 3.81Å; Y631-L635 WeakPolarHBondContact O-CB 3.5Å; Y631-L635 VanDerWaalsContact O-CG 3.3Å; Y631-L635 WeakPolarHBondContact O-CG 3.31Å; Y631-L635 PolarHBondContact O-N 3.08Å
632	M	97.2	Very high	95.9	Very high	0 Å²	0	36.9 Å²	36.9	0%	0	17%	0.171	C	C	.	.	H	α-helix	trans	-63	-42.2	172.2	-82.6	-76	-176.4	0	0	111.3	L571 V574 V575 F595 L596 W599 Y628 D629 L635 V636	L571-M632 HydrophobicContact CB-CE 4.08Å; L571-M632 HydrophobicContact CD2-CE 3.53Å; L571-M632 HydrophobicContact CG-CE 4.4Å; V574-M632 HydrophobicContact CB-CE 4.01Å; V574-M632 HydrophobicContact CG1-CE 3.91Å; V575-M632 HydrophobicContact CG2-CE 4.15Å; V575-M632 HydrophobicContact CG2-SD 3.34Å; V575-M632 WeakPolarHBondContact CG2-SD 3.29Å; F595-M632 HydrophobicContact CE1-CE 4.45Å; F595-M632 HydrophobicContact CE1-SD 3.69Å; F595-M632 HydrophobicContact CZ-CE 4.09Å; F595-M632 HydrophobicContact CZ-SD 3.92Å; L596-M632 HydrophobicContact CD2-CB 3.98Å; W599-M632 HydrophobicContact CD2-CE 4.26Å; W599-M632 HydrophobicContact CD2-CG 4.15Å; W599-M632 HydrophobicContact CE3-CE 3.98Å; W599-M632 HydrophobicContact CG-CG 4.44Å; W599-M632 HydrophobicContact CH2-CE 3.85Å; W599-M632 HydrophobicContact CZ2-CE 4.12Å; W599-M632 HydrophobicContact CZ2-CG 4.09Å; W599-M632 HydrophobicContact CZ3-CE 3.77Å; Y628-M632 WeakPolarHBondContact O-CB 3.35Å; Y628-M632 VanDerWaalsContact O-CG 3.24Å; Y628-M632 WeakPolarHBondContact O-CG 3.39Å; Y628-M632 PolarHBondContact O-N 3.11Å; D629-M632 PolarHBondContact O-N 3.48Å; M632-L635 PolarHBondContact O-N 2.93Å; M632-V636 WeakPolarHBondContact O-CB 3.29Å; M632-V636 VanDerWaalsContact O-CG2 3.24Å; M632-V636 WeakPolarHBondContact O-CG2 3.42Å; M632-V636 PolarHBondContact O-N 3.45Å
633	F	95.8	Very high	95.6	Very high	89 Å²	89	35.7 Å²	35.7	39%	0.39	18%	0.175	S	C	.	.	H	α-helix	trans	-60.2	-50.6	173.5	-163.7	-63.9	0	0	0	110.3	L596 D629 Y631 L635 V636 E637	L596-F633 HydrophobicContact CD1-CD2 4.07Å; L596-F633 HydrophobicContact CD1-CG 4.39Å; D629-F633 WeakPolarHBondContact O-CB 3.45Å; D629-F633 PolarHBondContact O-N 3.37Å; Y631-F633 VanDerWaalsContact C-N 3.35Å; F633-L635 VanDerWaalsContact C-N 3.34Å; F633-L635 PolarHBondContact O-N 3.07Å; F633-V636 PolarHBondContact O-N 3.11Å; F633-E637 HydrophobicContact CD1-CB 4.17Å; F633-E637 HydrophobicContact CE1-CB 4.33Å; F633-E637 VanDerWaalsContact CE1-OE1 3.29Å; F633-E637 WeakPolarHBondContact CE1-OE1 3.33Å; F633-E637 WeakPolarHBondContact O-CB 3.15Å; F633-E637 PolarHBondContact O-N 3.24Å
634	Y	96.3	Very high	95.3	Very high	43 Å²	43	36.9 Å²	36.9	17%	0.169	18%	0.184	C	C	.	.	H	α-helix	trans	-53.8	-46.2	177	166.3	-93	0	0	0	112.7	V445 Y497 L500 E630 Y631 H638	V445-Y634 HydrophobicContact CG1-CD2 4.29Å; V445-Y634 HydrophobicContact CG1-CE2 3.8Å; V445-Y634 HydrophobicContact CG2-CD1 4.38Å; V445-Y634 HydrophobicContact CG2-CE1 4.03Å; V445-Y634 HydrophobicContact CG2-CE2 4.3Å; Y497-Y634 HydrophobicContact CD1-CD2 4.21Å; Y497-Y634 HydrophobicContact CD2-CE2 4.43Å; Y497-Y634 AromaticContact CE1-CD2 3.71Å; Y497-Y634 HydrophobicContact CE1-CD2 3.71Å; Y497-Y634 HydrophobicContact CE1-CE2 4.27Å; Y497-Y634 HydrophobicContact CE2-CD2 4.24Å; Y497-Y634 AromaticContact CE2-CE2 3.95Å; Y497-Y634 HydrophobicContact CE2-CE2 3.95Å; Y497-Y634 AromaticContact CZ-CD2 3.75Å; Y497-Y634 AromaticContact CZ-CE2 3.89Å; L500-Y634 HydrophobicContact CD2-CD2 4.16Å; L500-Y634 HydrophobicContact CD2-CG 3.92Å; E630-Y634 VanDerWaalsContact O-CB 3.25Å; E630-Y634 WeakPolarHBondContact O-CB 3.43Å; E630-Y634 PolarHBondContact O-N 3.07Å; Y631-Y634 AromaticContact CD2-CD1 3.92Å; Y631-Y634 HydrophobicContact CD2-CD1 3.92Å; Y631-Y634 AromaticContact CE2-CD1 3.68Å; Y631-Y634 HydrophobicContact CE2-CD1 3.68Å; Y631-Y634 AromaticContact CE2-CE1 3.89Å; Y631-Y634 HydrophobicContact CE2-CE1 3.89Å; Y631-Y634 PolarHBondContact O-N 2.98Å; Y634-H638 AromaticContact CD2-CE1 3.56Å; Y634-H638 AromaticContact CD2-ND1 3.91Å; Y634-H638 AromaticContact CE2-CE1 3.18Å; Y634-H638 WeakPolarHBondContact CE2-CE1 3.39Å; Y634-H638 AromaticContact CE2-ND1 3.83Å; Y634-H638 AromaticContact CE2-NE2 3.91Å; Y634-H638 AromaticContact CZ-CE1 3.69Å; Y634-H638 PolarHBondContact O-N 2.91Å; Y634-H638 PolarHBondContact O-ND1 3.16Å
635	L	96.9	Very high	95	Very high	12 Å²	12	40.2 Å²	40.2	6%	0.063	22%	0.219	C	C	.	.	H	α-helix	trans	-62.9	-52.4	176.5	-71.2	171.1	0	0	0	111.3	L571 D572 V575 Y631 M632 F633 E637 H638 R639	L571-L635 HydrophobicContact CB-CD1 3.99Å; D572-L635 HydrophobicContact CB-CD1 4.17Å; D572-L635 HydrophobicContact CB-CD2 3.93Å; V575-L635 HydrophobicContact CG2-CB 3.96Å; V575-L635 HydrophobicContact CG2-CD1 3.92Å; Y631-L635 HydrophobicContact CD1-CD1 3.69Å; Y631-L635 HydrophobicContact CD1-CG 4.06Å; Y631-L635 HydrophobicContact CE1-CD1 3.54Å; Y631-L635 HydrophobicContact CE1-CD2 4.01Å; Y631-L635 HydrophobicContact CE1-CG 3.81Å; Y631-L635 WeakPolarHBondContact O-CB 3.5Å; Y631-L635 VanDerWaalsContact O-CG 3.3Å; Y631-L635 WeakPolarHBondContact O-CG 3.31Å; Y631-L635 PolarHBondContact O-N 3.08Å; M632-L635 PolarHBondContact O-N 2.93Å; F633-L635 VanDerWaalsContact C-N 3.34Å; F633-L635 PolarHBondContact O-N 3.07Å; L635-E637 VanDerWaalsContact C-N 3.32Å; L635-E637 PolarHBondContact O-N 3.5Å; L635-H638 PolarHBondContact O-N 2.9Å; L635-H638 VanDerWaalsContact O-N 3.17Å; L635-R639 WeakPolarHBondContact O-CG 3.35Å; L635-R639 PolarHBondContact O-N 2.86Å
636	V	95.7	Very high	94.7	Very high	5 Å²	5	43.2 Å²	43.2	3%	0.03	23%	0.234	C	C	.	.	H	α-helix	trans	-63.3	-37.7	-177.2	172.6	0	0	0	0	111.8	V575 L579 A592 F595 L596 M632 F633 R639 V640	V575-V636 HydrophobicContact CG1-CG2 3.88Å; V575-V636 HydrophobicContact CG2-CG2 4.09Å; L579-V636 HydrophobicContact CD1-CG2 4.45Å; A592-V636 HydrophobicContact CB-CG1 3.65Å; F595-V636 HydrophobicContact CD1-CG2 4Å; F595-V636 HydrophobicContact CE1-CG2 4.22Å; L596-V636 HydrophobicContact CD1-CB 4.1Å; L596-V636 HydrophobicContact CD1-CG1 3.86Å; L596-V636 HydrophobicContact CD2-CB 4.17Å; L596-V636 HydrophobicContact CD2-CG2 3.86Å; L596-V636 HydrophobicContact CG-CB 4.22Å; L596-V636 HydrophobicContact CG-CG1 4.11Å; L596-V636 HydrophobicContact CG-CG2 4.14Å; M632-V636 WeakPolarHBondContact O-CB 3.29Å; M632-V636 VanDerWaalsContact O-CG2 3.24Å; M632-V636 WeakPolarHBondContact O-CG2 3.42Å; M632-V636 PolarHBondContact O-N 3.45Å; F633-V636 PolarHBondContact O-N 3.11Å; V636-R639 PolarHBondContact O-N 3.24Å; V636-V640 HydrophobicContact CG1-CG2 4.34Å; V636-V640 WeakPolarHBondContact O-CB 3.43Å; V636-V640 WeakPolarHBondContact O-CG2 3.4Å; V636-V640 PolarHBondContact O-N 3.31Å
637	E	93.9	Very high	94.5	Very high	10 Å²	10	40.7 Å²	40.7	5%	0.047	22%	0.221	C	C	.	.	H	α-helix	trans	-55.8	-48.1	171.9	171.6	-177.5	-81.9	0	0	111.8	R496 Y497 F633 L635 V640 A641 P648	R496-E637 IonicContact CZ-OE1 3.53Å; R496-E637 IonicContact NH1-OE1 3.52Å; R496-E637 PolarHBondContact NH1-OE1 3.4Å; R496-E637 IonicContact NH1-OE2 2.71Å; R496-E637 IonicContact NH2-OE1 2.67Å; R496-E637 PolarHBondContact NH2-OE1 3.01Å; R496-E637 VanDerWaalsContact NH2-OE1 3.08Å; R496-E637 IonicContact NH2-OE2 3.64Å; Y497-E637 WeakPolarHBondContact CE1-OE2 3.47Å; Y497-E637 PolarHBondContact OH-OE2 3.49Å; F633-E637 HydrophobicContact CD1-CB 4.17Å; F633-E637 HydrophobicContact CE1-CB 4.33Å; F633-E637 VanDerWaalsContact CE1-OE1 3.29Å; F633-E637 WeakPolarHBondContact CE1-OE1 3.33Å; F633-E637 WeakPolarHBondContact O-CB 3.15Å; F633-E637 PolarHBondContact O-N 3.24Å; L635-E637 VanDerWaalsContact C-N 3.32Å; L635-E637 PolarHBondContact O-N 3.5Å; E637-V640 PolarHBondContact O-N 2.98Å; E637-A641 WeakPolarHBondContact O-CB 3.13Å; E637-A641 PolarHBondContact O-N 3.15Å; E637-P648 HydrophobicContact CG-CB 4.15Å
638	H	94.6	Very high	94.3	Very high	37 Å²	37	41.1 Å²	41.1	17%	0.171	22%	0.224	C	C	.	.	H	α-helix	trans	-68.3	-38	175.8	-73.3	72	0	0	0	112.6	Y497 Y634 L635 A641 Q642	Y497-H638 AromaticContact CZ-CE1 3.98Å; Y497-H638 PolarHBondContact OH-CE1 3.24Å; Y634-H638 AromaticContact CD2-CE1 3.56Å; Y634-H638 AromaticContact CD2-ND1 3.91Å; Y634-H638 AromaticContact CE2-CE1 3.18Å; Y634-H638 WeakPolarHBondContact CE2-CE1 3.39Å; Y634-H638 AromaticContact CE2-ND1 3.83Å; Y634-H638 AromaticContact CE2-NE2 3.91Å; Y634-H638 AromaticContact CZ-CE1 3.69Å; Y634-H638 PolarHBondContact O-N 2.91Å; Y634-H638 PolarHBondContact O-ND1 3.16Å; L635-H638 PolarHBondContact O-N 2.9Å; L635-H638 VanDerWaalsContact O-N 3.17Å; H638-A641 PolarHBondContact O-N 3.06Å; H638-Q642 WeakPolarHBondContact O-CB 3.38Å; H638-Q642 WeakPolarHBondContact O-CG 3.44Å; H638-Q642 PolarHBondContact O-N 2.9Å
639	R	94.6	Very high	94	Very high	68 Å²	68	40.7 Å²	40.7	26%	0.257	22%	0.222	S	C	.	.	H	α-helix	trans	-66.7	-38.1	176.8	-64.1	-63	-179.9	-175.6	3.6	112.1	D572 V575 T576 L579 F588 L635 V636 A643	D572-R639 IonicContact OD1-CZ 2.82Å; D572-R639 IonicContact OD1-NE 3.98Å; D572-R639 PolarHBondContact OD1-NE 2.95Å; D572-R639 IonicContact OD1-NH2 2.71Å; D572-R639 PolarHBondContact OD1-NH2 3.19Å; D572-R639 IonicContact OD2-NH2 3.15Å; D572-R639 PolarHBondContact OD2-NH2 3Å; V575-R639 HydrophobicContact CG1-CG 3.89Å; T576-R639 PolarHBondContact OG1-NH2 3.09Å; L579-R639 HydrophobicContact CD1-CB 4.47Å; F588-R639 HydrophobicContact CE1-CB 4.25Å; F588-R639 WeakPolarHBondContact CE1-O 3.34Å; F588-R639 HydrophobicContact CZ-CB 4.07Å; L635-R639 WeakPolarHBondContact O-CG 3.35Å; L635-R639 PolarHBondContact O-N 2.86Å; V636-R639 PolarHBondContact O-N 3.24Å; R639-A643 WeakPolarHBondContact O-CB 3.39Å; R639-A643 PolarHBondContact O-N 3.21Å
640	V	93.7	Very high	93.6	Very high	11 Å²	11	38.7 Å²	38.7	7%	0.067	21%	0.213	C	C	.	.	H	α-helix	trans	-66.3	-46.1	174.4	170.9	0	0	0	0	110.7	F588 P589 A592 V636 E637 Q642 A643 T644 V651	F588-V640 HydrophobicContact CD1-CG2 4.24Å; F588-V640 HydrophobicContact CE1-CG2 4.05Å; P589-V640 HydrophobicContact CB-CG1 4.23Å; P589-V640 HydrophobicContact CG-CG1 4.34Å; A592-V640 HydrophobicContact CB-CG2 3.48Å; A592-V640 VanDerWaalsContact CB-CG2 3.48Å; V636-V640 HydrophobicContact CG1-CG2 4.34Å; V636-V640 WeakPolarHBondContact O-CB 3.43Å; V636-V640 WeakPolarHBondContact O-CG2 3.4Å; V636-V640 PolarHBondContact O-N 3.31Å; E637-V640 PolarHBondContact O-N 2.98Å; V640-Q642 VanDerWaalsContact C-N 3.34Å; V640-Q642 PolarHBondContact O-N 3.02Å; V640-A643 CarbonylContact O-C 3.5Å; V640-A643 WeakPolarHBondContact O-CA 3.41Å; V640-A643 PolarHBondContact O-N 3.02Å; V640-T644 HydrophobicContact CG1-CG2 4.32Å; V640-T644 PolarHBondContact O-N 3.35Å; V640-T644 PolarHBondContact O-OG1 2.85Å; V640-V651 HydrophobicContact CG1-CG1 3.86Å; V640-V651 HydrophobicContact CG1-CG2 4.45Å
641	A	93.6	Very high	93.1	Very high	2 Å²	2	35.9 Å²	35.9	2%	0.017	20%	0.2	C	C	.	.	H	α-helix	trans	-58.9	-42.8	176.1	0	0	0	0	0	112.7	E637 H638 A643 T644 G645 E646 P648 V651	E637-A641 WeakPolarHBondContact O-CB 3.13Å; E637-A641 PolarHBondContact O-N 3.15Å; H638-A641 PolarHBondContact O-N 3.06Å; A641-A643 VanDerWaalsContact C-N 3.28Å; A641-A643 PolarHBondContact O-N 2.9Å; A641-T644 PolarHBondContact O-N 3.35Å; A641-T644 PolarHBondContact O-OG1 3.12Å; A641-G645 PolarHBondContact O-N 3.43Å; A641-E646 PolarHBondContact O-N 3.35Å; A641-E646 VanDerWaalsContact O-N 3.07Å; A641-P648 HydrophobicContact CB-CG 4.02Å; A641-V651 HydrophobicContact CB-CG2 3.94Å
642	Q	92.6	Very high	91.8	Very high	131 Å²	131	35.9 Å²	35.9	61%	0.612	20%	0.201	S	C	*	.	H	α-helix	trans	-61.1	-34.3	172.6	-73.4	166.4	10.7	0	0	112.8	H638 V640	H638-Q642 WeakPolarHBondContact O-CB 3.38Å; H638-Q642 WeakPolarHBondContact O-CG 3.44Å; H638-Q642 PolarHBondContact O-N 2.9Å; V640-Q642 VanDerWaalsContact C-N 3.34Å; V640-Q642 PolarHBondContact O-N 3.02Å
643	A	90.8	Very high	90.2	Very high	56 Å²	56	36.2 Å²	36.2	46%	0.463	21%	0.205	S	C	.	.	H	α-helix	trans	-81.8	-28.8	179.8	0	0	0	0	0	113.9	F588 R639 V640 A641	F588-A643 HydrophobicContact CD1-CB 3.55Å; F588-A643 HydrophobicContact CE1-CB 3.78Å; F588-A643 HydrophobicContact CG-CB 3.99Å; F588-A643 HydrophobicContact CZ-CB 4.36Å; R639-A643 WeakPolarHBondContact O-CB 3.39Å; R639-A643 PolarHBondContact O-N 3.21Å; V640-A643 CarbonylContact O-C 3.5Å; V640-A643 WeakPolarHBondContact O-CA 3.41Å; V640-A643 PolarHBondContact O-N 3.02Å; A641-A643 VanDerWaalsContact C-N 3.28Å; A641-A643 PolarHBondContact O-N 2.9Å
644	T	90.3	Very high	88.4	Confident	64 Å²	64	38 Å²	38	39%	0.393	21%	0.214	S	C	.	.	H	α-helix	trans	-87.3	-19.6	174.6	60.6	0	0	0	0	113.3	P589 V640 A641 E646	P589-T644 HydrophobicContact CG-CG2 4.33Å; V640-T644 HydrophobicContact CG1-CG2 4.32Å; V640-T644 PolarHBondContact O-N 3.35Å; V640-T644 PolarHBondContact O-OG1 2.85Å; A641-T644 PolarHBondContact O-N 3.35Å; A641-T644 PolarHBondContact O-OG1 3.12Å; T644-E646 WeakPolarHBondContact CB-OE2 3.4Å; T644-E646 WeakPolarHBondContact OG1-CB 3.45Å; T644-E646 WeakPolarHBondContact OG1-CG 3.44Å; T644-E646 PolarHBondContact OG1-OE2 3.47Å
645	G	89.4	Confident	86.3	Confident	73 Å²	73	39 Å²	39	75%	0.753	22%	0.219	S	C	*	.	T	Hydrogen-bonded Turn	trans	83.3	21.9	-174.7	0	0	0	0	0	113.5	A641	A641-G645 PolarHBondContact O-N 3.43Å
646	E	90.8	Very high	83.8	Confident	86 Å²	86	42.4 Å²	42.4	40%	0.402	24%	0.238	S	C	.	.	S	Bend	trans	-113.6	178.2	-174.8	-60.8	-179.8	123.9	0	0	111.8	A641 T644 V651	A641-E646 PolarHBondContact O-N 3.35Å; A641-E646 VanDerWaalsContact O-N 3.07Å; T644-E646 WeakPolarHBondContact CB-OE2 3.4Å; T644-E646 WeakPolarHBondContact OG1-CB 3.45Å; T644-E646 WeakPolarHBondContact OG1-CG 3.44Å; T644-E646 PolarHBondContact OG1-OE2 3.47Å; E646-V651 HydrophobicContact CB-CG2 4.08Å
647	T	92.7	Very high	81	Confident	18 Å²	18	46.3 Å²	46.3	11%	0.11	26%	0.258	C	S	.	.			trans	-87.1	151.1	168.7	73.3	0	0	0	0	110.9	H431 L432 Q435 I649 G650 V651	H431-T647 PolarHBondContact O-OG1 3.49Å; H431-T647 VanDerWaalsContact O-OG1 3.08Å; L432-T647 HydrophobicContact CD2-CG2 3.93Å; Q435-T647 HydrophobicContact CB-CG2 3.93Å; Q435-T647 HydrophobicContact CG-CG2 4.11Å; T647-I649 PolarHBondContact O-N 3.14Å; T647-I649 VanDerWaalsContact O-N 3.13Å; T647-G650 PolarHBondContact O-N 3.49Å; T647-G650 PolarHBondContact OG1-N 3.27Å; T647-G650 VanDerWaalsContact OG1-N 3.16Å; T647-V651 PolarHBondContact O-N 3.02Å
648	P	93.2	Very high	78.2	Confident	11 Å²	11	50.1 Å²	50.1	7%	0.071	28%	0.279	C	S	.	.	H	α-helix	trans	-46.6	-38	169.7	-32.7	36.2	0	0	0	114.3	E637 A641 M652	E637-P648 HydrophobicContact CG-CB 4.15Å; A641-P648 HydrophobicContact CB-CG 4.02Å; P648-M652 WeakPolarHBondContact O-CG 3.28Å; P648-M652 PolarHBondContact O-N 3.39Å
649	I	91.8	Very high	75.4	Confident	0 Å²	0	55.3 Å²	55.3	0%	0	30%	0.303	C	S	.	.	H	α-helix	trans	-70.4	-39.9	176.7	-61.6	179.1	0	0	0	112.1	Y434 Q435 V438 A489 F490 T493 T647 M652 G653	Y434-I649 WeakPolarHBondContact O-CD1 3.39Å; Q435-I649 HydrophobicContact CB-CD1 4.41Å; V438-I649 HydrophobicContact CG2-CD1 3.83Å; A489-I649 HydrophobicContact CB-CG2 3.8Å; F490-I649 HydrophobicContact CB-CD1 4.38Å; F490-I649 HydrophobicContact CD2-CD1 4.13Å; T493-I649 HydrophobicContact CG2-CG1 4.42Å; T647-I649 PolarHBondContact O-N 3.14Å; T647-I649 VanDerWaalsContact O-N 3.13Å; I649-M652 WeakPolarHBondContact O-CB 3.29Å; I649-M652 PolarHBondContact O-N 3.15Å; I649-G653 PolarHBondContact O-N 2.96Å
650	G	87.1	Confident	72.5	Confident	3 Å²	3	57.4 Å²	57.4	3%	0.031	32%	0.323	C	S	.	.	H	α-helix	trans	-60.8	-48	175	0	0	0	0	0	111.8	T647 M652 G653 E654	T647-G650 PolarHBondContact O-N 3.49Å; T647-G650 PolarHBondContact OG1-N 3.27Å; T647-G650 VanDerWaalsContact OG1-N 3.16Å; G650-M652 VanDerWaalsContact C-N 3.31Å; G650-M652 PolarHBondContact O-N 2.85Å; G650-G653 PolarHBondContact O-N 3.45Å; G650-E654 PolarHBondContact O-N 2.92Å; G650-E654 VanDerWaalsContact O-N 3.14Å
651	V	86.1	Confident	69.4	Low	9 Å²	9	61.9 Å²	61.9	6%	0.055	35%	0.346	C	S	.	.	H	α-helix	trans	-57	-41.9	174.3	171.6	0	0	0	0	111.7	V640 A641 E646 T647 F655	V640-V651 HydrophobicContact CG1-CG1 3.86Å; V640-V651 HydrophobicContact CG1-CG2 4.45Å; A641-V651 HydrophobicContact CB-CG2 3.94Å; E646-V651 HydrophobicContact CB-CG2 4.08Å; T647-V651 PolarHBondContact O-N 3.02Å; V651-F655 HydrophobicContact CG1-CD2 4.22Å; V651-F655 HydrophobicContact CG1-CE2 3.61Å; V651-F655 WeakPolarHBondContact O-CD2 3.38Å
652	M	71.9	Confident	66.3	Low	25 Å²	25	64.1 Å²	64.1	12%	0.123	36%	0.362	C	S	.	.	H	α-helix	trans	-62.5	-43.2	172.7	-77	-142.6	76.5	0	0	113	A489 R496 P648 I649 G650 E654 F655 D656	A489-M652 HydrophobicContact CB-CB 4.46Å; R496-M652 PolarHBondContact NH1-SD 3.34Å; P648-M652 WeakPolarHBondContact O-CG 3.28Å; P648-M652 PolarHBondContact O-N 3.39Å; I649-M652 WeakPolarHBondContact O-CB 3.29Å; I649-M652 PolarHBondContact O-N 3.15Å; G650-M652 VanDerWaalsContact C-N 3.31Å; G650-M652 PolarHBondContact O-N 2.85Å; M652-E654 VanDerWaalsContact C-N 3.29Å; M652-E654 PolarHBondContact O-N 2.96Å; M652-F655 PolarHBondContact O-N 2.87Å; M652-F655 VanDerWaalsContact O-N 3.09Å; M652-D656 PolarHBondContact O-N 2.8Å
653	G	62.6	Low	63.4	Low	7 Å²	7	65.9 Å²	65.9	7%	0.072	38%	0.375	C	S	.	.	H	α-helix	trans	-62.4	-32.7	-178.3	0	0	0	0	0	113.5	I649 G650 N657	I649-G653 PolarHBondContact O-N 2.96Å; G650-G653 PolarHBondContact O-N 3.45Å; G653-N657 PolarHBondContact O-N 3.13Å; G653-N657 PolarHBondContact O-ND2 3.24Å
654	E	58.5	Low	60.6	Low	126 Å²	126	67.3 Å²	67.3	59%	0.589	39%	0.386	S	S	*	.	H	α-helix	trans	-70	-33.2	173.1	-62.8	-140.8	139.7	0	0	112.7	G650 M652 N657 L658	G650-E654 PolarHBondContact O-N 2.92Å; G650-E654 VanDerWaalsContact O-N 3.14Å; M652-E654 VanDerWaalsContact C-N 3.29Å; M652-E654 PolarHBondContact O-N 2.96Å; E654-N657 PolarHBondContact O-N 2.7Å; E654-L658 PolarHBondContact O-N 3.12Å
655	F	51.7	Low	57.8	Low	64 Å²	64	67.6 Å²	67.6	28%	0.281	39%	0.391	S	S	.	.	H	α-helix	trans	-72.1	-33.3	179.7	-70.7	-55.1	0	0	0	114.1	V651 M652 L658 H659	V651-F655 HydrophobicContact CG1-CD2 4.22Å; V651-F655 HydrophobicContact CG1-CE2 3.61Å; V651-F655 WeakPolarHBondContact O-CD2 3.38Å; M652-F655 PolarHBondContact O-N 2.87Å; M652-F655 VanDerWaalsContact O-N 3.09Å; F655-L658 HydrophobicContact CD1-CD2 4.27Å; F655-L658 WeakPolarHBondContact O-CB 3.37Å; F655-L658 PolarHBondContact O-N 2.8Å; F655-H659 PolarHBondContact O-N 3.39Å
656	D	44.4	Very low	55.2	Low	84 Å²	84	70.6 Å²	70.6	45%	0.449	39%	0.388	S	S	.	.	H	α-helix	trans	-69.1	-35.1	171.8	-85.2	-22.1	0	0	0	111.6	M652 L658 H659 T660	M652-D656 PolarHBondContact O-N 2.8Å; D656-L658 VanDerWaalsContact C-N 3.3Å; D656-L658 PolarHBondContact O-N 3.12Å; D656-H659 WeakPolarHBondContact O-CB 3.44Å; D656-H659 PolarHBondContact O-N 2.77Å; D656-T660 PolarHBondContact O-N 2.75Å
657	N	36.3	Very low	52.5	Low	87 Å²	87	74 Å²	74	47%	0.465	41%	0.409	S	S	.	.	H	α-helix	trans	-64.2	-36.2	168.7	-76.6	-70.6	0	0	0	111.7	G653 E654 H659 T660 L661	G653-N657 PolarHBondContact O-N 3.13Å; G653-N657 PolarHBondContact O-ND2 3.24Å; E654-N657 PolarHBondContact O-N 2.7Å; N657-H659 VanDerWaalsContact C-N 3.3Å; N657-H659 PolarHBondContact O-N 3.29Å; N657-T660 WeakPolarHBondContact O-CA 3.06Å; N657-T660 WeakPolarHBondContact O-CB 3.25Å; N657-T660 PolarHBondContact O-N 3.25Å; N657-L661 PolarHBondContact O-N 3.02Å
658	L	35.4	Very low	50	Low	91 Å²	91	81.9 Å²	81.9	48%	0.476	44%	0.442	S	S	.	.	H	α-helix	trans	-63.4	-34.6	173.8	-157.9	75.8	0	0	0	111.9	E654 F655 D656 T660 L661 S662	E654-L658 PolarHBondContact O-N 3.12Å; F655-L658 HydrophobicContact CD1-CD2 4.27Å; F655-L658 WeakPolarHBondContact O-CB 3.37Å; F655-L658 PolarHBondContact O-N 2.8Å; D656-L658 VanDerWaalsContact C-N 3.3Å; D656-L658 PolarHBondContact O-N 3.12Å; L658-T660 PolarHBondContact O-N 2.98Å; L658-L661 PolarHBondContact O-N 3.35Å; L658-S662 WeakPolarHBondContact O-CB 3.29Å; L658-S662 PolarHBondContact O-N 2.97Å
659	H	35.4	Very low	47.1	Very low	146 Å²	146	88.7 Å²	88.7	68%	0.676	48%	0.478	S	S	*	.	H	α-helix	trans	-64.1	-26.7	170.9	-87.9	-71.2	0	0	0	113.5	F655 D656 N657	F655-H659 PolarHBondContact O-N 3.39Å; D656-H659 WeakPolarHBondContact O-CB 3.44Å; D656-H659 PolarHBondContact O-N 2.77Å; N657-H659 VanDerWaalsContact C-N 3.3Å; N657-H659 PolarHBondContact O-N 3.29Å
660	T	33.4	Very low	44.5	Very low	111 Å²	111	96 Å²	96	68%	0.681	51%	0.512	S	S	*	.	H	α-helix	trans	-81.4	-31.5	172.9	-53.8	0	0	0	0	112.6	D656 N657 L658	D656-T660 PolarHBondContact O-N 2.75Å; N657-T660 WeakPolarHBondContact O-CA 3.06Å; N657-T660 WeakPolarHBondContact O-CB 3.25Å; N657-T660 PolarHBondContact O-N 3.25Å; L658-T660 PolarHBondContact O-N 2.98Å
661	L	29.6	Very low	42	Very low	105 Å²	105	102.7 Å²	102.7	55%	0.55	55%	0.552	S	S	.	*	H	α-helix	trans	-89	-23.8	-179.2	-73.7	164.5	0	0	0	114.7	N657 L658 L663 A664 S665	N657-L661 PolarHBondContact O-N 3.02Å; L658-L661 PolarHBondContact O-N 3.35Å; L661-L663 PolarHBondContact O-N 2.9Å; L661-L663 VanDerWaalsContact O-N 3.14Å; L661-A664 PolarHBondContact O-N 3.12Å; L661-S665 PolarHBondContact O-N 3.37Å; L661-S665 PolarHBondContact O-OG 2.82Å
662	S	27.5	Very low	39.6	Very low	49 Å²	49	107.7 Å²	107.7	34%	0.343	59%	0.588	S	S	.	*	H	α-helix	trans	-61	-23.1	-176.9	-177.8	0	0	0	0	113.7	L658 A664 I666	L658-S662 WeakPolarHBondContact O-CB 3.29Å; L658-S662 PolarHBondContact O-N 2.97Å; S662-A664 PolarHBondContact O-N 3.26Å; S662-I666 WeakPolarHBondContact O-CD1 3.5Å; S662-I666 WeakPolarHBondContact O-CG1 3.37Å
663	L	32	Very low	37.8	Very low	169 Å²	169	110 Å²	110	89%	0.885	62%	0.617	S	S	*	*	H	α-helix	trans	-74.2	-4.1	171.3	-80.5	164.8	0	0	0	114.4	L661	L661-L663 PolarHBondContact O-N 2.9Å; L661-L663 VanDerWaalsContact O-N 3.14Å
664	A	32.2	Very low	36.4	Very low	86 Å²	86	117.9 Å²	117.9	71%	0.711	66%	0.655	S	S	*	*	H	α-helix	trans	-131.6	-8.1	-174.4	0	0	0	0	0	115.1	L661 S662	L661-A664 PolarHBondContact O-N 3.12Å; S662-A664 PolarHBondContact O-N 3.26Å
665	S	31.4	Very low	35.2	Very low	69 Å²	69	120.1 Å²	120.1	48%	0.483	67%	0.67	S	S	.	*	H	α-helix	trans	-120.4	-4.6	-170.7	59.5	0	0	0	0	116.4	L661 D667	L661-S665 PolarHBondContact O-N 3.37Å; L661-S665 PolarHBondContact O-OG 2.82Å; S665-D667 PolarHBondContact O-N 2.99Å
666	I	36.1	Very low	34.4	Very low	136 Å²	136	122.1 Å²	122.1	70%	0.697	69%	0.692	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.9	-24.1	-179	-73.7	173.6	0	0	0	113	S662 K668	S662-I666 WeakPolarHBondContact O-CD1 3.5Å; S662-I666 WeakPolarHBondContact O-CG1 3.37Å; I666-K668 PolarHBondContact O-N 2.97Å
667	D	33.8	Very low	33.8	Very low	157 Å²	157	125.3 Å²	125.3	84%	0.84	71%	0.709	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92.4	17.1	-160	-145.8	35.9	0	0	0	115.4	S665	S665-D667 PolarHBondContact O-N 2.99Å
668	K	38.7	Very low	33.8	Very low	185 Å²	185	129 Å²	129	80%	0.804	73%	0.728	S	S	*	*	S	Bend	trans	-141.9	-17.2	-172	-92.3	-169	176.2	178.7	0	121.5	I666	I666-K668 PolarHBondContact O-N 2.97Å
669	D	32.4	Very low	33.6	Very low	153 Å²	153	134 Å²	134	82%	0.818	75%	0.749	S	S	*	*	S	Bend	trans	-122.2	17.6	-165.1	-99.8	-27.5	0	0	0	117
670	E	37.4	Very low	33.6	Very low	155 Å²	155	136.1 Å²	136.1	72%	0.724	76%	0.759	S	S	*	*	S	Bend	trans	-119.9	70.5	169.8	-68.3	-151.9	141.1	0	0	113.2	R590	R590-E670 IonicContact CZ-OE1 2.75Å; R590-E670 IonicContact NH1-OE1 3.68Å; R590-E670 IonicContact NH2-OE1 3.33Å; R590-E670 PolarHBondContact NH2-OE1 2.82Å
671	T	34	Very low	33.4	Very low	142 Å²	142	138.1 Å²	138.1	87%	0.871	77%	0.766	S	S	*	*	S	Bend	trans	-142.1	-11.7	161.4	44.8	0	0	0	0	116.3
672	S	36.2	Very low	33.5	Very low	115 Å²	115	139 Å²	139	80%	0.804	78%	0.776	S	S	*	*	S	Bend	trans	-133.6	86.6	-175.5	58.2	0	0	0	0	112.5
673	G	34.8	Very low	33.7	Very low	72 Å²	72	145.8 Å²	145.8	74%	0.742	80%	0.802	S	S	*	*	S	Bend	trans	-173.5	-1.4	-178.6	0	0	0	0	0	118
674	M	33.9	Very low	33.6	Very low	174 Å²	174	144.9 Å²	144.9	86%	0.857	80%	0.798	S	S	*	*			trans	-136	98.3	172.8	-88.4	88.1	163.6	0	0	110
675	D	33.3	Very low	33.5	Very low	172 Å²	172	146.2 Å²	146.2	92%	0.92	80%	0.802	S	S	*	*			trans	174.2	77.5	141.2	-95.7	-7.4	0	0	0	109.9
676	S	34.5	Very low	33.3	Very low	106 Å²	106	146.8 Å²	146.8	74%	0.741	82%	0.819	S	S	*	*			trans	-159.2	153.9	158.3	65.6	0	0	0	0	109.5
677	D	32	Very low	32.8	Very low	151 Å²	151	149.1 Å²	149.1	81%	0.807	83%	0.827	S	S	*	*	S	Bend	trans	90.1	36.4	171.8	-51.1	-0.6	0	0	0	118
678	L	34.7	Very low	33	Very low	165 Å²	165	146.2 Å²	146.2	86%	0.864	82%	0.817	S	S	*	*			trans	-140.9	156.8	150.7	-76.8	-177.4	0	0	0	111.3
679	E	32.8	Very low	32.6	Very low	196 Å²	196	145.5 Å²	145.5	92%	0.916	82%	0.821	S	S	*	*			trans	71.4	84.2	172.3	-59.6	-175.3	-170.5	0	0	117.9
680	E	33.7	Very low	32.3	Very low	190 Å²	190	142.8 Å²	142.8	89%	0.888	82%	0.82	S	S	*	*			trans	-123.5	92.1	152.4	-179.7	177.7	-139	0	0	108.9
681	D	30.5	Very low	31.9	Very low	153 Å²	153	145.2 Å²	145.2	82%	0.818	83%	0.828	S	S	*	*			trans	-175.7	158.4	149.2	-117.7	-31.2	0	0	0	113.9
682	T	32.3	Very low	31.5	Very low	123 Å²	123	149.8 Å²	149.8	76%	0.755	83%	0.829	S	S	*	*			trans	71.7	92.2	166.7	56.1	0	0	0	0	122.3
683	E	31.6	Very low	31	Very low	192 Å²	192	153 Å²	153	90%	0.897	83%	0.832	S	S	*	*				46.6	110.4	126.1	-58.7	-170.5	142.2	0	0	124.1
684	D	29.5	Very low	30.5	Very low	151 Å²	151	156.9 Å²	156.9	81%	0.807	83%	0.828	S	S	*	*			trans	31.7	112.5	131.1	-170.2	31.3	0	0	0	122.3
685	S	30.5	Very low	30.2	Very low	114 Å²	114	154.1 Å²	154.1	80%	0.797	82%	0.823	S	S	*	*				173.1	131.2	125.6	-82.8	0	0	0	0	114.6
686	G	26.8	Very low	29.9	Very low	81 Å²	81	153 Å²	153	84%	0.835	81%	0.813	S	S	*	*			trans	104.8	106.9	145.7	0	0	0	0	0	120.2
687	E	25.9	Very low	29.6	Very low	185 Å²	185	156.5 Å²	156.5	86%	0.864	82%	0.817	S	S	*	*			trans	-82.6	173.9	159	-113.2	-163.6	157.3	0	0	111.7
688	P	37.6	Very low	29.4	Very low	96 Å²	96	158.2 Å²	158.2	62%	0.623	82%	0.82	S	S	*	*			cis	-139.3	170.2	-11.3	36	-16.4	0	0	0	116.9
689	L	29.5	Very low	29.1	Very low	169 Å²	169	156.7 Å²	156.7	89%	0.885	82%	0.817	S	S	*	*			trans	46.9	111.9	143.3	-70.3	166.5	0	0	0	122.2
690	A	25.9	Very low	28.9	Very low	97 Å²	97	154.5 Å²	154.5	80%	0.802	81%	0.81	S	S	*	*			trans	-153.1	121.3	138.1	0	0	0	0	0	114
691	K	29	Very low	28.6	Very low	206 Å²	206	154 Å²	154	90%	0.896	81%	0.808	S	S	*	*			trans	33	107.1	155.5	-62.7	-177.5	177.6	-176.4	0	119.5
692	R	25.6	Very low	28.4	Very low	238 Å²	238	153 Å²	153	90%	0.898	81%	0.807	S	S	*	*			trans	-99.7	114.3	161.5	-176.1	-179.3	-170.4	167.1	4.5	109.8
693	E	25.9	Very low	28.2	Very low	182 Å²	182	154 Å²	154	85%	0.85	81%	0.806	S	S	*	*			trans	-91.2	144.6	164.1	-70.8	-175.8	157.8	0	0	109.7
694	K	25.3	Very low	28	Very low	154 Å²	154	154 Å²	154	67%	0.67	81%	0.806	S	S	*	*			trans	-108.5	134.9	170.4	-76.1	-172.2	-177.5	-176.4	0	109.3	E696	K694-E696 HydrophobicContact CB-CG 4.33Å; K694-E696 HydrophobicContact CD-CG 3.99Å; K694-E696 WeakPolarHBondContact CD-OE1 3.32Å; K694-E696 IonicContact NZ-OE1 2.73Å; K694-E696 PolarHBondContact NZ-OE1 2.89Å
695	P	27.6	Very low	28.1	Very low	116 Å²	116	152.8 Å²	152.8	75%	0.753	80%	0.804	S	S	*	*			trans	-82.2	134	141.8	32.6	-27.1	0	0	0	109.2
696	E	26.5	Very low	28.1	Very low	149 Å²	149	150.6 Å²	150.6	70%	0.696	80%	0.799	S	S	*	*			trans	-103.2	134.1	172.2	-63.3	-172.3	144.4	0	0	109.1	K694	K694-E696 HydrophobicContact CB-CG 4.33Å; K694-E696 HydrophobicContact CD-CG 3.99Å; K694-E696 WeakPolarHBondContact CD-OE1 3.32Å; K694-E696 IonicContact NZ-OE1 2.73Å; K694-E696 PolarHBondContact NZ-OE1 2.89Å
697	H	28.6	Very low	28.1	Very low	178 Å²	178	151.6 Å²	151.6	82%	0.824	80%	0.8	S	S	*	*			trans	-110.4	104.2	173.2	-93.1	-85	0	0	0	108.8
698	E	27.7	Very low	28.3	Very low	187 Å²	187	150.8 Å²	150.8	87%	0.874	80%	0.8	S	S	*	*			trans	-71	131.7	165.7	-73.5	-174.4	119.3	0	0	109.9
699	V	29	Very low	28.4	Very low	134 Å²	134	155.9 Å²	155.9	81%	0.812	82%	0.816	S	S	*	*			trans	-101.4	119.5	173.5	177.5	0	0	0	0	108.6	Q701	V699-Q701 PolarHBondContact O-N 3.45Å
700	I	28.3	Very low	28.4	Very low	149 Å²	149	155 Å²	155	76%	0.764	81%	0.812	S	S	*	*			trans	-85	110.8	179.3	-59.8	174.5	0	0	0	109.1
701	Q	26.5	Very low	29.1	Very low	181 Å²	181	154.3 Å²	154.3	85%	0.846	81%	0.814	S	S	*	*			trans	-71.4	130.1	168.4	-85.3	-173.3	-27.3	0	0	110.9	V699	V699-Q701 PolarHBondContact O-N 3.45Å
702	V	27.1	Very low	29.3	Very low	130 Å²	130	149.4 Å²	149.4	79%	0.788	81%	0.806	S	S	*	*			trans	-108.4	116.1	173.8	179.5	0	0	0	0	109
703	I	28.8	Very low	29.5	Very low	145 Å²	145	147.1 Å²	147.1	74%	0.744	81%	0.805	S	S	*	*			trans	-87.8	120.3	174.7	-60.7	175.4	0	0	0	108.8	V705	I703-V705 HydrophobicContact CG2-CG2 4.14Å
704	Q	26.5	Very low	29.9	Very low	192 Å²	192	144.3 Å²	144.3	90%	0.897	80%	0.803	S	S	*	*			trans	-90	121.8	176.3	-171.2	166.5	-8.5	0	0	110.6
705	V	30.7	Very low	30.1	Very low	125 Å²	125	143.8 Å²	143.8	76%	0.758	81%	0.813	S	S	*	*			trans	-115.5	142.9	177.7	-176.5	0	0	0	0	109.4	I703	I703-V705 HydrophobicContact CG2-CG2 4.14Å
706	G	30.6	Very low	30.2	Very low	68 Å²	68	144.8 Å²	144.8	70%	0.701	82%	0.816	S	S	*	*			trans	-67.6	158.8	-175.6	0	0	0	0	0	114.5
707	A	28.1	Very low	30.3	Very low	103 Å²	103	141 Å²	141	85%	0.851	82%	0.817	S	S	*	*			trans	-70.9	143.3	-178	0	0	0	0	0	113.2
708	L	30.4	Very low	30.1	Very low	167 Å²	167	138.9 Å²	138.9	87%	0.874	82%	0.817	S	S	*	*			trans	-115.5	146.2	156.1	-109.9	75.6	0	0	0	108.7	D710	L708-D710 PolarHBondContact O-N 3.44Å; L708-D710 VanDerWaalsContact O-N 3.12Å
709	E	38	Very low	30.2	Very low	203 Å²	203	136.3 Å²	136.3	95%	0.949	81%	0.813	S	S	*	*	S	Bend	trans	-80.6	81.7	174.4	-65.2	-174.6	126	0	0	111.4
710	D	29.9	Very low	30	Very low	150 Å²	150	138.7 Å²	138.7	80%	0.802	82%	0.816	S	S	*	*	S	Bend	trans	-154.9	144.2	145.6	-137.8	-25.5	0	0	0	112.4	L708 S712	L708-D710 PolarHBondContact O-N 3.44Å; L708-D710 VanDerWaalsContact O-N 3.12Å; D710-S712 PolarHBondContact O-N 2.79Å
711	G	40.9	Very low	29.9	Very low	83 Å²	83	140.3 Å²	140.3	86%	0.856	82%	0.819	S	S	*	*			trans	-79.4	70.5	-160.9	0	0	0	0	0	115.8
712	S	32.9	Very low	29.9	Very low	104 Å²	104	136.7 Å²	136.7	73%	0.727	81%	0.814	S	S	*	*			trans	-142.2	143.7	176	59.2	0	0	0	0	113.8	D710	D710-S712 PolarHBondContact O-N 2.79Å
713	H	30.8	Very low	30	Very low	189 Å²	189	135.8 Å²	135.8	88%	0.875	81%	0.809	S	S	*	*			trans	-88.7	137.6	-174.3	-65.7	-86.2	0	0	0	112.6
714	P	33.8	Very low	29.9	Very low	124 Å²	124	136.5 Å²	136.5	81%	0.805	81%	0.813	S	S	*	*			trans	-77.2	143.3	170.9	31.7	-33.8	0	0	0	111.9
715	V	29.7	Very low	29.9	Very low	143 Å²	143	135.8 Å²	135.8	87%	0.867	81%	0.809	S	S	*	*			trans	-104.3	137.4	174.9	176.2	0	0	0	0	109.6
716	V	29.3	Very low	29.7	Very low	136 Å²	136	134.6 Å²	134.6	82%	0.824	81%	0.807	S	S	*	*			trans	-92.9	136.1	178.8	-178.8	0	0	0	0	110.5
717	G	27.6	Very low	29.5	Very low	70 Å²	70	138.6 Å²	138.6	72%	0.722	81%	0.811	S	S	*	*			trans	-129.5	139.9	171.7	0	0	0	0	0	111.1
718	V	26.1	Very low	29.4	Very low	134 Å²	134	142.2 Å²	142.2	81%	0.812	81%	0.811	S	S	*	*			trans	-107.9	137.4	-177.7	179.7	0	0	0	0	110
719	V	28.4	Very low	29.2	Very low	133 Å²	133	142.6 Å²	142.6	81%	0.806	81%	0.808	S	S	*	*			trans	-130.5	120.2	175.4	-178.6	0	0	0	0	108.9
720	Q	25	Very low	29.2	Very low	184 Å²	184	138.4 Å²	138.4	86%	0.86	80%	0.798	S	S	*	*			trans	-76.5	149.9	172.7	-85.6	-177.6	-33.3	0	0	111.4
721	H	26.6	Very low	29	Very low	182 Å²	182	137.9 Å²	137.9	84%	0.843	80%	0.795	S	S	*	*			trans	-132.1	111.6	-179.5	-153.9	-81.1	0	0	0	113.7
722	S	25.7	Very low	28.4	Very low	105 Å²	105	141.2 Å²	141.2	73%	0.734	79%	0.788	S	S	*	*			trans	-144.8	142.5	150.9	56.2	0	0	0	0	105.8
723	V	29.2	Very low	28.1	Very low	112 Å²	112	141.4 Å²	141.4	68%	0.679	78%	0.781	S	S	*	*				-167.2	161.2	69.8	152.2	0	0	0	0	110
724	L	26.7	Very low	28	Very low	160 Å²	160	140.1 Å²	140.1	84%	0.838	78%	0.775	S	S	*	*			trans	83.6	125.1	162.6	-90	164.4	0	0	0	120.9
725	H	26.9	Very low	27.8	Very low	176 Å²	176	139.1 Å²	139.1	82%	0.815	77%	0.767	S	S	*	*			trans	-66.6	158.7	160	-64.9	-118.2	0	0	0	112
726	S	27.3	Very low	27.8	Very low	101 Å²	101	139.9 Å²	139.9	71%	0.706	76%	0.761	S	S	*	*				179.1	144.5	113.3	54.9	0	0	0	0	113.5
727	L	26.8	Very low	27.8	Very low	151 Å²	151	140.1 Å²	140.1	79%	0.791	75%	0.753	S	S	*	*			trans	62.2	118.6	161.4	-59.3	160	0	0	0	116.4
728	Q	26.2	Very low	27.8	Very low	180 Å²	180	143.1 Å²	143.1	84%	0.841	75%	0.751	S	S	*	*				90.7	128.2	50.6	-165.1	168.1	10.7	0	0	113.5
729	Q	25.7	Very low	27.9	Very low	175 Å²	175	144.5 Å²	144.5	82%	0.818	75%	0.753	S	S	*	*			trans	-59.5	168	-175.4	-90.2	177.8	-12.1	0	0	115.2
730	P	37.4	Very low	27.9	Very low	115 Å²	115	144.1 Å²	144.1	75%	0.747	75%	0.751	S	S	*	*			cis	-145.5	-161.5	37.1	43.8	-22.4	0	0	0	118
731	L	26.2	Very low	28.8	Very low	138 Å²	138	141.2 Å²	141.2	72%	0.723	75%	0.748	S	S	*	*			trans	-62	176.7	175.7	-50.2	82	0	0	0	112
732	Q	28.8	Very low	28.8	Very low	153 Å²	153	137.8 Å²	137.8	72%	0.715	74%	0.744	S	S	*	*			cis	-173.5	180	41.4	-141.1	179.8	-75.6	0	0	112.3
733	D	26.6	Very low	29.1	Very low	108 Å²	108	137.5 Å²	137.5	58%	0.578	75%	0.749	S	S	*	*			trans	72.4	122.1	153.7	-70.2	5.9	0	0	0	123.2
734	H	28.9	Very low	29	Very low	163 Å²	163	136.1 Å²	136.1	76%	0.755	76%	0.757	S	S	*	*				52	149.7	125.8	-65	-52.8	0	0	0	123.2
735	T	28.2	Very low	29.2	Very low	103 Å²	103	135.1 Å²	135.1	63%	0.632	76%	0.758	S	S	*	*			cis	-163.9	169.5	-33.7	-40.9	0	0	0	0	106
736	E	29.4	Very low	29.9	Very low	158 Å²	158	131.7 Å²	131.7	74%	0.738	75%	0.751	S	S	*	*			trans	68.5	158.4	162.3	-64.6	-176.6	-161.5	0	0	116.6
737	H	29.8	Very low	30	Very low	142 Å²	142	132.4 Å²	132.4	66%	0.657	75%	0.751	S	S	*	*			cis	-156.7	149.2	-19.2	-114.8	-29.3	0	0	0	111.2
738	I	28	Very low	30	Very low	133 Å²	133	132.2 Å²	132.2	68%	0.682	75%	0.749	S	S	*	*			trans	40.5	120.1	147.6	-33.7	156.9	0	0	0	119.8
739	L	28.3	Very low	30	Very low	163 Å²	163	134.1 Å²	134.1	85%	0.853	75%	0.749	S	S	*	*				168.7	128	114.4	-89.4	172.5	0	0	0	114.4
740	T	28.8	Very low	30	Very low	125 Å²	125	134 Å²	134	77%	0.767	75%	0.748	S	S	*	*			trans	-99.1	-179.2	153.2	54.8	0	0	0	0	107.9
741	P	43.9	Very low	29.3	Very low	122 Å²	122	134.5 Å²	134.5	79%	0.792	75%	0.752	S	S	*	*			cis	-142.3	-156.1	12	45.5	-25.1	0	0	0	115.3
742	S	27	Very low	29.3	Very low	110 Å²	110	132.8 Å²	132.8	77%	0.769	75%	0.752	S	S	*	*			trans	110.8	94.3	169.5	-163.3	0	0	0	0	113.1
743	A	30.5	Very low	29.3	Very low	100 Å²	100	131.4 Å²	131.4	83%	0.826	75%	0.754	S	S	*	*				72.8	116.7	69.5	0	0	0	0	0	113.6
744	G	28.6	Very low	29.4	Very low	82 Å²	82	132.9 Å²	132.9	85%	0.845	77%	0.768	S	S	*	*			trans	169.8	65.4	-176.5	0	0	0	0	0	116.4
745	T	29.3	Very low	29.4	Very low	140 Å²	140	128.7 Å²	128.7	86%	0.859	77%	0.768	S	S	*	*			trans	-76.5	166.5	154.9	28	0	0	0	0	109.8
746	P	41.8	Very low	29.4	Very low	103 Å²	103	131.3 Å²	131.3	67%	0.669	78%	0.778	S	S	*	*			cis	-149.2	-174	32.5	40	-17	0	0	0	118.2
747	T	29	Very low	29.4	Very low	117 Å²	117	129 Å²	129	72%	0.718	78%	0.776	S	S	*	*			trans	57.2	126	151.4	45.7	0	0	0	0	120.1
748	I	27.2	Very low	29.2	Very low	146 Å²	146	132.7 Å²	132.7	75%	0.749	79%	0.785	S	S	*	*			cis	111.8	140.4	37.3	-85.7	172.3	0	0	0	111.9
749	R	26.7	Very low	29.2	Very low	220 Å²	220	130.7 Å²	130.7	83%	0.83	79%	0.789	S	S	*	*			trans	89.3	106.8	162.8	-89.2	161.3	-173.4	178.3	2.5	121.4
750	H	25.2	Very low	29.2	Very low	174 Å²	174	127.8 Å²	127.8	81%	0.806	78%	0.782	S	S	*	*				39.4	123.9	121.7	-69.9	-94.6	0	0	0	120.2
751	C	23.4	Very low	29.2	Very low	124 Å²	124	132.4 Å²	132.4	84%	0.838	81%	0.809	S	S	*	*				-177.8	166.9	95.5	-107.5	0	0	0	0	115.8
752	S	26.4	Very low	28.4	Very low	103 Å²	103	132.9 Å²	132.9	72%	0.72	81%	0.81	S	S	*	*			trans	89.9	90.3	149.7	78.9	0	0	0	0	124.2
753	T	27.8	Very low	28.5	Very low	123 Å²	123	134.1 Å²	134.1	76%	0.755	81%	0.812	S	S	*	*				51.1	117.2	112.1	-20.8	0	0	0	0	122.4
754	T	29.7	Very low	28.4	Very low	140 Å²	140	136 Å²	136	86%	0.859	81%	0.811	S	S	*	*			trans	59.3	130.1	142.6	54.1	0	0	0	0	122.9
755	G	28.1	Very low	28.4	Very low	75 Å²	75	139.2 Å²	139.2	77%	0.773	81%	0.809	S	S	*	*			trans	-178.4	107.9	155.5	0	0	0	0	0	113.1
756	N	28.4	Very low	28.3	Very low	157 Å²	157	139.1 Å²	139.1	84%	0.84	81%	0.806	S	S	*	*			trans	-68.4	167.1	170.6	-69	-11.2	0	0	0	109.9
757	T	29.6	Very low	27.4	Very low	111 Å²	111	141.5 Å²	141.5	68%	0.681	82%	0.815	S	S	*	*			cis	-175.4	164.1	49.2	-35.1	0	0	0	0	112.5
758	Y	26.2	Very low	27.3	Very low	219 Å²	219	143.3 Å²	143.3	86%	0.859	82%	0.822	S	S	*	*			trans	91.2	134.1	154.2	-82.8	-69.5	0	0	0	121.8
759	A	26.8	Very low	27.3	Very low	91 Å²	91	143.1 Å²	143.1	75%	0.752	83%	0.828	S	S	*	*			trans	70	146.7	155.8	0	0	0	0	0	118.4
760	S	28.4	Very low	27.4	Very low	102 Å²	102	136.7 Å²	136.7	71%	0.713	83%	0.828	S	S	*	*			cis	-173.1	146.7	-18.6	50.2	0	0	0	0	110.9
761	V	28.7	Very low	27.6	Very low	221 Å²	221	133.3 Å²	133.3	100%	1.339	83%	0.83	S	S	*	*			trans	55.5	0	167.1	-173.1	0	0	0	0	115.2

Retrieved 761 of 761 residues in 567.5 ms (Link to these results)

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