A0A087XTU9_POEFO Loading...

Nuclear receptor subfamily 4, group A, member 1

AlphaFold DB , UniProt , Accession A0A087XTU9, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 567 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	29.9	Very low	32.7	Very low	228 Å²	228	154.5 Å²	154.5	100%	1.123	85%	0.849	S	S	*	*				0	80.1	0	-61.7	175.1	-175.9	0	0	106.1
2	T	31.8	Very low	32.2	Very low	126 Å²	126	155.9 Å²	155.9	77%	0.773	85%	0.853	S	S	*	*			cis	56.2	127.4	32.5	62.6	0	0	0	0	113.3
3	C	29.8	Very low	31.8	Very low	121 Å²	121	160.2 Å²	160.2	82%	0.818	85%	0.851	S	S	*	*			cis	-156.2	160	-12.1	-114.7	0	0	0	0	110.9
4	I	33.8	Very low	31.6	Very low	164 Å²	164	159.1 Å²	159.1	84%	0.841	84%	0.839	S	S	*	*			trans	-114.8	149.4	171.3	-63.8	170.9	0	0	0	107.8
5	H	30.5	Very low	31.5	Very low	185 Å²	185	157.4 Å²	157.4	86%	0.856	83%	0.83	S	S	*	*			trans	-137	124.1	178.8	-139.9	-29.6	0	0	0	111.8
6	P	49.7	Very low	31.4	Very low	108 Å²	108	153 Å²	153	70%	0.701	82%	0.816	S	S	*	*			trans	-121.4	172.3	171.2	39.1	-28.4	0	0	0	114.6
7	Q	36.3	Very low	31.2	Very low	178 Å²	178	153.9 Å²	153.9	83%	0.832	82%	0.817	S	S	*	*			trans	-52.1	159	-178	-56.1	160.1	-18.3	0	0	117.3
8	H	30.8	Very low	31	Very low	198 Å²	198	152.3 Å²	152.3	92%	0.917	82%	0.82	S	S	*	*				-174.9	159.3	130	-97.4	64.5	0	0	0	107.1
9	G	29.1	Very low	30.9	Very low	60 Å²	60	149.9 Å²	149.9	62%	0.619	82%	0.817	S	S	*	*			cis	171.2	-174.8	-3.8	0	0	0	0	0	111.6
10	S	29.1	Very low	30.8	Very low	132 Å²	132	150.2 Å²	150.2	92%	0.923	82%	0.816	S	S	*	*			trans	83.8	146.1	163.2	-52.9	0	0	0	0	121
11	Q	28.8	Very low	30.8	Very low	200 Å²	200	150.7 Å²	150.7	94%	0.935	81%	0.813	S	S	*	*			trans	-115.2	174.2	176.9	-66.9	174.9	-78.1	0	0	111.2
12	L	27.4	Very low	30.7	Very low	171 Å²	171	144.6 Å²	144.6	90%	0.895	79%	0.793	S	S	*	*			trans	-100.4	160	179.8	-73.1	164.1	0	0	0	113.2
13	Y	26.4	Very low	30.6	Very low	212 Å²	212	147.9 Å²	147.9	83%	0.831	80%	0.8	S	S	*	*			trans	-143.5	171	161.5	-141.1	-92.7	0	0	0	110.4
14	E	29.7	Very low	30.5	Very low	145 Å²	145	145.5 Å²	145.5	68%	0.678	80%	0.795	S	S	*	*			trans	-65.7	174.9	-171.5	-45.4	176.4	122.4	0	0	114.2
15	N	29.7	Very low	30.4	Very low	133 Å²	133	142 Å²	142	71%	0.711	79%	0.791	S	S	*	*			cis	-169.4	170.3	28.1	-147.3	-43.8	0	0	0	113.8
16	S	29.3	Very low	30.3	Very low	87 Å²	87	139.6 Å²	139.6	61%	0.608	79%	0.785	S	S	*	*			trans	85.5	136.2	145.8	-152.1	0	0	0	0	124.3
17	M	28.4	Very low	29.3	Very low	169 Å²	169	140.8 Å²	140.8	83%	0.833	78%	0.783	S	S	*	*			trans	52.8	123.4	150.1	-74.5	166.9	65.1	0	0	122.4
18	S	28.2	Very low	29	Very low	125 Å²	125	137.7 Å²	137.7	87%	0.874	78%	0.777	S	S	*	*				-176.8	174.3	86.1	40.8	0	0	0	0	112.3
19	S	28.7	Very low	28.9	Very low	107 Å²	107	133.2 Å²	133.2	75%	0.748	77%	0.768	S	S	*	*			trans	-120.7	153.7	-168.4	-179.4	0	0	0	0	112.8
20	L	28.9	Very low	28.8	Very low	155 Å²	155	142.2 Å²	142.2	81%	0.812	78%	0.783	S	S	*	*			trans	-158.6	163	138.1	-137.6	70.9	0	0	0	113.3
21	E	30.5	Very low	28.9	Very low	161 Å²	161	143.5 Å²	143.5	75%	0.752	78%	0.779	S	S	*	*			trans	-79.9	172.5	-174.3	-57	132.6	107.4	0	0	112.6
22	S	28.6	Very low	28.7	Very low	100 Å²	100	140.2 Å²	140.2	70%	0.699	77%	0.768	S	S	*	*			cis	-178.1	160.5	49.1	41.2	0	0	0	0	114.2
23	Q	30.1	Very low	28.7	Very low	195 Å²	195	139 Å²	139	91%	0.911	76%	0.759	S	S	*	*			trans	27.3	137.3	144.4	-55	168.9	23.4	0	0	120.1
24	G	27.6	Very low	28.8	Very low	70 Å²	70	133.1 Å²	133.1	72%	0.722	75%	0.749	S	S	*	*			cis	140.2	135.4	-1.5	0	0	0	0	0	112.6
25	A	29.9	Very low	28.8	Very low	91 Å²	91	131.6 Å²	131.6	75%	0.752	75%	0.754	S	S	*	*			trans	64.4	157.3	173.8	0	0	0	0	0	116.9
26	D	28.8	Very low	29.6	Very low	135 Å²	135	130.5 Å²	130.5	72%	0.722	76%	0.755	S	S	*	*			cis	-161.8	149.6	-19.8	-109.8	-19.9	0	0	0	112.9
27	I	29.6	Very low	29.6	Very low	132 Å²	132	134 Å²	134	68%	0.677	76%	0.761	S	S	*	*			trans	62.4	149.9	135.4	-63	167.8	0	0	0	122.9
28	T	28.9	Very low	29.7	Very low	113 Å²	113	133.3 Å²	133.3	69%	0.693	76%	0.756	S	S	*	*			trans	79	102.5	161.3	35.8	0	0	0	0	122.9
29	S	29.3	Very low	29.7	Very low	104 Å²	104	134.6 Å²	134.6	73%	0.727	75%	0.752	S	S	*	*				16.9	137.7	124.3	62	0	0	0	0	121.6
30	W	27.6	Very low	29.7	Very low	249 Å²	249	134.3 Å²	134.3	94%	0.943	75%	0.75	S	S	*	*			trans	-131.5	141.2	152	-86.5	76	0	0	0	111.7
31	L	29.6	Very low	29.6	Very low	159 Å²	159	130.9 Å²	130.9	83%	0.832	74%	0.744	S	S	*	*			trans	-105.9	146.4	168.6	-84.3	164	0	0	0	109.5
32	D	26.6	Very low	29.5	Very low	132 Å²	132	128.9 Å²	128.9	71%	0.706	75%	0.748	S	S	*	*			trans	32	141.9	140.6	-161.6	15	0	0	0	121.5
33	M	26	Very low	29.5	Very low	145 Å²	145	129.4 Å²	129.4	71%	0.714	75%	0.752	S	S	*	*			trans	178	120.8	132.3	-96.1	-58.7	99.9	0	0	114.4
34	S	28.7	Very low	29.7	Very low	88 Å²	88	128 Å²	128	62%	0.615	75%	0.749	S	S	*	*			trans	60.8	112.2	136.7	-62.5	0	0	0	0	123.1
35	S	29.7	Very low	30.3	Very low	113 Å²	113	130.7 Å²	130.7	79%	0.79	75%	0.754	S	S	*	*				33.5	159.8	97.7	-56.2	0	0	0	0	120.9
36	P	47.4	Very low	30.2	Very low	111 Å²	111	131.6 Å²	131.6	72%	0.721	76%	0.755	S	S	*	*			cis	-143.2	177.9	18.2	33.2	-9.4	0	0	0	117.8
37	Q	28.2	Very low	30.5	Very low	159 Å²	159	132.3 Å²	132.3	74%	0.743	77%	0.765	S	S	*	*				157.9	127.1	115.9	-82.8	-162.2	4.9	0	0	115.2
38	H	30.9	Very low	30.5	Very low	155 Å²	155	130.5 Å²	130.5	72%	0.718	77%	0.769	S	S	*	*			trans	55.3	141.9	142.2	-66.4	-57.1	0	0	0	121.5
39	L	28.1	Very low	30.6	Very low	152 Å²	152	134 Å²	134	80%	0.796	78%	0.778	S	S	*	*			cis	-152.8	170.8	16.1	-110.6	147.4	0	0	0	113.3
40	S	28.1	Very low	30.6	Very low	102 Å²	102	135 Å²	135	71%	0.713	78%	0.779	S	S	*	*			trans	-62.7	171.9	174.2	47.7	0	0	0	0	116.9
41	A	28.2	Very low	30.6	Very low	83 Å²	83	130.4 Å²	130.4	69%	0.686	77%	0.772	S	S	*	*			cis	-179.8	-175.5	-19.2	0	0	0	0	0	109.9
42	S	28.5	Very low	30.4	Very low	118 Å²	118	131.2 Å²	131.2	83%	0.825	77%	0.772	S	S	*	*			trans	66.4	154.6	165.8	35.1	0	0	0	0	118.3
43	S	28.4	Very low	30.5	Very low	112 Å²	112	129 Å²	129	78%	0.783	77%	0.772	S	S	*	*			cis	-162.6	167.5	-8.9	44.6	0	0	0	0	112.1
44	L	33.9	Very low	31	Very low	164 Å²	164	127.8 Å²	127.8	86%	0.859	78%	0.775	S	S	*	*			trans	-65.9	166.9	169	-74.7	163.9	0	0	0	113.4
45	P	39.4	Very low	30.9	Very low	127 Å²	127	127.1 Å²	127.1	83%	0.825	77%	0.774	S	S	*	*				-135.2	176.5	120.7	39.8	-30.8	0	0	0	114.9
46	S	28.3	Very low	30.7	Very low	111 Å²	111	130 Å²	130	78%	0.776	78%	0.775	S	S	*	*			trans	-143.7	149.1	179.4	168.9	0	0	0	0	110.3
47	T	35.8	Very low	29.8	Very low	149 Å²	149	132.1 Å²	132.1	91%	0.914	78%	0.78	S	S	*	*			trans	-174.1	169.6	151.8	10.8	0	0	0	0	111.2
48	A	29.6	Very low	29.7	Very low	94 Å²	94	135.6 Å²	135.6	78%	0.777	79%	0.788	S	S	*	*			trans	-142.8	157.7	-170.9	0	0	0	0	0	114.1
49	Q	30.4	Very low	29.6	Very low	188 Å²	188	136 Å²	136	88%	0.879	79%	0.791	S	S	*	*			trans	-162.9	119.7	162.4	-100	158	9.3	0	0	106.2
50	V	29	Very low	29.5	Very low	124 Å²	124	133.2 Å²	133.2	75%	0.752	79%	0.789	S	S	*	*				68.3	101.4	64.4	-176.4	0	0	0	0	113.7
51	L	27.3	Very low	29.5	Very low	152 Å²	152	138.1 Å²	138.1	80%	0.796	79%	0.794	S	S	*	*				-179.5	136.2	122	-115	111	0	0	0	113.2
52	H	26.7	Very low	29.3	Very low	177 Å²	177	139.4 Å²	139.4	82%	0.819	80%	0.798	S	S	*	*			trans	38.9	133.3	151.4	-78.5	-101.5	0	0	0	124.2
53	A	27.5	Very low	29.1	Very low	85 Å²	85	139 Å²	139	70%	0.702	79%	0.794	S	S	*	*			trans	-87.1	173.9	155.4	0	0	0	0	0	111.2
54	P	36.8	Very low	29	Very low	120 Å²	120	142.3 Å²	142.3	78%	0.779	80%	0.797	S	S	*	*				-151.6	171.6	86.5	42.4	-25.8	0	0	0	117.7
55	A	25.9	Very low	28.5	Very low	73 Å²	73	144.1 Å²	144.1	60%	0.603	80%	0.798	S	S	*	*			trans	74.5	137.6	144.2	0	0	0	0	0	122.6
56	E	26.5	Very low	27.9	Very low	175 Å²	175	144.5 Å²	144.5	82%	0.818	80%	0.798	S	S	*	*			trans	59.4	138.7	149.3	-70.6	135	-140.9	0	0	119.4
57	D	28.6	Very low	27.7	Very low	154 Å²	154	146.2 Å²	146.2	82%	0.824	80%	0.804	S	S	*	*			cis	-133.6	162.9	10	-102.5	-44.7	0	0	0	113.2
58	Y	26.6	Very low	27.4	Very low	232 Å²	232	143.7 Å²	143.7	91%	0.91	80%	0.798	S	S	*	*			trans	-132.2	97.1	177.9	-131.2	-82.4	0	0	0	110.5	A60	Y58-A60 PolarHBondContact O-N 3.43Å
59	E	28.6	Very low	27.7	Very low	165 Å²	165	145.2 Å²	145.2	77%	0.771	80%	0.8	S	S	*	*			trans	-81.1	114.4	177.1	-111.6	-166.6	171.6	0	0	111.8
60	A	25.3	Very low	27.4	Very low	92 Å²	92	141 Å²	141	76%	0.76	80%	0.798	S	S	*	*			trans	-96	111.5	178	0	0	0	0	0	111.6	Y58 S62	Y58-A60 PolarHBondContact O-N 3.43Å; A60-S62 PolarHBondContact O-N 3.01Å
61	Y	28.1	Very low	27.4	Very low	206 Å²	206	141.8 Å²	141.8	81%	0.808	80%	0.802	S	S	*	*			trans	-85.3	105.5	171.3	-89	-91.9	0	0	0	111.3
62	S	24.9	Very low	27.3	Very low	110 Å²	110	140.9 Å²	140.9	77%	0.769	80%	0.803	S	S	*	*			trans	-84.4	128.5	-179	-171.8	0	0	0	0	112.2	A60	A60-S62 PolarHBondContact O-N 3.01Å
63	C	23.1	Very low	27.2	Very low	110 Å²	110	137.9 Å²	137.9	74%	0.743	80%	0.802	S	S	*	*			trans	-67.2	140.2	171.2	-66.9	0	0	0	0	111.6
64	Q	25.9	Very low	27.5	Very low	181 Å²	181	140.1 Å²	140.1	85%	0.846	81%	0.81	S	S	*	*			trans	-119	119	168.2	-66.9	-173.9	0.9	0	0	109.5
65	F	24.5	Very low	26.9	Very low	202 Å²	202	139.1 Å²	139.1	89%	0.886	81%	0.806	S	S	*	*			trans	-94.8	132.8	168	-83.4	-91.7	0	0	0	109.6
66	T	27.2	Very low	26.9	Very low	134 Å²	134	143.7 Å²	143.7	82%	0.822	81%	0.814	S	S	*	*			trans	-118.6	128.5	172.5	49.8	0	0	0	0	110.4
67	T	24.5	Very low	26.8	Very low	148 Å²	148	144.8 Å²	144.8	91%	0.908	82%	0.819	S	S	*	*			trans	-91.2	151.7	-178	44.8	0	0	0	0	112.5
68	A	28.2	Very low	26.6	Very low	95 Å²	95	146.4 Å²	146.4	79%	0.785	82%	0.822	S	S	*	*			trans	-144.3	150.8	170.5	0	0	0	0	0	109.8
69	P	36.3	Very low	26.5	Very low	126 Å²	126	139.1 Å²	139.1	82%	0.818	82%	0.817	S	S	*	*			trans	-91.3	165.6	-159.8	35.6	-37.5	0	0	0	115.4
70	A	24	Very low	26.3	Very low	101 Å²	101	140 Å²	140	84%	0.835	82%	0.821	S	S	*	*			trans	-76.2	157.5	175.6	0	0	0	0	0	113.5
71	V	29.2	Very low	26.2	Very low	140 Å²	140	146 Å²	146	85%	0.848	83%	0.825	S	S	*	*			trans	-135.4	145.4	171.5	179.5	0	0	0	0	109.2
72	T	25.3	Very low	26	Very low	133 Å²	133	143.2 Å²	143.2	82%	0.816	83%	0.825	S	S	*	*			trans	-84.2	153.9	-170	42.6	0	0	0	0	115.6
73	S	24.9	Very low	26.3	Very low	114 Å²	114	147 Å²	147	80%	0.797	83%	0.833	S	S	*	*			trans	-68.7	163.4	171.3	-37.5	0	0	0	0	113.8
74	P	32.8	Very low	26.7	Very low	132 Å²	132	150.6 Å²	150.6	86%	0.857	84%	0.838	S	S	*	*				-127.6	-172.7	124.7	37.7	-30.9	0	0	0	112.6
75	S	25.2	Very low	26.8	Very low	99 Å²	99	148.4 Å²	148.4	69%	0.692	83%	0.833	S	S	*	*			trans	-132.4	170.1	-152.7	53.7	0	0	0	0	116.5
76	H	25.8	Very low	27	Very low	169 Å²	169	146 Å²	146	78%	0.782	83%	0.828	S	S	*	*			trans	62.5	122.1	166.8	-66.4	-80.4	0	0	0	120.4
77	Q	24.8	Very low	27	Very low	197 Å²	197	147.7 Å²	147.7	92%	0.921	83%	0.827	S	S	*	*				-157.6	155.2	100.8	-108.9	179.1	-3.3	0	0	111.6
78	E	23.8	Very low	27.5	Very low	189 Å²	189	146.1 Å²	146.1	88%	0.883	81%	0.812	S	S	*	*			trans	-88.6	152.5	-179	-67.5	168	104.1	0	0	112
79	G	24.7	Very low	27.6	Very low	78 Å²	78	147.6 Å²	147.6	80%	0.804	80%	0.798	S	S	*	*			trans	-157.3	79.2	-176.4	0	0	0	0	0	112.7	Y81	G79-Y81 PolarHBondContact O-N 2.93Å
80	Q	23	Very low	27.3	Very low	185 Å²	185	145 Å²	145	86%	0.864	79%	0.794	S	S	*	*			trans	-63.7	120.6	176.2	172.4	-170	9	0	0	112.2
81	Y	24.3	Very low	27.5	Very low	216 Å²	216	146.2 Å²	146.2	85%	0.847	80%	0.795	S	S	*	*			trans	-163.5	136.7	152.1	-103.9	-63.4	0	0	0	114.6	G79	G79-Y81 PolarHBondContact O-N 2.93Å
82	N	24.4	Very low	27.6	Very low	148 Å²	148	146.6 Å²	146.6	79%	0.791	78%	0.782	S	S	*	*			trans	28.7	133	163.7	-73.8	-2	0	0	0	122.7
83	M	31.3	Very low	28	Very low	190 Å²	190	146.2 Å²	146.2	94%	0.936	78%	0.782	S	S	*	*			trans	-113.8	90	173	176.2	179.5	66.9	0	0	109.9
84	E	31.8	Very low	28.2	Very low	185 Å²	185	143.6 Å²	143.6	86%	0.864	77%	0.773	S	S	*	*			trans	-157.7	68.4	176.1	-145.8	169.5	-147.4	0	0	112.5
85	D	26.2	Very low	28.2	Very low	136 Å²	136	142.8 Å²	142.8	73%	0.727	77%	0.768	S	S	*	*			trans	-158.1	95.3	168.9	-139.3	-11.9	0	0	0	111.8	Q87	D85-Q87 PolarHBondContact O-N 3.45Å
86	L	29.7	Very low	28.4	Very low	151 Å²	151	146 Å²	146	79%	0.791	78%	0.776	S	S	*	*			trans	-86.9	84.6	179	-110.7	88.3	0	0	0	111.6	I88	L86-I88 HydrophobicContact CD2-CD1 4.21Å; L86-I88 HydrophobicContact CD2-CG1 4.3Å; L86-I88 PolarHBondContact O-N 3Å
87	Q	27.9	Very low	28.4	Very low	169 Å²	169	146.5 Å²	146.5	79%	0.79	78%	0.781	S	S	*	*			trans	-76.5	85.6	169.3	-67	-171.2	3.4	0	0	111.3	D85 Y89	D85-Q87 PolarHBondContact O-N 3.45Å; Q87-Y89 PolarHBondContact O-N 3.5Å
88	I	33.6	Very low	28.5	Very low	116 Å²	116	143.8 Å²	143.8	60%	0.595	77%	0.772	S	S	*	*			trans	-80.9	90.2	172.7	-54.3	178	0	0	0	109.4	L86	L86-I88 HydrophobicContact CD2-CD1 4.21Å; L86-I88 HydrophobicContact CD2-CG1 4.3Å; L86-I88 PolarHBondContact O-N 3Å
89	Y	31.8	Very low	28.6	Very low	126 Å²	126	142.2 Å²	142.2	49%	0.494	77%	0.77	S	S	.	*			trans	-150.9	134.3	164.4	-109.1	-80	0	0	0	112.6	Q87 E494 N498	Q87-Y89 PolarHBondContact O-N 3.5Å; Y89-E494 HydrophobicContact CE1-CG 4.43Å; Y89-N498 PolarHBondContact OH-ND2 3.06Å; Y89-N498 PolarHBondContact OH-OD1 3.33Å; Y89-N498 VanDerWaalsContact OH-OD1 3.12Å
90	G	28.6	Very low	28.7	Very low	72 Å²	72	147.8 Å²	147.8	74%	0.742	77%	0.768	S	S	*	*			trans	54.9	88	154.7	0	0	0	0	0	119.3
91	C	27.7	Very low	29.1	Very low	126 Å²	126	145 Å²	145	85%	0.851	77%	0.766	S	S	*	*			trans	-136	90.2	161.3	-80.6	0	0	0	0	111.2
92	Y	32	Very low	29.1	Very low	147 Å²	147	137.6 Å²	137.6	58%	0.576	76%	0.755	S	S	*	*			trans	-96.9	125.6	154.7	-73	-85.7	0	0	0	107.6	D483 R484	Y92-D483 PolarHBondContact OH-O 3.24Å; Y92-R484 WeakPolarHBondContact OH-CD 3.24Å; Y92-R484 PolarHBondContact OH-NH1 3.41Å
93	P	34.1	Very low	29.4	Very low	126 Å²	126	139.7 Å²	139.7	82%	0.818	76%	0.76	S	S	*	*			trans	-76.7	134.2	177.3	29.8	-32.4	0	0	0	111.6
94	G	28.7	Very low	29.3	Very low	59 Å²	59	134.8 Å²	134.8	61%	0.608	75%	0.75	S	S	*	*			trans	-77.9	175.2	163.5	0	0	0	0	0	112.3
95	P	33.5	Very low	29.2	Very low	115 Å²	115	135 Å²	135	75%	0.747	75%	0.754	S	S	*	*			trans	-67.1	142.9	-159	24.8	-35.3	0	0	0	114.7	M97	P95-M97 PolarHBondContact O-N 2.83Å
96	L	27.9	Very low	29.3	Very low	165 Å²	165	134.1 Å²	134.1	86%	0.864	76%	0.758	S	S	*	*			trans	-77.2	112.7	178	-68	173.6	0	0	0	111.4	L98	L96-L98 PolarHBondContact O-N 3.48Å
97	M	25.9	Very low	30.2	Very low	180 Å²	180	132.6 Å²	132.6	89%	0.887	76%	0.757	S	S	*	*			trans	-72.1	110.2	162.2	-82.2	-74.6	147.9	0	0	109.6	P95 N99	P95-M97 PolarHBondContact O-N 2.83Å; M97-N99 PolarHBondContact O-N 3.32Å
98	L	27.6	Very low	30.3	Very low	140 Å²	140	130.6 Å²	130.6	73%	0.733	76%	0.762	S	S	*	*			trans	-81.2	96.9	-178.1	-162.6	82.8	0	0	0	111.1	L96 Y100	L96-L98 PolarHBondContact O-N 3.48Å; L98-Y100 HydrophobicContact CD2-CD2 4.22Å; L98-Y100 HydrophobicContact CD2-CE2 3.99Å; L98-Y100 PolarHBondContact O-N 2.67Å; L98-Y100 VanDerWaalsContact O-N 3.15Å
99	N	26.1	Very low	30	Very low	156 Å²	156	128.7 Å²	128.7	83%	0.834	77%	0.771	S	S	*	*			trans	-70.5	105.5	169.6	-93.7	-1.3	0	0	0	110.6	M97 P101	M97-N99 PolarHBondContact O-N 3.32Å; N99-P101 WeakPolarHBondContact O-CD 3.45Å
100	Y	25.7	Very low	30	Very low	196 Å²	196	127.6 Å²	127.6	77%	0.769	78%	0.782	S	S	*	*			trans	-71.4	129.7	163.5	-99.9	-92.7	0	0	0	110.9	L98	L98-Y100 HydrophobicContact CD2-CD2 4.22Å; L98-Y100 HydrophobicContact CD2-CE2 3.99Å; L98-Y100 PolarHBondContact O-N 2.67Å; L98-Y100 VanDerWaalsContact O-N 3.15Å
101	P	31.4	Very low	30.2	Very low	126 Å²	126	130.5 Å²	130.5	82%	0.818	78%	0.78	S	S	*	*			trans	-83.9	119.3	141.8	32.6	-25	0	0	0	107.9	N99	N99-P101 WeakPolarHBondContact O-CD 3.45Å
102	G	25.8	Very low	30.4	Very low	61 Å²	61	134 Å²	134	63%	0.629	78%	0.777	S	S	*	*			trans	-128.7	135.7	173.7	0	0	0	0	0	110.7
103	E	29.3	Very low	30.4	Very low	191 Å²	191	137.3 Å²	137.3	89%	0.893	79%	0.79	S	S	*	*			trans	-173.5	129.3	135.2	-106.7	175.5	167.7	0	0	112.2
104	A	29.3	Very low	30.1	Very low	88 Å²	88	134.8 Å²	134.8	73%	0.727	79%	0.787	S	S	*	*			trans	64.6	141.2	139	0	0	0	0	0	119.9
105	M	29.5	Very low	30.3	Very low	189 Å²	189	137.7 Å²	137.7	93%	0.931	80%	0.798	S	S	*	*			cis	-140.4	177.6	10.5	-86.5	-154.1	149.7	0	0	113.8
106	S	29.8	Very low	31.1	Very low	117 Å²	117	138.2 Å²	138.2	82%	0.818	80%	0.801	S	S	*	*			trans	-73.5	170.6	-175.2	-53.3	0	0	0	0	116.2
107	P	48.6	Very low	31.5	Very low	119 Å²	119	134.3 Å²	134.3	77%	0.773	79%	0.793	S	S	*	*			trans	-104.8	164.5	-162.7	40.1	-35.6	0	0	0	116.3
108	S	28.5	Very low	31.8	Very low	128 Å²	128	132.6 Å²	132.6	90%	0.895	79%	0.792	S	S	*	*			trans	-171.8	147.2	160	-81.7	0	0	0	0	113.3
109	G	28.7	Very low	31.9	Very low	75 Å²	75	130.2 Å²	130.2	77%	0.773	79%	0.793	S	S	*	*			trans	71.1	135.1	161.2	0	0	0	0	0	117.6
110	S	31.4	Very low	32.1	Very low	104 Å²	104	128.2 Å²	128.2	73%	0.727	79%	0.791	S	S	*	*			cis	102	104.1	33.3	178.3	0	0	0	0	112.9
111	D	32.2	Very low	32.5	Very low	133 Å²	133	124 Å²	124	71%	0.711	79%	0.79	S	S	*	*			trans	73.7	127.8	144.1	-60.4	-66.8	0	0	0	125
112	Y	31.8	Very low	33.2	Very low	198 Å²	198	124.4 Å²	124.4	78%	0.776	79%	0.793	S	S	*	*			trans	80.9	124	137.7	-94.1	-120.6	0	0	0	123.9
113	Y	32.9	Very low	33.5	Very low	218 Å²	218	126.1 Å²	126.1	86%	0.855	80%	0.795	S	S	*	*			trans	75.8	129.3	144.4	-100.5	-118.9	0	0	0	123.2
114	G	28.6	Very low	33.7	Very low	73 Å²	73	123.5 Å²	123.5	75%	0.753	79%	0.793	S	S	*	*				118.1	98.2	126.6	0	0	0	0	0	119.8
115	S	32.9	Very low	34.4	Very low	120 Å²	120	125.3 Å²	125.3	84%	0.839	80%	0.797	S	S	*	*			trans	-88.7	154.3	153.9	-49.3	0	0	0	0	109.8
116	P	50.1	Low	34.5	Very low	126 Å²	126	119.4 Å²	119.4	82%	0.818	79%	0.785	S	S	*	*				-158.1	153.5	85.7	40.7	-20.5	0	0	0	119.8
117	A	34.8	Very low	34.5	Very low	83 Å²	83	123.8 Å²	123.8	69%	0.686	79%	0.789	S	S	*	*			trans	65.5	127.9	132.4	0	0	0	0	0	126.2
118	T	32.5	Very low	33.6	Very low	143 Å²	143	126.2 Å²	126.2	88%	0.877	79%	0.79	S	S	*	*			trans	83.8	139.7	130.5	49.9	0	0	0	0	125.9
119	A	30.9	Very low	33.5	Very low	91 Å²	91	125.6 Å²	125.6	75%	0.752	79%	0.786	S	S	*	*			trans	115.7	87.3	136.6	0	0	0	0	0	122.5
120	S	29.3	Very low	33.5	Very low	113 Å²	113	130.6 Å²	130.6	79%	0.79	79%	0.789	S	S	*	*				39	130.3	127.4	60	0	0	0	0	126.6
121	S	33.3	Very low	34.1	Very low	108 Å²	108	131 Å²	131	76%	0.755	79%	0.789	S	S	*	*			trans	3.9	158.5	144.3	-40.9	0	0	0	0	124.8
122	P	47.6	Very low	33.8	Very low	134 Å²	134	128.7 Å²	128.7	87%	0.87	79%	0.789	S	S	*	*				-143.4	-167.8	106.8	40.1	-25.2	0	0	0	116.2
123	S	31.4	Very low	33.7	Very low	97 Å²	97	123.8 Å²	123.8	68%	0.678	78%	0.784	S	S	*	*			trans	-147.2	163.9	-153.9	-42.9	0	0	0	0	118.4
124	T	32.9	Very low	33.4	Very low	137 Å²	137	119.7 Å²	119.7	84%	0.84	78%	0.776	S	S	*	*			trans	65.9	166	154.9	51.9	0	0	0	0	120
125	P	45.6	Very low	33.5	Very low	126 Å²	126	127.4 Å²	127.4	82%	0.818	78%	0.783	S	S	*	*			cis	-118.7	-167.3	-7.7	42.4	-29.2	0	0	0	112.8
126	G	29.8	Very low	33.1	Very low	65 Å²	65	128.8 Å²	128.8	67%	0.67	78%	0.781	S	S	*	*			cis	127.5	109	-12	0	0	0	0	0	116.5
127	F	29.8	Very low	32.2	Very low	208 Å²	208	128 Å²	128	91%	0.912	78%	0.779	S	S	*	*			trans	-155.3	169	163.9	-131	-90.1	0	0	0	113.8
128	Q	29.9	Very low	31.9	Very low	170 Å²	170	130.5 Å²	130.5	79%	0.794	79%	0.785	S	S	*	*			trans	-89.2	174.2	-170.2	-64.3	170.6	-26.5	0	0	113.5
129	S	27.3	Very low	31.8	Very low	115 Å²	115	134 Å²	134	80%	0.804	79%	0.789	S	S	*	*			cis	-153.7	161.7	23.9	58.1	0	0	0	0	115.9
130	Q	27.6	Very low	31.6	Very low	180 Å²	180	133.2 Å²	133.2	84%	0.841	79%	0.789	S	S	*	*			trans	-82.9	-176.7	170.2	-104.5	-160.6	12.8	0	0	112.8
131	P	45.7	Very low	31.5	Very low	113 Å²	113	133.7 Å²	133.7	73%	0.734	79%	0.787	S	S	*	*			cis	-111.1	-159.5	-0.3	44	-32.3	0	0	0	111.4
132	A	25.3	Very low	31.2	Very low	85 Å²	85	139.2 Å²	139.2	70%	0.702	79%	0.793	S	S	*	*			cis	-160	166.9	8	0	0	0	0	0	109.3
133	S	28.7	Very low	30.2	Very low	95 Å²	95	138 Å²	138	66%	0.664	79%	0.788	S	S	*	*			cis	-177.5	145.6	-31.1	58.4	0	0	0	0	109.6
134	N	27.8	Very low	30	Very low	132 Å²	132	137.4 Å²	137.4	71%	0.706	79%	0.789	S	S	*	*			trans	66.7	138.9	162.1	-67.5	-0.4	0	0	0	118.6
135	W	30.2	Very low	29.6	Very low	234 Å²	234	136.5 Å²	136.5	89%	0.886	79%	0.788	S	S	*	*			cis	-136.6	153.7	-6.3	-99.8	107.1	0	0	0	108.8
136	D	25.6	Very low	29.4	Very low	149 Å²	149	135.7 Å²	135.7	80%	0.797	78%	0.783	S	S	*	*			trans	-121.1	167.1	-169.9	-141	-29.5	0	0	0	113.7
137	S	30.8	Very low	29.2	Very low	110 Å²	110	141.5 Å²	141.5	77%	0.769	79%	0.793	S	S	*	*			trans	-89.3	144.4	179.6	-61.6	0	0	0	0	112.8
138	V	27	Very low	29	Very low	136 Å²	136	136.9 Å²	136.9	82%	0.824	79%	0.785	S	S	*	*			trans	-141.7	126.8	165.8	-177	0	0	0	0	111.7
139	F	31.6	Very low	28.9	Very low	217 Å²	217	139.1 Å²	139.1	95%	0.952	79%	0.786	S	S	*	*			trans	-105.3	145.4	153.3	-105.4	-90.3	0	0	0	107.7
140	G	26	Very low	28.8	Very low	73 Å²	73	141 Å²	141	75%	0.753	78%	0.784	S	S	*	*			trans	-171.8	134	175.8	0	0	0	0	0	114
141	T	28.5	Very low	28.9	Very low	124 Å²	124	136.7 Å²	136.7	76%	0.761	78%	0.78	S	S	*	*			trans	-117.8	154.8	-178.1	-30.1	0	0	0	0	110.1
142	Y	26.8	Very low	28	Very low	223 Å²	223	141 Å²	141	88%	0.875	79%	0.787	S	S	*	*			trans	164.4	-178.9	134.9	-96.3	-71.1	0	0	0	112.7
143	S	26.3	Very low	28.2	Very low	110 Å²	110	144 Å²	144	77%	0.769	79%	0.791	S	S	*	*			trans	-154.7	161.8	-153	-59.7	0	0	0	0	112.1
144	A	27.2	Very low	28.3	Very low	84 Å²	84	146.9 Å²	146.9	69%	0.694	80%	0.797	S	S	*	*			cis	-173.4	178.5	-18	0	0	0	0	0	109.4
145	S	24.9	Very low	28.4	Very low	117 Å²	117	146.1 Å²	146.1	82%	0.818	80%	0.802	S	S	*	*			trans	69.4	166.3	168.6	-62.1	0	0	0	0	116.4
146	P	40.7	Very low	28.3	Very low	110 Å²	110	138.3 Å²	138.3	71%	0.714	79%	0.794	S	S	*	*			cis	-130.1	168.2	4.2	41.7	-25.8	0	0	0	117.8
147	E	26.4	Very low	29.7	Very low	187 Å²	187	136.8 Å²	136.8	87%	0.874	79%	0.792	S	S	*	*			trans	48.7	138.3	145.6	-67.1	177.5	169.2	0	0	124.5
148	C	24.8	Very low	29.7	Very low	111 Å²	111	139.5 Å²	139.5	75%	0.75	80%	0.798	S	S	*	*				146.2	89.4	116.8	-170.2	0	0	0	0	118
149	W	26.6	Very low	29.9	Very low	217 Å²	217	137.6 Å²	137.6	82%	0.822	80%	0.797	S	S	*	*			trans	61.1	142	137.9	-66.9	94.8	0	0	0	126.1
150	M	26	Very low	29.9	Very low	153 Å²	153	132.6 Å²	132.6	75%	0.754	79%	0.789	S	S	*	*			trans	83.9	97.3	148.8	-71	-65.4	-179.3	0	0	124.8
151	A	29.3	Very low	30.2	Very low	91 Å²	91	134.8 Å²	134.8	75%	0.752	79%	0.788	S	S	*	*				33.5	144.3	119.7	0	0	0	0	0	124.7
152	K	27.5	Very low	30.5	Very low	204 Å²	204	136.5 Å²	136.5	89%	0.887	79%	0.792	S	S	*	*			trans	-160.1	139.7	152.2	-155.7	163.1	-172.6	170.1	0	113.8
153	D	30	Very low	31	Very low	148 Å²	148	135.1 Å²	135.1	79%	0.791	79%	0.791	S	S	*	*			trans	-121.6	175.8	-177.1	-81.3	-61.5	0	0	0	113.9
154	I	30.6	Very low	32.1	Very low	154 Å²	154	135.2 Å²	135.2	79%	0.79	79%	0.788	S	S	*	*			trans	132	106.8	137.4	-67.2	172.2	0	0	0	118.3
155	S	30.5	Very low	32.4	Very low	117 Å²	117	141 Å²	141	82%	0.818	80%	0.798	S	S	*	*			trans	74.9	149.3	142.9	74.8	0	0	0	0	125.2
156	G	26.2	Very low	32.6	Very low	69 Å²	69	138.2 Å²	138.2	71%	0.711	79%	0.788	S	S	*	*			trans	-102.8	-130	166.4	0	0	0	0	0	112
157	P	55.9	Low	32.1	Very low	117 Å²	117	139.5 Å²	139.5	76%	0.76	80%	0.8	S	S	*	*			cis	-138.2	-174.7	-0.6	44.7	-27.7	0	0	0	115.3
158	N	29.9	Very low	32.1	Very low	167 Å²	167	134.2 Å²	134.2	89%	0.893	80%	0.795	S	S	*	*			trans	173	165.6	136.2	-92.9	-28	0	0	0	113.4
159	A	33.1	Very low	33.6	Very low	97 Å²	97	134.7 Å²	134.7	80%	0.802	80%	0.797	S	S	*	*			trans	-152.1	159.6	-170.6	0	0	0	0	0	115.7
160	S	30.4	Very low	33.7	Very low	111 Å²	111	130.2 Å²	130.2	78%	0.776	79%	0.794	S	S	*	*			trans	-179.4	159.7	165.4	-78.7	0	0	0	0	110.9
161	T	33.2	Very low	34	Very low	120 Å²	120	131 Å²	131	74%	0.736	80%	0.796	S	S	*	*			cis	-171.1	167.7	-29.2	35	0	0	0	0	109.9
162	L	34	Very low	34	Very low	160 Å²	160	133.6 Å²	133.6	84%	0.838	80%	0.797	S	S	*	*			trans	94.6	155.8	161.3	-53.9	-177.1	0	0	0	119.8
163	F	37.3	Very low	34.4	Very low	194 Å²	194	129 Å²	129	85%	0.851	79%	0.785	S	S	*	*			trans	-153.2	169.6	-147.2	-94.7	-69.8	0	0	0	109.9
164	P	50.1	Low	34.9	Very low	111 Å²	111	127.8 Å²	127.8	72%	0.721	79%	0.786	S	S	*	*				-154.7	173.4	55.9	37.9	-13	0	0	0	121.5
165	F	34	Very low	34.9	Very low	205 Å²	205	128.1 Å²	128.1	90%	0.899	78%	0.784	S	S	*	*			trans	-4.5	155.6	160.1	-61.8	-86.9	0	0	0	122.8
166	G	28.2	Very low	34.8	Very low	60 Å²	60	132.1 Å²	132.1	62%	0.619	79%	0.787	S	S	*	*			cis	158.3	-178.4	-4.7	0	0	0	0	0	115.7
167	S	30.5	Very low	34.8	Very low	136 Å²	136	132.6 Å²	132.6	95%	0.951	79%	0.791	S	S	*	*			trans	66.9	140.4	163.7	65.9	0	0	0	0	122.7
168	G	26.4	Very low	33.5	Very low	76 Å²	76	133.5 Å²	133.5	78%	0.784	80%	0.795	S	S	*	*			trans	130.8	129	157.4	0	0	0	0	0	117.4
169	P	55.5	Low	33.3	Very low	122 Å²	122	131.6 Å²	131.6	79%	0.792	79%	0.794	S	S	*	*			trans	-127.3	-170.4	179.4	37.7	-20.3	0	0	0	115.9
170	V	30.3	Very low	33	Very low	123 Å²	123	133.9 Å²	133.9	75%	0.745	79%	0.793	S	S	*	*			trans	109.7	148.2	162.2	-174.4	0	0	0	0	117.3
171	E	32	Very low	32.8	Very low	170 Å²	170	135.3 Å²	135.3	79%	0.794	79%	0.791	S	S	*	*			trans	-41.6	176.6	-176	-59.6	151.3	138.9	0	0	117.3
172	D	27.9	Very low	32.3	Very low	145 Å²	145	136.5 Å²	136.5	78%	0.775	79%	0.788	S	S	*	*			cis	-164.5	-171.9	27.6	-153.8	-10.5	0	0	0	113.2
173	V	36	Very low	31.9	Very low	106 Å²	106	137.2 Å²	137.2	64%	0.642	79%	0.787	S	S	*	*			trans	-75.9	167.7	-179.9	-145.1	0	0	0	0	114.1
174	P	41.3	Very low	31.3	Very low	123 Å²	123	135.3 Å²	135.3	80%	0.799	78%	0.781	S	S	*	*				-146.8	177	107.1	39.2	-23.8	0	0	0	116.7
175	H	29.8	Very low	30.1	Very low	162 Å²	162	136.5 Å²	136.5	75%	0.75	78%	0.777	S	S	*	*			trans	-120.9	168.5	179.3	-89.3	-9.9	0	0	0	113.1
176	F	29.6	Very low	29.7	Very low	201 Å²	201	132.5 Å²	132.5	88%	0.882	76%	0.764	S	S	*	*			trans	70.8	146.8	157.4	-80.5	-69.8	0	0	0	120.6
177	G	25.6	Very low	29.7	Very low	78 Å²	78	139.8 Å²	139.8	80%	0.804	77%	0.774	S	S	*	*			trans	163.8	68.4	175.3	0	0	0	0	0	115.1
178	T	28.4	Very low	29.5	Very low	137 Å²	137	137.3 Å²	137.3	84%	0.84	76%	0.762	S	S	*	*			trans	-86	146.3	172.6	45.8	0	0	0	0	112.8
179	S	25.7	Very low	29.7	Very low	126 Å²	126	141.8 Å²	141.8	88%	0.881	77%	0.767	S	S	*	*			trans	-147.5	171.2	159.5	-161	0	0	0	0	111.3
180	L	26.1	Very low	28.2	Very low	146 Å²	146	139.8 Å²	139.8	76%	0.764	76%	0.761	S	S	*	*			trans	-149.7	161.1	-155.2	-124.4	171.4	0	0	0	111.6
181	L	26.8	Very low	28.2	Very low	141 Å²	141	142.7 Å²	142.7	74%	0.738	77%	0.766	S	S	*	*			trans	72.5	154.1	168.3	-57.6	-176.8	0	0	0	116.3
182	Q	23.9	Very low	29.1	Very low	145 Å²	145	140 Å²	140	68%	0.678	76%	0.763	S	S	*	*			cis	-170.1	-173.7	-14.4	172.1	169.4	-12.6	0	0	109.2
183	E	24	Very low	29.1	Very low	175 Å²	175	139.7 Å²	139.7	82%	0.818	76%	0.761	S	S	*	*			trans	82.2	138.7	167.4	-59.5	-167.8	109.3	0	0	117.7
184	Q	24.6	Very low	28.9	Very low	153 Å²	153	142.8 Å²	142.8	72%	0.715	77%	0.768	S	S	*	*			cis	85.9	121.1	-1.8	-146	159.4	16	0	0	116.8
185	E	26	Very low	28.3	Very low	137 Å²	137	142.2 Å²	142.2	64%	0.64	77%	0.767	S	S	*	*			cis	-169.5	-179	-4	-135.8	-175.7	116.8	0	0	113.8
186	L	25.5	Very low	28.3	Very low	121 Å²	121	137.6 Å²	137.6	63%	0.634	76%	0.763	S	S	*	*			trans	72.9	124.4	148.7	-68.1	160.1	0	0	0	124.3
187	Y	28.1	Very low	28.3	Very low	212 Å²	212	136.3 Å²	136.3	83%	0.831	77%	0.765	S	S	*	*			trans	79.8	134	138.9	-86.9	-58.6	0	0	0	126.6
188	A	26.9	Very low	28.4	Very low	85 Å²	85	139 Å²	139	70%	0.702	77%	0.765	S	S	*	*			trans	69.5	141	150.2	0	0	0	0	0	118.6
189	L	28.8	Very low	28.7	Very low	170 Å²	170	141.9 Å²	141.9	89%	0.89	77%	0.767	S	S	*	*			cis	-153.1	-175	2.3	-108	163.1	0	0	0	107.1
190	A	25.2	Very low	29.5	Very low	79 Å²	79	141.8 Å²	141.8	65%	0.653	76%	0.763	S	S	*	*			cis	-150.7	-143.2	17.6	0	0	0	0	0	113.4
191	H	30	Very low	29.7	Very low	185 Å²	185	141.5 Å²	141.5	86%	0.856	77%	0.768	S	S	*	*			trans	-143.8	179.1	-178.4	-91.6	-48.8	0	0	0	109.7
192	P	50.9	Low	29.8	Very low	112 Å²	112	139.4 Å²	139.4	73%	0.727	77%	0.77	S	S	*	*			cis	-134.6	-167.1	21.7	33.9	-7.7	0	0	0	114
193	L	27	Very low	30.1	Very low	140 Å²	140	139.2 Å²	139.2	73%	0.733	78%	0.779	S	S	*	*			cis	-147	146.6	23.6	-92.6	168.9	0	0	0	114.1
194	Q	33	Very low	30.2	Very low	171 Å²	171	142.6 Å²	142.6	80%	0.799	78%	0.784	S	S	*	*			trans	24.4	142	141.4	-70.1	173.1	-11.4	0	0	121.8
195	S	28.6	Very low	30.4	Very low	111 Å²	111	143.1 Å²	143.1	78%	0.776	79%	0.787	S	S	*	*			cis	-158.7	-176.5	9.6	-101.7	0	0	0	0	109.7
196	G	28.7	Very low	31.7	Very low	64 Å²	64	142.3 Å²	142.3	66%	0.66	79%	0.793	S	S	*	*			cis	106.8	134.4	13.4	0	0	0	0	0	111.9
197	L	30.1	Very low	31.7	Very low	175 Å²	175	140.1 Å²	140.1	92%	0.916	80%	0.8	S	S	*	*			cis	-146.3	-148.9	5.6	-68.4	173	0	0	0	111.5
198	T	27.7	Very low	31.8	Very low	134 Å²	134	140.9 Å²	140.9	82%	0.822	81%	0.808	S	S	*	*			trans	-141.5	-178.9	-168.4	41.1	0	0	0	0	116.1
199	F	35	Very low	31.8	Very low	197 Å²	197	140.3 Å²	140.3	86%	0.864	81%	0.81	S	S	*	*			trans	-36.6	162.5	178.5	-71.1	-89.9	0	0	0	119.3
200	P	41.8	Very low	31.9	Very low	125 Å²	125	139.6 Å²	139.6	81%	0.812	81%	0.806	S	S	*	*				-145.4	175.6	117.3	40	-26.2	0	0	0	117.4
201	T	30.9	Very low	32.1	Very low	140 Å²	140	144.2 Å²	144.2	86%	0.859	81%	0.814	S	S	*	*			trans	-89.9	164.3	-178.6	-40	0	0	0	0	113.8
202	A	28.6	Very low	32.1	Very low	96 Å²	96	138.2 Å²	138.2	79%	0.793	80%	0.803	S	S	*	*			trans	-144.5	163.7	169.6	0	0	0	0	0	113.5
203	V	30.4	Very low	31.3	Very low	142 Å²	142	140.1 Å²	140.1	86%	0.861	81%	0.812	S	S	*	*			trans	-138.3	141.7	-170.7	171.4	0	0	0	0	111.4
204	R	27.2	Very low	31.6	Very low	246 Å²	246	142.1 Å²	142.1	93%	0.928	82%	0.818	S	S	*	*			trans	-162.6	152.3	156.4	-136.1	178.8	169.5	152.7	-1.3	115.7
205	E	27	Very low	31.6	Very low	164 Å²	164	142.6 Å²	142.6	77%	0.766	82%	0.82	S	S	*	*			trans	-123.4	-179.9	172.7	-78.2	-104	139.8	0	0	108.7
206	P	54.1	Low	32.1	Very low	120 Å²	120	145.2 Å²	145.2	78%	0.779	83%	0.825	S	S	*	*			cis	-129.2	-172.6	-34.9	33.4	-14.7	0	0	0	112.4
207	G	25.2	Very low	32.2	Very low	75 Å²	75	150.2 Å²	150.2	77%	0.773	84%	0.836	S	S	*	*			trans	-170.6	143.1	168.9	0	0	0	0	0	115.4
208	F	29.6	Very low	32.7	Very low	228 Å²	228	146.3 Å²	146.3	100%	1	83%	0.829	S	S	*	*			trans	-99.6	155	-177.6	-88.6	-106.3	0	0	0	113.5
209	G	26.9	Very low	33.1	Very low	72 Å²	72	146 Å²	146	74%	0.742	83%	0.832	S	S	*	*			trans	-165.9	146.9	166.6	0	0	0	0	0	111.7
210	L	32.2	Very low	33.8	Very low	155 Å²	155	144.5 Å²	144.5	81%	0.812	83%	0.832	S	S	*	*			trans	-139.9	165.8	-172.1	-148.4	82	0	0	0	111.8
211	H	30.1	Very low	33.4	Very low	176 Å²	176	144 Å²	144	82%	0.815	83%	0.832	S	S	*	*			trans	67.8	144.3	-176.3	-66.4	-93.4	0	0	0	116.3
212	G	30.1	Very low	33.9	Very low	60 Å²	60	142.9 Å²	142.9	62%	0.619	83%	0.827	S	S	*	*			cis	112.4	96.3	-19.5	0	0	0	0	0	117.4
213	T	32.3	Very low	34.4	Very low	152 Å²	152	148.3 Å²	148.3	93%	0.933	83%	0.833	S	S	*	*			trans	-160.7	170	158.9	10.5	0	0	0	0	111.7
214	E	35.2	Very low	35	Very low	181 Å²	181	149 Å²	149	85%	0.846	83%	0.831	S	S	*	*			trans	-111.3	154.5	-168.7	-53.9	159.6	101.7	0	0	113.6
215	Q	31.5	Very low	35.9	Very low	182 Å²	182	147 Å²	147	85%	0.85	83%	0.829	S	S	*	*			trans	-175.5	118.4	138	-101.1	172	-27	0	0	107.6
216	L	39.1	Very low	36.7	Very low	166 Å²	166	150.1 Å²	150.1	87%	0.869	83%	0.834	S	S	*	*				62.5	105.1	78.6	-67.3	179.4	0	0	0	114.4
217	D	31.3	Very low	36.4	Very low	168 Å²	168	147.3 Å²	147.3	90%	0.898	83%	0.827	S	S	*	*				-149.1	159.5	129.1	-149.8	-16.1	0	0	0	110.2
218	A	40.1	Very low	38	Very low	93 Å²	93	149.1 Å²	149.1	77%	0.769	82%	0.819	S	S	*	*			trans	-144.9	130.9	-174.2	0	0	0	0	0	112.5
219	S	36.2	Very low	39.7	Very low	127 Å²	127	145.8 Å²	145.8	89%	0.888	81%	0.806	S	S	*	*			trans	-139.2	155.1	169.7	-165.7	0	0	0	0	112.1
220	L	49.4	Very low	42.3	Very low	166 Å²	166	143.4 Å²	143.4	87%	0.869	78%	0.782	S	S	*	*			trans	-102.4	139.8	-161	-67	167.3	0	0	0	112.5
221	S	33.4	Very low	45.4	Very low	114 Å²	114	138.7 Å²	138.7	80%	0.797	76%	0.757	S	S	*	*			trans	-156.1	158.5	169.4	-89.6	0	0	0	0	110.5
222	P	42.6	Very low	48.6	Very low	117 Å²	117	130.5 Å²	130.5	76%	0.76	72%	0.719	S	S	*	*			trans	-71.1	148.5	-150.1	24.1	-34.3	0	0	0	115.2	L224	P222-L224 PolarHBondContact O-N 3.41Å
223	K	39.5	Very low	51.7	Low	210 Å²	210	130 Å²	130	91%	0.913	71%	0.71	S	S	*	*			trans	-70.4	82.5	-179.9	-70.3	179.7	177.6	174.2	0	112.5	K225	K223-K225 PolarHBondContact O-N 2.67Å
224	L	42.3	Very low	54.9	Low	156 Å²	156	122.8 Å²	122.8	82%	0.817	67%	0.665	S	S	*	*			trans	-56.6	134.9	143.8	-101.4	67.6	0	0	0	108	P222 R226	P222-L224 PolarHBondContact O-N 3.41Å; L224-R226 PolarHBondContact O-N 3.05Å; L224-R226 VanDerWaalsContact O-N 3.12Å
225	K	45.6	Very low	57.8	Low	206 Å²	206	114.4 Å²	114.4	90%	0.896	63%	0.627	S	S	*	*			trans	-64.8	113.9	177	-68.2	177.3	-179.6	174.5	0	108.5	K223 G227	K223-K225 PolarHBondContact O-N 2.67Å; K225-G227 PolarHBondContact O-N 3.11Å
226	R	43.1	Very low	60.9	Low	229 Å²	229	108 Å²	108	86%	0.864	61%	0.609	S	S	*	*			trans	-56.8	121	170	-67	-171.6	-177.8	-156.9	1.1	108.2	L224 N228	L224-R226 PolarHBondContact O-N 3.05Å; L224-R226 VanDerWaalsContact O-N 3.12Å; R226-N228 PolarHBondContact O-N 3.22Å
227	G	49.5	Very low	63.7	Low	61 Å²	61	101 Å²	101	63%	0.629	57%	0.573	S	S	*	*			trans	-79.2	103.4	-166.9	0	0	0	0	0	113.2	K225 E229	K225-G227 PolarHBondContact O-N 3.11Å; G227-E229 VanDerWaalsContact C-N 3.32Å; G227-E229 PolarHBondContact O-N 3.01Å
228	N	57.8	Low	66.7	Low	113 Å²	113	98.5 Å²	98.5	60%	0.604	56%	0.555	S	S	*	*			trans	40	45.6	146.8	-85.8	36.7	0	0	0	117.8	R226 G230 D231	R226-N228 PolarHBondContact O-N 3.22Å; N228-G230 PolarHBondContact O-N 3.12Å; N228-D231 HydrophobicContact CB-CB 4.18Å; N228-D231 PolarHBondContact ND2-OD2 3Å; N228-D231 PolarHBondContact O-N 3.43Å
229	E	64.8	Low	69.4	Low	158 Å²	158	94.1 Å²	94.1	74%	0.738	52%	0.519	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.9	-6.9	-176.9	-66.9	-175.3	94.3	0	0	114.7	G227 R247	G227-E229 VanDerWaalsContact C-N 3.32Å; G227-E229 PolarHBondContact O-N 3.01Å; E229-R247 PolarHBondContact O-NE 3.39Å; E229-R247 PolarHBondContact O-NH2 2.96Å; E229-R247 VanDerWaalsContact O-NH2 3.11Å
230	G	83	Confident	72	Confident	22 Å²	22	92.5 Å²	92.5	23%	0.227	51%	0.508	C	S	.	.	T	Hydrogen-bonded Turn	trans	-121.5	9.8	-179.7	0	0	0	0	0	116.5	N228 H238 A239	N228-G230 PolarHBondContact O-N 3.12Å; G230-H238 PolarHBondContact O-ND1 2.94Å; G230-A239 CarbonylContact O-C 3.57Å; G230-A239 PolarHBondContact O-N 3.47Å
231	D	95.8	Very high	73.9	Confident	56 Å²	56	87.6 Å²	87.6	30%	0.299	49%	0.487	S	S	.	.	B	Isolated β-bridge	trans	-111.1	154	-171	-83.1	6	0	0	0	115.1	N228 A233 R247	N228-D231 HydrophobicContact CB-CB 4.18Å; N228-D231 PolarHBondContact ND2-OD2 3Å; N228-D231 PolarHBondContact O-N 3.43Å; D231-A233 PolarHBondContact O-N 2.72Å; D231-R247 WeakPolarHBondContact O-CD 3.44Å
232	C	97.4	Very high	76.8	Confident	3 Å²	3	88.5 Å²	88.5	2%	0.02	48%	0.478	C	S	.	.			trans	-79.1	114.6	179.4	176	0	0	0	0	112	V234 C235 G236 D237 A239 T248 C249	C232-V234 PolarHBondContact O-N 2.72Å; C232-C235 PolarHBondContact O-N 2.89Å; C232-C235 VanDerWaalsContact SG-SG 3.61Å; C232-G236 PolarHBondContact O-N 3.42Å; C232-D237 WeakPolarHBondContact CA-O 3.36Å; C232-D237 WeakPolarHBondContact CB-O 3.39Å; C232-D237 PolarHBondContact N-O 2.85Å; C232-A239 HydrophobicContact CB-CB 3.96Å; C232-T248 VanDerWaalsContact SG-CA 3.56Å; C232-C249 HydrophobicContact CB-CB 3.99Å; C232-C249 PolarHBondContact SG-N 3.49Å; C232-C249 VanDerWaalsContact SG-N 3.36Å; C232-C249 VanDerWaalsContact SG-SG 3.67Å
233	A	96.9	Very high	79.3	Confident	50 Å²	50	84.1 Å²	84.1	41%	0.413	45%	0.448	S	S	.	.	T	Hydrogen-bonded Turn	trans	-51.7	-33.1	178.1	0	0	0	0	0	114.1	D231 V246 R247 V295	D231-A233 PolarHBondContact O-N 2.72Å; A233-V246 HydrophobicContact CB-CG1 3.88Å; A233-R247 PolarHBondContact N-O 2.91Å; A233-V295 HydrophobicContact CB-CB 4Å; A233-V295 HydrophobicContact CB-CG1 4.02Å; A233-V295 HydrophobicContact CB-CG2 4.16Å
234	V	98	Very high	81.9	Confident	0 Å²	0	76.2 Å²	76.2	0%	0	41%	0.413	C	S	.	.	T	Hydrogen-bonded Turn	trans	-71	-36.6	179	-176.6	0	0	0	0	112.9	C232 T248 C252 V276 R288 K291 V295 M297	C232-V234 PolarHBondContact O-N 2.72Å; V234-T248 HydrophobicContact CG2-CG2 3.93Å; V234-C252 HydrophobicContact CB-CB 4.35Å; V234-C252 HydrophobicContact CG1-CB 4.49Å; V234-C252 HydrophobicContact CG2-CB 4.48Å; V234-V276 HydrophobicContact CG1-CG1 4.03Å; V234-V276 WeakPolarHBondContact O-CG1 3.08Å; V234-R288 HydrophobicContact CG1-CG 4.48Å; V234-K291 VanDerWaalsContact O-CD 3.26Å; V234-K291 WeakPolarHBondContact O-CD 3.43Å; V234-K291 WeakPolarHBondContact O-CE 3.45Å; V234-K291 PolarHBondContact O-NZ 2.92Å; V234-V295 HydrophobicContact CG2-CG2 3.61Å; V234-M297 HydrophobicContact CG2-SD 3.95Å
235	C	97.2	Very high	84.2	Confident	6 Å²	6	71.3 Å²	71.3	4%	0.041	40%	0.399	C	S	.	.	T	Hydrogen-bonded Turn	trans	-149.9	4.1	-165.3	66.5	0	0	0	0	117.9	C232 D237 C249 C252 V276 D277 K278 R281	C232-C235 PolarHBondContact O-N 2.89Å; C232-C235 VanDerWaalsContact SG-SG 3.61Å; C235-D237 PolarHBondContact O-N 3.12Å; C235-C249 VanDerWaalsContact SG-SG 3.64Å; C235-C252 VanDerWaalsContact SG-SG 3.61Å; C235-V276 HydrophobicContact CB-CG1 4.19Å; C235-D277 CarbonylContact O-C 3.58Å; C235-K278 PolarHBondContact O-N 2.65Å; C235-R281 HydrophobicContact CB-CB 4.37Å; C235-R281 PolarHBondContact SG-NH1 3.28Å
236	G	96.1	Very high	86.6	Confident	46 Å²	46	62.3 Å²	62.3	47%	0.474	36%	0.361	S	S	.	.	S	Bend	trans	65.3	24	179.6	0	0	0	0	0	114.4	C232	C232-G236 PolarHBondContact O-N 3.42Å
237	D	96.7	Very high	89.1	Confident	21 Å²	21	55.6 Å²	55.6	11%	0.112	34%	0.336	C	S	.	.			trans	-94.8	153.1	169.4	-166.3	10	0	0	0	109.9	C232 C235 A239 C249 K278 R281	C232-D237 WeakPolarHBondContact CA-O 3.36Å; C232-D237 WeakPolarHBondContact CB-O 3.39Å; C232-D237 PolarHBondContact N-O 2.85Å; C235-D237 PolarHBondContact O-N 3.12Å; D237-A239 PolarHBondContact O-N 2.98Å; D237-C249 HydrophobicContact CB-CB 4.08Å; D237-K278 HydrophobicContact CB-CB 4.17Å; D237-K278 HydrophobicContact CB-CD 3.99Å; D237-K278 HydrophobicContact CB-CG 3.97Å; D237-K278 VanDerWaalsContact OD1-CD 3.28Å; D237-K278 WeakPolarHBondContact OD1-CD 3.29Å; D237-K278 WeakPolarHBondContact OD1-CE 3.37Å; D237-K278 IonicContact OD1-NZ 3.57Å; D237-K278 PolarHBondContact OD1-NZ 3.26Å; D237-R281 VanDerWaalsContact CB-NH1 3.33Å; D237-R281 IonicContact OD2-CZ 2.84Å; D237-R281 IonicContact OD2-NH1 3.76Å; D237-R281 PolarHBondContact OD2-NH1 3.04Å; D237-R281 IonicContact OD2-NH2 3.65Å; D237-R281 PolarHBondContact OD2-NH2 2.9Å
238	H	96.2	Very high	91.4	Very high	114 Å²	114	52.7 Å²	52.7	53%	0.528	31%	0.306	S	S	.	.	B	Isolated β-bridge	trans	-60.4	138.4	-175.1	-175.9	63.9	0	0	0	111.8	G230 S240 C249	G230-H238 PolarHBondContact O-ND1 2.94Å; H238-S240 PolarHBondContact NE2-OG 3.13Å; H238-C249 WeakPolarHBondContact O-CB 3.42Å
239	A	95.8	Very high	93.3	Very high	2 Å²	2	47.5 Å²	47.5	2%	0.017	28%	0.279	C	S	.	.			trans	-143.5	91	-170.7	0	0	0	0	0	110.8	G230 C232 D237 C241 R247 T248	G230-A239 CarbonylContact O-C 3.57Å; G230-A239 PolarHBondContact O-N 3.47Å; C232-A239 HydrophobicContact CB-CB 3.96Å; D237-A239 PolarHBondContact O-N 2.98Å; A239-C241 VanDerWaalsContact C-N 3.28Å; A239-C241 PolarHBondContact O-N 3.28Å; A239-R247 HydrophobicContact CB-CG 3.71Å; A239-R247 WeakPolarHBondContact O-CD 3.48Å; A239-R247 WeakPolarHBondContact O-CG 3.5Å; A239-R247 PolarHBondContact O-NH1 3.41Å; A239-T248 WeakPolarHBondContact CB-O 3.47Å
240	S	90.3	Very high	94.8	Very high	92 Å²	92	45.5 Å²	45.5	64%	0.643	27%	0.269	S	S	*	.	S	Bend	trans	-64.7	-28.8	-174.7	-40.2	0	0	0	0	113.5	H238 R247	H238-S240 PolarHBondContact NE2-OG 3.13Å; S240-R247 VanDerWaalsContact C-NH1 3.25Å; S240-R247 PolarHBondContact O-NH1 3Å
241	C	89.5	Confident	95.5	Very high	63 Å²	63	45.9 Å²	45.9	43%	0.426	27%	0.273	S	S	.	.	S	Bend	trans	-144.5	-175.2	-179.5	66	0	0	0	0	113.4	A239 H243 T248	A239-C241 VanDerWaalsContact C-N 3.28Å; A239-C241 PolarHBondContact O-N 3.28Å; C241-H243 PolarHBondContact SG-CE1 3.32Å; C241-T248 PolarHBondContact O-N 3.16Å
242	Q	94.4	Very high	95.6	Very high	134 Å²	134	43.2 Å²	43.2	63%	0.626	26%	0.259	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-89.1	147.1	175.3	-64.2	179.9	-7.3	0	0	112.3	V246	Q242-V246 WeakPolarHBondContact CA-O 3.2Å
243	H	94.4	Very high	95.6	Very high	25 Å²	25	45.8 Å²	45.8	12%	0.116	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.1	134.5	169.2	-49.3	-55.3	0	0	0	109.4	C241 G245 V246 T248 E250 K253	C241-H243 PolarHBondContact SG-CE1 3.32Å; H243-G245 PolarHBondContact O-N 2.86Å; H243-G245 VanDerWaalsContact O-N 3.17Å; H243-V246 PolarHBondContact N-O 3.28Å; H243-V246 PolarHBondContact O-N 2.99Å; H243-V246 VanDerWaalsContact O-N 3.1Å; H243-V246 VanDerWaalsContact O-O 3.11Å; H243-T248 PolarHBondContact CD2-O 3.08Å; H243-T248 PolarHBondContact CD2-OG1 3.27Å; H243-T248 PolarHBondContact NE2-O 2.9Å; H243-E250 IonicContact CE1-OE1 3.44Å; H243-E250 IonicContact NE2-OE1 3.92Å; H243-E250 PolarHBondContact NE2-OE1 3.29Å; H243-K253 HydrophobicContact CB-CB 4.05Å; H243-K253 HydrophobicContact CB-CG 3.9Å
244	Y	94.7	Very high	95.6	Very high	44 Å²	44	44.3 Å²	44.3	17%	0.173	26%	0.26	C	S	.	.	T	Hydrogen-bonded Turn	trans	53.2	34.8	178.8	-46.1	-73.8	0	0	0	113.6	K253 F256 M297 V298 V301 V302	Y244-K253 HydrophobicContact CD2-CG 4.49Å; Y244-K253 HydrophobicContact CE2-CB 4.24Å; Y244-K253 HydrophobicContact CE2-CG 3.65Å; Y244-F256 HydrophobicContact CD1-CD1 4.39Å; Y244-F256 AromaticContact CD2-CD1 3.81Å; Y244-F256 HydrophobicContact CD2-CD1 3.81Å; Y244-F256 HydrophobicContact CE2-CD1 4.35Å; Y244-F256 AromaticContact CG-CD1 3.84Å; Y244-F256 HydrophobicContact CG-CD1 3.84Å; Y244-F256 HydrophobicContact CG-CE1 4.11Å; Y244-M297 HydrophobicContact CD2-CE 3.68Å; Y244-M297 HydrophobicContact CG-CE 4.34Å; Y244-M297 CarbonylContact O-C 3.48Å; Y244-M297 WeakPolarHBondContact O-CA 3.49Å; Y244-V298 PolarHBondContact O-N 3.36Å; Y244-V301 HydrophobicContact CD1-CG2 3.93Å; Y244-V302 HydrophobicContact CD1-CB 4.49Å; Y244-V302 HydrophobicContact CD1-CG2 3.57Å; Y244-V302 HydrophobicContact CE1-CB 4.24Å; Y244-V302 HydrophobicContact CE1-CG1 4.46Å; Y244-V302 HydrophobicContact CE1-CG2 3.64Å; Y244-V302 HydrophobicContact CG-CG2 4.33Å
245	G	91	Very high	95.6	Very high	52 Å²	52	44.8 Å²	44.8	54%	0.536	26%	0.262	S	S	.	.	T	Hydrogen-bonded Turn	trans	99	-18	-179.2	0	0	0	0	0	115.8	H243	H243-G245 PolarHBondContact O-N 2.86Å; H243-G245 VanDerWaalsContact O-N 3.17Å
246	V	95.2	Very high	95.6	Very high	17 Å²	17	44.5 Å²	44.5	10%	0.103	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	142.5	-167.1	-168.5	0	0	0	0	112.4	A233 Q242 H243 T248 V295 G296 M297	A233-V246 HydrophobicContact CB-CG1 3.88Å; Q242-V246 WeakPolarHBondContact CA-O 3.2Å; H243-V246 PolarHBondContact N-O 3.28Å; H243-V246 PolarHBondContact O-N 2.99Å; H243-V246 VanDerWaalsContact O-N 3.1Å; H243-V246 VanDerWaalsContact O-O 3.11Å; V246-T248 HydrophobicContact CB-CG2 4.06Å; V246-T248 HydrophobicContact CG1-CG2 4.06Å; V246-T248 PolarHBondContact O-N 3.23Å; V246-T248 PolarHBondContact O-OG1 2.97Å; V246-V295 HydrophobicContact CG1-CB 4.36Å; V246-V295 HydrophobicContact CG1-CG2 3.96Å; V246-V295 HydrophobicContact CG2-CG2 4.44Å; V246-V295 WeakPolarHBondContact CG2-O 3.38Å; V246-G296 VanDerWaalsContact CG2-O 3.3Å; V246-G296 WeakPolarHBondContact CG2-O 3.48Å; V246-M297 HydrophobicContact CB-CG 4.11Å; V246-M297 HydrophobicContact CG2-CB 4.48Å; V246-M297 HydrophobicContact CG2-CG 3.83Å
247	R	96.2	Very high	95.6	Very high	88 Å²	88	45.6 Å²	45.6	33%	0.332	25%	0.252	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.2	108.2	170	-174.6	179.4	-72.3	-82.4	10.9	109.4	E229 D231 A233 A239 S240	E229-R247 PolarHBondContact O-NE 3.39Å; E229-R247 PolarHBondContact O-NH2 2.96Å; E229-R247 VanDerWaalsContact O-NH2 3.11Å; D231-R247 WeakPolarHBondContact O-CD 3.44Å; A233-R247 PolarHBondContact N-O 2.91Å; A239-R247 HydrophobicContact CB-CG 3.71Å; A239-R247 WeakPolarHBondContact O-CD 3.48Å; A239-R247 WeakPolarHBondContact O-CG 3.5Å; A239-R247 PolarHBondContact O-NH1 3.41Å; S240-R247 VanDerWaalsContact C-NH1 3.25Å; S240-R247 PolarHBondContact O-NH1 3Å
248	T	97.5	Very high	95.5	Very high	0 Å²	0	51.6 Å²	51.6	0%	0	27%	0.272	C	S	.	.			trans	-144.2	154.1	-174.3	52.3	0	0	0	0	111.9	C232 V234 A239 C241 H243 V246 M297	C232-T248 VanDerWaalsContact SG-CA 3.56Å; V234-T248 HydrophobicContact CG2-CG2 3.93Å; A239-T248 WeakPolarHBondContact CB-O 3.47Å; C241-T248 PolarHBondContact O-N 3.16Å; H243-T248 PolarHBondContact CD2-O 3.08Å; H243-T248 PolarHBondContact CD2-OG1 3.27Å; H243-T248 PolarHBondContact NE2-O 2.9Å; V246-T248 HydrophobicContact CB-CG2 4.06Å; V246-T248 HydrophobicContact CG1-CG2 4.06Å; V246-T248 PolarHBondContact O-N 3.23Å; V246-T248 PolarHBondContact O-OG1 2.97Å; T248-M297 HydrophobicContact CG2-CE 4.29Å; T248-M297 HydrophobicContact CG2-CG 4.47Å; T248-M297 HydrophobicContact CG2-SD 3.92Å
249	C	97.8	Very high	95.5	Very high	5 Å²	5	46.2 Å²	46.2	3%	0.034	25%	0.248	C	C	.	.			trans	-78.1	156.2	176.1	63.3	0	0	0	0	111.1	C232 C235 D237 H238 G251 C252 K253 R281	C232-C249 HydrophobicContact CB-CB 3.99Å; C232-C249 PolarHBondContact SG-N 3.49Å; C232-C249 VanDerWaalsContact SG-N 3.36Å; C232-C249 VanDerWaalsContact SG-SG 3.67Å; C235-C249 VanDerWaalsContact SG-SG 3.64Å; D237-C249 HydrophobicContact CB-CB 4.08Å; H238-C249 WeakPolarHBondContact O-CB 3.42Å; C249-G251 PolarHBondContact O-N 2.9Å; C249-G251 VanDerWaalsContact O-N 3.09Å; C249-C252 PolarHBondContact O-N 2.85Å; C249-K253 PolarHBondContact O-N 2.97Å; C249-R281 PolarHBondContact SG-NH1 3.15Å
250	E	97.1	Very high	95.5	Very high	115 Å²	115	47 Å²	47	54%	0.537	25%	0.252	S	S	.	.	H	α-helix	trans	-49.3	-36.3	173.8	-73.1	-65.6	142.5	0	0	112.9	H243 C252 K253 G254	H243-E250 IonicContact CE1-OE1 3.44Å; H243-E250 IonicContact NE2-OE1 3.92Å; H243-E250 PolarHBondContact NE2-OE1 3.29Å; E250-C252 PolarHBondContact O-N 2.88Å; E250-K253 IonicContact OE1-NZ 2.69Å; E250-K253 PolarHBondContact OE1-NZ 3.22Å; E250-K253 WeakPolarHBondContact OE2-CD 3.4Å; E250-K253 WeakPolarHBondContact OE2-CE 3.26Å; E250-K253 IonicContact OE2-NZ 2.79Å; E250-K253 PolarHBondContact OE2-NZ 3.44Å; E250-G254 PolarHBondContact O-N 3.29Å
251	G	97.3	Very high	95.4	Very high	30 Å²	30	44.6 Å²	44.6	31%	0.309	23%	0.231	S	C	.	.	H	α-helix	trans	-64.3	-35.5	177.6	0	0	0	0	0	114.1	C249 F255 R288	C249-G251 PolarHBondContact O-N 2.9Å; C249-G251 VanDerWaalsContact O-N 3.09Å; G251-F255 WeakPolarHBondContact O-CB 3.35Å; G251-F255 PolarHBondContact O-N 3.5Å; G251-R288 PolarHBondContact O-NH2 3.15Å
252	C	98.1	Very high	95.5	Very high	0 Å²	0	49.6 Å²	49.6	0%	0	25%	0.245	C	C	.	.	H	α-helix	trans	-86.4	-37.3	176.6	-73.9	0	0	0	0	112.2	V234 C235 C249 E250 G254 F255 F256	V234-C252 HydrophobicContact CB-CB 4.35Å; V234-C252 HydrophobicContact CG1-CB 4.49Å; V234-C252 HydrophobicContact CG2-CB 4.48Å; C235-C252 VanDerWaalsContact SG-SG 3.61Å; C249-C252 PolarHBondContact O-N 2.85Å; E250-C252 PolarHBondContact O-N 2.88Å; C252-G254 PolarHBondContact O-N 3.45Å; C252-F255 PolarHBondContact O-N 3.11Å; C252-F256 WeakPolarHBondContact O-CB 3.32Å; C252-F256 PolarHBondContact O-N 2.83Å
253	K	97	Very high	95.1	Very high	58 Å²	58	48 Å²	48	25%	0.252	24%	0.241	S	C	.	.	H	α-helix	trans	-49.8	-54.8	166.7	172.9	-152.9	-168.7	179.8	0	112.1	H243 Y244 C249 E250 F255 F256 K257	H243-K253 HydrophobicContact CB-CB 4.05Å; H243-K253 HydrophobicContact CB-CG 3.9Å; Y244-K253 HydrophobicContact CD2-CG 4.49Å; Y244-K253 HydrophobicContact CE2-CB 4.24Å; Y244-K253 HydrophobicContact CE2-CG 3.65Å; C249-K253 PolarHBondContact O-N 2.97Å; E250-K253 IonicContact OE1-NZ 2.69Å; E250-K253 PolarHBondContact OE1-NZ 3.22Å; E250-K253 WeakPolarHBondContact OE2-CD 3.4Å; E250-K253 WeakPolarHBondContact OE2-CE 3.26Å; E250-K253 IonicContact OE2-NZ 2.79Å; E250-K253 PolarHBondContact OE2-NZ 3.44Å; K253-F255 PolarHBondContact O-N 3.46Å; K253-F256 PolarHBondContact O-N 2.89Å; K253-K257 PolarHBondContact O-N 2.96Å
254	G	96.9	Very high	95	Very high	19 Å²	19	48.5 Å²	48.5	20%	0.196	25%	0.247	C	C	.	.	H	α-helix	trans	-66.9	-34.2	-178.6	0	0	0	0	0	113.5	E250 C252 R258	E250-G254 PolarHBondContact O-N 3.29Å; C252-G254 PolarHBondContact O-N 3.45Å; G254-R258 WeakPolarHBondContact O-CG 3.44Å; G254-R258 VanDerWaalsContact O-CZ 3.29Å; G254-R258 PolarHBondContact O-N 3.45Å; G254-R258 PolarHBondContact O-NH1 2.69Å
255	F	98.2	Very high	94.9	Very high	10 Å²	10	57.6 Å²	57.6	4%	0.044	28%	0.282	C	S	.	.	H	α-helix	trans	-66.5	-47	172.9	170.4	-96.3	0	0	0	112	G251 C252 K253 R258 T259 Y266 Q285 R288 F289	G251-F255 WeakPolarHBondContact O-CB 3.35Å; G251-F255 PolarHBondContact O-N 3.5Å; C252-F255 PolarHBondContact O-N 3.11Å; K253-F255 PolarHBondContact O-N 3.46Å; F255-R258 PolarHBondContact O-N 3.16Å; F255-T259 WeakPolarHBondContact O-CB 3.31Å; F255-T259 PolarHBondContact O-N 2.68Å; F255-T259 PolarHBondContact O-OG1 3.02Å; F255-Y266 AromaticContact CE2-CE2 3.95Å; F255-Y266 HydrophobicContact CE2-CE2 3.95Å; F255-Y266 HydrophobicContact CZ-CD2 4.38Å; F255-Y266 AromaticContact CZ-CE2 3.6Å; F255-Y266 HydrophobicContact CZ-CE2 3.6Å; F255-Q285 HydrophobicContact CE2-CB 4.23Å; F255-Q285 HydrophobicContact CE2-CG 4.23Å; F255-Q285 HydrophobicContact CZ-CB 4.33Å; F255-Q285 WeakPolarHBondContact CZ-O 3.31Å; F255-R288 VanDerWaalsContact CD1-CD 3.46Å; F255-R288 HydrophobicContact CD1-CG 4.05Å; F255-R288 HydrophobicContact CE1-CB 4.13Å; F255-R288 HydrophobicContact CE1-CG 3.85Å; F255-R288 HydrophobicContact CZ-CB 4.25Å; F255-R288 HydrophobicContact CZ-CG 4.33Å; F255-F289 HydrophobicContact CE1-CB 3.8Å; F255-F289 HydrophobicContact CE1-CD2 4.14Å; F255-F289 HydrophobicContact CE1-CG 4.45Å; F255-F289 HydrophobicContact CZ-CB 3.99Å
256	F	97.5	Very high	95.2	Very high	0 Å²	0	57.5 Å²	57.5	0%	0	27%	0.265	C	S	.	.	H	α-helix	trans	-62.2	-48.9	178.5	-169.8	-101.3	0	0	0	111	Y244 C252 K253 R258 T259 V260 F289 C292 L293 M297 V298 K299 V302	Y244-F256 HydrophobicContact CD1-CD1 4.39Å; Y244-F256 AromaticContact CD2-CD1 3.81Å; Y244-F256 HydrophobicContact CD2-CD1 3.81Å; Y244-F256 HydrophobicContact CE2-CD1 4.35Å; Y244-F256 AromaticContact CG-CD1 3.84Å; Y244-F256 HydrophobicContact CG-CD1 3.84Å; Y244-F256 HydrophobicContact CG-CE1 4.11Å; C252-F256 WeakPolarHBondContact O-CB 3.32Å; C252-F256 PolarHBondContact O-N 2.83Å; K253-F256 PolarHBondContact O-N 2.89Å; F256-R258 PolarHBondContact O-N 2.94Å; F256-T259 PolarHBondContact O-N 3.47Å; F256-V260 HydrophobicContact CD1-CG2 4.28Å; F256-V260 HydrophobicContact CE1-CG2 4Å; F256-V260 HydrophobicContact CE2-CG2 4.29Å; F256-V260 HydrophobicContact CZ-CG2 4Å; F256-V260 WeakPolarHBondContact O-CG2 3.29Å; F256-V260 PolarHBondContact O-N 2.99Å; F256-F289 HydrophobicContact CD2-CD2 4.02Å; F256-F289 AromaticContact CD2-CE2 3.64Å; F256-F289 HydrophobicContact CD2-CE2 3.64Å; F256-F289 HydrophobicContact CE2-CD2 4.31Å; F256-F289 AromaticContact CE2-CE2 3.62Å; F256-F289 HydrophobicContact CE2-CE2 3.62Å; F256-F289 HydrophobicContact CE2-CZ 4.41Å; F256-C292 HydrophobicContact CD2-CB 3.61Å; F256-C292 HydrophobicContact CE2-CB 4.03Å; F256-L293 HydrophobicContact CE2-CD2 3.96Å; F256-L293 HydrophobicContact CZ-CD2 4.32Å; F256-M297 HydrophobicContact CB-CE 3.7Å; F256-M297 HydrophobicContact CB-SD 4.39Å; F256-M297 HydrophobicContact CD1-CB 4.41Å; F256-M297 HydrophobicContact CD1-CE 3.92Å; F256-M297 HydrophobicContact CD2-CB 4.06Å; F256-M297 HydrophobicContact CD2-CE 4.26Å; F256-M297 HydrophobicContact CD2-SD 4.22Å; F256-M297 HydrophobicContact CE1-CB 4.07Å; F256-M297 HydrophobicContact CE2-CB 3.69Å; F256-M297 HydrophobicContact CG-CB 4.4Å; F256-M297 HydrophobicContact CG-CE 3.7Å; F256-M297 HydrophobicContact CG-SD 4.25Å; F256-M297 HydrophobicContact CZ-CB 3.7Å; F256-M297 WeakPolarHBondContact CZ-O 3.42Å; F256-V298 WeakPolarHBondContact CE1-O 3.49Å; F256-K299 HydrophobicContact CZ-CB 4.35Å; F256-V302 HydrophobicContact CD1-CG2 3.79Å; F256-V302 HydrophobicContact CE1-CG2 3.58Å
257	K	95.4	Very high	95.2	Very high	69 Å²	69	62.3 Å²	62.3	30%	0.3	29%	0.294	S	S	.	.	H	α-helix	trans	-50.9	-53.4	175.1	-166.5	-162.2	-174.5	-113.8	0	111.5	K253 V260 Q261 V302 D305	K253-K257 PolarHBondContact O-N 2.96Å; K257-V260 PolarHBondContact O-N 3.21Å; K257-Q261 VanDerWaalsContact CE-NE2 3.33Å; K257-Q261 VanDerWaalsContact CE-OE1 3.3Å; K257-Q261 HydrophobicContact CG-CG 4.21Å; K257-Q261 VanDerWaalsContact O-CB 3.31Å; K257-Q261 WeakPolarHBondContact O-CB 3.18Å; K257-Q261 VanDerWaalsContact O-CG 3.29Å; K257-Q261 WeakPolarHBondContact O-CG 3.37Å; K257-Q261 PolarHBondContact O-N 3.16Å; K257-V302 HydrophobicContact CB-CG1 4.5Å; K257-V302 HydrophobicContact CG-CG1 3.93Å; K257-D305 IonicContact NZ-OD1 2.62Å; K257-D305 PolarHBondContact NZ-OD1 3.35Å
258	R	96.2	Very high	95.2	Very high	146 Å²	146	59 Å²	59	55%	0.551	29%	0.285	S	S	*	.	H	α-helix	trans	-64.8	-41.9	-177.3	-72.4	-173.3	-59.8	-94.5	2.8	112.6	G254 F255 F256 K262	G254-R258 WeakPolarHBondContact O-CG 3.44Å; G254-R258 VanDerWaalsContact O-CZ 3.29Å; G254-R258 PolarHBondContact O-N 3.45Å; G254-R258 PolarHBondContact O-NH1 2.69Å; F255-R258 PolarHBondContact O-N 3.16Å; F256-R258 PolarHBondContact O-N 2.94Å; R258-K262 WeakPolarHBondContact O-CB 3.49Å; R258-K262 PolarHBondContact O-N 3.2Å
259	T	95.9	Very high	95.1	Very high	2 Å²	2	66.9 Å²	66.9	1%	0.012	33%	0.327	C	S	.	.	H	α-helix	trans	-61.9	-45.2	178.8	-55.6	0	0	0	0	110.8	F255 F256 N263 S264 Y266 F289	F255-T259 WeakPolarHBondContact O-CB 3.31Å; F255-T259 PolarHBondContact O-N 2.68Å; F255-T259 PolarHBondContact O-OG1 3.02Å; F256-T259 PolarHBondContact O-N 3.47Å; T259-N263 CarbonylContact O-C 3.42Å; T259-N263 WeakPolarHBondContact O-CA 3.38Å; T259-N263 PolarHBondContact O-N 2.71Å; T259-N263 VanDerWaalsContact O-N 3.1Å; T259-S264 PolarHBondContact O-N 3.45Å; T259-Y266 HydrophobicContact CG2-CD2 4.3Å; T259-Y266 HydrophobicContact CG2-CE2 3.43Å; T259-Y266 VanDerWaalsContact CG2-CE2 3.43Å; T259-Y266 PolarHBondContact OG1-OH 3.03Å; T259-F289 HydrophobicContact CG2-CD1 4.02Å; T259-F289 HydrophobicContact CG2-CD2 3.56Å; T259-F289 HydrophobicContact CG2-CE1 4Å; T259-F289 HydrophobicContact CG2-CE2 3.54Å; T259-F289 HydrophobicContact CG2-CG 3.81Å; T259-F289 HydrophobicContact CG2-CZ 3.77Å
260	V	94.2	Very high	95	Very high	17 Å²	17	68.9 Å²	68.9	10%	0.103	34%	0.344	C	S	.	.	H	α-helix	trans	-70.8	-48.6	179.5	173.9	0	0	0	0	111.8	F256 K257 K262 N263 F289 K299 V302	F256-V260 HydrophobicContact CD1-CG2 4.28Å; F256-V260 HydrophobicContact CE1-CG2 4Å; F256-V260 HydrophobicContact CE2-CG2 4.29Å; F256-V260 HydrophobicContact CZ-CG2 4Å; F256-V260 WeakPolarHBondContact O-CG2 3.29Å; F256-V260 PolarHBondContact O-N 2.99Å; K257-V260 PolarHBondContact O-N 3.21Å; V260-K262 VanDerWaalsContact C-N 3.27Å; V260-K262 PolarHBondContact O-N 2.98Å; V260-N263 PolarHBondContact O-N 3.39Å; V260-F289 HydrophobicContact CG2-CE2 4.15Å; V260-F289 HydrophobicContact CG2-CZ 4.27Å; V260-K299 HydrophobicContact CB-CG 4.33Å; V260-K299 HydrophobicContact CG1-CD 4.44Å; V260-K299 HydrophobicContact CG1-CG 3.56Å; V260-K299 HydrophobicContact CG2-CB 4.38Å; V260-K299 HydrophobicContact CG2-CG 3.81Å; V260-V302 HydrophobicContact CB-CB 4.16Å; V260-V302 HydrophobicContact CB-CG1 4.09Å; V260-V302 HydrophobicContact CB-CG2 4.04Å; V260-V302 HydrophobicContact CG1-CB 3.71Å; V260-V302 HydrophobicContact CG1-CG1 3.98Å; V260-V302 HydrophobicContact CG1-CG2 3.96Å; V260-V302 HydrophobicContact CG2-CG2 4.18Å
261	Q	90	Very high	94.9	Very high	43 Å²	43	70.1 Å²	70.1	20%	0.201	35%	0.354	C	S	.	.	H	α-helix	trans	-62	-31.4	-179.5	-74.5	-171.8	-51	0	0	113.6	K257 V302 R303 D305	K257-Q261 VanDerWaalsContact CE-NE2 3.33Å; K257-Q261 VanDerWaalsContact CE-OE1 3.3Å; K257-Q261 HydrophobicContact CG-CG 4.21Å; K257-Q261 VanDerWaalsContact O-CB 3.31Å; K257-Q261 WeakPolarHBondContact O-CB 3.18Å; K257-Q261 VanDerWaalsContact O-CG 3.29Å; K257-Q261 WeakPolarHBondContact O-CG 3.37Å; K257-Q261 PolarHBondContact O-N 3.16Å; Q261-V302 HydrophobicContact CG-CG1 3.91Å; Q261-R303 PolarHBondContact NE2-O 3.49Å; Q261-D305 PolarHBondContact NE2-OD1 3.11Å; Q261-D305 PolarHBondContact NE2-OD2 3.04Å
262	K	89.6	Confident	94.7	Very high	167 Å²	167	76 Å²	76	73%	0.726	37%	0.371	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.7	9.3	175.7	-64.8	-166.9	171.9	-159.9	0	113.5	R258 V260 S264	R258-K262 WeakPolarHBondContact O-CB 3.49Å; R258-K262 PolarHBondContact O-N 3.2Å; V260-K262 VanDerWaalsContact C-N 3.27Å; V260-K262 PolarHBondContact O-N 2.98Å; K262-S264 VanDerWaalsContact CB-OG 3.31Å; K262-S264 WeakPolarHBondContact CB-OG 3.27Å; K262-S264 PolarHBondContact O-N 3.43Å; K262-S264 PolarHBondContact O-OG 2.75Å
263	N	87.1	Confident	94.6	Very high	100 Å²	100	81.3 Å²	81.3	54%	0.535	40%	0.4	S	S	.	.	T	Hydrogen-bonded Turn	trans	40.1	39.2	-173.4	-158.4	39.3	0	0	0	113.9	T259 V260 R265 K299	T259-N263 CarbonylContact O-C 3.42Å; T259-N263 WeakPolarHBondContact O-CA 3.38Å; T259-N263 PolarHBondContact O-N 2.71Å; T259-N263 VanDerWaalsContact O-N 3.1Å; V260-N263 PolarHBondContact O-N 3.39Å; N263-R265 PolarHBondContact O-N 2.82Å; N263-K299 PolarHBondContact OD1-NZ 2.92Å
264	S	92.9	Very high	94.6	Very high	36 Å²	36	80 Å²	80	25%	0.252	40%	0.398	S	S	.	.			trans	-72.2	121	-164.3	-56.3	0	0	0	0	111.6	T259 K262	T259-S264 PolarHBondContact O-N 3.45Å; K262-S264 VanDerWaalsContact CB-OG 3.31Å; K262-S264 WeakPolarHBondContact CB-OG 3.27Å; K262-S264 PolarHBondContact O-N 3.43Å; K262-S264 PolarHBondContact O-OG 2.75Å
265	R	92.1	Very high	94.6	Very high	236 Å²	236	82.9 Å²	82.9	89%	0.891	41%	0.412	S	S	*	.			trans	-84.2	134.7	170.6	-59.7	-176.7	-179	-165.8	-0.1	108.8	N263	N263-R265 PolarHBondContact O-N 2.82Å
266	Y	96.4	Very high	94.6	Very high	50 Å²	50	83.2 Å²	83.2	20%	0.196	42%	0.416	C	S	.	.			trans	-120.2	155.7	175.3	-57.5	-55.8	0	0	0	109.7	F255 T259 Q285 F286 F289	F255-Y266 AromaticContact CE2-CE2 3.95Å; F255-Y266 HydrophobicContact CE2-CE2 3.95Å; F255-Y266 HydrophobicContact CZ-CD2 4.38Å; F255-Y266 AromaticContact CZ-CE2 3.6Å; F255-Y266 HydrophobicContact CZ-CE2 3.6Å; T259-Y266 HydrophobicContact CG2-CD2 4.3Å; T259-Y266 HydrophobicContact CG2-CE2 3.43Å; T259-Y266 VanDerWaalsContact CG2-CE2 3.43Å; T259-Y266 PolarHBondContact OG1-OH 3.03Å; Y266-Q285 HydrophobicContact CD1-CB 3.67Å; Y266-Q285 HydrophobicContact CD1-CG 4.47Å; Y266-Q285 VanDerWaalsContact CD1-OE1 3.3Å; Y266-Q285 HydrophobicContact CD2-CB 3.78Å; Y266-Q285 HydrophobicContact CE1-CB 3.87Å; Y266-Q285 HydrophobicContact CE1-CG 4.32Å; Y266-Q285 HydrophobicContact CE2-CB 3.96Å; Y266-Q285 HydrophobicContact CG-CB 3.64Å; Y266-F286 WeakPolarHBondContact O-CD2 3.22Å; Y266-F289 HydrophobicContact CD2-CB 4.15Å; Y266-F289 HydrophobicContact CE2-CB 4.28Å
267	V	95.3	Very high	94.6	Very high	117 Å²	117	85.3 Å²	85.3	71%	0.709	43%	0.426	S	S	*	.			trans	-115.9	154	171.1	-178.3	0	0	0	0	108.4
268	C	96.9	Very high	94.6	Very high	19 Å²	19	87.6 Å²	87.6	13%	0.128	44%	0.436	C	S	.	.			trans	-102.4	127	168.7	-165.8	0	0	0	0	109.4	A270 K272 C274 F286 C287	C268-A270 PolarHBondContact O-N 3.14Å; C268-A270 PolarHBondContact SG-O 3.31Å; C268-A270 VanDerWaalsContact SG-O 3.39Å; C268-K272 HydrophobicContact CB-CG 4.12Å; C268-C274 VanDerWaalsContact SG-SG 3.66Å; C268-F286 HydrophobicContact CB-CB 4.1Å; C268-F286 HydrophobicContact CB-CD1 3.76Å; C268-F286 HydrophobicContact CB-CG 4.06Å; C268-C287 VanDerWaalsContact SG-SG 3.61Å
269	N	96.1	Very high	94.6	Very high	165 Å²	165	91.9 Å²	91.9	88%	0.882	45%	0.453	S	S	*	.	S	Bend	trans	-85.7	28.7	174.5	-54.6	85.6	0	0	0	112.2
270	A	94.4	Very high	94.5	Very high	48 Å²	48	98.3 Å²	98.3	40%	0.397	48%	0.477	S	S	.	.	S	Bend	trans	-162.5	-171.8	-176.8	0	0	0	0	0	108.7	C268 K272	C268-A270 PolarHBondContact O-N 3.14Å; C268-A270 PolarHBondContact SG-O 3.31Å; C268-A270 VanDerWaalsContact SG-O 3.39Å; A270-K272 PolarHBondContact O-N 2.93Å
271	N	94.6	Very high	94.6	Very high	141 Å²	141	99.3 Å²	99.3	75%	0.754	48%	0.479	S	S	*	.	S	Bend	trans	-73.6	29.7	-166.9	-59.2	-7.9	0	0	0	115.4	D273	N271-D273 PolarHBondContact O-N 2.98Å
272	K	94.5	Very high	94.9	Very high	153 Å²	153	103 Å²	103	67%	0.665	50%	0.5	S	S	*	.	S	Bend	trans	59.6	8.1	179.7	-64	174.8	-176.7	169.4	0	115.4	C268 A270 F286 C287	C268-K272 HydrophobicContact CB-CG 4.12Å; A270-K272 PolarHBondContact O-N 2.93Å; K272-F286 HydrophobicContact CB-CD1 4.47Å; K272-F286 HydrophobicContact CB-CE1 3.82Å; K272-F286 HydrophobicContact CD-CE1 4.18Å; K272-F286 HydrophobicContact CD-CZ 4.27Å; K272-F286 HydrophobicContact CG-CD1 4.37Å; K272-F286 HydrophobicContact CG-CE1 3.72Å; K272-F286 HydrophobicContact CG-CZ 4.27Å; K272-C287 PolarHBondContact O-SG 3.27Å
273	D	95.7	Very high	95.3	Very high	112 Å²	112	106.1 Å²	106.1	60%	0.599	51%	0.507	S	S	*	.			trans	-108.7	0.2	-168.1	63.4	-19.6	0	0	0	114.9	N271	N271-D273 PolarHBondContact O-N 2.98Å
274	C	97.3	Very high	95.8	Very high	31 Å²	31	102.2 Å²	102.2	21%	0.209	49%	0.487	C	S	.	.			trans	-53.6	130.7	-165.3	-62.3	0	0	0	0	113.9	C268 V276 C284 C287	C268-C274 VanDerWaalsContact SG-SG 3.66Å; C274-V276 WeakPolarHBondContact O-CG2 3.48Å; C274-V276 PolarHBondContact O-N 3.38Å; C274-C284 HydrophobicContact CB-CB 3.87Å; C274-C287 HydrophobicContact CB-CB 3.95Å; C274-C287 PolarHBondContact N-SG 3.11Å; C274-C287 VanDerWaalsContact N-SG 3.38Å
275	P	96.7	Very high	96.1	Very high	78 Å²	78	105.4 Å²	105.4	51%	0.506	50%	0.498	S	S	.	.			trans	-66.5	120.8	-172.8	25	-34.6	0	0	0	112.9
276	V	97.5	Very high	96.3	Very high	18 Å²	18	96.1 Å²	96.1	11%	0.109	46%	0.464	C	S	.	.			trans	-98.4	94.6	-179.4	-173.3	0	0	0	0	110.1	V234 C235 C274 R281 C287 R288 K291	V234-V276 HydrophobicContact CG1-CG1 4.03Å; V234-V276 WeakPolarHBondContact O-CG1 3.08Å; C235-V276 HydrophobicContact CB-CG1 4.19Å; C274-V276 WeakPolarHBondContact O-CG2 3.48Å; C274-V276 PolarHBondContact O-N 3.38Å; V276-R281 HydrophobicContact CG1-CB 3.91Å; V276-C287 HydrophobicContact CG2-CB 4.27Å; V276-R288 HydrophobicContact CG1-CB 4.37Å; V276-R288 HydrophobicContact CG1-CG 4.08Å; V276-R288 HydrophobicContact CG2-CB 4.46Å; V276-K291 HydrophobicContact CB-CD 3.82Å; V276-K291 HydrophobicContact CG1-CD 4.33Å; V276-K291 HydrophobicContact CG2-CB 4.41Å; V276-K291 HydrophobicContact CG2-CD 4.16Å; V276-K291 PolarHBondContact O-NZ 2.62Å
277	D	96.9	Very high	96.4	Very high	43 Å²	43	94.1 Å²	94.1	23%	0.23	46%	0.457	C	S	.	.			trans	-120.9	169.4	175	68.2	59.6	0	0	0	112.1	C235 R279 R280 R281	C235-D277 CarbonylContact O-C 3.58Å; D277-R279 PolarHBondContact O-N 3Å; D277-R279 VanDerWaalsContact O-N 3.11Å; D277-R279 WeakPolarHBondContact OD1-CA 3.47Å; D277-R279 WeakPolarHBondContact OD1-CB 3.35Å; D277-R279 PolarHBondContact OD1-N 3.14Å; D277-R280 PolarHBondContact O-N 2.57Å; D277-R280 PolarHBondContact OD1-N 2.91Å; D277-R280 IonicContact OD2-CZ 3.36Å; D277-R280 IonicContact OD2-NE 2.75Å; D277-R280 PolarHBondContact OD2-NE 3.47Å; D277-R280 IonicContact OD2-NH2 3.71Å; D277-R280 PolarHBondContact OD2-NH2 2.94Å; D277-R281 WeakPolarHBondContact O-CB 3.01Å; D277-R281 WeakPolarHBondContact O-CG 3.4Å; D277-R281 PolarHBondContact O-N 3.17Å
278	K	95.9	Very high	96.6	Very high	117 Å²	117	89.1 Å²	89.1	51%	0.509	43%	0.426	S	S	.	.	T	Hydrogen-bonded Turn	trans	-50.8	-36.1	-178.5	178.7	172.4	179.6	153	0	114	C235 D237 R281	C235-K278 PolarHBondContact O-N 2.65Å; D237-K278 HydrophobicContact CB-CB 4.17Å; D237-K278 HydrophobicContact CB-CD 3.99Å; D237-K278 HydrophobicContact CB-CG 3.97Å; D237-K278 VanDerWaalsContact OD1-CD 3.28Å; D237-K278 WeakPolarHBondContact OD1-CD 3.29Å; D237-K278 WeakPolarHBondContact OD1-CE 3.37Å; D237-K278 IonicContact OD1-NZ 3.57Å; D237-K278 PolarHBondContact OD1-NZ 3.26Å; K278-R281 PolarHBondContact O-NE 3.49Å
279	R	96.1	Very high	96.6	Very high	236 Å²	236	89.7 Å²	89.7	89%	0.891	43%	0.426	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.6	-40.8	-177.8	-61.5	176.5	71.2	174.9	1.5	111.7	D277	D277-R279 PolarHBondContact O-N 3Å; D277-R279 VanDerWaalsContact O-N 3.11Å; D277-R279 WeakPolarHBondContact OD1-CA 3.47Å; D277-R279 WeakPolarHBondContact OD1-CB 3.35Å; D277-R279 PolarHBondContact OD1-N 3.14Å
280	R	94.6	Very high	96.7	Very high	137 Å²	137	85.9 Å²	85.9	52%	0.517	40%	0.403	S	S	.	.	T	Hydrogen-bonded Turn	trans	-106	-3.2	-169.4	-64.2	-177.4	-63.4	173.6	2.9	115.4	D277 N282 R283	D277-R280 PolarHBondContact O-N 2.57Å; D277-R280 PolarHBondContact OD1-N 2.91Å; D277-R280 IonicContact OD2-CZ 3.36Å; D277-R280 IonicContact OD2-NE 2.75Å; D277-R280 PolarHBondContact OD2-NE 3.47Å; D277-R280 IonicContact OD2-NH2 3.71Å; D277-R280 PolarHBondContact OD2-NH2 2.94Å; R280-N282 PolarHBondContact O-N 3.4Å; R280-R283 VanDerWaalsContact O-CB 3.28Å; R280-R283 WeakPolarHBondContact O-CB 3.48Å; R280-R283 PolarHBondContact O-N 2.84Å
281	R	96.6	Very high	96.9	Very high	39 Å²	39	87.1 Å²	87.1	15%	0.147	40%	0.399	C	S	.	.	T	Hydrogen-bonded Turn	trans	-52.1	-14.6	175.9	61.7	-176	179.1	-166.1	-6.5	116.2	C235 D237 C249 V276 D277 K278 R288	C235-R281 HydrophobicContact CB-CB 4.37Å; C235-R281 PolarHBondContact SG-NH1 3.28Å; D237-R281 VanDerWaalsContact CB-NH1 3.33Å; D237-R281 IonicContact OD2-CZ 2.84Å; D237-R281 IonicContact OD2-NH1 3.76Å; D237-R281 PolarHBondContact OD2-NH1 3.04Å; D237-R281 IonicContact OD2-NH2 3.65Å; D237-R281 PolarHBondContact OD2-NH2 2.9Å; C249-R281 PolarHBondContact SG-NH1 3.15Å; V276-R281 HydrophobicContact CG1-CB 3.91Å; D277-R281 WeakPolarHBondContact O-CB 3.01Å; D277-R281 WeakPolarHBondContact O-CG 3.4Å; D277-R281 PolarHBondContact O-N 3.17Å; K278-R281 PolarHBondContact O-NE 3.49Å; R281-R288 VanDerWaalsContact O-CD 3.25Å; R281-R288 WeakPolarHBondContact O-CD 3.3Å; R281-R288 PolarHBondContact O-NH1 3.27Å
282	N	96.6	Very high	97.1	Very high	121 Å²	121	80.4 Å²	80.4	65%	0.647	36%	0.363	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.8	-11.7	174.9	-67.4	-5.8	0	0	0	113.5	R280 R288	R280-N282 PolarHBondContact O-N 3.4Å; N282-R288 PolarHBondContact OD1-NH1 3.34Å
283	R	97	Very high	97.2	Very high	232 Å²	232	76.2 Å²	76.2	88%	0.875	35%	0.348	S	S	*	.	S	Bend	trans	-74.9	-31.9	-171.8	-176.9	59.8	171.9	-169.8	-1	114	R280	R280-R283 VanDerWaalsContact O-CB 3.28Å; R280-R283 WeakPolarHBondContact O-CB 3.48Å; R280-R283 PolarHBondContact O-N 2.84Å
284	C	97.9	Very high	97.3	Very high	17 Å²	17	75.1 Å²	75.1	12%	0.115	35%	0.354	C	S	.	.			trans	-135.4	114.4	173.7	-179.9	0	0	0	0	110	C274 C287 R288	C274-C284 HydrophobicContact CB-CB 3.87Å; C284-C287 HydrophobicContact CB-CB 4.33Å; C284-C287 PolarHBondContact SG-N 2.99Å; C284-C287 VanDerWaalsContact SG-N 3.45Å; C284-R288 WeakPolarHBondContact O-CB 3.36Å; C284-R288 PolarHBondContact O-N 3.44Å
285	Q	98	Very high	97.2	Very high	104 Å²	104	75.8 Å²	75.8	49%	0.486	36%	0.358	S	S	.	.	H	α-helix	trans	-72.9	-35.1	-179.8	-66.6	175.4	-35.2	0	0	111.8	F255 Y266 F289	F255-Q285 HydrophobicContact CE2-CB 4.23Å; F255-Q285 HydrophobicContact CE2-CG 4.23Å; F255-Q285 HydrophobicContact CZ-CB 4.33Å; F255-Q285 WeakPolarHBondContact CZ-O 3.31Å; Y266-Q285 HydrophobicContact CD1-CB 3.67Å; Y266-Q285 HydrophobicContact CD1-CG 4.47Å; Y266-Q285 VanDerWaalsContact CD1-OE1 3.3Å; Y266-Q285 HydrophobicContact CD2-CB 3.78Å; Y266-Q285 HydrophobicContact CE1-CB 3.87Å; Y266-Q285 HydrophobicContact CE1-CG 4.32Å; Y266-Q285 HydrophobicContact CE2-CB 3.96Å; Y266-Q285 HydrophobicContact CG-CB 3.64Å; Q285-F289 WeakPolarHBondContact O-CB 3.46Å; Q285-F289 PolarHBondContact O-N 3.4Å
286	F	98.3	Very high	97	Very high	41 Å²	41	74 Å²	74	18%	0.18	35%	0.354	C	S	.	.	H	α-helix	trans	-59.3	-60.3	175.9	177.8	-90	0	0	0	111.7	Y266 C268 K272 R288 F289 Q290	Y266-F286 WeakPolarHBondContact O-CD2 3.22Å; C268-F286 HydrophobicContact CB-CB 4.1Å; C268-F286 HydrophobicContact CB-CD1 3.76Å; C268-F286 HydrophobicContact CB-CG 4.06Å; K272-F286 HydrophobicContact CB-CD1 4.47Å; K272-F286 HydrophobicContact CB-CE1 3.82Å; K272-F286 HydrophobicContact CD-CE1 4.18Å; K272-F286 HydrophobicContact CD-CZ 4.27Å; K272-F286 HydrophobicContact CG-CD1 4.37Å; K272-F286 HydrophobicContact CG-CE1 3.72Å; K272-F286 HydrophobicContact CG-CZ 4.27Å; F286-R288 PolarHBondContact O-N 2.9Å; F286-F289 PolarHBondContact O-N 2.91Å; F286-Q290 HydrophobicContact CD1-CG 4.02Å; F286-Q290 HydrophobicContact CD2-CG 4.41Å; F286-Q290 HydrophobicContact CE1-CG 3.6Å; F286-Q290 HydrophobicContact CE2-CG 4.06Å; F286-Q290 HydrophobicContact CG-CG 4.4Å; F286-Q290 HydrophobicContact CZ-CG 3.64Å; F286-Q290 WeakPolarHBondContact O-CG 3.43Å; F286-Q290 PolarHBondContact O-N 3.02Å
287	C	98.3	Very high	97	Very high	7 Å²	7	73.4 Å²	73.4	5%	0.047	35%	0.349	C	S	.	.	H	α-helix	trans	-61.3	-33.7	-177.6	-59.8	0	0	0	0	112.1	C268 K272 C274 V276 C284 K291	C268-C287 VanDerWaalsContact SG-SG 3.61Å; K272-C287 PolarHBondContact O-SG 3.27Å; C274-C287 HydrophobicContact CB-CB 3.95Å; C274-C287 PolarHBondContact N-SG 3.11Å; C274-C287 VanDerWaalsContact N-SG 3.38Å; V276-C287 HydrophobicContact CG2-CB 4.27Å; C284-C287 HydrophobicContact CB-CB 4.33Å; C284-C287 PolarHBondContact SG-N 2.99Å; C284-C287 VanDerWaalsContact SG-N 3.45Å; C287-K291 VanDerWaalsContact O-CB 3.29Å; C287-K291 WeakPolarHBondContact O-CB 3.38Å; C287-K291 PolarHBondContact O-N 3.2Å
288	R	98.4	Very high	96.7	Very high	12 Å²	12	74.1 Å²	74.1	5%	0.045	36%	0.355	C	S	.	.	H	α-helix	trans	-64.3	-45	172.5	-169.6	-164.2	-168.2	148.1	-7	112.4	V234 G251 F255 V276 R281 N282 C284 F286 K291 C292	V234-R288 HydrophobicContact CG1-CG 4.48Å; G251-R288 PolarHBondContact O-NH2 3.15Å; F255-R288 VanDerWaalsContact CD1-CD 3.46Å; F255-R288 HydrophobicContact CD1-CG 4.05Å; F255-R288 HydrophobicContact CE1-CB 4.13Å; F255-R288 HydrophobicContact CE1-CG 3.85Å; F255-R288 HydrophobicContact CZ-CB 4.25Å; F255-R288 HydrophobicContact CZ-CG 4.33Å; V276-R288 HydrophobicContact CG1-CB 4.37Å; V276-R288 HydrophobicContact CG1-CG 4.08Å; V276-R288 HydrophobicContact CG2-CB 4.46Å; R281-R288 VanDerWaalsContact O-CD 3.25Å; R281-R288 WeakPolarHBondContact O-CD 3.3Å; R281-R288 PolarHBondContact O-NH1 3.27Å; N282-R288 PolarHBondContact OD1-NH1 3.34Å; C284-R288 WeakPolarHBondContact O-CB 3.36Å; C284-R288 PolarHBondContact O-N 3.44Å; F286-R288 PolarHBondContact O-N 2.9Å; R288-K291 PolarHBondContact O-N 3.42Å; R288-C292 PolarHBondContact O-N 2.99Å; R288-C292 PolarHBondContact O-SG 3.43Å; R288-C292 VanDerWaalsContact O-SG 3.39Å
289	F	98.3	Very high	96.4	Very high	32 Å²	32	72.3 Å²	72.3	14%	0.14	35%	0.348	C	S	.	.	H	α-helix	trans	-70.5	-41.4	-180	-172.3	-120.4	0	0	0	112.1	F255 F256 T259 V260 Y266 Q285 F286 K291 C292 L293	F255-F289 HydrophobicContact CE1-CB 3.8Å; F255-F289 HydrophobicContact CE1-CD2 4.14Å; F255-F289 HydrophobicContact CE1-CG 4.45Å; F255-F289 HydrophobicContact CZ-CB 3.99Å; F256-F289 HydrophobicContact CD2-CD2 4.02Å; F256-F289 AromaticContact CD2-CE2 3.64Å; F256-F289 HydrophobicContact CD2-CE2 3.64Å; F256-F289 HydrophobicContact CE2-CD2 4.31Å; F256-F289 AromaticContact CE2-CE2 3.62Å; F256-F289 HydrophobicContact CE2-CE2 3.62Å; F256-F289 HydrophobicContact CE2-CZ 4.41Å; T259-F289 HydrophobicContact CG2-CD1 4.02Å; T259-F289 HydrophobicContact CG2-CD2 3.56Å; T259-F289 HydrophobicContact CG2-CE1 4Å; T259-F289 HydrophobicContact CG2-CE2 3.54Å; T259-F289 HydrophobicContact CG2-CG 3.81Å; T259-F289 HydrophobicContact CG2-CZ 3.77Å; V260-F289 HydrophobicContact CG2-CE2 4.15Å; V260-F289 HydrophobicContact CG2-CZ 4.27Å; Y266-F289 HydrophobicContact CD2-CB 4.15Å; Y266-F289 HydrophobicContact CE2-CB 4.28Å; Q285-F289 WeakPolarHBondContact O-CB 3.46Å; Q285-F289 PolarHBondContact O-N 3.4Å; F286-F289 PolarHBondContact O-N 2.91Å; F289-K291 VanDerWaalsContact C-N 3.31Å; F289-K291 PolarHBondContact O-N 2.91Å; F289-C292 VanDerWaalsContact O-CB 3.32Å; F289-C292 WeakPolarHBondContact O-CB 3.38Å; F289-C292 PolarHBondContact O-N 2.79Å; F289-C292 VanDerWaalsContact O-N 3.11Å; F289-L293 HydrophobicContact CD1-CD1 4.24Å; F289-L293 HydrophobicContact CE1-CD1 3.88Å; F289-L293 HydrophobicContact CE1-CG 4.48Å; F289-L293 HydrophobicContact CZ-CD1 4.22Å; F289-L293 HydrophobicContact CZ-CD2 4.36Å; F289-L293 HydrophobicContact CZ-CG 4.4Å; F289-L293 PolarHBondContact O-N 3.38Å
290	Q	97.9	Very high	95.8	Very high	84 Å²	84	68.3 Å²	68.3	39%	0.393	34%	0.339	S	S	.	.	H	α-helix	trans	-58.4	-44.2	171.7	-65.6	-59.5	-11.5	0	0	111.2	F286 C292 L293 A294	F286-Q290 HydrophobicContact CD1-CG 4.02Å; F286-Q290 HydrophobicContact CD2-CG 4.41Å; F286-Q290 HydrophobicContact CE1-CG 3.6Å; F286-Q290 HydrophobicContact CE2-CG 4.06Å; F286-Q290 HydrophobicContact CG-CG 4.4Å; F286-Q290 HydrophobicContact CZ-CG 3.64Å; F286-Q290 WeakPolarHBondContact O-CG 3.43Å; F286-Q290 PolarHBondContact O-N 3.02Å; Q290-C292 VanDerWaalsContact C-N 3.34Å; Q290-C292 PolarHBondContact O-N 3.49Å; Q290-L293 PolarHBondContact O-N 2.88Å; Q290-A294 WeakPolarHBondContact O-CB 3.12Å; Q290-A294 PolarHBondContact O-N 3.11Å
291	K	98.1	Very high	95.3	Very high	74 Å²	74	65.2 Å²	65.2	32%	0.322	34%	0.335	S	S	.	.	H	α-helix	trans	-67.5	-29.6	175.4	-164.4	177.2	177.6	-167.3	0	113.4	V234 V276 C287 R288 F289 V295	V234-K291 VanDerWaalsContact O-CD 3.26Å; V234-K291 WeakPolarHBondContact O-CD 3.43Å; V234-K291 WeakPolarHBondContact O-CE 3.45Å; V234-K291 PolarHBondContact O-NZ 2.92Å; V276-K291 HydrophobicContact CB-CD 3.82Å; V276-K291 HydrophobicContact CG1-CD 4.33Å; V276-K291 HydrophobicContact CG2-CB 4.41Å; V276-K291 HydrophobicContact CG2-CD 4.16Å; V276-K291 PolarHBondContact O-NZ 2.62Å; C287-K291 VanDerWaalsContact O-CB 3.29Å; C287-K291 WeakPolarHBondContact O-CB 3.38Å; C287-K291 PolarHBondContact O-N 3.2Å; R288-K291 PolarHBondContact O-N 3.42Å; F289-K291 VanDerWaalsContact C-N 3.31Å; F289-K291 PolarHBondContact O-N 2.91Å; K291-V295 HydrophobicContact CG-CG1 4.44Å; K291-V295 WeakPolarHBondContact O-CG1 3.36Å; K291-V295 WeakPolarHBondContact O-CG2 3.44Å; K291-V295 PolarHBondContact O-N 3.36Å
292	C	97.9	Very high	94.8	Very high	0 Å²	0	63.9 Å²	63.9	0%	0	33%	0.331	C	S	.	.	H	α-helix	trans	-60.5	-48	169.2	-76.7	0	0	0	0	111.4	F256 R288 F289 Q290 V295 M297	F256-C292 HydrophobicContact CD2-CB 3.61Å; F256-C292 HydrophobicContact CE2-CB 4.03Å; R288-C292 PolarHBondContact O-N 2.99Å; R288-C292 PolarHBondContact O-SG 3.43Å; R288-C292 VanDerWaalsContact O-SG 3.39Å; F289-C292 VanDerWaalsContact O-CB 3.32Å; F289-C292 WeakPolarHBondContact O-CB 3.38Å; F289-C292 PolarHBondContact O-N 2.79Å; F289-C292 VanDerWaalsContact O-N 3.11Å; Q290-C292 VanDerWaalsContact C-N 3.34Å; Q290-C292 PolarHBondContact O-N 3.49Å; C292-V295 WeakPolarHBondContact O-CG2 3.13Å; C292-M297 HydrophobicContact CB-CB 4.37Å; C292-M297 HydrophobicContact CB-CG 4.31Å; C292-M297 HydrophobicContact CB-SD 3.61Å; C292-M297 WeakPolarHBondContact O-CB 3.45Å; C292-M297 VanDerWaalsContact O-CG 3.25Å; C292-M297 WeakPolarHBondContact O-CG 3.32Å; C292-M297 PolarHBondContact O-N 2.83Å
293	L	97.3	Very high	93.9	Very high	66 Å²	66	64.5 Å²	64.5	35%	0.346	33%	0.325	S	S	.	.	H	α-helix	trans	-65	-45.7	177.8	-62.9	171.6	0	0	0	111.3	F256 F289 Q290 V295 G296	F256-L293 HydrophobicContact CE2-CD2 3.96Å; F256-L293 HydrophobicContact CZ-CD2 4.32Å; F289-L293 HydrophobicContact CD1-CD1 4.24Å; F289-L293 HydrophobicContact CE1-CD1 3.88Å; F289-L293 HydrophobicContact CE1-CG 4.48Å; F289-L293 HydrophobicContact CZ-CD1 4.22Å; F289-L293 HydrophobicContact CZ-CD2 4.36Å; F289-L293 HydrophobicContact CZ-CG 4.4Å; F289-L293 PolarHBondContact O-N 3.38Å; Q290-L293 PolarHBondContact O-N 2.88Å; L293-V295 VanDerWaalsContact C-N 3.28Å; L293-V295 PolarHBondContact O-N 3.31Å; L293-G296 WeakPolarHBondContact O-CA 3.43Å; L293-G296 PolarHBondContact O-N 2.75Å
294	A	96.7	Very high	92.6	Very high	88 Å²	88	56.5 Å²	56.5	73%	0.727	30%	0.302	S	S	*	.	H	α-helix	trans	-64.7	-23.4	-177.7	0	0	0	0	0	114.7	Q290 G296	Q290-A294 WeakPolarHBondContact O-CB 3.12Å; Q290-A294 PolarHBondContact O-N 3.11Å; A294-G296 VanDerWaalsContact C-N 3.32Å
295	V	95.9	Very high	90.7	Very high	46 Å²	46	61 Å²	61	28%	0.279	32%	0.324	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.3	5.3	170.6	-56.1	0	0	0	0	113.5	A233 V234 V246 K291 C292 L293 M297	A233-V295 HydrophobicContact CB-CB 4Å; A233-V295 HydrophobicContact CB-CG1 4.02Å; A233-V295 HydrophobicContact CB-CG2 4.16Å; V234-V295 HydrophobicContact CG2-CG2 3.61Å; V246-V295 HydrophobicContact CG1-CB 4.36Å; V246-V295 HydrophobicContact CG1-CG2 3.96Å; V246-V295 HydrophobicContact CG2-CG2 4.44Å; V246-V295 WeakPolarHBondContact CG2-O 3.38Å; K291-V295 HydrophobicContact CG-CG1 4.44Å; K291-V295 WeakPolarHBondContact O-CG1 3.36Å; K291-V295 WeakPolarHBondContact O-CG2 3.44Å; K291-V295 PolarHBondContact O-N 3.36Å; C292-V295 WeakPolarHBondContact O-CG2 3.13Å; L293-V295 VanDerWaalsContact C-N 3.28Å; L293-V295 PolarHBondContact O-N 3.31Å; V295-M297 HydrophobicContact CG2-CG 4.2Å
296	G	93.8	Very high	88.6	Confident	41 Å²	41	60.9 Å²	60.9	42%	0.423	34%	0.335	S	S	.	.	T	Hydrogen-bonded Turn	trans	92.5	21.7	175.9	0	0	0	0	0	116	V246 L293 A294 V298	V246-G296 VanDerWaalsContact CG2-O 3.3Å; V246-G296 WeakPolarHBondContact CG2-O 3.48Å; L293-G296 WeakPolarHBondContact O-CA 3.43Å; L293-G296 PolarHBondContact O-N 2.75Å; A294-G296 VanDerWaalsContact C-N 3.32Å; G296-V298 PolarHBondContact O-N 3.35Å
297	M	96.6	Very high	86.6	Confident	4 Å²	4	64.9 Å²	64.9	2%	0.02	36%	0.357	C	S	.	.			trans	-71.5	113.3	175.6	-63.5	-173.6	75.3	0	0	110.7	V234 Y244 V246 T248 F256 C292 V295	V234-M297 HydrophobicContact CG2-SD 3.95Å; Y244-M297 HydrophobicContact CD2-CE 3.68Å; Y244-M297 HydrophobicContact CG-CE 4.34Å; Y244-M297 CarbonylContact O-C 3.48Å; Y244-M297 WeakPolarHBondContact O-CA 3.49Å; V246-M297 HydrophobicContact CB-CG 4.11Å; V246-M297 HydrophobicContact CG2-CB 4.48Å; V246-M297 HydrophobicContact CG2-CG 3.83Å; T248-M297 HydrophobicContact CG2-CE 4.29Å; T248-M297 HydrophobicContact CG2-CG 4.47Å; T248-M297 HydrophobicContact CG2-SD 3.92Å; F256-M297 HydrophobicContact CB-CE 3.7Å; F256-M297 HydrophobicContact CB-SD 4.39Å; F256-M297 HydrophobicContact CD1-CB 4.41Å; F256-M297 HydrophobicContact CD1-CE 3.92Å; F256-M297 HydrophobicContact CD2-CB 4.06Å; F256-M297 HydrophobicContact CD2-CE 4.26Å; F256-M297 HydrophobicContact CD2-SD 4.22Å; F256-M297 HydrophobicContact CE1-CB 4.07Å; F256-M297 HydrophobicContact CE2-CB 3.69Å; F256-M297 HydrophobicContact CG-CB 4.4Å; F256-M297 HydrophobicContact CG-CE 3.7Å; F256-M297 HydrophobicContact CG-SD 4.25Å; F256-M297 HydrophobicContact CZ-CB 3.7Å; F256-M297 WeakPolarHBondContact CZ-O 3.42Å; C292-M297 HydrophobicContact CB-CB 4.37Å; C292-M297 HydrophobicContact CB-CG 4.31Å; C292-M297 HydrophobicContact CB-SD 3.61Å; C292-M297 WeakPolarHBondContact O-CB 3.45Å; C292-M297 VanDerWaalsContact O-CG 3.25Å; C292-M297 WeakPolarHBondContact O-CG 3.32Å; C292-M297 PolarHBondContact O-N 2.83Å; V295-M297 HydrophobicContact CG2-CG 4.2Å
298	V	90.6	Very high	84.2	Confident	58 Å²	58	74.5 Å²	74.5	35%	0.352	40%	0.399	S	S	.	.			trans	-77.6	120.4	-173.7	-174.7	0	0	0	0	110.5	Y244 F256 G296 E300 V301	Y244-V298 PolarHBondContact O-N 3.36Å; F256-V298 WeakPolarHBondContact CE1-O 3.49Å; G296-V298 PolarHBondContact O-N 3.35Å; V298-E300 VanDerWaalsContact C-N 3.34Å; V298-E300 HydrophobicContact CG1-CB 4.11Å; V298-E300 VanDerWaalsContact CG1-OE2 3.24Å; V298-E300 WeakPolarHBondContact CG1-OE2 3.49Å; V298-V301 HydrophobicContact CB-CG1 4.47Å; V298-V301 HydrophobicContact CB-CG2 4.14Å; V298-V301 HydrophobicContact CG1-CG1 3.99Å; V298-V301 HydrophobicContact CG1-CG2 4.44Å
299	K	89.4	Confident	81.9	Confident	80 Å²	80	76.8 Å²	76.8	35%	0.348	43%	0.425	S	S	.	.	S	Bend	trans	-69.3	-35.7	-177.8	175.4	-178.2	-174	-177.1	0	111.1	F256 V260 N263 V301 V302	F256-K299 HydrophobicContact CZ-CB 4.35Å; V260-K299 HydrophobicContact CB-CG 4.33Å; V260-K299 HydrophobicContact CG1-CD 4.44Å; V260-K299 HydrophobicContact CG1-CG 3.56Å; V260-K299 HydrophobicContact CG2-CB 4.38Å; V260-K299 HydrophobicContact CG2-CG 3.81Å; N263-K299 PolarHBondContact OD1-NZ 2.92Å; K299-V301 VanDerWaalsContact C-N 3.3Å; K299-V301 PolarHBondContact O-N 2.98Å; K299-V302 WeakPolarHBondContact O-CB 3.46Å; K299-V302 WeakPolarHBondContact O-CG2 3.43Å; K299-V302 PolarHBondContact O-N 3.45Å; K299-V302 VanDerWaalsContact O-N 3.13Å
300	E	83.3	Confident	79.5	Confident	151 Å²	151	86.4 Å²	86.4	71%	0.706	46%	0.461	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.7	-25.5	-168.9	-63.8	57.7	-125.6	0	0	112.3	V298 V302	V298-E300 VanDerWaalsContact C-N 3.34Å; V298-E300 HydrophobicContact CG1-CB 4.11Å; V298-E300 VanDerWaalsContact CG1-OE2 3.24Å; V298-E300 WeakPolarHBondContact CG1-OE2 3.49Å; E300-V302 VanDerWaalsContact C-N 3.32Å
301	V	84.5	Confident	77.3	Confident	73 Å²	73	94.3 Å²	94.3	44%	0.442	49%	0.487	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.6	2	178.1	-49.4	0	0	0	0	113.1	Y244 V298 K299 R303	Y244-V301 HydrophobicContact CD1-CG2 3.93Å; V298-V301 HydrophobicContact CB-CG1 4.47Å; V298-V301 HydrophobicContact CB-CG2 4.14Å; V298-V301 HydrophobicContact CG1-CG1 3.99Å; V298-V301 HydrophobicContact CG1-CG2 4.44Å; K299-V301 VanDerWaalsContact C-N 3.3Å; K299-V301 PolarHBondContact O-N 2.98Å; V301-R303 PolarHBondContact O-N 2.71Å
302	V	85.4	Confident	75.1	Confident	10 Å²	10	94.5 Å²	94.5	6%	0.061	51%	0.51	C	S	.	.	S	Bend	trans	-79.4	100.7	169.5	-174.7	0	0	0	0	109.5	Y244 F256 K257 V260 Q261 K299 E300 T304	Y244-V302 HydrophobicContact CD1-CB 4.49Å; Y244-V302 HydrophobicContact CD1-CG2 3.57Å; Y244-V302 HydrophobicContact CE1-CB 4.24Å; Y244-V302 HydrophobicContact CE1-CG1 4.46Å; Y244-V302 HydrophobicContact CE1-CG2 3.64Å; Y244-V302 HydrophobicContact CG-CG2 4.33Å; F256-V302 HydrophobicContact CD1-CG2 3.79Å; F256-V302 HydrophobicContact CE1-CG2 3.58Å; K257-V302 HydrophobicContact CB-CG1 4.5Å; K257-V302 HydrophobicContact CG-CG1 3.93Å; V260-V302 HydrophobicContact CB-CB 4.16Å; V260-V302 HydrophobicContact CB-CG1 4.09Å; V260-V302 HydrophobicContact CB-CG2 4.04Å; V260-V302 HydrophobicContact CG1-CB 3.71Å; V260-V302 HydrophobicContact CG1-CG1 3.98Å; V260-V302 HydrophobicContact CG1-CG2 3.96Å; V260-V302 HydrophobicContact CG2-CG2 4.18Å; Q261-V302 HydrophobicContact CG-CG1 3.91Å; K299-V302 WeakPolarHBondContact O-CB 3.46Å; K299-V302 WeakPolarHBondContact O-CG2 3.43Å; K299-V302 PolarHBondContact O-N 3.45Å; K299-V302 VanDerWaalsContact O-N 3.13Å; E300-V302 VanDerWaalsContact C-N 3.32Å; V302-T304 PolarHBondContact O-N 2.98Å; V302-T304 VanDerWaalsContact O-N 3.16Å
303	R	79.4	Confident	72.8	Confident	135 Å²	135	105.1 Å²	105.1	51%	0.509	55%	0.55	S	S	.	*			trans	-55.2	120.3	170.8	-73.4	174.4	169.4	70.9	-1.5	110.8	Q261 V301	Q261-R303 PolarHBondContact NE2-O 3.49Å; V301-R303 PolarHBondContact O-N 2.71Å
304	T	68.8	Low	70.2	Confident	64 Å²	64	109.4 Å²	109.4	39%	0.393	57%	0.572	S	S	.	*			trans	-68.8	151.9	161.8	48.5	0	0	0	0	109.8	V302 S306 L307	V302-T304 PolarHBondContact O-N 2.98Å; V302-T304 VanDerWaalsContact O-N 3.16Å; T304-S306 PolarHBondContact O-N 3.05Å; T304-S306 VanDerWaalsContact O-N 3.11Å; T304-S306 PolarHBondContact OG1-OG 2.95Å; T304-S306 VanDerWaalsContact OG1-OG 3.09Å; T304-L307 PolarHBondContact O-N 2.93Å
305	D	58	Low	67.5	Low	111 Å²	111	110.4 Å²	110.4	59%	0.594	57%	0.572	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.3	-3.9	-172.3	-59.3	-50.8	0	0	0	113.5	K257 Q261 L307	K257-D305 IonicContact NZ-OD1 2.62Å; K257-D305 PolarHBondContact NZ-OD1 3.35Å; Q261-D305 PolarHBondContact NE2-OD1 3.11Å; Q261-D305 PolarHBondContact NE2-OD2 3.04Å; D305-L307 VanDerWaalsContact C-N 3.3Å; D305-L307 PolarHBondContact O-N 3.04Å
306	S	53.9	Low	64.9	Low	101 Å²	101	113.7 Å²	113.7	71%	0.706	60%	0.597	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.8	-17.5	168.9	43.9	0	0	0	0	114.5	T304	T304-S306 PolarHBondContact O-N 3.05Å; T304-S306 VanDerWaalsContact O-N 3.11Å; T304-S306 PolarHBondContact OG1-OG 2.95Å; T304-S306 VanDerWaalsContact OG1-OG 3.09Å
307	L	57.2	Low	62.2	Low	125 Å²	125	121 Å²	121	65%	0.654	62%	0.617	S	S	*	*			trans	-106.5	60.2	178.3	-65	179.7	0	0	0	112.1	T304 D305 G309	T304-L307 PolarHBondContact O-N 2.93Å; D305-L307 VanDerWaalsContact C-N 3.3Å; D305-L307 PolarHBondContact O-N 3.04Å; L307-G309 PolarHBondContact O-N 3.22Å
308	K	47.4	Very low	59.6	Low	210 Å²	210	126 Å²	126	91%	0.913	65%	0.65	S	S	*	*			trans	-80.3	50.5	-171.9	-154.7	174.7	-175.5	179.4	0	113.8
309	G	50.3	Low	57	Low	59 Å²	59	132.5 Å²	132.5	61%	0.608	67%	0.673	S	S	*	*	S	Bend	trans	-160.4	133.4	179.9	0	0	0	0	0	115.3	L307	L307-G309 PolarHBondContact O-N 3.22Å
310	R	46.8	Very low	54.6	Low	235 Å²	235	133.5 Å²	133.5	89%	0.887	69%	0.686	S	S	*	*			trans	72.1	122.4	176.9	-49.6	-176.4	-165.4	-129.8	1.1	116.6
311	R	51.5	Low	52.6	Low	249 Å²	249	132.1 Å²	132.1	94%	0.94	69%	0.687	S	S	*	*			trans	-97.6	157	169.5	-49.8	-178.3	-164.5	-162.6	5.5	109.3
312	G	51.9	Low	50.4	Low	78 Å²	78	134.7 Å²	134.7	80%	0.804	70%	0.695	S	S	*	*	S	Bend	trans	95.5	14.2	151.5	0	0	0	0	0	120.3
313	R	50	Low	48.1	Very low	224 Å²	224	142.3 Å²	142.3	85%	0.845	74%	0.735	S	S	*	*			trans	-144.3	145.9	165.1	-161.4	166.9	-74.2	-124.7	1.7	111.9
314	L	43.3	Very low	46.3	Very low	155 Å²	155	139.7 Å²	139.7	81%	0.812	73%	0.734	S	S	*	*			trans	-74.6	131.6	169.3	-82.3	160	0	0	0	109.4	S316	L314-S316 PolarHBondContact O-N 3.4Å
315	P	40.3	Very low	44.9	Very low	109 Å²	109	142.5 Å²	142.5	71%	0.708	75%	0.753	S	S	*	*			trans	-71.8	113.1	173.4	-16.6	31.4	0	0	0	111.2	K317	P315-K317 PolarHBondContact O-N 2.81Å
316	S	40.8	Very low	44.2	Very low	116 Å²	116	141.2 Å²	141.2	81%	0.811	76%	0.758	S	S	*	*	S	Bend	trans	-77	98.7	169.8	51.5	0	0	0	0	110.1	L314	L314-S316 PolarHBondContact O-N 3.4Å
317	K	36.4	Very low	44.1	Very low	194 Å²	194	142.5 Å²	142.5	84%	0.843	76%	0.764	S	S	*	*	S	Bend	trans	57.9	125.3	-172.4	-73.9	-174.9	173.3	-177.9	0	114.5	P315 K319	P315-K317 PolarHBondContact O-N 2.81Å; K317-K319 PolarHBondContact O-N 3.42Å; K317-K319 VanDerWaalsContact O-N 3.12Å
318	P	43	Very low	44.1	Very low	110 Å²	110	139.6 Å²	139.6	71%	0.714	75%	0.752	S	S	*	*			trans	-72.6	106.8	173.8	29.8	-32.5	0	0	0	110.3	V320	P318-V320 PolarHBondContact O-N 3.41Å; P318-V320 VanDerWaalsContact O-N 3.14Å
319	K	35.4	Very low	45.3	Very low	193 Å²	193	132.8 Å²	132.8	84%	0.839	73%	0.73	S	S	*	*			trans	-71.6	101.1	154.1	-174.5	172.9	-176.9	177	0	106.5	K317 V321	K317-K319 PolarHBondContact O-N 3.42Å; K317-K319 VanDerWaalsContact O-N 3.12Å; K319-V321 PolarHBondContact O-N 3.15Å
320	V	39.1	Very low	46.2	Very low	101 Å²	101	132.3 Å²	132.3	61%	0.612	72%	0.717	S	S	*	*			trans	-64.6	105.5	177.7	176.4	0	0	0	0	108.1	P318 Q322	P318-V320 PolarHBondContact O-N 3.41Å; P318-V320 VanDerWaalsContact O-N 3.14Å; V320-Q322 HydrophobicContact CG1-CB 3.61Å
321	V	41.3	Very low	47.3	Very low	122 Å²	122	126.4 Å²	126.4	74%	0.739	71%	0.707	S	S	*	*			trans	-96.9	94.8	160.4	-178.2	0	0	0	0	105.3	K319	K319-V321 PolarHBondContact O-N 3.15Å
322	Q	38.7	Very low	49	Very low	128 Å²	128	117.3 Å²	117.3	60%	0.598	68%	0.681	S	S	*	*			trans	-116.3	131.3	172.8	-177.3	178.6	20.5	0	0	104.5	V320 T324	V320-Q322 HydrophobicContact CG1-CB 3.61Å; Q322-T324 HydrophobicContact CG-CG2 4.27Å; Q322-T324 WeakPolarHBondContact CG-OG1 3.41Å; Q322-T324 PolarHBondContact O-N 3.22Å; Q322-T324 PolarHBondContact O-OG1 3.3Å
323	D	37.3	Very low	50.8	Low	169 Å²	169	113.8 Å²	113.8	90%	0.904	64%	0.643	S	S	*	*	S	Bend	trans	-77.1	61.6	179	-66.1	-58.8	0	0	0	110.6
324	T	41.1	Very low	52.9	Low	81 Å²	81	103.6 Å²	103.6	50%	0.497	61%	0.606	S	S	.	*	S	Bend	trans	-112.2	158.3	169.1	28.2	0	0	0	0	108.6	Q322 A326	Q322-T324 HydrophobicContact CG-CG2 4.27Å; Q322-T324 WeakPolarHBondContact CG-OG1 3.41Å; Q322-T324 PolarHBondContact O-N 3.22Å; Q322-T324 PolarHBondContact O-OG1 3.3Å; T324-A326 PolarHBondContact O-N 3.39Å
325	P	39.8	Very low	55.2	Low	122 Å²	122	98.9 Å²	98.9	79%	0.792	59%	0.589	S	S	*	*	S	Bend	trans	-49.6	142.7	169.7	-25.4	34.9	0	0	0	110.9
326	A	43.4	Very low	57.8	Low	84 Å²	84	95.6 Å²	95.6	69%	0.694	57%	0.568	S	S	*	*			trans	-51.4	137	-173	0	0	0	0	0	111.1	T324 V328	T324-A326 PolarHBondContact O-N 3.39Å; A326-V328 PolarHBondContact O-N 2.83Å
327	P	50.4	Low	60.5	Low	129 Å²	129	90.1 Å²	90.1	84%	0.838	53%	0.53	S	S	*	.			trans	-59.2	109.5	-171.7	23.5	-34	0	0	0	109.9	S329	P327-S329 PolarHBondContact O-N 3Å
328	V	57.8	Low	63.3	Low	64 Å²	64	82.1 Å²	82.1	39%	0.388	50%	0.498	S	S	.	.			trans	-59.3	125	-178.8	-72.6	0	0	0	0	109.2	A326 M333	A326-V328 PolarHBondContact O-N 2.83Å; V328-M333 HydrophobicContact CG2-CB 4.31Å; V328-M333 HydrophobicContact CG2-CE 3.81Å
329	S	73.4	Confident	65.8	Low	66 Å²	66	84.3 Å²	84.3	46%	0.462	49%	0.492	S	S	.	.			trans	-53.9	142.2	173.6	174.2	0	0	0	0	109.3	P327 V331 S332 M333	P327-S329 PolarHBondContact O-N 3Å; S329-V331 PolarHBondContact O-N 3.38Å; S329-V331 VanDerWaalsContact O-N 3.11Å; S329-S332 CarbonylContact O-C 3.58Å; S329-S332 WeakPolarHBondContact O-CA 3.23Å; S329-S332 VanDerWaalsContact O-CB 3.32Å; S329-S332 WeakPolarHBondContact O-CB 3.4Å; S329-S332 PolarHBondContact O-N 3.47Å; S329-M333 PolarHBondContact O-N 3.38Å
330	P	68.4	Low	68.6	Low	50 Å²	50	75.3 Å²	75.3	33%	0.325	45%	0.453	S	S	.	.	H	α-helix	trans	-48.5	-40.5	175.7	-31.5	37.5	0	0	0	113.4	S332 M333 I334 C503	P330-S332 VanDerWaalsContact C-N 3.35Å; P330-S332 PolarHBondContact O-N 3.41Å; P330-M333 PolarHBondContact O-N 3.14Å; P330-I334 WeakPolarHBondContact O-CG1 3.16Å; P330-I334 PolarHBondContact O-N 2.86Å; P330-C503 HydrophobicContact CB-CB 4.32Å
331	V	71	Confident	71.3	Confident	111 Å²	111	70.5 Å²	70.5	67%	0.673	42%	0.424	S	S	*	.	H	α-helix	trans	-62.3	-40.1	175.2	-175.7	0	0	0	0	111.9	S329 A335	S329-V331 PolarHBondContact O-N 3.38Å; S329-V331 VanDerWaalsContact O-N 3.11Å; V331-A335 VanDerWaalsContact O-CB 3.29Å; V331-A335 WeakPolarHBondContact O-CB 3.46Å; V331-A335 PolarHBondContact O-N 2.97Å
332	S	85.4	Confident	73.7	Confident	57 Å²	57	68.7 Å²	68.7	40%	0.399	41%	0.414	S	S	.	.	H	α-helix	trans	-71.6	-31.6	176.9	-171.4	0	0	0	0	112.8	S329 P330 S336	S329-S332 CarbonylContact O-C 3.58Å; S329-S332 WeakPolarHBondContact O-CA 3.23Å; S329-S332 VanDerWaalsContact O-CB 3.32Å; S329-S332 WeakPolarHBondContact O-CB 3.4Å; S329-S332 PolarHBondContact O-N 3.47Å; P330-S332 VanDerWaalsContact C-N 3.35Å; P330-S332 PolarHBondContact O-N 3.41Å; S332-S336 WeakPolarHBondContact O-CB 3.16Å; S332-S336 PolarHBondContact O-N 3.35Å; S332-S336 PolarHBondContact O-OG 3.49Å
333	M	91.3	Very high	76.2	Confident	4 Å²	4	68.6 Å²	68.6	2%	0.02	41%	0.413	C	S	.	.	H	α-helix	trans	-67.8	-51.3	173.6	175.8	165.1	-83.2	0	0	110	V328 S329 P330 A335 S336 L337 F496 Q499 L500 C503	V328-M333 HydrophobicContact CG2-CB 4.31Å; V328-M333 HydrophobicContact CG2-CE 3.81Å; S329-M333 PolarHBondContact O-N 3.38Å; P330-M333 PolarHBondContact O-N 3.14Å; M333-A335 PolarHBondContact O-N 2.97Å; M333-S336 WeakPolarHBondContact O-CB 3.38Å; M333-S336 PolarHBondContact O-N 3.4Å; M333-S336 VanDerWaalsContact O-N 3.07Å; M333-L337 HydrophobicContact CG-CD1 4.2Å; M333-L337 HydrophobicContact CG-CG 4.46Å; M333-L337 WeakPolarHBondContact O-CG 3.37Å; M333-L337 PolarHBondContact O-N 3.39Å; M333-F496 HydrophobicContact CE-CE2 3.77Å; M333-F496 HydrophobicContact SD-CE2 4.45Å; M333-Q499 HydrophobicContact CE-CG 4.3Å; M333-Q499 HydrophobicContact SD-CG 4.11Å; M333-L500 HydrophobicContact SD-CD2 3.87Å; M333-C503 VanDerWaalsContact SD-SG 3.69Å
334	I	92.4	Very high	78.9	Confident	11 Å²	11	61.2 Å²	61.2	6%	0.056	37%	0.374	C	S	.	.	H	α-helix	trans	-60.5	-47.2	179.3	-64.9	177.3	0	0	0	111.2	P330 S336 L337 V338 E470 C503 H507	P330-I334 WeakPolarHBondContact O-CG1 3.16Å; P330-I334 PolarHBondContact O-N 2.86Å; I334-S336 PolarHBondContact O-N 2.9Å; I334-S336 VanDerWaalsContact O-N 3.13Å; I334-L337 PolarHBondContact O-N 3.41Å; I334-V338 HydrophobicContact CG2-CG2 4.27Å; I334-V338 WeakPolarHBondContact O-CG2 3.27Å; I334-V338 PolarHBondContact O-N 3.49Å; I334-E470 HydrophobicContact CG2-CB 3.61Å; I334-E470 HydrophobicContact CG2-CG 3.49Å; I334-E470 VanDerWaalsContact CG2-CG 3.49Å; I334-C503 HydrophobicContact CD1-CB 4.13Å; I334-C503 HydrophobicContact CG1-CB 4.11Å; I334-H507 HydrophobicContact CD1-CB 3.66Å
335	A	92.6	Very high	81.3	Confident	55 Å²	55	59.1 Å²	59.1	46%	0.455	36%	0.36	S	S	.	.	H	α-helix	trans	-61.3	-23.4	177	0	0	0	0	0	113.8	V331 M333 R339	V331-A335 VanDerWaalsContact O-CB 3.29Å; V331-A335 WeakPolarHBondContact O-CB 3.46Å; V331-A335 PolarHBondContact O-N 2.97Å; M333-A335 PolarHBondContact O-N 2.97Å; A335-R339 WeakPolarHBondContact O-CB 3.46Å; A335-R339 PolarHBondContact O-N 3.17Å
336	S	94.9	Very high	83.7	Confident	40 Å²	40	54.8 Å²	54.8	28%	0.28	33%	0.332	S	S	.	.	H	α-helix	trans	-83.1	-38.3	172.7	-56.4	0	0	0	0	112.1	S332 M333 I334 R339 A340 P394	S332-S336 WeakPolarHBondContact O-CB 3.16Å; S332-S336 PolarHBondContact O-N 3.35Å; S332-S336 PolarHBondContact O-OG 3.49Å; M333-S336 WeakPolarHBondContact O-CB 3.38Å; M333-S336 PolarHBondContact O-N 3.4Å; M333-S336 VanDerWaalsContact O-N 3.07Å; I334-S336 PolarHBondContact O-N 2.9Å; I334-S336 VanDerWaalsContact O-N 3.13Å; S336-R339 PolarHBondContact O-N 3.26Å; S336-A340 PolarHBondContact O-N 2.77Å; S336-P394 VanDerWaalsContact CB-CG 3.42Å
337	L	96.3	Very high	85.8	Confident	2 Å²	2	53.9 Å²	53.9	1%	0.01	32%	0.321	C	S	.	.	H	α-helix	trans	-63.2	-46.2	174.2	-66.8	175.1	0	0	0	111.6	M333 I334 A340 Q341 I393 A473 A477 L500	M333-L337 HydrophobicContact CG-CD1 4.2Å; M333-L337 HydrophobicContact CG-CG 4.46Å; M333-L337 WeakPolarHBondContact O-CG 3.37Å; M333-L337 PolarHBondContact O-N 3.39Å; I334-L337 PolarHBondContact O-N 3.41Å; L337-A340 PolarHBondContact O-N 3.35Å; L337-Q341 VanDerWaalsContact O-CB 3.3Å; L337-Q341 WeakPolarHBondContact O-CB 3.44Å; L337-Q341 PolarHBondContact O-N 3.04Å; L337-I393 HydrophobicContact CD2-CG1 4.48Å; L337-I393 HydrophobicContact CD2-CG2 3.93Å; L337-A473 HydrophobicContact CB-CB 3.99Å; L337-A477 HydrophobicContact CD1-CB 4.22Å; L337-A477 HydrophobicContact CD2-CB 3.97Å; L337-L500 HydrophobicContact CD1-CD2 3.72Å
338	V	95.8	Very high	87.5	Confident	26 Å²	26	55.2 Å²	55.2	16%	0.158	32%	0.319	C	S	.	.	H	α-helix	trans	-58.9	-48.1	175.1	173.4	0	0	0	0	110	I334 A340 Q341 T342 E469 E470 A473	I334-V338 HydrophobicContact CG2-CG2 4.27Å; I334-V338 WeakPolarHBondContact O-CG2 3.27Å; I334-V338 PolarHBondContact O-N 3.49Å; V338-A340 PolarHBondContact O-N 3.23Å; V338-Q341 CarbonylContact O-C 3.54Å; V338-Q341 WeakPolarHBondContact O-CA 3.46Å; V338-Q341 WeakPolarHBondContact O-CB 3.48Å; V338-Q341 PolarHBondContact O-N 3.04Å; V338-T342 PolarHBondContact O-N 2.89Å; V338-T342 PolarHBondContact O-OG1 3.39Å; V338-T342 VanDerWaalsContact O-OG1 3.04Å; V338-E469 HydrophobicContact CG1-CB 4.31Å; V338-E470 HydrophobicContact CG2-CB 4.37Å; V338-E470 HydrophobicContact CG2-CG 4.02Å; V338-A473 HydrophobicContact CG2-CB 3.98Å
339	R	95.3	Very high	88.9	Confident	155 Å²	155	57.7 Å²	57.7	59%	0.585	34%	0.339	S	S	*	.	H	α-helix	trans	-55.6	-52.1	177.2	-175.2	-171	-49.8	-145.4	-0.5	112.3	A335 S336 Q341 T342 E343	A335-R339 WeakPolarHBondContact O-CB 3.46Å; A335-R339 PolarHBondContact O-N 3.17Å; S336-R339 PolarHBondContact O-N 3.26Å; R339-Q341 PolarHBondContact O-N 3.48Å; R339-T342 PolarHBondContact O-N 3.05Å; R339-E343 VanDerWaalsContact CD-OE1 3.29Å; R339-E343 WeakPolarHBondContact CD-OE1 3.22Å; R339-E343 HydrophobicContact CG-CG 4.22Å; R339-E343 WeakPolarHBondContact CG-OE1 3.43Å; R339-E343 WeakPolarHBondContact O-CB 3.45Å; R339-E343 WeakPolarHBondContact O-CG 3.4Å; R339-E343 PolarHBondContact O-N 2.64Å
340	A	95.8	Very high	89.6	Confident	4 Å²	4	57 Å²	57	3%	0.033	34%	0.338	C	S	.	.	H	α-helix	trans	-59.3	-38.5	176.6	0	0	0	0	0	111.6	S336 L337 V338 S344 D392	S336-A340 PolarHBondContact O-N 2.77Å; L337-A340 PolarHBondContact O-N 3.35Å; V338-A340 PolarHBondContact O-N 3.23Å; A340-S344 WeakPolarHBondContact O-CB 3.26Å; A340-S344 PolarHBondContact O-N 3.02Å; A340-S344 PolarHBondContact O-OG 3.44Å; A340-D392 HydrophobicContact CB-CB 3.78Å
341	Q	94	Very high	90.8	Very high	0 Å²	0	56.2 Å²	56.2	0%	0	33%	0.331	C	S	.	.	H	α-helix	trans	-65.7	-41.8	177.6	-172.2	52.1	76.9	0	0	112.3	L337 V338 R339 S344 N345 F472 A473	L337-Q341 VanDerWaalsContact O-CB 3.3Å; L337-Q341 WeakPolarHBondContact O-CB 3.44Å; L337-Q341 PolarHBondContact O-N 3.04Å; V338-Q341 CarbonylContact O-C 3.54Å; V338-Q341 WeakPolarHBondContact O-CA 3.46Å; V338-Q341 WeakPolarHBondContact O-CB 3.48Å; V338-Q341 PolarHBondContact O-N 3.04Å; R339-Q341 PolarHBondContact O-N 3.48Å; Q341-S344 PolarHBondContact O-OG 3Å; Q341-N345 PolarHBondContact NE2-ND2 2.85Å; Q341-N345 PolarHBondContact NE2-OD1 3.16Å; Q341-N345 PolarHBondContact O-ND2 3.21Å; Q341-F472 HydrophobicContact CG-CD1 4.13Å; Q341-F472 HydrophobicContact CG-CE1 4.12Å; Q341-A473 HydrophobicContact CB-CB 4.05Å; Q341-A473 HydrophobicContact CG-CB 4.35Å
342	T	92.7	Very high	91.7	Very high	85 Å²	85	53.3 Å²	53.3	52%	0.521	31%	0.311	S	S	.	.	H	α-helix	trans	-68.6	-49.4	174.8	-49	0	0	0	0	111.7	V338 R339 S344 N345	V338-T342 PolarHBondContact O-N 2.89Å; V338-T342 PolarHBondContact O-OG1 3.39Å; V338-T342 VanDerWaalsContact O-OG1 3.04Å; R339-T342 PolarHBondContact O-N 3.05Å; T342-S344 PolarHBondContact O-N 3.48Å; T342-S344 VanDerWaalsContact O-N 3.1Å; T342-N345 PolarHBondContact O-N 3.03Å; T342-N345 VanDerWaalsContact O-N 3.1Å
343	E	92.1	Very high	92	Very high	126 Å²	126	55.7 Å²	55.7	59%	0.589	31%	0.312	S	S	*	.	H	α-helix	trans	-66.7	-10.1	-178.3	-71.1	176.8	-170.7	0	0	114.1	R339	R339-E343 VanDerWaalsContact CD-OE1 3.29Å; R339-E343 WeakPolarHBondContact CD-OE1 3.22Å; R339-E343 HydrophobicContact CG-CG 4.22Å; R339-E343 WeakPolarHBondContact CG-OE1 3.43Å; R339-E343 WeakPolarHBondContact O-CB 3.45Å; R339-E343 WeakPolarHBondContact O-CG 3.4Å; R339-E343 PolarHBondContact O-N 2.64Å
344	S	93	Very high	91.8	Very high	13 Å²	13	60.3 Å²	60.3	9%	0.091	35%	0.345	C	S	.	.	T	Hydrogen-bonded Turn	trans	-111.5	7.7	175.6	67.1	0	0	0	0	114.3	A340 Q341 T342 R419	A340-S344 WeakPolarHBondContact O-CB 3.26Å; A340-S344 PolarHBondContact O-N 3.02Å; A340-S344 PolarHBondContact O-OG 3.44Å; Q341-S344 PolarHBondContact O-OG 3Å; T342-S344 PolarHBondContact O-N 3.48Å; T342-S344 VanDerWaalsContact O-N 3.1Å; S344-R419 PolarHBondContact O-NH2 2.88Å; S344-R419 PolarHBondContact OG-NH1 3.06Å; S344-R419 PolarHBondContact OG-NH2 3.14Å
345	N	91.3	Very high	91.3	Very high	37 Å²	37	63.7 Å²	63.7	20%	0.198	36%	0.359	C	S	.	.	S	Bend	trans	-104.1	151.9	168.5	-75.9	-22.9	0	0	0	109.6	Q341 T342 R419 R423	Q341-N345 PolarHBondContact NE2-ND2 2.85Å; Q341-N345 PolarHBondContact NE2-OD1 3.16Å; Q341-N345 PolarHBondContact O-ND2 3.21Å; T342-N345 PolarHBondContact O-N 3.03Å; T342-N345 VanDerWaalsContact O-N 3.1Å; N345-R419 PolarHBondContact OD1-NH2 3.4Å; N345-R423 PolarHBondContact OD1-NH1 2.92Å
346	P	90.3	Very high	91	Very high	31 Å²	31	64.2 Å²	64.2	20%	0.201	35%	0.35	C	S	.	.			trans	-65.5	144.2	175.4	29.4	-36.3	0	0	0	110.6	L351 I432	P346-L351 HydrophobicContact CB-CD2 4.25Å; P346-L351 HydrophobicContact CG-CD2 4.07Å; P346-I432 HydrophobicContact CG-CG2 4.14Å
347	S	87.4	Confident	90.5	Very high	66 Å²	66	66 Å²	66	46%	0.462	36%	0.359	S	S	.	.			trans	-73.4	154.9	170.9	60	0	0	0	0	110.8	S349 A350	S347-S349 PolarHBondContact O-N 3.33Å; S347-S349 VanDerWaalsContact O-N 3.13Å; S347-S349 PolarHBondContact OG-OG 3.14Å; S347-A350 WeakPolarHBondContact O-CA 3.5Å; S347-A350 PolarHBondContact O-N 3.42Å; S347-A350 WeakPolarHBondContact OG-CB 3.06Å
348	I	86	Confident	89.7	Confident	157 Å²	157	72.1 Å²	72.1	81%	0.805	39%	0.388	S	S	*	.	G	3₁₀ helix	trans	-54.7	-34.9	177.1	-59	171.4	0	0	0	111.3	A350	I348-A350 VanDerWaalsContact C-N 3.27Å; I348-A350 PolarHBondContact O-N 2.97Å
349	S	87.9	Confident	88.5	Confident	115 Å²	115	73.7 Å²	73.7	80%	0.804	39%	0.393	S	S	*	.	G	3₁₀ helix	trans	-71.8	-11.4	175.6	53.2	0	0	0	0	115.6	S347	S347-S349 PolarHBondContact O-N 3.33Å; S347-S349 VanDerWaalsContact O-N 3.13Å; S347-S349 PolarHBondContact OG-OG 3.14Å
350	A	88.8	Confident	86.8	Confident	52 Å²	52	74.5 Å²	74.5	43%	0.43	40%	0.401	S	S	.	.	G	3₁₀ helix	trans	-107.6	7.6	-179.8	0	0	0	0	0	112.7	S347 I348 D352	S347-A350 WeakPolarHBondContact O-CA 3.5Å; S347-A350 PolarHBondContact O-N 3.42Å; S347-A350 WeakPolarHBondContact OG-CB 3.06Å; I348-A350 VanDerWaalsContact C-N 3.27Å; I348-A350 PolarHBondContact O-N 2.97Å; A350-D352 PolarHBondContact O-N 2.87Å
351	L	91.9	Very high	84.7	Confident	34 Å²	34	82.9 Å²	82.9	18%	0.178	44%	0.437	C	S	.	.			trans	-76.2	116	177.6	-62.8	-177	0	0	0	111.1	P346 Y353 I432 G436 V438	P346-L351 HydrophobicContact CB-CD2 4.25Å; P346-L351 HydrophobicContact CG-CD2 4.07Å; L351-Y353 HydrophobicContact CB-CD2 4.13Å; L351-Y353 HydrophobicContact CB-CE2 3.63Å; L351-Y353 HydrophobicContact CD1-CE2 4.14Å; L351-Y353 PolarHBondContact O-N 3.24Å; L351-I432 HydrophobicContact CD1-CD1 4.22Å; L351-I432 HydrophobicContact CD2-CG2 3.62Å; L351-G436 CarbonylContact C-O 3.55Å; L351-G436 WeakPolarHBondContact CA-O 3.47Å; L351-V438 HydrophobicContact CB-CG2 3.99Å; L351-V438 HydrophobicContact CD2-CG2 4.2Å
352	D	90.9	Very high	82.7	Confident	49 Å²	49	86 Å²	86	26%	0.262	46%	0.459	S	S	.	.	B	Isolated β-bridge	trans	-91.8	93.8	179	177.2	27.4	0	0	0	111.3	A350 S354 K355 G436 V438	A350-D352 PolarHBondContact O-N 2.87Å; D352-S354 VanDerWaalsContact C-N 3.31Å; D352-S354 VanDerWaalsContact CG-OG 3.3Å; D352-S354 WeakPolarHBondContact OD1-CB 3.15Å; D352-S354 PolarHBondContact OD1-N 3.24Å; D352-S354 PolarHBondContact OD1-OG 2.79Å; D352-S354 PolarHBondContact OD2-OG 3.2Å; D352-K355 IonicContact OD2-NZ 2.68Å; D352-K355 PolarHBondContact OD2-NZ 3.35Å; D352-G436 PolarHBondContact N-O 3.42Å; D352-V438 PolarHBondContact O-N 3.02Å; D352-V438 VanDerWaalsContact O-N 3.11Å
353	Y	90.9	Very high	80.7	Confident	108 Å²	108	88.1 Å²	88.1	42%	0.424	47%	0.472	S	S	.	.	G	3₁₀ helix	trans	-81.3	-0.7	171	-70.4	-88.1	0	0	0	113.6	L351 K355 Y356 E430 V438	L351-Y353 HydrophobicContact CB-CD2 4.13Å; L351-Y353 HydrophobicContact CB-CE2 3.63Å; L351-Y353 HydrophobicContact CD1-CE2 4.14Å; L351-Y353 PolarHBondContact O-N 3.24Å; Y353-K355 PolarHBondContact O-N 2.94Å; Y353-K355 VanDerWaalsContact O-N 3.14Å; Y353-Y356 HydrophobicContact CD1-CG 4.32Å; Y353-Y356 WeakPolarHBondContact O-CB 3.44Å; Y353-Y356 PolarHBondContact O-N 2.66Å; Y353-E430 VanDerWaalsContact CE1-OE1 3.24Å; Y353-E430 WeakPolarHBondContact CE1-OE1 3.36Å; Y353-E430 VanDerWaalsContact CZ-OE1 3.32Å; Y353-E430 PolarHBondContact OH-OE1 2.8Å; Y353-V438 HydrophobicContact CD1-CB 4.07Å; Y353-V438 HydrophobicContact CD1-CG1 4.03Å; Y353-V438 HydrophobicContact CD1-CG2 4.41Å; Y353-V438 HydrophobicContact CD2-CG2 4.4Å; Y353-V438 HydrophobicContact CE1-CB 4.04Å; Y353-V438 HydrophobicContact CE1-CG1 3.63Å; Y353-V438 HydrophobicContact CE1-CG2 4.16Å; Y353-V438 HydrophobicContact CE2-CG2 4.15Å; Y353-V438 HydrophobicContact CG-CB 4.47Å
354	S	88.2	Confident	78.7	Confident	101 Å²	101	89.8 Å²	89.8	71%	0.706	49%	0.485	S	S	*	.	G	3₁₀ helix	trans	-63.4	-22.5	-178.6	71.7	0	0	0	0	113.3	D352	D352-S354 VanDerWaalsContact C-N 3.31Å; D352-S354 VanDerWaalsContact CG-OG 3.3Å; D352-S354 WeakPolarHBondContact OD1-CB 3.15Å; D352-S354 PolarHBondContact OD1-N 3.24Å; D352-S354 PolarHBondContact OD1-OG 2.79Å; D352-S354 PolarHBondContact OD2-OG 3.2Å
355	K	81.8	Confident	77	Confident	81 Å²	81	95.2 Å²	95.2	35%	0.352	51%	0.509	S	S	.	.	G	3₁₀ helix	trans	-94	-6.8	175.3	-49.9	-169.3	-162.3	77.7	0	113.6	D352 Y353 V357 T437 L439 Q443	D352-K355 IonicContact OD2-NZ 2.68Å; D352-K355 PolarHBondContact OD2-NZ 3.35Å; Y353-K355 PolarHBondContact O-N 2.94Å; Y353-K355 VanDerWaalsContact O-N 3.14Å; K355-V357 PolarHBondContact O-N 2.95Å; K355-T437 HydrophobicContact CD-CG2 3.99Å; K355-T437 PolarHBondContact NZ-OG1 2.88Å; K355-L439 HydrophobicContact CB-CD2 3.93Å; K355-Q443 PolarHBondContact O-NE2 3.22Å; K355-Q443 PolarHBondContact O-OE1 2.77Å
356	Y	86.9	Confident	75.6	Confident	67 Å²	67	102.3 Å²	102.3	26%	0.263	54%	0.538	S	S	.	.			trans	-73.6	119.7	-174.3	-176.4	-89.3	0	0	0	111.4	Y353 E430 V438 H440	Y353-Y356 HydrophobicContact CD1-CG 4.32Å; Y353-Y356 WeakPolarHBondContact O-CB 3.44Å; Y353-Y356 PolarHBondContact O-N 2.66Å; Y356-E430 HydrophobicContact CE2-CB 4.33Å; Y356-E430 HydrophobicContact CE2-CG 4.14Å; Y356-V438 HydrophobicContact CD2-CG1 4.1Å; Y356-H440 HydrophobicContact CD2-CB 4.19Å; Y356-H440 HydrophobicContact CE2-CB 3.66Å
357	V	83.6	Confident	74.4	Confident	78 Å²	78	102.8 Å²	102.8	47%	0.473	54%	0.537	S	S	.	.			trans	-138.8	110.9	179.8	-175.1	0	0	0	0	110.4	K355 Q359 Q443	K355-V357 PolarHBondContact O-N 2.95Å; V357-Q359 HydrophobicContact CG1-CB 4.23Å; V357-Q359 PolarHBondContact O-N 2.84Å; V357-Q443 HydrophobicContact CB-CG 4.49Å; V357-Q443 WeakPolarHBondContact O-CG 3.41Å; V357-Q443 PolarHBondContact O-OE1 3.39Å
358	E	79.9	Confident	74	Confident	130 Å²	130	103.8 Å²	103.8	61%	0.607	54%	0.537	S	S	*	.			trans	-72.1	69.3	168.9	-164.2	-162.2	141.2	0	0	110.4	K360	E358-K360 PolarHBondContact O-N 3.44Å
359	Q	69.5	Low	73.9	Confident	58 Å²	58	100.3 Å²	100.3	27%	0.271	52%	0.523	S	S	.	.			trans	-70.6	115.3	-178.3	-177.8	171.5	5	0	0	110.1	V357 S362 T442	V357-Q359 HydrophobicContact CG1-CB 4.23Å; V357-Q359 PolarHBondContact O-N 2.84Å; Q359-S362 PolarHBondContact NE2-OG 3Å; Q359-T442 PolarHBondContact O-OG1 2.93Å; Q359-T442 VanDerWaalsContact O-OG1 3.11Å
360	K	59.3	Low	73.9	Confident	172 Å²	172	99.2 Å²	99.2	75%	0.748	52%	0.516	S	S	*	.			trans	-63.2	138.5	167.1	-66.7	-178.6	179.2	178.3	0	109.8	E358 S362	E358-K360 PolarHBondContact O-N 3.44Å; K360-S362 PolarHBondContact O-N 3.39Å; K360-S362 PolarHBondContact O-OG 3.45Å
361	F	52.1	Low	73.8	Confident	180 Å²	180	98.3 Å²	98.3	79%	0.789	50%	0.504	S	S	*	.			trans	-40.4	129.2	-165.5	-85.3	-96.8	0	0	0	114.9
362	S	52.5	Low	73.7	Confident	65 Å²	65	96.7 Å²	96.7	46%	0.455	50%	0.495	S	S	.	.			trans	-136.6	78.9	174.4	-54.5	0	0	0	0	107.5	Q359 K360 D364	Q359-S362 PolarHBondContact NE2-OG 3Å; K360-S362 PolarHBondContact O-N 3.39Å; K360-S362 PolarHBondContact O-OG 3.45Å; S362-D364 PolarHBondContact O-N 3.06Å; S362-D364 VanDerWaalsContact O-N 3.12Å
363	T	51.1	Low	73.7	Confident	131 Å²	131	99.2 Å²	99.2	80%	0.804	50%	0.504	S	S	*	.			trans	-74.6	-0.8	-156.9	-34.7	0	0	0	0	115.6
364	D	50.1	Low	73.7	Confident	161 Å²	161	96.6 Å²	96.6	86%	0.861	50%	0.496	S	S	*	.			trans	-128.6	43.4	-160.4	-155.9	20.5	0	0	0	113.2	S362	S362-D364 PolarHBondContact O-N 3.06Å; S362-D364 VanDerWaalsContact O-N 3.12Å
365	Q	57.5	Low	73.9	Confident	127 Å²	127	91.8 Å²	91.8	59%	0.593	46%	0.462	S	S	*	.			trans	-127.6	134.2	172.4	-73.5	-179.8	-21.4	0	0	110.2
366	K	61.1	Low	74.4	Confident	185 Å²	185	88 Å²	88	80%	0.804	45%	0.446	S	S	*	.			trans	-72	172.4	-178.6	-79	-172	173.6	-175.3	0	112.2	D368	K366-D368 VanDerWaalsContact C-N 3.31Å; K366-D368 PolarHBondContact O-N 2.84Å
367	E	65.3	Low	74.6	Confident	42 Å²	42	88.1 Å²	88.1	20%	0.196	45%	0.45	C	S	.	.			trans	-65.8	84.8	170.3	-55.8	-179.5	160.1	0	0	110.5	V372 R541 Y544 L550	E367-V372 HydrophobicContact CB-CG2 4.37Å; E367-R541 IonicContact OE1-CZ 3.44Å; E367-R541 IonicContact OE1-NH1 3.44Å; E367-R541 PolarHBondContact OE1-NH1 3.4Å; E367-R541 IonicContact OE1-NH2 3.46Å; E367-R541 PolarHBondContact OE1-NH2 3.4Å; E367-Y544 WeakPolarHBondContact OE1-CE1 3.46Å; E367-Y544 WeakPolarHBondContact OE2-CE1 3.41Å; E367-L550 HydrophobicContact CB-CD1 4.47Å; E367-L550 VanDerWaalsContact O-CD1 3.24Å; E367-L550 WeakPolarHBondContact O-CD1 3.45Å
368	D	78.1	Confident	75.1	Confident	86 Å²	86	84.5 Å²	84.5	46%	0.46	43%	0.429	S	S	.	.			trans	-64.8	147.6	176.2	-55.7	-54.3	0	0	0	111.5	K366 S370 N371 V372	K366-D368 VanDerWaalsContact C-N 3.31Å; K366-D368 PolarHBondContact O-N 2.84Å; D368-S370 PolarHBondContact O-N 3.38Å; D368-N371 WeakPolarHBondContact CB-ND2 3.31Å; D368-N371 PolarHBondContact N-ND2 2.87Å; D368-N371 WeakPolarHBondContact O-CB 3.23Å; D368-N371 PolarHBondContact O-N 3.44Å; D368-N371 PolarHBondContact O-ND2 3.49Å; D368-V372 PolarHBondContact O-N 3.41Å
369	V	85.1	Confident	75.7	Confident	84 Å²	84	78.4 Å²	78.4	51%	0.509	40%	0.4	S	S	.	.	H	α-helix	trans	-44.1	-38.5	175.8	179.8	0	0	0	0	112.5	N371 V372 K373 L550 V551	V369-N371 PolarHBondContact O-N 2.96Å; V369-V372 PolarHBondContact O-N 2.92Å; V369-K373 WeakPolarHBondContact O-CB 3.39Å; V369-K373 PolarHBondContact O-N 3.05Å; V369-L550 HydrophobicContact CG2-CB 4.44Å; V369-V551 HydrophobicContact CG1-CG2 3.79Å; V369-V551 WeakPolarHBondContact O-CG2 3.25Å
370	S	87.3	Confident	76.9	Confident	93 Å²	93	77.3 Å²	77.3	65%	0.65	40%	0.397	S	S	*	.	H	α-helix	trans	-63.6	-39.5	178	-166.6	0	0	0	0	113.2	D368 H374	D368-S370 PolarHBondContact O-N 3.38Å; S370-H374 WeakPolarHBondContact O-CB 3.27Å; S370-H374 PolarHBondContact O-N 2.89Å
371	N	87.6	Confident	78.5	Confident	32 Å²	32	70.6 Å²	70.6	17%	0.171	37%	0.374	C	S	.	.	H	α-helix	trans	-69.4	-42.2	179.7	-56.5	-66.6	0	0	0	110.5	D368 V369 H374 F375 R446	D368-N371 WeakPolarHBondContact CB-ND2 3.31Å; D368-N371 PolarHBondContact N-ND2 2.87Å; D368-N371 WeakPolarHBondContact O-CB 3.23Å; D368-N371 PolarHBondContact O-N 3.44Å; D368-N371 PolarHBondContact O-ND2 3.49Å; V369-N371 PolarHBondContact O-N 2.96Å; N371-H374 PolarHBondContact O-N 2.6Å; N371-F375 WeakPolarHBondContact O-CB 3.49Å; N371-F375 PolarHBondContact O-N 3.02Å; N371-R446 HydrophobicContact CB-CB 4.19Å
372	V	89.5	Confident	80.5	Confident	0 Å²	0	62.2 Å²	62.2	0%	0	34%	0.338	C	S	.	.	H	α-helix	trans	-67.7	-40.3	178.9	-175.9	0	0	0	0	111	E367 D368 V369 F375 Y376 L545 L550 V551	E367-V372 HydrophobicContact CB-CG2 4.37Å; D368-V372 PolarHBondContact O-N 3.41Å; V369-V372 PolarHBondContact O-N 2.92Å; V372-F375 WeakPolarHBondContact O-CB 3.37Å; V372-F375 PolarHBondContact O-N 2.93Å; V372-Y376 HydrophobicContact CG1-CD2 4.22Å; V372-Y376 HydrophobicContact CG1-CE2 3.87Å; V372-Y376 PolarHBondContact O-N 3.26Å; V372-Y376 VanDerWaalsContact O-N 3.13Å; V372-L545 HydrophobicContact CG1-CB 4.48Å; V372-L545 HydrophobicContact CG1-CD2 4.2Å; V372-L545 HydrophobicContact CG2-CD2 3.92Å; V372-L550 HydrophobicContact CG2-CD1 4.2Å; V372-V551 HydrophobicContact CB-CG2 3.92Å; V372-V551 HydrophobicContact CG1-CB 4.14Å; V372-V551 HydrophobicContact CG1-CG2 3.97Å
373	K	90.6	Very high	82.5	Confident	103 Å²	103	59.2 Å²	59.2	45%	0.448	32%	0.317	S	S	.	.	H	α-helix	trans	-63	-48.5	173.5	-167.3	-155.3	175.3	-61.8	0	111	V369 F375 Y376 D377 V551	V369-K373 WeakPolarHBondContact O-CB 3.39Å; V369-K373 PolarHBondContact O-N 3.05Å; K373-F375 VanDerWaalsContact C-N 3.28Å; K373-F375 PolarHBondContact O-N 3.11Å; K373-Y376 PolarHBondContact O-N 3.03Å; K373-Y376 VanDerWaalsContact O-N 3.08Å; K373-D377 IonicContact NZ-OD1 2.67Å; K373-D377 PolarHBondContact NZ-OD1 2.85Å; K373-D377 IonicContact NZ-OD2 2.67Å; K373-D377 PolarHBondContact NZ-OD2 2.92Å; K373-D377 PolarHBondContact O-N 3.1Å; K373-V551 HydrophobicContact CB-CG1 4.22Å; K373-V551 HydrophobicContact CB-CG2 4.15Å; K373-V551 HydrophobicContact CG-CG1 4.31Å
374	H	90.4	Very high	84.5	Confident	53 Å²	53	58.2 Å²	58.2	25%	0.245	30%	0.303	C	S	.	.	H	α-helix	trans	-60.5	-38.3	-179.4	-174	30.8	0	0	0	112.1	S370 N371 D377 L378	S370-H374 WeakPolarHBondContact O-CB 3.27Å; S370-H374 PolarHBondContact O-N 2.89Å; N371-H374 PolarHBondContact O-N 2.6Å; H374-D377 WeakPolarHBondContact O-CB 3.27Å; H374-D377 PolarHBondContact O-N 3.38Å; H374-L378 VanDerWaalsContact O-CG 3.3Å; H374-L378 WeakPolarHBondContact O-CG 3.41Å; H374-L378 PolarHBondContact O-N 2.84Å
375	F	92.1	Very high	86.6	Confident	0 Å²	0	51.5 Å²	51.5	0%	0	27%	0.27	C	S	.	.	H	α-helix	trans	-58.6	-46.5	171.8	176.6	-105.5	0	0	0	113	N371 V372 K373 L378 L379 F448 W451 I542 L545	N371-F375 WeakPolarHBondContact O-CB 3.49Å; N371-F375 PolarHBondContact O-N 3.02Å; V372-F375 WeakPolarHBondContact O-CB 3.37Å; V372-F375 PolarHBondContact O-N 2.93Å; K373-F375 VanDerWaalsContact C-N 3.28Å; K373-F375 PolarHBondContact O-N 3.11Å; F375-L378 PolarHBondContact O-N 3.13Å; F375-L379 HydrophobicContact CD1-CD1 3.95Å; F375-L379 HydrophobicContact CE1-CD1 3.43Å; F375-L379 VanDerWaalsContact CE1-CD1 3.43Å; F375-L379 HydrophobicContact CE1-CG 4.47Å; F375-L379 HydrophobicContact CE2-CD1 4.21Å; F375-L379 HydrophobicContact CZ-CD1 3.59Å; F375-L379 HydrophobicContact CZ-CG 4.36Å; F375-L379 WeakPolarHBondContact O-CG 3.29Å; F375-L379 PolarHBondContact O-N 2.93Å; F375-F448 HydrophobicContact CD2-CD1 4.37Å; F375-F448 AromaticContact CD2-CD2 3.9Å; F375-F448 HydrophobicContact CD2-CD2 3.9Å; F375-F448 HydrophobicContact CD2-CE1 4.18Å; F375-F448 AromaticContact CD2-CE2 3.7Å; F375-F448 HydrophobicContact CD2-CE2 3.7Å; F375-F448 HydrophobicContact CD2-CG 4.22Å; F375-F448 AromaticContact CD2-CZ 3.84Å; F375-F448 HydrophobicContact CD2-CZ 3.84Å; F375-F448 AromaticContact CE2-CD1 3.83Å; F375-F448 HydrophobicContact CE2-CD1 3.83Å; F375-F448 HydrophobicContact CE2-CD2 4.16Å; F375-F448 AromaticContact CE2-CE1 3.78Å; F375-F448 HydrophobicContact CE2-CE1 3.78Å; F375-F448 HydrophobicContact CE2-CE2 4.12Å; F375-F448 HydrophobicContact CE2-CG 4Å; F375-F448 AromaticContact CE2-CZ 3.92Å; F375-F448 HydrophobicContact CE2-CZ 3.92Å; F375-W451 HydrophobicContact CE2-CE3 4.49Å; F375-W451 AromaticContact CE2-CZ3 3.95Å; F375-W451 HydrophobicContact CE2-CZ3 3.95Å; F375-W451 AromaticContact CZ-CZ3 3.98Å; F375-W451 HydrophobicContact CZ-CZ3 3.98Å; F375-I542 HydrophobicContact CE1-CG1 3.8Å; F375-I542 HydrophobicContact CZ-CG1 3.84Å; F375-L545 HydrophobicContact CD1-CD1 3.51Å; F375-L545 HydrophobicContact CE1-CD1 3.42Å; F375-L545 VanDerWaalsContact CE1-CD1 3.42Å; F375-L545 HydrophobicContact CG-CD1 4.32Å; F375-L545 HydrophobicContact CZ-CD1 4.17Å
376	Y	92.2	Very high	88.5	Confident	2 Å²	2	45.7 Å²	45.7	1%	0.008	24%	0.243	C	C	.	.	H	α-helix	trans	-67.5	-33.6	175.8	-74.1	-32.1	0	0	0	113.1	V372 K373 L379 T380 V551 P554 V557	V372-Y376 HydrophobicContact CG1-CD2 4.22Å; V372-Y376 HydrophobicContact CG1-CE2 3.87Å; V372-Y376 PolarHBondContact O-N 3.26Å; V372-Y376 VanDerWaalsContact O-N 3.13Å; K373-Y376 PolarHBondContact O-N 3.03Å; K373-Y376 VanDerWaalsContact O-N 3.08Å; Y376-L379 HydrophobicContact CD1-CD1 4.37Å; Y376-T380 WeakPolarHBondContact O-CB 3.38Å; Y376-T380 PolarHBondContact O-N 3Å; Y376-T380 PolarHBondContact O-OG1 3.29Å; Y376-V551 HydrophobicContact CD2-CB 4.24Å; Y376-V551 HydrophobicContact CD2-CG1 4.03Å; Y376-V551 HydrophobicContact CE2-CB 4.26Å; Y376-V551 HydrophobicContact CE2-CG1 4.47Å; Y376-P554 HydrophobicContact CG-CG 4.11Å; Y376-V557 HydrophobicContact CD1-CG2 4.04Å; Y376-V557 HydrophobicContact CE1-CG1 4.47Å; Y376-V557 HydrophobicContact CE1-CG2 4.19Å
377	D	92.2	Very high	90.1	Very high	68 Å²	68	41.3 Å²	41.3	36%	0.364	22%	0.221	S	C	.	.	H	α-helix	trans	-63	-48.2	172.1	-61.2	-30.1	0	0	0	110.8	K373 H374 L379 T380 A381	K373-D377 IonicContact NZ-OD1 2.67Å; K373-D377 PolarHBondContact NZ-OD1 2.85Å; K373-D377 IonicContact NZ-OD2 2.67Å; K373-D377 PolarHBondContact NZ-OD2 2.92Å; K373-D377 PolarHBondContact O-N 3.1Å; H374-D377 WeakPolarHBondContact O-CB 3.27Å; H374-D377 PolarHBondContact O-N 3.38Å; D377-L379 PolarHBondContact O-N 3.02Å; D377-T380 PolarHBondContact O-N 2.97Å; D377-A381 PolarHBondContact O-N 3.09Å
378	L	93.4	Very high	91.6	Very high	3 Å²	3	45.5 Å²	45.5	2%	0.016	24%	0.239	C	C	.	.	H	α-helix	trans	-62.3	-41.5	178.3	-71.3	171.7	0	0	0	112.7	H374 F375 S382 F433 L439	H374-L378 VanDerWaalsContact O-CG 3.3Å; H374-L378 WeakPolarHBondContact O-CG 3.41Å; H374-L378 PolarHBondContact O-N 2.84Å; F375-L378 PolarHBondContact O-N 3.13Å; L378-S382 VanDerWaalsContact O-CB 3.27Å; L378-S382 WeakPolarHBondContact O-CB 3.33Å; L378-S382 PolarHBondContact O-N 2.87Å; L378-S382 PolarHBondContact O-OG 3.11Å; L378-F433 HydrophobicContact CB-CD1 4.38Å; L378-F433 HydrophobicContact CD1-CD1 4.24Å; L378-F433 HydrophobicContact CD1-CD2 4.49Å; L378-F433 HydrophobicContact CD1-CE1 4.1Å; L378-F433 HydrophobicContact CD1-CE2 4.35Å; L378-F433 HydrophobicContact CD1-CG 4.44Å; L378-F433 HydrophobicContact CD1-CZ 4.15Å; L378-F433 HydrophobicContact CD2-CB 3.92Å; L378-F433 HydrophobicContact CD2-CD1 4Å; L378-F433 HydrophobicContact CD2-CD2 4.28Å; L378-F433 HydrophobicContact CD2-CG 3.78Å; L378-F433 HydrophobicContact CG-CD1 4.44Å; L378-L439 HydrophobicContact CD1-CD1 4.23Å
379	L	93.5	Very high	92.5	Very high	2 Å²	2	41.5 Å²	41.5	1%	0.01	22%	0.217	C	C	.	.	H	α-helix	trans	-65.1	-39.9	174.1	-75.8	173.7	0	0	0	111.9	F375 Y376 D377 S382 F383 F412 F416 I542	F375-L379 HydrophobicContact CD1-CD1 3.95Å; F375-L379 HydrophobicContact CE1-CD1 3.43Å; F375-L379 VanDerWaalsContact CE1-CD1 3.43Å; F375-L379 HydrophobicContact CE1-CG 4.47Å; F375-L379 HydrophobicContact CE2-CD1 4.21Å; F375-L379 HydrophobicContact CZ-CD1 3.59Å; F375-L379 HydrophobicContact CZ-CG 4.36Å; F375-L379 WeakPolarHBondContact O-CG 3.29Å; F375-L379 PolarHBondContact O-N 2.93Å; Y376-L379 HydrophobicContact CD1-CD1 4.37Å; D377-L379 PolarHBondContact O-N 3.02Å; L379-S382 PolarHBondContact O-N 3.18Å; L379-F383 PolarHBondContact O-N 3.41Å; L379-F412 HydrophobicContact CD2-CE1 4.16Å; L379-F412 HydrophobicContact CD2-CZ 4.07Å; L379-F412 WeakPolarHBondContact O-CZ 3.46Å; L379-F416 HydrophobicContact CD2-CD1 4.12Å; L379-F416 HydrophobicContact CD2-CD2 4.25Å; L379-F416 HydrophobicContact CD2-CE1 3.94Å; L379-F416 HydrophobicContact CD2-CE2 4.07Å; L379-F416 HydrophobicContact CD2-CG 4.26Å; L379-F416 HydrophobicContact CD2-CZ 3.9Å; L379-I542 HydrophobicContact CD1-CD1 3.81Å; L379-I542 HydrophobicContact CD1-CG1 4.04Å
380	T	93.3	Very high	93.1	Very high	34 Å²	34	37.6 Å²	37.6	21%	0.209	19%	0.193	C	C	.	.	H	α-helix	trans	-66.1	-50.1	179.5	-56.8	0	0	0	0	110.8	Y376 D377 S382 F383 E384 I556	Y376-T380 WeakPolarHBondContact O-CB 3.38Å; Y376-T380 PolarHBondContact O-N 3Å; Y376-T380 PolarHBondContact O-OG1 3.29Å; D377-T380 PolarHBondContact O-N 2.97Å; T380-S382 VanDerWaalsContact C-N 3.26Å; T380-S382 PolarHBondContact O-N 3.06Å; T380-F383 PolarHBondContact O-N 3.12Å; T380-F383 VanDerWaalsContact O-N 3.14Å; T380-E384 WeakPolarHBondContact O-CG 3.35Å; T380-E384 PolarHBondContact O-N 3.34Å; T380-I556 HydrophobicContact CG2-CD1 4.15Å
381	A	93.6	Very high	93.5	Very high	32 Å²	32	38.9 Å²	38.9	26%	0.264	19%	0.188	S	C	.	.	H	α-helix	trans	-57.4	-40.1	174.2	0	0	0	0	0	112	D377 E384 A385 C434 D435	D377-A381 PolarHBondContact O-N 3.09Å; A381-E384 PolarHBondContact O-N 2.75Å; A381-A385 WeakPolarHBondContact O-CB 3.16Å; A381-A385 PolarHBondContact O-N 3.07Å; A381-C434 VanDerWaalsContact C-SG 3.57Å; A381-D435 HydrophobicContact CB-CB 4.39Å
382	S	94.6	Very high	93.9	Very high	4 Å²	4	40.8 Å²	40.8	3%	0.028	20%	0.197	C	C	.	.	H	α-helix	trans	-63.2	-42.2	176.1	-62.7	0	0	0	0	112.9	L378 L379 T380 E384 I386 F416 C434	L378-S382 VanDerWaalsContact O-CB 3.27Å; L378-S382 WeakPolarHBondContact O-CB 3.33Å; L378-S382 PolarHBondContact O-N 2.87Å; L378-S382 PolarHBondContact O-OG 3.11Å; L379-S382 PolarHBondContact O-N 3.18Å; T380-S382 VanDerWaalsContact C-N 3.26Å; T380-S382 PolarHBondContact O-N 3.06Å; S382-E384 VanDerWaalsContact C-N 3.34Å; S382-I386 WeakPolarHBondContact O-CB 3.31Å; S382-I386 WeakPolarHBondContact O-CD1 3.41Å; S382-I386 VanDerWaalsContact O-CG1 3.23Å; S382-I386 WeakPolarHBondContact O-CG1 3.43Å; S382-I386 PolarHBondContact O-N 3.23Å; S382-F416 WeakPolarHBondContact OG-CD2 3.36Å; S382-F416 WeakPolarHBondContact OG-CE2 3.49Å; S382-C434 WeakPolarHBondContact CA-SG 3.37Å; S382-C434 PolarHBondContact N-SG 3.05Å; S382-C434 VanDerWaalsContact N-SG 3.45Å
383	F	93.9	Very high	94.2	Very high	2 Å²	2	40.9 Å²	40.9	1%	0.009	20%	0.198	C	C	.	.	H	α-helix	trans	-65.3	-40.5	176.7	-165.1	-72.9	0	0	0	110.8	L379 T380 I386 R387 L408 E409 F412 I556 I560	L379-F383 PolarHBondContact O-N 3.41Å; T380-F383 PolarHBondContact O-N 3.12Å; T380-F383 VanDerWaalsContact O-N 3.14Å; F383-I386 PolarHBondContact O-N 2.76Å; F383-R387 HydrophobicContact CD1-CB 4.16Å; F383-R387 HydrophobicContact CE1-CB 4.2Å; F383-R387 VanDerWaalsContact CE1-NH2 3.29Å; F383-R387 WeakPolarHBondContact O-CB 3.18Å; F383-R387 PolarHBondContact O-N 3.27Å; F383-L408 HydrophobicContact CE1-CD2 3.56Å; F383-L408 HydrophobicContact CE1-CG 4.01Å; F383-L408 HydrophobicContact CE2-CG 4.36Å; F383-L408 HydrophobicContact CZ-CD1 4.5Å; F383-L408 HydrophobicContact CZ-CD2 3.67Å; F383-L408 HydrophobicContact CZ-CG 3.67Å; F383-E409 HydrophobicContact CE2-CG 4.28Å; F383-E409 HydrophobicContact CZ-CG 3.99Å; F383-F412 VanDerWaalsContact CA-CE2 3.42Å; F383-F412 HydrophobicContact CB-CD2 4.01Å; F383-F412 HydrophobicContact CB-CE2 3.63Å; F383-F412 HydrophobicContact CB-CZ 4.02Å; F383-F412 HydrophobicContact CD2-CB 3.92Å; F383-F412 AromaticContact CD2-CD1 3.85Å; F383-F412 HydrophobicContact CD2-CD1 3.85Å; F383-F412 AromaticContact CD2-CD2 3.37Å; F383-F412 HydrophobicContact CD2-CD2 3.37Å; F383-F412 HydrophobicContact CD2-CE1 4.21Å; F383-F412 AromaticContact CD2-CE2 3.81Å; F383-F412 HydrophobicContact CD2-CE2 3.81Å; F383-F412 AromaticContact CD2-CG 3.39Å; F383-F412 HydrophobicContact CD2-CG 3.39Å; F383-F412 HydrophobicContact CD2-CZ 4.2Å; F383-F412 HydrophobicContact CE2-CB 3.82Å; F383-F412 HydrophobicContact CE2-CD1 4.4Å; F383-F412 HydrophobicContact CE2-CD2 4.13Å; F383-F412 AromaticContact CE2-CG 3.83Å; F383-F412 HydrophobicContact CE2-CG 3.83Å; F383-F412 AromaticContact CG-CD2 3.99Å; F383-F412 HydrophobicContact CG-CD2 3.99Å; F383-F412 HydrophobicContact CG-CE2 4.13Å; F383-F412 HydrophobicContact CG-CG 4.42Å; F383-I556 HydrophobicContact CB-CD1 3.57Å; F383-I556 HydrophobicContact CB-CG1 3.98Å; F383-I556 HydrophobicContact CD1-CD1 3.6Å; F383-I556 HydrophobicContact CD1-CG1 3.83Å; F383-I556 HydrophobicContact CD2-CD1 4.46Å; F383-I556 HydrophobicContact CD2-CG1 4.02Å; F383-I556 HydrophobicContact CE1-CD1 4.44Å; F383-I556 HydrophobicContact CE1-CG1 4.34Å; F383-I556 HydrophobicContact CE2-CG1 4.5Å; F383-I556 HydrophobicContact CG-CD1 3.62Å; F383-I556 HydrophobicContact CG-CG1 3.66Å; F383-I560 HydrophobicContact CD2-CD1 3.39Å; F383-I560 HydrophobicContact CD2-CG1 4.16Å; F383-I560 HydrophobicContact CE2-CD1 3.47Å; F383-I560 VanDerWaalsContact CE2-CD1 3.47Å; F383-I560 HydrophobicContact CE2-CG1 3.69Å; F383-I560 HydrophobicContact CG-CD1 4.49Å
384	E	93.4	Very high	94.3	Very high	109 Å²	109	37.6 Å²	37.6	51%	0.509	19%	0.187	S	C	.	.	H	α-helix	trans	-66.7	-41.5	179	-65.2	-165.7	154.3	0	0	112.5	T380 A381 S382 I386 R387 K388 I556	T380-E384 WeakPolarHBondContact O-CG 3.35Å; T380-E384 PolarHBondContact O-N 3.34Å; A381-E384 PolarHBondContact O-N 2.75Å; S382-E384 VanDerWaalsContact C-N 3.34Å; E384-I386 PolarHBondContact O-N 3.27Å; E384-R387 PolarHBondContact O-N 2.84Å; E384-R387 IonicContact OE1-NH1 2.69Å; E384-K388 WeakPolarHBondContact O-CB 3.14Å; E384-K388 PolarHBondContact O-N 3Å; E384-I556 HydrophobicContact CG-CD1 4.49Å
385	A	94.9	Very high	94.4	Very high	21 Å²	21	37 Å²	37	17%	0.174	20%	0.195	C	C	.	.	H	α-helix	trans	-61.5	-41.7	172.8	0	0	0	0	0	112.4	A381 W389 C434	A381-A385 WeakPolarHBondContact O-CB 3.16Å; A381-A385 PolarHBondContact O-N 3.07Å; A385-W389 VanDerWaalsContact O-CB 3.27Å; A385-W389 WeakPolarHBondContact O-CB 3.28Å; A385-W389 PolarHBondContact O-N 3.42Å; A385-C434 HydrophobicContact CB-CB 3.95Å
386	I	96.4	Very high	94.6	Very high	5 Å²	5	37.1 Å²	37.1	3%	0.026	20%	0.196	C	C	.	.	H	α-helix	trans	-72	-39.8	177.2	-67.1	163.9	0	0	0	111.3	S382 F383 E384 K388 W389 A390 L408 F412 L415	S382-I386 WeakPolarHBondContact O-CB 3.31Å; S382-I386 WeakPolarHBondContact O-CD1 3.41Å; S382-I386 VanDerWaalsContact O-CG1 3.23Å; S382-I386 WeakPolarHBondContact O-CG1 3.43Å; S382-I386 PolarHBondContact O-N 3.23Å; F383-I386 PolarHBondContact O-N 2.76Å; E384-I386 PolarHBondContact O-N 3.27Å; I386-K388 VanDerWaalsContact C-N 3.32Å; I386-K388 PolarHBondContact O-N 2.87Å; I386-W389 HydrophobicContact CG2-CE3 4.09Å; I386-W389 HydrophobicContact CG2-CZ3 4.41Å; I386-W389 PolarHBondContact O-N 3.45Å; I386-A390 WeakPolarHBondContact O-CB 3.5Å; I386-A390 PolarHBondContact O-N 2.87Å; I386-L408 HydrophobicContact CG2-CD1 3.68Å; I386-F412 HydrophobicContact CD1-CD2 3.93Å; I386-F412 HydrophobicContact CD1-CE2 3.95Å; I386-L415 HydrophobicContact CD1-CB 3.86Å; I386-L415 HydrophobicContact CG2-CB 4.26Å; I386-L415 HydrophobicContact CG2-CD1 3.61Å
387	R	95.3	Very high	94.7	Very high	93 Å²	93	40.3 Å²	40.3	35%	0.351	22%	0.218	S	C	.	.	H	α-helix	trans	-62.2	-37.2	175.5	-175.9	-165.2	-73.8	136.1	-3.2	111.8	F383 E384 L408	F383-R387 HydrophobicContact CD1-CB 4.16Å; F383-R387 HydrophobicContact CE1-CB 4.2Å; F383-R387 VanDerWaalsContact CE1-NH2 3.29Å; F383-R387 WeakPolarHBondContact O-CB 3.18Å; F383-R387 PolarHBondContact O-N 3.27Å; E384-R387 PolarHBondContact O-N 2.84Å; E384-R387 IonicContact OE1-NH1 2.69Å; R387-L408 HydrophobicContact CB-CD2 3.87Å; R387-L408 HydrophobicContact CG-CD2 3.81Å
388	K	95.6	Very high	94.8	Very high	129 Å²	129	40.4 Å²	40.4	56%	0.561	22%	0.224	S	C	*	.	H	α-helix	trans	-66.2	-61.3	172	-175.8	-169.6	171	-161.6	0	109.7	E384 I386 A390 K391	E384-K388 WeakPolarHBondContact O-CB 3.14Å; E384-K388 PolarHBondContact O-N 3Å; I386-K388 VanDerWaalsContact C-N 3.32Å; I386-K388 PolarHBondContact O-N 2.87Å; K388-A390 PolarHBondContact O-N 2.79Å; K388-A390 VanDerWaalsContact O-N 3.11Å; K388-K391 WeakPolarHBondContact O-CB 3.26Å; K388-K391 PolarHBondContact O-N 2.83Å
389	W	97.4	Very high	94.9	Very high	3 Å²	3	40.7 Å²	40.7	1%	0.011	23%	0.225	C	C	.	.	H	α-helix	trans	-48	-41.5	-179.9	166.4	76.8	0	0	0	113.9	A385 I386 K391 D392 I393 L415 T476 I480	A385-W389 VanDerWaalsContact O-CB 3.27Å; A385-W389 WeakPolarHBondContact O-CB 3.28Å; A385-W389 PolarHBondContact O-N 3.42Å; I386-W389 HydrophobicContact CG2-CE3 4.09Å; I386-W389 HydrophobicContact CG2-CZ3 4.41Å; I386-W389 PolarHBondContact O-N 3.45Å; W389-K391 PolarHBondContact O-N 3.41Å; W389-D392 WeakPolarHBondContact O-CB 3.25Å; W389-D392 PolarHBondContact O-N 3.42Å; W389-I393 HydrophobicContact CD2-CD1 4.5Å; W389-I393 HydrophobicContact CE3-CD1 4.29Å; W389-I393 HydrophobicContact CH2-CD1 3.62Å; W389-I393 HydrophobicContact CH2-CG1 4.49Å; W389-I393 HydrophobicContact CZ2-CD1 3.86Å; W389-I393 HydrophobicContact CZ2-CG1 4.25Å; W389-I393 HydrophobicContact CZ3-CD1 3.87Å; W389-I393 PolarHBondContact O-N 3.11Å; W389-L415 HydrophobicContact CH2-CD2 4.19Å; W389-L415 HydrophobicContact CZ3-CD1 4.29Å; W389-L415 HydrophobicContact CZ3-CD2 4.09Å; W389-T476 HydrophobicContact CH2-CG2 3.61Å; W389-T476 WeakPolarHBondContact CH2-O 3.49Å; W389-T476 HydrophobicContact CZ2-CG2 3.64Å; W389-T476 HydrophobicContact CZ3-CG2 4.38Å; W389-I480 HydrophobicContact CH2-CG2 3.85Å; W389-I480 HydrophobicContact CZ3-CB 4.47Å; W389-I480 HydrophobicContact CZ3-CD1 4.32Å; W389-I480 HydrophobicContact CZ3-CG2 3.96Å
390	A	97.6	Very high	95	Very high	1 Å²	1	42.1 Å²	42.1	1%	0.008	24%	0.235	C	C	.	.	H	α-helix	trans	-58.7	-35.1	179.8	0	0	0	0	0	112.6	I386 K388 D392 I393 F396 I480	I386-A390 WeakPolarHBondContact O-CB 3.5Å; I386-A390 PolarHBondContact O-N 2.87Å; K388-A390 PolarHBondContact O-N 2.79Å; K388-A390 VanDerWaalsContact O-N 3.11Å; A390-D392 VanDerWaalsContact C-N 3.29Å; A390-D392 PolarHBondContact O-N 3.33Å; A390-I393 WeakPolarHBondContact O-CB 3.34Å; A390-I393 PolarHBondContact O-N 2.84Å; A390-F396 HydrophobicContact CB-CD1 4.07Å; A390-F396 HydrophobicContact CB-CE1 3.74Å; A390-F396 HydrophobicContact CB-CZ 4.13Å; A390-F396 VanDerWaalsContact O-CB 3.27Å; A390-F396 WeakPolarHBondContact O-CB 3.24Å; A390-F396 WeakPolarHBondContact O-CD1 3.43Å; A390-F396 VanDerWaalsContact O-CG 3.3Å; A390-F396 WeakPolarHBondContact O-CG 3.24Å; A390-I480 HydrophobicContact CB-CD1 3.74Å
391	K	95.9	Very high	95.1	Very high	121 Å²	121	46.4 Å²	46.4	53%	0.526	26%	0.256	S	S	.	.	H	α-helix	trans	-71.1	-26.6	178.3	-63.7	-179.9	179.7	-174.7	0	113.1	K388 W389 I393 S397	K388-K391 WeakPolarHBondContact O-CB 3.26Å; K388-K391 PolarHBondContact O-N 2.83Å; W389-K391 PolarHBondContact O-N 3.41Å; K391-I393 VanDerWaalsContact C-N 3.3Å; K391-S397 WeakPolarHBondContact CA-OG 3.41Å; K391-S397 PolarHBondContact O-OG 3.44Å
392	D	95.8	Very high	95.2	Very high	71 Å²	71	50.2 Å²	50.2	38%	0.38	27%	0.268	S	S	.	.	H	α-helix	trans	-80.7	-11.5	179.4	-52	-43.6	0	0	0	111.9	A340 W389 A390 P394	A340-D392 HydrophobicContact CB-CB 3.78Å; W389-D392 WeakPolarHBondContact O-CB 3.25Å; W389-D392 PolarHBondContact O-N 3.42Å; A390-D392 VanDerWaalsContact C-N 3.29Å; A390-D392 PolarHBondContact O-N 3.33Å; D392-P394 WeakPolarHBondContact O-CD 3.24Å
393	I	96.1	Very high	95.3	Very high	2 Å²	2	50 Å²	50	1%	0.01	27%	0.267	C	S	.	.	S	Bend	trans	-65.4	122.6	170.6	-61.1	174.2	0	0	0	109.8	L337 W389 A390 K391 G395 F396 I480 F496	L337-I393 HydrophobicContact CD2-CG1 4.48Å; L337-I393 HydrophobicContact CD2-CG2 3.93Å; W389-I393 HydrophobicContact CD2-CD1 4.5Å; W389-I393 HydrophobicContact CE3-CD1 4.29Å; W389-I393 HydrophobicContact CH2-CD1 3.62Å; W389-I393 HydrophobicContact CH2-CG1 4.49Å; W389-I393 HydrophobicContact CZ2-CD1 3.86Å; W389-I393 HydrophobicContact CZ2-CG1 4.25Å; W389-I393 HydrophobicContact CZ3-CD1 3.87Å; W389-I393 PolarHBondContact O-N 3.11Å; A390-I393 WeakPolarHBondContact O-CB 3.34Å; A390-I393 PolarHBondContact O-N 2.84Å; K391-I393 VanDerWaalsContact C-N 3.3Å; I393-G395 PolarHBondContact O-N 3.2Å; I393-F396 HydrophobicContact CB-CB 3.88Å; I393-F396 HydrophobicContact CG2-CB 4.11Å; I393-F396 PolarHBondContact O-N 3.43Å; I393-F396 VanDerWaalsContact O-N 3.09Å; I393-I480 HydrophobicContact CD1-CG2 3.74Å; I393-F496 HydrophobicContact CG2-CE1 4.3Å; I393-F496 HydrophobicContact CG2-CZ 4.01Å
394	P	93	Very high	95.4	Very high	35 Å²	35	51 Å²	51	23%	0.227	27%	0.272	C	S	.	.	T	Hydrogen-bonded Turn	trans	-58.7	106.8	-179	-24.1	32.8	0	0	0	112.8	S336 D392 F496	S336-P394 VanDerWaalsContact CB-CG 3.42Å; D392-P394 WeakPolarHBondContact O-CD 3.24Å; P394-F496 WeakPolarHBondContact O-CZ 3.46Å
395	G	91.8	Very high	95.4	Very high	39 Å²	39	50.7 Å²	50.7	40%	0.402	27%	0.27	S	S	.	.	T	Hydrogen-bonded Turn	trans	101.8	-13.6	177.7	0	0	0	0	0	115.7	I393 S397 S398	I393-G395 PolarHBondContact O-N 3.2Å; G395-S397 PolarHBondContact O-N 2.93Å; G395-S398 VanDerWaalsContact O-CB 3.3Å; G395-S398 WeakPolarHBondContact O-CB 3.27Å; G395-S398 PolarHBondContact O-N 3.03Å; G395-S398 VanDerWaalsContact O-N 3.07Å; G395-S398 PolarHBondContact O-OG 2.68Å
396	F	95.8	Very high	95.4	Very high	4 Å²	4	51.7 Å²	51.7	2%	0.018	27%	0.272	C	S	.	.	G	3₁₀ helix	trans	-61.3	-45.7	178	178.2	-99.5	0	0	0	111.9	A390 I393 S398 F399 Q404 L407 I480 I481	A390-F396 HydrophobicContact CB-CD1 4.07Å; A390-F396 HydrophobicContact CB-CE1 3.74Å; A390-F396 HydrophobicContact CB-CZ 4.13Å; A390-F396 VanDerWaalsContact O-CB 3.27Å; A390-F396 WeakPolarHBondContact O-CB 3.24Å; A390-F396 WeakPolarHBondContact O-CD1 3.43Å; A390-F396 VanDerWaalsContact O-CG 3.3Å; A390-F396 WeakPolarHBondContact O-CG 3.24Å; I393-F396 HydrophobicContact CB-CB 3.88Å; I393-F396 HydrophobicContact CG2-CB 4.11Å; I393-F396 PolarHBondContact O-N 3.43Å; I393-F396 VanDerWaalsContact O-N 3.09Å; F396-S398 PolarHBondContact O-N 2.87Å; F396-F399 HydrophobicContact CD2-CD2 4.14Å; F396-F399 HydrophobicContact CD2-CE2 4.38Å; F396-F399 VanDerWaalsContact O-CD2 3.23Å; F396-F399 WeakPolarHBondContact O-CD2 3.33Å; F396-F399 PolarHBondContact O-N 3.35Å; F396-F399 VanDerWaalsContact O-N 3.1Å; F396-Q404 HydrophobicContact CD1-CG 4.26Å; F396-Q404 HydrophobicContact CE1-CB 3.87Å; F396-Q404 HydrophobicContact CE1-CG 3.81Å; F396-Q404 HydrophobicContact CE2-CG 4.49Å; F396-Q404 HydrophobicContact CZ-CB 3.78Å; F396-Q404 HydrophobicContact CZ-CG 3.96Å; F396-L407 HydrophobicContact CE2-CB 4.34Å; F396-L407 HydrophobicContact CE2-CD1 4.1Å; F396-I480 HydrophobicContact CE2-CD1 4Å; F396-I480 HydrophobicContact CE2-CG1 4.24Å; F396-I480 HydrophobicContact CZ-CD1 4.09Å; F396-I481 HydrophobicContact CD2-CD1 3.64Å; F396-I481 HydrophobicContact CE2-CD1 4.26Å
397	S	95	Very high	95.3	Very high	69 Å²	69	51.5 Å²	51.5	48%	0.483	27%	0.271	S	S	.	.	G	3₁₀ helix	trans	-62.7	4.2	175	-58.6	0	0	0	0	114.7	K391 G395	K391-S397 WeakPolarHBondContact CA-OG 3.41Å; K391-S397 PolarHBondContact O-OG 3.44Å; G395-S397 PolarHBondContact O-N 2.93Å
398	S	93.7	Very high	95.3	Very high	69 Å²	69	47.5 Å²	47.5	48%	0.483	26%	0.257	S	S	.	.	G	3₁₀ helix	trans	-98.7	-11.3	173.6	79.9	0	0	0	0	114.7	G395 F396 R492	G395-S398 VanDerWaalsContact O-CB 3.3Å; G395-S398 WeakPolarHBondContact O-CB 3.27Å; G395-S398 PolarHBondContact O-N 3.03Å; G395-S398 VanDerWaalsContact O-N 3.07Å; G395-S398 PolarHBondContact O-OG 2.68Å; F396-S398 PolarHBondContact O-N 2.87Å; S398-R492 VanDerWaalsContact C-NH2 3.3Å; S398-R492 PolarHBondContact O-NH1 3.09Å; S398-R492 PolarHBondContact O-NH2 3.49Å; S398-R492 PolarHBondContact OG-NH2 3.16Å
399	F	95.8	Very high	95.1	Very high	10 Å²	10	42.4 Å²	42.4	4%	0.044	24%	0.235	C	C	.	.	S	Bend	trans	-71.3	158.8	171.5	-66	-66.5	0	0	0	110.7	F396 D403 Q404 I481 R492 V493 F496	F396-F399 HydrophobicContact CD2-CD2 4.14Å; F396-F399 HydrophobicContact CD2-CE2 4.38Å; F396-F399 VanDerWaalsContact O-CD2 3.23Å; F396-F399 WeakPolarHBondContact O-CD2 3.33Å; F396-F399 PolarHBondContact O-N 3.35Å; F396-F399 VanDerWaalsContact O-N 3.1Å; F399-D403 HydrophobicContact CB-CB 4.37Å; F399-Q404 HydrophobicContact CB-CG 3.97Å; F399-Q404 PolarHBondContact O-NE2 3.09Å; F399-I481 HydrophobicContact CE2-CD1 4.3Å; F399-R492 HydrophobicContact CD1-CB 4.34Å; F399-R492 HydrophobicContact CE1-CB 3.71Å; F399-V493 HydrophobicContact CD1-CG2 4.26Å; F399-V493 HydrophobicContact CE1-CG2 3.71Å; F399-V493 HydrophobicContact CZ-CG2 4.01Å; F399-F496 AromaticContact CE2-CD1 3.79Å; F399-F496 HydrophobicContact CE2-CD1 3.79Å; F399-F496 HydrophobicContact CE2-CE1 4.25Å; F399-F496 HydrophobicContact CZ-CB 4.27Å; F399-F496 AromaticContact CZ-CD1 3.77Å; F399-F496 HydrophobicContact CZ-CD1 3.77Å; F399-F496 HydrophobicContact CZ-CG 4.46Å
400	C	96.1	Very high	94.9	Very high	32 Å²	32	43.5 Å²	43.5	22%	0.216	24%	0.243	C	C	.	.			trans	-57.7	153	166.1	65.5	0	0	0	0	111.4	E402 D403 Q404 E489	C400-E402 WeakPolarHBondContact CB-OE2 3.38Å; C400-E402 PolarHBondContact O-N 3.37Å; C400-D403 PolarHBondContact O-N 3.07Å; C400-D403 VanDerWaalsContact O-N 3.16Å; C400-Q404 PolarHBondContact O-N 2.63Å; C400-E489 PolarHBondContact N-OE2 3.38Å
401	L	95.9	Very high	94.8	Very high	124 Å²	124	43.5 Å²	43.5	65%	0.649	24%	0.243	S	C	*	.	H	α-helix	trans	-64	-35.1	-173.8	-68.8	174.5	0	0	0	111.3	D403 Q404 E405	L401-D403 VanDerWaalsContact C-N 3.31Å; L401-D403 PolarHBondContact O-N 3.1Å; L401-Q404 PolarHBondContact O-N 2.78Å; L401-E405 WeakPolarHBondContact O-CG 3.35Å; L401-E405 PolarHBondContact O-N 2.84Å
402	E	95	Very high	94.8	Very high	111 Å²	111	37.9 Å²	37.9	52%	0.519	22%	0.218	S	C	.	.	H	α-helix	trans	-58.8	-40.4	176.1	-59.8	86.1	162.1	0	0	112	C400 L406 K488	C400-E402 WeakPolarHBondContact CB-OE2 3.38Å; C400-E402 PolarHBondContact O-N 3.37Å; E402-L406 VanDerWaalsContact O-CB 3.23Å; E402-L406 WeakPolarHBondContact O-CB 3.37Å; E402-L406 PolarHBondContact O-N 3.22Å; E402-L406 VanDerWaalsContact O-N 3.14Å; E402-K488 HydrophobicContact CB-CG 4.31Å
403	D	96.1	Very high	94.7	Very high	0 Å²	0	34.5 Å²	34.5	0%	0	20%	0.2	C	C	.	.	H	α-helix	trans	-78.3	-34.5	176.3	-73.6	-1.1	0	0	0	111.4	F399 C400 L401 L407 L487 K488 E489	F399-D403 HydrophobicContact CB-CB 4.37Å; C400-D403 PolarHBondContact O-N 3.07Å; C400-D403 VanDerWaalsContact O-N 3.16Å; L401-D403 VanDerWaalsContact C-N 3.31Å; L401-D403 PolarHBondContact O-N 3.1Å; D403-L407 WeakPolarHBondContact O-CB 3.32Å; D403-L407 WeakPolarHBondContact O-CG 3.38Å; D403-L407 PolarHBondContact O-N 3.46Å; D403-L487 HydrophobicContact CB-CD2 3.73Å; D403-L487 VanDerWaalsContact CG-CD2 3.46Å; D403-L487 VanDerWaalsContact OD1-CA 3.3Å; D403-L487 WeakPolarHBondContact OD1-CA 3.28Å; D403-K488 VanDerWaalsContact CG-N 3.34Å; D403-K488 WeakPolarHBondContact OD1-CG 3.38Å; D403-K488 PolarHBondContact OD1-N 3.43Å; D403-K488 PolarHBondContact OD2-N 3.05Å; D403-K488 VanDerWaalsContact OD2-N 3.11Å; D403-E489 PolarHBondContact OD2-N 3.26Å
404	Q	96.6	Very high	94.8	Very high	23 Å²	23	34.9 Å²	34.9	11%	0.107	20%	0.202	C	C	.	.	H	α-helix	trans	-61.9	-44.5	174	-69.1	-178.2	46.3	0	0	112.1	F396 F399 C400 L401 L408	F396-Q404 HydrophobicContact CD1-CG 4.26Å; F396-Q404 HydrophobicContact CE1-CB 3.87Å; F396-Q404 HydrophobicContact CE1-CG 3.81Å; F396-Q404 HydrophobicContact CE2-CG 4.49Å; F396-Q404 HydrophobicContact CZ-CB 3.78Å; F396-Q404 HydrophobicContact CZ-CG 3.96Å; F399-Q404 HydrophobicContact CB-CG 3.97Å; F399-Q404 PolarHBondContact O-NE2 3.09Å; C400-Q404 PolarHBondContact O-N 2.63Å; L401-Q404 PolarHBondContact O-N 2.78Å; Q404-L408 VanDerWaalsContact O-CB 3.29Å; Q404-L408 WeakPolarHBondContact O-CB 3.27Å; Q404-L408 PolarHBondContact O-N 3.46Å
405	E	93.7	Very high	95	Very high	103 Å²	103	33.2 Å²	33.2	48%	0.481	19%	0.191	S	C	.	.	H	α-helix	trans	-67.8	-47.4	177.1	-68.3	-161.4	146.7	0	0	111.6	L401 L407 L408 E409 K559	L401-E405 WeakPolarHBondContact O-CG 3.35Å; L401-E405 PolarHBondContact O-N 2.84Å; E405-L407 PolarHBondContact O-N 3.06Å; E405-L408 PolarHBondContact O-N 2.93Å; E405-E409 WeakPolarHBondContact O-CB 3.21Å; E405-E409 PolarHBondContact O-N 3.34Å; E405-K559 IonicContact OE1-NZ 2.72Å; E405-K559 PolarHBondContact OE1-NZ 3.04Å; E405-K559 IonicContact OE2-NZ 2.72Å; E405-K559 PolarHBondContact OE2-NZ 3.24Å
406	L	93.9	Very high	95.3	Very high	42 Å²	42	31.6 Å²	31.6	22%	0.22	17%	0.173	C	C	.	.	H	α-helix	trans	-59.6	-44.4	179.8	176.6	61.8	0	0	0	113	E402 C410 L487	E402-L406 VanDerWaalsContact O-CB 3.23Å; E402-L406 WeakPolarHBondContact O-CB 3.37Å; E402-L406 PolarHBondContact O-N 3.22Å; E402-L406 VanDerWaalsContact O-N 3.14Å; L406-C410 VanDerWaalsContact O-CB 3.31Å; L406-C410 WeakPolarHBondContact O-CB 3.41Å; L406-C410 PolarHBondContact O-N 3.38Å; L406-C410 PolarHBondContact O-SG 3.34Å; L406-L487 HydrophobicContact CD2-CD2 4.01Å; L406-L487 HydrophobicContact CD2-CG 4.06Å
407	L	95.8	Very high	95.4	Very high	0 Å²	0	31.4 Å²	31.4	0%	0	17%	0.172	C	C	.	.	H	α-helix	trans	-62.8	-43.6	176.9	-70.8	174.5	0	0	0	111.2	F396 D403 E405 A411 I480 T482 R484 L487 V493	F396-L407 HydrophobicContact CE2-CB 4.34Å; F396-L407 HydrophobicContact CE2-CD1 4.1Å; D403-L407 WeakPolarHBondContact O-CB 3.32Å; D403-L407 WeakPolarHBondContact O-CG 3.38Å; D403-L407 PolarHBondContact O-N 3.46Å; E405-L407 PolarHBondContact O-N 3.06Å; L407-A411 WeakPolarHBondContact O-CB 3.42Å; L407-A411 PolarHBondContact O-N 3.06Å; L407-I480 HydrophobicContact CB-CG1 4.27Å; L407-T482 WeakPolarHBondContact CD2-O 3.32Å; L407-R484 HydrophobicContact CD2-CG 3.94Å; L407-L487 HydrophobicContact CD2-CD1 4.32Å; L407-L487 HydrophobicContact CD2-CD2 3.96Å; L407-L487 HydrophobicContact CG-CD2 4Å; L407-V493 HydrophobicContact CD1-CG1 4.4Å; L407-V493 HydrophobicContact CD1-CG2 4.13Å; L407-V493 HydrophobicContact CD2-CG1 4.19Å
408	L	94.9	Very high	95.5	Very high	9 Å²	9	28.1 Å²	28.1	5%	0.047	15%	0.149	C	C	.	.	H	α-helix	trans	-65	-45	179.4	179.3	64.2	0	0	0	112.1	F383 I386 R387 Q404 E405 A411 F412 I480	F383-L408 HydrophobicContact CE1-CD2 3.56Å; F383-L408 HydrophobicContact CE1-CG 4.01Å; F383-L408 HydrophobicContact CE2-CG 4.36Å; F383-L408 HydrophobicContact CZ-CD1 4.5Å; F383-L408 HydrophobicContact CZ-CD2 3.67Å; F383-L408 HydrophobicContact CZ-CG 3.67Å; I386-L408 HydrophobicContact CG2-CD1 3.68Å; R387-L408 HydrophobicContact CB-CD2 3.87Å; R387-L408 HydrophobicContact CG-CD2 3.81Å; Q404-L408 VanDerWaalsContact O-CB 3.29Å; Q404-L408 WeakPolarHBondContact O-CB 3.27Å; Q404-L408 PolarHBondContact O-N 3.46Å; E405-L408 PolarHBondContact O-N 2.93Å; L408-A411 PolarHBondContact O-N 3.18Å; L408-F412 WeakPolarHBondContact O-CA 3.41Å; L408-F412 VanDerWaalsContact O-CB 3.31Å; L408-F412 WeakPolarHBondContact O-CB 3.3Å; L408-F412 PolarHBondContact O-N 3.44Å; L408-I480 HydrophobicContact CB-CD1 4.49Å; L408-I480 HydrophobicContact CD1-CD1 4.17Å
409	E	91.9	Very high	95.7	Very high	23 Å²	23	25 Å²	25	11%	0.107	13%	0.127	C	C	.	.	H	α-helix	trans	-74.2	-35	-177	-76.6	151	-149.9	0	0	112.8	F383 E405 R539 K559 I560	F383-E409 HydrophobicContact CE2-CG 4.28Å; F383-E409 HydrophobicContact CZ-CG 3.99Å; E405-E409 WeakPolarHBondContact O-CB 3.21Å; E405-E409 PolarHBondContact O-N 3.34Å; E409-R539 PolarHBondContact O-NH2 3.09Å; E409-K559 WeakPolarHBondContact OE1-CD 3.13Å; E409-K559 VanDerWaalsContact OE1-CE 3.29Å; E409-K559 WeakPolarHBondContact OE1-CE 3.41Å; E409-K559 IonicContact OE1-NZ 3.17Å; E409-K559 PolarHBondContact OE1-NZ 2.9Å; E409-K559 WeakPolarHBondContact OE2-CE 3.47Å; E409-K559 IonicContact OE2-NZ 2.79Å; E409-K559 PolarHBondContact OE2-NZ 2.89Å; E409-I560 HydrophobicContact CG-CG1 4.41Å
410	C	91.9	Very high	95.8	Very high	26 Å²	26	24.6 Å²	24.6	18%	0.176	13%	0.125	C	C	.	.	H	α-helix	trans	-64	-47.8	169.4	-72.6	0	0	0	0	111.5	L406 R484 R539	L406-C410 VanDerWaalsContact O-CB 3.31Å; L406-C410 WeakPolarHBondContact O-CB 3.41Å; L406-C410 PolarHBondContact O-N 3.38Å; L406-C410 PolarHBondContact O-SG 3.34Å; C410-R484 HydrophobicContact CB-CG 3.94Å; C410-R539 PolarHBondContact O-NH2 2.98Å
411	A	95.5	Very high	95.8	Very high	0 Å²	0	23 Å²	23	0%	0	12%	0.115	C	C	.	.	H	α-helix	trans	-84	-16.2	-171.9	0	0	0	0	0	114.7	L407 L408 I413 E414 L415 V479 I480	L407-A411 WeakPolarHBondContact O-CB 3.42Å; L407-A411 PolarHBondContact O-N 3.06Å; L408-A411 PolarHBondContact O-N 3.18Å; A411-I413 PolarHBondContact O-N 3.24Å; A411-E414 WeakPolarHBondContact O-CA 3.45Å; A411-E414 WeakPolarHBondContact O-CB 3.39Å; A411-E414 PolarHBondContact O-N 3.1Å; A411-L415 HydrophobicContact CB-CD1 3.74Å; A411-L415 HydrophobicContact CB-CG 4.14Å; A411-L415 WeakPolarHBondContact O-CG 3.29Å; A411-L415 PolarHBondContact O-N 2.76Å; A411-V479 HydrophobicContact CB-CG1 4.39Å; A411-V479 WeakPolarHBondContact CB-O 3.41Å; A411-I480 HydrophobicContact CB-CB 4.32Å; A411-I480 HydrophobicContact CB-CG1 4.36Å
412	F	95.7	Very high	95.8	Very high	3 Å²	3	18.5 Å²	18.5	1%	0.013	9%	0.09	C	C	.	.	H	α-helix	trans	-50.9	-49.5	-169	166.2	-109.5	0	0	0	114.3	L379 F383 I386 L408 E414 L415 F416 I560	L379-F412 HydrophobicContact CD2-CE1 4.16Å; L379-F412 HydrophobicContact CD2-CZ 4.07Å; L379-F412 WeakPolarHBondContact O-CZ 3.46Å; F383-F412 VanDerWaalsContact CA-CE2 3.42Å; F383-F412 HydrophobicContact CB-CD2 4.01Å; F383-F412 HydrophobicContact CB-CE2 3.63Å; F383-F412 HydrophobicContact CB-CZ 4.02Å; F383-F412 HydrophobicContact CD2-CB 3.92Å; F383-F412 AromaticContact CD2-CD1 3.85Å; F383-F412 HydrophobicContact CD2-CD1 3.85Å; F383-F412 AromaticContact CD2-CD2 3.37Å; F383-F412 HydrophobicContact CD2-CD2 3.37Å; F383-F412 HydrophobicContact CD2-CE1 4.21Å; F383-F412 AromaticContact CD2-CE2 3.81Å; F383-F412 HydrophobicContact CD2-CE2 3.81Å; F383-F412 AromaticContact CD2-CG 3.39Å; F383-F412 HydrophobicContact CD2-CG 3.39Å; F383-F412 HydrophobicContact CD2-CZ 4.2Å; F383-F412 HydrophobicContact CE2-CB 3.82Å; F383-F412 HydrophobicContact CE2-CD1 4.4Å; F383-F412 HydrophobicContact CE2-CD2 4.13Å; F383-F412 AromaticContact CE2-CG 3.83Å; F383-F412 HydrophobicContact CE2-CG 3.83Å; F383-F412 AromaticContact CG-CD2 3.99Å; F383-F412 HydrophobicContact CG-CD2 3.99Å; F383-F412 HydrophobicContact CG-CE2 4.13Å; F383-F412 HydrophobicContact CG-CG 4.42Å; I386-F412 HydrophobicContact CD1-CD2 3.93Å; I386-F412 HydrophobicContact CD1-CE2 3.95Å; L408-F412 WeakPolarHBondContact O-CA 3.41Å; L408-F412 VanDerWaalsContact O-CB 3.31Å; L408-F412 WeakPolarHBondContact O-CB 3.3Å; L408-F412 PolarHBondContact O-N 3.44Å; F412-E414 VanDerWaalsContact C-N 3.35Å; F412-E414 PolarHBondContact O-N 3.43Å; F412-L415 PolarHBondContact O-N 3.37Å; F412-F416 HydrophobicContact CE2-CB 4.18Å; F412-F416 HydrophobicContact CZ-CB 4.25Å; F412-F416 WeakPolarHBondContact O-CB 3.42Å; F412-F416 PolarHBondContact O-N 2.83Å; F412-I560 HydrophobicContact CD1-CD1 3.62Å; F412-I560 HydrophobicContact CD1-CG1 4.46Å; F412-I560 HydrophobicContact CD1-CG2 4.33Å; F412-I560 HydrophobicContact CE1-CD1 3.97Å; F412-I560 HydrophobicContact CG-CD1 4.26Å
413	I	95.6	Very high	95.8	Very high	0 Å²	0	15 Å²	15	0%	0	7%	0.072	C	C	.	.	H	α-helix	trans	-66.7	-39.7	-177.7	-52.9	-68.8	0	0	0	110.4	A411 L415 F416 I417 W451 R539 I542 I560	A411-I413 PolarHBondContact O-N 3.24Å; I413-L415 PolarHBondContact O-N 3.38Å; I413-F416 PolarHBondContact O-N 3.27Å; I413-I417 HydrophobicContact CG2-CD1 3.9Å; I413-I417 VanDerWaalsContact O-CD1 3.27Å; I413-I417 WeakPolarHBondContact O-CD1 3.02Å; I413-I417 VanDerWaalsContact O-CG1 3.27Å; I413-I417 WeakPolarHBondContact O-CG1 3.23Å; I413-I417 PolarHBondContact O-N 2.85Å; I413-W451 HydrophobicContact CG2-CZ2 4.2Å; I413-R539 HydrophobicContact CG1-CG 4.23Å; I413-I542 HydrophobicContact CD1-CD1 3.77Å; I413-I560 HydrophobicContact CG1-CG2 4.45Å
414	E	97.1	Very high	95.7	Very high	10 Å²	10	15 Å²	15	5%	0.047	7%	0.073	C	C	.	.	H	α-helix	trans	-59.7	-44.9	173.8	-59.8	179.7	-106.7	0	0	110.7	A411 F412 L418 V479 R484 L531	A411-E414 WeakPolarHBondContact O-CA 3.45Å; A411-E414 WeakPolarHBondContact O-CB 3.39Å; A411-E414 PolarHBondContact O-N 3.1Å; F412-E414 VanDerWaalsContact C-N 3.35Å; F412-E414 PolarHBondContact O-N 3.43Å; E414-L418 VanDerWaalsContact O-CB 3.29Å; E414-L418 WeakPolarHBondContact O-CB 3.04Å; E414-L418 PolarHBondContact O-N 3.46Å; E414-V479 HydrophobicContact CB-CG1 3.5Å; E414-R484 IonicContact OE1-CZ 3.75Å; E414-R484 IonicContact OE1-NH1 3.47Å; E414-R484 PolarHBondContact OE1-NH1 3.21Å; E414-R484 IonicContact OE1-NH2 2.65Å; E414-R484 PolarHBondContact OE1-NH2 3.34Å; E414-L531 HydrophobicContact CB-CD2 3.98Å; E414-L531 HydrophobicContact CB-CG 4.03Å; E414-L531 HydrophobicContact CG-CG 4.5Å; E414-L531 WeakPolarHBondContact O-CD1 3.29Å
415	L	97.6	Very high	95.6	Very high	0 Å²	0	16.7 Å²	16.7	0%	0	8%	0.082	C	C	.	.	H	α-helix	trans	-68.6	-38.5	178.4	-65.3	165.1	0	0	0	112.9	I386 W389 A411 F412 I413 R419 T476 V479 I480	I386-L415 HydrophobicContact CD1-CB 3.86Å; I386-L415 HydrophobicContact CG2-CB 4.26Å; I386-L415 HydrophobicContact CG2-CD1 3.61Å; W389-L415 HydrophobicContact CH2-CD2 4.19Å; W389-L415 HydrophobicContact CZ3-CD1 4.29Å; W389-L415 HydrophobicContact CZ3-CD2 4.09Å; A411-L415 HydrophobicContact CB-CD1 3.74Å; A411-L415 HydrophobicContact CB-CG 4.14Å; A411-L415 WeakPolarHBondContact O-CG 3.29Å; A411-L415 PolarHBondContact O-N 2.76Å; F412-L415 PolarHBondContact O-N 3.37Å; I413-L415 PolarHBondContact O-N 3.38Å; L415-R419 VanDerWaalsContact O-CB 3.25Å; L415-R419 WeakPolarHBondContact O-CB 3.31Å; L415-R419 VanDerWaalsContact O-CG 3.28Å; L415-R419 WeakPolarHBondContact O-CG 3.44Å; L415-R419 PolarHBondContact O-N 3.07Å; L415-T476 HydrophobicContact CD2-CG2 3.73Å; L415-T476 WeakPolarHBondContact CD2-O 3.18Å; L415-V479 HydrophobicContact CD2-CB 3.86Å; L415-V479 HydrophobicContact CD2-CG1 3.7Å; L415-V479 HydrophobicContact CG-CG1 3.87Å; L415-I480 HydrophobicContact CD1-CB 4.03Å; L415-I480 HydrophobicContact CD1-CD1 4.23Å; L415-I480 HydrophobicContact CD1-CG1 4.36Å; L415-I480 HydrophobicContact CD2-CB 4.46Å
416	F	97.3	Very high	95.5	Very high	5 Å²	5	13.1 Å²	13.1	2%	0.022	7%	0.068	C	C	.	.	H	α-helix	trans	-60.5	-51.9	175.9	169.1	-104.4	0	0	0	110.7	L379 S382 F412 I413 L420 F433 F448 W451	L379-F416 HydrophobicContact CD2-CD1 4.12Å; L379-F416 HydrophobicContact CD2-CD2 4.25Å; L379-F416 HydrophobicContact CD2-CE1 3.94Å; L379-F416 HydrophobicContact CD2-CE2 4.07Å; L379-F416 HydrophobicContact CD2-CG 4.26Å; L379-F416 HydrophobicContact CD2-CZ 3.9Å; S382-F416 WeakPolarHBondContact OG-CD2 3.36Å; S382-F416 WeakPolarHBondContact OG-CE2 3.49Å; F412-F416 HydrophobicContact CE2-CB 4.18Å; F412-F416 HydrophobicContact CZ-CB 4.25Å; F412-F416 WeakPolarHBondContact O-CB 3.42Å; F412-F416 PolarHBondContact O-N 2.83Å; I413-F416 PolarHBondContact O-N 3.27Å; F416-L420 HydrophobicContact CE1-CD2 4.33Å; F416-L420 HydrophobicContact CE2-CD2 4.46Å; F416-L420 HydrophobicContact CZ-CD2 3.98Å; F416-L420 WeakPolarHBondContact O-CB 3.35Å; F416-L420 PolarHBondContact O-N 3.1Å; F416-F433 HydrophobicContact CE2-CE1 4.41Å; F416-F433 HydrophobicContact CZ-CE1 4.26Å; F416-F448 AromaticContact CE1-CE1 3.99Å; F416-F448 HydrophobicContact CE1-CE1 3.99Å; F416-F448 AromaticContact CZ-CE1 3.85Å; F416-F448 HydrophobicContact CZ-CE1 3.85Å; F416-F448 HydrophobicContact CZ-CZ 4.12Å; F416-W451 AromaticContact CD1-CH2 3.91Å; F416-W451 HydrophobicContact CD1-CH2 3.91Å; F416-W451 HydrophobicContact CD1-CZ2 4.42Å; F416-W451 AromaticContact CE1-CH2 3.63Å; F416-W451 HydrophobicContact CE1-CH2 3.63Å; F416-W451 HydrophobicContact CE1-CZ2 4.38Å; F416-W451 HydrophobicContact CE1-CZ3 4.19Å
417	I	98	Very high	95.4	Very high	0 Å²	0	18.8 Å²	18.8	0%	0	9%	0.093	C	C	.	.	H	α-helix	trans	-59.5	-51.9	177.3	-64.2	154.6	0	0	0	110.2	I413 R419 L420 A421 W451 I455 F458 L531 L534	I413-I417 HydrophobicContact CG2-CD1 3.9Å; I413-I417 VanDerWaalsContact O-CD1 3.27Å; I413-I417 WeakPolarHBondContact O-CD1 3.02Å; I413-I417 VanDerWaalsContact O-CG1 3.27Å; I413-I417 WeakPolarHBondContact O-CG1 3.23Å; I413-I417 PolarHBondContact O-N 2.85Å; I417-R419 PolarHBondContact O-N 2.69Å; I417-L420 PolarHBondContact O-N 3.14Å; I417-A421 WeakPolarHBondContact O-CB 3.49Å; I417-A421 PolarHBondContact O-N 3.37Å; I417-W451 HydrophobicContact CD1-CZ2 3.95Å; I417-W451 HydrophobicContact CG1-CZ2 3.75Å; I417-I455 HydrophobicContact CG2-CG1 4.3Å; I417-F458 HydrophobicContact CG2-CD1 4.26Å; I417-L531 HydrophobicContact CB-CD1 3.78Å; I417-L531 HydrophobicContact CG2-CD1 3.59Å; I417-L534 VanDerWaalsContact CD1-C 3.41Å; I417-L534 HydrophobicContact CD1-CB 3.68Å; I417-L534 HydrophobicContact CG2-CB 4.18Å; I417-L534 HydrophobicContact CG2-CD1 3.99Å
418	L	98.3	Very high	95.2	Very high	0 Å²	0	21.9 Å²	21.9	0%	0	11%	0.112	C	C	.	.	H	α-helix	trans	-61.1	-44.9	-175.1	-179.7	60.5	0	0	0	112.2	E414 H422 F458 L462 F472 L475 T476 V479 L531	E414-L418 VanDerWaalsContact O-CB 3.29Å; E414-L418 WeakPolarHBondContact O-CB 3.04Å; E414-L418 PolarHBondContact O-N 3.46Å; L418-H422 PolarHBondContact O-N 2.84Å; L418-H422 VanDerWaalsContact O-N 3.11Å; L418-F458 HydrophobicContact CD1-CE1 4.11Å; L418-F458 HydrophobicContact CD1-CZ 4.3Å; L418-L462 HydrophobicContact CD1-CD1 4.44Å; L418-L462 HydrophobicContact CD1-CD2 4.15Å; L418-F472 HydrophobicContact CD1-CE2 3.8Å; L418-F472 HydrophobicContact CD2-CE2 4.36Å; L418-F472 HydrophobicContact CG-CE2 3.75Å; L418-F472 HydrophobicContact CG-CZ 4.2Å; L418-L475 HydrophobicContact CD1-CD2 3.87Å; L418-L475 HydrophobicContact CD2-CD2 3.94Å; L418-L475 HydrophobicContact CD2-CG 4.02Å; L418-T476 HydrophobicContact CD2-CG2 4.49Å; L418-V479 HydrophobicContact CD2-CG2 3.99Å; L418-L531 HydrophobicContact CB-CD1 4.07Å; L418-L531 HydrophobicContact CB-CD2 4.05Å; L418-L531 HydrophobicContact CD2-CD2 4.26Å
419	R	97.4	Very high	95.1	Very high	5 Å²	5	21.8 Å²	21.8	2%	0.019	11%	0.114	C	C	.	.	H	α-helix	trans	-75.5	-29.8	-179.3	-67	-176.3	61.9	168.5	0.2	113.3	S344 N345 L415 I417 R423 F472 T476	S344-R419 PolarHBondContact O-NH2 2.88Å; S344-R419 PolarHBondContact OG-NH1 3.06Å; S344-R419 PolarHBondContact OG-NH2 3.14Å; N345-R419 PolarHBondContact OD1-NH2 3.4Å; L415-R419 VanDerWaalsContact O-CB 3.25Å; L415-R419 WeakPolarHBondContact O-CB 3.31Å; L415-R419 VanDerWaalsContact O-CG 3.28Å; L415-R419 WeakPolarHBondContact O-CG 3.44Å; L415-R419 PolarHBondContact O-N 3.07Å; I417-R419 PolarHBondContact O-N 2.69Å; R419-R423 WeakPolarHBondContact O-CG 3.38Å; R419-F472 HydrophobicContact CG-CZ 4.39Å; R419-T476 HydrophobicContact CG-CG2 3.94Å
420	L	97.3	Very high	95.2	Very high	0 Å²	0	22 Å²	22	0%	0	12%	0.115	C	C	.	.	H	α-helix	trans	-69.7	-48.2	170.9	-178.2	60	0	0	0	110.5	F416 I417 H422 R423 S424 L431 I432 F433 I455	F416-L420 HydrophobicContact CE1-CD2 4.33Å; F416-L420 HydrophobicContact CE2-CD2 4.46Å; F416-L420 HydrophobicContact CZ-CD2 3.98Å; F416-L420 WeakPolarHBondContact O-CB 3.35Å; F416-L420 PolarHBondContact O-N 3.1Å; I417-L420 PolarHBondContact O-N 3.14Å; L420-H422 VanDerWaalsContact C-N 3.31Å; L420-H422 PolarHBondContact O-N 3.14Å; L420-R423 PolarHBondContact O-N 3.01Å; L420-S424 WeakPolarHBondContact O-CB 3.3Å; L420-S424 PolarHBondContact O-N 2.9Å; L420-S424 PolarHBondContact O-OG 2.91Å; L420-L431 HydrophobicContact CD1-CB 4.39Å; L420-L431 HydrophobicContact CD1-CD2 4.24Å; L420-L431 HydrophobicContact CD2-CD2 4.04Å; L420-L431 HydrophobicContact CG-CD2 4.12Å; L420-I432 WeakPolarHBondContact CD1-O 3.27Å; L420-F433 HydrophobicContact CD1-CD1 3.91Å; L420-F433 HydrophobicContact CD1-CE1 3.81Å; L420-F433 HydrophobicContact CD1-CE2 4.45Å; L420-F433 HydrophobicContact CD1-CG 4.28Å; L420-F433 HydrophobicContact CD1-CZ 4.1Å; L420-F433 HydrophobicContact CD2-CD1 4.48Å; L420-F433 HydrophobicContact CD2-CE1 3.72Å; L420-F433 HydrophobicContact CD2-CZ 4.11Å; L420-F433 HydrophobicContact CG-CE1 4.44Å; L420-I455 HydrophobicContact CD2-CG2 4.35Å
421	A	97.4	Very high	95.3	Very high	0 Å²	0	20.8 Å²	20.8	0%	0	11%	0.106	C	C	.	.	H	α-helix	trans	-61.6	-34.4	-178.8	0	0	0	0	0	113.5	I417 F458 S459 L462	I417-A421 WeakPolarHBondContact O-CB 3.49Å; I417-A421 PolarHBondContact O-N 3.37Å; A421-F458 HydrophobicContact CB-CD1 3.74Å; A421-F458 HydrophobicContact CB-CE1 4.16Å; A421-S459 WeakPolarHBondContact O-CB 3.38Å; A421-S459 PolarHBondContact O-OG 3.24Å; A421-L462 HydrophobicContact CB-CD2 4.48Å
422	H	96	Very high	95.3	Very high	28 Å²	28	22 Å²	22	13%	0.13	11%	0.112	C	C	.	.	H	α-helix	trans	-70.2	-38.2	175.2	-170.1	-94	0	0	0	113.5	L418 L420 L462 H463 E469 F472	L418-H422 PolarHBondContact O-N 2.84Å; L418-H422 VanDerWaalsContact O-N 3.11Å; L420-H422 VanDerWaalsContact C-N 3.31Å; L420-H422 PolarHBondContact O-N 3.14Å; H422-L462 HydrophobicContact CB-CD2 4.16Å; H422-H463 PolarHBondContact O-CE1 3.21Å; H422-E469 IonicContact CE1-OE1 3.27Å; H422-F472 HydrophobicContact CB-CD2 4.25Å; H422-F472 HydrophobicContact CB-CE1 4.03Å; H422-F472 HydrophobicContact CB-CE2 3.53Å; H422-F472 HydrophobicContact CB-CZ 3.41Å; H422-F472 VanDerWaalsContact CB-CZ 3.41Å; H422-F472 AromaticContact CD2-CD1 3.81Å; H422-F472 AromaticContact CD2-CD2 3.24Å; H422-F472 WeakPolarHBondContact CD2-CD2 3.39Å; H422-F472 AromaticContact CD2-CE2 3.48Å; H422-F472 VanDerWaalsContact CD2-CE2 3.48Å; H422-F472 WeakPolarHBondContact CD2-CE2 3.35Å; H422-F472 AromaticContact CD2-CG 3.43Å; H422-F472 VanDerWaalsContact CD2-CG 3.43Å; H422-F472 WeakPolarHBondContact CD2-CG 3.47Å; H422-F472 AromaticContact CD2-CZ 3.88Å; H422-F472 AromaticContact CE1-CD1 3.77Å; H422-F472 AromaticContact CE1-CG 3.98Å; H422-F472 AromaticContact CG-CD1 3.92Å; H422-F472 AromaticContact CG-CD2 3.82Å; H422-F472 AromaticContact CG-CE1 3.7Å; H422-F472 AromaticContact CG-CE2 3.58Å; H422-F472 AromaticContact CG-CG 3.98Å; H422-F472 AromaticContact CG-CZ 3.54Å; H422-F472 AromaticContact ND1-CD1 3.9Å; H422-F472 AromaticContact ND1-CE1 3.81Å; H422-F472 AromaticContact NE2-CD1 3.71Å; H422-F472 AromaticContact NE2-CD2 3.76Å; H422-F472 AromaticContact NE2-CG 3.43Å; H422-F472 WeakPolarHBondContact NE2-CG 3.07Å
423	R	94.3	Very high	95.3	Very high	37 Å²	37	21.9 Å²	21.9	14%	0.14	11%	0.112	C	C	.	.	H	α-helix	trans	-84.6	-20.5	-179.8	-64.1	-171.5	-54.4	-97.4	-13.8	114	N345 R419 L420 I432	N345-R423 PolarHBondContact OD1-NH1 2.92Å; R419-R423 WeakPolarHBondContact O-CG 3.38Å; L420-R423 PolarHBondContact O-N 3.01Å; R423-I432 HydrophobicContact CB-CB 4.04Å; R423-I432 HydrophobicContact CB-CG2 4.35Å; R423-I432 PolarHBondContact NE-O 2.86Å; R423-I432 PolarHBondContact NH2-O 2.94Å
424	S	94.1	Very high	95.1	Very high	2 Å²	2	22.9 Å²	22.9	1%	0.014	12%	0.119	C	C	.	.	S	Bend	trans	-77.2	148	-179.2	-56.6	0	0	0	0	111	L420 P426 E430 H463	L420-S424 WeakPolarHBondContact O-CB 3.3Å; L420-S424 PolarHBondContact O-N 2.9Å; L420-S424 PolarHBondContact O-OG 2.91Å; S424-P426 WeakPolarHBondContact O-CD 3.3Å; S424-E430 CarbonylContact C-O 3.59Å; S424-E430 VanDerWaalsContact CA-O 3.24Å; S424-E430 WeakPolarHBondContact CA-O 3.44Å; S424-E430 VanDerWaalsContact CB-O 3.26Å; S424-E430 WeakPolarHBondContact CB-O 3.46Å; S424-H463 PolarHBondContact O-NE2 3.39Å
425	N	93.6	Very high	94.7	Very high	58 Å²	58	26 Å²	26	31%	0.31	14%	0.136	S	C	.	.	B	Isolated β-bridge	trans	-102.1	107.3	170.9	-178.7	-5.4	0	0	0	109.4	E427 T428 G429 E430	N425-E427 VanDerWaalsContact C-N 3.31Å; N425-E427 PolarHBondContact O-N 3.38Å; N425-E427 PolarHBondContact OD1-N 3.47Å; N425-T428 WeakPolarHBondContact CB-OG1 3.35Å; N425-T428 VanDerWaalsContact CG-OG1 3.24Å; N425-T428 PolarHBondContact ND2-OG1 3.21Å; N425-T428 PolarHBondContact O-OG1 3.44Å; N425-G429 PolarHBondContact O-N 3.38Å; N425-E430 HydrophobicContact CB-CB 4.31Å; N425-E430 PolarHBondContact N-O 2.81Å; N425-E430 PolarHBondContact O-N 3.5Å
426	P	93.1	Very high	94.3	Very high	27 Å²	27	26.1 Å²	26.1	18%	0.175	14%	0.136	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71.9	-22.3	-177.9	30	-35.4	0	0	0	113.3	S424 Q460	S424-P426 WeakPolarHBondContact O-CD 3.3Å; P426-Q460 HydrophobicContact CB-CB 4.04Å; P426-Q460 HydrophobicContact CG-CB 4.09Å
427	E	91.2	Very high	94.1	Very high	162 Å²	162	26.1 Å²	26.1	76%	0.757	14%	0.137	S	C	*	.	T	Hydrogen-bonded Turn	trans	-74.1	-34.9	179.7	-59.7	-173.9	171.4	0	0	111.9	N425	N425-E427 VanDerWaalsContact C-N 3.31Å; N425-E427 PolarHBondContact O-N 3.38Å; N425-E427 PolarHBondContact OD1-N 3.47Å
428	T	91.4	Very high	94	Very high	64 Å²	64	26.1 Å²	26.1	39%	0.393	14%	0.137	S	C	.	.	T	Hydrogen-bonded Turn	trans	-93.9	-7.4	174.3	56.8	0	0	0	0	113.5	N425 E430 H440	N425-T428 WeakPolarHBondContact CB-OG1 3.35Å; N425-T428 VanDerWaalsContact CG-OG1 3.24Å; N425-T428 PolarHBondContact ND2-OG1 3.21Å; N425-T428 PolarHBondContact O-OG1 3.44Å; T428-E430 PolarHBondContact O-N 3.01Å; T428-E430 VanDerWaalsContact OG1-CB 3.24Å; T428-E430 WeakPolarHBondContact OG1-CB 3.45Å; T428-E430 PolarHBondContact OG1-OE2 3.39Å; T428-H440 PolarHBondContact O-CD2 3.48Å
429	G	91.9	Very high	93.8	Very high	8 Å²	8	26.4 Å²	26.4	8%	0.082	14%	0.139	C	C	.	.	T	Hydrogen-bonded Turn	trans	67.6	23.6	-173.5	0	0	0	0	0	113.6	N425 H440 K441	N425-G429 PolarHBondContact O-N 3.38Å; G429-H440 CarbonylContact O-C 3.59Å; G429-H440 PolarHBondContact O-CD2 3.37Å; G429-K441 PolarHBondContact O-N 2.87Å
430	E	94.1	Very high	93.6	Very high	28 Å²	28	27.3 Å²	27.3	13%	0.131	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.4	126.6	-173.5	-178.2	-175.1	168.1	0	0	111.3	Y353 Y356 S424 N425 T428 V438	Y353-E430 VanDerWaalsContact CE1-OE1 3.24Å; Y353-E430 WeakPolarHBondContact CE1-OE1 3.36Å; Y353-E430 VanDerWaalsContact CZ-OE1 3.32Å; Y353-E430 PolarHBondContact OH-OE1 2.8Å; Y356-E430 HydrophobicContact CE2-CB 4.33Å; Y356-E430 HydrophobicContact CE2-CG 4.14Å; S424-E430 CarbonylContact C-O 3.59Å; S424-E430 VanDerWaalsContact CA-O 3.24Å; S424-E430 WeakPolarHBondContact CA-O 3.44Å; S424-E430 VanDerWaalsContact CB-O 3.26Å; S424-E430 WeakPolarHBondContact CB-O 3.46Å; N425-E430 HydrophobicContact CB-CB 4.31Å; N425-E430 PolarHBondContact N-O 2.81Å; N425-E430 PolarHBondContact O-N 3.5Å; T428-E430 PolarHBondContact O-N 3.01Å; T428-E430 VanDerWaalsContact OG1-CB 3.24Å; T428-E430 WeakPolarHBondContact OG1-CB 3.45Å; T428-E430 PolarHBondContact OG1-OE2 3.39Å; E430-V438 HydrophobicContact CG-CG1 3.5Å
431	L	95.6	Very high	93.4	Very high	0 Å²	0	30.2 Å²	30.2	0%	0	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	122.2	-179	-68	118.3	0	0	0	111.2	L420 F433 V438 L439 K441 C444 I452 L456	L420-L431 HydrophobicContact CD1-CB 4.39Å; L420-L431 HydrophobicContact CD1-CD2 4.24Å; L420-L431 HydrophobicContact CD2-CD2 4.04Å; L420-L431 HydrophobicContact CG-CD2 4.12Å; L431-F433 HydrophobicContact CB-CE2 3.81Å; L431-F433 HydrophobicContact CB-CZ 4.27Å; L431-V438 WeakPolarHBondContact O-CA 3.44Å; L431-L439 PolarHBondContact N-O 2.82Å; L431-L439 PolarHBondContact O-N 2.82Å; L431-K441 HydrophobicContact CD1-CB 4.4Å; L431-C444 HydrophobicContact CD1-CB 4.47Å; L431-I452 HydrophobicContact CD1-CD1 4.02Å; L431-I452 HydrophobicContact CD1-CG1 4.24Å; L431-I452 HydrophobicContact CD2-CD1 3.61Å; L431-I452 HydrophobicContact CD2-CG1 4.47Å; L431-I452 HydrophobicContact CG-CD1 4.48Å; L431-L456 HydrophobicContact CD1-CD1 4.38Å; L431-L456 HydrophobicContact CD1-CD2 4.49Å; L431-L456 HydrophobicContact CD2-CD2 4.12Å; L431-L456 HydrophobicContact CG-CD2 4.18Å
432	I	95.3	Very high	93	Very high	24 Å²	24	31.7 Å²	31.7	12%	0.123	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	105.9	-177	-59.4	-176.5	0	0	0	110.1	P346 L351 L420 R423 V438	P346-I432 HydrophobicContact CG-CG2 4.14Å; L351-I432 HydrophobicContact CD1-CD1 4.22Å; L351-I432 HydrophobicContact CD2-CG2 3.62Å; L420-I432 WeakPolarHBondContact CD1-O 3.27Å; R423-I432 HydrophobicContact CB-CB 4.04Å; R423-I432 HydrophobicContact CB-CG2 4.35Å; R423-I432 PolarHBondContact NE-O 2.86Å; R423-I432 PolarHBondContact NH2-O 2.94Å; I432-V438 HydrophobicContact CG1-CG1 4.16Å; I432-V438 HydrophobicContact CG1-CG2 4.27Å
433	F	94.9	Very high	92.7	Very high	1 Å²	1	32 Å²	32	0%	0.004	17%	0.166	C	C	.	.			trans	-81.3	163.9	179.1	-66.8	-86.4	0	0	0	111.8	L378 F416 L420 L431 D435 G436 T437 L439 F448	L378-F433 HydrophobicContact CB-CD1 4.38Å; L378-F433 HydrophobicContact CD1-CD1 4.24Å; L378-F433 HydrophobicContact CD1-CD2 4.49Å; L378-F433 HydrophobicContact CD1-CE1 4.1Å; L378-F433 HydrophobicContact CD1-CE2 4.35Å; L378-F433 HydrophobicContact CD1-CG 4.44Å; L378-F433 HydrophobicContact CD1-CZ 4.15Å; L378-F433 HydrophobicContact CD2-CB 3.92Å; L378-F433 HydrophobicContact CD2-CD1 4Å; L378-F433 HydrophobicContact CD2-CD2 4.28Å; L378-F433 HydrophobicContact CD2-CG 3.78Å; L378-F433 HydrophobicContact CG-CD1 4.44Å; F416-F433 HydrophobicContact CE2-CE1 4.41Å; F416-F433 HydrophobicContact CZ-CE1 4.26Å; L420-F433 HydrophobicContact CD1-CD1 3.91Å; L420-F433 HydrophobicContact CD1-CE1 3.81Å; L420-F433 HydrophobicContact CD1-CE2 4.45Å; L420-F433 HydrophobicContact CD1-CG 4.28Å; L420-F433 HydrophobicContact CD1-CZ 4.1Å; L420-F433 HydrophobicContact CD2-CD1 4.48Å; L420-F433 HydrophobicContact CD2-CE1 3.72Å; L420-F433 HydrophobicContact CD2-CZ 4.11Å; L420-F433 HydrophobicContact CG-CE1 4.44Å; L431-F433 HydrophobicContact CB-CE2 3.81Å; L431-F433 HydrophobicContact CB-CZ 4.27Å; F433-D435 VanDerWaalsContact C-N 3.29Å; F433-D435 WeakPolarHBondContact CB-OD1 3.29Å; F433-D435 PolarHBondContact O-N 3.43Å; F433-G436 PolarHBondContact O-N 2.89Å; F433-T437 PolarHBondContact N-O 3.21Å; F433-L439 HydrophobicContact CD2-CD1 4.45Å; F433-L439 HydrophobicContact CE2-CB 4.3Å; F433-L439 HydrophobicContact CE2-CD1 3.92Å; F433-L439 HydrophobicContact CE2-CG 4.26Å; F433-F448 AromaticContact CE1-CZ 3.84Å; F433-F448 HydrophobicContact CE1-CZ 3.84Å; F433-F448 HydrophobicContact CZ-CE2 4.22Å; F433-F448 AromaticContact CZ-CZ 3.89Å; F433-F448 HydrophobicContact CZ-CZ 3.89Å
434	C	91.3	Very high	92.6	Very high	21 Å²	21	30.2 Å²	30.2	14%	0.142	16%	0.159	C	C	.	.	T	Hydrogen-bonded Turn	trans	-73.5	-19.2	-171.7	61	0	0	0	0	114.4	A381 S382 A385	A381-C434 VanDerWaalsContact C-SG 3.57Å; S382-C434 WeakPolarHBondContact CA-SG 3.37Å; S382-C434 PolarHBondContact N-SG 3.05Å; S382-C434 VanDerWaalsContact N-SG 3.45Å; A385-C434 HydrophobicContact CB-CB 3.95Å
435	D	88.5	Confident	92.4	Very high	77 Å²	77	32.9 Å²	32.9	41%	0.412	18%	0.175	S	C	.	.	T	Hydrogen-bonded Turn	trans	-79.2	-5.8	174	67.4	-34.3	0	0	0	112.5	A381 F433 T437	A381-D435 HydrophobicContact CB-CB 4.39Å; F433-D435 VanDerWaalsContact C-N 3.29Å; F433-D435 WeakPolarHBondContact CB-OD1 3.29Å; F433-D435 PolarHBondContact O-N 3.43Å; D435-T437 WeakPolarHBondContact OD1-CB 3.44Å; D435-T437 PolarHBondContact OD1-N 3.36Å; D435-T437 VanDerWaalsContact OD2-CB 3.22Å; D435-T437 WeakPolarHBondContact OD2-CB 3.12Å; D435-T437 PolarHBondContact OD2-OG1 3.05Å
436	G	90.3	Very high	91.9	Very high	1 Å²	1	32.6 Å²	32.6	1%	0.01	17%	0.17	C	C	.	.	S	Bend	trans	90	-6.5	-173.3	0	0	0	0	0	114.1	L351 D352 F433 V438	L351-G436 CarbonylContact C-O 3.55Å; L351-G436 WeakPolarHBondContact CA-O 3.47Å; D352-G436 PolarHBondContact N-O 3.42Å; F433-G436 PolarHBondContact O-N 2.89Å; G436-V438 PolarHBondContact O-N 3.01Å
437	T	93	Very high	91.7	Very high	5 Å²	5	31.6 Å²	31.6	3%	0.031	16%	0.163	C	C	.	.	B	Isolated β-bridge	trans	-64	129.8	176	-68.7	0	0	0	0	110	K355 F433 D435 L439	K355-T437 HydrophobicContact CD-CG2 3.99Å; K355-T437 PolarHBondContact NZ-OG1 2.88Å; F433-T437 PolarHBondContact N-O 3.21Å; D435-T437 WeakPolarHBondContact OD1-CB 3.44Å; D435-T437 PolarHBondContact OD1-N 3.36Å; D435-T437 VanDerWaalsContact OD2-CB 3.22Å; D435-T437 WeakPolarHBondContact OD2-CB 3.12Å; D435-T437 PolarHBondContact OD2-OG1 3.05Å; T437-L439 HydrophobicContact CG2-CD1 4.48Å; T437-L439 HydrophobicContact CG2-CD2 4.03Å; T437-L439 HydrophobicContact CG2-CG 3.95Å
438	V	94.6	Very high	91.8	Very high	0 Å²	0	23.9 Å²	23.9	0%	0	13%	0.128	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	127.5	174.4	-168	0	0	0	0	110.1	L351 D352 Y353 Y356 E430 L431 I432 G436	L351-V438 HydrophobicContact CB-CG2 3.99Å; L351-V438 HydrophobicContact CD2-CG2 4.2Å; D352-V438 PolarHBondContact O-N 3.02Å; D352-V438 VanDerWaalsContact O-N 3.11Å; Y353-V438 HydrophobicContact CD1-CB 4.07Å; Y353-V438 HydrophobicContact CD1-CG1 4.03Å; Y353-V438 HydrophobicContact CD1-CG2 4.41Å; Y353-V438 HydrophobicContact CD2-CG2 4.4Å; Y353-V438 HydrophobicContact CE1-CB 4.04Å; Y353-V438 HydrophobicContact CE1-CG1 3.63Å; Y353-V438 HydrophobicContact CE1-CG2 4.16Å; Y353-V438 HydrophobicContact CE2-CG2 4.15Å; Y353-V438 HydrophobicContact CG-CB 4.47Å; Y356-V438 HydrophobicContact CD2-CG1 4.1Å; E430-V438 HydrophobicContact CG-CG1 3.5Å; L431-V438 WeakPolarHBondContact O-CA 3.44Å; I432-V438 HydrophobicContact CG1-CG1 4.16Å; I432-V438 HydrophobicContact CG1-CG2 4.27Å; G436-V438 PolarHBondContact O-N 3.01Å
439	L	93.8	Very high	91.8	Very high	7 Å²	7	21.5 Å²	21.5	4%	0.037	12%	0.115	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	147.1	179.3	-60.5	177	0	0	0	111.1	K355 L378 L431 F433 T437	K355-L439 HydrophobicContact CB-CD2 3.93Å; L378-L439 HydrophobicContact CD1-CD1 4.23Å; L431-L439 PolarHBondContact N-O 2.82Å; L431-L439 PolarHBondContact O-N 2.82Å; F433-L439 HydrophobicContact CD2-CD1 4.45Å; F433-L439 HydrophobicContact CE2-CB 4.3Å; F433-L439 HydrophobicContact CE2-CD1 3.92Å; F433-L439 HydrophobicContact CE2-CG 4.26Å; T437-L439 HydrophobicContact CG2-CD1 4.48Å; T437-L439 HydrophobicContact CG2-CD2 4.03Å; T437-L439 HydrophobicContact CG2-CG 3.95Å
440	H	93.6	Very high	91.8	Very high	24 Å²	24	28.1 Å²	28.1	11%	0.111	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.3	148.9	166.5	-177.6	-112.4	0	0	0	111.1	Y356 T428 G429 T442 Q443 C444	Y356-H440 HydrophobicContact CD2-CB 4.19Å; Y356-H440 HydrophobicContact CE2-CB 3.66Å; T428-H440 PolarHBondContact O-CD2 3.48Å; G429-H440 CarbonylContact O-C 3.59Å; G429-H440 PolarHBondContact O-CD2 3.37Å; H440-T442 VanDerWaalsContact C-N 3.28Å; H440-T442 PolarHBondContact CE1-OG1 3.43Å; H440-T442 PolarHBondContact ND1-N 3.05Å; H440-T442 PolarHBondContact ND1-OG1 3Å; H440-T442 PolarHBondContact O-N 3.39Å; H440-T442 VanDerWaalsContact O-N 3.15Å; H440-Q443 HydrophobicContact CB-CG 4.38Å; H440-Q443 VanDerWaalsContact O-CB 3.31Å; H440-Q443 WeakPolarHBondContact O-CB 3.45Å; H440-Q443 PolarHBondContact O-N 3.42Å; H440-C444 PolarHBondContact O-N 2.89Å
441	K	92.8	Very high	91.9	Very high	60 Å²	60	27.3 Å²	27.3	26%	0.261	14%	0.14	S	C	.	.	H	α-helix	trans	-41.9	-50.4	177.4	-179.8	-175.8	-176	179	0	113.3	G429 L431 Q443 C444 V445 I452 D453 L456	G429-K441 PolarHBondContact O-N 2.87Å; L431-K441 HydrophobicContact CD1-CB 4.4Å; K441-Q443 PolarHBondContact O-N 3.37Å; K441-Q443 VanDerWaalsContact O-N 3.16Å; K441-C444 WeakPolarHBondContact O-CB 3.31Å; K441-C444 PolarHBondContact O-N 3.32Å; K441-V445 PolarHBondContact O-N 3.43Å; K441-V445 VanDerWaalsContact O-N 3.11Å; K441-I452 HydrophobicContact CG-CG2 4.36Å; K441-D453 WeakPolarHBondContact CE-OD1 3.47Å; K441-D453 WeakPolarHBondContact CE-OD2 3.48Å; K441-D453 VanDerWaalsContact NZ-CG 3.34Å; K441-D453 IonicContact NZ-OD1 3.22Å; K441-D453 PolarHBondContact NZ-OD1 2.92Å; K441-D453 IonicContact NZ-OD2 3.95Å; K441-L456 HydrophobicContact CB-CD1 3.89Å; K441-L456 HydrophobicContact CD-CD1 3.52Å; K441-L456 HydrophobicContact CG-CD1 3.55Å
442	T	90.1	Very high	91.9	Very high	32 Å²	32	27.3 Å²	27.3	20%	0.196	14%	0.14	C	C	.	.	H	α-helix	trans	-65.5	-18.9	-175.6	57.2	0	0	0	0	113.9	Q359 H440	Q359-T442 PolarHBondContact O-OG1 2.93Å; Q359-T442 VanDerWaalsContact O-OG1 3.11Å; H440-T442 VanDerWaalsContact C-N 3.28Å; H440-T442 PolarHBondContact CE1-OG1 3.43Å; H440-T442 PolarHBondContact ND1-N 3.05Å; H440-T442 PolarHBondContact ND1-OG1 3Å; H440-T442 PolarHBondContact O-N 3.39Å; H440-T442 VanDerWaalsContact O-N 3.15Å
443	Q	90.2	Very high	91.9	Very high	34 Å²	34	29 Å²	29	16%	0.159	15%	0.15	C	C	.	.	H	α-helix	trans	-77.2	-42.3	171.2	-51.6	-179.9	-97.6	0	0	110.5	K355 V357 H440 K441 V445	K355-Q443 PolarHBondContact O-NE2 3.22Å; K355-Q443 PolarHBondContact O-OE1 2.77Å; V357-Q443 HydrophobicContact CB-CG 4.49Å; V357-Q443 WeakPolarHBondContact O-CG 3.41Å; V357-Q443 PolarHBondContact O-OE1 3.39Å; H440-Q443 HydrophobicContact CB-CG 4.38Å; H440-Q443 VanDerWaalsContact O-CB 3.31Å; H440-Q443 WeakPolarHBondContact O-CB 3.45Å; H440-Q443 PolarHBondContact O-N 3.42Å; K441-Q443 PolarHBondContact O-N 3.37Å; K441-Q443 VanDerWaalsContact O-N 3.16Å; Q443-V445 PolarHBondContact O-N 3.04Å
444	C	91.7	Very high	92	Very high	0 Å²	0	30.4 Å²	30.4	0%	0	16%	0.159	C	C	.	.	H	α-helix	trans	-68.3	-29.1	-179.2	-68.5	0	0	0	0	113.4	L431 H440 K441 R446 S447 F448 I452	L431-C444 HydrophobicContact CD1-CB 4.47Å; H440-C444 PolarHBondContact O-N 2.89Å; K441-C444 WeakPolarHBondContact O-CB 3.31Å; K441-C444 PolarHBondContact O-N 3.32Å; C444-R446 PolarHBondContact O-N 3.05Å; C444-R446 VanDerWaalsContact O-N 3.16Å; C444-S447 PolarHBondContact O-N 3.1Å; C444-S447 PolarHBondContact O-OG 3.34Å; C444-F448 HydrophobicContact CB-CD2 3.82Å; C444-F448 HydrophobicContact CB-CE2 4.23Å; C444-F448 WeakPolarHBondContact O-CD2 3.34Å; C444-F448 PolarHBondContact O-N 3.18Å; C444-I452 HydrophobicContact CB-CD1 3.62Å; C444-I452 HydrophobicContact CB-CG1 3.71Å
445	V	89.7	Confident	92.3	Very high	57 Å²	57	29.4 Å²	29.4	35%	0.345	15%	0.153	S	C	.	.	H	α-helix	trans	-49.9	-41	178.5	172.7	0	0	0	0	112.5	K441 Q443 S447 G449 I452	K441-V445 PolarHBondContact O-N 3.43Å; K441-V445 VanDerWaalsContact O-N 3.11Å; Q443-V445 PolarHBondContact O-N 3.04Å; V445-S447 PolarHBondContact O-N 2.98Å; V445-G449 VanDerWaalsContact O-CA 3.27Å; V445-G449 WeakPolarHBondContact O-CA 3.3Å; V445-G449 PolarHBondContact O-N 2.86Å; V445-I452 HydrophobicContact CG2-CG2 3.8Å
446	R	83.4	Confident	92.7	Very high	52 Å²	52	26.3 Å²	26.3	20%	0.196	14%	0.136	C	C	.	.	H	α-helix	trans	-62.1	-28.8	179.8	-63.5	-171.2	-178.4	96.2	0.7	113.9	N371 C444 R541	N371-R446 HydrophobicContact CB-CB 4.19Å; C444-R446 PolarHBondContact O-N 3.05Å; C444-R446 VanDerWaalsContact O-N 3.16Å; R446-R541 PolarHBondContact O-NH2 2.69Å
447	S	88.6	Confident	93	Very high	6 Å²	6	33.3 Å²	33.3	4%	0.042	17%	0.168	C	C	.	.	H	α-helix	trans	-99.8	-46.1	-176.5	26.2	0	0	0	0	112.7	C444 V445 R541	C444-S447 PolarHBondContact O-N 3.1Å; C444-S447 PolarHBondContact O-OG 3.34Å; V445-S447 PolarHBondContact O-N 2.98Å; S447-R541 VanDerWaalsContact O-CZ 3.29Å; S447-R541 PolarHBondContact O-NE 3.17Å; S447-R541 PolarHBondContact O-NH2 2.62Å
448	F	92.7	Very high	93.3	Very high	1 Å²	1	33.5 Å²	33.5	0%	0.004	17%	0.169	C	C	.	.	H	α-helix	trans	-89.2	-23.7	-174.8	-70.9	-107.7	0	0	0	112.6	F375 F416 F433 C444 W451 I452 I455 R541	F375-F448 HydrophobicContact CD2-CD1 4.37Å; F375-F448 AromaticContact CD2-CD2 3.9Å; F375-F448 HydrophobicContact CD2-CD2 3.9Å; F375-F448 HydrophobicContact CD2-CE1 4.18Å; F375-F448 AromaticContact CD2-CE2 3.7Å; F375-F448 HydrophobicContact CD2-CE2 3.7Å; F375-F448 HydrophobicContact CD2-CG 4.22Å; F375-F448 AromaticContact CD2-CZ 3.84Å; F375-F448 HydrophobicContact CD2-CZ 3.84Å; F375-F448 AromaticContact CE2-CD1 3.83Å; F375-F448 HydrophobicContact CE2-CD1 3.83Å; F375-F448 HydrophobicContact CE2-CD2 4.16Å; F375-F448 AromaticContact CE2-CE1 3.78Å; F375-F448 HydrophobicContact CE2-CE1 3.78Å; F375-F448 HydrophobicContact CE2-CE2 4.12Å; F375-F448 HydrophobicContact CE2-CG 4Å; F375-F448 AromaticContact CE2-CZ 3.92Å; F375-F448 HydrophobicContact CE2-CZ 3.92Å; F416-F448 AromaticContact CE1-CE1 3.99Å; F416-F448 HydrophobicContact CE1-CE1 3.99Å; F416-F448 AromaticContact CZ-CE1 3.85Å; F416-F448 HydrophobicContact CZ-CE1 3.85Å; F416-F448 HydrophobicContact CZ-CZ 4.12Å; F433-F448 AromaticContact CE1-CZ 3.84Å; F433-F448 HydrophobicContact CE1-CZ 3.84Å; F433-F448 HydrophobicContact CZ-CE2 4.22Å; F433-F448 AromaticContact CZ-CZ 3.89Å; F433-F448 HydrophobicContact CZ-CZ 3.89Å; C444-F448 HydrophobicContact CB-CD2 3.82Å; C444-F448 HydrophobicContact CB-CE2 4.23Å; C444-F448 WeakPolarHBondContact O-CD2 3.34Å; C444-F448 PolarHBondContact O-N 3.18Å; F448-W451 HydrophobicContact CB-CE3 4.46Å; F448-W451 HydrophobicContact CD1-CD2 4.45Å; F448-W451 AromaticContact CD1-CE3 3.56Å; F448-W451 HydrophobicContact CD1-CE3 3.56Å; F448-W451 AromaticContact CD1-CZ3 3.72Å; F448-W451 HydrophobicContact CD1-CZ3 3.72Å; F448-W451 HydrophobicContact CE1-CE3 4.29Å; F448-W451 AromaticContact CE1-CZ3 3.98Å; F448-W451 HydrophobicContact CE1-CZ3 3.98Å; F448-W451 HydrophobicContact CG-CE3 4.41Å; F448-W451 WeakPolarHBondContact O-CB 3.41Å; F448-I452 HydrophobicContact CB-CB 3.88Å; F448-I452 HydrophobicContact CB-CD1 4.3Å; F448-I452 HydrophobicContact CD1-CD1 4.05Å; F448-I452 HydrophobicContact CD2-CD1 4.32Å; F448-I452 HydrophobicContact CE1-CD1 4.49Å; F448-I452 HydrophobicContact CG-CB 4.5Å; F448-I452 HydrophobicContact CG-CD1 3.99Å; F448-I455 HydrophobicContact CD1-CD1 4.25Å; F448-R541 VanDerWaalsContact O-CD 3.29Å; F448-R541 WeakPolarHBondContact O-CD 3.06Å; F448-R541 WeakPolarHBondContact O-CG 3.48Å; F448-R541 PolarHBondContact O-NE 3.2Å
449	G	91.7	Very high	93.4	Very high	13 Å²	13	33.5 Å²	33.5	13%	0.134	17%	0.169	C	C	.	.	T	Hydrogen-bonded Turn	trans	59.5	-156.7	-166.6	0	0	0	0	0	111.8	V445 W451 I452	V445-G449 VanDerWaalsContact O-CA 3.27Å; V445-G449 WeakPolarHBondContact O-CA 3.3Å; V445-G449 PolarHBondContact O-N 2.86Å; G449-W451 PolarHBondContact O-N 2.9Å; G449-I452 WeakPolarHBondContact O-CG2 3.48Å; G449-I452 PolarHBondContact O-N 3.03Å
450	E	91.6	Very high	93.6	Very high	148 Å²	148	36.4 Å²	36.4	69%	0.692	18%	0.182	S	C	*	.	T	Hydrogen-bonded Turn	trans	-52.4	-18.1	177.6	-50	-55.2	111.1	0	0	114.7	I452 D453 S454	E450-I452 PolarHBondContact O-N 3.31Å; E450-D453 WeakPolarHBondContact O-CB 3.28Å; E450-D453 PolarHBondContact O-N 2.84Å; E450-S454 PolarHBondContact O-N 2.79Å
451	W	95.9	Very high	93.6	Very high	10 Å²	10	37.5 Å²	37.5	4%	0.038	19%	0.193	C	C	.	.	H	α-helix	trans	-60.3	-28.6	175	-173	42	0	0	0	112.2	F375 I413 F416 I417 F448 G449 D453 S454 I455 L534 Q537 R541	F375-W451 HydrophobicContact CE2-CE3 4.49Å; F375-W451 AromaticContact CE2-CZ3 3.95Å; F375-W451 HydrophobicContact CE2-CZ3 3.95Å; F375-W451 AromaticContact CZ-CZ3 3.98Å; F375-W451 HydrophobicContact CZ-CZ3 3.98Å; I413-W451 HydrophobicContact CG2-CZ2 4.2Å; F416-W451 AromaticContact CD1-CH2 3.91Å; F416-W451 HydrophobicContact CD1-CH2 3.91Å; F416-W451 HydrophobicContact CD1-CZ2 4.42Å; F416-W451 AromaticContact CE1-CH2 3.63Å; F416-W451 HydrophobicContact CE1-CH2 3.63Å; F416-W451 HydrophobicContact CE1-CZ2 4.38Å; F416-W451 HydrophobicContact CE1-CZ3 4.19Å; I417-W451 HydrophobicContact CD1-CZ2 3.95Å; I417-W451 HydrophobicContact CG1-CZ2 3.75Å; F448-W451 HydrophobicContact CB-CE3 4.46Å; F448-W451 HydrophobicContact CD1-CD2 4.45Å; F448-W451 AromaticContact CD1-CE3 3.56Å; F448-W451 HydrophobicContact CD1-CE3 3.56Å; F448-W451 AromaticContact CD1-CZ3 3.72Å; F448-W451 HydrophobicContact CD1-CZ3 3.72Å; F448-W451 HydrophobicContact CE1-CE3 4.29Å; F448-W451 AromaticContact CE1-CZ3 3.98Å; F448-W451 HydrophobicContact CE1-CZ3 3.98Å; F448-W451 HydrophobicContact CG-CE3 4.41Å; F448-W451 WeakPolarHBondContact O-CB 3.41Å; G449-W451 PolarHBondContact O-N 2.9Å; W451-D453 VanDerWaalsContact C-N 3.34Å; W451-D453 PolarHBondContact O-N 3.03Å; W451-S454 PolarHBondContact O-N 3.12Å; W451-I455 HydrophobicContact CD2-CD1 3.82Å; W451-I455 HydrophobicContact CE3-CD1 4.28Å; W451-I455 HydrophobicContact CG-CD1 4.17Å; W451-I455 HydrophobicContact CH2-CD1 4.48Å; W451-I455 HydrophobicContact CZ2-CD1 4.05Å; W451-I455 VanDerWaalsContact O-CG1 3.26Å; W451-I455 WeakPolarHBondContact O-CG1 3.34Å; W451-I455 PolarHBondContact O-N 3.37Å; W451-L534 PolarHBondContact NE1-O 2.85Å; W451-Q537 HydrophobicContact CG-CB 4.46Å; W451-R541 HydrophobicContact CE3-CB 4.36Å; W451-R541 HydrophobicContact CE3-CG 4.36Å
452	I	96.3	Very high	93.7	Very high	0 Å²	0	34.8 Å²	34.8	0%	0	18%	0.181	C	C	.	.	H	α-helix	trans	-66	-37.1	176.5	-159.3	67.7	0	0	0	112.3	L431 K441 C444 V445 F448 G449 E450 I455 L456	L431-I452 HydrophobicContact CD1-CD1 4.02Å; L431-I452 HydrophobicContact CD1-CG1 4.24Å; L431-I452 HydrophobicContact CD2-CD1 3.61Å; L431-I452 HydrophobicContact CD2-CG1 4.47Å; L431-I452 HydrophobicContact CG-CD1 4.48Å; K441-I452 HydrophobicContact CG-CG2 4.36Å; C444-I452 HydrophobicContact CB-CD1 3.62Å; C444-I452 HydrophobicContact CB-CG1 3.71Å; V445-I452 HydrophobicContact CG2-CG2 3.8Å; F448-I452 HydrophobicContact CB-CB 3.88Å; F448-I452 HydrophobicContact CB-CD1 4.3Å; F448-I452 HydrophobicContact CD1-CD1 4.05Å; F448-I452 HydrophobicContact CD2-CD1 4.32Å; F448-I452 HydrophobicContact CE1-CD1 4.49Å; F448-I452 HydrophobicContact CG-CB 4.5Å; F448-I452 HydrophobicContact CG-CD1 3.99Å; G449-I452 WeakPolarHBondContact O-CG2 3.48Å; G449-I452 PolarHBondContact O-N 3.03Å; E450-I452 PolarHBondContact O-N 3.31Å; I452-I455 PolarHBondContact O-N 3.13Å; I452-L456 HydrophobicContact CG1-CD1 4.42Å; I452-L456 WeakPolarHBondContact O-CG 3.44Å; I452-L456 PolarHBondContact O-N 3.32Å
453	D	95.3	Very high	93.8	Very high	61 Å²	61	36.7 Å²	36.7	33%	0.326	19%	0.187	S	C	.	.	H	α-helix	trans	-66.6	-43.4	177.7	-79.1	-108.7	0	0	0	110.5	K441 E450 W451 I455 L456 E457	K441-D453 WeakPolarHBondContact CE-OD1 3.47Å; K441-D453 WeakPolarHBondContact CE-OD2 3.48Å; K441-D453 VanDerWaalsContact NZ-CG 3.34Å; K441-D453 IonicContact NZ-OD1 3.22Å; K441-D453 PolarHBondContact NZ-OD1 2.92Å; K441-D453 IonicContact NZ-OD2 3.95Å; E450-D453 WeakPolarHBondContact O-CB 3.28Å; E450-D453 PolarHBondContact O-N 2.84Å; W451-D453 VanDerWaalsContact C-N 3.34Å; W451-D453 PolarHBondContact O-N 3.03Å; D453-I455 PolarHBondContact O-N 2.81Å; D453-L456 PolarHBondContact O-N 3.28Å; D453-E457 PolarHBondContact O-N 3.44Å
454	S	97.4	Very high	93.9	Very high	30 Å²	30	39.1 Å²	39.1	21%	0.21	21%	0.207	C	C	.	.	H	α-helix	trans	-66	-36.2	175.7	-55.3	0	0	0	0	112.6	E450 W451 F458 L534	E450-S454 PolarHBondContact O-N 2.79Å; W451-S454 PolarHBondContact O-N 3.12Å; S454-F458 WeakPolarHBondContact O-CB 3.5Å; S454-F458 PolarHBondContact O-N 2.92Å; S454-F458 VanDerWaalsContact O-N 3.07Å; S454-L534 VanDerWaalsContact CB-CD2 3.43Å; S454-L534 WeakPolarHBondContact O-CD2 3.33Å
455	I	97.7	Very high	93.9	Very high	0 Å²	0	39.9 Å²	39.9	0%	0	21%	0.211	C	C	.	.	H	α-helix	trans	-64	-41.3	172.7	-70.4	165.6	0	0	0	111.2	I417 L420 F448 W451 I452 D453 F458 S459	I417-I455 HydrophobicContact CG2-CG1 4.3Å; L420-I455 HydrophobicContact CD2-CG2 4.35Å; F448-I455 HydrophobicContact CD1-CD1 4.25Å; W451-I455 HydrophobicContact CD2-CD1 3.82Å; W451-I455 HydrophobicContact CE3-CD1 4.28Å; W451-I455 HydrophobicContact CG-CD1 4.17Å; W451-I455 HydrophobicContact CH2-CD1 4.48Å; W451-I455 HydrophobicContact CZ2-CD1 4.05Å; W451-I455 VanDerWaalsContact O-CG1 3.26Å; W451-I455 WeakPolarHBondContact O-CG1 3.34Å; W451-I455 PolarHBondContact O-N 3.37Å; I452-I455 PolarHBondContact O-N 3.13Å; D453-I455 PolarHBondContact O-N 2.81Å; I455-F458 PolarHBondContact O-N 3.12Å; I455-S459 WeakPolarHBondContact O-CB 3.41Å; I455-S459 PolarHBondContact O-N 3.45Å
456	L	97.1	Very high	93.8	Very high	12 Å²	12	45.9 Å²	45.9	6%	0.063	23%	0.232	C	C	.	.	H	α-helix	trans	-75.2	-34.4	-179.4	-72.1	171.7	0	0	0	112.9	L431 K441 I452 D453 F458 S459 Q460	L431-L456 HydrophobicContact CD1-CD1 4.38Å; L431-L456 HydrophobicContact CD1-CD2 4.49Å; L431-L456 HydrophobicContact CD2-CD2 4.12Å; L431-L456 HydrophobicContact CG-CD2 4.18Å; K441-L456 HydrophobicContact CB-CD1 3.89Å; K441-L456 HydrophobicContact CD-CD1 3.52Å; K441-L456 HydrophobicContact CG-CD1 3.55Å; I452-L456 HydrophobicContact CG1-CD1 4.42Å; I452-L456 WeakPolarHBondContact O-CG 3.44Å; I452-L456 PolarHBondContact O-N 3.32Å; D453-L456 PolarHBondContact O-N 3.28Å; L456-F458 VanDerWaalsContact C-N 3.32Å; L456-S459 WeakPolarHBondContact O-CB 3.45Å; L456-S459 PolarHBondContact O-N 2.94Å; L456-Q460 PolarHBondContact O-N 3.42Å
457	E	96.9	Very high	94	Very high	148 Å²	148	44.7 Å²	44.7	69%	0.692	23%	0.229	S	C	*	.	H	α-helix	trans	-61.3	-43.2	169.5	-175.5	178.7	-170	0	0	110.8	D453 Q460 S461	D453-E457 PolarHBondContact O-N 3.44Å; E457-Q460 PolarHBondContact O-N 3.34Å; E457-S461 WeakPolarHBondContact O-CB 3.44Å; E457-S461 PolarHBondContact O-N 3.37Å
458	F	97.8	Very high	94.1	Very high	9 Å²	9	46.3 Å²	46.3	4%	0.039	24%	0.238	C	C	.	.	H	α-helix	trans	-64.4	-40.6	173.4	-179.1	-100.6	0	0	0	112.5	I417 L418 A421 S454 I455 L456 S461 L462 K527 D530 L531 L534	I417-F458 HydrophobicContact CG2-CD1 4.26Å; L418-F458 HydrophobicContact CD1-CE1 4.11Å; L418-F458 HydrophobicContact CD1-CZ 4.3Å; A421-F458 HydrophobicContact CB-CD1 3.74Å; A421-F458 HydrophobicContact CB-CE1 4.16Å; S454-F458 WeakPolarHBondContact O-CB 3.5Å; S454-F458 PolarHBondContact O-N 2.92Å; S454-F458 VanDerWaalsContact O-N 3.07Å; I455-F458 PolarHBondContact O-N 3.12Å; L456-F458 VanDerWaalsContact C-N 3.32Å; F458-S461 CarbonylContact O-C 3.56Å; F458-S461 WeakPolarHBondContact O-CB 3.48Å; F458-S461 PolarHBondContact O-N 2.92Å; F458-L462 WeakPolarHBondContact O-CB 3.21Å; F458-L462 PolarHBondContact O-N 3.01Å; F458-K527 HydrophobicContact CE2-CB 4.12Å; F458-K527 HydrophobicContact CE2-CD 4.15Å; F458-K527 HydrophobicContact CE2-CG 4.49Å; F458-K527 HydrophobicContact CZ-CB 4.38Å; F458-D530 HydrophobicContact CD2-CB 3.84Å; F458-D530 HydrophobicContact CE2-CB 3.77Å; F458-L531 HydrophobicContact CE1-CD1 4.02Å; F458-L531 HydrophobicContact CZ-CB 4.39Å; F458-L531 HydrophobicContact CZ-CD1 4.03Å; F458-L534 HydrophobicContact CB-CD1 3.49Å; F458-L534 VanDerWaalsContact CB-CD1 3.49Å; F458-L534 HydrophobicContact CD1-CD1 3.97Å; F458-L534 HydrophobicContact CD2-CD1 3.6Å; F458-L534 HydrophobicContact CE2-CD1 4.3Å; F458-L534 HydrophobicContact CG-CD1 3.4Å; F458-L534 VanDerWaalsContact CG-CD1 3.4Å
459	S	97.6	Very high	94.1	Very high	0 Å²	0	50 Å²	50	0%	0	26%	0.255	C	S	.	.	H	α-helix	trans	-57.9	-48.6	172.8	178.9	0	0	0	0	111.7	A421 I455 L456 S461 L462 H463	A421-S459 WeakPolarHBondContact O-CB 3.38Å; A421-S459 PolarHBondContact O-OG 3.24Å; I455-S459 WeakPolarHBondContact O-CB 3.41Å; I455-S459 PolarHBondContact O-N 3.45Å; L456-S459 WeakPolarHBondContact O-CB 3.45Å; L456-S459 PolarHBondContact O-N 2.94Å; S459-S461 VanDerWaalsContact C-N 3.31Å; S459-S461 PolarHBondContact O-N 3.12Å; S459-L462 WeakPolarHBondContact O-CB 3.43Å; S459-L462 PolarHBondContact O-N 3.45Å; S459-L462 VanDerWaalsContact O-N 3.14Å; S459-H463 PolarHBondContact O-CD2 3.04Å; S459-H463 PolarHBondContact O-N 3.12Å; S459-H463 PolarHBondContact OG-CD2 2.9Å
460	Q	96.7	Very high	94.1	Very high	68 Å²	68	53 Å²	53	32%	0.318	27%	0.265	S	S	.	.	H	α-helix	trans	-58.2	-44.8	174.1	-172.2	66.3	63.6	0	0	111.3	P426 L456 E457 L462 H463 C464	P426-Q460 HydrophobicContact CB-CB 4.04Å; P426-Q460 HydrophobicContact CG-CB 4.09Å; L456-Q460 PolarHBondContact O-N 3.42Å; E457-Q460 PolarHBondContact O-N 3.34Å; Q460-L462 VanDerWaalsContact C-N 3.28Å; Q460-L462 PolarHBondContact O-N 3.11Å; Q460-H463 PolarHBondContact O-N 2.96Å; Q460-C464 PolarHBondContact NE2-SG 3.28Å; Q460-C464 VanDerWaalsContact O-CB 3.31Å; Q460-C464 WeakPolarHBondContact O-CB 3.45Å; Q460-C464 PolarHBondContact O-N 3.5Å; Q460-C464 PolarHBondContact O-SG 2.89Å
461	S	95.2	Very high	94.2	Very high	47 Å²	47	45.9 Å²	45.9	33%	0.329	23%	0.232	S	C	.	.	H	α-helix	trans	-63.7	-32.3	178	-146.5	0	0	0	0	113.1	E457 F458 S459 K527	E457-S461 WeakPolarHBondContact O-CB 3.44Å; E457-S461 PolarHBondContact O-N 3.37Å; F458-S461 CarbonylContact O-C 3.56Å; F458-S461 WeakPolarHBondContact O-CB 3.48Å; F458-S461 PolarHBondContact O-N 2.92Å; S459-S461 VanDerWaalsContact C-N 3.31Å; S459-S461 PolarHBondContact O-N 3.12Å; S461-K527 WeakPolarHBondContact OG-CE 3.24Å; S461-K527 PolarHBondContact OG-NZ 3.5Å
462	L	94.3	Very high	94.2	Very high	2 Å²	2	45.5 Å²	45.5	1%	0.01	23%	0.231	C	C	.	.	H	α-helix	trans	-75	-47.5	177	-164.5	72.4	0	0	0	111.3	L418 A421 H422 F458 S459 Q460 C464 M465 L467 F472	L418-L462 HydrophobicContact CD1-CD1 4.44Å; L418-L462 HydrophobicContact CD1-CD2 4.15Å; A421-L462 HydrophobicContact CB-CD2 4.48Å; H422-L462 HydrophobicContact CB-CD2 4.16Å; F458-L462 WeakPolarHBondContact O-CB 3.21Å; F458-L462 PolarHBondContact O-N 3.01Å; S459-L462 WeakPolarHBondContact O-CB 3.43Å; S459-L462 PolarHBondContact O-N 3.45Å; S459-L462 VanDerWaalsContact O-N 3.14Å; Q460-L462 VanDerWaalsContact C-N 3.28Å; Q460-L462 PolarHBondContact O-N 3.11Å; L462-C464 VanDerWaalsContact C-N 3.34Å; L462-C464 PolarHBondContact O-N 2.88Å; L462-M465 WeakPolarHBondContact O-CB 3.43Å; L462-M465 PolarHBondContact O-N 3.41Å; L462-L467 HydrophobicContact CD1-CD1 3.43Å; L462-L467 VanDerWaalsContact CD1-CD1 3.43Å; L462-L467 HydrophobicContact CG-CD1 3.9Å; L462-F472 HydrophobicContact CD2-CE2 4.49Å
463	H	92.8	Very high	94.2	Very high	73 Å²	73	45.5 Å²	45.5	34%	0.338	23%	0.231	S	C	.	.	H	α-helix	trans	-63.2	-37.5	175.6	-75.9	-59.2	0	0	0	112.4	H422 S424 S459 Q460 M465 K466	H422-H463 PolarHBondContact O-CE1 3.21Å; S424-H463 PolarHBondContact O-NE2 3.39Å; S459-H463 PolarHBondContact O-CD2 3.04Å; S459-H463 PolarHBondContact O-N 3.12Å; S459-H463 PolarHBondContact OG-CD2 2.9Å; Q460-H463 PolarHBondContact O-N 2.96Å; H463-M465 PolarHBondContact O-N 3.05Å; H463-M465 VanDerWaalsContact O-N 3.12Å; H463-K466 PolarHBondContact O-N 3.19Å
464	C	92.6	Very high	94.2	Very high	84 Å²	84	42.6 Å²	42.6	57%	0.568	22%	0.216	S	C	*	.	T	Hydrogen-bonded Turn	trans	-63.4	-13.3	172.2	-73.6	0	0	0	0	114.1	Q460 L462	Q460-C464 PolarHBondContact NE2-SG 3.28Å; Q460-C464 VanDerWaalsContact O-CB 3.31Å; Q460-C464 WeakPolarHBondContact O-CB 3.45Å; Q460-C464 PolarHBondContact O-N 3.5Å; Q460-C464 PolarHBondContact O-SG 2.89Å; L462-C464 VanDerWaalsContact C-N 3.34Å; L462-C464 PolarHBondContact O-N 2.88Å
465	M	89.9	Confident	94.1	Very high	17 Å²	17	41.3 Å²	41.3	8%	0.084	21%	0.206	C	C	.	.	T	Hydrogen-bonded Turn	trans	-85.4	-15.3	169.8	-68.8	-170.8	52.3	0	0	113.9	L462 H463 L467 Y520 R523 L524 K527	L462-M465 WeakPolarHBondContact O-CB 3.43Å; L462-M465 PolarHBondContact O-N 3.41Å; H463-M465 PolarHBondContact O-N 3.05Å; H463-M465 VanDerWaalsContact O-N 3.12Å; M465-L467 HydrophobicContact CB-CG 4.46Å; M465-Y520 HydrophobicContact CE-CD2 4.39Å; M465-Y520 HydrophobicContact CE-CE2 4.21Å; M465-R523 HydrophobicContact CE-CB 3.88Å; M465-L524 HydrophobicContact CE-CB 4.09Å; M465-L524 HydrophobicContact CE-CD1 4.3Å; M465-K527 HydrophobicContact SD-CG 4.01Å
466	K	87.4	Confident	94.1	Very high	182 Å²	182	41.3 Å²	41.3	79%	0.791	21%	0.206	S	C	*	.	T	Hydrogen-bonded Turn	trans	52.8	56.1	-176.3	-59.3	-173.3	177.8	-173.7	0	112.7	H463	H463-K466 PolarHBondContact O-N 3.19Å
467	L	89.6	Confident	94.1	Very high	27 Å²	27	40.7 Å²	40.7	14%	0.141	20%	0.203	C	C	.	.			trans	-65.3	134	178.5	-82.3	159.3	0	0	0	112.1	L462 M465 Y520 L524	L462-L467 HydrophobicContact CD1-CD1 3.43Å; L462-L467 VanDerWaalsContact CD1-CD1 3.43Å; L462-L467 HydrophobicContact CG-CD1 3.9Å; M465-L467 HydrophobicContact CB-CG 4.46Å; L467-Y520 WeakPolarHBondContact CD2-OH 3.42Å; L467-L524 HydrophobicContact CD1-CD1 3.79Å; L467-L524 HydrophobicContact CD2-CD1 3.56Å; L467-L524 HydrophobicContact CD2-CD2 3.88Å; L467-L524 HydrophobicContact CD2-CG 4.33Å; L467-L524 HydrophobicContact CG-CD1 4.25Å
468	D	90.6	Very high	94.1	Very high	40 Å²	40	34 Å²	34	21%	0.214	17%	0.172	C	C	.	.			trans	-78.6	146.9	166.4	51.4	-59.2	0	0	0	110.9	E470 S471 F472 H507 Y520	D468-E470 PolarHBondContact O-N 3.23Å; D468-S471 PolarHBondContact O-N 2.98Å; D468-S471 WeakPolarHBondContact OD1-CB 3.3Å; D468-S471 PolarHBondContact OD1-OG 3.47Å; D468-S471 WeakPolarHBondContact OD2-CB 3.4Å; D468-S471 PolarHBondContact OD2-N 3.07Å; D468-S471 PolarHBondContact OD2-OG 3.13Å; D468-F472 PolarHBondContact O-N 3.48Å; D468-H507 IonicContact OD2-CD2 3Å; D468-H507 PolarHBondContact OD2-CD2 3.43Å; D468-H507 IonicContact OD2-CE1 2.68Å; D468-H507 IonicContact OD2-NE2 3.5Å; D468-H507 PolarHBondContact OD2-NE2 3.4Å; D468-Y520 PolarHBondContact OD1-OH 3.11Å; D468-Y520 VanDerWaalsContact OD1-OH 3.09Å
469	E	91.6	Very high	94.1	Very high	80 Å²	80	33.8 Å²	33.8	37%	0.374	17%	0.172	S	C	.	.	H	α-helix	trans	-56.8	-36.3	-177.8	-73.4	-71.5	161.3	0	0	111.9	V338 H422 F472 A473	V338-E469 HydrophobicContact CG1-CB 4.31Å; H422-E469 IonicContact CE1-OE1 3.27Å; E469-F472 PolarHBondContact O-N 2.8Å; E469-A473 WeakPolarHBondContact O-CB 3.37Å; E469-A473 PolarHBondContact O-N 2.76Å
470	E	92.7	Very high	94.1	Very high	74 Å²	74	33.8 Å²	33.8	35%	0.346	17%	0.172	S	C	.	.	H	α-helix	trans	-59.1	-50.7	173.4	-70.8	82	176.8	0	0	112.4	I334 V338 D468 C474 H507	I334-E470 HydrophobicContact CG2-CB 3.61Å; I334-E470 HydrophobicContact CG2-CG 3.49Å; I334-E470 VanDerWaalsContact CG2-CG 3.49Å; V338-E470 HydrophobicContact CG2-CB 4.37Å; V338-E470 HydrophobicContact CG2-CG 4.02Å; D468-E470 PolarHBondContact O-N 3.23Å; E470-C474 WeakPolarHBondContact O-CB 3.31Å; E470-C474 PolarHBondContact O-N 2.91Å; E470-C474 PolarHBondContact O-SG 2.98Å; E470-H507 VanDerWaalsContact CB-NE2 3.31Å; E470-H507 WeakPolarHBondContact CB-NE2 3.2Å
471	S	93.2	Very high	94.1	Very high	0 Å²	0	30.6 Å²	30.6	0%	0	16%	0.156	C	C	.	.	H	α-helix	trans	-67.1	-37	177	-66.6	0	0	0	0	112.3	D468 L475	D468-S471 PolarHBondContact O-N 2.98Å; D468-S471 WeakPolarHBondContact OD1-CB 3.3Å; D468-S471 PolarHBondContact OD1-OG 3.47Å; D468-S471 WeakPolarHBondContact OD2-CB 3.4Å; D468-S471 PolarHBondContact OD2-N 3.07Å; D468-S471 PolarHBondContact OD2-OG 3.13Å; S471-L475 WeakPolarHBondContact O-CB 3.38Å; S471-L475 PolarHBondContact O-N 3Å
472	F	95.4	Very high	93.9	Very high	1 Å²	1	29.4 Å²	29.4	0%	0.004	15%	0.147	C	C	.	.	H	α-helix	trans	-68.9	-43.5	177.4	-180	-105.3	0	0	0	112.8	Q341 L418 R419 H422 L462 D468 E469 C474 L475 T476	Q341-F472 HydrophobicContact CG-CD1 4.13Å; Q341-F472 HydrophobicContact CG-CE1 4.12Å; L418-F472 HydrophobicContact CD1-CE2 3.8Å; L418-F472 HydrophobicContact CD2-CE2 4.36Å; L418-F472 HydrophobicContact CG-CE2 3.75Å; L418-F472 HydrophobicContact CG-CZ 4.2Å; R419-F472 HydrophobicContact CG-CZ 4.39Å; H422-F472 HydrophobicContact CB-CD2 4.25Å; H422-F472 HydrophobicContact CB-CE1 4.03Å; H422-F472 HydrophobicContact CB-CE2 3.53Å; H422-F472 HydrophobicContact CB-CZ 3.41Å; H422-F472 VanDerWaalsContact CB-CZ 3.41Å; H422-F472 AromaticContact CD2-CD1 3.81Å; H422-F472 AromaticContact CD2-CD2 3.24Å; H422-F472 WeakPolarHBondContact CD2-CD2 3.39Å; H422-F472 AromaticContact CD2-CE2 3.48Å; H422-F472 VanDerWaalsContact CD2-CE2 3.48Å; H422-F472 WeakPolarHBondContact CD2-CE2 3.35Å; H422-F472 AromaticContact CD2-CG 3.43Å; H422-F472 VanDerWaalsContact CD2-CG 3.43Å; H422-F472 WeakPolarHBondContact CD2-CG 3.47Å; H422-F472 AromaticContact CD2-CZ 3.88Å; H422-F472 AromaticContact CE1-CD1 3.77Å; H422-F472 AromaticContact CE1-CG 3.98Å; H422-F472 AromaticContact CG-CD1 3.92Å; H422-F472 AromaticContact CG-CD2 3.82Å; H422-F472 AromaticContact CG-CE1 3.7Å; H422-F472 AromaticContact CG-CE2 3.58Å; H422-F472 AromaticContact CG-CG 3.98Å; H422-F472 AromaticContact CG-CZ 3.54Å; H422-F472 AromaticContact ND1-CD1 3.9Å; H422-F472 AromaticContact ND1-CE1 3.81Å; H422-F472 AromaticContact NE2-CD1 3.71Å; H422-F472 AromaticContact NE2-CD2 3.76Å; H422-F472 AromaticContact NE2-CG 3.43Å; H422-F472 WeakPolarHBondContact NE2-CG 3.07Å; L462-F472 HydrophobicContact CD2-CE2 4.49Å; D468-F472 PolarHBondContact O-N 3.48Å; E469-F472 PolarHBondContact O-N 2.8Å; F472-C474 VanDerWaalsContact C-N 3.33Å; F472-C474 PolarHBondContact O-N 2.91Å; F472-L475 PolarHBondContact O-N 2.84Å; F472-T476 WeakPolarHBondContact CZ-OG1 3.49Å; F472-T476 WeakPolarHBondContact O-CB 3.45Å; F472-T476 PolarHBondContact O-N 3.14Å; F472-T476 PolarHBondContact O-OG1 3.45Å
473	A	96.3	Very high	93.7	Very high	1 Å²	1	33.1 Å²	33.1	1%	0.008	17%	0.167	C	C	.	.	H	α-helix	trans	-64.5	-38.2	175.2	0	0	0	0	0	111.4	L337 V338 Q341 E469 A477	L337-A473 HydrophobicContact CB-CB 3.99Å; V338-A473 HydrophobicContact CG2-CB 3.98Å; Q341-A473 HydrophobicContact CB-CB 4.05Å; Q341-A473 HydrophobicContact CG-CB 4.35Å; E469-A473 WeakPolarHBondContact O-CB 3.37Å; E469-A473 PolarHBondContact O-N 2.76Å; A473-A477 WeakPolarHBondContact O-CB 3.39Å; A473-A477 PolarHBondContact O-N 2.74Å
474	C	95.4	Very high	93.6	Very high	0 Å²	0	30.8 Å²	30.8	0%	0	16%	0.155	C	C	.	.	H	α-helix	trans	-63.7	-45.7	171.5	-70.6	0	0	0	0	112.5	E470 F472 A477 L478 L504	E470-C474 WeakPolarHBondContact O-CB 3.31Å; E470-C474 PolarHBondContact O-N 2.91Å; E470-C474 PolarHBondContact O-SG 2.98Å; F472-C474 VanDerWaalsContact C-N 3.33Å; F472-C474 PolarHBondContact O-N 2.91Å; C474-A477 PolarHBondContact O-N 3.27Å; C474-L478 VanDerWaalsContact O-CG 3.28Å; C474-L478 WeakPolarHBondContact O-CG 3.5Å; C474-L478 PolarHBondContact O-N 2.87Å; C474-L504 HydrophobicContact CB-CB 4.17Å; C474-L504 HydrophobicContact CB-CD1 3.81Å; C474-L504 HydrophobicContact CB-CD2 4.25Å; C474-L504 HydrophobicContact CB-CG 4.3Å
475	L	95.9	Very high	93.5	Very high	2 Å²	2	37.4 Å²	37.4	1%	0.01	17%	0.17	C	C	.	.	H	α-helix	trans	-60	-46.9	177	179.5	70.6	0	0	0	111	L418 S471 F472 A477 L478 V479 L524 L528	L418-L475 HydrophobicContact CD1-CD2 3.87Å; L418-L475 HydrophobicContact CD2-CD2 3.94Å; L418-L475 HydrophobicContact CD2-CG 4.02Å; S471-L475 WeakPolarHBondContact O-CB 3.38Å; S471-L475 PolarHBondContact O-N 3Å; F472-L475 PolarHBondContact O-N 2.84Å; L475-A477 VanDerWaalsContact C-N 3.32Å; L475-A477 PolarHBondContact O-N 3.38Å; L475-L478 WeakPolarHBondContact O-CB 3.49Å; L475-L478 PolarHBondContact O-N 3.02Å; L475-V479 WeakPolarHBondContact O-CG2 3.42Å; L475-V479 PolarHBondContact O-N 3.23Å; L475-L524 HydrophobicContact CD1-CD1 4.36Å; L475-L524 HydrophobicContact CD1-CG 4.36Å; L475-L524 HydrophobicContact CD2-CD1 3.85Å; L475-L528 HydrophobicContact CD1-CD2 3.9Å; L475-L528 HydrophobicContact CD1-CG 4.37Å
476	T	97.4	Very high	93.6	Very high	0 Å²	0	38.4 Å²	38.4	0%	0	19%	0.185	C	C	.	.	H	α-helix	trans	-63.8	-39.2	-179	-50.9	0	0	0	0	110.8	W389 L415 L418 R419 F472 V479	W389-T476 HydrophobicContact CH2-CG2 3.61Å; W389-T476 WeakPolarHBondContact CH2-O 3.49Å; W389-T476 HydrophobicContact CZ2-CG2 3.64Å; W389-T476 HydrophobicContact CZ3-CG2 4.38Å; L415-T476 HydrophobicContact CD2-CG2 3.73Å; L415-T476 WeakPolarHBondContact CD2-O 3.18Å; L418-T476 HydrophobicContact CD2-CG2 4.49Å; R419-T476 HydrophobicContact CG-CG2 3.94Å; F472-T476 WeakPolarHBondContact CZ-OG1 3.49Å; F472-T476 WeakPolarHBondContact O-CB 3.45Å; F472-T476 PolarHBondContact O-N 3.14Å; F472-T476 PolarHBondContact O-OG1 3.45Å; T476-V479 PolarHBondContact O-N 2.96Å
477	A	97.8	Very high	93.9	Very high	0 Å²	0	30.7 Å²	30.7	0%	0	15%	0.152	C	C	.	.	H	α-helix	trans	-63.1	-38.3	170.6	0	0	0	0	0	113	L337 A473 C474 L475 V479 I480 I481 L500	L337-A477 HydrophobicContact CD1-CB 4.22Å; L337-A477 HydrophobicContact CD2-CB 3.97Å; A473-A477 WeakPolarHBondContact O-CB 3.39Å; A473-A477 PolarHBondContact O-N 2.74Å; C474-A477 PolarHBondContact O-N 3.27Å; L475-A477 VanDerWaalsContact C-N 3.32Å; L475-A477 PolarHBondContact O-N 3.38Å; A477-V479 VanDerWaalsContact C-N 3.32Å; A477-V479 PolarHBondContact O-N 3.34Å; A477-I480 VanDerWaalsContact O-CG2 3.31Å; A477-I480 WeakPolarHBondContact O-CG2 3.41Å; A477-I480 PolarHBondContact O-N 3.18Å; A477-I481 WeakPolarHBondContact O-CB 2.94Å; A477-I481 WeakPolarHBondContact O-CG1 3.38Å; A477-I481 PolarHBondContact O-N 3.34Å; A477-L500 HydrophobicContact CB-CD1 4.07Å; A477-L500 HydrophobicContact CB-CD2 4.21Å
478	L	96.8	Very high	94.2	Very high	8 Å²	8	35.6 Å²	35.6	4%	0.042	17%	0.172	C	C	.	.	H	α-helix	trans	-69.8	-23.4	177.5	-72.6	168.7	0	0	0	114.1	C474 L475 Q497 L500 I501 L504	C474-L478 VanDerWaalsContact O-CG 3.28Å; C474-L478 WeakPolarHBondContact O-CG 3.5Å; C474-L478 PolarHBondContact O-N 2.87Å; L475-L478 WeakPolarHBondContact O-CB 3.49Å; L475-L478 PolarHBondContact O-N 3.02Å; L478-Q497 HydrophobicContact CD2-CG 3.91Å; L478-L500 HydrophobicContact CD2-CB 3.57Å; L478-L500 HydrophobicContact CD2-CD1 4.26Å; L478-L500 HydrophobicContact CG-CB 4.16Å; L478-I501 HydrophobicContact CD1-CG1 4.26Å; L478-I501 HydrophobicContact CD2-CD1 4.47Å; L478-I501 HydrophobicContact CD2-CG1 3.7Å; L478-L504 HydrophobicContact CD1-CD2 3.99Å
479	V	97.3	Very high	94.4	Very high	4 Å²	4	36.6 Å²	36.6	2%	0.024	18%	0.175	C	C	.	.	H	α-helix	trans	-72.4	-36.8	175	171.6	0	0	0	0	111.7	A411 E414 L415 L418 L475 T476 A477 R484 L528 L531	A411-V479 HydrophobicContact CB-CG1 4.39Å; A411-V479 WeakPolarHBondContact CB-O 3.41Å; E414-V479 HydrophobicContact CB-CG1 3.5Å; L415-V479 HydrophobicContact CD2-CB 3.86Å; L415-V479 HydrophobicContact CD2-CG1 3.7Å; L415-V479 HydrophobicContact CG-CG1 3.87Å; L418-V479 HydrophobicContact CD2-CG2 3.99Å; L475-V479 WeakPolarHBondContact O-CG2 3.42Å; L475-V479 PolarHBondContact O-N 3.23Å; T476-V479 PolarHBondContact O-N 2.96Å; A477-V479 VanDerWaalsContact C-N 3.32Å; A477-V479 PolarHBondContact O-N 3.34Å; V479-R484 PolarHBondContact O-NH2 2.81Å; V479-L528 HydrophobicContact CG2-CD2 3.67Å; V479-L531 HydrophobicContact CG1-CD2 4.39Å; V479-L531 HydrophobicContact CG2-CD2 3.88Å
480	I	97.1	Very high	94.6	Very high	0 Å²	0	35.4 Å²	35.4	0%	0	18%	0.175	C	C	.	.	H	α-helix	trans	-84	-40.9	174.8	-166.8	168.9	0	0	0	112.6	W389 A390 I393 F396 L407 L408 A411 L415 A477 T482	W389-I480 HydrophobicContact CH2-CG2 3.85Å; W389-I480 HydrophobicContact CZ3-CB 4.47Å; W389-I480 HydrophobicContact CZ3-CD1 4.32Å; W389-I480 HydrophobicContact CZ3-CG2 3.96Å; A390-I480 HydrophobicContact CB-CD1 3.74Å; I393-I480 HydrophobicContact CD1-CG2 3.74Å; F396-I480 HydrophobicContact CE2-CD1 4Å; F396-I480 HydrophobicContact CE2-CG1 4.24Å; F396-I480 HydrophobicContact CZ-CD1 4.09Å; L407-I480 HydrophobicContact CB-CG1 4.27Å; L408-I480 HydrophobicContact CB-CD1 4.49Å; L408-I480 HydrophobicContact CD1-CD1 4.17Å; A411-I480 HydrophobicContact CB-CB 4.32Å; A411-I480 HydrophobicContact CB-CG1 4.36Å; L415-I480 HydrophobicContact CD1-CB 4.03Å; L415-I480 HydrophobicContact CD1-CD1 4.23Å; L415-I480 HydrophobicContact CD1-CG1 4.36Å; L415-I480 HydrophobicContact CD2-CB 4.46Å; A477-I480 VanDerWaalsContact O-CG2 3.31Å; A477-I480 WeakPolarHBondContact O-CG2 3.41Å; A477-I480 PolarHBondContact O-N 3.18Å; I480-T482 PolarHBondContact O-N 2.98Å; I480-T482 VanDerWaalsContact O-N 3.14Å
481	I	96.8	Very high	94.7	Very high	0 Å²	0	37.9 Å²	37.9	0%	0	19%	0.185	C	C	.	.	S	Bend	trans	-87	82.2	176.7	-48.8	-52.4	0	0	0	109.5	F396 F399 A477 V493 F496 Q497 L500	F396-I481 HydrophobicContact CD2-CD1 3.64Å; F396-I481 HydrophobicContact CE2-CD1 4.26Å; F399-I481 HydrophobicContact CE2-CD1 4.3Å; A477-I481 WeakPolarHBondContact O-CB 2.94Å; A477-I481 WeakPolarHBondContact O-CG1 3.38Å; A477-I481 PolarHBondContact O-N 3.34Å; I481-V493 HydrophobicContact CG2-CG1 4.08Å; I481-F496 HydrophobicContact CB-CD1 4.36Å; I481-F496 HydrophobicContact CD1-CD1 3.92Å; I481-F496 HydrophobicContact CD1-CE1 3.69Å; I481-F496 HydrophobicContact CG1-CD1 3.87Å; I481-F496 HydrophobicContact CG1-CE1 3.67Å; I481-F496 HydrophobicContact CG2-CB 4.14Å; I481-F496 HydrophobicContact CG2-CD1 3.53Å; I481-F496 HydrophobicContact CG2-CE1 4.22Å; I481-F496 HydrophobicContact CG2-CG 4.02Å; I481-Q497 HydrophobicContact CG2-CB 4.14Å; I481-Q497 WeakPolarHBondContact O-CG 3.18Å; I481-Q497 PolarHBondContact O-NE2 3.41Å; I481-L500 HydrophobicContact CB-CD1 3.74Å; I481-L500 HydrophobicContact CG1-CD1 3.71Å; I481-L500 HydrophobicContact CG2-CD1 4.09Å
482	T	91.6	Very high	94.8	Very high	23 Å²	23	42.1 Å²	42.1	14%	0.141	20%	0.201	C	C	.	.	S	Bend	trans	-148.3	157.1	176.4	-165.2	0	0	0	0	111.7	L407 I480 Q497	L407-T482 WeakPolarHBondContact CD2-O 3.32Å; I480-T482 PolarHBondContact O-N 2.98Å; I480-T482 VanDerWaalsContact O-N 3.14Å; T482-Q497 VanDerWaalsContact CA-NE2 3.28Å; T482-Q497 PolarHBondContact OG1-NE2 3.02Å
483	D	89.3	Confident	94.8	Very high	80 Å²	80	42.1 Å²	42.1	43%	0.428	20%	0.2	S	C	.	.			trans	-66.5	133.9	-179.3	-169.9	28.8	0	0	0	111.6	Y92	Y92-D483 PolarHBondContact OH-O 3.24Å
484	R	90.6	Very high	94.8	Very high	23 Å²	23	46 Å²	46	9%	0.087	22%	0.218	C	C	.	.			trans	-140.6	143.7	-177	-57.5	-64.9	-177.3	169.1	1.1	108.9	Y92 L407 C410 E414 V479 G486 L487	Y92-R484 WeakPolarHBondContact OH-CD 3.24Å; Y92-R484 PolarHBondContact OH-NH1 3.41Å; L407-R484 HydrophobicContact CD2-CG 3.94Å; C410-R484 HydrophobicContact CB-CG 3.94Å; E414-R484 IonicContact OE1-CZ 3.75Å; E414-R484 IonicContact OE1-NH1 3.47Å; E414-R484 PolarHBondContact OE1-NH1 3.21Å; E414-R484 IonicContact OE1-NH2 2.65Å; E414-R484 PolarHBondContact OE1-NH2 3.34Å; V479-R484 PolarHBondContact O-NH2 2.81Å; R484-G486 PolarHBondContact O-N 2.96Å; R484-L487 HydrophobicContact CB-CD1 4.3Å; R484-L487 HydrophobicContact CB-CG 4.42Å; R484-L487 WeakPolarHBondContact O-CD1 3.48Å; R484-L487 VanDerWaalsContact O-CG 3.32Å; R484-L487 WeakPolarHBondContact O-CG 3.38Å
485	Y	90.6	Very high	94.8	Very high	224 Å²	224	49.8 Å²	49.8	88%	0.878	24%	0.239	S	C	*	.	T	Hydrogen-bonded Turn	trans	-63.6	135.5	175.8	-178	-91.3	0	0	0	111.1
486	G	91.6	Very high	94.7	Very high	38 Å²	38	50.6 Å²	50.6	39%	0.392	24%	0.242	S	C	.	.	T	Hydrogen-bonded Turn	trans	102.4	-10.5	177.3	0	0	0	0	0	115.7	R484 K488	R484-G486 PolarHBondContact O-N 2.96Å; G486-K488 PolarHBondContact O-NZ 2.88Å
487	L	94.3	Very high	94.6	Very high	20 Å²	20	51.7 Å²	51.7	11%	0.105	25%	0.247	C	C	.	.			trans	-55.2	140	177.7	-72.6	169.3	0	0	0	112.5	D403 L406 L407 R484 P490 V493	D403-L487 HydrophobicContact CB-CD2 3.73Å; D403-L487 VanDerWaalsContact CG-CD2 3.46Å; D403-L487 VanDerWaalsContact OD1-CA 3.3Å; D403-L487 WeakPolarHBondContact OD1-CA 3.28Å; L406-L487 HydrophobicContact CD2-CD2 4.01Å; L406-L487 HydrophobicContact CD2-CG 4.06Å; L407-L487 HydrophobicContact CD2-CD1 4.32Å; L407-L487 HydrophobicContact CD2-CD2 3.96Å; L407-L487 HydrophobicContact CG-CD2 4Å; R484-L487 HydrophobicContact CB-CD1 4.3Å; R484-L487 HydrophobicContact CB-CG 4.42Å; R484-L487 WeakPolarHBondContact O-CD1 3.48Å; R484-L487 VanDerWaalsContact O-CG 3.32Å; R484-L487 WeakPolarHBondContact O-CG 3.38Å; L487-P490 HydrophobicContact CB-CB 3.95Å; L487-P490 HydrophobicContact CB-CG 4.42Å; L487-P490 HydrophobicContact CD1-CB 4.17Å; L487-V493 HydrophobicContact CD1-CB 4.33Å; L487-V493 HydrophobicContact CD1-CG1 4.48Å; L487-V493 HydrophobicContact CD1-CG2 4.06Å; L487-V493 HydrophobicContact CD2-CG2 4.25Å
488	K	96	Very high	94.5	Very high	130 Å²	130	54.7 Å²	54.7	57%	0.565	26%	0.263	S	S	*	.	S	Bend	trans	-82.5	-36.6	174.7	-49.3	-58.4	170	-75	0	111	E402 D403 G486 P490	E402-K488 HydrophobicContact CB-CG 4.31Å; D403-K488 VanDerWaalsContact CG-N 3.34Å; D403-K488 WeakPolarHBondContact OD1-CG 3.38Å; D403-K488 PolarHBondContact OD1-N 3.43Å; D403-K488 PolarHBondContact OD2-N 3.05Å; D403-K488 VanDerWaalsContact OD2-N 3.11Å; G486-K488 PolarHBondContact O-NZ 2.88Å; K488-P490 WeakPolarHBondContact O-CD 3.39Å
489	E	94.6	Very high	94.3	Very high	60 Å²	60	58 Å²	58	28%	0.28	28%	0.278	S	S	.	.	S	Bend	trans	-121.3	47.8	-177	-55	-173.5	91.8	0	0	113	C400 D403 K491 R492 V493	C400-E489 PolarHBondContact N-OE2 3.38Å; D403-E489 PolarHBondContact OD2-N 3.26Å; E489-K491 PolarHBondContact O-N 3.05Å; E489-R492 HydrophobicContact CB-CB 4.23Å; E489-R492 HydrophobicContact CB-CG 4.35Å; E489-R492 WeakPolarHBondContact O-CB 3.39Å; E489-R492 PolarHBondContact O-N 3.46Å; E489-R492 WeakPolarHBondContact OE1-CD 3.36Å; E489-R492 IonicContact OE1-CZ 3.18Å; E489-R492 IonicContact OE1-NE 2.77Å; E489-R492 IonicContact OE1-NH1 2.72Å; E489-R492 PolarHBondContact OE1-NH1 2.92Å; E489-R492 IonicContact OE2-CZ 2.77Å; E489-R492 IonicContact OE2-NH1 2.78Å; E489-R492 PolarHBondContact OE2-NH1 2.96Å; E489-V493 PolarHBondContact O-N 2.93Å
490	P	95.1	Very high	94.1	Very high	55 Å²	55	57.8 Å²	57.8	36%	0.357	28%	0.277	S	S	.	.	H	α-helix	trans	-56.4	-35.1	-170.5	22.2	-33.4	0	0	0	113	L487 K488 R492 V493 E494	L487-P490 HydrophobicContact CB-CB 3.95Å; L487-P490 HydrophobicContact CB-CG 4.42Å; L487-P490 HydrophobicContact CD1-CB 4.17Å; K488-P490 WeakPolarHBondContact O-CD 3.39Å; P490-R492 VanDerWaalsContact C-N 3.34Å; P490-R492 PolarHBondContact O-N 3.5Å; P490-V493 WeakPolarHBondContact O-CB 3.4Å; P490-V493 PolarHBondContact O-N 3.24Å; P490-V493 VanDerWaalsContact O-N 3.14Å; P490-E494 PolarHBondContact O-N 3.31Å
491	K	95.1	Very high	93.9	Very high	127 Å²	127	59.4 Å²	59.4	55%	0.552	29%	0.286	S	S	*	.	H	α-helix	trans	-63.5	-34.3	174.7	176.2	161.6	177.2	142	0	113.3	E489 V493 E494 D495	E489-K491 PolarHBondContact O-N 3.05Å; K491-V493 VanDerWaalsContact C-N 3.29Å; K491-V493 PolarHBondContact O-N 3.38Å; K491-E494 WeakPolarHBondContact O-CB 3.31Å; K491-E494 PolarHBondContact O-N 3.09Å; K491-D495 VanDerWaalsContact CE-CG 3.41Å; K491-D495 WeakPolarHBondContact CE-OD1 3.21Å; K491-D495 WeakPolarHBondContact CE-OD2 3.43Å; K491-D495 IonicContact NZ-OD1 2.64Å; K491-D495 PolarHBondContact NZ-OD1 2.83Å; K491-D495 IonicContact NZ-OD2 3.58Å; K491-D495 WeakPolarHBondContact O-CB 3.28Å; K491-D495 VanDerWaalsContact O-CG 3.31Å; K491-D495 PolarHBondContact O-N 3.48Å
492	R	95.1	Very high	93.6	Very high	89 Å²	89	62.8 Å²	62.8	34%	0.336	31%	0.309	S	S	.	.	H	α-helix	trans	-68.6	-33.3	174.9	-72.9	177.5	60.4	-166.8	-6.6	111.2	S398 F399 E489 P490 F496	S398-R492 VanDerWaalsContact C-NH2 3.3Å; S398-R492 PolarHBondContact O-NH1 3.09Å; S398-R492 PolarHBondContact O-NH2 3.49Å; S398-R492 PolarHBondContact OG-NH2 3.16Å; F399-R492 HydrophobicContact CD1-CB 4.34Å; F399-R492 HydrophobicContact CE1-CB 3.71Å; E489-R492 HydrophobicContact CB-CB 4.23Å; E489-R492 HydrophobicContact CB-CG 4.35Å; E489-R492 WeakPolarHBondContact O-CB 3.39Å; E489-R492 PolarHBondContact O-N 3.46Å; E489-R492 WeakPolarHBondContact OE1-CD 3.36Å; E489-R492 IonicContact OE1-CZ 3.18Å; E489-R492 IonicContact OE1-NE 2.77Å; E489-R492 IonicContact OE1-NH1 2.72Å; E489-R492 PolarHBondContact OE1-NH1 2.92Å; E489-R492 IonicContact OE2-CZ 2.77Å; E489-R492 IonicContact OE2-NH1 2.78Å; E489-R492 PolarHBondContact OE2-NH1 2.96Å; P490-R492 VanDerWaalsContact C-N 3.34Å; P490-R492 PolarHBondContact O-N 3.5Å; R492-F496 VanDerWaalsContact O-CB 3.3Å; R492-F496 WeakPolarHBondContact O-CB 3.45Å; R492-F496 PolarHBondContact O-N 2.85Å
493	V	96.6	Very high	93.6	Very high	0 Å²	0	61.8 Å²	61.8	0%	0	30%	0.303	C	S	.	.	H	α-helix	trans	-67.4	-43.9	173.5	-176.1	0	0	0	0	110.1	F399 L407 I481 L487 E489 P490 K491 F496 Q497	F399-V493 HydrophobicContact CD1-CG2 4.26Å; F399-V493 HydrophobicContact CE1-CG2 3.71Å; F399-V493 HydrophobicContact CZ-CG2 4.01Å; L407-V493 HydrophobicContact CD1-CG1 4.4Å; L407-V493 HydrophobicContact CD1-CG2 4.13Å; L407-V493 HydrophobicContact CD2-CG1 4.19Å; I481-V493 HydrophobicContact CG2-CG1 4.08Å; L487-V493 HydrophobicContact CD1-CB 4.33Å; L487-V493 HydrophobicContact CD1-CG1 4.48Å; L487-V493 HydrophobicContact CD1-CG2 4.06Å; L487-V493 HydrophobicContact CD2-CG2 4.25Å; E489-V493 PolarHBondContact O-N 2.93Å; P490-V493 WeakPolarHBondContact O-CB 3.4Å; P490-V493 PolarHBondContact O-N 3.24Å; P490-V493 VanDerWaalsContact O-N 3.14Å; K491-V493 VanDerWaalsContact C-N 3.29Å; K491-V493 PolarHBondContact O-N 3.38Å; V493-F496 PolarHBondContact O-N 3.13Å; V493-Q497 VanDerWaalsContact O-CB 3.28Å; V493-Q497 WeakPolarHBondContact O-CB 3.45Å; V493-Q497 PolarHBondContact O-N 2.98Å
494	E	95.6	Very high	93.6	Very high	82 Å²	82	58 Å²	58	38%	0.383	28%	0.283	S	S	.	.	H	α-helix	trans	-59	-50.9	172.3	-175.1	-165.1	-179.9	0	0	112.1	Y89 P490 K491 F496 Q497 N498	Y89-E494 HydrophobicContact CE1-CG 4.43Å; P490-E494 PolarHBondContact O-N 3.31Å; K491-E494 WeakPolarHBondContact O-CB 3.31Å; K491-E494 PolarHBondContact O-N 3.09Å; E494-F496 VanDerWaalsContact C-N 3.3Å; E494-F496 PolarHBondContact O-N 3.26Å; E494-Q497 PolarHBondContact O-N 2.9Å; E494-N498 WeakPolarHBondContact O-CB 3.29Å; E494-N498 PolarHBondContact O-N 3.29Å; E494-N498 PolarHBondContact O-ND2 3.44Å
495	D	94.7	Very high	93.5	Very high	80 Å²	80	62 Å²	62	43%	0.428	30%	0.301	S	S	.	.	H	α-helix	trans	-60.3	-39.4	178.9	-73.8	-33	0	0	0	110.8	K491 Q499	K491-D495 VanDerWaalsContact CE-CG 3.41Å; K491-D495 WeakPolarHBondContact CE-OD1 3.21Å; K491-D495 WeakPolarHBondContact CE-OD2 3.43Å; K491-D495 IonicContact NZ-OD1 2.64Å; K491-D495 PolarHBondContact NZ-OD1 2.83Å; K491-D495 IonicContact NZ-OD2 3.58Å; K491-D495 WeakPolarHBondContact O-CB 3.28Å; K491-D495 VanDerWaalsContact O-CG 3.31Å; K491-D495 PolarHBondContact O-N 3.48Å; D495-Q499 PolarHBondContact O-N 3.22Å; D495-Q499 VanDerWaalsContact O-N 3.13Å
496	F	95.3	Very high	93.3	Very high	19 Å²	19	54.5 Å²	54.5	8%	0.083	28%	0.281	C	S	.	.	H	α-helix	trans	-75	-38.1	177.4	-174.6	-147.8	0	0	0	113.1	M333 I393 P394 F399 I481 R492 V493 E494 N498 Q499 L500	M333-F496 HydrophobicContact CE-CE2 3.77Å; M333-F496 HydrophobicContact SD-CE2 4.45Å; I393-F496 HydrophobicContact CG2-CE1 4.3Å; I393-F496 HydrophobicContact CG2-CZ 4.01Å; P394-F496 WeakPolarHBondContact O-CZ 3.46Å; F399-F496 AromaticContact CE2-CD1 3.79Å; F399-F496 HydrophobicContact CE2-CD1 3.79Å; F399-F496 HydrophobicContact CE2-CE1 4.25Å; F399-F496 HydrophobicContact CZ-CB 4.27Å; F399-F496 AromaticContact CZ-CD1 3.77Å; F399-F496 HydrophobicContact CZ-CD1 3.77Å; F399-F496 HydrophobicContact CZ-CG 4.46Å; I481-F496 HydrophobicContact CB-CD1 4.36Å; I481-F496 HydrophobicContact CD1-CD1 3.92Å; I481-F496 HydrophobicContact CD1-CE1 3.69Å; I481-F496 HydrophobicContact CG1-CD1 3.87Å; I481-F496 HydrophobicContact CG1-CE1 3.67Å; I481-F496 HydrophobicContact CG2-CB 4.14Å; I481-F496 HydrophobicContact CG2-CD1 3.53Å; I481-F496 HydrophobicContact CG2-CE1 4.22Å; I481-F496 HydrophobicContact CG2-CG 4.02Å; R492-F496 VanDerWaalsContact O-CB 3.3Å; R492-F496 WeakPolarHBondContact O-CB 3.45Å; R492-F496 PolarHBondContact O-N 2.85Å; V493-F496 PolarHBondContact O-N 3.13Å; E494-F496 VanDerWaalsContact C-N 3.3Å; E494-F496 PolarHBondContact O-N 3.26Å; F496-N498 VanDerWaalsContact C-N 3.32Å; F496-N498 PolarHBondContact O-N 3.44Å; F496-Q499 HydrophobicContact CD2-CB 4.43Å; F496-Q499 WeakPolarHBondContact O-CB 3.44Å; F496-Q499 PolarHBondContact O-N 2.78Å; F496-Q499 VanDerWaalsContact O-N 3.12Å; F496-L500 HydrophobicContact CD2-CG 4.36Å; F496-L500 HydrophobicContact CE2-CD1 4.35Å; F496-L500 HydrophobicContact CE2-CD2 4.28Å; F496-L500 HydrophobicContact CE2-CG 4.09Å; F496-L500 HydrophobicContact CZ-CD1 4.32Å; F496-L500 HydrophobicContact CZ-CG 4.49Å; F496-L500 PolarHBondContact O-N 3.19Å
497	Q	95.7	Very high	93	Very high	23 Å²	23	54.6 Å²	54.6	11%	0.107	27%	0.271	C	S	.	.	H	α-helix	trans	-59.5	-44.1	172	-176.9	174.6	66.5	0	0	110.7	L478 I481 T482 V493 E494 Q499 L500 I501	L478-Q497 HydrophobicContact CD2-CG 3.91Å; I481-Q497 HydrophobicContact CG2-CB 4.14Å; I481-Q497 WeakPolarHBondContact O-CG 3.18Å; I481-Q497 PolarHBondContact O-NE2 3.41Å; T482-Q497 VanDerWaalsContact CA-NE2 3.28Å; T482-Q497 PolarHBondContact OG1-NE2 3.02Å; V493-Q497 VanDerWaalsContact O-CB 3.28Å; V493-Q497 WeakPolarHBondContact O-CB 3.45Å; V493-Q497 PolarHBondContact O-N 2.98Å; E494-Q497 PolarHBondContact O-N 2.9Å; Q497-Q499 VanDerWaalsContact C-N 3.31Å; Q497-Q499 PolarHBondContact O-N 2.9Å; Q497-L500 PolarHBondContact O-N 3Å; Q497-I501 HydrophobicContact CG-CD1 4.01Å; Q497-I501 WeakPolarHBondContact O-CG1 3.49Å; Q497-I501 PolarHBondContact O-N 2.97Å
498	N	94.3	Very high	92.5	Very high	63 Å²	63	54.9 Å²	54.9	34%	0.337	27%	0.272	S	S	.	.	H	α-helix	trans	-62.7	-35.8	174.7	-76.7	-64.4	0	0	0	112.4	Y89 E494 F496 S502	Y89-N498 PolarHBondContact OH-ND2 3.06Å; Y89-N498 PolarHBondContact OH-OD1 3.33Å; Y89-N498 VanDerWaalsContact OH-OD1 3.12Å; E494-N498 WeakPolarHBondContact O-CB 3.29Å; E494-N498 PolarHBondContact O-N 3.29Å; E494-N498 PolarHBondContact O-ND2 3.44Å; F496-N498 VanDerWaalsContact C-N 3.32Å; F496-N498 PolarHBondContact O-N 3.44Å; N498-S502 WeakPolarHBondContact O-CB 3.39Å; N498-S502 PolarHBondContact O-N 2.93Å
499	Q	93.4	Very high	91.7	Very high	77 Å²	77	53.4 Å²	53.4	36%	0.36	28%	0.279	S	S	.	.	H	α-helix	trans	-62.5	-47.9	172.5	-174.9	176.3	1.2	0	0	111.5	M333 D495 F496 Q497 I501 S502 C503	M333-Q499 HydrophobicContact CE-CG 4.3Å; M333-Q499 HydrophobicContact SD-CG 4.11Å; D495-Q499 PolarHBondContact O-N 3.22Å; D495-Q499 VanDerWaalsContact O-N 3.13Å; F496-Q499 HydrophobicContact CD2-CB 4.43Å; F496-Q499 WeakPolarHBondContact O-CB 3.44Å; F496-Q499 PolarHBondContact O-N 2.78Å; F496-Q499 VanDerWaalsContact O-N 3.12Å; Q497-Q499 VanDerWaalsContact C-N 3.31Å; Q497-Q499 PolarHBondContact O-N 2.9Å; Q499-I501 PolarHBondContact O-N 3.03Å; Q499-S502 WeakPolarHBondContact O-CB 3.29Å; Q499-S502 PolarHBondContact O-N 3.46Å; Q499-S502 VanDerWaalsContact O-N 3.13Å; Q499-C503 PolarHBondContact O-N 2.81Å; Q499-C503 PolarHBondContact O-SG 2.87Å
500	L	93.8	Very high	90.4	Very high	0 Å²	0	53.6 Å²	53.6	0%	0	30%	0.297	C	S	.	.	H	α-helix	trans	-61	-44.7	177.2	-70.1	170	0	0	0	112.2	M333 L337 A477 L478 I481 F496 Q497 S502 C503 L504	M333-L500 HydrophobicContact SD-CD2 3.87Å; L337-L500 HydrophobicContact CD1-CD2 3.72Å; A477-L500 HydrophobicContact CB-CD1 4.07Å; A477-L500 HydrophobicContact CB-CD2 4.21Å; L478-L500 HydrophobicContact CD2-CB 3.57Å; L478-L500 HydrophobicContact CD2-CD1 4.26Å; L478-L500 HydrophobicContact CG-CB 4.16Å; I481-L500 HydrophobicContact CB-CD1 3.74Å; I481-L500 HydrophobicContact CG1-CD1 3.71Å; I481-L500 HydrophobicContact CG2-CD1 4.09Å; F496-L500 HydrophobicContact CD2-CG 4.36Å; F496-L500 HydrophobicContact CE2-CD1 4.35Å; F496-L500 HydrophobicContact CE2-CD2 4.28Å; F496-L500 HydrophobicContact CE2-CG 4.09Å; F496-L500 HydrophobicContact CZ-CD1 4.32Å; F496-L500 HydrophobicContact CZ-CG 4.49Å; F496-L500 PolarHBondContact O-N 3.19Å; Q497-L500 PolarHBondContact O-N 3Å; L500-S502 VanDerWaalsContact C-N 3.28Å; L500-S502 PolarHBondContact O-N 3.25Å; L500-C503 PolarHBondContact O-N 2.77Å; L500-L504 PolarHBondContact O-N 2.79Å
501	I	91.9	Very high	88.8	Confident	35 Å²	35	53.2 Å²	53.2	18%	0.179	30%	0.295	C	S	.	.	H	α-helix	trans	-59.5	-39.7	173.7	-68.3	170.5	0	0	0	110.8	L478 Q497 Q499 K505	L478-I501 HydrophobicContact CD1-CG1 4.26Å; L478-I501 HydrophobicContact CD2-CD1 4.47Å; L478-I501 HydrophobicContact CD2-CG1 3.7Å; Q497-I501 HydrophobicContact CG-CD1 4.01Å; Q497-I501 WeakPolarHBondContact O-CG1 3.49Å; Q497-I501 PolarHBondContact O-N 2.97Å; Q499-I501 PolarHBondContact O-N 3.03Å; I501-K505 HydrophobicContact CG2-CD 3.95Å; I501-K505 WeakPolarHBondContact O-CB 3.44Å; I501-K505 VanDerWaalsContact O-CG 3.28Å; I501-K505 WeakPolarHBondContact O-CG 3.41Å; I501-K505 PolarHBondContact O-N 3.11Å
502	S	90.9	Very high	86.9	Confident	70 Å²	70	49.6 Å²	49.6	49%	0.49	29%	0.293	S	S	.	.	H	α-helix	trans	-68	-37	177.2	-168.3	0	0	0	0	112.4	N498 Q499 L500 S506	N498-S502 WeakPolarHBondContact O-CB 3.39Å; N498-S502 PolarHBondContact O-N 2.93Å; Q499-S502 WeakPolarHBondContact O-CB 3.29Å; Q499-S502 PolarHBondContact O-N 3.46Å; Q499-S502 VanDerWaalsContact O-N 3.13Å; L500-S502 VanDerWaalsContact C-N 3.28Å; L500-S502 PolarHBondContact O-N 3.25Å; S502-S506 WeakPolarHBondContact O-CB 3.31Å; S502-S506 PolarHBondContact O-N 3.24Å
503	C	90.8	Very high	84.7	Confident	3 Å²	3	51.3 Å²	51.3	2%	0.02	32%	0.319	C	S	.	.	H	α-helix	trans	-64.7	-50.1	174.5	-66.3	0	0	0	0	111	P330 M333 I334 Q499 L500 K505 S506 H507	P330-C503 HydrophobicContact CB-CB 4.32Å; M333-C503 VanDerWaalsContact SD-SG 3.69Å; I334-C503 HydrophobicContact CD1-CB 4.13Å; I334-C503 HydrophobicContact CG1-CB 4.11Å; Q499-C503 PolarHBondContact O-N 2.81Å; Q499-C503 PolarHBondContact O-SG 2.87Å; L500-C503 PolarHBondContact O-N 2.77Å; C503-K505 PolarHBondContact O-N 3.26Å; C503-S506 WeakPolarHBondContact O-CB 3.4Å; C503-S506 PolarHBondContact O-N 2.78Å; C503-H507 PolarHBondContact O-N 2.83Å
504	L	89.7	Confident	82.7	Confident	1 Å²	1	60.8 Å²	60.8	1%	0.005	36%	0.363	C	S	.	.	H	α-helix	trans	-58.3	-44.9	177.4	-176.6	56.6	0	0	0	112.2	C474 L478 L500 S506 H507 M508 L521 L524	C474-L504 HydrophobicContact CB-CB 4.17Å; C474-L504 HydrophobicContact CB-CD1 3.81Å; C474-L504 HydrophobicContact CB-CD2 4.25Å; C474-L504 HydrophobicContact CB-CG 4.3Å; L478-L504 HydrophobicContact CD1-CD2 3.99Å; L500-L504 PolarHBondContact O-N 2.79Å; L504-S506 VanDerWaalsContact C-N 3.33Å; L504-S506 PolarHBondContact O-N 3.24Å; L504-H507 PolarHBondContact O-N 2.8Å; L504-M508 HydrophobicContact CD1-CE 3.77Å; L504-M508 HydrophobicContact CD1-CG 4.43Å; L504-M508 HydrophobicContact CD1-SD 4.38Å; L504-M508 HydrophobicContact CD2-CE 4.44Å; L504-M508 HydrophobicContact CG-CE 4.03Å; L504-M508 HydrophobicContact CG-SD 4.28Å; L504-M508 WeakPolarHBondContact O-CG 3.37Å; L504-M508 PolarHBondContact O-N 3.11Å; L504-L521 HydrophobicContact CD2-CD1 3.83Å; L504-L521 HydrophobicContact CG-CD1 4.13Å; L504-L524 HydrophobicContact CD2-CD2 4.28Å
505	K	88.7	Confident	80.9	Confident	107 Å²	107	61 Å²	61	47%	0.465	37%	0.374	S	S	.	.	H	α-helix	trans	-59.1	-42	172.9	-78.3	172	179.9	177.8	0	112.4	I501 C503 S509 L521	I501-K505 HydrophobicContact CG2-CD 3.95Å; I501-K505 WeakPolarHBondContact O-CB 3.44Å; I501-K505 VanDerWaalsContact O-CG 3.28Å; I501-K505 WeakPolarHBondContact O-CG 3.41Å; I501-K505 PolarHBondContact O-N 3.11Å; C503-K505 PolarHBondContact O-N 3.26Å; K505-S509 WeakPolarHBondContact O-CB 3.34Å; K505-S509 PolarHBondContact O-N 2.93Å; K505-S509 VanDerWaalsContact O-N 3.09Å; K505-S509 PolarHBondContact O-OG 3.45Å; K505-L521 HydrophobicContact CD-CD2 4.24Å; K505-L521 HydrophobicContact CG-CD2 3.54Å
506	S	86.6	Confident	79.5	Confident	65 Å²	65	59.6 Å²	59.6	46%	0.455	37%	0.366	S	S	.	.	H	α-helix	trans	-67.9	-34.2	179.1	-170	0	0	0	0	112.7	S502 C503 L504 G510	S502-S506 WeakPolarHBondContact O-CB 3.31Å; S502-S506 PolarHBondContact O-N 3.24Å; C503-S506 WeakPolarHBondContact O-CB 3.4Å; C503-S506 PolarHBondContact O-N 2.78Å; L504-S506 VanDerWaalsContact C-N 3.33Å; L504-S506 PolarHBondContact O-N 3.24Å; S506-G510 PolarHBondContact O-N 3.39Å; S506-G510 VanDerWaalsContact O-N 3.07Å
507	H	85.3	Confident	78.1	Confident	40 Å²	40	61.3 Å²	61.3	19%	0.185	38%	0.379	C	S	.	.	H	α-helix	trans	-68.3	-53.1	175.7	178.8	67.9	0	0	0	111.3	I334 D468 E470 C503 L504 S509 G510 C511	I334-H507 HydrophobicContact CD1-CB 3.66Å; D468-H507 IonicContact OD2-CD2 3Å; D468-H507 PolarHBondContact OD2-CD2 3.43Å; D468-H507 IonicContact OD2-CE1 2.68Å; D468-H507 IonicContact OD2-NE2 3.5Å; D468-H507 PolarHBondContact OD2-NE2 3.4Å; E470-H507 VanDerWaalsContact CB-NE2 3.31Å; E470-H507 WeakPolarHBondContact CB-NE2 3.2Å; C503-H507 PolarHBondContact O-N 2.83Å; L504-H507 PolarHBondContact O-N 2.8Å; H507-S509 PolarHBondContact O-N 3.42Å; H507-S509 VanDerWaalsContact O-N 3.09Å; H507-G510 WeakPolarHBondContact O-CA 3.28Å; H507-G510 PolarHBondContact O-N 2.93Å; H507-C511 PolarHBondContact O-N 2.93Å
508	M	83.2	Confident	76.8	Confident	27 Å²	27	65.7 Å²	65.7	13%	0.133	41%	0.409	C	S	.	.	H	α-helix	trans	-60.2	-21.6	176.1	-67.5	177.9	167.9	0	0	114.1	L504 L516 Y520 L521 L524	L504-M508 HydrophobicContact CD1-CE 3.77Å; L504-M508 HydrophobicContact CD1-CG 4.43Å; L504-M508 HydrophobicContact CD1-SD 4.38Å; L504-M508 HydrophobicContact CD2-CE 4.44Å; L504-M508 HydrophobicContact CG-CE 4.03Å; L504-M508 HydrophobicContact CG-SD 4.28Å; L504-M508 WeakPolarHBondContact O-CG 3.37Å; L504-M508 PolarHBondContact O-N 3.11Å; M508-L516 HydrophobicContact CB-CD1 4.24Å; M508-L516 HydrophobicContact CG-CD1 4.41Å; M508-Y520 HydrophobicContact CE-CD1 3.5Å; M508-Y520 VanDerWaalsContact CE-CD1 3.5Å; M508-Y520 HydrophobicContact CE-CE1 3.7Å; M508-Y520 HydrophobicContact CE-CG 4.46Å; M508-Y520 HydrophobicContact CG-CD1 4.26Å; M508-Y520 HydrophobicContact SD-CD1 4.08Å; M508-L521 HydrophobicContact CE-CB 4.35Å; M508-L521 HydrophobicContact CE-CD1 4.03Å; M508-L521 HydrophobicContact SD-CB 3.61Å; M508-L521 HydrophobicContact SD-CD1 3.78Å; M508-L521 HydrophobicContact SD-CG 4.18Å; M508-L524 HydrophobicContact CE-CD2 3.58Å
509	S	79	Confident	76.2	Confident	99 Å²	99	68.4 Å²	68.4	69%	0.692	42%	0.424	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.2	-13.9	174.2	-50.7	0	0	0	0	113.5	K505 H507	K505-S509 WeakPolarHBondContact O-CB 3.34Å; K505-S509 PolarHBondContact O-N 2.93Å; K505-S509 VanDerWaalsContact O-N 3.09Å; K505-S509 PolarHBondContact O-OG 3.45Å; H507-S509 PolarHBondContact O-N 3.42Å; H507-S509 VanDerWaalsContact O-N 3.09Å
510	G	68.4	Low	75.8	Confident	64 Å²	64	65.2 Å²	65.2	66%	0.66	41%	0.409	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.2	-31.6	178.8	0	0	0	0	0	112.7	S506 H507 G512	S506-G510 PolarHBondContact O-N 3.39Å; S506-G510 VanDerWaalsContact O-N 3.07Å; H507-G510 WeakPolarHBondContact O-CA 3.28Å; H507-G510 PolarHBondContact O-N 2.93Å; G510-G512 PolarHBondContact O-N 2.85Å
511	C	60.9	Low	75.4	Confident	47 Å²	47	67 Å²	67	32%	0.318	42%	0.418	S	S	.	.	S	Bend	trans	-59.6	120.6	158.9	-66.4	0	0	0	0	108.8	H507 L516	H507-C511 PolarHBondContact O-N 2.93Å; C511-L516 HydrophobicContact CB-CD1 3.85Å; C511-L516 HydrophobicContact CB-CG 4.39Å
512	G	54.4	Low	75.3	Confident	51 Å²	51	68.4 Å²	68.4	53%	0.526	43%	0.431	S	S	.	.			trans	-55.8	142.4	-175.9	0	0	0	0	0	112.6	G510 E514 S515	G510-G512 PolarHBondContact O-N 2.85Å; G512-E514 PolarHBondContact O-N 3.2Å; G512-S515 PolarHBondContact O-N 3.42Å; G512-S515 PolarHBondContact O-OG 2.92Å
513	S	50.6	Low	75.2	Confident	124 Å²	124	70.5 Å²	70.5	87%	0.867	43%	0.428	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.1	14.5	-167.7	61.3	0	0	0	0	116.3
514	E	52.9	Low	75.2	Confident	199 Å²	199	70.3 Å²	70.3	93%	0.93	43%	0.427	S	S	*	.	T	Hydrogen-bonded Turn	trans	-103.3	-13.1	176.6	-59.9	-176.5	142.8	0	0	112.3	G512	G512-E514 PolarHBondContact O-N 3.2Å
515	S	58.8	Low	75.3	Confident	87 Å²	87	72.2 Å²	72.2	61%	0.608	44%	0.437	S	S	*	.	T	Hydrogen-bonded Turn	trans	-104.8	-34.8	-171.6	60.9	0	0	0	0	115.4	G512	G512-S515 PolarHBondContact O-N 3.42Å; G512-S515 PolarHBondContact O-OG 2.92Å
516	L	64.9	Low	75.5	Confident	51 Å²	51	68.9 Å²	68.9	27%	0.267	43%	0.432	S	S	.	.	S	Bend	trans	-99.4	135.1	-177.1	-69.7	176.9	0	0	0	111.5	M508 C511 Y520	M508-L516 HydrophobicContact CB-CD1 4.24Å; M508-L516 HydrophobicContact CG-CD1 4.41Å; C511-L516 HydrophobicContact CB-CD1 3.85Å; C511-L516 HydrophobicContact CB-CG 4.39Å; L516-Y520 HydrophobicContact CD1-CD1 4.17Å; L516-Y520 HydrophobicContact CD1-CE1 4.43Å; L516-Y520 HydrophobicContact CD2-CD1 3.84Å; L516-Y520 HydrophobicContact CD2-CE1 3.69Å; L516-Y520 HydrophobicContact CD2-CG 4.39Å; L516-Y520 HydrophobicContact CG-CD1 4.46Å
517	P	66.3	Low	75.8	Confident	55 Å²	55	67 Å²	67	36%	0.357	42%	0.416	S	S	.	.	P	Polyproline II helix	trans	-68.6	150.3	180	28.3	-34.1	0	0	0	111.5	N519 Y520	P517-N519 PolarHBondContact O-N 2.95Å; P517-Y520 HydrophobicContact CG-CD2 4.08Å; P517-Y520 HydrophobicContact CG-CG 4.48Å; P517-Y520 WeakPolarHBondContact O-CB 3.37Å; P517-Y520 PolarHBondContact O-N 3.45Å
518	P	68.5	Low	76.2	Confident	114 Å²	114	66.5 Å²	66.5	74%	0.74	41%	0.414	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.7	144.9	172.1	25	-34.1	0	0	0	110.4	Y520	P518-Y520 VanDerWaalsContact C-N 3.27Å; P518-Y520 PolarHBondContact O-N 3.39Å
519	N	80.8	Confident	76.8	Confident	120 Å²	120	68.4 Å²	68.4	64%	0.642	43%	0.429	S	S	*	.	T	Hydrogen-bonded Turn	trans	63.8	19.9	-177.4	-57.1	-41.6	0	0	0	115.7	P517 L521 S522 R523	P517-N519 PolarHBondContact O-N 2.95Å; N519-L521 VanDerWaalsContact C-N 3.33Å; N519-L521 PolarHBondContact O-N 3.06Å; N519-S522 WeakPolarHBondContact CB-OG 3.4Å; N519-S522 PolarHBondContact O-N 3.23Å; N519-S522 PolarHBondContact O-OG 2.92Å; N519-S522 VanDerWaalsContact O-OG 3.11Å; N519-R523 WeakPolarHBondContact O-CG 3.36Å; N519-R523 PolarHBondContact O-N 3.35Å
520	Y	84.6	Confident	77.6	Confident	11 Å²	11	66.6 Å²	66.6	4%	0.043	41%	0.411	C	S	.	.	H	α-helix	trans	-53.5	-43.7	176.6	-173.8	-124	0	0	0	113.5	M465 L467 D468 M508 L516 P517 P518 S522 R523 L524	M465-Y520 HydrophobicContact CE-CD2 4.39Å; M465-Y520 HydrophobicContact CE-CE2 4.21Å; L467-Y520 WeakPolarHBondContact CD2-OH 3.42Å; D468-Y520 PolarHBondContact OD1-OH 3.11Å; D468-Y520 VanDerWaalsContact OD1-OH 3.09Å; M508-Y520 HydrophobicContact CE-CD1 3.5Å; M508-Y520 VanDerWaalsContact CE-CD1 3.5Å; M508-Y520 HydrophobicContact CE-CE1 3.7Å; M508-Y520 HydrophobicContact CE-CG 4.46Å; M508-Y520 HydrophobicContact CG-CD1 4.26Å; M508-Y520 HydrophobicContact SD-CD1 4.08Å; L516-Y520 HydrophobicContact CD1-CD1 4.17Å; L516-Y520 HydrophobicContact CD1-CE1 4.43Å; L516-Y520 HydrophobicContact CD2-CD1 3.84Å; L516-Y520 HydrophobicContact CD2-CE1 3.69Å; L516-Y520 HydrophobicContact CD2-CG 4.39Å; L516-Y520 HydrophobicContact CG-CD1 4.46Å; P517-Y520 HydrophobicContact CG-CD2 4.08Å; P517-Y520 HydrophobicContact CG-CG 4.48Å; P517-Y520 WeakPolarHBondContact O-CB 3.37Å; P517-Y520 PolarHBondContact O-N 3.45Å; P518-Y520 VanDerWaalsContact C-N 3.27Å; P518-Y520 PolarHBondContact O-N 3.39Å; Y520-S522 PolarHBondContact O-N 2.89Å; Y520-R523 PolarHBondContact O-N 2.85Å; Y520-L524 WeakPolarHBondContact O-CB 3.43Å; Y520-L524 PolarHBondContact O-N 3.46Å
521	L	87	Confident	79	Confident	38 Å²	38	63.6 Å²	63.6	20%	0.199	38%	0.38	C	S	.	.	H	α-helix	trans	-62.1	-44.5	177.7	-178.7	58.7	0	0	0	113.3	L504 K505 M508 N519 L524 L525	L504-L521 HydrophobicContact CD2-CD1 3.83Å; L504-L521 HydrophobicContact CG-CD1 4.13Å; K505-L521 HydrophobicContact CD-CD2 4.24Å; K505-L521 HydrophobicContact CG-CD2 3.54Å; M508-L521 HydrophobicContact CE-CB 4.35Å; M508-L521 HydrophobicContact CE-CD1 4.03Å; M508-L521 HydrophobicContact SD-CB 3.61Å; M508-L521 HydrophobicContact SD-CD1 3.78Å; M508-L521 HydrophobicContact SD-CG 4.18Å; N519-L521 VanDerWaalsContact C-N 3.33Å; N519-L521 PolarHBondContact O-N 3.06Å; L521-L524 PolarHBondContact O-N 3.3Å; L521-L525 HydrophobicContact CD1-CD1 3.96Å; L521-L525 HydrophobicContact CD1-CG 4.06Å; L521-L525 HydrophobicContact CG-CD1 4.08Å; L521-L525 WeakPolarHBondContact O-CG 3.36Å; L521-L525 PolarHBondContact O-N 3.47Å
522	S	89	Confident	80.6	Confident	63 Å²	63	67.3 Å²	67.3	44%	0.441	39%	0.388	S	S	.	.	H	α-helix	trans	-74	-30.3	-179.7	46.4	0	0	0	0	111.9	N519 Y520 G526	N519-S522 WeakPolarHBondContact CB-OG 3.4Å; N519-S522 PolarHBondContact O-N 3.23Å; N519-S522 PolarHBondContact O-OG 2.92Å; N519-S522 VanDerWaalsContact O-OG 3.11Å; Y520-S522 PolarHBondContact O-N 2.89Å; S522-G526 WeakPolarHBondContact O-CA 3.43Å; S522-G526 PolarHBondContact O-N 3.11Å
523	R	89.6	Confident	82.6	Confident	114 Å²	114	68.8 Å²	68.8	43%	0.43	39%	0.387	S	S	.	.	H	α-helix	trans	-61.7	-42.2	166.1	-71.1	176.8	63.6	-158.1	-3.2	111.9	M465 N519 Y520 G526	M465-R523 HydrophobicContact CE-CB 3.88Å; N519-R523 WeakPolarHBondContact O-CG 3.36Å; N519-R523 PolarHBondContact O-N 3.35Å; Y520-R523 PolarHBondContact O-N 2.85Å; R523-G526 WeakPolarHBondContact O-CA 3.39Å; R523-G526 PolarHBondContact O-N 3.13Å
524	L	90.8	Very high	84.8	Confident	0 Å²	0	63.5 Å²	63.5	0%	0	35%	0.348	C	S	.	.	H	α-helix	trans	-69.4	-48.9	-178.7	-177.5	55.7	0	0	0	112.2	M465 L467 L475 L504 M508 Y520 L521 G526 K527	M465-L524 HydrophobicContact CE-CB 4.09Å; M465-L524 HydrophobicContact CE-CD1 4.3Å; L467-L524 HydrophobicContact CD1-CD1 3.79Å; L467-L524 HydrophobicContact CD2-CD1 3.56Å; L467-L524 HydrophobicContact CD2-CD2 3.88Å; L467-L524 HydrophobicContact CD2-CG 4.33Å; L467-L524 HydrophobicContact CG-CD1 4.25Å; L475-L524 HydrophobicContact CD1-CD1 4.36Å; L475-L524 HydrophobicContact CD1-CG 4.36Å; L475-L524 HydrophobicContact CD2-CD1 3.85Å; L504-L524 HydrophobicContact CD2-CD2 4.28Å; M508-L524 HydrophobicContact CE-CD2 3.58Å; Y520-L524 WeakPolarHBondContact O-CB 3.43Å; Y520-L524 PolarHBondContact O-N 3.46Å; L521-L524 PolarHBondContact O-N 3.3Å; L524-G526 PolarHBondContact O-N 3.32Å; L524-K527 WeakPolarHBondContact O-CB 3.42Å; L524-K527 PolarHBondContact O-N 3.23Å
525	L	90.9	Very high	86.9	Confident	41 Å²	41	54.4 Å²	54.4	22%	0.215	31%	0.307	C	S	.	.	H	α-helix	trans	-65.2	-26.3	173.4	-63.2	176	0	0	0	111.8	L521 K527 L528	L521-L525 HydrophobicContact CD1-CD1 3.96Å; L521-L525 HydrophobicContact CD1-CG 4.06Å; L521-L525 HydrophobicContact CG-CD1 4.08Å; L521-L525 WeakPolarHBondContact O-CG 3.36Å; L521-L525 PolarHBondContact O-N 3.47Å; L525-K527 PolarHBondContact O-N 3.34Å; L525-L528 HydrophobicContact CD2-CD1 4.01Å; L525-L528 WeakPolarHBondContact O-CB 3.37Å; L525-L528 WeakPolarHBondContact O-CG 3.32Å; L525-L528 PolarHBondContact O-N 3.29Å; L525-L528 VanDerWaalsContact O-N 3.1Å
526	G	92.6	Very high	88.6	Confident	36 Å²	36	54 Å²	54	37%	0.371	30%	0.301	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63	-8.3	169.5	0	0	0	0	0	115.2	S522 R523 L524 P529	S522-G526 WeakPolarHBondContact O-CA 3.43Å; S522-G526 PolarHBondContact O-N 3.11Å; R523-G526 WeakPolarHBondContact O-CA 3.39Å; R523-G526 PolarHBondContact O-N 3.13Å; L524-G526 PolarHBondContact O-N 3.32Å; G526-P529 WeakPolarHBondContact O-CD 3.18Å
527	K	93.9	Very high	90	Very high	27 Å²	27	54.4 Å²	54.4	12%	0.117	30%	0.302	C	S	.	.	H	α-helix	trans	-87.1	-10.7	169.8	-68	-49.3	-161.5	179.1	0	114.8	F458 S461 M465 L524 L525 D530 L531	F458-K527 HydrophobicContact CE2-CB 4.12Å; F458-K527 HydrophobicContact CE2-CD 4.15Å; F458-K527 HydrophobicContact CE2-CG 4.49Å; F458-K527 HydrophobicContact CZ-CB 4.38Å; S461-K527 WeakPolarHBondContact OG-CE 3.24Å; S461-K527 PolarHBondContact OG-NZ 3.5Å; M465-K527 HydrophobicContact SD-CG 4.01Å; L524-K527 WeakPolarHBondContact O-CB 3.42Å; L524-K527 PolarHBondContact O-N 3.23Å; L525-K527 PolarHBondContact O-N 3.34Å; K527-D530 WeakPolarHBondContact CD-OD2 3.25Å; K527-D530 IonicContact NZ-OD2 2.69Å; K527-D530 PolarHBondContact NZ-OD2 2.94Å; K527-L531 WeakPolarHBondContact O-CB 3.41Å; K527-L531 PolarHBondContact O-N 3.07Å
528	L	94.3	Very high	91.3	Very high	28 Å²	28	51.8 Å²	51.8	15%	0.147	29%	0.285	C	S	.	.	H	α-helix	trans	-69.1	-36.6	176.6	-60.9	172.7	0	0	0	113.6	L475 V479 L525 L531 R532	L475-L528 HydrophobicContact CD1-CD2 3.9Å; L475-L528 HydrophobicContact CD1-CG 4.37Å; V479-L528 HydrophobicContact CG2-CD2 3.67Å; L525-L528 HydrophobicContact CD2-CD1 4.01Å; L525-L528 WeakPolarHBondContact O-CB 3.37Å; L525-L528 WeakPolarHBondContact O-CG 3.32Å; L525-L528 PolarHBondContact O-N 3.29Å; L525-L528 VanDerWaalsContact O-N 3.1Å; L528-L531 PolarHBondContact O-N 2.88Å; L528-R532 WeakPolarHBondContact O-CD 3.42Å; L528-R532 VanDerWaalsContact O-CG 3.27Å; L528-R532 WeakPolarHBondContact O-CG 3.36Å; L528-R532 PolarHBondContact O-N 3.09Å; L528-R532 VanDerWaalsContact O-N 3.09Å
529	P	95.4	Very high	92.4	Very high	68 Å²	68	48.3 Å²	48.3	44%	0.442	26%	0.256	S	S	.	.	H	α-helix	trans	-62	-45.1	170.3	-24.9	36.1	0	0	0	113.8	G526 L531 R532 T533	G526-P529 WeakPolarHBondContact O-CD 3.18Å; P529-L531 VanDerWaalsContact C-N 3.31Å; P529-L531 PolarHBondContact O-N 3.09Å; P529-R532 PolarHBondContact O-N 2.7Å; P529-T533 PolarHBondContact O-N 3Å; P529-T533 VanDerWaalsContact O-N 3.12Å; P529-T533 PolarHBondContact O-OG1 2.91Å
530	D	96	Very high	93	Very high	60 Å²	60	48.5 Å²	48.5	32%	0.321	25%	0.254	S	S	.	.	H	α-helix	trans	-55.4	-49.4	174.3	-57.4	0.8	0	0	0	109.9	F458 K527 R532 T533 L534	F458-D530 HydrophobicContact CD2-CB 3.84Å; F458-D530 HydrophobicContact CE2-CB 3.77Å; K527-D530 WeakPolarHBondContact CD-OD2 3.25Å; K527-D530 IonicContact NZ-OD2 2.69Å; K527-D530 PolarHBondContact NZ-OD2 2.94Å; D530-R532 VanDerWaalsContact C-N 3.33Å; D530-R532 PolarHBondContact O-N 2.99Å; D530-T533 WeakPolarHBondContact O-CB 3.32Å; D530-T533 PolarHBondContact O-N 3.12Å; D530-L534 WeakPolarHBondContact O-CG 3.46Å; D530-L534 PolarHBondContact O-N 3.34Å
531	L	96.8	Very high	93.3	Very high	1 Å²	1	49.5 Å²	49.5	1%	0.005	26%	0.257	C	S	.	.	H	α-helix	trans	-61.7	-36.3	-178.5	-166.7	63.1	0	0	0	113.4	E414 I417 L418 F458 V479 K527 L528 P529 S535	E414-L531 HydrophobicContact CB-CD2 3.98Å; E414-L531 HydrophobicContact CB-CG 4.03Å; E414-L531 HydrophobicContact CG-CG 4.5Å; E414-L531 WeakPolarHBondContact O-CD1 3.29Å; I417-L531 HydrophobicContact CB-CD1 3.78Å; I417-L531 HydrophobicContact CG2-CD1 3.59Å; L418-L531 HydrophobicContact CB-CD1 4.07Å; L418-L531 HydrophobicContact CB-CD2 4.05Å; L418-L531 HydrophobicContact CD2-CD2 4.26Å; F458-L531 HydrophobicContact CE1-CD1 4.02Å; F458-L531 HydrophobicContact CZ-CB 4.39Å; F458-L531 HydrophobicContact CZ-CD1 4.03Å; V479-L531 HydrophobicContact CG1-CD2 4.39Å; V479-L531 HydrophobicContact CG2-CD2 3.88Å; K527-L531 WeakPolarHBondContact O-CB 3.41Å; K527-L531 PolarHBondContact O-N 3.07Å; L528-L531 PolarHBondContact O-N 2.88Å; P529-L531 VanDerWaalsContact C-N 3.31Å; P529-L531 PolarHBondContact O-N 3.09Å; L531-S535 VanDerWaalsContact O-CB 3.22Å; L531-S535 WeakPolarHBondContact O-CB 3.18Å; L531-S535 PolarHBondContact O-N 3.26Å
532	R	94.9	Very high	93.5	Very high	125 Å²	125	47.8 Å²	47.8	47%	0.472	25%	0.248	S	C	.	.	H	α-helix	trans	-68	-35.6	173.9	-70.8	164.1	-172.1	165.7	3	112.4	L528 P529 D530 S535 T536	L528-R532 WeakPolarHBondContact O-CD 3.42Å; L528-R532 VanDerWaalsContact O-CG 3.27Å; L528-R532 WeakPolarHBondContact O-CG 3.36Å; L528-R532 PolarHBondContact O-N 3.09Å; L528-R532 VanDerWaalsContact O-N 3.09Å; P529-R532 PolarHBondContact O-N 2.7Å; D530-R532 VanDerWaalsContact C-N 3.33Å; D530-R532 PolarHBondContact O-N 2.99Å; R532-S535 PolarHBondContact O-N 3.3Å; R532-T536 PolarHBondContact O-N 2.99Å; R532-T536 PolarHBondContact O-OG1 2.77Å
533	T	96.5	Very high	93.5	Very high	83 Å²	83	49 Å²	49	51%	0.509	25%	0.246	S	C	.	.	H	α-helix	trans	-66.7	-48.5	176.3	-53.5	0	0	0	0	110.1	P529 D530 S535 T536 Q537	P529-T533 PolarHBondContact O-N 3Å; P529-T533 VanDerWaalsContact O-N 3.12Å; P529-T533 PolarHBondContact O-OG1 2.91Å; D530-T533 WeakPolarHBondContact O-CB 3.32Å; D530-T533 PolarHBondContact O-N 3.12Å; T533-S535 VanDerWaalsContact C-N 3.29Å; T533-S535 PolarHBondContact O-N 3.14Å; T533-T536 WeakPolarHBondContact O-CB 3.39Å; T533-T536 PolarHBondContact O-N 2.85Å; T533-T536 VanDerWaalsContact O-N 3.14Å; T533-Q537 PolarHBondContact O-N 3.17Å
534	L	97.4	Very high	93.5	Very high	12 Å²	12	49.4 Å²	49.4	6%	0.063	25%	0.248	C	C	.	.	H	α-helix	trans	-61.1	-36.5	174	-63.4	161.3	0	0	0	112.1	I417 W451 S454 F458 D530 Q537 G538	I417-L534 VanDerWaalsContact CD1-C 3.41Å; I417-L534 HydrophobicContact CD1-CB 3.68Å; I417-L534 HydrophobicContact CG2-CB 4.18Å; I417-L534 HydrophobicContact CG2-CD1 3.99Å; W451-L534 PolarHBondContact NE1-O 2.85Å; S454-L534 VanDerWaalsContact CB-CD2 3.43Å; S454-L534 WeakPolarHBondContact O-CD2 3.33Å; F458-L534 HydrophobicContact CB-CD1 3.49Å; F458-L534 VanDerWaalsContact CB-CD1 3.49Å; F458-L534 HydrophobicContact CD1-CD1 3.97Å; F458-L534 HydrophobicContact CD2-CD1 3.6Å; F458-L534 HydrophobicContact CE2-CD1 4.3Å; F458-L534 HydrophobicContact CG-CD1 3.4Å; F458-L534 VanDerWaalsContact CG-CD1 3.4Å; D530-L534 WeakPolarHBondContact O-CG 3.46Å; D530-L534 PolarHBondContact O-N 3.34Å; L534-Q537 PolarHBondContact O-N 2.72Å; L534-G538 PolarHBondContact O-N 3.36Å
535	S	95.8	Very high	93.3	Very high	8 Å²	8	49.4 Å²	49.4	6%	0.056	25%	0.248	C	C	.	.	H	α-helix	trans	-65.7	-37.9	175.2	-178.9	0	0	0	0	112.1	L531 R532 T533 G538 R539	L531-S535 VanDerWaalsContact O-CB 3.22Å; L531-S535 WeakPolarHBondContact O-CB 3.18Å; L531-S535 PolarHBondContact O-N 3.26Å; R532-S535 PolarHBondContact O-N 3.3Å; T533-S535 VanDerWaalsContact C-N 3.29Å; T533-S535 PolarHBondContact O-N 3.14Å; S535-G538 PolarHBondContact O-N 2.88Å; S535-R539 WeakPolarHBondContact O-CG 3.33Å; S535-R539 PolarHBondContact O-N 3.24Å
536	T	94.1	Very high	93	Very high	78 Å²	78	50.3 Å²	50.3	48%	0.479	25%	0.25	S	S	.	.	H	α-helix	trans	-65.8	-44.8	174.1	-54	0	0	0	0	111.3	R532 T533 G538 R539 Q540	R532-T536 PolarHBondContact O-N 2.99Å; R532-T536 PolarHBondContact O-OG1 2.77Å; T533-T536 WeakPolarHBondContact O-CB 3.39Å; T533-T536 PolarHBondContact O-N 2.85Å; T533-T536 VanDerWaalsContact O-N 3.14Å; T536-G538 PolarHBondContact O-N 3.03Å; T536-R539 PolarHBondContact O-N 3.18Å; T536-Q540 WeakPolarHBondContact O-CG 3.36Å; T536-Q540 PolarHBondContact O-N 3.48Å
537	Q	95.4	Very high	92.7	Very high	61 Å²	61	54.4 Å²	54.4	29%	0.285	26%	0.263	S	S	.	.	H	α-helix	trans	-60.4	-42.9	173.6	-68.4	172.3	-16.4	0	0	112.1	W451 T533 L534 R539 Q540 R541	W451-Q537 HydrophobicContact CG-CB 4.46Å; T533-Q537 PolarHBondContact O-N 3.17Å; L534-Q537 PolarHBondContact O-N 2.72Å; Q537-R539 VanDerWaalsContact C-N 3.33Å; Q537-R539 PolarHBondContact O-N 3.04Å; Q537-Q540 WeakPolarHBondContact O-CB 3.24Å; Q537-Q540 PolarHBondContact O-N 3.2Å; Q537-Q540 VanDerWaalsContact O-N 3.17Å; Q537-R541 PolarHBondContact O-N 2.85Å
538	G	94.2	Very high	92.2	Very high	0 Å²	0	55 Å²	55	0%	0	27%	0.271	C	S	.	.	H	α-helix	trans	-60.7	-41.7	175.7	0	0	0	0	0	112.7	L534 S535 T536 R541 I542	L534-G538 PolarHBondContact O-N 3.36Å; S535-G538 PolarHBondContact O-N 2.88Å; T536-G538 PolarHBondContact O-N 3.03Å; G538-R541 PolarHBondContact O-N 3.1Å; G538-I542 WeakPolarHBondContact O-CB 3.28Å; G538-I542 WeakPolarHBondContact O-CD1 3.36Å; G538-I542 VanDerWaalsContact O-CG1 3.32Å; G538-I542 WeakPolarHBondContact O-CG1 3.47Å; G538-I542 PolarHBondContact O-N 3.23Å
539	R	91.6	Very high	91.6	Very high	40 Å²	40	59.7 Å²	59.7	15%	0.151	30%	0.296	C	S	.	.	H	α-helix	trans	-64.2	-40.7	173.4	-70.1	177.3	-177.4	-90.4	6.7	111.9	E409 C410 I413 S535 T536 Q537 F543 I560 F561 T564	E409-R539 PolarHBondContact O-NH2 3.09Å; C410-R539 PolarHBondContact O-NH2 2.98Å; I413-R539 HydrophobicContact CG1-CG 4.23Å; S535-R539 WeakPolarHBondContact O-CG 3.33Å; S535-R539 PolarHBondContact O-N 3.24Å; T536-R539 PolarHBondContact O-N 3.18Å; Q537-R539 VanDerWaalsContact C-N 3.33Å; Q537-R539 PolarHBondContact O-N 3.04Å; R539-F543 VanDerWaalsContact O-CB 3.31Å; R539-F543 WeakPolarHBondContact O-CB 3.17Å; R539-F543 PolarHBondContact O-N 3.17Å; R539-I560 PolarHBondContact NH1-O 2.78Å; R539-F561 HydrophobicContact CB-CE1 3.77Å; R539-F561 HydrophobicContact CB-CZ 4.05Å; R539-F561 HydrophobicContact CG-CE1 3.88Å; R539-F561 HydrophobicContact CG-CZ 3.78Å; R539-F561 WeakPolarHBondContact O-CE1 3.45Å; R539-T564 PolarHBondContact NH1-OG1 3.5Å; R539-T564 VanDerWaalsContact NH1-OG1 3.15Å
540	Q	92.2	Very high	91	Very high	124 Å²	124	59.8 Å²	59.8	58%	0.579	29%	0.292	S	S	*	.	H	α-helix	trans	-62.4	-42.9	173.1	-70.7	168.3	-16.8	0	0	112.5	T536 Q537 F543 Y544	T536-Q540 WeakPolarHBondContact O-CG 3.36Å; T536-Q540 PolarHBondContact O-N 3.48Å; Q537-Q540 WeakPolarHBondContact O-CB 3.24Å; Q537-Q540 PolarHBondContact O-N 3.2Å; Q537-Q540 VanDerWaalsContact O-N 3.17Å; Q540-F543 PolarHBondContact O-N 3.13Å; Q540-Y544 WeakPolarHBondContact O-CB 3.38Å; Q540-Y544 PolarHBondContact O-N 3.49Å
541	R	91.9	Very high	90.4	Very high	32 Å²	32	57.8 Å²	57.8	12%	0.121	28%	0.282	C	S	.	.	H	α-helix	trans	-64.4	-45.3	178.1	-179.9	60.8	-176.4	169	-0.6	112.2	E367 R446 S447 F448 W451 Q537 G538 F543 Y544 L545	E367-R541 IonicContact OE1-CZ 3.44Å; E367-R541 IonicContact OE1-NH1 3.44Å; E367-R541 PolarHBondContact OE1-NH1 3.4Å; E367-R541 IonicContact OE1-NH2 3.46Å; E367-R541 PolarHBondContact OE1-NH2 3.4Å; R446-R541 PolarHBondContact O-NH2 2.69Å; S447-R541 VanDerWaalsContact O-CZ 3.29Å; S447-R541 PolarHBondContact O-NE 3.17Å; S447-R541 PolarHBondContact O-NH2 2.62Å; F448-R541 VanDerWaalsContact O-CD 3.29Å; F448-R541 WeakPolarHBondContact O-CD 3.06Å; F448-R541 WeakPolarHBondContact O-CG 3.48Å; F448-R541 PolarHBondContact O-NE 3.2Å; W451-R541 HydrophobicContact CE3-CB 4.36Å; W451-R541 HydrophobicContact CE3-CG 4.36Å; Q537-R541 PolarHBondContact O-N 2.85Å; G538-R541 PolarHBondContact O-N 3.1Å; R541-F543 VanDerWaalsContact C-N 3.32Å; R541-F543 PolarHBondContact O-N 2.79Å; R541-Y544 PolarHBondContact O-N 2.68Å; R541-L545 HydrophobicContact CG-CD1 4.41Å; R541-L545 WeakPolarHBondContact O-CG 3.19Å; R541-L545 PolarHBondContact O-N 3.48Å
542	I	90.4	Very high	89.7	Confident	2 Å²	2	63 Å²	63	1%	0.01	32%	0.316	C	S	.	.	H	α-helix	trans	-64.9	-37.9	177.3	-68.5	161.2	0	0	0	110.9	F375 L379 I413 G538 L545 K546 V557 F561	F375-I542 HydrophobicContact CE1-CG1 3.8Å; F375-I542 HydrophobicContact CZ-CG1 3.84Å; L379-I542 HydrophobicContact CD1-CD1 3.81Å; L379-I542 HydrophobicContact CD1-CG1 4.04Å; I413-I542 HydrophobicContact CD1-CD1 3.77Å; G538-I542 WeakPolarHBondContact O-CB 3.28Å; G538-I542 WeakPolarHBondContact O-CD1 3.36Å; G538-I542 VanDerWaalsContact O-CG1 3.32Å; G538-I542 WeakPolarHBondContact O-CG1 3.47Å; G538-I542 PolarHBondContact O-N 3.23Å; I542-L545 PolarHBondContact O-N 2.8Å; I542-K546 WeakPolarHBondContact O-CB 3.41Å; I542-K546 PolarHBondContact O-N 3.18Å; I542-V557 HydrophobicContact CG2-CG1 3.57Å; I542-F561 HydrophobicContact CB-CE1 3.96Å; I542-F561 HydrophobicContact CB-CE2 4.18Å; I542-F561 HydrophobicContact CB-CZ 3.52Å; I542-F561 HydrophobicContact CD1-CE2 3.96Å; I542-F561 HydrophobicContact CD1-CZ 3.66Å; I542-F561 HydrophobicContact CG1-CZ 4.17Å; I542-F561 HydrophobicContact CG2-CD1 4.44Å; I542-F561 HydrophobicContact CG2-CD2 4.22Å; I542-F561 HydrophobicContact CG2-CE1 3.85Å; I542-F561 HydrophobicContact CG2-CE2 3.61Å; I542-F561 HydrophobicContact CG2-CZ 3.41Å; I542-F561 VanDerWaalsContact CG2-CZ 3.41Å
543	F	89	Confident	89	Confident	88 Å²	88	58.5 Å²	58.5	39%	0.386	30%	0.3	S	S	.	.	H	α-helix	trans	-65.8	-40.2	173.8	-179.8	-102.1	0	0	0	112.7	R539 Q540 R541 K546 L547	R539-F543 VanDerWaalsContact O-CB 3.31Å; R539-F543 WeakPolarHBondContact O-CB 3.17Å; R539-F543 PolarHBondContact O-N 3.17Å; Q540-F543 PolarHBondContact O-N 3.13Å; R541-F543 VanDerWaalsContact C-N 3.32Å; R541-F543 PolarHBondContact O-N 2.79Å; F543-K546 WeakPolarHBondContact O-CB 3.26Å; F543-K546 PolarHBondContact O-N 3.29Å; F543-L547 HydrophobicContact CD1-CD1 4.1Å; F543-L547 HydrophobicContact CE1-CD1 3.53Å; F543-L547 HydrophobicContact CE1-CG 4.14Å; F543-L547 HydrophobicContact CZ-CD1 3.97Å; F543-L547 HydrophobicContact CZ-CD2 4.35Å; F543-L547 HydrophobicContact CZ-CG 4.24Å; F543-L547 PolarHBondContact O-N 3.48Å
544	Y	88.9	Confident	88.5	Confident	123 Å²	123	55.8 Å²	55.8	48%	0.482	28%	0.284	S	S	.	.	H	α-helix	trans	-62.1	-44	173.6	171.7	-89.2	0	0	0	112	E367 Q540 R541 K546 L547 S548	E367-Y544 WeakPolarHBondContact OE1-CE1 3.46Å; E367-Y544 WeakPolarHBondContact OE2-CE1 3.41Å; Q540-Y544 WeakPolarHBondContact O-CB 3.38Å; Q540-Y544 PolarHBondContact O-N 3.49Å; R541-Y544 PolarHBondContact O-N 2.68Å; Y544-K546 VanDerWaalsContact C-N 3.27Å; Y544-K546 PolarHBondContact O-N 2.85Å; Y544-L547 PolarHBondContact O-N 3.44Å; Y544-S548 PolarHBondContact O-N 3.4Å; Y544-S548 VanDerWaalsContact O-N 3.11Å
545	L	87.8	Confident	87.8	Confident	0 Å²	0	60 Å²	60	0%	0	31%	0.312	C	S	.	.	H	α-helix	trans	-66.1	-28.1	175.1	-68.5	173.2	0	0	0	113	V372 F375 R541 I542 L547 S548	V372-L545 HydrophobicContact CG1-CB 4.48Å; V372-L545 HydrophobicContact CG1-CD2 4.2Å; V372-L545 HydrophobicContact CG2-CD2 3.92Å; F375-L545 HydrophobicContact CD1-CD1 3.51Å; F375-L545 HydrophobicContact CE1-CD1 3.42Å; F375-L545 VanDerWaalsContact CE1-CD1 3.42Å; F375-L545 HydrophobicContact CG-CD1 4.32Å; F375-L545 HydrophobicContact CZ-CD1 4.17Å; R541-L545 HydrophobicContact CG-CD1 4.41Å; R541-L545 WeakPolarHBondContact O-CG 3.19Å; R541-L545 PolarHBondContact O-N 3.48Å; I542-L545 PolarHBondContact O-N 2.8Å; L545-L547 VanDerWaalsContact C-N 3.35Å; L545-S548 PolarHBondContact O-OG 2.79Å; L545-S548 VanDerWaalsContact O-OG 3.12Å
546	K	84.9	Confident	86.9	Confident	60 Å²	60	60.5 Å²	60.5	26%	0.261	31%	0.314	S	S	.	.	H	α-helix	trans	-67.6	-32.3	168.4	166.1	172.1	-164.4	132.3	0	112.5	I542 F543 Y544 Q553	I542-K546 WeakPolarHBondContact O-CB 3.41Å; I542-K546 PolarHBondContact O-N 3.18Å; F543-K546 WeakPolarHBondContact O-CB 3.26Å; F543-K546 PolarHBondContact O-N 3.29Å; Y544-K546 VanDerWaalsContact C-N 3.27Å; Y544-K546 PolarHBondContact O-N 2.85Å; K546-Q553 VanDerWaalsContact CE-OE1 3.24Å
547	L	85.5	Confident	86.1	Confident	123 Å²	123	57 Å²	57	64%	0.644	29%	0.293	S	S	*	.	H	α-helix	trans	-81.2	-19.6	177.6	-69.6	-179.6	0	0	0	114	F543 Y544 L545 D549	F543-L547 HydrophobicContact CD1-CD1 4.1Å; F543-L547 HydrophobicContact CE1-CD1 3.53Å; F543-L547 HydrophobicContact CE1-CG 4.14Å; F543-L547 HydrophobicContact CZ-CD1 3.97Å; F543-L547 HydrophobicContact CZ-CD2 4.35Å; F543-L547 HydrophobicContact CZ-CG 4.24Å; F543-L547 PolarHBondContact O-N 3.48Å; Y544-L547 PolarHBondContact O-N 3.44Å; L545-L547 VanDerWaalsContact C-N 3.35Å; L547-D549 VanDerWaalsContact C-N 3.34Å
548	S	83.3	Confident	85.2	Confident	40 Å²	40	58.5 Å²	58.5	28%	0.28	30%	0.3	S	S	.	.	H	α-helix	trans	-81	-15.1	173.8	65.2	0	0	0	0	113.6	Y544 L545 L550	Y544-S548 PolarHBondContact O-N 3.4Å; Y544-S548 VanDerWaalsContact O-N 3.11Å; L545-S548 PolarHBondContact O-OG 2.79Å; L545-S548 VanDerWaalsContact O-OG 3.12Å; S548-L550 PolarHBondContact O-N 3.45Å
549	D	82.1	Confident	84.3	Confident	126 Å²	126	62.2 Å²	62.2	67%	0.674	32%	0.316	S	S	*	.			trans	51.1	26.5	173	-153.9	33.2	0	0	0	115	L547 V551	L547-D549 VanDerWaalsContact C-N 3.34Å; D549-V551 VanDerWaalsContact C-N 3.35Å
550	L	82.1	Confident	83.3	Confident	69 Å²	69	60.4 Å²	60.4	36%	0.361	31%	0.309	S	S	.	.	S	Bend	trans	-74.7	-24.5	-176.6	-64.2	178.6	0	0	0	113.3	E367 V369 V372 S548	E367-L550 HydrophobicContact CB-CD1 4.47Å; E367-L550 VanDerWaalsContact O-CD1 3.24Å; E367-L550 WeakPolarHBondContact O-CD1 3.45Å; V369-L550 HydrophobicContact CG2-CB 4.44Å; V372-L550 HydrophobicContact CG2-CD1 4.2Å; S548-L550 PolarHBondContact O-N 3.45Å
551	V	84.1	Confident	82.1	Confident	18 Å²	18	54.9 Å²	54.9	11%	0.109	28%	0.283	C	S	.	.	S	Bend	trans	-146.4	131.7	-177.8	-178.2	0	0	0	0	108.1	V369 V372 K373 Y376 D549	V369-V551 HydrophobicContact CG1-CG2 3.79Å; V369-V551 WeakPolarHBondContact O-CG2 3.25Å; V372-V551 HydrophobicContact CB-CG2 3.92Å; V372-V551 HydrophobicContact CG1-CB 4.14Å; V372-V551 HydrophobicContact CG1-CG2 3.97Å; K373-V551 HydrophobicContact CB-CG1 4.22Å; K373-V551 HydrophobicContact CB-CG2 4.15Å; K373-V551 HydrophobicContact CG-CG1 4.31Å; Y376-V551 HydrophobicContact CD2-CB 4.24Å; Y376-V551 HydrophobicContact CD2-CG1 4.03Å; Y376-V551 HydrophobicContact CE2-CB 4.26Å; Y376-V551 HydrophobicContact CE2-CG1 4.47Å; D549-V551 VanDerWaalsContact C-N 3.35Å
552	P	81.8	Confident	80.3	Confident	110 Å²	110	58.7 Å²	58.7	71%	0.714	30%	0.304	S	S	*	.	P	Polyproline II helix	trans	-60.8	139.6	174.7	26.2	-34.9	0	0	0	110.7
553	Q	80.9	Confident	78.5	Confident	31 Å²	31	64.4 Å²	64.4	15%	0.145	33%	0.334	C	S	.	.	P	Polyproline II helix	trans	-65.8	139.3	-179.3	-74.8	135	79.2	0	0	111.1	K546 V557 E558	K546-Q553 VanDerWaalsContact CE-OE1 3.24Å; Q553-V557 HydrophobicContact CB-CB 4.36Å; Q553-V557 HydrophobicContact CB-CG1 4.44Å; Q553-V557 HydrophobicContact CG-CG1 4.12Å; Q553-E558 HydrophobicContact CB-CG 3.97Å
554	P	84.3	Confident	76.7	Confident	26 Å²	26	63.4 Å²	63.4	17%	0.169	34%	0.336	C	S	.	.	P	Polyproline II helix	trans	-63.1	146	164.1	-15.7	27.9	0	0	0	109.8	Y376 I556 V557 E558	Y376-P554 HydrophobicContact CG-CG 4.11Å; P554-I556 HydrophobicContact CB-CG2 4.26Å; P554-I556 PolarHBondContact O-N 3.02Å; P554-V557 HydrophobicContact CG-CG2 4.31Å; P554-V557 WeakPolarHBondContact O-CB 3.19Å; P554-V557 PolarHBondContact O-N 2.86Å; P554-E558 PolarHBondContact O-N 3.33Å
555	P	82.6	Confident	74.4	Confident	101 Å²	101	60.8 Å²	60.8	66%	0.656	33%	0.33	S	S	*	.	H	α-helix	trans	-55.2	-23.2	177.9	-27.7	35.3	0	0	0	114.2	E558 K559	P555-E558 PolarHBondContact O-N 3.29Å; P555-K559 PolarHBondContact O-N 2.83Å
556	I	78.4	Confident	71.8	Confident	19 Å²	19	68.2 Å²	68.2	10%	0.097	37%	0.369	C	S	.	.	H	α-helix	trans	-63.8	-44.5	174.3	-132.4	150.6	0	0	0	111	T380 F383 E384 P554 E558 K559 I560	T380-I556 HydrophobicContact CG2-CD1 4.15Å; F383-I556 HydrophobicContact CB-CD1 3.57Å; F383-I556 HydrophobicContact CB-CG1 3.98Å; F383-I556 HydrophobicContact CD1-CD1 3.6Å; F383-I556 HydrophobicContact CD1-CG1 3.83Å; F383-I556 HydrophobicContact CD2-CD1 4.46Å; F383-I556 HydrophobicContact CD2-CG1 4.02Å; F383-I556 HydrophobicContact CE1-CD1 4.44Å; F383-I556 HydrophobicContact CE1-CG1 4.34Å; F383-I556 HydrophobicContact CE2-CG1 4.5Å; F383-I556 HydrophobicContact CG-CD1 3.62Å; F383-I556 HydrophobicContact CG-CG1 3.66Å; E384-I556 HydrophobicContact CG-CD1 4.49Å; P554-I556 HydrophobicContact CB-CG2 4.26Å; P554-I556 PolarHBondContact O-N 3.02Å; I556-E558 VanDerWaalsContact C-N 3.34Å; I556-K559 PolarHBondContact O-N 3.22Å; I556-I560 HydrophobicContact CG1-CD1 4.4Å; I556-I560 HydrophobicContact CG2-CD1 4.37Å; I556-I560 WeakPolarHBondContact O-CB 3.39Å; I556-I560 WeakPolarHBondContact O-CD1 3.46Å; I556-I560 WeakPolarHBondContact O-CG1 3.3Å; I556-I560 PolarHBondContact O-N 3.29Å; I556-I560 VanDerWaalsContact O-N 3.11Å
557	V	76.6	Confident	69.4	Low	4 Å²	4	77.2 Å²	77.2	2%	0.024	41%	0.408	C	S	.	.	H	α-helix	trans	-69.1	-36.4	177.1	175.7	0	0	0	0	110.2	Y376 I542 Q553 P554 F561	Y376-V557 HydrophobicContact CD1-CG2 4.04Å; Y376-V557 HydrophobicContact CE1-CG1 4.47Å; Y376-V557 HydrophobicContact CE1-CG2 4.19Å; I542-V557 HydrophobicContact CG2-CG1 3.57Å; Q553-V557 HydrophobicContact CB-CB 4.36Å; Q553-V557 HydrophobicContact CB-CG1 4.44Å; Q553-V557 HydrophobicContact CG-CG1 4.12Å; P554-V557 HydrophobicContact CG-CG2 4.31Å; P554-V557 WeakPolarHBondContact O-CB 3.19Å; P554-V557 PolarHBondContact O-N 2.86Å; V557-F561 HydrophobicContact CG1-CD2 4.07Å; V557-F561 HydrophobicContact CG1-CE2 4.38Å; V557-F561 WeakPolarHBondContact O-CB 2.99Å; V557-F561 WeakPolarHBondContact O-CD2 3.5Å; V557-F561 PolarHBondContact O-N 3.21Å
558	E	76.3	Confident	68.5	Low	93 Å²	93	74.9 Å²	74.9	44%	0.435	40%	0.396	S	S	.	.	H	α-helix	trans	-61.5	-50.8	175.1	-58.9	-170.6	132.8	0	0	111.3	Q553 P554 P555 I556 I560 F561 M562	Q553-E558 HydrophobicContact CB-CG 3.97Å; P554-E558 PolarHBondContact O-N 3.33Å; P555-E558 PolarHBondContact O-N 3.29Å; I556-E558 VanDerWaalsContact C-N 3.34Å; E558-I560 PolarHBondContact O-N 2.93Å; E558-F561 PolarHBondContact O-N 2.9Å; E558-M562 WeakPolarHBondContact O-CG 3.14Å; E558-M562 PolarHBondContact O-N 2.98Å
559	K	74.6	Confident	67.8	Low	77 Å²	77	76.7 Å²	76.7	34%	0.335	40%	0.402	S	S	.	.	H	α-helix	trans	-61.6	-45	-179.7	-158.5	-178.8	-178.1	-153.2	0	112.8	E405 E409 P555 I556 F561	E405-K559 IonicContact OE1-NZ 2.72Å; E405-K559 PolarHBondContact OE1-NZ 3.04Å; E405-K559 IonicContact OE2-NZ 2.72Å; E405-K559 PolarHBondContact OE2-NZ 3.24Å; E409-K559 WeakPolarHBondContact OE1-CD 3.13Å; E409-K559 VanDerWaalsContact OE1-CE 3.29Å; E409-K559 WeakPolarHBondContact OE1-CE 3.41Å; E409-K559 IonicContact OE1-NZ 3.17Å; E409-K559 PolarHBondContact OE1-NZ 2.9Å; E409-K559 WeakPolarHBondContact OE2-CE 3.47Å; E409-K559 IonicContact OE2-NZ 2.79Å; E409-K559 PolarHBondContact OE2-NZ 2.89Å; P555-K559 PolarHBondContact O-N 2.83Å; I556-K559 PolarHBondContact O-N 3.22Å; K559-F561 PolarHBondContact O-N 3.11Å; K559-F561 VanDerWaalsContact O-N 3.16Å
560	I	71.6	Confident	67	Low	3 Å²	3	74 Å²	74	2%	0.015	39%	0.387	C	S	.	.	H	α-helix	trans	-65.6	-19.8	-178.6	-62.2	156.1	0	0	0	112.8	F383 E409 F412 I413 R539 I556 E558 T564	F383-I560 HydrophobicContact CD2-CD1 3.39Å; F383-I560 HydrophobicContact CD2-CG1 4.16Å; F383-I560 HydrophobicContact CE2-CD1 3.47Å; F383-I560 VanDerWaalsContact CE2-CD1 3.47Å; F383-I560 HydrophobicContact CE2-CG1 3.69Å; F383-I560 HydrophobicContact CG-CD1 4.49Å; E409-I560 HydrophobicContact CG-CG1 4.41Å; F412-I560 HydrophobicContact CD1-CD1 3.62Å; F412-I560 HydrophobicContact CD1-CG1 4.46Å; F412-I560 HydrophobicContact CD1-CG2 4.33Å; F412-I560 HydrophobicContact CE1-CD1 3.97Å; F412-I560 HydrophobicContact CG-CD1 4.26Å; I413-I560 HydrophobicContact CG1-CG2 4.45Å; R539-I560 PolarHBondContact NH1-O 2.78Å; I556-I560 HydrophobicContact CG1-CD1 4.4Å; I556-I560 HydrophobicContact CG2-CD1 4.37Å; I556-I560 WeakPolarHBondContact O-CB 3.39Å; I556-I560 WeakPolarHBondContact O-CD1 3.46Å; I556-I560 WeakPolarHBondContact O-CG1 3.3Å; I556-I560 PolarHBondContact O-N 3.29Å; I556-I560 VanDerWaalsContact O-N 3.11Å; E558-I560 PolarHBondContact O-N 2.93Å; I560-T564 PolarHBondContact O-OG1 3.12Å
561	F	66.1	Low	66.1	Low	8 Å²	8	74.3 Å²	74.3	4%	0.035	39%	0.389	C	S	.	.	H	α-helix	trans	-111.8	-28.6	-174.2	-78	-103.8	0	0	0	114.6	R539 I542 V557 E558 K559 L565	R539-F561 HydrophobicContact CB-CE1 3.77Å; R539-F561 HydrophobicContact CB-CZ 4.05Å; R539-F561 HydrophobicContact CG-CE1 3.88Å; R539-F561 HydrophobicContact CG-CZ 3.78Å; R539-F561 WeakPolarHBondContact O-CE1 3.45Å; I542-F561 HydrophobicContact CB-CE1 3.96Å; I542-F561 HydrophobicContact CB-CE2 4.18Å; I542-F561 HydrophobicContact CB-CZ 3.52Å; I542-F561 HydrophobicContact CD1-CE2 3.96Å; I542-F561 HydrophobicContact CD1-CZ 3.66Å; I542-F561 HydrophobicContact CG1-CZ 4.17Å; I542-F561 HydrophobicContact CG2-CD1 4.44Å; I542-F561 HydrophobicContact CG2-CD2 4.22Å; I542-F561 HydrophobicContact CG2-CE1 3.85Å; I542-F561 HydrophobicContact CG2-CE2 3.61Å; I542-F561 HydrophobicContact CG2-CZ 3.41Å; I542-F561 VanDerWaalsContact CG2-CZ 3.41Å; V557-F561 HydrophobicContact CG1-CD2 4.07Å; V557-F561 HydrophobicContact CG1-CE2 4.38Å; V557-F561 WeakPolarHBondContact O-CB 2.99Å; V557-F561 WeakPolarHBondContact O-CD2 3.5Å; V557-F561 PolarHBondContact O-N 3.21Å; E558-F561 PolarHBondContact O-N 2.9Å; K559-F561 PolarHBondContact O-N 3.11Å; K559-F561 VanDerWaalsContact O-N 3.16Å; F561-L565 WeakPolarHBondContact O-CD1 3.48Å; F561-L565 VanDerWaalsContact O-CG 3.26Å; F561-L565 WeakPolarHBondContact O-CG 3.39Å; F561-L565 PolarHBondContact O-N 3.17Å
562	M	55.7	Low	65	Low	112 Å²	112	77.8 Å²	77.8	55%	0.552	41%	0.406	S	S	*	.	H	α-helix	trans	-64.4	-42.4	178.5	-67	-77.9	76.9	0	0	111.9	E558	E558-M562 WeakPolarHBondContact O-CG 3.14Å; E558-M562 PolarHBondContact O-N 2.98Å
563	D	51.4	Low	63.8	Low	121 Å²	121	75.7 Å²	75.7	65%	0.647	39%	0.386	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.7	-4.8	-176.6	-65.8	-40	0	0	0	114.4
564	T	51.5	Low	62.6	Low	67 Å²	67	78.9 Å²	78.9	41%	0.411	40%	0.403	S	S	.	.	T	Hydrogen-bonded Turn	trans	-109.4	8.4	176.1	-29.5	0	0	0	0	113.9	R539 I560	R539-T564 PolarHBondContact NH1-OG1 3.5Å; R539-T564 VanDerWaalsContact NH1-OG1 3.15Å; I560-T564 PolarHBondContact O-OG1 3.12Å
565	L	40.7	Very low	60.9	Low	69 Å²	69	82.9 Å²	82.9	36%	0.361	42%	0.421	S	S	.	.			trans	-104.8	28.1	176.8	-73.6	173.2	0	0	0	113.1	F561 F567	F561-L565 WeakPolarHBondContact O-CD1 3.48Å; F561-L565 VanDerWaalsContact O-CG 3.26Å; F561-L565 WeakPolarHBondContact O-CG 3.39Å; F561-L565 PolarHBondContact O-N 3.17Å; L565-F567 WeakPolarHBondContact O-CD2 3.45Å; L565-F567 PolarHBondContact O-N 2.88Å
566	L	33.8	Very low	59.1	Low	156 Å²	156	81.4 Å²	81.4	82%	0.817	40%	0.401	S	S	*	.			trans	-81	105.3	164.8	-64.9	177.3	0	0	0	108.9
567	F	33.1	Very low	57.4	Low	248 Å²	248	87.1 Å²	87.1	100%	1.088	43%	0.429	S	S	*	.			trans	-67.3	0	179.4	-66.5	-96.1	0	0	0	113.4	L565	L565-F567 WeakPolarHBondContact O-CD2 3.45Å; L565-F567 PolarHBondContact O-N 2.88Å

Retrieved 567 of 567 residues in 78 ms (Link to these results)

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