A0A3Q0KKM9_SCHMA Loading...

Lamin B receptor (ERG24)

AlphaFold DB , UniProt , Accession A0A3Q0KKM9, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 606 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	33.1	Very low	33.5	Very low	245 Å²	245	167.9 Å²	167.9	100%	1.207	84%	0.844	S	S	*	*				0	127.4	0	-84.9	-178.3	165.9	0	0	109.3
2	P	42.8	Very low	32.9	Very low	118 Å²	118	164.3 Å²	164.3	77%	0.766	84%	0.837	S	S	*	*			trans	-92.5	162.8	-179.2	37.1	-31.4	0	0	0	111.5
3	L	37.4	Very low	33	Very low	149 Å²	149	171.4 Å²	171.4	78%	0.78	85%	0.848	S	S	*	*			trans	-178	86	137.2	-96	159.3	0	0	0	109.3	K5	L3-K5 HydrophobicContact CD2-CD 4.17Å; L3-K5 HydrophobicContact CD2-CG 4.4Å
4	R	33.1	Very low	32.6	Very low	257 Å²	257	164.4 Å²	164.4	97%	0.97	84%	0.841	S	S	*	*			trans	-112.2	97.5	159.5	-137.4	179.4	-174.3	-173.7	1.9	106.2
5	K	35.7	Very low	32.3	Very low	173 Å²	173	170.1 Å²	170.1	75%	0.752	85%	0.848	S	S	*	*			trans	-109.8	116	172.4	-92.1	-178.1	175.3	178.7	0	107.4	L3	L3-K5 HydrophobicContact CD2-CD 4.17Å; L3-K5 HydrophobicContact CD2-CG 4.4Å
6	K	32.4	Very low	32.4	Very low	185 Å²	185	166.7 Å²	166.7	80%	0.804	85%	0.845	S	S	*	*				68.5	99.1	104	-83.5	-166.8	175.2	-173.6	0	113.1
7	T	28	Very low	32.2	Very low	113 Å²	113	169.4 Å²	169.4	69%	0.693	85%	0.85	S	S	*	*				67.7	111.3	94	54.6	0	0	0	0	113.7
8	N	37.6	Very low	32.4	Very low	175 Å²	175	166.5 Å²	166.5	94%	0.936	85%	0.848	S	S	*	*			trans	-131.3	116.2	144.3	-94	-14.6	0	0	0	108.2
9	E	25.2	Very low	32.4	Very low	172 Å²	172	164.7 Å²	164.7	80%	0.804	85%	0.846	S	S	*	*			trans	-87.6	178.4	172.7	-72.2	-178.5	132.5	0	0	111.4
10	V	28.9	Very low	32.1	Very low	126 Å²	126	162.3 Å²	162.3	76%	0.764	85%	0.845	S	S	*	*			trans	84.8	119.2	159.9	-144.3	0	0	0	0	113
11	V	34	Very low	32.2	Very low	134 Å²	134	166.4 Å²	166.4	81%	0.812	85%	0.849	S	S	*	*				-151.8	145.2	52.8	173	0	0	0	0	112.5
12	T	26.2	Very low	32	Very low	124 Å²	124	158.1 Å²	158.1	76%	0.761	83%	0.827	S	S	*	*			trans	-70.1	146.4	176	36.8	0	0	0	0	115.7
13	R	35.4	Very low	31.2	Very low	257 Å²	257	159.9 Å²	159.9	97%	0.97	84%	0.836	S	S	*	*			trans	-142.6	120	141.4	-107.8	-178.6	179.8	177	0.7	109
14	G	27.1	Very low	31.1	Very low	73 Å²	73	158.7 Å²	158.7	75%	0.753	84%	0.84	S	S	*	*			trans	-102.7	169.5	-168.1	0	0	0	0	0	115.7
15	R	27.7	Very low	31	Very low	250 Å²	250	156 Å²	156	94%	0.943	84%	0.835	S	S	*	*			trans	76.5	105.3	142.1	-152.6	178.1	-166.7	174.7	3.9	118.7
16	S	34.3	Very low	30.6	Very low	116 Å²	116	155.9 Å²	155.9	81%	0.811	84%	0.841	S	S	*	*				-168.8	104.2	118	45.2	0	0	0	0	111.5
17	K	28.4	Very low	30.5	Very low	212 Å²	212	158 Å²	158	92%	0.922	84%	0.844	S	S	*	*			trans	-80.9	118.5	154.8	-77.8	178.5	175.2	177.5	0	106.7
18	S	36.1	Very low	30.5	Very low	118 Å²	118	157.4 Å²	157.4	83%	0.825	84%	0.844	S	S	*	*			trans	-108.9	115.5	162.6	69.4	0	0	0	0	109.3
19	T	32.6	Very low	30.3	Very low	132 Å²	132	160.1 Å²	160.1	81%	0.81	84%	0.841	S	S	*	*			trans	-67.9	154.6	176.4	28.2	0	0	0	0	113.1
20	S	26.5	Very low	30.5	Very low	117 Å²	117	158.5 Å²	158.5	82%	0.818	84%	0.844	S	S	*	*			trans	-52.4	131.7	172.6	57.1	0	0	0	0	114.2
21	R	33.5	Very low	31.3	Very low	248 Å²	248	158.3 Å²	158.3	94%	0.936	85%	0.845	S	S	*	*			trans	-124.1	127.9	148.4	-78.5	178.1	170.6	176	-3.3	104.5
22	G	30	Very low	31.4	Very low	71 Å²	71	157.7 Å²	157.7	73%	0.732	85%	0.846	S	S	*	*			cis	125.9	104.7	39.3	0	0	0	0	0	105.2
23	T	26	Very low	31.6	Very low	155 Å²	155	157.3 Å²	157.3	95%	0.951	85%	0.849	S	S	*	*			trans	-55.7	137.9	179	25.6	0	0	0	0	112.2
24	S	34	Very low	31.2	Very low	124 Å²	124	149.8 Å²	149.8	87%	0.867	84%	0.842	S	S	*	*			trans	-136	137.2	167.7	154.2	0	0	0	0	110.1
25	K	31.2	Very low	31.5	Very low	200 Å²	200	158.4 Å²	158.4	87%	0.87	85%	0.851	S	S	*	*			trans	-77.5	151.8	-156.8	-73.2	172.5	171.8	174.5	0	114.7
26	I	26.9	Very low	31.4	Very low	171 Å²	171	151.4 Å²	151.4	88%	0.877	84%	0.841	S	S	*	*			trans	-51	127.9	159.6	-64.5	162.6	0	0	0	110.1
27	R	32	Very low	31.3	Very low	229 Å²	229	157 Å²	157	86%	0.864	84%	0.844	S	S	*	*			trans	-128.9	118.3	165.2	-152.3	177.5	-169.5	178.6	3.9	109.5
28	S	26.1	Very low	31.3	Very low	101 Å²	101	151 Å²	151	71%	0.706	83%	0.829	S	S	*	*			trans	-67.6	146.9	168	45.1	0	0	0	0	111.6
29	R	34.6	Very low	31.1	Very low	232 Å²	232	154.5 Å²	154.5	88%	0.875	83%	0.83	S	S	*	*			trans	-164.9	137.1	142.2	-107.7	172.6	-176.7	-179.9	-0.5	111.5
30	T	28.6	Very low	30.6	Very low	139 Å²	139	154.6 Å²	154.6	85%	0.853	83%	0.83	S	S	*	*			trans	-84.7	-175.5	-173.2	3.7	0	0	0	0	112.1
31	P	45.3	Very low	30.8	Very low	121 Å²	121	154.8 Å²	154.8	79%	0.786	83%	0.829	S	S	*	*			trans	-101.9	162.5	-132.2	41.5	-35.7	0	0	0	115
32	S	36.6	Very low	30.5	Very low	121 Å²	121	149.3 Å²	149.3	85%	0.846	82%	0.823	S	S	*	*			trans	-110.5	135.8	164.3	59.3	0	0	0	0	111.5
33	S	30	Very low	30.6	Very low	116 Å²	116	157.5 Å²	157.5	81%	0.811	83%	0.832	S	S	*	*			trans	-74.6	159.9	-168.2	55.7	0	0	0	0	116.8
34	A	26.9	Very low	30.5	Very low	99 Å²	99	160.1 Å²	160.1	82%	0.818	82%	0.824	S	S	*	*			trans	-14.1	131	158	0	0	0	0	0	118.8
35	R	33.9	Very low	30.4	Very low	254 Å²	254	159.1 Å²	159.1	96%	0.958	82%	0.823	S	S	*	*			trans	-123.7	125.6	147.7	-158	171.7	-165.5	166.8	3.9	110
36	S	26.5	Very low	30.4	Very low	104 Å²	104	159.1 Å²	159.1	73%	0.727	82%	0.818	S	S	*	*			trans	-85.9	168.1	-177.9	167.8	0	0	0	0	112.3
37	R	31.3	Very low	30.2	Very low	232 Å²	232	156.6 Å²	156.6	88%	0.875	81%	0.81	S	S	*	*			trans	83	139.4	169.4	-75.1	-177.2	165.9	177.6	-3.3	117
38	S	27.8	Very low	30.2	Very low	87 Å²	87	152.3 Å²	152.3	61%	0.608	81%	0.812	S	S	*	*			cis	177.7	158.8	-9.1	53.3	0	0	0	0	108.3
39	K	32	Very low	30.1	Very low	192 Å²	192	151.8 Å²	151.8	84%	0.835	81%	0.814	S	S	*	*			trans	84	97.4	158.3	-61.1	-176.6	-178.9	-177.9	0	118.8
40	T	23.8	Very low	29.8	Very low	134 Å²	134	145.5 Å²	145.5	82%	0.822	81%	0.805	S	S	*	*			trans	-47.7	146.7	135.6	11.3	0	0	0	0	111.5
41	P	30.6	Very low	29.9	Very low	121 Å²	121	146.7 Å²	146.7	79%	0.786	80%	0.801	S	S	*	*				-132.4	146.3	108.7	36.2	-26.8	0	0	0	113.6
42	T	27	Very low	29.1	Very low	132 Å²	132	146 Å²	146	81%	0.81	80%	0.8	S	S	*	*			trans	-53.6	132.3	162.8	43.6	0	0	0	0	113.3
43	R	31.9	Very low	28.9	Very low	243 Å²	243	150.5 Å²	150.5	92%	0.917	80%	0.804	S	S	*	*			trans	-152.4	114.4	140.2	-162.8	170.2	174.6	-178.3	-1.6	111.3
44	R	23.6	Very low	28.9	Very low	211 Å²	211	151.1 Å²	151.1	80%	0.796	80%	0.802	S	S	*	*			trans	-55.6	134.6	163	-118.2	175.7	-179.3	-177.3	2.5	109.9
45	A	32.4	Very low	28.8	Very low	102 Å²	102	155.8 Å²	155.8	84%	0.843	80%	0.799	S	S	*	*			trans	-136.8	111.9	149.7	0	0	0	0	0	108.2
46	R	30.4	Very low	28.7	Very low	201 Å²	201	155.4 Å²	155.4	76%	0.758	80%	0.798	S	S	*	*			trans	-68.6	140.9	172.2	-85	173.6	163	166.7	-7.8	109.6
47	T	23.9	Very low	28.7	Very low	117 Å²	117	160 Å²	160	72%	0.718	80%	0.799	S	S	*	*			trans	14.4	126.5	148	50	0	0	0	0	119
48	P	31	Very low	28.7	Very low	139 Å²	139	160.5 Å²	160.5	90%	0.903	80%	0.801	S	S	*	*			trans	-88.9	110.2	142.9	30	-20	0	0	0	109.3
49	A	25	Very low	28.6	Very low	90 Å²	90	161.4 Å²	161.4	74%	0.744	81%	0.807	S	S	*	*			trans	-104.6	111.5	152.4	0	0	0	0	0	106.3
50	S	28.3	Very low	28.5	Very low	100 Å²	100	158.2 Å²	158.2	70%	0.699	81%	0.806	S	S	*	*			trans	173.9	147.2	143.6	60.4	0	0	0	0	111.7
51	E	29.6	Very low	28.7	Very low	164 Å²	164	157.4 Å²	157.4	77%	0.766	81%	0.806	S	S	*	*			trans	82.7	93.8	149.1	-73.9	162.9	-155.4	0	0	121	K53	E51-K53 PolarHBondContact O-N 3.09Å
52	S	28.5	Very low	28.7	Very low	108 Å²	108	156.7 Å²	156.7	76%	0.755	80%	0.801	S	S	*	*				15.9	101.3	116.8	52	0	0	0	0	117
53	K	33.5	Very low	28.6	Very low	215 Å²	215	157.7 Å²	157.7	94%	0.935	80%	0.802	S	S	*	*			trans	-110.2	109	155.2	-100	179.6	179.3	174.6	0	111.1	E51	E51-K53 PolarHBondContact O-N 3.09Å
54	V	28.3	Very low	28.3	Very low	128 Å²	128	151.8 Å²	151.8	78%	0.776	80%	0.795	S	S	*	*			trans	-68.5	143.7	171.1	162.1	0	0	0	0	110.9
55	R	26	Very low	28.4	Very low	198 Å²	198	146.7 Å²	146.7	75%	0.747	79%	0.792	S	S	*	*			trans	72.1	112.1	147.9	-163.1	179.2	-158.6	-147	5.7	119.9
56	R	31.3	Very low	28.3	Very low	246 Å²	246	151 Å²	151	93%	0.928	79%	0.794	S	S	*	*			trans	-134.8	101.1	133.2	-90.6	-174.2	175.4	175.3	-1.7	109.6
57	R	26.5	Very low	28	Very low	201 Å²	201	150.2 Å²	150.2	76%	0.758	80%	0.799	S	S	*	*			trans	-70.9	134.9	156.8	-80.5	-178	173.9	-175.1	-3.7	107.5
58	R	31	Very low	28	Very low	242 Å²	242	149.2 Å²	149.2	91%	0.913	80%	0.797	S	S	*	*			trans	-124.4	108.9	154	-90.5	-173.6	174.3	-178.5	-2.6	106.8
59	S	25.5	Very low	27.8	Very low	106 Å²	106	148.5 Å²	148.5	74%	0.741	79%	0.79	S	S	*	*	P	Polyproline II helix	trans	-85.7	141.2	165.2	-29.9	0	0	0	0	108.2
60	P	31	Very low	27.6	Very low	124 Å²	124	153.3 Å²	153.3	81%	0.805	79%	0.794	S	S	*	*	P	Polyproline II helix	trans	-101.7	143.5	145.2	-6.2	25.6	0	0	0	110.4
61	S	27.7	Very low	27.3	Very low	118 Å²	118	154 Å²	154	83%	0.825	80%	0.798	S	S	*	*	P	Polyproline II helix	trans	-75.3	173.1	-174.9	20	0	0	0	0	114.6
62	P	30.9	Very low	27	Very low	106 Å²	106	152.2 Å²	152.2	69%	0.688	80%	0.798	S	S	*	*			trans	-111.4	168.7	-143.6	41.9	-34.6	0	0	0	116.6
63	D	24.4	Very low	26.7	Very low	153 Å²	153	153 Å²	153	82%	0.818	80%	0.799	S	S	*	*			trans	41	144.4	142.6	-60.2	-19.1	0	0	0	121.8
64	P	25.4	Very low	26.1	Very low	119 Å²	119	152 Å²	152	77%	0.773	79%	0.794	S	S	*	*				-141.8	159.9	94.2	35.1	-18.5	0	0	0	116.4
65	S	25.9	Very low	25.9	Very low	104 Å²	104	152.6 Å²	152.6	73%	0.727	80%	0.799	S	S	*	*			trans	68.2	109.7	154.8	64.2	0	0	0	0	119.9
66	E	29.7	Very low	25.6	Very low	192 Å²	192	149 Å²	149	90%	0.897	80%	0.799	S	S	*	*				-169.7	128.8	94.4	-99.6	176.4	173.9	0	0	112.2
67	E	24.4	Very low	25.3	Very low	185 Å²	185	146.4 Å²	146.4	86%	0.864	80%	0.797	S	S	*	*			trans	-55.6	171.6	162.7	-65.2	172.6	151.2	0	0	111.3
68	S	23.2	Very low	25	Very low	95 Å²	95	147.3 Å²	147.3	66%	0.664	80%	0.802	S	S	*	*			cis	-177.7	175	-14.3	53.4	0	0	0	0	105.4
69	V	27.1	Very low	24.6	Very low	125 Å²	125	141.5 Å²	141.5	76%	0.758	79%	0.794	S	S	*	*			trans	82.1	103.3	165.6	-166.4	0	0	0	0	115.8
70	K	21.9	Very low	24.6	Very low	190 Å²	190	144.4 Å²	144.4	83%	0.826	80%	0.796	S	S	*	*				69.6	127.2	72.8	-78.7	-173.7	178.2	177.4	0	116.7
71	S	21.9	Very low	24.2	Very low	114 Å²	114	144.2 Å²	144.2	80%	0.797	79%	0.792	S	S	*	*			trans	75	153.2	147.6	87.6	0	0	0	0	116.2
72	V	22.9	Very low	24.1	Very low	127 Å²	127	145.2 Å²	145.2	77%	0.77	79%	0.793	S	S	*	*			cis	-174.1	147.3	-1.3	120	0	0	0	0	106.7
73	T	22.3	Very low	23.8	Very low	124 Å²	124	150 Å²	150	76%	0.761	80%	0.804	S	S	*	*			trans	77.3	135.8	149.1	-54.1	0	0	0	0	123.4
74	K	20.3	Very low	23.8	Very low	194 Å²	194	145.8 Å²	145.8	84%	0.843	80%	0.796	S	S	*	*			trans	-63.5	138.2	173.7	-59.3	163.8	173.3	175.7	0	113.1
75	T	24.2	Very low	23.8	Very low	142 Å²	142	151.5 Å²	151.5	87%	0.871	80%	0.802	S	S	*	*			trans	-146.4	132.1	143.7	-44.1	0	0	0	0	110.4
76	T	20.1	Very low	23.8	Very low	122 Å²	122	152.7 Å²	152.7	75%	0.748	81%	0.807	S	S	*	*			trans	-69.1	128.4	174.7	-34.7	0	0	0	0	110.7
77	Q	25.9	Very low	23.7	Very low	191 Å²	191	147.6 Å²	147.6	89%	0.893	80%	0.798	S	S	*	*			trans	-161.8	131.4	150.1	-111.4	170.2	9.1	0	0	110.2
78	Y	19.2	Very low	23.7	Very low	221 Å²	221	147.9 Å²	147.9	87%	0.867	80%	0.799	S	S	*	*			trans	-59.7	145.6	169.4	-79.7	-107.6	0	0	0	110.1
79	T	23.1	Very low	24	Very low	119 Å²	119	149.1 Å²	149.1	73%	0.73	80%	0.803	S	S	*	*				164.5	132.1	120.6	-50.9	0	0	0	0	109.5
80	E	24.8	Very low	23.9	Very low	168 Å²	168	151 Å²	151	79%	0.785	81%	0.809	S	S	*	*			trans	65.6	105.7	156.2	-78.1	169.8	-179.1	0	0	122.9
81	T	22.1	Very low	24.4	Very low	119 Å²	119	148 Å²	148	73%	0.73	81%	0.806	S	S	*	*				34.1	98.5	126.9	49.6	0	0	0	0	119.5
82	V	27.2	Very low	24.8	Very low	140 Å²	140	150 Å²	150	85%	0.848	81%	0.807	S	S	*	*			trans	-129.7	103.2	144.1	178.9	0	0	0	0	108.7	G84	V82-G84 PolarHBondContact O-N 3.31Å
83	F	23.8	Very low	25	Very low	207 Å²	207	153.5 Å²	153.5	91%	0.908	81%	0.812	S	S	*	*			trans	-64.7	118.6	162	-95.1	-95.2	0	0	0	108.8
84	G	25.3	Very low	25.5	Very low	63 Å²	63	153 Å²	153	65%	0.649	81%	0.814	S	S	*	*			trans	157.2	74.6	166.8	0	0	0	0	0	116.4	V82	V82-G84 PolarHBondContact O-N 3.31Å
85	R	24.6	Very low	26.1	Very low	240 Å²	240	151 Å²	151	91%	0.906	81%	0.811	S	S	*	*			trans	172.2	118.4	133.7	-96.8	169.6	-164.9	-170.4	5.9	108.9	A87	R85-A87 PolarHBondContact O-N 2.82Å
86	P	26.4	Very low	26.6	Very low	128 Å²	128	149.6 Å²	149.6	83%	0.831	81%	0.805	S	S	*	*			trans	-65.7	124.6	170.1	26.6	-29	0	0	0	108.3	Q88	P86-Q88 PolarHBondContact O-N 2.91Å
87	A	27.4	Very low	27.5	Very low	86 Å²	86	151.4 Å²	151.4	71%	0.711	81%	0.809	S	S	*	*			trans	-49.5	126.1	173.1	0	0	0	0	0	109.6	R85 T89	R85-A87 PolarHBondContact O-N 2.82Å; A87-T89 PolarHBondContact O-N 3.4Å
88	Q	25.1	Very low	28.2	Very low	191 Å²	191	146.3 Å²	146.3	89%	0.893	79%	0.788	S	S	*	*			trans	-61.6	90.2	163.2	-80.4	173.5	-20.1	0	0	107.1	P86 D90	P86-Q88 PolarHBondContact O-N 2.91Å; Q88-D90 PolarHBondContact O-N 3.22Å
89	T	28	Very low	29.1	Very low	121 Å²	121	145.5 Å²	145.5	74%	0.742	79%	0.792	S	S	*	*			trans	-64.5	115.2	161.8	-5	0	0	0	0	105.8	A87 V91	A87-T89 PolarHBondContact O-N 3.4Å; T89-V91 PolarHBondContact O-N 3.4Å
90	D	26.5	Very low	30.3	Very low	163 Å²	163	143.6 Å²	143.6	87%	0.872	80%	0.795	S	S	*	*			trans	-54.2	85	166.8	-81.2	-46.7	0	0	0	109.2	Q88 L92	Q88-D90 PolarHBondContact O-N 3.22Å; D90-L92 PolarHBondContact O-N 3.43Å
91	V	32.2	Very low	31.8	Very low	128 Å²	128	139.5 Å²	139.5	78%	0.776	78%	0.778	S	S	*	*			trans	-67.4	104.6	169.1	175.3	0	0	0	0	105.4	T89 K93	T89-V91 PolarHBondContact O-N 3.4Å; V91-K93 PolarHBondContact O-N 2.83Å
92	L	29.4	Very low	33.6	Very low	157 Å²	157	137.6 Å²	137.6	82%	0.822	77%	0.77	S	S	*	*			trans	-2.2	107	160.1	-112.3	85.3	0	0	0	112	D90 S94	D90-L92 PolarHBondContact O-N 3.43Å; L92-S94 PolarHBondContact O-N 3.44Å
93	K	28.3	Very low	35.4	Very low	200 Å²	200	141.2 Å²	141.2	87%	0.87	77%	0.768	S	S	*	*			trans	-44	107.7	166.2	-79.7	174.9	178	170	0	108	V91 L95	V91-K93 PolarHBondContact O-N 2.83Å; K93-L95 PolarHBondContact O-N 3.21Å
94	S	32.3	Very low	37.2	Very low	113 Å²	113	138.4 Å²	138.4	79%	0.79	76%	0.756	S	S	*	*			trans	-58.2	111.6	174.7	44.5	0	0	0	0	107.7	L92	L92-S94 PolarHBondContact O-N 3.44Å
95	L	32.2	Very low	39.4	Very low	152 Å²	152	137 Å²	137	80%	0.796	74%	0.736	S	S	*	*			trans	-55.2	135.1	169.4	-99.5	94.3	0	0	0	108.1	K93 L97	K93-L95 PolarHBondContact O-N 3.21Å; L95-L97 VanDerWaalsContact C-N 3.33Å; L95-L97 PolarHBondContact O-N 3.36Å
96	P	35.6	Very low	41.5	Very low	113 Å²	113	129 Å²	129	73%	0.734	71%	0.709	S	S	*	*			trans	-72.5	89.6	-173.9	28.4	-32.6	0	0	0	110	N98	P96-N98 PolarHBondContact O-N 2.97Å
97	L	38.5	Very low	43.6	Very low	160 Å²	160	130.6 Å²	130.6	84%	0.838	70%	0.703	S	S	*	*			trans	-82.2	61.3	178.6	-141	139.5	0	0	0	109.5	L95	L95-L97 VanDerWaalsContact C-N 3.33Å; L95-L97 PolarHBondContact O-N 3.36Å
98	N	39.9	Very low	45.7	Very low	84 Å²	84	130.1 Å²	130.1	45%	0.449	69%	0.688	S	S	.	*			trans	-146.6	23.9	-177.8	-91.8	-32.3	0	0	0	114.7	P96 G100 L101	P96-N98 PolarHBondContact O-N 2.97Å; N98-G100 PolarHBondContact O-N 2.97Å; N98-L101 VanDerWaalsContact OD1-CD1 3.31Å; N98-L101 WeakPolarHBondContact OD1-CD1 3.47Å
99	H	38.4	Very low	48	Very low	204 Å²	204	124 Å²	124	94%	0.944	66%	0.663	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.3	95.9	164.6	-94.8	-69.4	0	0	0	109.8
100	G	48.7	Very low	50.2	Low	78 Å²	78	125.4 Å²	125.4	80%	0.804	66%	0.659	S	S	*	*	T	Hydrogen-bonded Turn	trans	142.1	-13.4	169.2	0	0	0	0	0	115.9	N98	N98-G100 PolarHBondContact O-N 2.97Å
101	L	56.6	Low	52.3	Low	83 Å²	83	124.3 Å²	124.3	44%	0.435	65%	0.646	S	S	.	*			trans	-88.1	130.3	176.9	-76.2	152.1	0	0	0	110.6	N98 Q106	N98-L101 VanDerWaalsContact OD1-CD1 3.31Å; N98-L101 WeakPolarHBondContact OD1-CD1 3.47Å; L101-Q106 HydrophobicContact CB-CG 4.05Å
102	S	60.2	Low	54	Low	79 Å²	79	123.4 Å²	123.4	55%	0.552	64%	0.636	S	S	*	*			trans	-54.2	148.3	168	162.3	0	0	0	0	110.8	F104 S105 Q106	S102-F104 PolarHBondContact O-N 3.18Å; S102-F104 PolarHBondContact OG-N 3.19Å; S102-S105 WeakPolarHBondContact CA-OG 3.43Å; S102-S105 PolarHBondContact N-OG 3.47Å; S102-S105 VanDerWaalsContact N-OG 3.07Å; S102-S105 PolarHBondContact O-N 3.34Å; S102-S105 PolarHBondContact O-OG 3.31Å; S102-Q106 PolarHBondContact O-N 2.93Å; S102-Q106 VanDerWaalsContact O-N 3.08Å
103	R	64.3	Low	56	Low	215 Å²	215	122.5 Å²	122.5	81%	0.811	63%	0.628	S	S	*	*	H	α-helix	trans	-51.4	-31.6	177.3	-79.6	-172.7	179.7	-175.8	0.6	112.8	K107	R103-K107 PolarHBondContact O-N 2.97Å
104	F	61.8	Low	57.8	Low	149 Å²	149	117.8 Å²	117.8	65%	0.654	62%	0.616	S	S	*	*	H	α-helix	trans	-68.6	-46.2	177.7	-175	-106.3	0	0	0	112	S102 Q106 K107 I108	S102-F104 PolarHBondContact O-N 3.18Å; S102-F104 PolarHBondContact OG-N 3.19Å; F104-Q106 VanDerWaalsContact C-N 3.33Å; F104-Q106 PolarHBondContact O-N 3.1Å; F104-K107 WeakPolarHBondContact O-CB 3.39Å; F104-K107 PolarHBondContact O-N 2.89Å; F104-I108 HydrophobicContact CD1-CD1 3.82Å; F104-I108 HydrophobicContact CE1-CD1 3.45Å; F104-I108 VanDerWaalsContact CE1-CD1 3.45Å; F104-I108 HydrophobicContact CE1-CG1 4.39Å; F104-I108 HydrophobicContact CZ-CD1 4.02Å; F104-I108 PolarHBondContact O-N 3.4Å; F104-I108 VanDerWaalsContact O-N 3.12Å
105	S	71.9	Confident	58.4	Low	33 Å²	33	118 Å²	118	23%	0.231	61%	0.608	C	S	.	*	H	α-helix	trans	-63.9	-35.7	175.7	28.5	0	0	0	0	112.8	S102 K107 I108 V109	S102-S105 WeakPolarHBondContact CA-OG 3.43Å; S102-S105 PolarHBondContact N-OG 3.47Å; S102-S105 VanDerWaalsContact N-OG 3.07Å; S102-S105 PolarHBondContact O-N 3.34Å; S102-S105 PolarHBondContact O-OG 3.31Å; S105-K107 VanDerWaalsContact C-N 3.34Å; S105-K107 PolarHBondContact O-N 3.15Å; S105-I108 PolarHBondContact O-N 3.41Å; S105-V109 WeakPolarHBondContact O-CG2 3.34Å; S105-V109 PolarHBondContact O-N 2.63Å
106	Q	68.4	Low	58.7	Low	73 Å²	73	118.6 Å²	118.6	34%	0.341	60%	0.604	S	S	.	*	H	α-helix	trans	-62.9	-39.7	173.1	-69.3	-179.5	-9.7	0	0	112	L101 S102 F104 V109 K110	L101-Q106 HydrophobicContact CB-CG 4.05Å; S102-Q106 PolarHBondContact O-N 2.93Å; S102-Q106 VanDerWaalsContact O-N 3.08Å; F104-Q106 VanDerWaalsContact C-N 3.33Å; F104-Q106 PolarHBondContact O-N 3.1Å; Q106-V109 PolarHBondContact O-N 3.49Å; Q106-K110 WeakPolarHBondContact O-CB 3.05Å; Q106-K110 PolarHBondContact O-N 3.44Å
107	K	69.6	Low	58.7	Low	160 Å²	160	118.2 Å²	118.2	70%	0.696	60%	0.602	S	S	*	*	H	α-helix	trans	-64.2	-38.4	175.3	-76.4	-175.5	176.9	-174.4	0	112.4	R103 F104 S105 K111	R103-K107 PolarHBondContact O-N 2.97Å; F104-K107 WeakPolarHBondContact O-CB 3.39Å; F104-K107 PolarHBondContact O-N 2.89Å; S105-K107 VanDerWaalsContact C-N 3.34Å; S105-K107 PolarHBondContact O-N 3.15Å; K107-K111 WeakPolarHBondContact O-CB 3.36Å; K107-K111 PolarHBondContact O-N 3.17Å
108	I	72	Confident	58.5	Low	77 Å²	77	116.7 Å²	116.7	40%	0.395	60%	0.599	S	S	.	*	H	α-helix	trans	-65	-47.3	177.1	-67.9	170.2	0	0	0	110.7	F104 S105 K110 K111 I112	F104-I108 HydrophobicContact CD1-CD1 3.82Å; F104-I108 HydrophobicContact CE1-CD1 3.45Å; F104-I108 VanDerWaalsContact CE1-CD1 3.45Å; F104-I108 HydrophobicContact CE1-CG1 4.39Å; F104-I108 HydrophobicContact CZ-CD1 4.02Å; F104-I108 PolarHBondContact O-N 3.4Å; F104-I108 VanDerWaalsContact O-N 3.12Å; S105-I108 PolarHBondContact O-N 3.41Å; I108-K110 VanDerWaalsContact C-N 3.33Å; I108-K110 PolarHBondContact O-N 2.84Å; I108-K111 PolarHBondContact O-N 2.85Å; I108-I112 HydrophobicContact CG2-CD1 3.78Å; I108-I112 HydrophobicContact CG2-CG1 4.46Å; I108-I112 VanDerWaalsContact O-CG1 3.31Å; I108-I112 WeakPolarHBondContact O-CG1 3.5Å; I108-I112 PolarHBondContact O-N 3.36Å
109	V	73.5	Confident	58.1	Low	63 Å²	63	120.3 Å²	120.3	38%	0.382	61%	0.613	S	S	.	*	H	α-helix	trans	-60.5	-45.9	178.4	174.4	0	0	0	0	110.6	S105 Q106 K111 I112 E113	S105-V109 WeakPolarHBondContact O-CG2 3.34Å; S105-V109 PolarHBondContact O-N 2.63Å; Q106-V109 PolarHBondContact O-N 3.49Å; V109-K111 VanDerWaalsContact C-N 3.29Å; V109-K111 PolarHBondContact O-N 3.44Å; V109-I112 PolarHBondContact O-N 3.28Å; V109-E113 PolarHBondContact O-N 2.87Å
110	K	73.4	Confident	57.7	Low	149 Å²	149	117.2 Å²	117.2	65%	0.648	60%	0.602	S	S	*	*	H	α-helix	trans	-61.5	-38.3	178.1	-157.8	175	-173	-179.6	0	112.1	Q106 I108 E113 T114	Q106-K110 WeakPolarHBondContact O-CB 3.05Å; Q106-K110 PolarHBondContact O-N 3.44Å; I108-K110 VanDerWaalsContact C-N 3.33Å; I108-K110 PolarHBondContact O-N 2.84Å; K110-E113 PolarHBondContact O-N 3.13Å; K110-T114 PolarHBondContact O-N 3.36Å; K110-T114 PolarHBondContact O-OG1 2.79Å
111	K	70.7	Confident	56.7	Low	140 Å²	140	123.5 Å²	123.5	61%	0.609	60%	0.603	S	S	*	*	H	α-helix	trans	-67.2	-38.1	176.6	-168	170.4	-176.2	178	0	112.5	K107 I108 V109 E113 T114 D115	K107-K111 WeakPolarHBondContact O-CB 3.36Å; K107-K111 PolarHBondContact O-N 3.17Å; I108-K111 PolarHBondContact O-N 2.85Å; V109-K111 VanDerWaalsContact C-N 3.29Å; V109-K111 PolarHBondContact O-N 3.44Å; K111-E113 VanDerWaalsContact C-N 3.32Å; K111-T114 WeakPolarHBondContact CA-OG1 3.29Å; K111-T114 PolarHBondContact O-N 3.16Å; K111-T114 PolarHBondContact O-OG1 2.95Å; K111-D115 WeakPolarHBondContact O-CB 3.35Å; K111-D115 PolarHBondContact O-N 3.34Å
112	I	67.7	Low	55.2	Low	110 Å²	110	128.4 Å²	128.4	56%	0.564	62%	0.624	S	S	*	*	H	α-helix	trans	-66.9	-34.8	175.5	-67.5	166	0	0	0	111.3	I108 V109	I108-I112 HydrophobicContact CG2-CD1 3.78Å; I108-I112 HydrophobicContact CG2-CG1 4.46Å; I108-I112 VanDerWaalsContact O-CG1 3.31Å; I108-I112 WeakPolarHBondContact O-CG1 3.5Å; I108-I112 PolarHBondContact O-N 3.36Å; V109-I112 PolarHBondContact O-N 3.28Å
113	E	71.8	Confident	53.7	Low	138 Å²	138	133.4 Å²	133.4	65%	0.645	64%	0.639	S	S	*	*	H	α-helix	trans	-71.2	-37.5	175.6	-76.5	176.4	168.7	0	0	112.5	V109 K110 K111	V109-E113 PolarHBondContact O-N 2.87Å; K110-E113 PolarHBondContact O-N 3.13Å; K111-E113 VanDerWaalsContact C-N 3.32Å
114	T	67.3	Low	52	Low	100 Å²	100	126.3 Å²	126.3	61%	0.613	63%	0.632	S	S	*	*	H	α-helix	trans	-73.5	-30.9	176.7	50.9	0	0	0	0	113.6	K110 K111 K116	K110-T114 PolarHBondContact O-N 3.36Å; K110-T114 PolarHBondContact O-OG1 2.79Å; K111-T114 WeakPolarHBondContact CA-OG1 3.29Å; K111-T114 PolarHBondContact O-N 3.16Å; K111-T114 PolarHBondContact O-OG1 2.95Å; T114-K116 PolarHBondContact O-N 2.96Å
115	D	43.5	Very low	50.2	Low	117 Å²	117	127 Å²	127	63%	0.626	64%	0.642	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.8	15.1	-179	-82.3	-9.2	0	0	0	113.7	K111 P117	K111-D115 WeakPolarHBondContact O-CB 3.35Å; K111-D115 PolarHBondContact O-N 3.34Å; D115-P117 WeakPolarHBondContact O-CD 3.25Å
116	K	38.6	Very low	48.1	Very low	165 Å²	165	131.6 Å²	131.6	72%	0.717	67%	0.668	S	S	*	*	S	Bend	trans	-82.3	108.2	165.9	-90.1	-173.9	176.6	179.2	0	109.7	T114 T118	T114-K116 PolarHBondContact O-N 2.96Å; K116-T118 PolarHBondContact O-N 3.03Å
117	P	36.9	Very low	46	Very low	106 Å²	106	136.2 Å²	136.2	69%	0.688	69%	0.689	S	S	*	*			trans	-65.1	118.4	173.9	25.1	-32.8	0	0	0	110.2	D115 H119	D115-P117 WeakPolarHBondContact O-CD 3.25Å; P117-H119 VanDerWaalsContact C-N 3.26Å; P117-H119 PolarHBondContact O-N 2.87Å
118	T	32.8	Very low	44	Very low	128 Å²	128	138.1 Å²	138.1	79%	0.785	70%	0.698	S	S	*	*			trans	-70.4	79.5	167	44.4	0	0	0	0	109.5	K116 I120	K116-T118 PolarHBondContact O-N 3.03Å; T118-I120 VanDerWaalsContact C-N 3.29Å; T118-I120 PolarHBondContact O-N 2.94Å; T118-I120 VanDerWaalsContact O-N 3.15Å
119	H	31.8	Very low	41.8	Very low	160 Å²	160	139.8 Å²	139.8	74%	0.741	72%	0.716	S	S	*	*			trans	-79.3	86.1	160.6	-90	-78.6	0	0	0	108.4	P117 Y121	P117-H119 VanDerWaalsContact C-N 3.26Å; P117-H119 PolarHBondContact O-N 2.87Å; H119-Y121 PolarHBondContact O-N 3.22Å
120	I	29.9	Very low	39.5	Very low	139 Å²	139	145.9 Å²	145.9	71%	0.713	74%	0.74	S	S	*	*			trans	-76.2	108.5	164	-63.6	172.7	0	0	0	106	T118 Q122	T118-I120 VanDerWaalsContact C-N 3.29Å; T118-I120 PolarHBondContact O-N 2.94Å; T118-I120 VanDerWaalsContact O-N 3.15Å; I120-Q122 PolarHBondContact O-N 2.66Å
121	Y	28.7	Very low	37.5	Very low	209 Å²	209	143.2 Å²	143.2	82%	0.82	75%	0.747	S	S	*	*			trans	-68.9	108.4	165.3	-87.2	-94.8	0	0	0	107.9	H119 E123	H119-Y121 PolarHBondContact O-N 3.22Å; Y121-E123 PolarHBondContact O-N 2.92Å
122	Q	23.8	Very low	35.6	Very low	186 Å²	186	143.2 Å²	143.2	87%	0.869	76%	0.759	S	S	*	*			trans	-77.1	96.6	158.2	-85.9	171.4	-53.1	0	0	107.2	I120 G124	I120-Q122 PolarHBondContact O-N 2.66Å; Q122-G124 PolarHBondContact O-N 3.35Å
123	E	29.6	Very low	33.6	Very low	185 Å²	185	147.2 Å²	147.2	86%	0.864	78%	0.775	S	S	*	*			trans	-67.1	119.6	162	-85.5	-179.5	159.1	0	0	108.3	Y121	Y121-E123 PolarHBondContact O-N 2.92Å
124	G	28	Very low	31.6	Very low	66 Å²	66	148.1 Å²	148.1	68%	0.68	78%	0.783	S	S	*	*			trans	-61.3	134	179.3	0	0	0	0	0	111.6	Q122 V126	Q122-G124 PolarHBondContact O-N 3.35Å; G124-V126 PolarHBondContact O-N 3.42Å
125	L	24.6	Very low	30	Very low	163 Å²	163	152.7 Å²	152.7	85%	0.853	80%	0.797	S	S	*	*			trans	-54.9	102.9	166.9	-76.1	117	0	0	0	110.1
126	V	28.4	Very low	29.5	Very low	129 Å²	129	156.5 Å²	156.5	78%	0.782	81%	0.808	S	S	*	*			trans	-96.7	100.4	160.7	178.7	0	0	0	0	107.1	G124 K128	G124-V126 PolarHBondContact O-N 3.42Å; V126-K128 PolarHBondContact O-N 3.37Å
127	H	23.3	Very low	29.3	Very low	170 Å²	170	153.8 Å²	153.8	79%	0.787	81%	0.808	S	S	*	*			trans	-55.1	118	163.5	-86.5	-83.5	0	0	0	109.3
128	K	28.1	Very low	29.6	Very low	201 Å²	201	155.8 Å²	155.8	87%	0.874	82%	0.818	S	S	*	*			trans	-135.3	127.1	152.6	-102.6	-177	179.9	-179.9	0	110.8	V126	V126-K128 PolarHBondContact O-N 3.37Å
129	S	26.2	Very low	30.1	Very low	112 Å²	112	154.2 Å²	154.2	78%	0.783	81%	0.808	S	S	*	*			trans	-43.4	148.3	-173.3	-164.7	0	0	0	0	116.4
130	E	24.3	Very low	30.8	Very low	190 Å²	190	152.7 Å²	152.7	89%	0.888	81%	0.805	S	S	*	*			trans	-46.6	127.6	163.9	-63.8	167.4	156.7	0	0	111.9
131	A	32.3	Very low	31.7	Very low	94 Å²	94	149.9 Å²	149.9	78%	0.777	79%	0.794	S	S	*	*			trans	-147.4	101.5	159.2	0	0	0	0	0	108.6
132	T	29.8	Very low	32.8	Very low	140 Å²	140	143.5 Å²	143.5	86%	0.859	78%	0.778	S	S	*	*			trans	30.1	118.9	149.3	-36.1	0	0	0	0	119.2	L134	T132-L134 PolarHBondContact O-N 3Å; T132-L134 VanDerWaalsContact O-N 3.16Å
133	Q	25.7	Very low	33.9	Very low	194 Å²	194	140.9 Å²	140.9	91%	0.907	77%	0.769	S	S	*	*			trans	-57.4	107.7	171.9	-62.4	176.7	-2.5	0	0	111.3
134	L	30	Very low	34.9	Very low	157 Å²	157	136.3 Å²	136.3	82%	0.822	75%	0.75	S	S	*	*			trans	-117.4	123.4	162.4	-161.9	71.1	0	0	0	108.4	T132 K136	T132-L134 PolarHBondContact O-N 3Å; T132-L134 VanDerWaalsContact O-N 3.16Å; L134-K136 PolarHBondContact O-N 3.35Å; L134-K136 VanDerWaalsContact O-N 3.11Å
135	H	32.6	Very low	36.3	Very low	196 Å²	196	136.7 Å²	136.7	91%	0.907	74%	0.74	S	S	*	*			trans	-42.5	110.4	-176.1	-76.6	-88.1	0	0	0	112.9
136	K	34.1	Very low	38.1	Very low	196 Å²	196	133.6 Å²	133.6	85%	0.852	72%	0.724	S	S	*	*			trans	-88.2	132.6	168.3	-79.5	-177.1	178.7	176.2	0	109.8	L134	L134-K136 PolarHBondContact O-N 3.35Å; L134-K136 VanDerWaalsContact O-N 3.11Å
137	P	34.7	Very low	39.5	Very low	109 Å²	109	132.6 Å²	132.6	71%	0.708	71%	0.707	S	S	*	*			trans	-67.5	149.7	-176.2	27.5	-32.9	0	0	0	111.3	T139	P137-T139 PolarHBondContact O-N 2.92Å
138	V	43.4	Very low	41.1	Very low	148 Å²	148	132.5 Å²	132.5	90%	0.897	70%	0.699	S	S	*	*			trans	-53.6	99.3	177.9	179.2	0	0	0	0	109	L140	V138-L140 PolarHBondContact O-N 3.47Å
139	T	43.7	Very low	42.6	Very low	95 Å²	95	130.3 Å²	130.3	58%	0.583	69%	0.69	S	S	*	*			trans	-78.8	122.7	-179.5	28.1	0	0	0	0	108	P137 T141 P142	P137-T139 PolarHBondContact O-N 2.92Å; T139-T141 WeakPolarHBondContact CB-OG1 3.21Å; T139-T141 PolarHBondContact O-N 2.83Å; T139-P142 WeakPolarHBondContact O-CD 3.29Å
140	L	45.1	Very low	44.5	Very low	128 Å²	128	129.5 Å²	129.5	67%	0.67	68%	0.681	S	S	*	*	S	Bend	trans	-65	3.6	178.9	-143.7	85.9	0	0	0	113.7	V138 L143 L144	V138-L140 PolarHBondContact O-N 3.47Å; L140-L143 PolarHBondContact O-N 2.73Å; L140-L144 WeakPolarHBondContact O-CB 3.41Å; L140-L144 PolarHBondContact O-N 3.14Å; L140-L144 VanDerWaalsContact O-N 3.07Å
141	T	49.3	Very low	46.5	Very low	79 Å²	79	124.9 Å²	124.9	49%	0.485	66%	0.661	S	S	.	*	H	α-helix	trans	-66.9	-31.8	-174	42.7	0	0	0	0	115.3	T139 L144 T145	T139-T141 WeakPolarHBondContact CB-OG1 3.21Å; T139-T141 PolarHBondContact O-N 2.83Å; T141-L144 PolarHBondContact O-N 2.95Å; T141-T145 WeakPolarHBondContact O-CB 3.28Å; T141-T145 WeakPolarHBondContact O-CG2 3.26Å; T141-T145 PolarHBondContact O-N 3.44Å; T141-T145 PolarHBondContact O-OG1 2.88Å
142	P	50.7	Low	48.3	Very low	75 Å²	75	126.8 Å²	126.8	49%	0.487	65%	0.652	S	S	.	*	H	α-helix	trans	-69.7	-40	175	-16.8	30.8	0	0	0	112	T139 L144 T145 N146	T139-P142 WeakPolarHBondContact O-CD 3.29Å; P142-L144 VanDerWaalsContact C-N 3.31Å; P142-T145 WeakPolarHBondContact CA-OG1 3.44Å; P142-T145 PolarHBondContact O-N 2.84Å; P142-T145 PolarHBondContact O-OG1 3.34Å; P142-T145 VanDerWaalsContact O-OG1 3.04Å; P142-N146 WeakPolarHBondContact O-CB 3.46Å; P142-N146 PolarHBondContact O-N 2.9Å
143	L	48.7	Very low	50.3	Low	131 Å²	131	121.9 Å²	121.9	69%	0.686	62%	0.624	S	S	*	*	H	α-helix	trans	-64.4	-41.9	175.6	-154.1	91.5	0	0	0	110	L140 N146 Y147	L140-L143 PolarHBondContact O-N 2.73Å; L143-N146 PolarHBondContact O-N 3.26Å; L143-Y147 WeakPolarHBondContact O-CD1 3.4Å; L143-Y147 PolarHBondContact O-N 3.46Å
144	L	50.5	Low	52.6	Low	90 Å²	90	116.5 Å²	116.5	47%	0.471	61%	0.606	S	S	.	*	H	α-helix	trans	-67.6	-31.5	176.7	-151	69.3	0	0	0	112.2	L140 T141 P142 Y147 R148	L140-L144 WeakPolarHBondContact O-CB 3.41Å; L140-L144 PolarHBondContact O-N 3.14Å; L140-L144 VanDerWaalsContact O-N 3.07Å; T141-L144 PolarHBondContact O-N 2.95Å; P142-L144 VanDerWaalsContact C-N 3.31Å; L144-Y147 HydrophobicContact CB-CD1 4.29Å; L144-Y147 HydrophobicContact CB-CE1 3.89Å; L144-Y147 HydrophobicContact CD1-CD1 4.01Å; L144-Y147 HydrophobicContact CD1-CE1 3.2Å; L144-Y147 HydrophobicContact CG-CD1 4.26Å; L144-Y147 HydrophobicContact CG-CE1 3.4Å; L144-Y147 WeakPolarHBondContact O-CD1 3.17Å; L144-Y147 WeakPolarHBondContact O-CE1 3.33Å; L144-R148 WeakPolarHBondContact O-CB 3.19Å
145	T	56.9	Low	54.7	Low	74 Å²	74	110.4 Å²	110.4	45%	0.454	58%	0.575	S	S	.	*	H	α-helix	trans	-79.7	-34	176	47.4	0	0	0	0	112.1	T141 P142 K149	T141-T145 WeakPolarHBondContact O-CB 3.28Å; T141-T145 WeakPolarHBondContact O-CG2 3.26Å; T141-T145 PolarHBondContact O-N 3.44Å; T141-T145 PolarHBondContact O-OG1 2.88Å; P142-T145 WeakPolarHBondContact CA-OG1 3.44Å; P142-T145 PolarHBondContact O-N 2.84Å; P142-T145 PolarHBondContact O-OG1 3.34Å; P142-T145 VanDerWaalsContact O-OG1 3.04Å; T145-K149 WeakPolarHBondContact O-CG 3.4Å; T145-K149 PolarHBondContact O-N 2.92Å; T145-K149 VanDerWaalsContact O-N 3.09Å
146	N	61.4	Low	56.8	Low	97 Å²	97	103.3 Å²	103.3	52%	0.519	55%	0.546	S	S	.	.	H	α-helix	trans	-72.6	-45.6	177.4	-77.9	-16.1	0	0	0	113	P142 L143 R148 K149 T150	P142-N146 WeakPolarHBondContact O-CB 3.46Å; P142-N146 PolarHBondContact O-N 2.9Å; L143-N146 PolarHBondContact O-N 3.26Å; N146-R148 VanDerWaalsContact C-N 3.26Å; N146-R148 PolarHBondContact O-N 3.22Å; N146-K149 PolarHBondContact O-N 2.99Å; N146-T150 PolarHBondContact O-N 3.15Å; N146-T150 PolarHBondContact O-OG1 2.94Å
147	Y	58.5	Low	58.7	Low	109 Å²	109	96.3 Å²	96.3	43%	0.427	52%	0.519	S	S	.	.	H	α-helix	trans	-60.1	-39.5	176.3	90.9	-66.7	0	0	0	111	L143 L144 T150 L151	L143-Y147 WeakPolarHBondContact O-CD1 3.4Å; L143-Y147 PolarHBondContact O-N 3.46Å; L144-Y147 HydrophobicContact CB-CD1 4.29Å; L144-Y147 HydrophobicContact CB-CE1 3.89Å; L144-Y147 HydrophobicContact CD1-CD1 4.01Å; L144-Y147 HydrophobicContact CD1-CE1 3.2Å; L144-Y147 HydrophobicContact CG-CD1 4.26Å; L144-Y147 HydrophobicContact CG-CE1 3.4Å; L144-Y147 WeakPolarHBondContact O-CD1 3.17Å; L144-Y147 WeakPolarHBondContact O-CE1 3.33Å; Y147-T150 PolarHBondContact O-N 3.35Å; Y147-L151 HydrophobicContact CD2-CD1 3.54Å; Y147-L151 HydrophobicContact CE2-CD1 4.37Å; Y147-L151 HydrophobicContact CG-CD1 4.33Å; Y147-L151 WeakPolarHBondContact O-CB 3.41Å; Y147-L151 PolarHBondContact O-N 2.93Å
148	R	56.4	Low	60.7	Low	168 Å²	168	91.3 Å²	91.3	63%	0.634	49%	0.487	S	S	*	.	H	α-helix	trans	-64	-44.4	177.9	-169.4	178.3	178.2	174.7	-0.7	111.1	L144 N146 T150 F152	L144-R148 WeakPolarHBondContact O-CB 3.19Å; N146-R148 VanDerWaalsContact C-N 3.26Å; N146-R148 PolarHBondContact O-N 3.22Å; R148-T150 VanDerWaalsContact C-N 3.32Å; R148-T150 PolarHBondContact O-N 3.49Å; R148-F152 HydrophobicContact CB-CD2 4.39Å; R148-F152 HydrophobicContact CG-CD2 3.62Å; R148-F152 HydrophobicContact CG-CE2 4Å; R148-F152 VanDerWaalsContact O-CB 3.24Å; R148-F152 WeakPolarHBondContact O-CB 3.11Å; R148-F152 VanDerWaalsContact O-CD2 3.22Å; R148-F152 WeakPolarHBondContact O-CD2 3.39Å; R148-F152 PolarHBondContact O-N 3.21Å
149	K	61	Low	62.4	Low	154 Å²	154	86.9 Å²	86.9	67%	0.67	46%	0.458	S	S	*	.	H	α-helix	trans	-64.6	-35.5	176.4	-74.8	176.1	-178.2	175.8	0	112.7	T145 N146 S153	T145-K149 WeakPolarHBondContact O-CG 3.4Å; T145-K149 PolarHBondContact O-N 2.92Å; T145-K149 VanDerWaalsContact O-N 3.09Å; N146-K149 PolarHBondContact O-N 2.99Å; K149-S153 PolarHBondContact O-N 3.05Å; K149-S153 VanDerWaalsContact O-N 3.16Å
150	T	65.8	Low	64	Low	96 Å²	96	86.9 Å²	86.9	59%	0.589	45%	0.453	S	S	*	.	H	α-helix	trans	-75.4	-51.3	-179.5	-52	0	0	0	0	112.2	N146 Y147 R148 F152 S153 V156	N146-T150 PolarHBondContact O-N 3.15Å; N146-T150 PolarHBondContact O-OG1 2.94Å; Y147-T150 PolarHBondContact O-N 3.35Å; R148-T150 VanDerWaalsContact C-N 3.32Å; R148-T150 PolarHBondContact O-N 3.49Å; T150-F152 PolarHBondContact O-N 2.92Å; T150-S153 VanDerWaalsContact O-CB 3.31Å; T150-S153 WeakPolarHBondContact O-CB 3.49Å; T150-S153 PolarHBondContact O-N 3.28Å; T150-V156 WeakPolarHBondContact O-CG2 3.28Å
151	L	65.2	Low	65.6	Low	93 Å²	93	84.8 Å²	84.8	49%	0.487	44%	0.44	S	S	.	.	H	α-helix	trans	-66.8	-35	179.5	-80.8	151.3	0	0	0	112.7	Y147 V156	Y147-L151 HydrophobicContact CD2-CD1 3.54Å; Y147-L151 HydrophobicContact CE2-CD1 4.37Å; Y147-L151 HydrophobicContact CG-CD1 4.33Å; Y147-L151 WeakPolarHBondContact O-CB 3.41Å; Y147-L151 PolarHBondContact O-N 2.93Å; L151-V156 VanDerWaalsContact O-CG1 3.32Å; L151-V156 WeakPolarHBondContact O-CG1 3.31Å
152	F	70.3	Confident	66.9	Low	133 Å²	133	83.2 Å²	83.2	58%	0.583	43%	0.43	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.2	19	176.9	-60.7	-81.2	0	0	0	113.2	R148 T150	R148-F152 HydrophobicContact CB-CD2 4.39Å; R148-F152 HydrophobicContact CG-CD2 3.62Å; R148-F152 HydrophobicContact CG-CE2 4Å; R148-F152 VanDerWaalsContact O-CB 3.24Å; R148-F152 WeakPolarHBondContact O-CB 3.11Å; R148-F152 VanDerWaalsContact O-CD2 3.22Å; R148-F152 WeakPolarHBondContact O-CD2 3.39Å; R148-F152 PolarHBondContact O-N 3.21Å; T150-F152 PolarHBondContact O-N 2.92Å
153	S	73	Confident	68.2	Low	38 Å²	38	85.4 Å²	85.4	27%	0.266	44%	0.437	S	S	.	.			trans	-58.6	137.8	169.7	173.9	0	0	0	0	109.5	K149 T150 T155 V156 V157	K149-S153 PolarHBondContact O-N 3.05Å; K149-S153 VanDerWaalsContact O-N 3.16Å; T150-S153 VanDerWaalsContact O-CB 3.31Å; T150-S153 WeakPolarHBondContact O-CB 3.49Å; T150-S153 PolarHBondContact O-N 3.28Å; S153-T155 PolarHBondContact O-N 2.82Å; S153-V156 PolarHBondContact O-N 2.86Å; S153-V157 WeakPolarHBondContact O-CG2 3.43Å; S153-V157 PolarHBondContact O-N 3.2Å
154	P	73.2	Confident	70	Confident	80 Å²	80	85 Å²	85	52%	0.519	43%	0.43	S	S	.	.	H	α-helix	trans	-52.5	-31.1	179.6	-27.9	34.3	0	0	0	113.8	A158 L349	P154-A158 VanDerWaalsContact O-CB 3.25Å; P154-A158 WeakPolarHBondContact O-CB 3.44Å; P154-A158 PolarHBondContact O-N 3.02Å; P154-L349 HydrophobicContact CB-CD1 4.47Å; P154-L349 HydrophobicContact CB-CD2 4.36Å
155	T	73.6	Confident	71.7	Confident	29 Å²	29	82.7 Å²	82.7	18%	0.178	42%	0.418	C	S	.	.	H	α-helix	trans	-71.8	-45	176.9	-54	0	0	0	0	111.9	S153 A158 I159 S346 F348	S153-T155 PolarHBondContact O-N 2.82Å; T155-A158 PolarHBondContact O-N 3.49Å; T155-I159 HydrophobicContact CG2-CD1 4.01Å; T155-I159 VanDerWaalsContact O-CG1 3.31Å; T155-I159 WeakPolarHBondContact O-CG1 3.19Å; T155-I159 PolarHBondContact O-N 3.14Å; T155-S346 VanDerWaalsContact CG2-OG 3.3Å; T155-S346 WeakPolarHBondContact CG2-OG 3.47Å; T155-S346 PolarHBondContact OG1-OG 3.29Å; T155-F348 HydrophobicContact CG2-CB 4.21Å
156	V	76.8	Confident	73.3	Confident	48 Å²	48	81 Å²	81	29%	0.291	41%	0.407	S	S	.	.	H	α-helix	trans	-65.9	-43.9	179.5	175.9	0	0	0	0	109.9	T150 L151 S153 A158 I159 I160	T150-V156 WeakPolarHBondContact O-CG2 3.28Å; L151-V156 VanDerWaalsContact O-CG1 3.32Å; L151-V156 WeakPolarHBondContact O-CG1 3.31Å; S153-V156 PolarHBondContact O-N 2.86Å; V156-A158 VanDerWaalsContact C-N 3.33Å; V156-A158 PolarHBondContact O-N 3.21Å; V156-I159 PolarHBondContact O-N 2.76Å; V156-I160 HydrophobicContact CG1-CD1 3.75Å; V156-I160 HydrophobicContact CG1-CG1 4.36Å; V156-I160 VanDerWaalsContact O-CG1 3.3Å; V156-I160 WeakPolarHBondContact O-CG1 3.3Å; V156-I160 PolarHBondContact O-N 3.13Å
157	V	75	Confident	74.6	Confident	49 Å²	49	79.3 Å²	79.3	30%	0.297	40%	0.402	S	S	.	.	H	α-helix	trans	-59.4	-43.5	174.3	176.1	0	0	0	0	111.2	S153 I160 Q161	S153-V157 WeakPolarHBondContact O-CG2 3.43Å; S153-V157 PolarHBondContact O-N 3.2Å; V157-I160 PolarHBondContact O-N 2.88Å; V157-Q161 HydrophobicContact CG1-CG 4.38Å; V157-Q161 WeakPolarHBondContact O-CB 3.48Å; V157-Q161 VanDerWaalsContact O-CG 3.24Å; V157-Q161 WeakPolarHBondContact O-CG 3.33Å; V157-Q161 PolarHBondContact O-N 3.3Å
158	A	76	Confident	76.2	Confident	4 Å²	4	76.7 Å²	76.7	3%	0.033	39%	0.392	C	S	.	.	H	α-helix	trans	-62.4	-43.4	176.5	0	0	0	0	0	112.3	P154 T155 V156 Q161 V162 L349 W352	P154-A158 VanDerWaalsContact O-CB 3.25Å; P154-A158 WeakPolarHBondContact O-CB 3.44Å; P154-A158 PolarHBondContact O-N 3.02Å; T155-A158 PolarHBondContact O-N 3.49Å; V156-A158 VanDerWaalsContact C-N 3.33Å; V156-A158 PolarHBondContact O-N 3.21Å; A158-Q161 PolarHBondContact O-N 2.97Å; A158-V162 WeakPolarHBondContact O-CG2 3.45Å; A158-V162 PolarHBondContact O-N 2.97Å; A158-L349 HydrophobicContact CB-CD1 4.09Å; A158-W352 HydrophobicContact CB-CB 4.09Å; A158-W352 VanDerWaalsContact CB-CD1 3.49Å; A158-W352 HydrophobicContact CB-CG 3.88Å
159	I	78.8	Confident	77.9	Confident	55 Å²	55	68.9 Å²	68.9	28%	0.282	36%	0.363	S	S	.	.	H	α-helix	trans	-63.6	-47.8	177.6	-69	166.3	0	0	0	110.6	T155 V156 Q161 V162 L163 F348	T155-I159 HydrophobicContact CG2-CD1 4.01Å; T155-I159 VanDerWaalsContact O-CG1 3.31Å; T155-I159 WeakPolarHBondContact O-CG1 3.19Å; T155-I159 PolarHBondContact O-N 3.14Å; V156-I159 PolarHBondContact O-N 2.76Å; I159-Q161 VanDerWaalsContact C-N 3.3Å; I159-Q161 PolarHBondContact O-N 3.28Å; I159-V162 PolarHBondContact O-N 3.18Å; I159-L163 HydrophobicContact CG2-CD1 3.78Å; I159-L163 HydrophobicContact CG2-CG 4.39Å; I159-L163 WeakPolarHBondContact O-CB 3.33Å; I159-L163 WeakPolarHBondContact O-CG 3.37Å; I159-L163 PolarHBondContact O-N 2.66Å; I159-F348 HydrophobicContact CD1-CB 4.43Å; I159-F348 HydrophobicContact CD1-CD1 4.46Å; I159-F348 HydrophobicContact CD1-CD2 4.17Å; I159-F348 HydrophobicContact CD1-CG 4.11Å; I159-F348 HydrophobicContact CG1-CB 4.23Å; I159-F348 HydrophobicContact CG1-CD1 4.2Å; I159-F348 HydrophobicContact CG1-CG 4.14Å
160	I	77.1	Confident	79.4	Confident	94 Å²	94	62.7 Å²	62.7	48%	0.482	34%	0.336	S	S	.	.	H	α-helix	trans	-58.6	-44.5	177	-68.2	169.7	0	0	0	110.1	V156 V157 L163 F164	V156-I160 HydrophobicContact CG1-CD1 3.75Å; V156-I160 HydrophobicContact CG1-CG1 4.36Å; V156-I160 VanDerWaalsContact O-CG1 3.3Å; V156-I160 WeakPolarHBondContact O-CG1 3.3Å; V156-I160 PolarHBondContact O-N 3.13Å; V157-I160 PolarHBondContact O-N 2.88Å; I160-L163 PolarHBondContact O-N 3.3Å; I160-F164 WeakPolarHBondContact O-CB 3.31Å; I160-F164 PolarHBondContact O-N 3.41Å
161	Q	79.8	Confident	80.6	Confident	84 Å²	84	61.3 Å²	61.3	39%	0.393	32%	0.32	S	S	.	.	H	α-helix	trans	-62.6	-45	177.8	-77	178.1	-3.8	0	0	112.6	V157 A158 I159 L163 F164 I165 W352	V157-Q161 HydrophobicContact CG1-CG 4.38Å; V157-Q161 WeakPolarHBondContact O-CB 3.48Å; V157-Q161 VanDerWaalsContact O-CG 3.24Å; V157-Q161 WeakPolarHBondContact O-CG 3.33Å; V157-Q161 PolarHBondContact O-N 3.3Å; A158-Q161 PolarHBondContact O-N 2.97Å; I159-Q161 VanDerWaalsContact C-N 3.3Å; I159-Q161 PolarHBondContact O-N 3.28Å; Q161-L163 VanDerWaalsContact C-N 3.35Å; Q161-L163 PolarHBondContact O-N 3.09Å; Q161-F164 PolarHBondContact O-N 3.36Å; Q161-I165 HydrophobicContact CB-CD1 4.07Å; Q161-I165 VanDerWaalsContact O-CB 3.27Å; Q161-I165 WeakPolarHBondContact O-CB 3.25Å; Q161-I165 WeakPolarHBondContact O-CD1 3.28Å; Q161-I165 WeakPolarHBondContact O-CG1 3.19Å; Q161-I165 PolarHBondContact O-N 2.86Å; Q161-W352 HydrophobicContact CB-CH2 4.45Å; Q161-W352 HydrophobicContact CB-CZ2 3.73Å; Q161-W352 VanDerWaalsContact OE1-NE1 3.13Å
162	V	77	Confident	81.7	Confident	47 Å²	47	58 Å²	58	29%	0.285	30%	0.303	S	S	.	.	H	α-helix	trans	-57.8	-50.6	176.6	175.8	0	0	0	0	110.5	A158 I159 F164 W352	A158-V162 WeakPolarHBondContact O-CG2 3.45Å; A158-V162 PolarHBondContact O-N 2.97Å; I159-V162 PolarHBondContact O-N 3.18Å; V162-F164 VanDerWaalsContact C-N 3.28Å; V162-F164 PolarHBondContact O-N 3.46Å; V162-W352 HydrophobicContact CB-CE3 4.25Å; V162-W352 HydrophobicContact CB-CZ3 4.08Å; V162-W352 HydrophobicContact CG2-CD2 3.61Å; V162-W352 HydrophobicContact CG2-CE3 3.06Å; V162-W352 HydrophobicContact CG2-CG 4.28Å; V162-W352 HydrophobicContact CG2-CH2 4.11Å; V162-W352 HydrophobicContact CG2-CZ3 3.33Å
163	L	78.3	Confident	82.6	Confident	121 Å²	121	51.8 Å²	51.8	63%	0.634	28%	0.276	S	S	*	.	H	α-helix	trans	-69.2	-28.5	-176.1	-67.8	175.8	0	0	0	112.1	I159 I160 Q161 P167	I159-L163 HydrophobicContact CG2-CD1 3.78Å; I159-L163 HydrophobicContact CG2-CG 4.39Å; I159-L163 WeakPolarHBondContact O-CB 3.33Å; I159-L163 WeakPolarHBondContact O-CG 3.37Å; I159-L163 PolarHBondContact O-N 2.66Å; I160-L163 PolarHBondContact O-N 3.3Å; Q161-L163 VanDerWaalsContact C-N 3.35Å; Q161-L163 PolarHBondContact O-N 3.09Å; L163-P167 WeakPolarHBondContact O-CD 3.35Å; L163-P167 WeakPolarHBondContact O-CG 3.36Å
164	F	85.3	Confident	83.4	Confident	121 Å²	121	50 Å²	50	53%	0.531	26%	0.263	S	S	.	.	H	α-helix	trans	-90.3	-38.3	-177.2	-171.6	-101.6	0	0	0	113.2	I160 Q161 V162 V166 P167 F168	I160-F164 WeakPolarHBondContact O-CB 3.31Å; I160-F164 PolarHBondContact O-N 3.41Å; Q161-F164 PolarHBondContact O-N 3.36Å; V162-F164 VanDerWaalsContact C-N 3.28Å; V162-F164 PolarHBondContact O-N 3.46Å; F164-V166 PolarHBondContact O-N 3.18Å; F164-P167 WeakPolarHBondContact O-CD 3.48Å; F164-F168 HydrophobicContact CD1-CB 3.87Å; F164-F168 HydrophobicContact CD1-CG 4.2Å; F164-F168 HydrophobicContact CE1-CB 3.66Å; F164-F168 HydrophobicContact CE1-CD1 4.33Å; F164-F168 AromaticContact CE1-CD2 3.52Å; F164-F168 HydrophobicContact CE1-CD2 3.52Å; F164-F168 HydrophobicContact CE1-CE2 4.22Å; F164-F168 AromaticContact CE1-CG 3.58Å; F164-F168 HydrophobicContact CE1-CG 3.58Å; F164-F168 HydrophobicContact CG-CB 4.49Å; F164-F168 HydrophobicContact CZ-CB 4.12Å; F164-F168 AromaticContact CZ-CD2 3.62Å; F164-F168 HydrophobicContact CZ-CD2 3.62Å; F164-F168 HydrophobicContact CZ-CE2 4.34Å; F164-F168 HydrophobicContact CZ-CG 4.09Å; F164-F168 WeakPolarHBondContact O-CB 3.45Å; F164-F168 PolarHBondContact O-N 3.46Å
165	I	87.2	Confident	83.8	Confident	42 Å²	42	47.6 Å²	47.6	22%	0.215	25%	0.246	C	C	.	.	H	α-helix	trans	-60.5	-45.7	-170.9	-77.7	162.7	0	0	0	111.9	Q161 F168 V169 W352 I438	Q161-I165 HydrophobicContact CB-CD1 4.07Å; Q161-I165 VanDerWaalsContact O-CB 3.27Å; Q161-I165 WeakPolarHBondContact O-CB 3.25Å; Q161-I165 WeakPolarHBondContact O-CD1 3.28Å; Q161-I165 WeakPolarHBondContact O-CG1 3.19Å; Q161-I165 PolarHBondContact O-N 2.86Å; I165-F168 PolarHBondContact O-N 3.47Å; I165-V169 VanDerWaalsContact O-CG2 3.28Å; I165-V169 WeakPolarHBondContact O-CG2 3.19Å; I165-V169 PolarHBondContact O-N 2.79Å; I165-W352 HydrophobicContact CD1-CH2 3.47Å; I165-W352 VanDerWaalsContact CD1-CH2 3.47Å; I165-W352 HydrophobicContact CD1-CZ2 3.61Å; I165-I438 HydrophobicContact CG2-CG2 3.75Å
166	V	89.3	Confident	84.1	Confident	38 Å²	38	47.7 Å²	47.7	23%	0.23	25%	0.245	C	C	.	.	H	α-helix	trans	-66	-55.7	-178.4	172.3	0	0	0	0	110.9	F164 F168 V169 Y170	F164-V166 PolarHBondContact O-N 3.18Å; V166-F168 PolarHBondContact O-N 3.41Å; V166-V169 PolarHBondContact O-N 2.8Å; V166-V169 VanDerWaalsContact O-N 3.11Å; V166-Y170 HydrophobicContact CG1-CD2 3.97Å; V166-Y170 HydrophobicContact CG1-CE2 3.66Å; V166-Y170 VanDerWaalsContact O-CD2 3.25Å; V166-Y170 WeakPolarHBondContact O-CD2 3.44Å; V166-Y170 PolarHBondContact O-N 3.12Å; V166-Y170 VanDerWaalsContact O-N 3.11Å
167	P	90.4	Very high	84.1	Confident	63 Å²	63	47.5 Å²	47.5	41%	0.409	24%	0.24	S	C	.	.	H	α-helix	trans	-55.8	-35.9	174	-27.8	36.8	0	0	0	113.9	L163 F164 Y170 W171	L163-P167 WeakPolarHBondContact O-CD 3.35Å; L163-P167 WeakPolarHBondContact O-CG 3.36Å; F164-P167 WeakPolarHBondContact O-CD 3.48Å; P167-Y170 WeakPolarHBondContact O-CB 3.36Å; P167-Y170 PolarHBondContact O-N 3.26Å; P167-W171 WeakPolarHBondContact O-CB 3.48Å; P167-W171 PolarHBondContact O-N 3.42Å
168	F	90.7	Very high	83.9	Confident	53 Å²	53	45.4 Å²	45.4	23%	0.232	23%	0.228	C	C	.	.	H	α-helix	trans	-66.1	-39.8	177.5	-178.7	-110.2	0	0	0	112.3	F164 I165 V166 W171 L172 I566	F164-F168 HydrophobicContact CD1-CB 3.87Å; F164-F168 HydrophobicContact CD1-CG 4.2Å; F164-F168 HydrophobicContact CE1-CB 3.66Å; F164-F168 HydrophobicContact CE1-CD1 4.33Å; F164-F168 AromaticContact CE1-CD2 3.52Å; F164-F168 HydrophobicContact CE1-CD2 3.52Å; F164-F168 HydrophobicContact CE1-CE2 4.22Å; F164-F168 AromaticContact CE1-CG 3.58Å; F164-F168 HydrophobicContact CE1-CG 3.58Å; F164-F168 HydrophobicContact CG-CB 4.49Å; F164-F168 HydrophobicContact CZ-CB 4.12Å; F164-F168 AromaticContact CZ-CD2 3.62Å; F164-F168 HydrophobicContact CZ-CD2 3.62Å; F164-F168 HydrophobicContact CZ-CE2 4.34Å; F164-F168 HydrophobicContact CZ-CG 4.09Å; F164-F168 WeakPolarHBondContact O-CB 3.45Å; F164-F168 PolarHBondContact O-N 3.46Å; I165-F168 PolarHBondContact O-N 3.47Å; V166-F168 PolarHBondContact O-N 3.41Å; F168-W171 AromaticContact CD2-CE3 3.87Å; F168-W171 HydrophobicContact CD2-CE3 3.87Å; F168-W171 HydrophobicContact CD2-CZ3 4.28Å; F168-W171 AromaticContact CE2-CE3 3.77Å; F168-W171 HydrophobicContact CE2-CE3 3.77Å; F168-W171 AromaticContact CE2-CZ3 3.72Å; F168-W171 HydrophobicContact CE2-CZ3 3.72Å; F168-W171 PolarHBondContact O-N 3.34Å; F168-L172 HydrophobicContact CD1-CD1 3.9Å; F168-L172 HydrophobicContact CD1-CG 4.39Å; F168-L172 HydrophobicContact CE1-CD1 3.38Å; F168-L172 HydrophobicContact CE1-CG 4.02Å; F168-L172 HydrophobicContact CE2-CD1 4.41Å; F168-L172 HydrophobicContact CE2-CD2 4.38Å; F168-L172 HydrophobicContact CE2-CG 4.17Å; F168-L172 HydrophobicContact CZ-CD1 3.67Å; F168-L172 HydrophobicContact CZ-CD2 4.1Å; F168-L172 HydrophobicContact CZ-CG 3.9Å; F168-L172 WeakPolarHBondContact O-CB 3.25Å; F168-L172 WeakPolarHBondContact O-CG 3.37Å; F168-L172 PolarHBondContact O-N 2.86Å; F168-I566 HydrophobicContact CE1-CD1 3.96Å; F168-I566 HydrophobicContact CZ-CD1 3.97Å
169	V	92.1	Very high	83.6	Confident	4 Å²	4	48.6 Å²	48.6	2%	0.024	25%	0.248	C	C	.	.	H	α-helix	trans	-64.5	-41.2	173.6	174.2	0	0	0	0	110.9	I165 V166 N173 L312 V442 F446 V447	I165-V169 VanDerWaalsContact O-CG2 3.28Å; I165-V169 WeakPolarHBondContact O-CG2 3.19Å; I165-V169 PolarHBondContact O-N 2.79Å; V166-V169 PolarHBondContact O-N 2.8Å; V166-V169 VanDerWaalsContact O-N 3.11Å; V169-N173 PolarHBondContact O-N 2.95Å; V169-N173 VanDerWaalsContact O-N 3.07Å; V169-N173 PolarHBondContact O-ND2 2.83Å; V169-L312 HydrophobicContact CG1-CD1 3.78Å; V169-L312 HydrophobicContact CG1-CD2 4.25Å; V169-V442 HydrophobicContact CB-CG1 4.42Å; V169-V442 HydrophobicContact CG1-CG1 4.01Å; V169-V442 HydrophobicContact CG2-CG1 4.33Å; V169-F446 HydrophobicContact CG1-CB 4Å; V169-V447 HydrophobicContact CB-CG2 4.45Å; V169-V447 HydrophobicContact CG1-CG2 4.11Å; V169-V447 HydrophobicContact CG2-CG2 3.76Å
170	Y	92.3	Very high	83	Confident	25 Å²	25	47.9 Å²	47.9	10%	0.098	25%	0.245	C	C	.	.	H	α-helix	trans	-60.3	-49.8	172.9	-81.6	-80.2	0	0	0	111.8	V166 P167 L172 N173 L174 W224 Y231 L309 L312 T313	V166-Y170 HydrophobicContact CG1-CD2 3.97Å; V166-Y170 HydrophobicContact CG1-CE2 3.66Å; V166-Y170 VanDerWaalsContact O-CD2 3.25Å; V166-Y170 WeakPolarHBondContact O-CD2 3.44Å; V166-Y170 PolarHBondContact O-N 3.12Å; V166-Y170 VanDerWaalsContact O-N 3.11Å; P167-Y170 WeakPolarHBondContact O-CB 3.36Å; P167-Y170 PolarHBondContact O-N 3.26Å; Y170-L172 VanDerWaalsContact C-N 3.34Å; Y170-L172 PolarHBondContact O-N 2.82Å; Y170-N173 PolarHBondContact O-N 3.38Å; Y170-N173 VanDerWaalsContact O-N 3.15Å; Y170-L174 WeakPolarHBondContact O-CB 3.27Å; Y170-L174 WeakPolarHBondContact O-CG 3.44Å; Y170-L174 PolarHBondContact O-N 3.2Å; Y170-W224 HydrophobicContact CG-CZ3 4.45Å; Y170-Y231 HydrophobicContact CD1-CE1 4.35Å; Y170-Y231 AromaticContact CE1-CD1 3.99Å; Y170-Y231 HydrophobicContact CE1-CD1 3.99Å; Y170-Y231 HydrophobicContact CE1-CE1 4.08Å; Y170-L309 HydrophobicContact CD1-CD1 3.56Å; Y170-L309 HydrophobicContact CE1-CD1 3.53Å; Y170-L309 HydrophobicContact CE1-CG 4.37Å; Y170-L312 HydrophobicContact CD1-CD2 3.52Å; Y170-L312 HydrophobicContact CD1-CG 4.31Å; Y170-L312 HydrophobicContact CD2-CD2 4.33Å; Y170-L312 HydrophobicContact CE1-CD2 3.54Å; Y170-L312 HydrophobicContact CE1-CG 3.85Å; Y170-L312 HydrophobicContact CE2-CD2 4.34Å; Y170-L312 HydrophobicContact CE2-CG 4.34Å; Y170-L312 HydrophobicContact CG-CD2 3.93Å; Y170-T313 WeakPolarHBondContact OH-CA 3.36Å; Y170-T313 WeakPolarHBondContact OH-CB 3.43Å; Y170-T313 PolarHBondContact OH-N 2.97Å; Y170-T313 PolarHBondContact OH-OG1 3.2Å
171	W	91.1	Very high	82.2	Confident	66 Å²	66	45.9 Å²	45.9	25%	0.25	24%	0.239	C	C	.	.	H	α-helix	trans	-58.3	-46.3	-179.9	176.9	75.9	0	0	0	111.3	P167 F168 N173 L174 L175 L220 W224	P167-W171 WeakPolarHBondContact O-CB 3.48Å; P167-W171 PolarHBondContact O-N 3.42Å; F168-W171 AromaticContact CD2-CE3 3.87Å; F168-W171 HydrophobicContact CD2-CE3 3.87Å; F168-W171 HydrophobicContact CD2-CZ3 4.28Å; F168-W171 AromaticContact CE2-CE3 3.77Å; F168-W171 HydrophobicContact CE2-CE3 3.77Å; F168-W171 AromaticContact CE2-CZ3 3.72Å; F168-W171 HydrophobicContact CE2-CZ3 3.72Å; F168-W171 PolarHBondContact O-N 3.34Å; W171-N173 VanDerWaalsContact C-N 3.33Å; W171-N173 PolarHBondContact O-N 2.88Å; W171-L174 PolarHBondContact O-N 2.83Å; W171-L175 HydrophobicContact CH2-CD1 3.87Å; W171-L175 HydrophobicContact CZ2-CD1 3.66Å; W171-L175 HydrophobicContact CZ3-CD1 4.45Å; W171-L175 VanDerWaalsContact O-CB 3.24Å; W171-L175 WeakPolarHBondContact O-CB 3.4Å; W171-L175 PolarHBondContact O-N 2.97Å; W171-L220 PolarHBondContact NE1-O 3.49Å; W171-W224 HydrophobicContact CB-CH2 4.31Å; W171-W224 HydrophobicContact CB-CZ2 4.09Å
172	L	88.9	Confident	80.8	Confident	23 Å²	23	48.3 Å²	48.3	12%	0.12	25%	0.253	C	S	.	.	H	α-helix	trans	-60	-40	175.8	-78.3	179.5	0	0	0	113	F168 Y170 V447 I450	F168-L172 HydrophobicContact CD1-CD1 3.9Å; F168-L172 HydrophobicContact CD1-CG 4.39Å; F168-L172 HydrophobicContact CE1-CD1 3.38Å; F168-L172 HydrophobicContact CE1-CG 4.02Å; F168-L172 HydrophobicContact CE2-CD1 4.41Å; F168-L172 HydrophobicContact CE2-CD2 4.38Å; F168-L172 HydrophobicContact CE2-CG 4.17Å; F168-L172 HydrophobicContact CZ-CD1 3.67Å; F168-L172 HydrophobicContact CZ-CD2 4.1Å; F168-L172 HydrophobicContact CZ-CG 3.9Å; F168-L172 WeakPolarHBondContact O-CB 3.25Å; F168-L172 WeakPolarHBondContact O-CG 3.37Å; F168-L172 PolarHBondContact O-N 2.86Å; Y170-L172 VanDerWaalsContact C-N 3.34Å; Y170-L172 PolarHBondContact O-N 2.82Å; L172-V447 HydrophobicContact CD1-CG1 4.12Å; L172-V447 HydrophobicContact CD1-CG2 4.41Å; L172-I450 HydrophobicContact CB-CD1 3.69Å
173	N	90	Very high	79.3	Confident	3 Å²	3	50.6 Å²	50.6	2%	0.016	27%	0.271	C	S	.	.	H	α-helix	trans	-69	-50.1	177.8	-85.9	-88.4	0	0	0	111.4	V169 Y170 W171 L175 I176 F177 W308 F446	V169-N173 PolarHBondContact O-N 2.95Å; V169-N173 VanDerWaalsContact O-N 3.07Å; V169-N173 PolarHBondContact O-ND2 2.83Å; Y170-N173 PolarHBondContact O-N 3.38Å; Y170-N173 VanDerWaalsContact O-N 3.15Å; W171-N173 VanDerWaalsContact C-N 3.33Å; W171-N173 PolarHBondContact O-N 2.88Å; N173-L175 PolarHBondContact O-N 3.13Å; N173-I176 PolarHBondContact O-N 2.62Å; N173-I176 VanDerWaalsContact O-N 3.09Å; N173-F177 VanDerWaalsContact O-CD2 3.24Å; N173-F177 WeakPolarHBondContact O-CD2 3.42Å; N173-F177 PolarHBondContact O-N 3.09Å; N173-W308 VanDerWaalsContact OD1-CZ2 3.29Å; N173-W308 WeakPolarHBondContact OD1-CZ2 3.4Å; N173-W308 PolarHBondContact OD1-NE1 3.47Å; N173-F446 PolarHBondContact ND2-O 3.02Å; N173-F446 PolarHBondContact OD1-O 3.44Å
174	L	88.1	Confident	77.4	Confident	1 Å²	1	51.3 Å²	51.3	1%	0.005	28%	0.276	C	S	.	.	H	α-helix	trans	-66.3	-27	-178.4	-68.6	173.8	0	0	0	112	Y170 W171 I176 F177 A178 W213 V222 W224 P225 L309	Y170-L174 WeakPolarHBondContact O-CB 3.27Å; Y170-L174 WeakPolarHBondContact O-CG 3.44Å; Y170-L174 PolarHBondContact O-N 3.2Å; W171-L174 PolarHBondContact O-N 2.83Å; L174-I176 PolarHBondContact O-N 3.44Å; L174-I176 VanDerWaalsContact O-N 3.13Å; L174-F177 PolarHBondContact O-N 3.2Å; L174-A178 CarbonylContact O-C 3.52Å; L174-A178 VanDerWaalsContact O-C 3.24Å; L174-A178 WeakPolarHBondContact O-CA 3.36Å; L174-A178 PolarHBondContact O-N 3.04Å; L174-W213 HydrophobicContact CD2-CE3 4.38Å; L174-W213 HydrophobicContact CD2-CH2 4.25Å; L174-W213 HydrophobicContact CD2-CZ3 3.64Å; L174-V222 HydrophobicContact CB-CG1 3.2Å; L174-V222 HydrophobicContact CD1-CG1 4.44Å; L174-V222 HydrophobicContact CG-CG1 4.42Å; L174-V222 WeakPolarHBondContact O-CG1 3.34Å; L174-W224 HydrophobicContact CD1-CD2 3.71Å; L174-W224 HydrophobicContact CD1-CE3 3.48Å; L174-W224 VanDerWaalsContact CD1-CE3 3.48Å; L174-W224 HydrophobicContact CD1-CG 4.31Å; L174-W224 HydrophobicContact CD1-CH2 4.21Å; L174-W224 HydrophobicContact CD1-CZ2 4.41Å; L174-W224 HydrophobicContact CD1-CZ3 3.75Å; L174-P225 HydrophobicContact CD2-CG 4.48Å; L174-L309 HydrophobicContact CD2-CD1 4.37Å
175	L	83.1	Confident	75.5	Confident	29 Å²	29	50.1 Å²	50.1	15%	0.152	27%	0.271	C	S	.	.	H	α-helix	trans	-57.4	-26.5	172.9	-173.6	142.2	0	0	0	113	W171 N173 V222 L559	W171-L175 HydrophobicContact CH2-CD1 3.87Å; W171-L175 HydrophobicContact CZ2-CD1 3.66Å; W171-L175 HydrophobicContact CZ3-CD1 4.45Å; W171-L175 VanDerWaalsContact O-CB 3.24Å; W171-L175 WeakPolarHBondContact O-CB 3.4Å; W171-L175 PolarHBondContact O-N 2.97Å; N173-L175 PolarHBondContact O-N 3.13Å; L175-V222 HydrophobicContact CB-CG2 3.94Å; L175-V222 HydrophobicContact CD1-CG2 4.45Å; L175-V222 HydrophobicContact CG-CG2 4.39Å; L175-L559 HydrophobicContact CD1-CD1 4.05Å; L175-L559 HydrophobicContact CD2-CB 4.12Å; L175-L559 HydrophobicContact CD2-CD1 3.74Å; L175-L559 HydrophobicContact CG-CD1 4.33Å
176	I	78	Confident	73.2	Confident	32 Å²	32	53.8 Å²	53.8	16%	0.164	30%	0.3	C	S	.	.	H	α-helix	trans	-94	-43.6	178.5	-57.9	-146.3	0	0	0	112.2	N173 L174 I450 Y454 L560	N173-I176 PolarHBondContact O-N 2.62Å; N173-I176 VanDerWaalsContact O-N 3.09Å; L174-I176 PolarHBondContact O-N 3.44Å; L174-I176 VanDerWaalsContact O-N 3.13Å; I176-I450 HydrophobicContact CD1-CB 4.38Å; I176-I450 HydrophobicContact CD1-CG2 3.04Å; I176-I450 HydrophobicContact CG1-CG2 3.83Å; I176-Y454 HydrophobicContact CD1-CD2 4.41Å; I176-Y454 HydrophobicContact CG2-CD2 4.26Å; I176-L560 HydrophobicContact CD1-CD2 3.32Å; I176-L560 HydrophobicContact CD1-CG 4.24Å
177	F	77.5	Confident	71	Confident	43 Å²	43	54.4 Å²	54.4	19%	0.189	31%	0.314	C	S	.	.	H	α-helix	trans	-81.1	-24.8	-176.1	-70.6	-72.6	0	0	0	113.7	N173 L174 W213 W308 Y385 S453	N173-F177 VanDerWaalsContact O-CD2 3.24Å; N173-F177 WeakPolarHBondContact O-CD2 3.42Å; N173-F177 PolarHBondContact O-N 3.09Å; L174-F177 PolarHBondContact O-N 3.2Å; F177-W213 HydrophobicContact CB-CH2 3.35Å; F177-W213 HydrophobicContact CB-CZ2 4.42Å; F177-W213 HydrophobicContact CB-CZ3 3.71Å; F177-W213 HydrophobicContact CD1-CH2 4.24Å; F177-W213 AromaticContact CD2-CH2 3.97Å; F177-W213 HydrophobicContact CD2-CH2 3.97Å; F177-W213 AromaticContact CG-CH2 3.62Å; F177-W213 HydrophobicContact CG-CH2 3.62Å; F177-W213 HydrophobicContact CG-CZ2 4.37Å; F177-W213 HydrophobicContact CG-CZ3 4.46Å; F177-W308 AromaticContact CE2-CD1 3.41Å; F177-W308 VanDerWaalsContact CE2-CD1 3.41Å; F177-W308 HydrophobicContact CE2-CD2 4.43Å; F177-W308 AromaticContact CE2-CE2 3.97Å; F177-W308 HydrophobicContact CE2-CG 4.11Å; F177-W308 AromaticContact CE2-NE1 3.32Å; F177-W308 VanDerWaalsContact CE2-NE1 3.32Å; F177-W308 AromaticContact CZ-CD1 3.9Å; F177-W308 HydrophobicContact CZ-CD2 4.41Å; F177-W308 HydrophobicContact CZ-CG 4.16Å; F177-Y385 WeakPolarHBondContact CZ-OH 3.42Å; F177-S453 WeakPolarHBondContact CE1-OG 3.44Å; F177-S453 WeakPolarHBondContact CE2-OG 3.42Å; F177-S453 WeakPolarHBondContact CZ-OG 3.33Å
178	A	71.5	Confident	69	Low	6 Å²	6	60.7 Å²	60.7	5%	0.05	34%	0.338	C	S	.	.	S	Bend	trans	-148.8	55.2	-173.8	0	0	0	0	0	112.5	L174 L223	L174-A178 CarbonylContact O-C 3.52Å; L174-A178 VanDerWaalsContact O-C 3.24Å; L174-A178 WeakPolarHBondContact O-CA 3.36Å; L174-A178 PolarHBondContact O-N 3.04Å; A178-L223 HydrophobicContact CB-CB 3.93Å; A178-L223 PolarHBondContact O-N 2.91Å
179	P	70.2	Confident	66.7	Low	70 Å²	70	63.3 Å²	63.3	46%	0.455	35%	0.354	S	S	.	.	B	Isolated β-bridge	trans	-63.9	149	171.6	29.4	-34.3	0	0	0	110.3	S181	P179-S181 PolarHBondContact O-N 3.21Å; P179-S181 VanDerWaalsContact O-N 3.08Å
180	I	65.6	Low	64.6	Low	40 Å²	40	69.2 Å²	69.2	21%	0.205	38%	0.38	C	S	.	.			trans	-68	108.4	166.7	-64.1	175.5	0	0	0	107.4	P205 P218 G221 L223	I180-P205 HydrophobicContact CD1-CG 4.35Å; I180-P205 HydrophobicContact CG2-CG 4.49Å; I180-P218 HydrophobicContact CD1-CB 3.75Å; I180-P218 HydrophobicContact CG1-CB 4.5Å; I180-G221 VanDerWaalsContact CD1-C 3.47Å; I180-G221 WeakPolarHBondContact CG1-O 3.39Å; I180-G221 PolarHBondContact N-O 3Å; I180-L223 HydrophobicContact CG1-CD2 4.27Å; I180-L223 HydrophobicContact CG1-CG 4.33Å
181	S	60.1	Low	62.6	Low	53 Å²	53	72.5 Å²	72.5	37%	0.371	41%	0.407	S	S	.	.			trans	-84.8	124.6	176.6	-172.3	0	0	0	0	110.8	P179 S183	P179-S181 PolarHBondContact O-N 3.21Å; P179-S181 VanDerWaalsContact O-N 3.08Å; S181-S183 PolarHBondContact O-N 3.29Å; S181-S183 WeakPolarHBondContact OG-CB 3.34Å; S181-S183 PolarHBondContact OG-N 2.85Å; S181-S183 VanDerWaalsContact OG-N 3.08Å; S181-S183 PolarHBondContact OG-OG 3.38Å
182	I	50.2	Low	60.3	Low	134 Å²	134	75 Å²	75	69%	0.687	42%	0.424	S	S	*	.	G	3₁₀ helix	trans	-65.3	-16.6	168.5	-55.2	169.2	0	0	0	110.5	N184 F185	I182-N184 VanDerWaalsContact C-N 3.26Å; I182-N184 PolarHBondContact O-N 3.26Å; I182-F185 HydrophobicContact CG2-CD2 4.13Å; I182-F185 VanDerWaalsContact O-CD2 3.26Å; I182-F185 WeakPolarHBondContact O-CD2 3.27Å; I182-F185 PolarHBondContact O-N 3.37Å
183	S	45.9	Very low	58	Low	95 Å²	95	79.9 Å²	79.9	66%	0.664	44%	0.441	S	S	*	.	G	3₁₀ helix	trans	-73.7	-10.5	-178.6	72.8	0	0	0	0	114.9	S181 F185	S181-S183 PolarHBondContact O-N 3.29Å; S181-S183 WeakPolarHBondContact OG-CB 3.34Å; S181-S183 PolarHBondContact OG-N 2.85Å; S181-S183 VanDerWaalsContact OG-N 3.08Å; S181-S183 PolarHBondContact OG-OG 3.38Å; S183-F185 VanDerWaalsContact C-N 3.26Å; S183-F185 PolarHBondContact O-N 2.86Å
184	N	38.5	Very low	56.1	Low	137 Å²	137	86.1 Å²	86.1	73%	0.733	47%	0.47	S	S	*	.	G	3₁₀ helix	trans	-85.1	4.9	177.2	-74	0.4	0	0	0	113.3	I182 S186	I182-N184 VanDerWaalsContact C-N 3.26Å; I182-N184 PolarHBondContact O-N 3.26Å; N184-S186 VanDerWaalsContact C-N 3.3Å; N184-S186 PolarHBondContact O-N 2.9Å
185	F	44.4	Very low	54.3	Low	96 Å²	96	90.8 Å²	90.8	42%	0.421	50%	0.503	S	S	.	.			trans	-80	77.1	170.6	-71.3	-76.6	0	0	0	110.6	I182 S183	I182-F185 HydrophobicContact CG2-CD2 4.13Å; I182-F185 VanDerWaalsContact O-CD2 3.26Å; I182-F185 WeakPolarHBondContact O-CD2 3.27Å; I182-F185 PolarHBondContact O-N 3.37Å; S183-F185 VanDerWaalsContact C-N 3.26Å; S183-F185 PolarHBondContact O-N 2.86Å
186	S	39.2	Very low	52.8	Low	119 Å²	119	91.9 Å²	91.9	83%	0.832	52%	0.516	S	S	*	.			trans	-101.3	97.1	160.4	64.3	0	0	0	0	108.8	N184	N184-S186 VanDerWaalsContact C-N 3.3Å; N184-S186 PolarHBondContact O-N 2.9Å
187	G	43.2	Very low	51.5	Low	50 Å²	50	96.4 Å²	96.4	52%	0.515	54%	0.535	S	S	.	.	S	Bend	trans	-163.3	141.5	173.6	0	0	0	0	0	110.8	N189 K190	G187-N189 PolarHBondContact O-N 3.25Å; G187-K190 PolarHBondContact O-N 2.97Å
188	E	48.8	Very low	50.1	Low	195 Å²	195	97.9 Å²	97.9	91%	0.911	55%	0.549	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.8	-9.4	-179.8	-72.4	-179.7	148.4	0	0	113.8
189	N	42.1	Very low	49	Very low	108 Å²	108	103.9 Å²	103.9	58%	0.578	58%	0.579	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.2	11.6	177.8	-75	-17.3	0	0	0	115	G187 S191 L192 W193	G187-N189 PolarHBondContact O-N 3.25Å; N189-S191 PolarHBondContact O-N 2.99Å; N189-S191 VanDerWaalsContact O-N 3.15Å; N189-L192 PolarHBondContact O-N 3.41Å; N189-L192 VanDerWaalsContact O-N 3.12Å; N189-W193 PolarHBondContact O-N 3.04Å
190	K	47.7	Very low	47.9	Very low	128 Å²	128	105.8 Å²	105.8	56%	0.557	58%	0.584	S	S	*	*	H	α-helix	trans	-54.2	-34.4	-179.5	-164.3	174.4	-179.3	179	0	113.7	G187 E194	G187-K190 PolarHBondContact O-N 2.97Å; K190-E194 WeakPolarHBondContact O-CG 3.48Å; K190-E194 PolarHBondContact O-N 3.31Å
191	S	49.9	Very low	47.1	Very low	95 Å²	95	105.6 Å²	105.6	66%	0.664	58%	0.583	S	S	*	*	H	α-helix	trans	-74.5	-28.7	-179.4	57.3	0	0	0	0	114.2	N189	N189-S191 PolarHBondContact O-N 2.99Å; N189-S191 VanDerWaalsContact O-N 3.15Å
192	L	43.3	Very low	46.6	Very low	118 Å²	118	107.4 Å²	107.4	62%	0.618	59%	0.587	S	S	*	*	H	α-helix	trans	-83.1	-34.6	-174.6	-146.9	133.6	0	0	0	111.2	N189 S195	N189-L192 PolarHBondContact O-N 3.41Å; N189-L192 VanDerWaalsContact O-N 3.12Å; L192-S195 PolarHBondContact O-OG 3.05Å; L192-S195 VanDerWaalsContact O-OG 3.04Å
193	W	41.8	Very low	46.3	Very low	125 Å²	125	106.5 Å²	106.5	47%	0.473	58%	0.583	S	S	.	*	H	α-helix	trans	-86.7	-23.9	-178	-71	85.7	0	0	0	114.7	N189 S195	N189-W193 PolarHBondContact O-N 3.04Å; W193-S195 PolarHBondContact O-N 3.22Å
194	E	48.4	Very low	46.4	Very low	135 Å²	135	109.3 Å²	109.3	63%	0.631	58%	0.579	S	S	*	*	H	α-helix	trans	-60.6	-28.3	171.7	-84.6	178.2	-176.3	0	0	112.5	K190	K190-E194 WeakPolarHBondContact O-CG 3.48Å; K190-E194 PolarHBondContact O-N 3.31Å
195	S	51.4	Low	47.1	Very low	98 Å²	98	103.6 Å²	103.6	69%	0.685	55%	0.549	S	S	*	.	H	α-helix	trans	-88.6	-29.8	-173.6	72.3	0	0	0	0	115	L192 W193	L192-S195 PolarHBondContact O-OG 3.05Å; L192-S195 VanDerWaalsContact O-OG 3.04Å; W193-S195 PolarHBondContact O-N 3.22Å
196	A	52.2	Low	47.2	Very low	52 Å²	52	104.3 Å²	104.3	43%	0.43	56%	0.562	S	S	.	*	H	α-helix	trans	-99.5	-51.4	-163.4	0	0	0	0	0	113.9
197	F	48.9	Very low	48.2	Very low	128 Å²	128	101.1 Å²	101.1	56%	0.561	55%	0.548	S	S	*	.			trans	-155.9	65.1	-172.5	-68.2	-78.5	0	0	0	114	L199 I200	F197-L199 PolarHBondContact O-N 3.4Å; F197-I200 HydrophobicContact CB-CB 4.28Å; F197-I200 HydrophobicContact CB-CD1 4.11Å; F197-I200 HydrophobicContact CB-CG1 4.31Å; F197-I200 HydrophobicContact CD1-CD1 3.78Å; F197-I200 HydrophobicContact CE1-CD1 4.5Å; F197-I200 HydrophobicContact CG-CD1 4.03Å; F197-I200 PolarHBondContact O-N 2.81Å
198	P	49.5	Very low	49	Very low	74 Å²	74	106.3 Å²	106.3	48%	0.481	56%	0.564	S	S	.	*	H	α-helix	trans	-56.1	-30	178.9	20.6	-31.7	0	0	0	113.1	I202	P198-I202 WeakPolarHBondContact O-CB 3.38Å; P198-I202 WeakPolarHBondContact O-CD1 3.23Å; P198-I202 WeakPolarHBondContact O-CG1 3.48Å; P198-I202 PolarHBondContact O-N 3.24Å
199	L	48.2	Very low	49.9	Very low	131 Å²	131	98.9 Å²	98.9	69%	0.686	53%	0.531	S	S	*	.	H	α-helix	trans	-71.3	-34	-178.9	-77	163	0	0	0	114.2	F197 L203	F197-L199 PolarHBondContact O-N 3.4Å; L199-L203 WeakPolarHBondContact O-CB 3.23Å; L199-L203 VanDerWaalsContact O-CD1 3.24Å; L199-L203 WeakPolarHBondContact O-CD1 3.35Å; L199-L203 PolarHBondContact O-N 2.76Å; L199-L203 VanDerWaalsContact O-N 3.14Å
200	I	46.8	Very low	51	Low	110 Å²	110	101.5 Å²	101.5	56%	0.564	54%	0.537	S	S	*	.	H	α-helix	trans	-77.1	-39.4	-174.6	-65.5	175.9	0	0	0	110.5	F197 L203 W204	F197-I200 HydrophobicContact CB-CB 4.28Å; F197-I200 HydrophobicContact CB-CD1 4.11Å; F197-I200 HydrophobicContact CB-CG1 4.31Å; F197-I200 HydrophobicContact CD1-CD1 3.78Å; F197-I200 HydrophobicContact CE1-CD1 4.5Å; F197-I200 HydrophobicContact CG-CD1 4.03Å; F197-I200 PolarHBondContact O-N 2.81Å; I200-L203 PolarHBondContact O-N 2.71Å; I200-W204 PolarHBondContact O-N 3.31Å
201	E	48.4	Very low	52.3	Low	37 Å²	37	96.2 Å²	96.2	17%	0.173	52%	0.516	C	S	.	.	H	α-helix	trans	-77.9	-25.7	179.7	-145	175.1	-168.4	0	0	112.4	W204 P205	E201-W204 CarbonylContact O-C 3.53Å; E201-P205 WeakPolarHBondContact O-CA 3.22Å; E201-P205 WeakPolarHBondContact O-CD 3.49Å
202	I	49.8	Very low	53.4	Low	90 Å²	90	97.6 Å²	97.6	46%	0.462	52%	0.515	S	S	.	.	H	α-helix	trans	-67.1	-38	165.4	-71	168.1	0	0	0	111.1	P198	P198-I202 WeakPolarHBondContact O-CB 3.38Å; P198-I202 WeakPolarHBondContact O-CD1 3.23Å; P198-I202 WeakPolarHBondContact O-CG1 3.48Å; P198-I202 PolarHBondContact O-N 3.24Å
203	L	44.5	Very low	55.1	Low	116 Å²	116	93.3 Å²	93.3	61%	0.607	49%	0.491	S	S	*	.	H	α-helix	trans	-74.1	-32.8	177.3	-104.8	90.7	0	0	0	112.6	L199 I200	L199-L203 WeakPolarHBondContact O-CB 3.23Å; L199-L203 VanDerWaalsContact O-CD1 3.24Å; L199-L203 WeakPolarHBondContact O-CD1 3.35Å; L199-L203 PolarHBondContact O-N 2.76Å; L199-L203 VanDerWaalsContact O-N 3.14Å; I200-L203 PolarHBondContact O-N 2.71Å
204	W	47.2	Very low	57	Low	154 Å²	154	88.5 Å²	88.5	58%	0.583	48%	0.48	S	S	*	.	S	Bend	trans	-145	71.7	-174.5	-157.1	-87	0	0	0	112.6	I200 E201 T206	I200-W204 PolarHBondContact O-N 3.31Å; E201-W204 CarbonylContact O-C 3.53Å; W204-T206 PolarHBondContact O-N 3.49Å
205	P	52.8	Low	58.7	Low	16 Å²	16	85 Å²	85	10%	0.104	47%	0.469	C	S	.	.			trans	-59.8	123	175.3	16.3	-26.3	0	0	0	110.8	I180 E201 G207 N209 P218	I180-P205 HydrophobicContact CD1-CG 4.35Å; I180-P205 HydrophobicContact CG2-CG 4.49Å; E201-P205 WeakPolarHBondContact O-CA 3.22Å; E201-P205 WeakPolarHBondContact O-CD 3.49Å; P205-G207 PolarHBondContact O-N 2.99Å; P205-N209 PolarHBondContact O-ND2 3.21Å; P205-P218 HydrophobicContact CG-CB 3.41Å; P205-P218 VanDerWaalsContact CG-CB 3.41Å; P205-P218 HydrophobicContact CG-CG 3.54Å
206	T	48.3	Very low	60.3	Low	111 Å²	111	80.8 Å²	80.8	68%	0.681	44%	0.44	S	S	*	.			trans	-84	100.3	179	39.3	0	0	0	0	109.8	W204	W204-T206 PolarHBondContact O-N 3.49Å
207	G	59.3	Low	61.9	Low	53 Å²	53	86 Å²	86	55%	0.546	45%	0.449	S	S	.	.	S	Bend	trans	171.1	168.7	177	0	0	0	0	0	113	P205 N209	P205-G207 PolarHBondContact O-N 2.99Å; G207-N209 PolarHBondContact O-N 2.87Å; G207-N209 PolarHBondContact O-ND2 2.92Å
208	D	60.4	Low	63.5	Low	158 Å²	158	80.3 Å²	80.3	85%	0.845	42%	0.424	S	S	*	.			trans	-68.8	80.6	171.6	-86	-9.8	0	0	0	110.2	K210	D208-K210 PolarHBondContact O-N 3.49Å
209	N	67.2	Low	65	Low	40 Å²	40	82.4 Å²	82.4	21%	0.214	43%	0.426	C	S	.	.			trans	-73.2	115.1	179.4	-66.3	-45.9	0	0	0	109.7	P205 G207 A216 L223	P205-N209 PolarHBondContact O-ND2 3.21Å; G207-N209 PolarHBondContact O-N 2.87Å; G207-N209 PolarHBondContact O-ND2 2.92Å; N209-A216 WeakPolarHBondContact CB-O 3.39Å; N209-A216 PolarHBondContact O-N 3.04Å; N209-L223 HydrophobicContact CB-CD2 3.77Å
210	K	65.8	Low	66.5	Low	162 Å²	162	81.5 Å²	81.5	70%	0.704	42%	0.422	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-106.9	128.6	174.8	-67.2	-179.1	-177.9	176.2	0	110.2	D208	D208-K210 PolarHBondContact O-N 3.49Å
211	S	75.4	Confident	68	Low	17 Å²	17	78.1 Å²	78.1	12%	0.119	41%	0.413	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93	176.6	168.7	70.6	0	0	0	0	110.7	W213 G214	S211-W213 PolarHBondContact O-N 3.09Å; S211-W213 PolarHBondContact OG-N 2.64Å; S211-G214 PolarHBondContact N-O 2.96Å; S211-G214 PolarHBondContact O-N 3.13Å; S211-G214 VanDerWaalsContact O-N 3.09Å; S211-G214 PolarHBondContact OG-O 3.32Å
212	L	71.2	Confident	69.7	Low	125 Å²	125	76.3 Å²	76.3	65%	0.654	41%	0.405	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.6	-26.5	170.3	-172.7	69.6	0	0	0	112.8
213	W	79.8	Confident	71.4	Confident	28 Å²	28	73 Å²	73	11%	0.106	39%	0.388	C	S	.	.	T	Hydrogen-bonded Turn	trans	-105.8	14.6	-176.2	-57.9	-80	0	0	0	114	L174 F177 S211 P225 N230	L174-W213 HydrophobicContact CD2-CE3 4.38Å; L174-W213 HydrophobicContact CD2-CH2 4.25Å; L174-W213 HydrophobicContact CD2-CZ3 3.64Å; F177-W213 HydrophobicContact CB-CH2 3.35Å; F177-W213 HydrophobicContact CB-CZ2 4.42Å; F177-W213 HydrophobicContact CB-CZ3 3.71Å; F177-W213 HydrophobicContact CD1-CH2 4.24Å; F177-W213 AromaticContact CD2-CH2 3.97Å; F177-W213 HydrophobicContact CD2-CH2 3.97Å; F177-W213 AromaticContact CG-CH2 3.62Å; F177-W213 HydrophobicContact CG-CH2 3.62Å; F177-W213 HydrophobicContact CG-CZ2 4.37Å; F177-W213 HydrophobicContact CG-CZ3 4.46Å; S211-W213 PolarHBondContact O-N 3.09Å; S211-W213 PolarHBondContact OG-N 2.64Å; W213-P225 HydrophobicContact CB-CB 4.31Å; W213-P225 HydrophobicContact CB-CG 4.13Å; W213-P225 HydrophobicContact CD2-CG 4.41Å; W213-P225 HydrophobicContact CE3-CG 3.79Å; W213-N230 HydrophobicContact CB-CB 4.31Å; W213-N230 WeakPolarHBondContact CB-ND2 3.05Å; W213-N230 PolarHBondContact O-ND2 3.24Å
214	G	81.6	Confident	73.5	Confident	24 Å²	24	70 Å²	70	25%	0.247	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	103.4	-156	179.6	0	0	0	0	0	113.5	S211 A216	S211-G214 PolarHBondContact N-O 2.96Å; S211-G214 PolarHBondContact O-N 3.13Å; S211-G214 VanDerWaalsContact O-N 3.09Å; S211-G214 PolarHBondContact OG-O 3.32Å; G214-A216 PolarHBondContact O-N 3.34Å
215	P	84.6	Confident	75.5	Confident	60 Å²	60	63 Å²	63	39%	0.39	34%	0.343	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-56.9	137.6	-174	25.3	-34.3	0	0	0	111.2	P225 T226 D227	P215-P225 WeakPolarHBondContact O-CA 3.28Å; P215-T226 PolarHBondContact O-N 2.91Å; P215-T226 PolarHBondContact O-OG1 2.86Å; P215-T226 VanDerWaalsContact O-OG1 3.11Å; P215-D227 WeakPolarHBondContact CD-OD2 3.28Å
216	A	85	Confident	77.1	Confident	10 Å²	10	65.4 Å²	65.4	8%	0.083	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.1	152.6	-174.6	0	0	0	0	0	111.9	N209 G214 L223 W224	N209-A216 WeakPolarHBondContact CB-O 3.39Å; N209-A216 PolarHBondContact O-N 3.04Å; G214-A216 PolarHBondContact O-N 3.34Å; A216-L223 HydrophobicContact CB-CB 3.86Å; A216-W224 CarbonylContact C-O 3.5Å; A216-W224 WeakPolarHBondContact CA-O 3.39Å; A216-W224 WeakPolarHBondContact CB-O 3.31Å
217	R	84.6	Confident	79.1	Confident	163 Å²	163	63.2 Å²	63.2	62%	0.615	34%	0.342	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-107.9	134.7	173.8	-71.4	-176.3	-177.6	-158	0.6	111	W224 T226	R217-W224 PolarHBondContact N-O 3.46Å; R217-W224 PolarHBondContact O-N 3.33Å; R217-T226 HydrophobicContact CB-CG2 4.47Å; R217-T226 HydrophobicContact CG-CG2 3.73Å
218	P	82.3	Confident	80.5	Confident	7 Å²	7	68.1 Å²	68.1	5%	0.045	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72	129.5	175	32.5	-36.6	0	0	0	110.2	I180 P205 V222 L223	I180-P218 HydrophobicContact CD1-CB 3.75Å; I180-P218 HydrophobicContact CG1-CB 4.5Å; P205-P218 HydrophobicContact CG-CB 3.41Å; P205-P218 VanDerWaalsContact CG-CB 3.41Å; P205-P218 HydrophobicContact CG-CG 3.54Å; P218-V222 WeakPolarHBondContact CA-O 3.4Å; P218-L223 HydrophobicContact CB-CD2 4.15Å
219	F	82	Confident	81.8	Confident	118 Å²	118	66 Å²	66	52%	0.518	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.8	130.2	171	179.9	-109.1	0	0	0	110.3	G221 V222 W224	F219-G221 PolarHBondContact O-N 3.34Å; F219-V222 PolarHBondContact N-O 2.85Å; F219-V222 PolarHBondContact O-N 3.31Å; F219-V222 VanDerWaalsContact O-O 3.13Å; F219-W224 AromaticContact CD1-NE1 3.83Å; F219-W224 PolarHBondContact O-NE1 2.97Å
220	L	80.6	Confident	82.8	Confident	113 Å²	113	65.9 Å²	65.9	59%	0.592	33%	0.328	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.5	45.2	-177.7	-66.2	173.1	0	0	0	114	W171 V222	W171-L220 PolarHBondContact NE1-O 3.49Å; L220-V222 VanDerWaalsContact C-N 3.29Å; L220-V222 PolarHBondContact O-N 3.41Å
221	G	78	Confident	84.1	Confident	38 Å²	38	60.2 Å²	60.2	39%	0.392	30%	0.302	S	S	.	.	T	Hydrogen-bonded Turn	trans	79.7	6.3	176.7	0	0	0	0	0	115.1	I180 F219	I180-G221 VanDerWaalsContact CD1-C 3.47Å; I180-G221 WeakPolarHBondContact CG1-O 3.39Å; I180-G221 PolarHBondContact N-O 3Å; F219-G221 PolarHBondContact O-N 3.34Å
222	V	84.3	Confident	85	Confident	0 Å²	0	64 Å²	64	0%	0	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.2	146	-170.4	-179.1	0	0	0	0	111.2	L174 L175 P218 F219 L220	L174-V222 HydrophobicContact CB-CG1 3.2Å; L174-V222 HydrophobicContact CD1-CG1 4.44Å; L174-V222 HydrophobicContact CG-CG1 4.42Å; L174-V222 WeakPolarHBondContact O-CG1 3.34Å; L175-V222 HydrophobicContact CB-CG2 3.94Å; L175-V222 HydrophobicContact CD1-CG2 4.45Å; L175-V222 HydrophobicContact CG-CG2 4.39Å; P218-V222 WeakPolarHBondContact CA-O 3.4Å; F219-V222 PolarHBondContact N-O 2.85Å; F219-V222 PolarHBondContact O-N 3.31Å; F219-V222 VanDerWaalsContact O-O 3.13Å; L220-V222 VanDerWaalsContact C-N 3.29Å; L220-V222 PolarHBondContact O-N 3.41Å
223	L	85.1	Confident	86	Confident	19 Å²	19	60.5 Å²	60.5	10%	0.099	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.7	117.1	174.9	-64.3	176.2	0	0	0	110.8	A178 I180 N209 A216 P218 P225	A178-L223 HydrophobicContact CB-CB 3.93Å; A178-L223 PolarHBondContact O-N 2.91Å; I180-L223 HydrophobicContact CG1-CD2 4.27Å; I180-L223 HydrophobicContact CG1-CG 4.33Å; N209-L223 HydrophobicContact CB-CD2 3.77Å; A216-L223 HydrophobicContact CB-CB 3.86Å; P218-L223 HydrophobicContact CB-CD2 4.15Å; L223-P225 WeakPolarHBondContact O-CD 3.25Å
224	W	87.9	Confident	86.7	Confident	54 Å²	54	65.8 Å²	65.8	21%	0.205	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.4	114	178.1	-66.7	78.1	0	0	0	110.6	Y170 W171 L174 A216 R217 F219 T226	Y170-W224 HydrophobicContact CG-CZ3 4.45Å; W171-W224 HydrophobicContact CB-CH2 4.31Å; W171-W224 HydrophobicContact CB-CZ2 4.09Å; L174-W224 HydrophobicContact CD1-CD2 3.71Å; L174-W224 HydrophobicContact CD1-CE3 3.48Å; L174-W224 VanDerWaalsContact CD1-CE3 3.48Å; L174-W224 HydrophobicContact CD1-CG 4.31Å; L174-W224 HydrophobicContact CD1-CH2 4.21Å; L174-W224 HydrophobicContact CD1-CZ2 4.41Å; L174-W224 HydrophobicContact CD1-CZ3 3.75Å; A216-W224 CarbonylContact C-O 3.5Å; A216-W224 WeakPolarHBondContact CA-O 3.39Å; A216-W224 WeakPolarHBondContact CB-O 3.31Å; R217-W224 PolarHBondContact N-O 3.46Å; R217-W224 PolarHBondContact O-N 3.33Å; F219-W224 AromaticContact CD1-NE1 3.83Å; F219-W224 PolarHBondContact O-NE1 2.97Å; W224-T226 PolarHBondContact O-N 3.45Å
225	P	89.1	Confident	87.3	Confident	6 Å²	6	68.4 Å²	68.4	4%	0.039	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-52.8	134	174.5	-26.3	34.1	0	0	0	111.8	L174 W213 P215 L223 Y231 L309	L174-P225 HydrophobicContact CD2-CG 4.48Å; W213-P225 HydrophobicContact CB-CB 4.31Å; W213-P225 HydrophobicContact CB-CG 4.13Å; W213-P225 HydrophobicContact CD2-CG 4.41Å; W213-P225 HydrophobicContact CE3-CG 3.79Å; P215-P225 WeakPolarHBondContact O-CA 3.28Å; L223-P225 WeakPolarHBondContact O-CD 3.25Å; P225-Y231 HydrophobicContact CB-CE2 4.2Å; P225-Y231 WeakPolarHBondContact CD-OH 3.03Å; P225-Y231 VanDerWaalsContact O-CE2 3.3Å; P225-Y231 WeakPolarHBondContact O-CE2 3.48Å; P225-Y231 PolarHBondContact O-OH 3.38Å; P225-L309 HydrophobicContact CB-CD2 4.44Å; P225-L309 HydrophobicContact CG-CD2 4.01Å
226	T	87.6	Confident	87.8	Confident	67 Å²	67	65.6 Å²	65.6	41%	0.411	32%	0.318	S	S	.	.			trans	-87.2	-25.3	179.9	51.5	0	0	0	0	112.8	P215 R217 W224 W228	P215-T226 PolarHBondContact O-N 2.91Å; P215-T226 PolarHBondContact O-OG1 2.86Å; P215-T226 VanDerWaalsContact O-OG1 3.11Å; R217-T226 HydrophobicContact CB-CG2 4.47Å; R217-T226 HydrophobicContact CG-CG2 3.73Å; W224-T226 PolarHBondContact O-N 3.45Å; T226-W228 PolarHBondContact O-N 3.42Å
227	D	88.6	Confident	88.3	Confident	65 Å²	65	67.5 Å²	67.5	35%	0.348	33%	0.331	S	S	.	.			trans	-75.9	117.8	-175.3	-58.3	-24.6	0	0	0	110.6	P215 H229 N230 Y231	P215-D227 WeakPolarHBondContact CD-OD2 3.28Å; D227-H229 PolarHBondContact O-N 3.45Å; D227-N230 WeakPolarHBondContact O-CB 3.2Å; D227-N230 PolarHBondContact O-N 3.12Å; D227-N230 VanDerWaalsContact O-N 3.12Å; D227-Y231 WeakPolarHBondContact O-CD2 3.46Å
228	W	89.4	Confident	88.8	Confident	157 Å²	157	63.1 Å²	63.1	60%	0.595	32%	0.323	S	S	*	.	G	3₁₀ helix	trans	-63.3	-24.8	-177.6	64.3	-93.8	0	0	0	113	T226 N230 Y231 I232	T226-W228 PolarHBondContact O-N 3.42Å; W228-N230 PolarHBondContact O-N 2.96Å; W228-Y231 PolarHBondContact O-N 3.38Å; W228-I232 HydrophobicContact CE3-CB 4.3Å; W228-I232 PolarHBondContact O-N 3.18Å
229	H	88.5	Confident	89.4	Confident	114 Å²	114	65.4 Å²	65.4	53%	0.528	33%	0.334	S	S	.	.	G	3₁₀ helix	trans	-61.4	-26.5	175.4	-69.6	-69	0	0	0	113.4	D227 Y231	D227-H229 PolarHBondContact O-N 3.45Å; H229-Y231 PolarHBondContact O-N 2.74Å
230	N	88.1	Confident	90.2	Very high	36 Å²	36	60.6 Å²	60.6	19%	0.193	31%	0.314	C	S	.	.	G	3₁₀ helix	trans	-69.6	-25.2	175.4	-66	-37.8	0	0	0	112.4	W213 D227 W228 L309 S310	W213-N230 HydrophobicContact CB-CB 4.31Å; W213-N230 WeakPolarHBondContact CB-ND2 3.05Å; W213-N230 PolarHBondContact O-ND2 3.24Å; D227-N230 WeakPolarHBondContact O-CB 3.2Å; D227-N230 PolarHBondContact O-N 3.12Å; D227-N230 VanDerWaalsContact O-N 3.12Å; W228-N230 PolarHBondContact O-N 2.96Å; N230-L309 HydrophobicContact CB-CD2 4.08Å; N230-S310 WeakPolarHBondContact O-CB 3.19Å; N230-S310 PolarHBondContact O-N 2.92Å
231	Y	93.1	Very high	91	Very high	44 Å²	44	61 Å²	61	17%	0.173	31%	0.312	C	S	.	.	T	Hydrogen-bonded Turn	trans	-94.8	-42.9	178.8	-59.6	-90.1	0	0	0	111.3	Y170 P225 D227 W228 H229 L309 S310 T313	Y170-Y231 HydrophobicContact CD1-CE1 4.35Å; Y170-Y231 AromaticContact CE1-CD1 3.99Å; Y170-Y231 HydrophobicContact CE1-CD1 3.99Å; Y170-Y231 HydrophobicContact CE1-CE1 4.08Å; P225-Y231 HydrophobicContact CB-CE2 4.2Å; P225-Y231 WeakPolarHBondContact CD-OH 3.03Å; P225-Y231 VanDerWaalsContact O-CE2 3.3Å; P225-Y231 WeakPolarHBondContact O-CE2 3.48Å; P225-Y231 PolarHBondContact O-OH 3.38Å; D227-Y231 WeakPolarHBondContact O-CD2 3.46Å; W228-Y231 PolarHBondContact O-N 3.38Å; H229-Y231 PolarHBondContact O-N 2.74Å; Y231-L309 HydrophobicContact CD1-CD1 4.1Å; Y231-L309 HydrophobicContact CD1-CD2 3.71Å; Y231-L309 HydrophobicContact CD1-CG 3.66Å; Y231-L309 HydrophobicContact CD2-CD2 4.3Å; Y231-L309 HydrophobicContact CE1-CD1 3.83Å; Y231-L309 HydrophobicContact CE1-CD2 3.43Å; Y231-L309 VanDerWaalsContact CE1-CD2 3.43Å; Y231-L309 HydrophobicContact CE1-CG 3.71Å; Y231-L309 HydrophobicContact CE2-CD2 4.06Å; Y231-L309 HydrophobicContact CG-CD2 4.14Å; Y231-L309 HydrophobicContact CG-CG 4.33Å; Y231-S310 VanDerWaalsContact O-CA 3.24Å; Y231-S310 WeakPolarHBondContact O-CA 3.27Å; Y231-S310 WeakPolarHBondContact O-CB 3.26Å; Y231-T313 WeakPolarHBondContact O-CB 3.45Å; Y231-T313 WeakPolarHBondContact O-CG2 3.43Å; Y231-T313 PolarHBondContact O-OG1 2.91Å; Y231-T313 VanDerWaalsContact O-OG1 3.13Å
232	I	93.3	Very high	91.8	Very high	97 Å²	97	64.1 Å²	64.1	50%	0.497	32%	0.317	S	S	.	.			trans	-109.4	102.8	-176.2	-56.3	177.8	0	0	0	109.1	W228	W228-I232 HydrophobicContact CE3-CB 4.3Å; W228-I232 PolarHBondContact O-N 3.18Å
233	N	93.2	Very high	92.4	Very high	51 Å²	51	66.6 Å²	66.6	27%	0.273	33%	0.327	S	S	.	.			trans	-126.4	130.1	173.4	-169.8	-35.3	0	0	0	110	Q235 S236 S237 L307	N233-Q235 VanDerWaalsContact C-N 3.32Å; N233-Q235 PolarHBondContact O-N 3.28Å; N233-Q235 VanDerWaalsContact OD1-CB 3.31Å; N233-Q235 WeakPolarHBondContact OD1-CB 3.39Å; N233-Q235 PolarHBondContact OD1-N 3.2Å; N233-S236 PolarHBondContact O-N 3.3Å; N233-S237 PolarHBondContact O-N 3.28Å; N233-S237 VanDerWaalsContact O-N 3.09Å; N233-S237 PolarHBondContact O-OG 2.92Å; N233-L307 WeakPolarHBondContact ND2-CD2 3.41Å
234	I	94.4	Very high	93	Very high	138 Å²	138	67.4 Å²	67.4	71%	0.708	33%	0.331	S	S	*	.	H	α-helix	trans	-61.9	-41.1	179.2	-63.4	168.5	0	0	0	110.5	S236 S237 V238	I234-S236 VanDerWaalsContact C-N 3.34Å; I234-S236 PolarHBondContact O-N 3.04Å; I234-S237 WeakPolarHBondContact O-CB 3.46Å; I234-S237 PolarHBondContact O-N 3.13Å; I234-V238 HydrophobicContact CG2-CG2 4.24Å; I234-V238 WeakPolarHBondContact O-CG2 3.39Å; I234-V238 PolarHBondContact O-N 2.84Å
235	Q	93.3	Very high	93.4	Very high	80 Å²	80	68.1 Å²	68.1	37%	0.374	34%	0.338	S	S	.	.	H	α-helix	trans	-58.3	-47.1	178.9	-175.1	177.3	-1.8	0	0	111	N233 S237 V238 L239 M303 L307	N233-Q235 VanDerWaalsContact C-N 3.32Å; N233-Q235 PolarHBondContact O-N 3.28Å; N233-Q235 VanDerWaalsContact OD1-CB 3.31Å; N233-Q235 WeakPolarHBondContact OD1-CB 3.39Å; N233-Q235 PolarHBondContact OD1-N 3.2Å; Q235-S237 VanDerWaalsContact C-N 3.34Å; Q235-S237 PolarHBondContact O-N 3.2Å; Q235-V238 PolarHBondContact O-N 2.84Å; Q235-L239 HydrophobicContact CG-CD1 4.22Å; Q235-L239 WeakPolarHBondContact O-CB 3.5Å; Q235-L239 VanDerWaalsContact O-CG 3.28Å; Q235-L239 WeakPolarHBondContact O-CG 3.31Å; Q235-L239 PolarHBondContact O-N 3.5Å; Q235-M303 PolarHBondContact NE2-SD 3.41Å; Q235-L307 HydrophobicContact CG-CD1 4.06Å
236	S	94.7	Very high	93.8	Very high	0 Å²	0	70.5 Å²	70.5	0%	0	35%	0.35	C	S	.	.	H	α-helix	trans	-64.4	-38.7	177.5	-55.7	0	0	0	0	112.5	N233 I234 L239 V240 S310	N233-S236 PolarHBondContact O-N 3.3Å; I234-S236 VanDerWaalsContact C-N 3.34Å; I234-S236 PolarHBondContact O-N 3.04Å; S236-L239 PolarHBondContact O-N 3.46Å; S236-V240 WeakPolarHBondContact O-CG2 3.23Å; S236-V240 PolarHBondContact O-N 3.46Å; S236-S310 WeakPolarHBondContact CB-OG 3.44Å; S236-S310 PolarHBondContact OG-OG 3.11Å
237	S	96	Very high	94.2	Very high	50 Å²	50	67.3 Å²	67.3	35%	0.35	33%	0.331	S	S	.	.	H	α-helix	trans	-64	-43.4	175.9	-64.6	0	0	0	0	111.5	N233 I234 Q235 F241 S314	N233-S237 PolarHBondContact O-N 3.28Å; N233-S237 VanDerWaalsContact O-N 3.09Å; N233-S237 PolarHBondContact O-OG 2.92Å; I234-S237 WeakPolarHBondContact O-CB 3.46Å; I234-S237 PolarHBondContact O-N 3.13Å; Q235-S237 VanDerWaalsContact C-N 3.34Å; Q235-S237 PolarHBondContact O-N 3.2Å; S237-F241 VanDerWaalsContact O-CB 3.27Å; S237-F241 WeakPolarHBondContact O-CB 3.4Å; S237-F241 PolarHBondContact O-N 3.39Å; S237-S314 PolarHBondContact N-OG 2.88Å; S237-S314 PolarHBondContact OG-OG 3Å
238	V	96	Very high	94.5	Very high	72 Å²	72	65 Å²	65	44%	0.436	32%	0.32	S	S	.	.	H	α-helix	trans	-64.4	-44	175.5	172.2	0	0	0	0	110.8	I234 Q235 F241 M242	I234-V238 HydrophobicContact CG2-CG2 4.24Å; I234-V238 WeakPolarHBondContact O-CG2 3.39Å; I234-V238 PolarHBondContact O-N 2.84Å; Q235-V238 PolarHBondContact O-N 2.84Å; V238-F241 PolarHBondContact O-N 3.45Å; V238-M242 HydrophobicContact CG1-CE 4.48Å; V238-M242 HydrophobicContact CG1-CG 4.08Å; V238-M242 WeakPolarHBondContact O-CB 3.31Å; V238-M242 VanDerWaalsContact O-CG 3.23Å; V238-M242 WeakPolarHBondContact O-CG 3.49Å; V238-M242 PolarHBondContact O-N 2.87Å
239	L	95	Very high	94.8	Very high	55 Å²	55	61.2 Å²	61.2	29%	0.288	31%	0.311	S	S	.	.	H	α-helix	trans	-60.8	-48.5	178.3	-74.1	169.8	0	0	0	112.1	Q235 S236 F241 M242 Y243 M303 L307 L311	Q235-L239 HydrophobicContact CG-CD1 4.22Å; Q235-L239 WeakPolarHBondContact O-CB 3.5Å; Q235-L239 VanDerWaalsContact O-CG 3.28Å; Q235-L239 WeakPolarHBondContact O-CG 3.31Å; Q235-L239 PolarHBondContact O-N 3.5Å; S236-L239 PolarHBondContact O-N 3.46Å; L239-F241 VanDerWaalsContact C-N 3.35Å; L239-F241 PolarHBondContact O-N 2.81Å; L239-M242 PolarHBondContact O-N 3.01Å; L239-Y243 WeakPolarHBondContact O-CB 3.38Å; L239-Y243 PolarHBondContact O-N 3.31Å; L239-M303 HydrophobicContact CD1-CE 3.54Å; L239-M303 HydrophobicContact CD1-SD 3.86Å; L239-M303 HydrophobicContact CD2-CE 4.14Å; L239-L307 HydrophobicContact CD1-CD1 4.07Å; L239-L311 HydrophobicContact CB-CD2 4.47Å
240	V	97	Very high	95	Very high	16 Å²	16	56.5 Å²	56.5	10%	0.097	29%	0.29	C	S	.	.	H	α-helix	trans	-63.1	-43	177.5	171.4	0	0	0	0	110.8	S236 Y243 L244 L311 A318	S236-V240 WeakPolarHBondContact O-CG2 3.23Å; S236-V240 PolarHBondContact O-N 3.46Å; V240-Y243 PolarHBondContact O-N 2.98Å; V240-L244 HydrophobicContact CG1-CD1 4.01Å; V240-L244 HydrophobicContact CG1-CG 4.46Å; V240-L244 WeakPolarHBondContact O-CB 3.34Å; V240-L244 VanDerWaalsContact O-CG 3.31Å; V240-L244 WeakPolarHBondContact O-CG 3.28Å; V240-L244 PolarHBondContact O-N 3.47Å; V240-L311 HydrophobicContact CG2-CD2 4.05Å; V240-A318 HydrophobicContact CG1-CB 4.15Å
241	F	97.2	Very high	95.2	Very high	123 Å²	123	55.4 Å²	55.4	54%	0.539	29%	0.286	S	S	.	.	H	α-helix	trans	-61.5	-49.7	176.9	175.6	-98.9	0	0	0	111.9	S237 V238 L239 Y243 L244 L245	S237-F241 VanDerWaalsContact O-CB 3.27Å; S237-F241 WeakPolarHBondContact O-CB 3.4Å; S237-F241 PolarHBondContact O-N 3.39Å; V238-F241 PolarHBondContact O-N 3.45Å; L239-F241 VanDerWaalsContact C-N 3.35Å; L239-F241 PolarHBondContact O-N 2.81Å; F241-Y243 VanDerWaalsContact C-N 3.34Å; F241-Y243 PolarHBondContact O-N 2.7Å; F241-L244 PolarHBondContact O-N 3.45Å; F241-L245 HydrophobicContact CE1-CD2 3.98Å; F241-L245 HydrophobicContact CZ-CD2 4.31Å; F241-L245 VanDerWaalsContact O-CB 3.23Å; F241-L245 WeakPolarHBondContact O-CB 3.26Å; F241-L245 PolarHBondContact O-N 2.91Å
242	M	96.2	Very high	95.1	Very high	103 Å²	103	58.6 Å²	58.6	51%	0.507	30%	0.298	S	S	.	.	H	α-helix	trans	-64.1	-39.1	179.5	-70.1	-60	173.8	0	0	111.8	V238 L239 L245 L246	V238-M242 HydrophobicContact CG1-CE 4.48Å; V238-M242 HydrophobicContact CG1-CG 4.08Å; V238-M242 WeakPolarHBondContact O-CB 3.31Å; V238-M242 VanDerWaalsContact O-CG 3.23Å; V238-M242 WeakPolarHBondContact O-CG 3.49Å; V238-M242 PolarHBondContact O-N 2.87Å; L239-M242 PolarHBondContact O-N 3.01Å; M242-L245 PolarHBondContact O-N 2.78Å; M242-L245 HydrophobicContact SD-CD2 4.27Å; M242-L246 VanDerWaalsContact O-CB 3.28Å; M242-L246 WeakPolarHBondContact O-CB 3.35Å; M242-L246 PolarHBondContact O-N 2.81Å
243	Y	96.9	Very high	95.1	Very high	52 Å²	52	60.7 Å²	60.7	20%	0.204	30%	0.303	C	S	.	.	H	α-helix	trans	-58.5	-52.5	173.4	174.6	-107.7	0	0	0	111.6	L239 V240 F241 L245 L246 Q247 F280 S373 L380	L239-Y243 WeakPolarHBondContact O-CB 3.38Å; L239-Y243 PolarHBondContact O-N 3.31Å; V240-Y243 PolarHBondContact O-N 2.98Å; F241-Y243 VanDerWaalsContact C-N 3.34Å; F241-Y243 PolarHBondContact O-N 2.7Å; Y243-L245 PolarHBondContact O-N 3.32Å; Y243-L246 PolarHBondContact O-N 2.81Å; Y243-Q247 HydrophobicContact CE1-CG 4.31Å; Y243-Q247 HydrophobicContact CE2-CG 4.27Å; Y243-Q247 VanDerWaalsContact O-CG 3.25Å; Y243-Q247 WeakPolarHBondContact O-CG 3.38Å; Y243-Q247 PolarHBondContact O-N 3.49Å; Y243-Q247 PolarHBondContact OH-NE2 3.41Å; Y243-Q247 VanDerWaalsContact OH-NE2 3.1Å; Y243-F280 HydrophobicContact CD2-CD1 4.13Å; Y243-F280 AromaticContact CD2-CE1 3.54Å; Y243-F280 HydrophobicContact CD2-CE1 3.54Å; Y243-F280 HydrophobicContact CD2-CZ 4.36Å; Y243-F280 AromaticContact CE2-CD1 3.91Å; Y243-F280 HydrophobicContact CE2-CD1 3.91Å; Y243-F280 AromaticContact CE2-CE1 3.6Å; Y243-F280 HydrophobicContact CE2-CE1 3.6Å; Y243-F280 HydrophobicContact CE2-CZ 4.29Å; Y243-S373 WeakPolarHBondContact OH-CA 3.5Å; Y243-S373 PolarHBondContact OH-O 2.91Å; Y243-L380 HydrophobicContact CE2-CD1 4.38Å
244	L	97.3	Very high	95	Very high	36 Å²	36	60 Å²	60	19%	0.188	30%	0.299	C	S	.	.	H	α-helix	trans	-67.2	-37	-180	-67.6	177.2	0	0	0	112.4	V240 F241 Q247 C248 A318 L441	V240-L244 HydrophobicContact CG1-CD1 4.01Å; V240-L244 HydrophobicContact CG1-CG 4.46Å; V240-L244 WeakPolarHBondContact O-CB 3.34Å; V240-L244 VanDerWaalsContact O-CG 3.31Å; V240-L244 WeakPolarHBondContact O-CG 3.28Å; V240-L244 PolarHBondContact O-N 3.47Å; F241-L244 PolarHBondContact O-N 3.45Å; L244-Q247 PolarHBondContact O-N 2.85Å; L244-C248 PolarHBondContact O-N 3.11Å; L244-C248 PolarHBondContact O-SG 2.82Å; L244-A318 HydrophobicContact CD1-CB 4.02Å; L244-L441 HydrophobicContact CD1-CD1 4.46Å; L244-L441 HydrophobicContact CD2-CD2 3.88Å
245	L	96.5	Very high	94.5	Very high	69 Å²	69	57.9 Å²	57.9	36%	0.361	29%	0.294	S	S	.	.	H	α-helix	trans	-62.4	-47.9	174.8	-179.9	63.3	0	0	0	110.5	F241 M242 Y243 Q247 C248 L249	F241-L245 HydrophobicContact CE1-CD2 3.98Å; F241-L245 HydrophobicContact CZ-CD2 4.31Å; F241-L245 VanDerWaalsContact O-CB 3.23Å; F241-L245 WeakPolarHBondContact O-CB 3.26Å; F241-L245 PolarHBondContact O-N 2.91Å; M242-L245 PolarHBondContact O-N 2.78Å; M242-L245 HydrophobicContact SD-CD2 4.27Å; Y243-L245 PolarHBondContact O-N 3.32Å; L245-Q247 VanDerWaalsContact C-N 3.34Å; L245-Q247 PolarHBondContact O-N 2.99Å; L245-C248 WeakPolarHBondContact O-CB 3.24Å; L245-C248 PolarHBondContact O-N 3Å; L245-C248 VanDerWaalsContact O-N 3.11Å; L245-L249 HydrophobicContact CD1-CG 4.41Å; L245-L249 HydrophobicContact CG-CD1 4.19Å; L245-L249 HydrophobicContact CG-CG 4.42Å; L245-L249 WeakPolarHBondContact O-CG 3.41Å; L245-L249 PolarHBondContact O-N 2.77Å
246	L	96.4	Very high	94.3	Very high	55 Å²	55	58.4 Å²	58.4	29%	0.288	30%	0.299	S	S	.	.	H	α-helix	trans	-63	-40.8	178.1	-175	60.8	0	0	0	111.6	M242 Y243 C248 L249 V250 F280 L283	M242-L246 VanDerWaalsContact O-CB 3.28Å; M242-L246 WeakPolarHBondContact O-CB 3.35Å; M242-L246 PolarHBondContact O-N 2.81Å; Y243-L246 PolarHBondContact O-N 2.81Å; L246-C248 VanDerWaalsContact C-N 3.29Å; L246-C248 PolarHBondContact O-N 3.45Å; L246-L249 PolarHBondContact O-N 3.01Å; L246-V250 HydrophobicContact CD1-CG2 4.1Å; L246-V250 HydrophobicContact CG-CG2 4.36Å; L246-V250 VanDerWaalsContact O-CG2 3.31Å; L246-V250 WeakPolarHBondContact O-CG2 3.07Å; L246-V250 PolarHBondContact O-N 3Å; L246-F280 HydrophobicContact CB-CE1 4.41Å; L246-F280 HydrophobicContact CB-CZ 3.9Å; L246-F280 HydrophobicContact CD2-CD1 4.46Å; L246-F280 HydrophobicContact CD2-CE1 3.69Å; L246-F280 HydrophobicContact CD2-CE2 4.32Å; L246-F280 HydrophobicContact CD2-CZ 3.61Å; L246-F280 HydrophobicContact CG-CE1 4.17Å; L246-F280 HydrophobicContact CG-CE2 4.22Å; L246-F280 HydrophobicContact CG-CZ 3.59Å; L246-L283 HydrophobicContact CD2-CD1 3.66Å
247	Q	96.3	Very high	93.9	Very high	1 Å²	1	59.8 Å²	59.8	1%	0.005	31%	0.314	C	S	.	.	H	α-helix	trans	-56.8	-43.8	172.4	-70.7	-73.4	0.9	0	0	111.5	Y243 L244 L245 A251 F280 T369 M376	Y243-Q247 HydrophobicContact CE1-CG 4.31Å; Y243-Q247 HydrophobicContact CE2-CG 4.27Å; Y243-Q247 VanDerWaalsContact O-CG 3.25Å; Y243-Q247 WeakPolarHBondContact O-CG 3.38Å; Y243-Q247 PolarHBondContact O-N 3.49Å; Y243-Q247 PolarHBondContact OH-NE2 3.41Å; Y243-Q247 VanDerWaalsContact OH-NE2 3.1Å; L244-Q247 PolarHBondContact O-N 2.85Å; L245-Q247 VanDerWaalsContact C-N 3.34Å; L245-Q247 PolarHBondContact O-N 2.99Å; Q247-A251 WeakPolarHBondContact O-CB 3.42Å; Q247-A251 PolarHBondContact O-N 3.43Å; Q247-F280 HydrophobicContact CG-CE2 4.24Å; Q247-F280 HydrophobicContact CG-CZ 3.78Å; Q247-T369 HydrophobicContact CB-CG2 4.24Å; Q247-M376 PolarHBondContact NE2-SD 3.2Å
248	C	95.3	Very high	93.4	Very high	17 Å²	17	64 Å²	64	12%	0.115	32%	0.322	C	S	.	.	H	α-helix	trans	-65.6	-44	177	-71.1	0	0	0	0	112.6	L244 L245 L246 A251 R252 I364	L244-C248 PolarHBondContact O-N 3.11Å; L244-C248 PolarHBondContact O-SG 2.82Å; L245-C248 WeakPolarHBondContact O-CB 3.24Å; L245-C248 PolarHBondContact O-N 3Å; L245-C248 VanDerWaalsContact O-N 3.11Å; L246-C248 VanDerWaalsContact C-N 3.29Å; L246-C248 PolarHBondContact O-N 3.45Å; C248-A251 PolarHBondContact O-N 3.45Å; C248-R252 WeakPolarHBondContact O-CB 3.3Å; C248-R252 PolarHBondContact O-N 3.43Å; C248-I364 HydrophobicContact CB-CD1 3.76Å
249	L	95.1	Very high	93	Very high	77 Å²	77	64.1 Å²	64.1	40%	0.403	32%	0.318	S	S	.	.	H	α-helix	trans	-63	-47.3	179.1	-69.9	176.5	0	0	0	111.1	L245 L246 R252 F253	L245-L249 HydrophobicContact CD1-CG 4.41Å; L245-L249 HydrophobicContact CG-CD1 4.19Å; L245-L249 HydrophobicContact CG-CG 4.42Å; L245-L249 WeakPolarHBondContact O-CG 3.41Å; L245-L249 PolarHBondContact O-N 2.77Å; L246-L249 PolarHBondContact O-N 3.01Å; L249-R252 PolarHBondContact O-N 3.08Å; L249-F253 HydrophobicContact CB-CD2 4.48Å; L249-F253 HydrophobicContact CD2-CD2 3.83Å; L249-F253 HydrophobicContact CD2-CE2 3.71Å; L249-F253 WeakPolarHBondContact O-CB 3.4Å; L249-F253 PolarHBondContact O-N 3.26Å
250	V	94.1	Very high	92.5	Very high	14 Å²	14	61.9 Å²	61.9	9%	0.085	31%	0.307	C	S	.	.	H	α-helix	trans	-65.4	-42.4	177.8	179.6	0	0	0	0	110.6	L246 R252 L254 N272 S276	L246-V250 HydrophobicContact CD1-CG2 4.1Å; L246-V250 HydrophobicContact CG-CG2 4.36Å; L246-V250 VanDerWaalsContact O-CG2 3.31Å; L246-V250 WeakPolarHBondContact O-CG2 3.07Å; L246-V250 PolarHBondContact O-N 3Å; V250-R252 VanDerWaalsContact C-N 3.27Å; V250-R252 PolarHBondContact O-N 3.03Å; V250-L254 HydrophobicContact CG1-CB 4.05Å; V250-L254 HydrophobicContact CG1-CD2 3.76Å; V250-L254 WeakPolarHBondContact O-CB 3.46Å; V250-L254 PolarHBondContact O-N 3.28Å; V250-N272 PolarHBondContact O-ND2 3.48Å; V250-S276 WeakPolarHBondContact CG1-OG 3.4Å
251	A	92.5	Very high	91.6	Very high	13 Å²	13	65.1 Å²	65.1	11%	0.107	33%	0.327	C	S	.	.	H	α-helix	trans	-61	-34.8	176.8	0	0	0	0	0	113	Q247 C248 T369	Q247-A251 WeakPolarHBondContact O-CB 3.42Å; Q247-A251 PolarHBondContact O-N 3.43Å; C248-A251 PolarHBondContact O-N 3.45Å; A251-T369 HydrophobicContact CB-CG2 4.15Å
252	R	90.9	Very high	90.2	Very high	112 Å²	112	60.2 Å²	60.2	42%	0.423	31%	0.307	S	S	.	.	H	α-helix	trans	-88.2	-46.4	-176.4	179.2	58.1	-173.1	94.3	-1.9	114.4	C248 L249 V250 G363 I364	C248-R252 WeakPolarHBondContact O-CB 3.3Å; C248-R252 PolarHBondContact O-N 3.43Å; L249-R252 PolarHBondContact O-N 3.08Å; V250-R252 VanDerWaalsContact C-N 3.27Å; V250-R252 PolarHBondContact O-N 3.03Å; R252-G363 WeakPolarHBondContact CD-O 3.49Å; R252-I364 HydrophobicContact CB-CD1 4.37Å; R252-I364 HydrophobicContact CB-CG1 3.8Å; R252-I364 HydrophobicContact CG-CG1 4.36Å
253	F	91.7	Very high	88.4	Confident	140 Å²	140	59 Å²	59	61%	0.614	32%	0.321	S	S	*	.	H	α-helix	trans	-104.8	-21.8	-162.5	-66.2	-68.7	0	0	0	113.5	L249 P255	L249-F253 HydrophobicContact CB-CD2 4.48Å; L249-F253 HydrophobicContact CD2-CD2 3.83Å; L249-F253 HydrophobicContact CD2-CE2 3.71Å; L249-F253 WeakPolarHBondContact O-CB 3.4Å; L249-F253 PolarHBondContact O-N 3.26Å; F253-P255 WeakPolarHBondContact O-CD 3.42Å; F253-P255 VanDerWaalsContact O-N 3.16Å
254	L	91.5	Very high	86.4	Confident	37 Å²	37	63.7 Å²	63.7	19%	0.194	35%	0.345	C	S	.	.			trans	-69.1	113.9	177.6	-173	70.8	0	0	0	109.3	V250 I256 N272 I275 I279	V250-L254 HydrophobicContact CG1-CB 4.05Å; V250-L254 HydrophobicContact CG1-CD2 3.76Å; V250-L254 WeakPolarHBondContact O-CB 3.46Å; V250-L254 PolarHBondContact O-N 3.28Å; L254-I256 HydrophobicContact CD1-CD1 4.28Å; L254-I256 HydrophobicContact CD1-CG1 4.42Å; L254-I256 HydrophobicContact CG-CB 4.46Å; L254-I256 HydrophobicContact CG-CG1 4.45Å; L254-I256 PolarHBondContact O-N 3.26Å; L254-N272 HydrophobicContact CD2-CB 4.25Å; L254-I275 HydrophobicContact CD2-CB 4.15Å; L254-I275 HydrophobicContact CD2-CG2 3.72Å; L254-I279 HydrophobicContact CD2-CD1 4.38Å
255	P	85.1	Confident	84.3	Confident	93 Å²	93	71.3 Å²	71.3	60%	0.604	37%	0.371	S	S	*	.			trans	-76.7	-8.5	-171.1	31.3	-35	0	0	0	113.1	F253 R270	F253-P255 WeakPolarHBondContact O-CD 3.42Å; F253-P255 VanDerWaalsContact O-N 3.16Å; P255-R270 PolarHBondContact O-NH1 3.24Å
256	I	87.9	Confident	82.2	Confident	91 Å²	91	74.4 Å²	74.4	47%	0.467	39%	0.388	S	S	.	.			trans	-85.4	133.7	-174.7	-43.6	173.2	0	0	0	109.8	L254 N272 I275	L254-I256 HydrophobicContact CD1-CD1 4.28Å; L254-I256 HydrophobicContact CD1-CG1 4.42Å; L254-I256 HydrophobicContact CG-CB 4.46Å; L254-I256 HydrophobicContact CG-CG1 4.45Å; L254-I256 PolarHBondContact O-N 3.26Å; I256-N272 WeakPolarHBondContact O-CB 3.11Å; I256-I275 HydrophobicContact CB-CD1 3.56Å; I256-I275 HydrophobicContact CD1-CD1 4.22Å; I256-I275 HydrophobicContact CG1-CD1 4.5Å; I256-I275 HydrophobicContact CG2-CD1 3.16Å
257	G	86.3	Confident	80.6	Confident	30 Å²	30	74.5 Å²	74.5	31%	0.309	39%	0.388	S	S	.	.	S	Bend	trans	138.2	154.3	175	0	0	0	0	0	113	M259 C271	G257-M259 PolarHBondContact O-N 3.32Å; G257-C271 WeakPolarHBondContact CA-O 3.31Å
258	R	86.3	Confident	79.6	Confident	139 Å²	139	78.3 Å²	78.3	53%	0.525	41%	0.408	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.2	131.2	177.7	-178.5	179	179.8	177.4	3.6	110	C271 H419	R258-C271 HydrophobicContact CB-CB 4.39Å; R258-C271 PolarHBondContact N-O 2.95Å; R258-C271 PolarHBondContact O-N 3.45Å; R258-H419 PolarHBondContact NH1-CD2 2.88Å
259	M	86.8	Confident	79.1	Confident	73 Å²	73	78 Å²	78	36%	0.36	41%	0.405	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.4	132	172.4	-68.4	-69.2	-101.9	0	0	110.5	G257 D268 Y269 R270	G257-M259 PolarHBondContact O-N 3.32Å; M259-D268 HydrophobicContact CE-CB 3.2Å; M259-D268 WeakPolarHBondContact CE-OD2 3.32Å; M259-D268 HydrophobicContact SD-CB 3.94Å; M259-Y269 WeakPolarHBondContact CA-O 3.46Å; M259-R270 HydrophobicContact CE-CG 4.4Å; M259-R270 HydrophobicContact CG-CG 4.44Å; M259-R270 HydrophobicContact SD-CB 4.32Å; M259-R270 HydrophobicContact SD-CG 3.15Å; M259-R270 WeakPolarHBondContact SD-CG 3.36Å
260	V	84.8	Confident	78.9	Confident	9 Å²	9	78.8 Å²	78.8	6%	0.055	40%	0.402	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	115.4	173.4	179.4	0	0	0	0	108.9	T262 Y269 H419 F423	V260-T262 HydrophobicContact CG1-CG2 4.47Å; V260-T262 PolarHBondContact O-N 2.61Å; V260-Y269 PolarHBondContact N-O 3.47Å; V260-Y269 PolarHBondContact O-N 2.91Å; V260-H419 HydrophobicContact CG2-CB 3.82Å; V260-F423 HydrophobicContact CG1-CE2 3.52Å; V260-F423 HydrophobicContact CG1-CZ 3.49Å; V260-F423 VanDerWaalsContact CG1-CZ 3.49Å
261	T	78.9	Confident	78.8	Confident	84 Å²	84	79 Å²	79	52%	0.515	40%	0.404	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.1	115.9	173.5	51.2	0	0	0	0	109.6	D268	T261-D268 WeakPolarHBondContact CG2-OD1 3.25Å
262	T	67.1	Low	78.9	Confident	20 Å²	20	78.4 Å²	78.4	12%	0.123	40%	0.399	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95	117.1	175	58.8	0	0	0	0	109.8	V260 H264 I267	V260-T262 HydrophobicContact CG1-CG2 4.47Å; V260-T262 PolarHBondContact O-N 2.61Å; T262-H264 PolarHBondContact O-N 3.29Å; T262-I267 PolarHBondContact N-O 3.17Å; T262-I267 PolarHBondContact OG1-O 3.33Å; T262-I267 VanDerWaalsContact OG1-O 3.1Å
263	G	57.9	Low	79	Confident	78 Å²	78	73.1 Å²	73.1	80%	0.804	38%	0.379	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.7	6.8	-159.2	0	0	0	0	0	118.5
264	H	54.7	Low	79.1	Confident	150 Å²	150	69.9 Å²	69.9	69%	0.694	37%	0.368	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.9	-26.2	177.6	-152.5	55.3	0	0	0	113.1	T262	T262-H264 PolarHBondContact O-N 3.29Å
265	R	53.3	Low	79.3	Confident	196 Å²	196	70.8 Å²	70.8	74%	0.74	37%	0.373	S	S	*	.	T	Hydrogen-bonded Turn	trans	-154.8	22.3	-175.3	-81.1	-170.8	-178.4	173.6	-1.3	114.2	I267	R265-I267 HydrophobicContact CB-CD1 3.48Å; R265-I267 VanDerWaalsContact CB-CD1 3.48Å; R265-I267 HydrophobicContact CB-CG1 3.46Å; R265-I267 VanDerWaalsContact CB-CG1 3.46Å; R265-I267 HydrophobicContact CG-CD1 4.35Å; R265-I267 WeakPolarHBondContact O-CG1 3.48Å; R265-I267 PolarHBondContact O-N 3.1Å
266	N	53.4	Low	79.7	Confident	134 Å²	134	66.4 Å²	66.4	72%	0.717	34%	0.344	S	S	*	.	T	Hydrogen-bonded Turn	trans	48	46.2	-169.9	-70.3	-15.4	0	0	0	111.4
267	I	62.3	Low	80.1	Confident	57 Å²	57	63.4 Å²	63.4	29%	0.292	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.4	122.3	-179.1	-46.4	176.4	0	0	0	108.9	T262 R265	T262-I267 PolarHBondContact N-O 3.17Å; T262-I267 PolarHBondContact OG1-O 3.33Å; T262-I267 VanDerWaalsContact OG1-O 3.1Å; R265-I267 HydrophobicContact CB-CD1 3.48Å; R265-I267 VanDerWaalsContact CB-CD1 3.48Å; R265-I267 HydrophobicContact CB-CG1 3.46Å; R265-I267 VanDerWaalsContact CB-CG1 3.46Å; R265-I267 HydrophobicContact CG-CD1 4.35Å; R265-I267 WeakPolarHBondContact O-CG1 3.48Å; R265-I267 PolarHBondContact O-N 3.1Å
268	D	75	Confident	80.6	Confident	80 Å²	80	66.5 Å²	66.5	43%	0.428	34%	0.34	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.7	125.1	-175.9	-61.5	-24.3	0	0	0	110.9	M259 T261	M259-D268 HydrophobicContact CE-CB 3.2Å; M259-D268 WeakPolarHBondContact CE-OD2 3.32Å; M259-D268 HydrophobicContact SD-CB 3.94Å; T261-D268 WeakPolarHBondContact CG2-OD1 3.25Å
269	Y	86.1	Confident	81.1	Confident	10 Å²	10	62.8 Å²	62.8	4%	0.039	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	132.3	168.6	173.4	-104.2	0	0	0	109.7	M259 V260 C271 D365 M368 R372 E418	M259-Y269 WeakPolarHBondContact CA-O 3.46Å; V260-Y269 PolarHBondContact N-O 3.47Å; V260-Y269 PolarHBondContact O-N 2.91Å; Y269-C271 HydrophobicContact CE1-CB 4.42Å; Y269-D365 HydrophobicContact CD2-CB 3.77Å; Y269-D365 HydrophobicContact CE2-CB 4.08Å; Y269-M368 HydrophobicContact CD2-CB 4.49Å; Y269-M368 HydrophobicContact CD2-CG 4.41Å; Y269-M368 HydrophobicContact CE1-CE 4.04Å; Y269-M368 HydrophobicContact CE1-CG 3.8Å; Y269-M368 HydrophobicContact CE2-CB 3.88Å; Y269-M368 HydrophobicContact CE2-CG 3.61Å; Y269-M368 WeakPolarHBondContact OH-CG 3.43Å; Y269-R372 VanDerWaalsContact OH-CD 3.31Å; Y269-R372 WeakPolarHBondContact OH-CD 3.37Å; Y269-R372 PolarHBondContact OH-NH1 2.94Å; Y269-E418 HydrophobicContact CE1-CG 4.24Å; Y269-E418 VanDerWaalsContact CE1-OE1 3.31Å; Y269-E418 WeakPolarHBondContact CE1-OE1 3.39Å; Y269-E418 VanDerWaalsContact CZ-OE1 3.25Å; Y269-E418 PolarHBondContact OH-OE1 3.48Å
270	R	89.9	Confident	81.5	Confident	95 Å²	95	60 Å²	60	36%	0.358	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.7	114.8	173.1	-74.3	-177.5	-168.1	-90.8	-5.3	110.3	P255 M259 N272	P255-R270 PolarHBondContact O-NH1 3.24Å; M259-R270 HydrophobicContact CE-CG 4.4Å; M259-R270 HydrophobicContact CG-CG 4.44Å; M259-R270 HydrophobicContact SD-CB 4.32Å; M259-R270 HydrophobicContact SD-CG 3.15Å; M259-R270 WeakPolarHBondContact SD-CG 3.36Å; R270-N272 PolarHBondContact O-N 2.59Å
271	C	91.8	Very high	82.1	Confident	17 Å²	17	61.8 Å²	61.8	12%	0.115	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.6	90.9	170.7	-64.5	0	0	0	0	110	G257 R258 Y269 E418 H419	G257-C271 WeakPolarHBondContact CA-O 3.31Å; R258-C271 HydrophobicContact CB-CB 4.39Å; R258-C271 PolarHBondContact N-O 2.95Å; R258-C271 PolarHBondContact O-N 3.45Å; Y269-C271 HydrophobicContact CE1-CB 4.42Å; C271-E418 WeakPolarHBondContact CA-OE2 3.24Å; C271-E418 HydrophobicContact CB-CB 4.28Å; C271-E418 HydrophobicContact CB-CG 4.15Å; C271-E418 WeakPolarHBondContact CB-OE2 3.35Å; C271-H419 VanDerWaalsContact SG-CA 3.55Å
272	N	94.3	Very high	83	Confident	2 Å²	2	59.6 Å²	59.6	1%	0.011	32%	0.319	C	S	.	.			trans	-123.2	18.3	-178.3	72.3	2.6	0	0	0	113	V250 L254 I256 R270 L274 I275 S276 R372 E418	V250-N272 PolarHBondContact O-ND2 3.48Å; L254-N272 HydrophobicContact CD2-CB 4.25Å; I256-N272 WeakPolarHBondContact O-CB 3.11Å; R270-N272 PolarHBondContact O-N 2.59Å; N272-L274 PolarHBondContact O-N 2.71Å; N272-I275 PolarHBondContact O-N 3.08Å; N272-S276 WeakPolarHBondContact O-CB 3.5Å; N272-S276 PolarHBondContact O-N 3.43Å; N272-S276 PolarHBondContact O-OG 3.03Å; N272-R372 PolarHBondContact OD1-NH1 3.22Å; N272-R372 PolarHBondContact OD1-NH2 2.69Å; N272-E418 PolarHBondContact N-OE2 3.27Å; N272-E418 VanDerWaalsContact N-OE2 3.15Å
273	S	94.2	Very high	84.3	Confident	0 Å²	0	62.6 Å²	62.6	0%	0	33%	0.334	C	S	.	.	H	α-helix	trans	-61.4	-40.7	-177.9	-70.7	0	0	0	0	113.7	S276 F277 R372 E418	S273-S276 WeakPolarHBondContact O-CB 3.46Å; S273-S276 PolarHBondContact O-N 3.44Å; S273-F277 WeakPolarHBondContact O-CB 3.24Å; S273-F277 PolarHBondContact O-N 2.89Å; S273-R372 WeakPolarHBondContact OG-CD 3.19Å; S273-R372 VanDerWaalsContact OG-CG 3.28Å; S273-R372 WeakPolarHBondContact OG-CG 3.35Å; S273-R372 VanDerWaalsContact OG-CZ 3.3Å; S273-R372 PolarHBondContact OG-NE 3.48Å; S273-E418 VanDerWaalsContact CB-CD 3.44Å; S273-E418 WeakPolarHBondContact CB-OE2 3.4Å; S273-E418 PolarHBondContact N-OE2 2.8Å; S273-E418 PolarHBondContact OG-OE1 2.9Å; S273-E418 PolarHBondContact OG-OE2 2.73Å; S273-E418 VanDerWaalsContact OG-OE2 3.1Å
274	L	94.4	Very high	86.1	Confident	73 Å²	73	59.8 Å²	59.8	38%	0.382	30%	0.3	S	S	.	.	H	α-helix	trans	-64.2	-43.6	-178.7	-173.9	66.1	0	0	0	112	N272 S276 F277 V278 L412 F415 I416	N272-L274 PolarHBondContact O-N 2.71Å; L274-S276 VanDerWaalsContact C-N 3.34Å; L274-F277 WeakPolarHBondContact O-CB 3.5Å; L274-F277 PolarHBondContact O-N 2.65Å; L274-V278 WeakPolarHBondContact O-CG2 3.2Å; L274-V278 PolarHBondContact O-N 2.85Å; L274-L412 HydrophobicContact CD1-CD1 3.49Å; L274-L412 VanDerWaalsContact CD1-CD1 3.49Å; L274-F415 HydrophobicContact CB-CB 4.42Å; L274-F415 HydrophobicContact CD1-CB 4.36Å; L274-I416 HydrophobicContact CD1-CG1 4.45Å
275	I	94.1	Very high	88	Confident	56 Å²	56	54.4 Å²	54.4	29%	0.287	28%	0.281	S	S	.	.	H	α-helix	trans	-68.7	-39.5	177.5	-60.6	167.6	0	0	0	110.1	L254 I256 N272 F277 V278 I279	L254-I275 HydrophobicContact CD2-CB 4.15Å; L254-I275 HydrophobicContact CD2-CG2 3.72Å; I256-I275 HydrophobicContact CB-CD1 3.56Å; I256-I275 HydrophobicContact CD1-CD1 4.22Å; I256-I275 HydrophobicContact CG1-CD1 4.5Å; I256-I275 HydrophobicContact CG2-CD1 3.16Å; N272-I275 PolarHBondContact O-N 3.08Å; I275-F277 VanDerWaalsContact C-N 3.26Å; I275-F277 PolarHBondContact O-N 3.1Å; I275-V278 PolarHBondContact O-N 3.32Å; I275-I279 HydrophobicContact CG2-CD1 4.09Å; I275-I279 WeakPolarHBondContact O-CG1 3.29Å; I275-I279 PolarHBondContact O-N 2.5Å
276	S	94.8	Very high	90	Very high	0 Å²	0	51.4 Å²	51.4	0%	0	27%	0.273	C	S	.	.	H	α-helix	trans	-57.7	-44.6	172.9	-52.4	0	0	0	0	110.4	V250 N272 S273 L274 V278 I279 F280 R372	V250-S276 WeakPolarHBondContact CG1-OG 3.4Å; N272-S276 WeakPolarHBondContact O-CB 3.5Å; N272-S276 PolarHBondContact O-N 3.43Å; N272-S276 PolarHBondContact O-OG 3.03Å; S273-S276 WeakPolarHBondContact O-CB 3.46Å; S273-S276 PolarHBondContact O-N 3.44Å; L274-S276 VanDerWaalsContact C-N 3.34Å; S276-V278 VanDerWaalsContact C-N 3.34Å; S276-V278 PolarHBondContact O-N 3.4Å; S276-I279 WeakPolarHBondContact O-CB 3.16Å; S276-I279 PolarHBondContact O-N 3.24Å; S276-I279 VanDerWaalsContact O-N 3.14Å; S276-F280 VanDerWaalsContact O-CD2 3.27Å; S276-F280 WeakPolarHBondContact O-CD2 3.41Å; S276-F280 PolarHBondContact O-N 3.43Å; S276-R372 PolarHBondContact OG-NH2 3.15Å
277	F	96.2	Very high	91.9	Very high	29 Å²	29	45.9 Å²	45.9	13%	0.127	25%	0.247	C	C	.	.	H	α-helix	trans	-59.2	-44.6	177.5	-176	-124.1	0	0	0	112.2	S273 L274 I275 I279 F280 I281 M376 P379 F415	S273-F277 WeakPolarHBondContact O-CB 3.24Å; S273-F277 PolarHBondContact O-N 2.89Å; L274-F277 WeakPolarHBondContact O-CB 3.5Å; L274-F277 PolarHBondContact O-N 2.65Å; I275-F277 VanDerWaalsContact C-N 3.26Å; I275-F277 PolarHBondContact O-N 3.1Å; F277-I279 VanDerWaalsContact C-N 3.34Å; F277-I279 PolarHBondContact O-N 3.13Å; F277-F280 PolarHBondContact O-N 3.46Å; F277-I281 HydrophobicContact CD1-CG1 4.49Å; F277-I281 HydrophobicContact CD2-CD1 4.5Å; F277-I281 HydrophobicContact CD2-CG1 3.88Å; F277-I281 HydrophobicContact CE1-CG1 4.19Å; F277-I281 HydrophobicContact CE2-CD1 3.73Å; F277-I281 HydrophobicContact CE2-CG1 3.55Å; F277-I281 HydrophobicContact CG-CG1 4.36Å; F277-I281 HydrophobicContact CZ-CD1 3.88Å; F277-I281 HydrophobicContact CZ-CG1 3.72Å; F277-I281 WeakPolarHBondContact O-CB 3.43Å; F277-I281 VanDerWaalsContact O-CG1 3.25Å; F277-I281 WeakPolarHBondContact O-CG1 3.15Å; F277-I281 PolarHBondContact O-N 2.99Å; F277-M376 HydrophobicContact CB-CE 4.18Å; F277-M376 HydrophobicContact CD2-CG 4.1Å; F277-P379 HydrophobicContact CE2-CB 4.27Å; F277-P379 HydrophobicContact CE2-CG 3.61Å; F277-P379 HydrophobicContact CZ-CB 4.34Å; F277-P379 HydrophobicContact CZ-CG 4.06Å; F277-F415 HydrophobicContact CB-CD2 3.59Å; F277-F415 HydrophobicContact CB-CE2 3.62Å; F277-F415 HydrophobicContact CD1-CD2 4.05Å; F277-F415 HydrophobicContact CD1-CE2 4.28Å; F277-F415 HydrophobicContact CD2-CD2 4.11Å; F277-F415 AromaticContact CD2-CE2 3.5Å; F277-F415 HydrophobicContact CD2-CE2 3.5Å; F277-F415 HydrophobicContact CE2-CE2 4.19Å; F277-F415 AromaticContact CG-CD2 3.65Å; F277-F415 HydrophobicContact CG-CD2 3.65Å; F277-F415 AromaticContact CG-CE2 3.53Å; F277-F415 HydrophobicContact CG-CE2 3.53Å
278	V	96	Very high	93.4	Very high	95 Å²	95	43.7 Å²	43.7	58%	0.576	24%	0.235	S	C	*	.	H	α-helix	trans	-60.4	-42.6	174.4	175	0	0	0	0	111.6	L274 I275 S276 G282	L274-V278 WeakPolarHBondContact O-CG2 3.2Å; L274-V278 PolarHBondContact O-N 2.85Å; I275-V278 PolarHBondContact O-N 3.32Å; S276-V278 VanDerWaalsContact C-N 3.34Å; S276-V278 PolarHBondContact O-N 3.4Å; V278-G282 PolarHBondContact O-N 3.41Å
279	I	96.2	Very high	94.2	Very high	61 Å²	61	45.7 Å²	45.7	31%	0.313	25%	0.245	S	C	.	.	H	α-helix	trans	-61.7	-49.4	177	-67.9	165.4	0	0	0	110.7	L254 I275 S276 F277 G282 L283	L254-I279 HydrophobicContact CD2-CD1 4.38Å; I275-I279 HydrophobicContact CG2-CD1 4.09Å; I275-I279 WeakPolarHBondContact O-CG1 3.29Å; I275-I279 PolarHBondContact O-N 2.5Å; S276-I279 WeakPolarHBondContact O-CB 3.16Å; S276-I279 PolarHBondContact O-N 3.24Å; S276-I279 VanDerWaalsContact O-N 3.14Å; F277-I279 VanDerWaalsContact C-N 3.34Å; F277-I279 PolarHBondContact O-N 3.13Å; I279-G282 PolarHBondContact O-N 3.17Å; I279-L283 HydrophobicContact CG2-CD1 3.99Å; I279-L283 HydrophobicContact CG2-CG 4.4Å; I279-L283 WeakPolarHBondContact O-CB 3.05Å; I279-L283 VanDerWaalsContact O-CG 3.31Å; I279-L283 WeakPolarHBondContact O-CG 3.28Å; I279-L283 PolarHBondContact O-N 3.03Å
280	F	96.9	Very high	94.4	Very high	13 Å²	13	46.3 Å²	46.3	6%	0.057	25%	0.25	C	S	.	.	H	α-helix	trans	-68.7	-37.6	-177.7	-84.4	-87	0	0	0	112.7	Y243 L246 Q247 S276 F277 L283 F284 M376 L380	Y243-F280 HydrophobicContact CD2-CD1 4.13Å; Y243-F280 AromaticContact CD2-CE1 3.54Å; Y243-F280 HydrophobicContact CD2-CE1 3.54Å; Y243-F280 HydrophobicContact CD2-CZ 4.36Å; Y243-F280 AromaticContact CE2-CD1 3.91Å; Y243-F280 HydrophobicContact CE2-CD1 3.91Å; Y243-F280 AromaticContact CE2-CE1 3.6Å; Y243-F280 HydrophobicContact CE2-CE1 3.6Å; Y243-F280 HydrophobicContact CE2-CZ 4.29Å; L246-F280 HydrophobicContact CB-CE1 4.41Å; L246-F280 HydrophobicContact CB-CZ 3.9Å; L246-F280 HydrophobicContact CD2-CD1 4.46Å; L246-F280 HydrophobicContact CD2-CE1 3.69Å; L246-F280 HydrophobicContact CD2-CE2 4.32Å; L246-F280 HydrophobicContact CD2-CZ 3.61Å; L246-F280 HydrophobicContact CG-CE1 4.17Å; L246-F280 HydrophobicContact CG-CE2 4.22Å; L246-F280 HydrophobicContact CG-CZ 3.59Å; Q247-F280 HydrophobicContact CG-CE2 4.24Å; Q247-F280 HydrophobicContact CG-CZ 3.78Å; S276-F280 VanDerWaalsContact O-CD2 3.27Å; S276-F280 WeakPolarHBondContact O-CD2 3.41Å; S276-F280 PolarHBondContact O-N 3.43Å; F277-F280 PolarHBondContact O-N 3.46Å; F280-L283 PolarHBondContact O-N 3.33Å; F280-F284 WeakPolarHBondContact O-CB 3.42Å; F280-F284 PolarHBondContact O-N 3.35Å; F280-M376 HydrophobicContact CB-CG 4.39Å; F280-M376 HydrophobicContact CB-SD 3.55Å; F280-M376 VanDerWaalsContact CB-SD 3.55Å; F280-M376 HydrophobicContact CD1-SD 4.26Å; F280-M376 HydrophobicContact CD2-CE 4.29Å; F280-M376 HydrophobicContact CD2-SD 3.26Å; F280-M376 WeakPolarHBondContact CD2-SD 3.49Å; F280-M376 HydrophobicContact CE2-SD 3.97Å; F280-M376 HydrophobicContact CG-SD 3.43Å; F280-M376 WeakPolarHBondContact CG-SD 2.79Å; F280-L380 HydrophobicContact CB-CD1 4.47Å
281	I	96.6	Very high	94.2	Very high	47 Å²	47	50.3 Å²	50.3	24%	0.241	27%	0.273	C	S	.	.	H	α-helix	trans	-65.6	-40.5	171.8	-68.1	-71.5	0	0	0	110.7	F277 F284 A285 L380 L383	F277-I281 HydrophobicContact CD1-CG1 4.49Å; F277-I281 HydrophobicContact CD2-CD1 4.5Å; F277-I281 HydrophobicContact CD2-CG1 3.88Å; F277-I281 HydrophobicContact CE1-CG1 4.19Å; F277-I281 HydrophobicContact CE2-CD1 3.73Å; F277-I281 HydrophobicContact CE2-CG1 3.55Å; F277-I281 HydrophobicContact CG-CG1 4.36Å; F277-I281 HydrophobicContact CZ-CD1 3.88Å; F277-I281 HydrophobicContact CZ-CG1 3.72Å; F277-I281 WeakPolarHBondContact O-CB 3.43Å; F277-I281 VanDerWaalsContact O-CG1 3.25Å; F277-I281 WeakPolarHBondContact O-CG1 3.15Å; F277-I281 PolarHBondContact O-N 2.99Å; I281-F284 PolarHBondContact O-N 3.47Å; I281-A285 WeakPolarHBondContact O-CB 3.2Å; I281-A285 PolarHBondContact O-N 2.82Å; I281-L380 HydrophobicContact CD1-CD2 3.86Å; I281-L383 HydrophobicContact CD1-CD1 3.66Å
282	G	96.6	Very high	93.8	Very high	38 Å²	38	52.6 Å²	52.6	39%	0.392	29%	0.288	S	S	.	.	H	α-helix	trans	-63.4	-42.8	175.3	0	0	0	0	0	112.8	V278 I279 A285 F286	V278-G282 PolarHBondContact O-N 3.41Å; I279-G282 PolarHBondContact O-N 3.17Å; G282-A285 PolarHBondContact O-N 3.35Å; G282-F286 VanDerWaalsContact O-CB 3.29Å; G282-F286 WeakPolarHBondContact O-CB 3.37Å; G282-F286 PolarHBondContact O-N 3.21Å
283	L	95	Very high	93.2	Very high	84 Å²	84	57.9 Å²	57.9	44%	0.44	32%	0.321	S	S	.	.	H	α-helix	trans	-64	-41.6	174.4	-73.1	172.8	0	0	0	111.8	L246 I279 F280 A287	L246-L283 HydrophobicContact CD2-CD1 3.66Å; I279-L283 HydrophobicContact CG2-CD1 3.99Å; I279-L283 HydrophobicContact CG2-CG 4.4Å; I279-L283 WeakPolarHBondContact O-CB 3.05Å; I279-L283 VanDerWaalsContact O-CG 3.31Å; I279-L283 WeakPolarHBondContact O-CG 3.28Å; I279-L283 PolarHBondContact O-N 3.03Å; F280-L283 PolarHBondContact O-N 3.33Å; L283-A287 WeakPolarHBondContact O-CB 3.07Å; L283-A287 PolarHBondContact O-N 2.91Å
284	F	95.6	Very high	92.5	Very high	19 Å²	19	62.7 Å²	62.7	8%	0.083	35%	0.351	C	S	.	.	H	α-helix	trans	-61.7	-50.8	174.6	-179.3	-82.3	0	0	0	111.3	F280 I281 F286 A287 E288 P300 L380 L383 T384 F387	F280-F284 WeakPolarHBondContact O-CB 3.42Å; F280-F284 PolarHBondContact O-N 3.35Å; I281-F284 PolarHBondContact O-N 3.47Å; F284-F286 VanDerWaalsContact C-N 3.32Å; F284-F286 PolarHBondContact O-N 3.48Å; F284-A287 PolarHBondContact O-N 3.02Å; F284-A287 VanDerWaalsContact O-N 3.15Å; F284-E288 HydrophobicContact CE1-CB 4.39Å; F284-E288 WeakPolarHBondContact O-CB 3.16Å; F284-E288 PolarHBondContact O-N 2.9Å; F284-P300 HydrophobicContact CD2-CB 3.94Å; F284-P300 HydrophobicContact CD2-CG 3.92Å; F284-P300 HydrophobicContact CE2-CB 3.32Å; F284-P300 HydrophobicContact CE2-CG 3.79Å; F284-P300 HydrophobicContact CZ-CB 3.83Å; F284-P300 HydrophobicContact CZ-CG 4.3Å; F284-L380 HydrophobicContact CB-CD2 3.77Å; F284-L380 HydrophobicContact CD2-CD2 3.92Å; F284-L380 HydrophobicContact CG-CD2 3.95Å; F284-L383 HydrophobicContact CD1-CB 4.47Å; F284-L383 HydrophobicContact CD1-CD1 4.34Å; F284-L383 HydrophobicContact CE1-CB 3.75Å; F284-L383 HydrophobicContact CE1-CD1 4.38Å; F284-L383 HydrophobicContact CZ-CB 3.82Å; F284-T384 WeakPolarHBondContact CE2-OG1 3.32Å; F284-F387 AromaticContact CE1-CD2 3.89Å; F284-F387 HydrophobicContact CE1-CD2 3.89Å; F284-F387 AromaticContact CE1-CE2 3.9Å; F284-F387 HydrophobicContact CE1-CE2 3.9Å; F284-F387 HydrophobicContact CZ-CD2 4.31Å
285	A	95.3	Very high	91.9	Very high	37 Å²	37	60.4 Å²	60.4	31%	0.306	34%	0.34	S	S	.	.	H	α-helix	trans	-62	-40	179.7	0	0	0	0	0	111.8	I281 G282 E288 I289	I281-A285 WeakPolarHBondContact O-CB 3.2Å; I281-A285 PolarHBondContact O-N 2.82Å; G282-A285 PolarHBondContact O-N 3.35Å; A285-E288 PolarHBondContact O-N 3.42Å; A285-I289 WeakPolarHBondContact O-CB 3.27Å; A285-I289 VanDerWaalsContact O-CG1 3.29Å; A285-I289 WeakPolarHBondContact O-CG1 3.45Å; A285-I289 PolarHBondContact O-N 3.46Å
286	F	94.7	Very high	91.1	Very high	132 Å²	132	65.2 Å²	65.2	58%	0.579	35%	0.354	S	S	*	.	H	α-helix	trans	-60.9	-46.2	173.3	178.1	-99.5	0	0	0	111.6	G282 F284 E288 S290	G282-F286 VanDerWaalsContact O-CB 3.29Å; G282-F286 WeakPolarHBondContact O-CB 3.37Å; G282-F286 PolarHBondContact O-N 3.21Å; F284-F286 VanDerWaalsContact C-N 3.32Å; F284-F286 PolarHBondContact O-N 3.48Å; F286-E288 VanDerWaalsContact C-N 3.34Å; F286-E288 PolarHBondContact O-N 3.5Å; F286-S290 WeakPolarHBondContact O-CB 3.49Å; F286-S290 PolarHBondContact O-N 3.02Å
287	A	93.7	Very high	90.6	Very high	19 Å²	19	71.5 Å²	71.5	16%	0.157	39%	0.388	C	S	.	.	H	α-helix	trans	-66.6	-33.4	178.7	0	0	0	0	0	113.3	L283 F284 P300	L283-A287 WeakPolarHBondContact O-CB 3.07Å; L283-A287 PolarHBondContact O-N 2.91Å; F284-A287 PolarHBondContact O-N 3.02Å; F284-A287 VanDerWaalsContact O-N 3.15Å; A287-P300 HydrophobicContact CB-CG 3.97Å
288	E	94	Very high	90.1	Very high	10 Å²	10	74.2 Å²	74.2	5%	0.047	40%	0.403	C	S	.	.	H	α-helix	trans	-75.2	-42.4	179.9	-170.7	63.4	-151.1	0	0	112.4	F284 A285 F286 P300 S301 F387	F284-E288 HydrophobicContact CE1-CB 4.39Å; F284-E288 WeakPolarHBondContact O-CB 3.16Å; F284-E288 PolarHBondContact O-N 2.9Å; A285-E288 PolarHBondContact O-N 3.42Å; F286-E288 VanDerWaalsContact C-N 3.34Å; F286-E288 PolarHBondContact O-N 3.5Å; E288-P300 VanDerWaalsContact OE2-CD 3.28Å; E288-P300 WeakPolarHBondContact OE2-CD 3.44Å; E288-S301 VanDerWaalsContact CD-OG 3.28Å; E288-S301 WeakPolarHBondContact OE1-CB 3.25Å; E288-S301 PolarHBondContact OE1-OG 3.49Å; E288-S301 WeakPolarHBondContact OE2-CB 3.37Å; E288-S301 PolarHBondContact OE2-N 3.32Å; E288-S301 VanDerWaalsContact OE2-N 3.1Å; E288-S301 PolarHBondContact OE2-OG 3.27Å; E288-F387 HydrophobicContact CG-CB 4.45Å; E288-F387 HydrophobicContact CG-CD1 3.97Å; E288-F387 HydrophobicContact CG-CD2 3.99Å; E288-F387 HydrophobicContact CG-CE1 4.19Å; E288-F387 HydrophobicContact CG-CE2 4.24Å; E288-F387 HydrophobicContact CG-CG 3.88Å; E288-F387 HydrophobicContact CG-CZ 4.33Å; E288-F387 WeakPolarHBondContact OE1-CB 3.3Å
289	I	92.1	Very high	89.9	Confident	123 Å²	123	71.8 Å²	71.8	63%	0.631	39%	0.385	S	S	*	.	H	α-helix	trans	-88.6	-27.6	-173.4	-60.3	168.1	0	0	0	112.2	A285 E291	A285-I289 WeakPolarHBondContact O-CB 3.27Å; A285-I289 VanDerWaalsContact O-CG1 3.29Å; A285-I289 WeakPolarHBondContact O-CG1 3.45Å; A285-I289 PolarHBondContact O-N 3.46Å; I289-E291 PolarHBondContact O-N 3.33Å
290	S	90	Very high	89.7	Confident	22 Å²	22	69.4 Å²	69.4	15%	0.154	37%	0.373	C	S	.	.			trans	-62	123.1	-174.4	-172.4	0	0	0	0	112.4	F286 C292	F286-S290 WeakPolarHBondContact O-CB 3.49Å; F286-S290 PolarHBondContact O-N 3.02Å; S290-C292 VanDerWaalsContact C-N 3.28Å; S290-C292 WeakPolarHBondContact OG-CB 3.35Å; S290-C292 PolarHBondContact OG-N 2.79Å
291	E	85	Confident	89.5	Confident	180 Å²	180	68.8 Å²	68.8	84%	0.841	37%	0.37	S	S	*	.			trans	-85.6	0.7	174	-61.6	-175.1	176.4	0	0	113.2	I289 T293	I289-E291 PolarHBondContact O-N 3.33Å; E291-T293 PolarHBondContact O-N 3.38Å
292	C	84	Confident	89.1	Confident	64 Å²	64	70.6 Å²	70.6	43%	0.432	38%	0.378	S	S	.	.			trans	-59.2	129.4	178.3	-174.4	0	0	0	0	110.1	S290 T294 V295 R296	S290-C292 VanDerWaalsContact C-N 3.28Å; S290-C292 WeakPolarHBondContact OG-CB 3.35Å; S290-C292 PolarHBondContact OG-N 2.79Å; C292-T294 PolarHBondContact O-N 3.5Å; C292-T294 VanDerWaalsContact O-N 3.09Å; C292-T294 PolarHBondContact SG-OG1 3.41Å; C292-T294 VanDerWaalsContact SG-OG1 3.4Å; C292-V295 HydrophobicContact CB-CB 4.33Å; C292-V295 HydrophobicContact CB-CG2 4.19Å; C292-V295 CarbonylContact O-C 3.59Å; C292-V295 PolarHBondContact O-N 2.98Å; C292-R296 WeakPolarHBondContact O-CB 3.12Å; C292-R296 PolarHBondContact O-N 3.15Å
293	T	80.7	Confident	88.9	Confident	114 Å²	114	69.9 Å²	69.9	70%	0.699	37%	0.365	S	S	*	.	H	α-helix	trans	-54.2	-35.1	-173.4	50.5	0	0	0	0	113.4	E291	E291-T293 PolarHBondContact O-N 3.38Å
294	T	80.3	Confident	88.7	Confident	101 Å²	101	67.7 Å²	67.7	62%	0.62	35%	0.353	S	S	*	.	H	α-helix	trans	-71.9	-34.3	177	55.3	0	0	0	0	113.2	C292	C292-T294 PolarHBondContact O-N 3.5Å; C292-T294 VanDerWaalsContact O-N 3.09Å; C292-T294 PolarHBondContact SG-OG1 3.41Å; C292-T294 VanDerWaalsContact SG-OG1 3.4Å
295	V	81.1	Confident	88.4	Confident	25 Å²	25	67.6 Å²	67.6	15%	0.152	35%	0.354	C	S	.	.	H	α-helix	trans	-89.2	-25.4	-177	-173.8	0	0	0	0	111.4	C292 N297 L298 K299	C292-V295 HydrophobicContact CB-CB 4.33Å; C292-V295 HydrophobicContact CB-CG2 4.19Å; C292-V295 CarbonylContact O-C 3.59Å; C292-V295 PolarHBondContact O-N 2.98Å; V295-N297 PolarHBondContact O-N 2.84Å; V295-L298 CarbonylContact O-C 3.53Å; V295-L298 WeakPolarHBondContact O-CA 3.44Å; V295-L298 WeakPolarHBondContact O-CB 3.44Å; V295-L298 PolarHBondContact O-N 3.43Å; V295-K299 PolarHBondContact O-N 3.38Å
296	R	79.2	Confident	88.1	Confident	156 Å²	156	71 Å²	71	59%	0.589	37%	0.368	S	S	*	.	H	α-helix	trans	-56.1	-37.3	178.7	-176.1	176.7	176.5	171.7	0.4	112.8	C292 L298 K299	C292-R296 WeakPolarHBondContact O-CB 3.12Å; C292-R296 PolarHBondContact O-N 3.15Å; R296-L298 PolarHBondContact O-N 2.88Å; R296-K299 WeakPolarHBondContact O-CG 3.34Å; R296-K299 PolarHBondContact O-N 3.48Å
297	N	83	Confident	87.9	Confident	133 Å²	133	65.5 Å²	65.5	71%	0.711	34%	0.344	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.8	-12.1	176.5	-66.5	-20.1	0	0	0	113.4	V295	V295-N297 PolarHBondContact O-N 2.84Å
298	L	86	Confident	87.9	Confident	85 Å²	85	64.9 Å²	64.9	45%	0.445	34%	0.338	S	S	.	.	T	Hydrogen-bonded Turn	trans	-102.9	10.6	179.3	-61.1	175.7	0	0	0	112.6	V295 R296 P300 M303	V295-L298 CarbonylContact O-C 3.53Å; V295-L298 WeakPolarHBondContact O-CA 3.44Å; V295-L298 WeakPolarHBondContact O-CB 3.44Å; V295-L298 PolarHBondContact O-N 3.43Å; R296-L298 PolarHBondContact O-N 2.88Å; L298-P300 WeakPolarHBondContact O-CD 3.43Å; L298-P300 VanDerWaalsContact O-N 3.08Å; L298-M303 HydrophobicContact CD2-SD 4.15Å
299	K	91	Very high	87.8	Confident	45 Å²	45	64.6 Å²	64.6	20%	0.196	34%	0.336	C	S	.	.			trans	-51	115.3	175.6	-83.9	-174.9	169.8	-152.4	0	110.5	V295 R296 S301 Q302 M303 E391	V295-K299 PolarHBondContact O-N 3.38Å; R296-K299 WeakPolarHBondContact O-CG 3.34Å; R296-K299 PolarHBondContact O-N 3.48Å; K299-S301 VanDerWaalsContact C-N 3.31Å; K299-S301 PolarHBondContact O-N 2.97Å; K299-Q302 HydrophobicContact CB-CB 4.34Å; K299-Q302 HydrophobicContact CB-CG 4.34Å; K299-Q302 PolarHBondContact O-N 3.38Å; K299-M303 VanDerWaalsContact O-CB 3.25Å; K299-M303 WeakPolarHBondContact O-CB 3.14Å; K299-M303 PolarHBondContact O-N 2.94Å; K299-E391 IonicContact NZ-OE1 3.92Å
300	P	92.7	Very high	87.9	Confident	10 Å²	10	58.9 Å²	58.9	7%	0.065	31%	0.308	C	S	.	.	H	α-helix	trans	-54.9	-44.4	-177	-29	35.3	0	0	0	113.3	F284 A287 E288 L298 Q302 M303 L304 T384	F284-P300 HydrophobicContact CD2-CB 3.94Å; F284-P300 HydrophobicContact CD2-CG 3.92Å; F284-P300 HydrophobicContact CE2-CB 3.32Å; F284-P300 HydrophobicContact CE2-CG 3.79Å; F284-P300 HydrophobicContact CZ-CB 3.83Å; F284-P300 HydrophobicContact CZ-CG 4.3Å; A287-P300 HydrophobicContact CB-CG 3.97Å; E288-P300 VanDerWaalsContact OE2-CD 3.28Å; E288-P300 WeakPolarHBondContact OE2-CD 3.44Å; L298-P300 WeakPolarHBondContact O-CD 3.43Å; L298-P300 VanDerWaalsContact O-N 3.08Å; P300-Q302 VanDerWaalsContact C-N 3.28Å; P300-Q302 PolarHBondContact O-N 3.38Å; P300-M303 PolarHBondContact O-N 3.17Å; P300-L304 HydrophobicContact CB-CD1 3.9Å; P300-L304 HydrophobicContact CB-CG 4.39Å; P300-L304 WeakPolarHBondContact O-CB 3.33Å; P300-L304 WeakPolarHBondContact O-CG 3.11Å; P300-L304 PolarHBondContact O-N 3.18Å; P300-T384 WeakPolarHBondContact O-CG2 3.45Å
301	S	92	Very high	88.2	Confident	0 Å²	0	58.8 Å²	58.8	0%	0	31%	0.305	C	S	.	.	H	α-helix	trans	-54.7	-38.6	179	55.5	0	0	0	0	113.8	E288 K299 P305 R388 E391	E288-S301 VanDerWaalsContact CD-OG 3.28Å; E288-S301 WeakPolarHBondContact OE1-CB 3.25Å; E288-S301 PolarHBondContact OE1-OG 3.49Å; E288-S301 WeakPolarHBondContact OE2-CB 3.37Å; E288-S301 PolarHBondContact OE2-N 3.32Å; E288-S301 VanDerWaalsContact OE2-N 3.1Å; E288-S301 PolarHBondContact OE2-OG 3.27Å; K299-S301 VanDerWaalsContact C-N 3.31Å; K299-S301 PolarHBondContact O-N 2.97Å; S301-P305 WeakPolarHBondContact O-CD 3.36Å; S301-P305 VanDerWaalsContact O-CG 3.28Å; S301-P305 WeakPolarHBondContact O-CG 3.28Å; S301-R388 WeakPolarHBondContact O-CD 3.38Å; S301-E391 PolarHBondContact OG-OE1 2.71Å; S301-E391 PolarHBondContact OG-OE2 3.18Å
302	Q	89.3	Confident	88.8	Confident	86 Å²	86	50.2 Å²	50.2	40%	0.402	27%	0.265	S	S	.	.	H	α-helix	trans	-89.1	-36.4	-178.3	-60.4	-176.7	-8	0	0	112.3	K299 P300 N306 E391	K299-Q302 HydrophobicContact CB-CB 4.34Å; K299-Q302 HydrophobicContact CB-CG 4.34Å; K299-Q302 PolarHBondContact O-N 3.38Å; P300-Q302 VanDerWaalsContact C-N 3.28Å; P300-Q302 PolarHBondContact O-N 3.38Å; Q302-N306 PolarHBondContact O-ND2 2.88Å; Q302-E391 VanDerWaalsContact CG-OE2 3.26Å; Q302-E391 WeakPolarHBondContact CG-OE2 3.18Å; Q302-E391 PolarHBondContact NE2-OE1 2.98Å; Q302-E391 PolarHBondContact NE2-OE2 3.07Å
303	M	91.2	Very high	89.3	Confident	23 Å²	23	48 Å²	48	11%	0.113	25%	0.249	C	C	.	.	H	α-helix	trans	-80.7	-51.3	-173.6	-178.9	-172.8	67.2	0	0	112.5	Q235 L239 L298 K299 P300 N306 L307	Q235-M303 PolarHBondContact NE2-SD 3.41Å; L239-M303 HydrophobicContact CD1-CE 3.54Å; L239-M303 HydrophobicContact CD1-SD 3.86Å; L239-M303 HydrophobicContact CD2-CE 4.14Å; L298-M303 HydrophobicContact CD2-SD 4.15Å; K299-M303 VanDerWaalsContact O-CB 3.25Å; K299-M303 WeakPolarHBondContact O-CB 3.14Å; K299-M303 PolarHBondContact O-N 2.94Å; P300-M303 PolarHBondContact O-N 3.17Å; M303-N306 PolarHBondContact O-N 3.44Å; M303-L307 HydrophobicContact CG-CD1 3.63Å; M303-L307 HydrophobicContact CG-CG 4.41Å; M303-L307 WeakPolarHBondContact O-CG 3.34Å; M303-L307 PolarHBondContact O-N 2.57Å; M303-L307 VanDerWaalsContact O-N 3.13Å; M303-L307 HydrophobicContact SD-CD1 4.3Å
304	L	92.2	Very high	90.1	Very high	38 Å²	38	42.9 Å²	42.9	20%	0.199	22%	0.218	C	C	.	.	H	α-helix	trans	-67.7	-40.9	-167.3	-64.8	176.4	0	0	0	113.9	P300 N306 L307 W308 L311 T384	P300-L304 HydrophobicContact CB-CD1 3.9Å; P300-L304 HydrophobicContact CB-CG 4.39Å; P300-L304 WeakPolarHBondContact O-CB 3.33Å; P300-L304 WeakPolarHBondContact O-CG 3.11Å; P300-L304 PolarHBondContact O-N 3.18Å; L304-N306 VanDerWaalsContact C-N 3.31Å; L304-N306 PolarHBondContact O-N 3.42Å; L304-L307 CarbonylContact O-C 3.46Å; L304-L307 PolarHBondContact O-N 2.94Å; L304-W308 PolarHBondContact O-N 3.27Å; L304-L311 HydrophobicContact CB-CD1 4.32Å; L304-L311 HydrophobicContact CD2-CD1 3.68Å; L304-T384 HydrophobicContact CB-CG2 3.84Å; L304-T384 HydrophobicContact CD1-CG2 4.06Å; L304-T384 WeakPolarHBondContact CD1-OG1 3.39Å; L304-T384 HydrophobicContact CG-CG2 4.48Å
305	P	88.9	Confident	90.9	Very high	16 Å²	16	38.7 Å²	38.7	10%	0.104	19%	0.193	C	C	.	.	H	α-helix	trans	-61.9	-38.7	176.4	-25.5	37.3	0	0	0	112.7	S301 L307 W308 T384 Y385 R388	S301-P305 WeakPolarHBondContact O-CD 3.36Å; S301-P305 VanDerWaalsContact O-CG 3.28Å; S301-P305 WeakPolarHBondContact O-CG 3.28Å; P305-L307 VanDerWaalsContact C-N 3.3Å; P305-L307 PolarHBondContact O-N 3.27Å; P305-W308 VanDerWaalsContact O-CB 3.28Å; P305-W308 WeakPolarHBondContact O-CB 3.03Å; P305-W308 PolarHBondContact O-N 3.3Å; P305-T384 HydrophobicContact CG-CG2 3.99Å; P305-Y385 HydrophobicContact CG-CE1 4.43Å; P305-R388 HydrophobicContact CG-CG 4.28Å
306	N	88.1	Confident	91.6	Very high	109 Å²	109	38.3 Å²	38.3	58%	0.583	19%	0.192	S	C	*	.	H	α-helix	trans	-66.8	-34.7	177.4	-67.9	-17.7	0	0	0	111.7	Q302 M303 L304 W308	Q302-N306 PolarHBondContact O-ND2 2.88Å; M303-N306 PolarHBondContact O-N 3.44Å; L304-N306 VanDerWaalsContact C-N 3.31Å; L304-N306 PolarHBondContact O-N 3.42Å; N306-W308 VanDerWaalsContact C-N 3.34Å
307	L	91.9	Very high	92.4	Very high	16 Å²	16	35.4 Å²	35.4	8%	0.084	19%	0.187	C	C	.	.	T	Hydrogen-bonded Turn	trans	-87.5	5.1	177.7	-64.7	179.6	0	0	0	113.8	N233 Q235 L239 M303 L304 P305 L309 S310 L311	N233-L307 WeakPolarHBondContact ND2-CD2 3.41Å; Q235-L307 HydrophobicContact CG-CD1 4.06Å; L239-L307 HydrophobicContact CD1-CD1 4.07Å; M303-L307 HydrophobicContact CG-CD1 3.63Å; M303-L307 HydrophobicContact CG-CG 4.41Å; M303-L307 WeakPolarHBondContact O-CG 3.34Å; M303-L307 PolarHBondContact O-N 2.57Å; M303-L307 VanDerWaalsContact O-N 3.13Å; M303-L307 HydrophobicContact SD-CD1 4.3Å; L304-L307 CarbonylContact O-C 3.46Å; L304-L307 PolarHBondContact O-N 2.94Å; P305-L307 VanDerWaalsContact C-N 3.3Å; P305-L307 PolarHBondContact O-N 3.27Å; L307-L309 PolarHBondContact O-N 3.49Å; L307-S310 CarbonylContact O-C 3.58Å; L307-S310 PolarHBondContact O-N 3Å; L307-S310 PolarHBondContact O-OG 3.36Å; L307-L311 HydrophobicContact CB-CD1 4.07Å; L307-L311 HydrophobicContact CB-CG 4.08Å; L307-L311 WeakPolarHBondContact O-CG 3.45Å; L307-L311 PolarHBondContact O-N 3.43Å
308	W	92.5	Very high	93.1	Very high	7 Å²	7	30.2 Å²	30.2	3%	0.027	16%	0.163	C	C	.	.	H	α-helix	trans	-50.7	-50.5	-168.5	-176.9	-106	0	0	0	114.3	N173 F177 L304 P305 N306 S310 L311 L312 I381 Y385 F446	N173-W308 VanDerWaalsContact OD1-CZ2 3.29Å; N173-W308 WeakPolarHBondContact OD1-CZ2 3.4Å; N173-W308 PolarHBondContact OD1-NE1 3.47Å; F177-W308 AromaticContact CE2-CD1 3.41Å; F177-W308 VanDerWaalsContact CE2-CD1 3.41Å; F177-W308 HydrophobicContact CE2-CD2 4.43Å; F177-W308 AromaticContact CE2-CE2 3.97Å; F177-W308 HydrophobicContact CE2-CG 4.11Å; F177-W308 AromaticContact CE2-NE1 3.32Å; F177-W308 VanDerWaalsContact CE2-NE1 3.32Å; F177-W308 AromaticContact CZ-CD1 3.9Å; F177-W308 HydrophobicContact CZ-CD2 4.41Å; F177-W308 HydrophobicContact CZ-CG 4.16Å; L304-W308 PolarHBondContact O-N 3.27Å; P305-W308 VanDerWaalsContact O-CB 3.28Å; P305-W308 WeakPolarHBondContact O-CB 3.03Å; P305-W308 PolarHBondContact O-N 3.3Å; N306-W308 VanDerWaalsContact C-N 3.34Å; W308-S310 VanDerWaalsContact C-N 3.34Å; W308-S310 PolarHBondContact O-N 3.11Å; W308-L311 PolarHBondContact O-N 2.89Å; W308-L312 PolarHBondContact O-N 3.04Å; W308-I381 HydrophobicContact CH2-CD1 4.29Å; W308-I381 HydrophobicContact CH2-CG2 4Å; W308-I381 HydrophobicContact CZ3-CD1 4.23Å; W308-I381 HydrophobicContact CZ3-CG1 4.37Å; W308-I381 HydrophobicContact CZ3-CG2 3.8Å; W308-Y385 HydrophobicContact CZ3-CE2 4.38Å; W308-F446 HydrophobicContact CD2-CD1 4.42Å; W308-F446 HydrophobicContact CD2-CE1 4.48Å; W308-F446 AromaticContact CE2-CD1 3.89Å; W308-F446 HydrophobicContact CE3-CE1 4.38Å; W308-F446 AromaticContact CH2-CD1 3.72Å; W308-F446 HydrophobicContact CH2-CD1 3.72Å; W308-F446 HydrophobicContact CH2-CE1 4.15Å; W308-F446 AromaticContact CZ2-CD1 3.54Å; W308-F446 HydrophobicContact CZ2-CD1 3.54Å; W308-F446 HydrophobicContact CZ2-CE1 4.26Å; W308-F446 HydrophobicContact CZ2-CG 4.45Å; W308-F446 HydrophobicContact CZ3-CD1 4.24Å; W308-F446 HydrophobicContact CZ3-CE1 4.21Å
309	L	93.1	Very high	93.6	Very high	3 Å²	3	26.2 Å²	26.2	2%	0.016	14%	0.142	C	C	.	.	H	α-helix	trans	-67.2	-36.1	-178.3	-168.1	64	0	0	0	112.4	Y170 L174 P225 N230 Y231 L307 L312 T313	Y170-L309 HydrophobicContact CD1-CD1 3.56Å; Y170-L309 HydrophobicContact CE1-CD1 3.53Å; Y170-L309 HydrophobicContact CE1-CG 4.37Å; L174-L309 HydrophobicContact CD2-CD1 4.37Å; P225-L309 HydrophobicContact CB-CD2 4.44Å; P225-L309 HydrophobicContact CG-CD2 4.01Å; N230-L309 HydrophobicContact CB-CD2 4.08Å; Y231-L309 HydrophobicContact CD1-CD1 4.1Å; Y231-L309 HydrophobicContact CD1-CD2 3.71Å; Y231-L309 HydrophobicContact CD1-CG 3.66Å; Y231-L309 HydrophobicContact CD2-CD2 4.3Å; Y231-L309 HydrophobicContact CE1-CD1 3.83Å; Y231-L309 HydrophobicContact CE1-CD2 3.43Å; Y231-L309 VanDerWaalsContact CE1-CD2 3.43Å; Y231-L309 HydrophobicContact CE1-CG 3.71Å; Y231-L309 HydrophobicContact CE2-CD2 4.06Å; Y231-L309 HydrophobicContact CG-CD2 4.14Å; Y231-L309 HydrophobicContact CG-CG 4.33Å; L307-L309 PolarHBondContact O-N 3.49Å; L309-L312 PolarHBondContact O-N 3.27Å; L309-T313 PolarHBondContact O-N 3.44Å; L309-T313 PolarHBondContact O-OG1 3.26Å
310	S	94.6	Very high	93.7	Very high	4 Å²	4	28.2 Å²	28.2	3%	0.028	16%	0.155	C	C	.	.	H	α-helix	trans	-76	-29.4	177	63	0	0	0	0	113.2	N230 Y231 S236 L307 W308 S314	N230-S310 WeakPolarHBondContact O-CB 3.19Å; N230-S310 PolarHBondContact O-N 2.92Å; Y231-S310 VanDerWaalsContact O-CA 3.24Å; Y231-S310 WeakPolarHBondContact O-CA 3.27Å; Y231-S310 WeakPolarHBondContact O-CB 3.26Å; S236-S310 WeakPolarHBondContact CB-OG 3.44Å; S236-S310 PolarHBondContact OG-OG 3.11Å; L307-S310 CarbonylContact O-C 3.58Å; L307-S310 PolarHBondContact O-N 3Å; L307-S310 PolarHBondContact O-OG 3.36Å; W308-S310 VanDerWaalsContact C-N 3.34Å; W308-S310 PolarHBondContact O-N 3.11Å; S310-S314 VanDerWaalsContact O-CB 3.25Å; S310-S314 WeakPolarHBondContact O-CB 3.24Å; S310-S314 PolarHBondContact O-N 3.43Å; S310-S314 PolarHBondContact O-OG 2.82Å
311	L	96.2	Very high	93.9	Very high	19 Å²	19	34.4 Å²	34.4	10%	0.099	18%	0.181	C	C	.	.	H	α-helix	trans	-66.9	-42.1	169.9	-71.5	167.4	0	0	0	111.4	L239 V240 L304 L307 W308 S314 S315 F446	L239-L311 HydrophobicContact CB-CD2 4.47Å; V240-L311 HydrophobicContact CG2-CD2 4.05Å; L304-L311 HydrophobicContact CB-CD1 4.32Å; L304-L311 HydrophobicContact CD2-CD1 3.68Å; L307-L311 HydrophobicContact CB-CD1 4.07Å; L307-L311 HydrophobicContact CB-CG 4.08Å; L307-L311 WeakPolarHBondContact O-CG 3.45Å; L307-L311 PolarHBondContact O-N 3.43Å; W308-L311 PolarHBondContact O-N 2.89Å; L311-S314 PolarHBondContact O-N 2.9Å; L311-S315 VanDerWaalsContact O-CB 3.32Å; L311-S315 WeakPolarHBondContact O-CB 3.33Å; L311-S315 PolarHBondContact O-N 3.1Å; L311-S315 PolarHBondContact O-OG 2.98Å; L311-F446 HydrophobicContact CB-CE1 4.19Å; L311-F446 HydrophobicContact CB-CZ 4.13Å
312	L	95.9	Very high	94.1	Very high	0 Å²	0	35.1 Å²	35.1	0%	0	18%	0.184	C	C	.	.	H	α-helix	trans	-60.1	-48.6	173.4	172.7	56.3	0	0	0	110.9	V169 Y170 W308 L309 S315 C316 V442 F446	V169-L312 HydrophobicContact CG1-CD1 3.78Å; V169-L312 HydrophobicContact CG1-CD2 4.25Å; Y170-L312 HydrophobicContact CD1-CD2 3.52Å; Y170-L312 HydrophobicContact CD1-CG 4.31Å; Y170-L312 HydrophobicContact CD2-CD2 4.33Å; Y170-L312 HydrophobicContact CE1-CD2 3.54Å; Y170-L312 HydrophobicContact CE1-CG 3.85Å; Y170-L312 HydrophobicContact CE2-CD2 4.34Å; Y170-L312 HydrophobicContact CE2-CG 4.34Å; Y170-L312 HydrophobicContact CG-CD2 3.93Å; W308-L312 PolarHBondContact O-N 3.04Å; L309-L312 PolarHBondContact O-N 3.27Å; L312-S315 PolarHBondContact O-N 3.18Å; L312-C316 PolarHBondContact O-N 3.01Å; L312-C316 PolarHBondContact O-SG 3.19Å; L312-V442 HydrophobicContact CD1-CG1 3.73Å; L312-F446 HydrophobicContact CB-CD1 3.85Å; L312-F446 HydrophobicContact CB-CE1 3.81Å; L312-F446 HydrophobicContact CB-CG 4.29Å; L312-F446 HydrophobicContact CB-CZ 4.22Å; L312-F446 HydrophobicContact CD1-CB 3.92Å; L312-F446 HydrophobicContact CD1-CD1 4.09Å; L312-F446 HydrophobicContact CD1-CD2 3.73Å; L312-F446 HydrophobicContact CD1-CE2 4.3Å; L312-F446 HydrophobicContact CD1-CG 3.64Å; L312-F446 HydrophobicContact CG-CD1 4.45Å; L312-F446 HydrophobicContact CG-CG 4.47Å
313	T	96	Very high	94.3	Very high	17 Å²	17	31.2 Å²	31.2	10%	0.104	17%	0.166	C	C	.	.	H	α-helix	trans	-59.6	-48.6	176.8	-50.6	0	0	0	0	111.8	Y170 Y231 L309 S315 C316 L317	Y170-T313 WeakPolarHBondContact OH-CA 3.36Å; Y170-T313 WeakPolarHBondContact OH-CB 3.43Å; Y170-T313 PolarHBondContact OH-N 2.97Å; Y170-T313 PolarHBondContact OH-OG1 3.2Å; Y231-T313 WeakPolarHBondContact O-CB 3.45Å; Y231-T313 WeakPolarHBondContact O-CG2 3.43Å; Y231-T313 PolarHBondContact O-OG1 2.91Å; Y231-T313 VanDerWaalsContact O-OG1 3.13Å; L309-T313 PolarHBondContact O-N 3.44Å; L309-T313 PolarHBondContact O-OG1 3.26Å; T313-S315 VanDerWaalsContact C-N 3.29Å; T313-S315 PolarHBondContact O-N 3.42Å; T313-C316 WeakPolarHBondContact O-CB 3.43Å; T313-C316 PolarHBondContact O-N 3.07Å; T313-C316 VanDerWaalsContact O-N 3.13Å; T313-L317 HydrophobicContact CG2-CD1 4.31Å; T313-L317 WeakPolarHBondContact O-CG 3.21Å; T313-L317 PolarHBondContact O-N 2.97Å
314	S	97.2	Very high	94.5	Very high	7 Å²	7	33.5 Å²	33.5	5%	0.049	18%	0.179	C	C	.	.	H	α-helix	trans	-60.7	-39.3	179	-60.1	0	0	0	0	111.6	S237 S310 L311 L317 A318	S237-S314 PolarHBondContact N-OG 2.88Å; S237-S314 PolarHBondContact OG-OG 3Å; S310-S314 VanDerWaalsContact O-CB 3.25Å; S310-S314 WeakPolarHBondContact O-CB 3.24Å; S310-S314 PolarHBondContact O-N 3.43Å; S310-S314 PolarHBondContact O-OG 2.82Å; L311-S314 PolarHBondContact O-N 2.9Å; S314-L317 PolarHBondContact O-N 2.94Å; S314-A318 WeakPolarHBondContact O-CB 3.41Å; S314-A318 PolarHBondContact O-N 2.93Å
315	S	97.3	Very high	94.5	Very high	13 Å²	13	34.3 Å²	34.3	9%	0.091	19%	0.185	C	C	.	.	H	α-helix	trans	-69	-34.8	176.5	-58.7	0	0	0	0	112.5	L311 L312 T313 S319 F446	L311-S315 VanDerWaalsContact O-CB 3.32Å; L311-S315 WeakPolarHBondContact O-CB 3.33Å; L311-S315 PolarHBondContact O-N 3.1Å; L311-S315 PolarHBondContact O-OG 2.98Å; L312-S315 PolarHBondContact O-N 3.18Å; T313-S315 VanDerWaalsContact C-N 3.29Å; T313-S315 PolarHBondContact O-N 3.42Å; S315-S319 VanDerWaalsContact O-CB 3.28Å; S315-S319 WeakPolarHBondContact O-CB 3.33Å; S315-S319 PolarHBondContact O-N 3.21Å; S315-S319 PolarHBondContact O-OG 3.19Å; S315-F446 WeakPolarHBondContact OG-CE2 3.37Å
316	C	96	Very high	94.7	Very high	18 Å²	18	33.8 Å²	33.8	12%	0.122	18%	0.182	C	C	.	.	H	α-helix	trans	-66.7	-44.9	173.2	-68.8	0	0	0	0	111.5	L312 T313 S319 L320 V442	L312-C316 PolarHBondContact O-N 3.01Å; L312-C316 PolarHBondContact O-SG 3.19Å; T313-C316 WeakPolarHBondContact O-CB 3.43Å; T313-C316 PolarHBondContact O-N 3.07Å; T313-C316 VanDerWaalsContact O-N 3.13Å; C316-S319 WeakPolarHBondContact O-CB 3.44Å; C316-S319 PolarHBondContact O-N 3.13Å; C316-L320 WeakPolarHBondContact O-CB 3.35Å; C316-L320 PolarHBondContact O-N 3.36Å; C316-V442 HydrophobicContact CB-CG2 4.49Å
317	L	95.9	Very high	94.8	Very high	94 Å²	94	29.9 Å²	29.9	49%	0.492	16%	0.159	S	C	.	.	H	α-helix	trans	-63.3	-44.9	176.5	-68.5	174.3	0	0	0	111.6	T313 S314 S319 L320 F321	T313-L317 HydrophobicContact CG2-CD1 4.31Å; T313-L317 WeakPolarHBondContact O-CG 3.21Å; T313-L317 PolarHBondContact O-N 2.97Å; S314-L317 PolarHBondContact O-N 2.94Å; L317-S319 VanDerWaalsContact C-N 3.32Å; L317-S319 PolarHBondContact O-N 3.3Å; L317-L320 PolarHBondContact O-N 2.9Å; L317-F321 WeakPolarHBondContact O-CB 3.28Å; L317-F321 PolarHBondContact O-N 3.41Å
318	A	96.6	Very high	94.8	Very high	25 Å²	25	34.6 Å²	34.6	21%	0.207	18%	0.18	C	C	.	.	H	α-helix	trans	-60.8	-41.3	175	0	0	0	0	0	111.9	V240 L244 S314 F321 L322	V240-A318 HydrophobicContact CG1-CB 4.15Å; L244-A318 HydrophobicContact CD1-CB 4.02Å; S314-A318 WeakPolarHBondContact O-CB 3.41Å; S314-A318 PolarHBondContact O-N 2.93Å; A318-F321 PolarHBondContact O-N 2.95Å; A318-L322 WeakPolarHBondContact O-CB 3.38Å; A318-L322 PolarHBondContact O-N 2.7Å
319	S	96.4	Very high	94.6	Very high	0 Å²	0	35.8 Å²	35.8	0%	0	19%	0.19	C	C	.	.	H	α-helix	trans	-63.6	-43.3	175.8	-62.4	0	0	0	0	112.1	S315 C316 L317 L322 S323 L441	S315-S319 VanDerWaalsContact O-CB 3.28Å; S315-S319 WeakPolarHBondContact O-CB 3.33Å; S315-S319 PolarHBondContact O-N 3.21Å; S315-S319 PolarHBondContact O-OG 3.19Å; C316-S319 WeakPolarHBondContact O-CB 3.44Å; C316-S319 PolarHBondContact O-N 3.13Å; L317-S319 VanDerWaalsContact C-N 3.32Å; L317-S319 PolarHBondContact O-N 3.3Å; S319-L322 PolarHBondContact O-N 2.93Å; S319-S323 VanDerWaalsContact O-CB 3.27Å; S319-S323 WeakPolarHBondContact O-CB 3.43Å; S319-S323 PolarHBondContact O-N 2.83Å; S319-S323 PolarHBondContact O-OG 2.95Å; S319-L441 VanDerWaalsContact OG-CB 3.29Å; S319-L441 WeakPolarHBondContact OG-CB 3.42Å
320	L	94.8	Very high	94.2	Very high	88 Å²	88	35.7 Å²	35.7	46%	0.461	19%	0.19	S	C	.	.	H	α-helix	trans	-63.9	-47	177.5	179.9	63.2	0	0	0	111.1	C316 L317 L322 S323 L324 F351	C316-L320 WeakPolarHBondContact O-CB 3.35Å; C316-L320 PolarHBondContact O-N 3.36Å; L317-L320 PolarHBondContact O-N 2.9Å; L320-L322 PolarHBondContact O-N 3.3Å; L320-S323 WeakPolarHBondContact O-CB 3.33Å; L320-S323 PolarHBondContact O-N 3.41Å; L320-L324 HydrophobicContact CG-CD1 4.45Å; L320-L324 WeakPolarHBondContact O-CG 3.35Å; L320-L324 PolarHBondContact O-N 2.81Å; L320-F351 HydrophobicContact CD1-CZ 4.15Å
321	F	95.9	Very high	93.6	Very high	140 Å²	140	41.7 Å²	41.7	61%	0.614	22%	0.216	S	C	*	.	H	α-helix	trans	-56.9	-50	176.2	175.6	-102.9	0	0	0	111.4	L317 A318 S323 L324 V325	L317-F321 WeakPolarHBondContact O-CB 3.28Å; L317-F321 PolarHBondContact O-N 3.41Å; A318-F321 PolarHBondContact O-N 2.95Å; F321-S323 VanDerWaalsContact C-N 3.27Å; F321-S323 PolarHBondContact O-N 2.86Å; F321-L324 WeakPolarHBondContact O-CB 3.43Å; F321-L324 PolarHBondContact O-N 3.35Å; F321-V325 HydrophobicContact CD1-CG2 4.42Å; F321-V325 HydrophobicContact CE1-CG2 4.01Å; F321-V325 HydrophobicContact CE2-CG2 4.33Å; F321-V325 HydrophobicContact CZ-CG2 3.96Å; F321-V325 WeakPolarHBondContact O-CG2 3.45Å; F321-V325 PolarHBondContact O-N 3.4Å
322	L	95.4	Very high	92.6	Very high	15 Å²	15	46.6 Å²	46.6	8%	0.079	25%	0.247	C	C	.	.	H	α-helix	trans	-66	-32.1	-179.9	-170.6	52.3	0	0	0	112.7	A318 S319 L320 V325 A326 W366 I370 I437 L441	A318-L322 WeakPolarHBondContact O-CB 3.38Å; A318-L322 PolarHBondContact O-N 2.7Å; S319-L322 PolarHBondContact O-N 2.93Å; L320-L322 PolarHBondContact O-N 3.3Å; L322-V325 PolarHBondContact O-N 2.85Å; L322-A326 VanDerWaalsContact O-CB 3.31Å; L322-A326 WeakPolarHBondContact O-CB 3.13Å; L322-A326 PolarHBondContact O-N 2.89Å; L322-W366 HydrophobicContact CD1-CE3 3.79Å; L322-W366 HydrophobicContact CD1-CH2 4.39Å; L322-W366 HydrophobicContact CD1-CZ3 3.72Å; L322-W366 HydrophobicContact CD2-CE3 4.13Å; L322-W366 HydrophobicContact CD2-CZ3 4.15Å; L322-I370 HydrophobicContact CD2-CD1 3.33Å; L322-I370 HydrophobicContact CD2-CG1 4.03Å; L322-I370 HydrophobicContact CG-CD1 4.31Å; L322-I437 HydrophobicContact CB-CD1 4.49Å; L322-I437 HydrophobicContact CB-CG2 4.43Å; L322-I437 HydrophobicContact CD2-CG2 4.33Å; L322-I437 HydrophobicContact CG-CD1 4.21Å; L322-L441 HydrophobicContact CD2-CD1 4.37Å
323	S	94.3	Very high	91.2	Very high	3 Å²	3	48.1 Å²	48.1	2%	0.021	26%	0.256	C	S	.	.	H	α-helix	trans	-66.4	-41.1	173.5	-61.1	0	0	0	0	112.2	S319 L320 F321 A326 Y327 S434 I437	S319-S323 VanDerWaalsContact O-CB 3.27Å; S319-S323 WeakPolarHBondContact O-CB 3.43Å; S319-S323 PolarHBondContact O-N 2.83Å; S319-S323 PolarHBondContact O-OG 2.95Å; L320-S323 WeakPolarHBondContact O-CB 3.33Å; L320-S323 PolarHBondContact O-N 3.41Å; F321-S323 VanDerWaalsContact C-N 3.27Å; F321-S323 PolarHBondContact O-N 2.86Å; S323-A326 PolarHBondContact O-N 3.15Å; S323-Y327 WeakPolarHBondContact O-CB 3.39Å; S323-Y327 PolarHBondContact O-N 3.31Å; S323-S434 VanDerWaalsContact CB-OG 3.28Å; S323-S434 WeakPolarHBondContact CB-OG 3.25Å; S323-S434 WeakPolarHBondContact OG-CA 3.48Å; S323-I437 WeakPolarHBondContact OG-CD1 3.24Å
324	L	94.5	Very high	89.7	Confident	71 Å²	71	51.7 Å²	51.7	37%	0.372	28%	0.277	S	S	.	.	H	α-helix	trans	-63.3	-47.9	173.9	-70.7	168.3	0	0	0	110.9	L320 F321 A326 Y327 F328 F351	L320-L324 HydrophobicContact CG-CD1 4.45Å; L320-L324 WeakPolarHBondContact O-CG 3.35Å; L320-L324 PolarHBondContact O-N 2.81Å; F321-L324 WeakPolarHBondContact O-CB 3.43Å; F321-L324 PolarHBondContact O-N 3.35Å; L324-A326 VanDerWaalsContact C-N 3.29Å; L324-A326 PolarHBondContact O-N 2.83Å; L324-Y327 PolarHBondContact O-N 3.07Å; L324-F328 HydrophobicContact CB-CD2 4.48Å; L324-F328 HydrophobicContact CB-CE2 4.4Å; L324-F328 HydrophobicContact CD2-CE2 4.3Å; L324-F328 WeakPolarHBondContact O-CD2 3.18Å; L324-F328 PolarHBondContact O-N 3.41Å; L324-F351 HydrophobicContact CD2-CE2 3.94Å; L324-F351 HydrophobicContact CG-CE2 4.32Å
325	V	94.1	Very high	87.7	Confident	55 Å²	55	59.3 Å²	59.3	33%	0.333	31%	0.305	S	S	.	.	H	α-helix	trans	-55.3	-46.9	174.7	173.4	0	0	0	0	110.5	F321 L322 Y327 F328 A329 W361	F321-V325 HydrophobicContact CD1-CG2 4.42Å; F321-V325 HydrophobicContact CE1-CG2 4.01Å; F321-V325 HydrophobicContact CE2-CG2 4.33Å; F321-V325 HydrophobicContact CZ-CG2 3.96Å; F321-V325 WeakPolarHBondContact O-CG2 3.45Å; F321-V325 PolarHBondContact O-N 3.4Å; L322-V325 PolarHBondContact O-N 2.85Å; V325-Y327 PolarHBondContact O-N 3.39Å; V325-F328 PolarHBondContact O-N 3.2Å; V325-A329 WeakPolarHBondContact O-CB 3.28Å; V325-A329 PolarHBondContact O-N 3.15Å; V325-W361 HydrophobicContact CG1-CE3 4.27Å; V325-W361 HydrophobicContact CG1-CZ3 4.04Å
326	A	92.3	Very high	85.6	Confident	5 Å²	5	66.9 Å²	66.9	4%	0.041	33%	0.333	C	S	.	.	H	α-helix	trans	-62.2	-42.5	178.4	0	0	0	0	0	113.4	L322 S323 L324 S330 W361 F432 I437	L322-A326 VanDerWaalsContact O-CB 3.31Å; L322-A326 WeakPolarHBondContact O-CB 3.13Å; L322-A326 PolarHBondContact O-N 2.89Å; S323-A326 PolarHBondContact O-N 3.15Å; L324-A326 VanDerWaalsContact C-N 3.29Å; L324-A326 PolarHBondContact O-N 2.83Å; A326-S330 WeakPolarHBondContact O-CB 3.14Å; A326-S330 PolarHBondContact O-N 2.88Å; A326-S330 PolarHBondContact O-OG 3.43Å; A326-W361 HydrophobicContact CB-CH2 3.64Å; A326-W361 HydrophobicContact CB-CZ3 4.4Å; A326-F432 HydrophobicContact CB-CD1 3.89Å; A326-F432 HydrophobicContact CB-CE1 3.8Å; A326-I437 HydrophobicContact CB-CD1 4.4Å
327	Y	91.1	Very high	83.6	Confident	27 Å²	27	67.8 Å²	67.8	11%	0.106	34%	0.338	C	S	.	.	H	α-helix	trans	-63.1	-48.1	177.7	176.3	-99.8	0	0	0	112.1	S323 L324 V325 S330 I347 D350 F351 R355	S323-Y327 WeakPolarHBondContact O-CB 3.39Å; S323-Y327 PolarHBondContact O-N 3.31Å; L324-Y327 PolarHBondContact O-N 3.07Å; V325-Y327 PolarHBondContact O-N 3.39Å; Y327-S330 PolarHBondContact O-N 3.13Å; Y327-S330 PolarHBondContact O-OG 3.38Å; Y327-I347 WeakPolarHBondContact OH-CG2 3.26Å; Y327-D350 HydrophobicContact CE2-CB 4Å; Y327-F351 HydrophobicContact CD2-CB 3.85Å; Y327-F351 HydrophobicContact CD2-CD2 4.19Å; Y327-F351 HydrophobicContact CE2-CB 4.19Å; Y327-F351 HydrophobicContact CG-CB 4.46Å; Y327-F351 AromaticContact CG-CD2 3.97Å; Y327-F351 HydrophobicContact CG-CD2 3.97Å; Y327-R355 PolarHBondContact O-NH1 3.1Å
328	F	91.6	Very high	81.5	Confident	116 Å²	116	64.5 Å²	64.5	51%	0.509	32%	0.319	S	S	.	.	H	α-helix	trans	-68.7	-45	-179.9	-71.6	-63.4	0	0	0	112.2	L324 V325 S330 K331	L324-F328 HydrophobicContact CB-CD2 4.48Å; L324-F328 HydrophobicContact CB-CE2 4.4Å; L324-F328 HydrophobicContact CD2-CE2 4.3Å; L324-F328 WeakPolarHBondContact O-CD2 3.18Å; L324-F328 PolarHBondContact O-N 3.41Å; V325-F328 PolarHBondContact O-N 3.2Å; F328-S330 PolarHBondContact O-N 3.12Å; F328-K331 WeakPolarHBondContact O-CB 3.32Å; F328-K331 PolarHBondContact O-N 3.26Å
329	A	88.2	Confident	79.5	Confident	31 Å²	31	65.8 Å²	65.8	26%	0.256	32%	0.321	S	S	.	.	H	α-helix	trans	-60.3	-35.1	176.3	0	0	0	0	0	112.1	V325 K331 T332 W361	V325-A329 WeakPolarHBondContact O-CB 3.28Å; V325-A329 PolarHBondContact O-N 3.15Å; A329-K331 PolarHBondContact O-N 3.4Å; A329-T332 PolarHBondContact O-OG1 3.44Å; A329-W361 HydrophobicContact CB-CH2 4.3Å; A329-W361 HydrophobicContact CB-CZ2 3.48Å; A329-W361 VanDerWaalsContact CB-CZ2 3.48Å
330	S	84.5	Confident	77.5	Confident	2 Å²	2	68.7 Å²	68.7	1%	0.014	34%	0.341	C	S	.	.	G	3₁₀ helix	trans	-71.7	-9.5	-179.9	80	0	0	0	0	115.7	A326 Y327 F328 T332 V333 R355 H356	A326-S330 WeakPolarHBondContact O-CB 3.14Å; A326-S330 PolarHBondContact O-N 2.88Å; A326-S330 PolarHBondContact O-OG 3.43Å; Y327-S330 PolarHBondContact O-N 3.13Å; Y327-S330 PolarHBondContact O-OG 3.38Å; F328-S330 PolarHBondContact O-N 3.12Å; S330-T332 PolarHBondContact O-N 2.71Å; S330-V333 WeakPolarHBondContact O-CB 3.23Å; S330-V333 WeakPolarHBondContact O-CG2 3.39Å; S330-V333 PolarHBondContact O-N 2.84Å; S330-V333 VanDerWaalsContact O-N 3.1Å; S330-R355 PolarHBondContact OG-NH1 3.37Å; S330-R355 VanDerWaalsContact OG-NH1 3.08Å; S330-H356 VanDerWaalsContact CA-CD2 3.5Å; S330-H356 WeakPolarHBondContact CA-CD2 3.21Å
331	K	80.8	Confident	75.4	Confident	129 Å²	129	66.7 Å²	66.7	56%	0.561	34%	0.338	S	S	*	.	G	3₁₀ helix	trans	-62.9	-20.7	176.3	-71.1	-173.7	176.6	-177	0	112.6	F328 A329 V333	F328-K331 WeakPolarHBondContact O-CB 3.32Å; F328-K331 PolarHBondContact O-N 3.26Å; A329-K331 PolarHBondContact O-N 3.4Å; K331-V333 VanDerWaalsContact C-N 3.26Å; K331-V333 PolarHBondContact O-N 3.32Å
332	T	75.1	Confident	73.3	Confident	123 Å²	123	60 Å²	60	76%	0.755	31%	0.308	S	S	*	.	G	3₁₀ helix	trans	-76.6	-8.4	176.5	60.4	0	0	0	0	113.9	A329 S330	A329-T332 PolarHBondContact O-OG1 3.44Å; S330-T332 PolarHBondContact O-N 2.71Å
333	V	68.1	Low	71.5	Confident	31 Å²	31	65.8 Å²	65.8	19%	0.188	33%	0.333	C	S	.	.	S	Bend	trans	-94.1	137.3	-172.2	-168.9	0	0	0	0	112.2	S330 K331 T337 H356	S330-V333 WeakPolarHBondContact O-CB 3.23Å; S330-V333 WeakPolarHBondContact O-CG2 3.39Å; S330-V333 PolarHBondContact O-N 2.84Å; S330-V333 VanDerWaalsContact O-N 3.1Å; K331-V333 VanDerWaalsContact C-N 3.26Å; K331-V333 PolarHBondContact O-N 3.32Å; V333-T337 HydrophobicContact CG1-CG2 4.32Å; V333-T337 WeakPolarHBondContact CG1-OG1 3.3Å; V333-H356 VanDerWaalsContact CG2-CD2 3.41Å; V333-H356 WeakPolarHBondContact CG2-CD2 3.35Å; V333-H356 WeakPolarHBondContact CG2-CE1 3.3Å; V333-H356 WeakPolarHBondContact CG2-NE2 3.43Å
334	V	64.2	Low	70.1	Confident	92 Å²	92	68.7 Å²	68.7	56%	0.558	35%	0.35	S	S	*	.			trans	-66.1	138	174	-167.1	0	0	0	0	110.9	Y336 T337	V334-Y336 HydrophobicContact CB-CD1 3.7Å; V334-Y336 HydrophobicContact CB-CE1 3.46Å; V334-Y336 VanDerWaalsContact CB-CE1 3.46Å; V334-Y336 HydrophobicContact CG1-CD1 3.33Å; V334-Y336 HydrophobicContact CG1-CE1 3.48Å; V334-Y336 VanDerWaalsContact CG1-CE1 3.48Å; V334-Y336 HydrophobicContact CG2-CE1 4.09Å; V334-Y336 PolarHBondContact O-N 3.43Å; V334-T337 PolarHBondContact O-N 3.5Å; V334-T337 PolarHBondContact O-OG1 3.34Å
335	R	55.7	Low	68.8	Low	168 Å²	168	70.1 Å²	70.1	63%	0.634	37%	0.366	S	S	*	.	G	3₁₀ helix	trans	-57.1	-17.2	-172.5	-64.2	-170	179.4	-177.9	0.6	116.1	T337 R338	R335-T337 VanDerWaalsContact C-N 3.32Å; R335-T337 PolarHBondContact O-N 2.89Å; R335-R338 WeakPolarHBondContact O-CB 3.36Å; R335-R338 WeakPolarHBondContact O-CG 3.37Å
336	Y	53.2	Low	68.1	Low	172 Å²	172	68.5 Å²	68.5	68%	0.675	36%	0.358	S	S	*	.	G	3₁₀ helix	trans	-73.8	-16.8	-175.3	68.6	-100.8	0	0	0	114.4	V334 R338	V334-Y336 HydrophobicContact CB-CD1 3.7Å; V334-Y336 HydrophobicContact CB-CE1 3.46Å; V334-Y336 VanDerWaalsContact CB-CE1 3.46Å; V334-Y336 HydrophobicContact CG1-CD1 3.33Å; V334-Y336 HydrophobicContact CG1-CE1 3.48Å; V334-Y336 VanDerWaalsContact CG1-CE1 3.48Å; V334-Y336 HydrophobicContact CG2-CE1 4.09Å; V334-Y336 PolarHBondContact O-N 3.43Å; Y336-R338 PolarHBondContact O-N 2.94Å
337	T	52.2	Low	67.7	Low	37 Å²	37	73.6 Å²	73.6	23%	0.227	38%	0.383	C	S	.	.	G	3₁₀ helix	trans	-82.1	5.1	178.2	63.4	0	0	0	0	113.7	V333 V334 R335 R355	V333-T337 HydrophobicContact CG1-CG2 4.32Å; V333-T337 WeakPolarHBondContact CG1-OG1 3.3Å; V334-T337 PolarHBondContact O-N 3.5Å; V334-T337 PolarHBondContact O-OG1 3.34Å; R335-T337 VanDerWaalsContact C-N 3.32Å; R335-T337 PolarHBondContact O-N 2.89Å; T337-R355 PolarHBondContact OG1-O 3.18Å
338	R	53.5	Low	67.3	Low	24 Å²	24	78.2 Å²	78.2	9%	0.091	40%	0.404	C	S	.	.	S	Bend	trans	-80.9	144.5	-174.8	-64.2	-175.9	-171.8	-164.6	-7.9	111.6	R335 Y336 A342 T344 D350 R355	R335-R338 WeakPolarHBondContact O-CB 3.36Å; R335-R338 WeakPolarHBondContact O-CG 3.37Å; Y336-R338 PolarHBondContact O-N 2.94Å; R338-A342 HydrophobicContact CB-CB 4.12Å; R338-A342 WeakPolarHBondContact CD-O 3.24Å; R338-A342 PolarHBondContact NH1-O 3.21Å; R338-T344 PolarHBondContact NH1-O 3.05Å; R338-D350 IonicContact CZ-OD1 3.42Å; R338-D350 IonicContact CZ-OD2 2.97Å; R338-D350 IonicContact NH1-OD1 3.66Å; R338-D350 PolarHBondContact NH1-OD1 3.1Å; R338-D350 IonicContact NH1-OD2 2.87Å; R338-D350 PolarHBondContact NH1-OD2 3.44Å; R338-D350 IonicContact NH2-OD1 2.71Å; R338-D350 IonicContact NH2-OD2 3.96Å; R338-D350 PolarHBondContact NH2-OD2 3Å; R338-R355 HydrophobicContact CG-CB 4.34Å
339	Q	53.7	Low	66.9	Low	52 Å²	52	72.9 Å²	72.9	24%	0.243	38%	0.38	C	S	.	.			trans	-56.9	149.3	164.7	-169.5	170	7.3	0	0	109.5	A341 A342 K343 T431	Q339-A341 PolarHBondContact O-N 3.43Å; Q339-A342 PolarHBondContact O-N 2.95Å; Q339-K343 PolarHBondContact O-N 3.44Å; Q339-T431 HydrophobicContact CB-CG2 4.19Å
340	S	53.5	Low	66.7	Low	61 Å²	61	71.7 Å²	71.7	43%	0.427	37%	0.37	S	S	.	.	G	3₁₀ helix	trans	-50.3	-35.7	-176.9	-156.3	0	0	0	0	113.5	R584	S340-R584 PolarHBondContact OG-NH1 3.49Å
341	A	52.4	Low	66.9	Low	47 Å²	47	73.3 Å²	73.3	39%	0.388	38%	0.377	S	S	.	.	G	3₁₀ helix	trans	-67.6	-38.5	176.6	0	0	0	0	0	112.8	Q339 K343 T344 L349	Q339-A341 PolarHBondContact O-N 3.43Å; A341-K343 PolarHBondContact O-N 3.15Å; A341-T344 PolarHBondContact O-OG1 3.36Å; A341-L349 WeakPolarHBondContact O-CD2 3.42Å
342	A	51.7	Low	67.4	Low	0 Å²	0	67.6 Å²	67.6	0%	0	35%	0.352	C	S	.	.	G	3₁₀ helix	trans	-80.9	6.4	-179.3	0	0	0	0	0	114.1	R338 Q339 T344 C353	R338-A342 HydrophobicContact CB-CB 4.12Å; R338-A342 WeakPolarHBondContact CD-O 3.24Å; R338-A342 PolarHBondContact NH1-O 3.21Å; Q339-A342 PolarHBondContact O-N 2.95Å; A342-T344 PolarHBondContact O-N 2.98Å; A342-C353 HydrophobicContact CB-CB 4.09Å
343	K	57.9	Low	67.9	Low	135 Å²	135	62.8 Å²	62.8	59%	0.587	32%	0.323	S	S	*	.	G	3₁₀ helix	trans	-69.7	-10.7	176	-70.3	-176.5	178.2	-178.9	0	113.4	Q339 A341	Q339-K343 PolarHBondContact O-N 3.44Å; A341-K343 PolarHBondContact O-N 3.15Å
344	T	63.2	Low	68.9	Low	64 Å²	64	61.5 Å²	61.5	39%	0.393	32%	0.316	S	S	.	.	S	Bend	trans	-72.1	153.7	177.7	-42.8	0	0	0	0	111.8	R338 A341 A342 S346	R338-T344 PolarHBondContact NH1-O 3.05Å; A341-T344 PolarHBondContact O-OG1 3.36Å; A342-T344 PolarHBondContact O-N 2.98Å; T344-S346 PolarHBondContact O-N 2.86Å
345	S	67.6	Low	69.8	Low	101 Å²	101	58.1 Å²	58.1	71%	0.706	29%	0.293	S	S	*	.	S	Bend	trans	-74.6	6.5	174.9	51.1	0	0	0	0	114.7	I347	S345-I347 PolarHBondContact O-N 3.09Å
346	S	80	Confident	71.2	Confident	22 Å²	22	52 Å²	52	15%	0.154	27%	0.272	C	S	.	.			trans	-76.5	123	-175.5	176.1	0	0	0	0	112	T155 T344 F348 L349 D350	T155-S346 VanDerWaalsContact CG2-OG 3.3Å; T155-S346 WeakPolarHBondContact CG2-OG 3.47Å; T155-S346 PolarHBondContact OG1-OG 3.29Å; T344-S346 PolarHBondContact O-N 2.86Å; S346-F348 VanDerWaalsContact C-N 3.32Å; S346-F348 PolarHBondContact O-N 2.44Å; S346-L349 PolarHBondContact O-N 3.33Å; S346-D350 PolarHBondContact O-N 3.38Å; S346-D350 VanDerWaalsContact O-N 3.08Å
347	I	84.1	Confident	72.8	Confident	112 Å²	112	45.5 Å²	45.5	57%	0.574	25%	0.25	S	C	*	.	H	α-helix	trans	-57.8	-44.1	176.5	-71.7	167.7	0	0	0	111.4	Y327 S345 D350 F351	Y327-I347 WeakPolarHBondContact OH-CG2 3.26Å; S345-I347 PolarHBondContact O-N 3.09Å; I347-D350 PolarHBondContact O-N 2.86Å; I347-F351 PolarHBondContact O-N 2.87Å
348	F	82.7	Confident	74.4	Confident	123 Å²	123	45.8 Å²	45.8	54%	0.539	25%	0.247	S	C	.	.	H	α-helix	trans	-65.6	-43	-178.9	-71.5	-77	0	0	0	112.3	T155 I159 S346 D350 F351 W352	T155-F348 HydrophobicContact CG2-CB 4.21Å; I159-F348 HydrophobicContact CD1-CB 4.43Å; I159-F348 HydrophobicContact CD1-CD1 4.46Å; I159-F348 HydrophobicContact CD1-CD2 4.17Å; I159-F348 HydrophobicContact CD1-CG 4.11Å; I159-F348 HydrophobicContact CG1-CB 4.23Å; I159-F348 HydrophobicContact CG1-CD1 4.2Å; I159-F348 HydrophobicContact CG1-CG 4.14Å; S346-F348 VanDerWaalsContact C-N 3.32Å; S346-F348 PolarHBondContact O-N 2.44Å; F348-D350 VanDerWaalsContact C-N 3.31Å; F348-D350 PolarHBondContact O-N 3.11Å; F348-F351 PolarHBondContact O-N 3.27Å; F348-W352 WeakPolarHBondContact O-CB 3.44Å; F348-W352 PolarHBondContact O-N 3.43Å
349	L	82.9	Confident	76.1	Confident	4 Å²	4	44.7 Å²	44.7	2%	0.021	24%	0.243	C	C	.	.	H	α-helix	trans	-67.1	-37.5	179.3	-166.8	62.4	0	0	0	111.3	P154 A158 A341 S346 F351 W352 C353	P154-L349 HydrophobicContact CB-CD1 4.47Å; P154-L349 HydrophobicContact CB-CD2 4.36Å; A158-L349 HydrophobicContact CB-CD1 4.09Å; A341-L349 WeakPolarHBondContact O-CD2 3.42Å; S346-L349 PolarHBondContact O-N 3.33Å; L349-F351 VanDerWaalsContact C-N 3.32Å; L349-F351 PolarHBondContact O-N 3.2Å; L349-W352 PolarHBondContact O-N 3.31Å; L349-C353 WeakPolarHBondContact O-CB 3.48Å; L349-C353 PolarHBondContact O-N 3.13Å
350	D	84.4	Confident	77.6	Confident	7 Å²	7	44.7 Å²	44.7	4%	0.037	24%	0.243	C	C	.	.	H	α-helix	trans	-63.6	-35.7	173.1	-84.4	-11.3	0	0	0	112.4	Y327 R338 S346 I347 F348 G354 R355	Y327-D350 HydrophobicContact CE2-CB 4Å; R338-D350 IonicContact CZ-OD1 3.42Å; R338-D350 IonicContact CZ-OD2 2.97Å; R338-D350 IonicContact NH1-OD1 3.66Å; R338-D350 PolarHBondContact NH1-OD1 3.1Å; R338-D350 IonicContact NH1-OD2 2.87Å; R338-D350 PolarHBondContact NH1-OD2 3.44Å; R338-D350 IonicContact NH2-OD1 2.71Å; R338-D350 IonicContact NH2-OD2 3.96Å; R338-D350 PolarHBondContact NH2-OD2 3Å; S346-D350 PolarHBondContact O-N 3.38Å; S346-D350 VanDerWaalsContact O-N 3.08Å; I347-D350 PolarHBondContact O-N 2.86Å; F348-D350 VanDerWaalsContact C-N 3.31Å; F348-D350 PolarHBondContact O-N 3.11Å; D350-G354 WeakPolarHBondContact O-CA 3.26Å; D350-G354 PolarHBondContact O-N 2.97Å; D350-G354 VanDerWaalsContact O-N 3.1Å; D350-R355 HydrophobicContact CB-CG 4.41Å; D350-R355 IonicContact OD1-NE 3.22Å; D350-R355 IonicContact OD2-CZ 3.82Å; D350-R355 IonicContact OD2-NE 3.46Å; D350-R355 PolarHBondContact OD2-NE 2.67Å; D350-R355 IonicContact OD2-NH2 3Å; D350-R355 PolarHBondContact OD2-NH2 3.3Å
351	F	88.7	Confident	79.2	Confident	36 Å²	36	44.4 Å²	44.4	16%	0.158	23%	0.232	C	C	.	.	H	α-helix	trans	-72.6	-42.9	174.5	177.3	-102.1	0	0	0	112.5	L320 L324 Y327 I347 F348 L349 S434	L320-F351 HydrophobicContact CD1-CZ 4.15Å; L324-F351 HydrophobicContact CD2-CE2 3.94Å; L324-F351 HydrophobicContact CG-CE2 4.32Å; Y327-F351 HydrophobicContact CD2-CB 3.85Å; Y327-F351 HydrophobicContact CD2-CD2 4.19Å; Y327-F351 HydrophobicContact CE2-CB 4.19Å; Y327-F351 HydrophobicContact CG-CB 4.46Å; Y327-F351 AromaticContact CG-CD2 3.97Å; Y327-F351 HydrophobicContact CG-CD2 3.97Å; I347-F351 PolarHBondContact O-N 2.87Å; F348-F351 PolarHBondContact O-N 3.27Å; L349-F351 VanDerWaalsContact C-N 3.32Å; L349-F351 PolarHBondContact O-N 3.2Å; F351-S434 VanDerWaalsContact CD1-OG 3.31Å; F351-S434 WeakPolarHBondContact CD1-OG 3.34Å; F351-S434 WeakPolarHBondContact CE1-OG 3.33Å; F351-S434 WeakPolarHBondContact CE2-OG 3.3Å; F351-S434 WeakPolarHBondContact CZ-OG 3.49Å; F351-S434 PolarHBondContact O-N 2.72Å; F351-S434 VanDerWaalsContact O-N 3.09Å; F351-S434 PolarHBondContact O-OG 3.26Å
352	W	89.8	Confident	80.9	Confident	9 Å²	9	49.1 Å²	49.1	3%	0.034	25%	0.25	C	S	.	.	H	α-helix	trans	-71.2	-55.2	-177.5	-176.3	-121.5	0	0	0	112.8	A158 Q161 V162 I165 F348 L349 G433 S434 C435 I438	A158-W352 HydrophobicContact CB-CB 4.09Å; A158-W352 VanDerWaalsContact CB-CD1 3.49Å; A158-W352 HydrophobicContact CB-CG 3.88Å; Q161-W352 HydrophobicContact CB-CH2 4.45Å; Q161-W352 HydrophobicContact CB-CZ2 3.73Å; Q161-W352 VanDerWaalsContact OE1-NE1 3.13Å; V162-W352 HydrophobicContact CB-CE3 4.25Å; V162-W352 HydrophobicContact CB-CZ3 4.08Å; V162-W352 HydrophobicContact CG2-CD2 3.61Å; V162-W352 HydrophobicContact CG2-CE3 3.06Å; V162-W352 HydrophobicContact CG2-CG 4.28Å; V162-W352 HydrophobicContact CG2-CH2 4.11Å; V162-W352 HydrophobicContact CG2-CZ3 3.33Å; I165-W352 HydrophobicContact CD1-CH2 3.47Å; I165-W352 VanDerWaalsContact CD1-CH2 3.47Å; I165-W352 HydrophobicContact CD1-CZ2 3.61Å; F348-W352 WeakPolarHBondContact O-CB 3.44Å; F348-W352 PolarHBondContact O-N 3.43Å; L349-W352 PolarHBondContact O-N 3.31Å; W352-G433 CarbonylContact O-C 3.6Å; W352-S434 PolarHBondContact O-N 3.07Å; W352-C435 HydrophobicContact CD2-CB 3.71Å; W352-C435 VanDerWaalsContact CE2-CB 3.5Å; W352-C435 HydrophobicContact CE3-CB 4.03Å; W352-C435 HydrophobicContact CG-CB 4.3Å; W352-C435 HydrophobicContact CH2-CB 4Å; W352-C435 HydrophobicContact CZ2-CB 3.66Å; W352-C435 HydrophobicContact CZ3-CB 4.19Å; W352-C435 WeakPolarHBondContact O-CB 3.28Å; W352-C435 PolarHBondContact O-N 3.07Å; W352-I438 HydrophobicContact CZ3-CD1 4.08Å
353	C	86.9	Confident	82.6	Confident	22 Å²	22	51.8 Å²	51.8	15%	0.149	28%	0.277	C	S	.	.	H	α-helix	trans	-78.3	-30.8	-178.6	-64.5	0	0	0	0	112.1	A342 L349 T431 G433	A342-C353 HydrophobicContact CB-CB 4.09Å; L349-C353 WeakPolarHBondContact O-CB 3.48Å; L349-C353 PolarHBondContact O-N 3.13Å; C353-T431 CarbonylContact O-C 3.56Å; C353-T431 WeakPolarHBondContact O-CB 2.94Å; C353-T431 PolarHBondContact O-OG1 3.43Å; C353-G433 PolarHBondContact O-N 2.85Å
354	G	87.8	Confident	84.1	Confident	4 Å²	4	46 Å²	46	4%	0.041	25%	0.253	C	S	.	.			trans	80.9	163.7	-172.6	0	0	0	0	0	113.2	D350 T431	D350-G354 WeakPolarHBondContact O-CA 3.26Å; D350-G354 PolarHBondContact O-N 2.97Å; D350-G354 VanDerWaalsContact O-N 3.1Å; G354-T431 VanDerWaalsContact O-CB 3.32Å; G354-T431 WeakPolarHBondContact O-CB 3.41Å; G354-T431 PolarHBondContact O-OG1 2.95Å
355	R	84	Confident	85.5	Confident	20 Å²	20	43.4 Å²	43.4	8%	0.075	24%	0.236	C	C	.	.	S	Bend	trans	-113.8	-33	179.4	-51.2	179.8	-177.3	118.2	-2.3	113.7	Y327 S330 T337 R338 D350	Y327-R355 PolarHBondContact O-NH1 3.1Å; S330-R355 PolarHBondContact OG-NH1 3.37Å; S330-R355 VanDerWaalsContact OG-NH1 3.08Å; T337-R355 PolarHBondContact OG1-O 3.18Å; R338-R355 HydrophobicContact CG-CB 4.34Å; D350-R355 HydrophobicContact CB-CG 4.41Å; D350-R355 IonicContact OD1-NE 3.22Å; D350-R355 IonicContact OD2-CZ 3.82Å; D350-R355 IonicContact OD2-NE 3.46Å; D350-R355 PolarHBondContact OD2-NE 2.67Å; D350-R355 IonicContact OD2-NH2 3Å; D350-R355 PolarHBondContact OD2-NH2 3.3Å
356	H	85.2	Confident	86.7	Confident	41 Å²	41	40.5 Å²	40.5	19%	0.19	21%	0.21	C	C	.	.			trans	-82.1	132.2	175.9	-92.9	-72.5	0	0	0	109.9	S330 V333 P359 F432	S330-H356 VanDerWaalsContact CA-CD2 3.5Å; S330-H356 WeakPolarHBondContact CA-CD2 3.21Å; V333-H356 VanDerWaalsContact CG2-CD2 3.41Å; V333-H356 WeakPolarHBondContact CG2-CD2 3.35Å; V333-H356 WeakPolarHBondContact CG2-CE1 3.3Å; V333-H356 WeakPolarHBondContact CG2-NE2 3.43Å; H356-P359 HydrophobicContact CB-CB 4.34Å; H356-P359 HydrophobicContact CB-CG 4.39Å; H356-F432 VanDerWaalsContact O-CB 3.28Å; H356-F432 WeakPolarHBondContact O-CB 3.5Å; H356-F432 PolarHBondContact O-N 3.35Å
357	V	85.9	Confident	87.3	Confident	35 Å²	35	39.5 Å²	39.5	21%	0.212	20%	0.203	C	C	.	.	S	Bend	trans	-75.8	-40.6	172.6	174.5	0	0	0	0	111.7	K367 Q428 T431	V357-K367 WeakPolarHBondContact O-CD 3.32Å; V357-K367 PolarHBondContact O-NZ 2.84Å; V357-K367 VanDerWaalsContact O-NZ 3.16Å; V357-Q428 VanDerWaalsContact CG1-O 3.32Å; V357-Q428 WeakPolarHBondContact CG1-O 3.44Å; V357-T431 HydrophobicContact CG2-CG2 4.07Å
358	R	86.4	Confident	87.8	Confident	43 Å²	43	34.1 Å²	34.1	16%	0.162	18%	0.175	C	C	.	.	S	Bend	trans	-147.3	82.1	-173.4	-167.2	167	173.6	135.5	8.2	110.2	D365	R358-D365 IonicContact CZ-OD1 3.78Å; R358-D365 IonicContact CZ-OD2 3.21Å; R358-D365 IonicContact NE-OD1 2.84Å; R358-D365 IonicContact NE-OD2 3.81Å; R358-D365 PolarHBondContact NE-OD2 2.93Å; R358-D365 IonicContact NH2-OD1 3.53Å; R358-D365 IonicContact NH2-OD2 2.73Å; R358-D365 PolarHBondContact NH2-OD2 3.36Å
359	P	88.9	Confident	88.3	Confident	1 Å²	1	28.5 Å²	28.5	1%	0.006	15%	0.151	C	C	.	.			trans	-70.7	134.7	179.7	21.1	-21.5	0	0	0	111.1	H356 W361 W366 F432	H356-P359 HydrophobicContact CB-CB 4.34Å; H356-P359 HydrophobicContact CB-CG 4.39Å; P359-W361 HydrophobicContact CB-CD2 4.11Å; P359-W361 HydrophobicContact CB-CE3 4.48Å; P359-W361 HydrophobicContact CB-CH2 3.68Å; P359-W361 HydrophobicContact CB-CZ2 3.31Å; P359-W361 HydrophobicContact CB-CZ3 4.3Å; P359-W361 HydrophobicContact CG-CH2 3.94Å; P359-W361 HydrophobicContact CG-CZ2 4.05Å; P359-W366 HydrophobicContact CG-CB 4.24Å; P359-W366 PolarHBondContact O-N 2.9Å; P359-F432 HydrophobicContact CG-CB 3.94Å; P359-F432 HydrophobicContact CG-CD1 3.27Å; P359-F432 HydrophobicContact CG-CD2 4.39Å; P359-F432 HydrophobicContact CG-CE1 3.76Å; P359-F432 HydrophobicContact CG-CG 3.6Å
360	Q	85.6	Confident	89	Confident	51 Å²	51	28.5 Å²	28.5	24%	0.238	15%	0.151	C	C	.	.			trans	-125.3	69.3	179.6	-74.6	177.5	-17.6	0	0	111.3	I364 D365	Q360-I364 VanDerWaalsContact CA-O 3.23Å; Q360-I364 WeakPolarHBondContact CA-O 3.13Å; Q360-D365 PolarHBondContact NE2-OD2 3.49Å
361	W	87.9	Confident	89.5	Confident	55 Å²	55	28.3 Å²	28.3	21%	0.208	15%	0.15	C	C	.	.	G	3₁₀ helix	trans	-86	141.5	175.4	-44.6	-47.6	0	0	0	109.6	V325 A326 A329 P359 G363 I364 W366 F432	V325-W361 HydrophobicContact CG1-CE3 4.27Å; V325-W361 HydrophobicContact CG1-CZ3 4.04Å; A326-W361 HydrophobicContact CB-CH2 3.64Å; A326-W361 HydrophobicContact CB-CZ3 4.4Å; A329-W361 HydrophobicContact CB-CH2 4.3Å; A329-W361 HydrophobicContact CB-CZ2 3.48Å; A329-W361 VanDerWaalsContact CB-CZ2 3.48Å; P359-W361 HydrophobicContact CB-CD2 4.11Å; P359-W361 HydrophobicContact CB-CE3 4.48Å; P359-W361 HydrophobicContact CB-CH2 3.68Å; P359-W361 HydrophobicContact CB-CZ2 3.31Å; P359-W361 HydrophobicContact CB-CZ3 4.3Å; P359-W361 HydrophobicContact CG-CH2 3.94Å; P359-W361 HydrophobicContact CG-CZ2 4.05Å; W361-G363 PolarHBondContact O-N 2.73Å; W361-I364 PolarHBondContact O-N 3.24Å; W361-I364 VanDerWaalsContact O-N 3.07Å; W361-W366 AromaticContact CE3-CD1 3.7Å; W361-W366 HydrophobicContact CE3-CD2 4.18Å; W361-W366 AromaticContact CE3-CE2 3.97Å; W361-W366 AromaticContact CE3-CG 4Å; W361-W366 HydrophobicContact CE3-CG 4Å; W361-W366 AromaticContact CE3-NE1 3.7Å; W361-W366 HydrophobicContact CZ3-CD2 4.5Å; W361-W366 HydrophobicContact CZ3-CG 4.28Å; W361-W366 PolarHBondContact O-NE1 3.39Å; W361-F432 HydrophobicContact CH2-CD1 4.44Å; W361-F432 HydrophobicContact CH2-CE1 4.15Å; W361-F432 HydrophobicContact CZ3-CE1 4.36Å
362	L	88	Confident	89.8	Confident	147 Å²	147	26.6 Å²	26.6	77%	0.77	14%	0.143	S	C	*	.	G	3₁₀ helix	trans	59.9	22.8	-179.2	-51.8	172.9	0	0	0	114.2	I364	L362-I364 HydrophobicContact CB-CD1 4.46Å; L362-I364 PolarHBondContact O-N 2.92Å
363	G	86.4	Confident	90.1	Very high	55 Å²	55	26.3 Å²	26.3	57%	0.567	14%	0.142	S	C	*	.	G	3₁₀ helix	trans	71.3	11.9	-175.6	0	0	0	0	0	114.2	R252 W361	R252-G363 WeakPolarHBondContact CD-O 3.49Å; W361-G363 PolarHBondContact O-N 2.73Å
364	I	90.6	Very high	90.6	Very high	14 Å²	14	25.3 Å²	25.3	7%	0.072	14%	0.135	C	C	.	.			trans	-101.1	133.6	177.9	-66.5	160.6	0	0	0	109.3	C248 R252 Q360 W361 L362 W366 T369	C248-I364 HydrophobicContact CB-CD1 3.76Å; R252-I364 HydrophobicContact CB-CD1 4.37Å; R252-I364 HydrophobicContact CB-CG1 3.8Å; R252-I364 HydrophobicContact CG-CG1 4.36Å; Q360-I364 VanDerWaalsContact CA-O 3.23Å; Q360-I364 WeakPolarHBondContact CA-O 3.13Å; W361-I364 PolarHBondContact O-N 3.24Å; W361-I364 VanDerWaalsContact O-N 3.07Å; L362-I364 HydrophobicContact CB-CD1 4.46Å; L362-I364 PolarHBondContact O-N 2.92Å; I364-W366 VanDerWaalsContact O-CD1 3.24Å; I364-W366 PolarHBondContact O-N 3.28Å; I364-W366 VanDerWaalsContact O-N 3.12Å; I364-T369 HydrophobicContact CG2-CG2 4.34Å; I364-T369 VanDerWaalsContact CG2-OG1 3.26Å; I364-T369 WeakPolarHBondContact CG2-OG1 3.37Å
365	D	91.9	Very high	91	Very high	9 Å²	9	25.6 Å²	25.6	5%	0.048	14%	0.136	C	C	.	.			trans	-77.9	92.7	167.8	-157.6	-61.9	0	0	0	111	Y269 R358 Q360 K367 M368 T369	Y269-D365 HydrophobicContact CD2-CB 3.77Å; Y269-D365 HydrophobicContact CE2-CB 4.08Å; R358-D365 IonicContact CZ-OD1 3.78Å; R358-D365 IonicContact CZ-OD2 3.21Å; R358-D365 IonicContact NE-OD1 2.84Å; R358-D365 IonicContact NE-OD2 3.81Å; R358-D365 PolarHBondContact NE-OD2 2.93Å; R358-D365 IonicContact NH2-OD1 3.53Å; R358-D365 IonicContact NH2-OD2 2.73Å; R358-D365 PolarHBondContact NH2-OD2 3.36Å; Q360-D365 PolarHBondContact NE2-OD2 3.49Å; D365-K367 VanDerWaalsContact C-N 3.29Å; D365-K367 PolarHBondContact O-N 3.19Å; D365-M368 HydrophobicContact CB-CB 4.01Å; D365-M368 PolarHBondContact O-N 3Å; D365-M368 WeakPolarHBondContact OD1-CB 3.1Å; D365-M368 PolarHBondContact OD1-N 3.35Å; D365-T369 VanDerWaalsContact O-CB 3.3Å; D365-T369 WeakPolarHBondContact O-CB 3.45Å; D365-T369 PolarHBondContact O-N 3.3Å; D365-T369 PolarHBondContact O-OG1 2.71Å
366	W	93	Very high	91.7	Very high	41 Å²	41	24.7 Å²	24.7	16%	0.155	13%	0.132	C	C	.	.	H	α-helix	trans	-62	-39.1	-171.6	-77.1	86.2	0	0	0	112.5	L322 P359 W361 I364 M368 T369 I370 F432	L322-W366 HydrophobicContact CD1-CE3 3.79Å; L322-W366 HydrophobicContact CD1-CH2 4.39Å; L322-W366 HydrophobicContact CD1-CZ3 3.72Å; L322-W366 HydrophobicContact CD2-CE3 4.13Å; L322-W366 HydrophobicContact CD2-CZ3 4.15Å; P359-W366 HydrophobicContact CG-CB 4.24Å; P359-W366 PolarHBondContact O-N 2.9Å; W361-W366 AromaticContact CE3-CD1 3.7Å; W361-W366 HydrophobicContact CE3-CD2 4.18Å; W361-W366 AromaticContact CE3-CE2 3.97Å; W361-W366 AromaticContact CE3-CG 4Å; W361-W366 HydrophobicContact CE3-CG 4Å; W361-W366 AromaticContact CE3-NE1 3.7Å; W361-W366 HydrophobicContact CZ3-CD2 4.5Å; W361-W366 HydrophobicContact CZ3-CG 4.28Å; W361-W366 PolarHBondContact O-NE1 3.39Å; I364-W366 VanDerWaalsContact O-CD1 3.24Å; I364-W366 PolarHBondContact O-N 3.28Å; I364-W366 VanDerWaalsContact O-N 3.12Å; W366-M368 PolarHBondContact O-N 2.88Å; W366-T369 PolarHBondContact O-N 3.39Å; W366-I370 HydrophobicContact CE3-CD1 4.27Å; W366-I370 WeakPolarHBondContact O-CB 3.31Å; W366-I370 VanDerWaalsContact O-CD1 3.26Å; W366-I370 WeakPolarHBondContact O-CD1 3.4Å; W366-I370 VanDerWaalsContact O-CG1 3.28Å; W366-I370 WeakPolarHBondContact O-CG1 3.1Å; W366-I370 PolarHBondContact O-N 3.23Å; W366-F432 HydrophobicContact CB-CE1 4.49Å; W366-F432 HydrophobicContact CB-CZ 4.14Å
367	K	93.1	Very high	92.2	Very high	0 Å²	0	23.4 Å²	23.4	0%	0	13%	0.129	C	C	.	.	H	α-helix	trans	-64.2	-44.6	-179.7	-169.8	171.1	173.8	-174.2	0	111.4	V357 D365 T371 E426 M427 V430 F432 F436	V357-K367 WeakPolarHBondContact O-CD 3.32Å; V357-K367 PolarHBondContact O-NZ 2.84Å; V357-K367 VanDerWaalsContact O-NZ 3.16Å; D365-K367 VanDerWaalsContact C-N 3.29Å; D365-K367 PolarHBondContact O-N 3.19Å; K367-T371 WeakPolarHBondContact O-CB 3.14Å; K367-T371 PolarHBondContact O-N 3.5Å; K367-T371 VanDerWaalsContact O-N 3.15Å; K367-T371 PolarHBondContact O-OG1 3.45Å; K367-E426 WeakPolarHBondContact CE-O 3.42Å; K367-E426 PolarHBondContact NZ-O 3.49Å; K367-M427 HydrophobicContact CB-SD 4.4Å; K367-M427 HydrophobicContact CD-SD 3.88Å; K367-M427 HydrophobicContact CG-CE 3.91Å; K367-M427 HydrophobicContact CG-SD 3.77Å; K367-M427 PolarHBondContact NZ-O 2.86Å; K367-V430 PolarHBondContact NZ-O 2.87Å; K367-F432 HydrophobicContact CB-CD2 3.95Å; K367-F432 HydrophobicContact CB-CE2 4.41Å; K367-F432 HydrophobicContact CG-CD2 4.05Å; K367-F436 HydrophobicContact CD-CE2 4.42Å; K367-F436 HydrophobicContact CD-CZ 4.15Å; K367-F436 HydrophobicContact CG-CD1 4.43Å; K367-F436 HydrophobicContact CG-CE1 3.59Å; K367-F436 HydrophobicContact CG-CE2 4.15Å; K367-F436 HydrophobicContact CG-CZ 3.41Å; K367-F436 VanDerWaalsContact CG-CZ 3.41Å
368	M	93	Very high	92.7	Very high	0 Å²	0	21.8 Å²	21.8	0%	0	12%	0.119	C	C	.	.	H	α-helix	trans	-70	-43.7	178	-162.5	61.3	-178.9	0	0	111.7	Y269 D365 W366 I370 T371 R372 F414 E418 F421 M427	Y269-M368 HydrophobicContact CD2-CB 4.49Å; Y269-M368 HydrophobicContact CD2-CG 4.41Å; Y269-M368 HydrophobicContact CE1-CE 4.04Å; Y269-M368 HydrophobicContact CE1-CG 3.8Å; Y269-M368 HydrophobicContact CE2-CB 3.88Å; Y269-M368 HydrophobicContact CE2-CG 3.61Å; Y269-M368 WeakPolarHBondContact OH-CG 3.43Å; D365-M368 HydrophobicContact CB-CB 4.01Å; D365-M368 PolarHBondContact O-N 3Å; D365-M368 WeakPolarHBondContact OD1-CB 3.1Å; D365-M368 PolarHBondContact OD1-N 3.35Å; W366-M368 PolarHBondContact O-N 2.88Å; M368-I370 PolarHBondContact O-N 2.88Å; M368-T371 PolarHBondContact O-N 3.35Å; M368-R372 WeakPolarHBondContact O-CD 3.46Å; M368-R372 WeakPolarHBondContact O-CG 3.43Å; M368-R372 PolarHBondContact O-N 3.32Å; M368-F414 HydrophobicContact CE-CE1 4.5Å; M368-F414 HydrophobicContact CE-CZ 3.87Å; M368-E418 HydrophobicContact CE-CB 4.46Å; M368-E418 HydrophobicContact CE-CG 3.2Å; M368-F421 HydrophobicContact CE-CD1 4.2Å; M368-F421 HydrophobicContact SD-CD1 4.05Å; M368-M427 HydrophobicContact SD-CE 3.66Å; M368-M427 HydrophobicContact SD-SD 4.19Å
369	T	94.9	Very high	93.2	Very high	4 Å²	4	20 Å²	20	3%	0.025	11%	0.113	C	C	.	.	H	α-helix	trans	-60.1	-44.8	179.8	-54.6	0	0	0	0	111.7	Q247 A251 I364 D365 W366 R372 S373	Q247-T369 HydrophobicContact CB-CG2 4.24Å; A251-T369 HydrophobicContact CB-CG2 4.15Å; I364-T369 HydrophobicContact CG2-CG2 4.34Å; I364-T369 VanDerWaalsContact CG2-OG1 3.26Å; I364-T369 WeakPolarHBondContact CG2-OG1 3.37Å; D365-T369 VanDerWaalsContact O-CB 3.3Å; D365-T369 WeakPolarHBondContact O-CB 3.45Å; D365-T369 PolarHBondContact O-N 3.3Å; D365-T369 PolarHBondContact O-OG1 2.71Å; W366-T369 PolarHBondContact O-N 3.39Å; T369-R372 WeakPolarHBondContact O-CB 3.31Å; T369-R372 PolarHBondContact O-N 3.49Å; T369-S373 PolarHBondContact O-N 3.48Å; T369-S373 PolarHBondContact O-OG 2.93Å
370	I	95.9	Very high	93.6	Very high	4 Å²	4	21 Å²	21	2%	0.021	12%	0.118	C	C	.	.	H	α-helix	trans	-69.6	-35.9	177.6	-71.8	159.3	0	0	0	112.3	L322 W366 M368 R372 S373 G374 F432 R440 L441	L322-I370 HydrophobicContact CD2-CD1 3.33Å; L322-I370 HydrophobicContact CD2-CG1 4.03Å; L322-I370 HydrophobicContact CG-CD1 4.31Å; W366-I370 HydrophobicContact CE3-CD1 4.27Å; W366-I370 WeakPolarHBondContact O-CB 3.31Å; W366-I370 VanDerWaalsContact O-CD1 3.26Å; W366-I370 WeakPolarHBondContact O-CD1 3.4Å; W366-I370 VanDerWaalsContact O-CG1 3.28Å; W366-I370 WeakPolarHBondContact O-CG1 3.1Å; W366-I370 PolarHBondContact O-N 3.23Å; M368-I370 PolarHBondContact O-N 2.88Å; I370-R372 VanDerWaalsContact C-N 3.29Å; I370-R372 PolarHBondContact O-N 3.17Å; I370-S373 WeakPolarHBondContact CA-OG 3.35Å; I370-S373 PolarHBondContact O-N 3.46Å; I370-S373 PolarHBondContact O-OG 3.49Å; I370-G374 PolarHBondContact O-N 2.88Å; I370-F432 HydrophobicContact CD1-CE2 3.47Å; I370-F432 VanDerWaalsContact CD1-CE2 3.47Å; I370-F432 HydrophobicContact CD1-CZ 3.29Å; I370-R440 HydrophobicContact CG2-CB 3.51Å; I370-R440 HydrophobicContact CG2-CG 4.15Å; I370-L441 HydrophobicContact CG2-CD1 4.42Å; I370-L441 HydrophobicContact CG2-CD2 3.92Å; I370-L441 HydrophobicContact CG2-CG 3.84Å
371	T	95.9	Very high	94.1	Very high	4 Å²	4	19.5 Å²	19.5	3%	0.025	11%	0.112	C	C	.	.	H	α-helix	trans	-62.8	-43.3	175.3	-58.7	0	0	0	0	110.3	K367 M368 L375 F414 F421 M427 F436	K367-T371 WeakPolarHBondContact O-CB 3.14Å; K367-T371 PolarHBondContact O-N 3.5Å; K367-T371 VanDerWaalsContact O-N 3.15Å; K367-T371 PolarHBondContact O-OG1 3.45Å; M368-T371 PolarHBondContact O-N 3.35Å; T371-L375 HydrophobicContact CG2-CD1 4.12Å; T371-L375 WeakPolarHBondContact O-CG 3.33Å; T371-L375 PolarHBondContact O-N 2.98Å; T371-L375 VanDerWaalsContact O-N 3.13Å; T371-F414 HydrophobicContact CG2-CE2 4.06Å; T371-F414 HydrophobicContact CG2-CZ 3.89Å; T371-F421 HydrophobicContact CG2-CE1 4.08Å; T371-F421 HydrophobicContact CG2-CZ 4.33Å; T371-M427 HydrophobicContact CG2-CE 4.21Å; T371-M427 WeakPolarHBondContact OG1-CE 3.46Å; T371-F436 WeakPolarHBondContact OG1-CZ 3.42Å
372	R	95.3	Very high	94.6	Very high	0 Å²	0	17 Å²	17	0%	0	10%	0.102	C	C	.	.	H	α-helix	trans	-65.3	-44.1	176.7	-68.2	164	54.8	167	4.5	112.3	Y269 N272 S273 S276 M368 T369 I370 G374 L375 M376 F414 E418	Y269-R372 VanDerWaalsContact OH-CD 3.31Å; Y269-R372 WeakPolarHBondContact OH-CD 3.37Å; Y269-R372 PolarHBondContact OH-NH1 2.94Å; N272-R372 PolarHBondContact OD1-NH1 3.22Å; N272-R372 PolarHBondContact OD1-NH2 2.69Å; S273-R372 WeakPolarHBondContact OG-CD 3.19Å; S273-R372 VanDerWaalsContact OG-CG 3.28Å; S273-R372 WeakPolarHBondContact OG-CG 3.35Å; S273-R372 VanDerWaalsContact OG-CZ 3.3Å; S273-R372 PolarHBondContact OG-NE 3.48Å; S276-R372 PolarHBondContact OG-NH2 3.15Å; M368-R372 WeakPolarHBondContact O-CD 3.46Å; M368-R372 WeakPolarHBondContact O-CG 3.43Å; M368-R372 PolarHBondContact O-N 3.32Å; T369-R372 WeakPolarHBondContact O-CB 3.31Å; T369-R372 PolarHBondContact O-N 3.49Å; I370-R372 VanDerWaalsContact C-N 3.29Å; I370-R372 PolarHBondContact O-N 3.17Å; R372-G374 VanDerWaalsContact C-N 3.31Å; R372-G374 PolarHBondContact O-N 2.64Å; R372-L375 PolarHBondContact O-N 3.35Å; R372-M376 WeakPolarHBondContact O-CB 3.08Å; R372-M376 PolarHBondContact O-N 3.11Å; R372-F414 HydrophobicContact CG-CE1 4.03Å; R372-F414 HydrophobicContact CG-CZ 4.42Å; R372-E418 IonicContact CZ-OE1 3.96Å; R372-E418 IonicContact NH1-OE1 3.6Å
373	S	96.6	Very high	95	Very high	2 Å²	2	12.3 Å²	12.3	1%	0.014	8%	0.078	C	C	.	.	H	α-helix	trans	-63.9	-37.9	-179.8	69.4	0	0	0	0	111.9	Y243 T369 I370 A377 L441	Y243-S373 WeakPolarHBondContact OH-CA 3.5Å; Y243-S373 PolarHBondContact OH-O 2.91Å; T369-S373 PolarHBondContact O-N 3.48Å; T369-S373 PolarHBondContact O-OG 2.93Å; I370-S373 WeakPolarHBondContact CA-OG 3.35Å; I370-S373 PolarHBondContact O-N 3.46Å; I370-S373 PolarHBondContact O-OG 3.49Å; S373-A377 WeakPolarHBondContact O-CB 3.28Å; S373-A377 PolarHBondContact O-N 2.88Å; S373-L441 WeakPolarHBondContact OG-CD2 3.27Å
374	G	96.7	Very high	95.5	Very high	1 Å²	1	9.8 Å²	9.8	1%	0.01	5%	0.052	C	C	.	.	H	α-helix	trans	-65.8	-46.6	174.3	0	0	0	0	0	112.9	I370 R372 A377 R440 L444	I370-G374 PolarHBondContact O-N 2.88Å; R372-G374 VanDerWaalsContact C-N 3.31Å; R372-G374 PolarHBondContact O-N 2.64Å; G374-A377 PolarHBondContact O-N 3.11Å; G374-R440 WeakPolarHBondContact CA-O 3.21Å; G374-L444 VanDerWaalsContact C-CD2 3.45Å
375	L	97.1	Very high	95.7	Very high	11 Å²	11	9.4 Å²	9.4	6%	0.058	5%	0.049	C	C	.	.	H	α-helix	trans	-67.7	-38.6	-179.9	-75.5	169	0	0	0	112.5	T371 R372 A377 L378 P379 W410 V411 F414 F415 L444	T371-L375 HydrophobicContact CG2-CD1 4.12Å; T371-L375 WeakPolarHBondContact O-CG 3.33Å; T371-L375 PolarHBondContact O-N 2.98Å; T371-L375 VanDerWaalsContact O-N 3.13Å; R372-L375 PolarHBondContact O-N 3.35Å; L375-A377 VanDerWaalsContact C-N 3.3Å; L375-A377 PolarHBondContact O-N 3.23Å; L375-L378 PolarHBondContact O-N 3.26Å; L375-P379 VanDerWaalsContact O-CD 3.25Å; L375-P379 WeakPolarHBondContact O-CD 3.47Å; L375-W410 HydrophobicContact CD2-CH2 4.48Å; L375-W410 HydrophobicContact CD2-CZ2 4.21Å; L375-V411 HydrophobicContact CB-CG1 4.39Å; L375-V411 HydrophobicContact CB-CG2 4.35Å; L375-V411 HydrophobicContact CD2-CG2 4.27Å; L375-V411 VanDerWaalsContact O-CG2 3.3Å; L375-V411 WeakPolarHBondContact O-CG2 3.13Å; L375-F414 HydrophobicContact CD1-CB 4.17Å; L375-F414 HydrophobicContact CD1-CD1 3.4Å; L375-F414 HydrophobicContact CD1-CD2 3.63Å; L375-F414 HydrophobicContact CD1-CE1 3.6Å; L375-F414 HydrophobicContact CD1-CE2 3.73Å; L375-F414 HydrophobicContact CD1-CG 3.45Å; L375-F414 VanDerWaalsContact CD1-CG 3.45Å; L375-F414 HydrophobicContact CD1-CZ 3.76Å; L375-F415 HydrophobicContact CB-CE1 4.45Å; L375-F415 HydrophobicContact CB-CZ 4.43Å; L375-L444 HydrophobicContact CD2-CD2 3.85Å; L375-L444 HydrophobicContact CG-CD2 3.86Å
376	M	96.7	Very high	95.9	Very high	0 Å²	0	10.1 Å²	10.1	0%	0	5%	0.053	C	C	.	.	H	α-helix	trans	-68.3	-30.2	-180	-170	169.6	-58.2	0	0	112.8	Q247 F277 F280 R372 L378 P379 L380 F415	Q247-M376 PolarHBondContact NE2-SD 3.2Å; F277-M376 HydrophobicContact CB-CE 4.18Å; F277-M376 HydrophobicContact CD2-CG 4.1Å; F280-M376 HydrophobicContact CB-CG 4.39Å; F280-M376 HydrophobicContact CB-SD 3.55Å; F280-M376 VanDerWaalsContact CB-SD 3.55Å; F280-M376 HydrophobicContact CD1-SD 4.26Å; F280-M376 HydrophobicContact CD2-CE 4.29Å; F280-M376 HydrophobicContact CD2-SD 3.26Å; F280-M376 WeakPolarHBondContact CD2-SD 3.49Å; F280-M376 HydrophobicContact CE2-SD 3.97Å; F280-M376 HydrophobicContact CG-SD 3.43Å; F280-M376 WeakPolarHBondContact CG-SD 2.79Å; R372-M376 WeakPolarHBondContact O-CB 3.08Å; R372-M376 PolarHBondContact O-N 3.11Å; M376-L378 VanDerWaalsContact C-N 3.27Å; M376-L378 PolarHBondContact O-N 2.87Å; M376-P379 WeakPolarHBondContact O-CD 3.38Å; M376-P379 WeakPolarHBondContact O-CG 3.37Å; M376-L380 HydrophobicContact CG-CD1 4.28Å; M376-L380 WeakPolarHBondContact O-CG 3.32Å; M376-F415 HydrophobicContact CB-CZ 3.95Å; M376-F415 HydrophobicContact CE-CE1 4.49Å; M376-F415 HydrophobicContact CE-CE2 4.21Å; M376-F415 HydrophobicContact CE-CZ 3.87Å; M376-F415 HydrophobicContact CG-CZ 4.46Å
377	A	96.9	Very high	96.1	Very high	15 Å²	15	11.6 Å²	11.6	12%	0.124	6%	0.061	C	C	.	.	H	α-helix	trans	-65	-31.2	178.9	0	0	0	0	0	112.5	S373 G374 L375 L380 I381 P445	S373-A377 WeakPolarHBondContact O-CB 3.28Å; S373-A377 PolarHBondContact O-N 2.88Å; G374-A377 PolarHBondContact O-N 3.11Å; L375-A377 VanDerWaalsContact C-N 3.3Å; L375-A377 PolarHBondContact O-N 3.23Å; A377-L380 PolarHBondContact O-N 3.06Å; A377-I381 HydrophobicContact CB-CD1 4.35Å; A377-I381 WeakPolarHBondContact O-CB 3.49Å; A377-I381 WeakPolarHBondContact O-CD1 3.15Å; A377-I381 WeakPolarHBondContact O-CG1 3.48Å; A377-I381 PolarHBondContact O-N 3.4Å; A377-P445 HydrophobicContact CB-CB 3.91Å
378	L	96.6	Very high	96.1	Very high	0 Å²	0	15.4 Å²	15.4	0%	0	8%	0.075	C	C	.	.	H	α-helix	trans	-57.2	-61.7	-178.7	-77.4	167	0	0	0	113.5	L375 M376 L380 I381 D382 W410 L444 S449	L375-L378 PolarHBondContact O-N 3.26Å; M376-L378 VanDerWaalsContact C-N 3.27Å; M376-L378 PolarHBondContact O-N 2.87Å; L378-L380 PolarHBondContact O-N 3.14Å; L378-I381 PolarHBondContact O-N 3.23Å; L378-I381 VanDerWaalsContact O-N 3.09Å; L378-D382 VanDerWaalsContact O-CG 3.22Å; L378-D382 PolarHBondContact O-N 3.12Å; L378-W410 HydrophobicContact CD1-CH2 4.46Å; L378-W410 HydrophobicContact CD1-CZ3 3.91Å; L378-L444 HydrophobicContact CD1-CD1 3.77Å; L378-L444 HydrophobicContact CD1-CG 4Å; L378-S449 WeakPolarHBondContact CD2-OG 3.32Å
379	P	97.3	Very high	96.2	Very high	5 Å²	5	15.5 Å²	15.5	3%	0.032	8%	0.075	C	C	.	.	H	α-helix	trans	-62.9	-28.4	179.6	24.6	-35.3	0	0	0	112.8	F277 L375 M376 D382 L383 V411	F277-P379 HydrophobicContact CE2-CB 4.27Å; F277-P379 HydrophobicContact CE2-CG 3.61Å; F277-P379 HydrophobicContact CZ-CB 4.34Å; F277-P379 HydrophobicContact CZ-CG 4.06Å; L375-P379 VanDerWaalsContact O-CD 3.25Å; L375-P379 WeakPolarHBondContact O-CD 3.47Å; M376-P379 WeakPolarHBondContact O-CD 3.38Å; M376-P379 WeakPolarHBondContact O-CG 3.37Å; P379-D382 PolarHBondContact O-N 3.2Å; P379-L383 WeakPolarHBondContact O-CB 3.45Å; P379-L383 WeakPolarHBondContact O-CG 3.21Å; P379-L383 PolarHBondContact O-N 2.94Å; P379-V411 HydrophobicContact CG-CG1 4.23Å
380	L	97.1	Very high	96.2	Very high	22 Å²	22	21.3 Å²	21.3	12%	0.115	10%	0.098	C	C	.	.	H	α-helix	trans	-67.5	-42.1	174.6	-66.1	173.6	0	0	0	111.7	Y243 F280 I281 F284 M376 A377 L378 T384	Y243-L380 HydrophobicContact CE2-CD1 4.38Å; F280-L380 HydrophobicContact CB-CD1 4.47Å; I281-L380 HydrophobicContact CD1-CD2 3.86Å; F284-L380 HydrophobicContact CB-CD2 3.77Å; F284-L380 HydrophobicContact CD2-CD2 3.92Å; F284-L380 HydrophobicContact CG-CD2 3.95Å; M376-L380 HydrophobicContact CG-CD1 4.28Å; M376-L380 WeakPolarHBondContact O-CG 3.32Å; A377-L380 PolarHBondContact O-N 3.06Å; L378-L380 PolarHBondContact O-N 3.14Å; L380-T384 PolarHBondContact O-N 3.17Å; L380-T384 PolarHBondContact O-OG1 3.07Å
381	I	96.6	Very high	96	Very high	21 Å²	21	24.3 Å²	24.3	11%	0.108	11%	0.112	C	C	.	.	H	α-helix	trans	-67.3	-41.2	174.9	-67.1	164.1	0	0	0	110.2	W308 A377 L378 L383 T384 Y385 P445	W308-I381 HydrophobicContact CH2-CD1 4.29Å; W308-I381 HydrophobicContact CH2-CG2 4Å; W308-I381 HydrophobicContact CZ3-CD1 4.23Å; W308-I381 HydrophobicContact CZ3-CG1 4.37Å; W308-I381 HydrophobicContact CZ3-CG2 3.8Å; A377-I381 HydrophobicContact CB-CD1 4.35Å; A377-I381 WeakPolarHBondContact O-CB 3.49Å; A377-I381 WeakPolarHBondContact O-CD1 3.15Å; A377-I381 WeakPolarHBondContact O-CG1 3.48Å; A377-I381 PolarHBondContact O-N 3.4Å; L378-I381 PolarHBondContact O-N 3.23Å; L378-I381 VanDerWaalsContact O-N 3.09Å; I381-L383 PolarHBondContact O-N 3.44Å; I381-T384 VanDerWaalsContact O-CB 3.25Å; I381-T384 WeakPolarHBondContact O-CB 3.25Å; I381-T384 PolarHBondContact O-N 2.94Å; I381-Y385 HydrophobicContact CG2-CD2 3.75Å; I381-Y385 HydrophobicContact CG2-CE2 3.4Å; I381-Y385 VanDerWaalsContact O-CD2 3.23Å; I381-Y385 WeakPolarHBondContact O-CD2 3.37Å; I381-Y385 PolarHBondContact O-N 3.31Å; I381-P445 HydrophobicContact CD1-CB 3.81Å
382	D	97.2	Very high	95.8	Very high	1 Å²	1	28.8 Å²	28.8	1%	0.005	13%	0.132	C	C	.	.	H	α-helix	trans	-62.2	-45.2	177.3	-63.9	-23	0	0	0	111.7	L378 P379 T384 Y385 I386 A404 H407 S452	L378-D382 VanDerWaalsContact O-CG 3.22Å; L378-D382 PolarHBondContact O-N 3.12Å; P379-D382 PolarHBondContact O-N 3.2Å; D382-T384 VanDerWaalsContact C-N 3.32Å; D382-T384 PolarHBondContact O-N 2.89Å; D382-Y385 PolarHBondContact O-N 2.95Å; D382-I386 WeakPolarHBondContact O-CG1 3.35Å; D382-I386 PolarHBondContact O-N 2.88Å; D382-A404 HydrophobicContact CB-CB 3.73Å; D382-H407 IonicContact OD1-ND1 3.99Å; D382-H407 WeakPolarHBondContact OD2-CB 3.31Å; D382-H407 IonicContact OD2-CG 2.79Å; D382-H407 IonicContact OD2-ND1 3.54Å; D382-H407 PolarHBondContact OD2-ND1 2.71Å; D382-S452 VanDerWaalsContact OD1-CB 3.27Å; D382-S452 WeakPolarHBondContact OD1-CB 3.35Å; D382-S452 PolarHBondContact OD1-OG 3.48Å
383	L	97.3	Very high	95.6	Very high	49 Å²	49	32.4 Å²	32.4	26%	0.257	15%	0.146	S	C	.	.	H	α-helix	trans	-60.6	-42.3	174.3	-74.3	171.8	0	0	0	111.4	I281 F284 P379 I381 Y385 I386 F387	I281-L383 HydrophobicContact CD1-CD1 3.66Å; F284-L383 HydrophobicContact CD1-CB 4.47Å; F284-L383 HydrophobicContact CD1-CD1 4.34Å; F284-L383 HydrophobicContact CE1-CB 3.75Å; F284-L383 HydrophobicContact CE1-CD1 4.38Å; F284-L383 HydrophobicContact CZ-CB 3.82Å; P379-L383 WeakPolarHBondContact O-CB 3.45Å; P379-L383 WeakPolarHBondContact O-CG 3.21Å; P379-L383 PolarHBondContact O-N 2.94Å; I381-L383 PolarHBondContact O-N 3.44Å; L383-Y385 VanDerWaalsContact C-N 3.29Å; L383-Y385 PolarHBondContact O-N 3.38Å; L383-I386 PolarHBondContact O-N 3.02Å; L383-I386 VanDerWaalsContact O-N 3.15Å; L383-F387 HydrophobicContact CB-CD2 4.46Å; L383-F387 HydrophobicContact CB-CE2 4.5Å; L383-F387 HydrophobicContact CD2-CE2 4.36Å; L383-F387 WeakPolarHBondContact O-CD2 3.46Å; L383-F387 PolarHBondContact O-N 3.37Å
384	T	96.6	Very high	95.4	Very high	3 Å²	3	40.2 Å²	40.2	2%	0.018	18%	0.183	C	C	.	.	H	α-helix	trans	-53.3	-48.1	174.5	-58.2	0	0	0	0	111	F284 P300 L304 P305 L380 I381 D382 R388	F284-T384 WeakPolarHBondContact CE2-OG1 3.32Å; P300-T384 WeakPolarHBondContact O-CG2 3.45Å; L304-T384 HydrophobicContact CB-CG2 3.84Å; L304-T384 HydrophobicContact CD1-CG2 4.06Å; L304-T384 WeakPolarHBondContact CD1-OG1 3.39Å; L304-T384 HydrophobicContact CG-CG2 4.48Å; P305-T384 HydrophobicContact CG-CG2 3.99Å; L380-T384 PolarHBondContact O-N 3.17Å; L380-T384 PolarHBondContact O-OG1 3.07Å; I381-T384 VanDerWaalsContact O-CB 3.25Å; I381-T384 WeakPolarHBondContact O-CB 3.25Å; I381-T384 PolarHBondContact O-N 2.94Å; D382-T384 VanDerWaalsContact C-N 3.32Å; D382-T384 PolarHBondContact O-N 2.89Å; T384-R388 WeakPolarHBondContact O-CB 3.41Å; T384-R388 PolarHBondContact O-N 3.28Å
385	Y	95.2	Very high	95.2	Very high	5 Å²	5	44 Å²	44	2%	0.02	20%	0.197	C	C	.	.	H	α-helix	trans	-70.3	-33.3	179.3	-74.2	-58.9	0	0	0	113.3	F177 P305 W308 I381 D382 L383 Q389	F177-Y385 WeakPolarHBondContact CZ-OH 3.42Å; P305-Y385 HydrophobicContact CG-CE1 4.43Å; W308-Y385 HydrophobicContact CZ3-CE2 4.38Å; I381-Y385 HydrophobicContact CG2-CD2 3.75Å; I381-Y385 HydrophobicContact CG2-CE2 3.4Å; I381-Y385 VanDerWaalsContact O-CD2 3.23Å; I381-Y385 WeakPolarHBondContact O-CD2 3.37Å; I381-Y385 PolarHBondContact O-N 3.31Å; D382-Y385 PolarHBondContact O-N 2.95Å; L383-Y385 VanDerWaalsContact C-N 3.29Å; L383-Y385 PolarHBondContact O-N 3.38Å; Y385-Q389 VanDerWaalsContact O-CB 3.27Å; Y385-Q389 WeakPolarHBondContact O-CB 3.32Å; Y385-Q389 PolarHBondContact O-N 3.41Å
386	I	96.3	Very high	94.9	Very high	25 Å²	25	46.7 Å²	46.7	13%	0.128	21%	0.211	C	C	.	.	H	α-helix	trans	-62.8	-52.4	173.9	-73.7	169.6	0	0	0	110.7	D382 L383 R388 Q389 Y390 I396 L400 A404	D382-I386 WeakPolarHBondContact O-CG1 3.35Å; D382-I386 PolarHBondContact O-N 2.88Å; L383-I386 PolarHBondContact O-N 3.02Å; L383-I386 VanDerWaalsContact O-N 3.15Å; I386-R388 VanDerWaalsContact C-N 3.35Å; I386-R388 PolarHBondContact O-N 3.26Å; I386-Q389 PolarHBondContact O-N 3.37Å; I386-Y390 PolarHBondContact O-N 3.06Å; I386-I396 HydrophobicContact CG2-CD1 3.68Å; I386-I396 HydrophobicContact CG2-CG1 4.1Å; I386-I396 HydrophobicContact CG2-CG2 4.21Å; I386-L400 HydrophobicContact CG1-CD2 3.88Å; I386-L400 HydrophobicContact CG1-CG 3.85Å; I386-A404 HydrophobicContact CD1-CB 3.53Å
387	F	96.1	Very high	94.6	Very high	72 Å²	72	46.7 Å²	46.7	32%	0.316	21%	0.211	S	C	.	.	H	α-helix	trans	-63.8	-42.5	179.4	-77.7	-71.3	0	0	0	111.1	F284 E288 L383 Q389 Y390 E391	F284-F387 AromaticContact CE1-CD2 3.89Å; F284-F387 HydrophobicContact CE1-CD2 3.89Å; F284-F387 AromaticContact CE1-CE2 3.9Å; F284-F387 HydrophobicContact CE1-CE2 3.9Å; F284-F387 HydrophobicContact CZ-CD2 4.31Å; E288-F387 HydrophobicContact CG-CB 4.45Å; E288-F387 HydrophobicContact CG-CD1 3.97Å; E288-F387 HydrophobicContact CG-CD2 3.99Å; E288-F387 HydrophobicContact CG-CE1 4.19Å; E288-F387 HydrophobicContact CG-CE2 4.24Å; E288-F387 HydrophobicContact CG-CG 3.88Å; E288-F387 HydrophobicContact CG-CZ 4.33Å; E288-F387 WeakPolarHBondContact OE1-CB 3.3Å; L383-F387 HydrophobicContact CB-CD2 4.46Å; L383-F387 HydrophobicContact CB-CE2 4.5Å; L383-F387 HydrophobicContact CD2-CE2 4.36Å; L383-F387 WeakPolarHBondContact O-CD2 3.46Å; L383-F387 PolarHBondContact O-N 3.37Å; F387-Q389 VanDerWaalsContact C-N 3.31Å; F387-Q389 PolarHBondContact O-N 2.83Å; F387-Y390 PolarHBondContact O-N 2.82Å; F387-Y390 VanDerWaalsContact O-N 3.16Å; F387-E391 WeakPolarHBondContact O-CG 3.31Å; F387-E391 PolarHBondContact O-N 2.92Å
388	R	93.7	Very high	94.4	Very high	80 Å²	80	47.9 Å²	47.9	30%	0.302	22%	0.217	S	C	.	.	H	α-helix	trans	-58.5	-42.3	175.6	-179.3	58.2	176.6	133.2	2.7	112.4	S301 P305 T384 I386 Q392	S301-R388 WeakPolarHBondContact O-CD 3.38Å; P305-R388 HydrophobicContact CG-CG 4.28Å; T384-R388 WeakPolarHBondContact O-CB 3.41Å; T384-R388 PolarHBondContact O-N 3.28Å; I386-R388 VanDerWaalsContact C-N 3.35Å; I386-R388 PolarHBondContact O-N 3.26Å; R388-Q392 WeakPolarHBondContact O-CB 3.29Å; R388-Q392 PolarHBondContact O-N 2.73Å; R388-Q392 VanDerWaalsContact O-N 3.13Å
389	Q	93.8	Very high	94.2	Very high	1 Å²	1	47.9 Å²	47.9	1%	0.005	22%	0.217	C	C	.	.	H	α-helix	trans	-66.4	-41.1	177.1	-174.4	172.8	70.3	0	0	111.3	Y385 I386 F387 Q392 Y393 L400 L455 S456 P459	Y385-Q389 VanDerWaalsContact O-CB 3.27Å; Y385-Q389 WeakPolarHBondContact O-CB 3.32Å; Y385-Q389 PolarHBondContact O-N 3.41Å; I386-Q389 PolarHBondContact O-N 3.37Å; F387-Q389 VanDerWaalsContact C-N 3.31Å; F387-Q389 PolarHBondContact O-N 2.83Å; Q389-Q392 PolarHBondContact O-N 3.24Å; Q389-Y393 HydrophobicContact CG-CD2 3.83Å; Q389-Y393 HydrophobicContact CG-CE2 4.39Å; Q389-Y393 WeakPolarHBondContact O-CD2 3.4Å; Q389-Y393 PolarHBondContact O-N 2.98Å; Q389-L400 HydrophobicContact CB-CD2 4.28Å; Q389-L455 PolarHBondContact NE2-O 3.04Å; Q389-S456 WeakPolarHBondContact CG-O 3.27Å; Q389-S456 VanDerWaalsContact NE2-C 3.31Å; Q389-S456 PolarHBondContact NE2-O 3.38Å; Q389-P459 HydrophobicContact CG-CB 4.5Å
390	Y	94.9	Very high	94	Very high	126 Å²	126	47.7 Å²	47.7	49%	0.494	22%	0.216	S	C	.	.	H	α-helix	trans	-63.8	-44.3	175.7	-175.4	-105.1	0	0	0	112.2	I386 F387 Q392 E394 I396	I386-Y390 PolarHBondContact O-N 3.06Å; F387-Y390 PolarHBondContact O-N 2.82Å; F387-Y390 VanDerWaalsContact O-N 3.16Å; Y390-Q392 VanDerWaalsContact C-N 3.27Å; Y390-Q392 PolarHBondContact O-N 3.18Å; Y390-E394 WeakPolarHBondContact CE2-O 3.46Å; Y390-E394 WeakPolarHBondContact O-CA 3.45Å; Y390-E394 PolarHBondContact O-N 2.6Å; Y390-I396 HydrophobicContact CD2-CD1 4.32Å; Y390-I396 HydrophobicContact CD2-CG1 4.17Å; Y390-I396 HydrophobicContact CG-CG1 4.49Å
391	E	92.5	Very high	93.9	Very high	67 Å²	67	48.6 Å²	48.6	31%	0.313	23%	0.226	S	C	.	.	H	α-helix	trans	-63	-32.7	177.1	-71.3	-172.6	154.6	0	0	112.9	K299 S301 Q302 F387	K299-E391 IonicContact NZ-OE1 3.92Å; S301-E391 PolarHBondContact OG-OE1 2.71Å; S301-E391 PolarHBondContact OG-OE2 3.18Å; Q302-E391 VanDerWaalsContact CG-OE2 3.26Å; Q302-E391 WeakPolarHBondContact CG-OE2 3.18Å; Q302-E391 PolarHBondContact NE2-OE1 2.98Å; Q302-E391 PolarHBondContact NE2-OE2 3.07Å; F387-E391 WeakPolarHBondContact O-CG 3.31Å; F387-E391 PolarHBondContact O-N 2.92Å
392	Q	91.7	Very high	93.8	Very high	99 Å²	99	48 Å²	48	46%	0.463	23%	0.225	S	C	.	.	H	α-helix	trans	-87.1	-32.6	-176.6	-174.8	172.2	-16.6	0	0	113.6	R388 Q389 Y390	R388-Q392 WeakPolarHBondContact O-CB 3.29Å; R388-Q392 PolarHBondContact O-N 2.73Å; R388-Q392 VanDerWaalsContact O-N 3.13Å; Q389-Q392 PolarHBondContact O-N 3.24Å; Y390-Q392 VanDerWaalsContact C-N 3.27Å; Y390-Q392 PolarHBondContact O-N 3.18Å
393	Y	91.6	Very high	93.7	Very high	75 Å²	75	48 Å²	48	29%	0.294	23%	0.225	S	C	.	.	H	α-helix	trans	-124.7	0.6	-171.5	-57.1	-75.9	0	0	0	114.1	Q389 R395 P459	Q389-Y393 HydrophobicContact CG-CD2 3.83Å; Q389-Y393 HydrophobicContact CG-CE2 4.39Å; Q389-Y393 WeakPolarHBondContact O-CD2 3.4Å; Q389-Y393 PolarHBondContact O-N 2.98Å; Y393-R395 WeakPolarHBondContact O-CD 3.47Å; Y393-R395 VanDerWaalsContact O-CG 3.3Å; Y393-R395 WeakPolarHBondContact O-CG 3.27Å; Y393-R395 PolarHBondContact O-N 3.1Å; Y393-P459 HydrophobicContact CD1-CG 3.9Å; Y393-P459 HydrophobicContact CD2-CB 4.2Å; Y393-P459 HydrophobicContact CD2-CG 4.09Å; Y393-P459 HydrophobicContact CE1-CG 4.18Å; Y393-P459 HydrophobicContact CE2-CG 4.36Å; Y393-P459 HydrophobicContact CG-CB 4.08Å; Y393-P459 HydrophobicContact CG-CG 3.83Å
394	E	92.5	Very high	93.7	Very high	167 Å²	167	46.1 Å²	46.1	78%	0.78	22%	0.216	S	C	*	.	S	Bend	trans	55.8	18	-174.5	-59.6	-176.4	164.8	0	0	114.1	Y390	Y390-E394 WeakPolarHBondContact CE2-O 3.46Å; Y390-E394 WeakPolarHBondContact O-CA 3.45Å; Y390-E394 PolarHBondContact O-N 2.6Å
395	R	91.1	Very high	93.7	Very high	81 Å²	81	50.2 Å²	50.2	31%	0.306	24%	0.237	S	C	.	.	S	Bend	trans	-155.1	153.2	-176.8	67.1	-154.9	178.5	126.9	7.9	111	Y393 P459 D460	Y393-R395 WeakPolarHBondContact O-CD 3.47Å; Y393-R395 VanDerWaalsContact O-CG 3.3Å; Y393-R395 WeakPolarHBondContact O-CG 3.27Å; Y393-R395 PolarHBondContact O-N 3.1Å; R395-P459 HydrophobicContact CG-CB 4.02Å; R395-D460 IonicContact CZ-OD1 3.15Å; R395-D460 IonicContact CZ-OD2 3.83Å; R395-D460 IonicContact NH1-OD1 2.66Å; R395-D460 PolarHBondContact NH1-OD1 3.01Å; R395-D460 IonicContact NH2-OD1 2.94Å; R395-D460 PolarHBondContact NH2-OD1 3.44Å; R395-D460 IonicContact NH2-OD2 2.87Å; R395-D460 PolarHBondContact NH2-OD2 2.84Å
396	I	91.9	Very high	93.8	Very high	67 Å²	67	50 Å²	50	34%	0.344	24%	0.237	S	C	.	.			trans	-112.9	134.8	179.8	-60	159.3	0	0	0	108.8	I386 Y390 P398 A401	I386-I396 HydrophobicContact CG2-CD1 3.68Å; I386-I396 HydrophobicContact CG2-CG1 4.1Å; I386-I396 HydrophobicContact CG2-CG2 4.21Å; Y390-I396 HydrophobicContact CD2-CD1 4.32Å; Y390-I396 HydrophobicContact CD2-CG1 4.17Å; Y390-I396 HydrophobicContact CG-CG1 4.49Å; I396-P398 WeakPolarHBondContact O-CD 3.45Å; I396-A401 HydrophobicContact CG2-CB 4.25Å
397	S	90.6	Very high	93.9	Very high	0 Å²	0	49 Å²	49	0%	0	23%	0.231	C	C	.	.			trans	-65	126.5	171.9	166.7	0	0	0	0	109.8	A399 L400 A401 R458 P459 V461	S397-A399 PolarHBondContact O-N 3.29Å; S397-A399 WeakPolarHBondContact OG-CB 3.31Å; S397-A399 PolarHBondContact OG-N 3.01Å; S397-L400 PolarHBondContact O-N 3.01Å; S397-L400 VanDerWaalsContact O-N 3.13Å; S397-L400 PolarHBondContact OG-N 3.26Å; S397-A401 PolarHBondContact O-N 3.32Å; S397-R458 WeakPolarHBondContact CB-O 3.26Å; S397-P459 WeakPolarHBondContact CA-O 3.23Å; S397-V461 PolarHBondContact OG-O 3.18Å
398	P	91.8	Very high	93.9	Very high	40 Å²	40	47 Å²	47	26%	0.26	23%	0.228	S	C	.	.	H	α-helix	trans	-54.3	-34.9	171.2	-27.1	34.8	0	0	0	112.8	I396 A401 A402 V461 M478	I396-P398 WeakPolarHBondContact O-CD 3.45Å; P398-A401 PolarHBondContact O-N 3.2Å; P398-A402 VanDerWaalsContact O-CB 3.31Å; P398-A402 WeakPolarHBondContact O-CB 3.37Å; P398-A402 PolarHBondContact O-N 2.7Å; P398-V461 WeakPolarHBondContact CD-O 3.31Å; P398-M478 HydrophobicContact CB-CE 3.82Å; P398-M478 HydrophobicContact CB-SD 3.64Å
399	A	91.9	Very high	94.1	Very high	0 Å²	0	45.6 Å²	45.6	0%	0	23%	0.226	C	C	.	.	H	α-helix	trans	-66.1	-43.3	177.5	0	0	0	0	0	112.7	S397 A402 H403 L455 V461 P552	S397-A399 PolarHBondContact O-N 3.29Å; S397-A399 WeakPolarHBondContact OG-CB 3.31Å; S397-A399 PolarHBondContact OG-N 3.01Å; A399-A402 PolarHBondContact O-N 3.01Å; A399-H403 WeakPolarHBondContact O-CB 3.28Å; A399-H403 PolarHBondContact O-N 3.14Å; A399-L455 HydrophobicContact CB-CD2 4.13Å; A399-V461 HydrophobicContact CB-CB 4.16Å; A399-V461 HydrophobicContact CB-CG1 3.69Å; A399-V461 PolarHBondContact N-O 3.42Å; A399-P552 HydrophobicContact CB-CB 3.98Å
400	L	93.6	Very high	94.3	Very high	0 Å²	0	46.6 Å²	46.6	0%	0	23%	0.23	C	C	.	.	H	α-helix	trans	-62.3	-46.1	174.2	178.9	60.2	0	0	0	110.9	I386 Q389 S397 A402 H403 A404 L455	I386-L400 HydrophobicContact CG1-CD2 3.88Å; I386-L400 HydrophobicContact CG1-CG 3.85Å; Q389-L400 HydrophobicContact CB-CD2 4.28Å; S397-L400 PolarHBondContact O-N 3.01Å; S397-L400 VanDerWaalsContact O-N 3.13Å; S397-L400 PolarHBondContact OG-N 3.26Å; L400-A402 PolarHBondContact O-N 3.25Å; L400-H403 PolarHBondContact O-N 3.44Å; L400-A404 WeakPolarHBondContact O-CB 3.38Å; L400-A404 PolarHBondContact O-N 2.97Å; L400-L455 HydrophobicContact CB-CB 4.02Å; L400-L455 HydrophobicContact CD1-CB 4Å
401	A	94.7	Very high	94.5	Very high	41 Å²	41	40.6 Å²	40.6	34%	0.339	21%	0.206	S	C	.	.	H	α-helix	trans	-61.3	-42.9	178.3	0	0	0	0	0	112.1	I396 S397 P398 L405	I396-A401 HydrophobicContact CG2-CB 4.25Å; S397-A401 PolarHBondContact O-N 3.32Å; P398-A401 PolarHBondContact O-N 3.2Å; A401-L405 VanDerWaalsContact O-CB 3.28Å; A401-L405 WeakPolarHBondContact O-CB 3.42Å; A401-L405 PolarHBondContact O-N 3.15Å
402	A	94.6	Very high	94.7	Very high	9 Å²	9	40 Å²	40	7%	0.074	21%	0.205	C	C	.	.	H	α-helix	trans	-65.2	-43.3	176.9	0	0	0	0	0	112.1	P398 A399 L400 L405 M406 M478 M482	P398-A402 VanDerWaalsContact O-CB 3.31Å; P398-A402 WeakPolarHBondContact O-CB 3.37Å; P398-A402 PolarHBondContact O-N 2.7Å; A399-A402 PolarHBondContact O-N 3.01Å; L400-A402 PolarHBondContact O-N 3.25Å; A402-L405 PolarHBondContact O-N 3.46Å; A402-M406 HydrophobicContact CB-CE 4.26Å; A402-M406 WeakPolarHBondContact O-CE 3.49Å; A402-M406 WeakPolarHBondContact O-CG 3.08Å; A402-M406 PolarHBondContact O-N 3.22Å; A402-M478 HydrophobicContact CB-CG 3.73Å; A402-M478 HydrophobicContact CB-SD 3.79Å; A402-M482 HydrophobicContact CB-CE 4.17Å
403	H	95.2	Very high	95	Very high	2 Å²	2	36.2 Å²	36.2	1%	0.009	19%	0.188	C	C	.	.	H	α-helix	trans	-61	-49.6	175.8	-179.5	66.9	0	0	0	112	A399 L400 L405 M406 H407 T451 S452 L455 M549 P552	A399-H403 WeakPolarHBondContact O-CB 3.28Å; A399-H403 PolarHBondContact O-N 3.14Å; L400-H403 PolarHBondContact O-N 3.44Å; H403-L405 VanDerWaalsContact C-N 3.31Å; H403-L405 PolarHBondContact O-N 3.08Å; H403-M406 PolarHBondContact O-N 3.15Å; H403-M406 VanDerWaalsContact O-N 3.15Å; H403-H407 AromaticContact CE1-CE1 3.33Å; H403-H407 PolarHBondContact CE1-CE1 3.32Å; H403-H407 AromaticContact CE1-ND1 3.97Å; H403-H407 AromaticContact CE1-NE2 3.41Å; H403-H407 PolarHBondContact CE1-NE2 2.79Å; H403-H407 AromaticContact NE2-CE1 3.02Å; H403-H407 PolarHBondContact NE2-CE1 3.05Å; H403-H407 AromaticContact NE2-ND1 3.51Å; H403-H407 AromaticContact NE2-NE2 3.62Å; H403-H407 PolarHBondContact O-N 3.08Å; H403-T451 VanDerWaalsContact CE1-CG2 3.44Å; H403-T451 WeakPolarHBondContact CE1-CG2 3.35Å; H403-S452 PolarHBondContact CD2-OG 3.01Å; H403-S452 PolarHBondContact NE2-OG 3.25Å; H403-L455 HydrophobicContact CB-CD1 4.08Å; H403-M549 PolarHBondContact CE1-O 3.26Å; H403-M549 PolarHBondContact ND1-O 2.88Å; H403-P552 HydrophobicContact CB-CB 4.41Å; H403-P552 HydrophobicContact CB-CG 4.32Å
404	A	96.9	Very high	95.2	Very high	9 Å²	9	33.5 Å²	33.5	7%	0.074	18%	0.178	C	C	.	.	H	α-helix	trans	-59.9	-40.2	176.3	0	0	0	0	0	112.4	D382 I386 L400 H407 A408	D382-A404 HydrophobicContact CB-CB 3.73Å; I386-A404 HydrophobicContact CD1-CB 3.53Å; L400-A404 WeakPolarHBondContact O-CB 3.38Å; L400-A404 PolarHBondContact O-N 2.97Å; A404-H407 PolarHBondContact O-N 3.12Å; A404-A408 VanDerWaalsContact O-CB 3.31Å; A404-A408 WeakPolarHBondContact O-CB 3.42Å; A404-A408 PolarHBondContact O-N 2.92Å
405	L	97	Very high	95.3	Very high	89 Å²	89	25.8 Å²	25.8	47%	0.466	14%	0.142	S	C	.	.	H	α-helix	trans	-63.4	-42.4	175.7	179.4	60.2	0	0	0	111.5	A401 A402 H403 A408 L409 M482	A401-L405 VanDerWaalsContact O-CB 3.28Å; A401-L405 WeakPolarHBondContact O-CB 3.42Å; A401-L405 PolarHBondContact O-N 3.15Å; A402-L405 PolarHBondContact O-N 3.46Å; H403-L405 VanDerWaalsContact C-N 3.31Å; H403-L405 PolarHBondContact O-N 3.08Å; L405-A408 PolarHBondContact O-N 3.3Å; L405-L409 HydrophobicContact CD1-CD1 4.34Å; L405-L409 HydrophobicContact CD1-CG 4.2Å; L405-L409 HydrophobicContact CG-CD1 4.19Å; L405-L409 HydrophobicContact CG-CG 4.48Å; L405-L409 WeakPolarHBondContact O-CB 3.21Å; L405-L409 VanDerWaalsContact O-CG 3.28Å; L405-L409 WeakPolarHBondContact O-CG 3.45Å; L405-L409 PolarHBondContact O-N 2.97Å; L405-M482 HydrophobicContact CB-CE 4.43Å; L405-M482 HydrophobicContact CD2-CE 3.87Å; L405-M482 HydrophobicContact CG-CE 4.29Å
406	M	98	Very high	95.5	Very high	0 Å²	0	26 Å²	26	0%	0	15%	0.148	C	C	.	.	H	α-helix	trans	-63.6	-44.7	176.2	-71	-176.9	-97.3	0	0	111.9	A402 H403 A408 L409 W410 S481 M482 F485 M549 P552	A402-M406 HydrophobicContact CB-CE 4.26Å; A402-M406 WeakPolarHBondContact O-CE 3.49Å; A402-M406 WeakPolarHBondContact O-CG 3.08Å; A402-M406 PolarHBondContact O-N 3.22Å; H403-M406 PolarHBondContact O-N 3.15Å; H403-M406 VanDerWaalsContact O-N 3.15Å; M406-A408 PolarHBondContact O-N 3.41Å; M406-L409 PolarHBondContact O-N 2.82Å; M406-W410 WeakPolarHBondContact O-CB 3.4Å; M406-W410 PolarHBondContact O-N 2.92Å; M406-S481 WeakPolarHBondContact CE-OG 3.44Å; M406-M482 HydrophobicContact CE-CE 4.41Å; M406-M482 HydrophobicContact CG-CE 3.83Å; M406-M482 HydrophobicContact CG-SD 4.02Å; M406-F485 HydrophobicContact CB-CD1 4.18Å; M406-F485 HydrophobicContact CB-CD2 3.82Å; M406-F485 HydrophobicContact CB-CE1 4.16Å; M406-F485 HydrophobicContact CB-CE2 3.79Å; M406-F485 HydrophobicContact CB-CG 4.02Å; M406-F485 HydrophobicContact CB-CZ 3.97Å; M406-F485 HydrophobicContact CG-CB 3.98Å; M406-F485 HydrophobicContact CG-CD1 3.75Å; M406-F485 HydrophobicContact CG-CD2 3.84Å; M406-F485 HydrophobicContact CG-CE1 4.21Å; M406-F485 HydrophobicContact CG-CE2 4.28Å; M406-F485 HydrophobicContact CG-CG 3.56Å; M406-F485 HydrophobicContact CG-CZ 4.45Å; M406-F485 WeakPolarHBondContact O-CZ 3.17Å; M406-F485 HydrophobicContact SD-CB 3.58Å; M406-F485 VanDerWaalsContact SD-CB 3.58Å; M406-F485 HydrophobicContact SD-CD1 4.48Å; M406-F485 HydrophobicContact SD-CD2 3.9Å; M406-F485 HydrophobicContact SD-CG 3.73Å; M406-M549 HydrophobicContact CB-CG 3.74Å; M406-M549 HydrophobicContact CB-SD 4.39Å; M406-M549 HydrophobicContact SD-CG 4.11Å; M406-P552 HydrophobicContact CE-CG 3.55Å
407	H	97.4	Very high	95.6	Very high	3 Å²	3	25.3 Å²	25.3	1%	0.014	14%	0.143	C	C	.	.	H	α-helix	trans	-58.4	-46.4	172	-83.5	174.5	0	0	0	112.2	D382 H403 A404 L409 W410 V411 Y448 M549	D382-H407 IonicContact OD1-ND1 3.99Å; D382-H407 WeakPolarHBondContact OD2-CB 3.31Å; D382-H407 IonicContact OD2-CG 2.79Å; D382-H407 IonicContact OD2-ND1 3.54Å; D382-H407 PolarHBondContact OD2-ND1 2.71Å; H403-H407 AromaticContact CE1-CE1 3.33Å; H403-H407 PolarHBondContact CE1-CE1 3.32Å; H403-H407 AromaticContact CE1-ND1 3.97Å; H403-H407 AromaticContact CE1-NE2 3.41Å; H403-H407 PolarHBondContact CE1-NE2 2.79Å; H403-H407 AromaticContact NE2-CE1 3.02Å; H403-H407 PolarHBondContact NE2-CE1 3.05Å; H403-H407 AromaticContact NE2-ND1 3.51Å; H403-H407 AromaticContact NE2-NE2 3.62Å; H403-H407 PolarHBondContact O-N 3.08Å; A404-H407 PolarHBondContact O-N 3.12Å; H407-L409 PolarHBondContact O-N 3.18Å; H407-W410 PolarHBondContact O-N 3.42Å; H407-V411 WeakPolarHBondContact O-CB 3.31Å; H407-V411 WeakPolarHBondContact O-CG2 3.28Å; H407-V411 PolarHBondContact O-N 3.48Å; H407-Y448 PolarHBondContact CE1-O 2.7Å; H407-M549 VanDerWaalsContact CD2-SD 3.55Å
408	A	97.6	Very high	95.8	Very high	30 Å²	30	25.5 Å²	25.5	25%	0.248	14%	0.143	C	C	.	.	H	α-helix	trans	-60.1	-45.4	178.5	0	0	0	0	0	111.8	A404 L405 M406 V411 L412	A404-A408 VanDerWaalsContact O-CB 3.31Å; A404-A408 WeakPolarHBondContact O-CB 3.42Å; A404-A408 PolarHBondContact O-N 2.92Å; L405-A408 PolarHBondContact O-N 3.3Å; M406-A408 PolarHBondContact O-N 3.41Å; A408-V411 PolarHBondContact O-N 3.18Å; A408-L412 WeakPolarHBondContact O-CB 3.33Å; A408-L412 PolarHBondContact O-N 2.89Å
409	L	98.1	Very high	95.8	Very high	51 Å²	51	25.1 Å²	25.1	27%	0.267	14%	0.138	S	C	.	.	H	α-helix	trans	-64	-40.7	176.9	-72.2	174.8	0	0	0	112.2	L405 M406 H407 D413 F485 L486	L405-L409 HydrophobicContact CD1-CD1 4.34Å; L405-L409 HydrophobicContact CD1-CG 4.2Å; L405-L409 HydrophobicContact CG-CD1 4.19Å; L405-L409 HydrophobicContact CG-CG 4.48Å; L405-L409 WeakPolarHBondContact O-CB 3.21Å; L405-L409 VanDerWaalsContact O-CG 3.28Å; L405-L409 WeakPolarHBondContact O-CG 3.45Å; L405-L409 PolarHBondContact O-N 2.97Å; M406-L409 PolarHBondContact O-N 2.82Å; H407-L409 PolarHBondContact O-N 3.18Å; L409-D413 WeakPolarHBondContact O-CB 3.12Å; L409-D413 PolarHBondContact O-N 3.39Å; L409-F485 HydrophobicContact CB-CE1 3.72Å; L409-F485 HydrophobicContact CB-CZ 4.1Å; L409-F485 HydrophobicContact CD1-CD1 4.46Å; L409-F485 HydrophobicContact CD1-CE1 3.95Å; L409-L486 HydrophobicContact CD1-CD2 4.22Å
410	W	97.6	Very high	95.7	Very high	22 Å²	22	25.9 Å²	25.9	8%	0.083	14%	0.144	C	C	.	.	H	α-helix	trans	-63.1	-46.4	176.2	171.9	32.6	0	0	0	111.9	L375 L378 M406 H407 D413 F414 L444 Y448 F485 Y542 M545 M549	L375-W410 HydrophobicContact CD2-CH2 4.48Å; L375-W410 HydrophobicContact CD2-CZ2 4.21Å; L378-W410 HydrophobicContact CD1-CH2 4.46Å; L378-W410 HydrophobicContact CD1-CZ3 3.91Å; M406-W410 WeakPolarHBondContact O-CB 3.4Å; M406-W410 PolarHBondContact O-N 2.92Å; H407-W410 PolarHBondContact O-N 3.42Å; W410-D413 PolarHBondContact O-N 3.42Å; W410-F414 PolarHBondContact O-N 3.34Å; W410-L444 HydrophobicContact CH2-CD1 4.04Å; W410-Y448 HydrophobicContact CH2-CD1 4.33Å; W410-Y448 HydrophobicContact CH2-CE1 4.27Å; W410-Y448 HydrophobicContact CZ3-CD1 4.15Å; W410-Y448 HydrophobicContact CZ3-CE1 4.47Å; W410-F485 HydrophobicContact CB-CE2 4.4Å; W410-F485 HydrophobicContact CB-CZ 4.07Å; W410-Y542 AromaticContact CE2-CE2 3.75Å; W410-Y542 WeakPolarHBondContact CH2-OH 3.46Å; W410-Y542 AromaticContact CZ2-CE2 3.7Å; W410-Y542 HydrophobicContact CZ2-CE2 3.7Å; W410-Y542 AromaticContact CZ2-CZ 3.84Å; W410-Y542 WeakPolarHBondContact CZ2-OH 3.49Å; W410-Y542 AromaticContact NE1-CE2 3.62Å; W410-M545 HydrophobicContact CB-CE 3.9Å; W410-M545 HydrophobicContact CG-CE 3.86Å; W410-M549 HydrophobicContact CD2-CE 4.44Å; W410-M549 HydrophobicContact CE3-CE 4.1Å; W410-M549 HydrophobicContact CE3-SD 4.08Å
411	V	97.8	Very high	95.6	Very high	0 Å²	0	28 Å²	28	0%	0	15%	0.154	C	C	.	.	H	α-helix	trans	-68.1	-40.5	179	169.4	0	0	0	0	111.4	L375 P379 H407 A408 D413 F414 F415	L375-V411 HydrophobicContact CB-CG1 4.39Å; L375-V411 HydrophobicContact CB-CG2 4.35Å; L375-V411 HydrophobicContact CD2-CG2 4.27Å; L375-V411 VanDerWaalsContact O-CG2 3.3Å; L375-V411 WeakPolarHBondContact O-CG2 3.13Å; P379-V411 HydrophobicContact CG-CG1 4.23Å; H407-V411 WeakPolarHBondContact O-CB 3.31Å; H407-V411 WeakPolarHBondContact O-CG2 3.28Å; H407-V411 PolarHBondContact O-N 3.48Å; A408-V411 PolarHBondContact O-N 3.18Å; V411-D413 PolarHBondContact O-N 3.44Å; V411-F414 WeakPolarHBondContact O-CB 3.41Å; V411-F414 PolarHBondContact O-N 2.99Å; V411-F415 HydrophobicContact CG1-CD2 3.8Å; V411-F415 HydrophobicContact CG1-CE1 4.28Å; V411-F415 HydrophobicContact CG1-CE2 3.17Å; V411-F415 HydrophobicContact CG1-CZ 3.45Å; V411-F415 VanDerWaalsContact CG1-CZ 3.45Å; V411-F415 WeakPolarHBondContact O-CG 3.41Å; V411-F415 PolarHBondContact O-N 3.44Å
412	L	97.4	Very high	95.3	Very high	56 Å²	56	26.1 Å²	26.1	29%	0.293	14%	0.138	S	C	.	.	H	α-helix	trans	-63.4	-41.4	177	-176.6	62.8	0	0	0	111.8	L274 A408 F414 F415 I416	L274-L412 HydrophobicContact CD1-CD1 3.49Å; L274-L412 VanDerWaalsContact CD1-CD1 3.49Å; A408-L412 WeakPolarHBondContact O-CB 3.33Å; A408-L412 PolarHBondContact O-N 2.89Å; L412-F414 VanDerWaalsContact C-N 3.28Å; L412-F414 PolarHBondContact O-N 2.97Å; L412-F415 PolarHBondContact O-N 3.43Å; L412-F415 VanDerWaalsContact O-N 3.1Å; L412-I416 HydrophobicContact CD1-CD1 4.14Å; L412-I416 HydrophobicContact CD1-CG1 4.23Å; L412-I416 HydrophobicContact CD2-CD1 4.4Å; L412-I416 HydrophobicContact CG-CD1 3.8Å; L412-I416 HydrophobicContact CG-CG1 4.33Å; L412-I416 WeakPolarHBondContact O-CG1 3.48Å; L412-I416 PolarHBondContact O-N 2.84Å
413	D	97.2	Very high	95	Very high	19 Å²	19	28.7 Å²	28.7	10%	0.102	15%	0.148	C	C	.	.	H	α-helix	trans	-57.8	-41.6	174.3	177.1	69.4	0	0	0	111.7	L409 W410 V411 F417 L489 R493	L409-D413 WeakPolarHBondContact O-CB 3.12Å; L409-D413 PolarHBondContact O-N 3.39Å; W410-D413 PolarHBondContact O-N 3.42Å; V411-D413 PolarHBondContact O-N 3.44Å; D413-F417 WeakPolarHBondContact O-CD2 3.37Å; D413-F417 PolarHBondContact O-N 3.11Å; D413-L489 HydrophobicContact CB-CD1 3.93Å; D413-R493 PolarHBondContact O-NH2 3.1Å; D413-R493 IonicContact OD1-CZ 2.7Å; D413-R493 VanDerWaalsContact OD1-CZ 3.29Å; D413-R493 IonicContact OD1-NE 3.44Å; D413-R493 PolarHBondContact OD1-NE 2.89Å; D413-R493 IonicContact OD1-NH2 2.67Å; D413-R493 PolarHBondContact OD1-NH2 2.88Å; D413-R493 VanDerWaalsContact OD1-NH2 3.1Å; D413-R493 IonicContact OD2-CZ 3.39Å; D413-R493 IonicContact OD2-NE 2.72Å; D413-R493 PolarHBondContact OD2-NE 2.84Å; D413-R493 IonicContact OD2-NH2 3.34Å; D413-R493 PolarHBondContact OD2-NH2 3.44Å
414	F	95.9	Very high	94.7	Very high	17 Å²	17	30.1 Å²	30.1	8%	0.075	16%	0.157	C	C	.	.	H	α-helix	trans	-63.1	-45	172.8	171.3	-87.1	0	0	0	112.1	M368 T371 R372 L375 W410 V411 L412 F417 E418 F421	M368-F414 HydrophobicContact CE-CE1 4.5Å; M368-F414 HydrophobicContact CE-CZ 3.87Å; T371-F414 HydrophobicContact CG2-CE2 4.06Å; T371-F414 HydrophobicContact CG2-CZ 3.89Å; R372-F414 HydrophobicContact CG-CE1 4.03Å; R372-F414 HydrophobicContact CG-CZ 4.42Å; L375-F414 HydrophobicContact CD1-CB 4.17Å; L375-F414 HydrophobicContact CD1-CD1 3.4Å; L375-F414 HydrophobicContact CD1-CD2 3.63Å; L375-F414 HydrophobicContact CD1-CE1 3.6Å; L375-F414 HydrophobicContact CD1-CE2 3.73Å; L375-F414 HydrophobicContact CD1-CG 3.45Å; L375-F414 VanDerWaalsContact CD1-CG 3.45Å; L375-F414 HydrophobicContact CD1-CZ 3.76Å; W410-F414 PolarHBondContact O-N 3.34Å; V411-F414 WeakPolarHBondContact O-CB 3.41Å; V411-F414 PolarHBondContact O-N 2.99Å; L412-F414 VanDerWaalsContact C-N 3.28Å; L412-F414 PolarHBondContact O-N 2.97Å; F414-F417 CarbonylContact O-C 3.47Å; F414-F417 PolarHBondContact O-N 3.45Å; F414-E418 WeakPolarHBondContact O-CA 3.3Å; F414-E418 PolarHBondContact O-N 3.38Å; F414-F421 HydrophobicContact CD2-CB 4.4Å; F414-F421 HydrophobicContact CD2-CD1 4.33Å; F414-F421 AromaticContact CD2-CD2 3.82Å; F414-F421 HydrophobicContact CD2-CD2 3.82Å; F414-F421 HydrophobicContact CD2-CE2 4.13Å; F414-F421 AromaticContact CD2-CG 3.92Å; F414-F421 HydrophobicContact CD2-CG 3.92Å; F414-F421 HydrophobicContact CE2-CB 4.05Å; F414-F421 AromaticContact CE2-CD1 3.36Å; F414-F421 HydrophobicContact CE2-CD1 3.36Å; F414-F421 AromaticContact CE2-CD2 3.62Å; F414-F421 HydrophobicContact CE2-CD2 3.62Å; F414-F421 AromaticContact CE2-CE1 3.55Å; F414-F421 HydrophobicContact CE2-CE1 3.55Å; F414-F421 AromaticContact CE2-CE2 3.83Å; F414-F421 HydrophobicContact CE2-CE2 3.83Å; F414-F421 AromaticContact CE2-CG 3.38Å; F414-F421 HydrophobicContact CE2-CG 3.38Å; F414-F421 AromaticContact CE2-CZ 3.8Å; F414-F421 HydrophobicContact CE2-CZ 3.8Å; F414-F421 AromaticContact CZ-CD1 3.96Å; F414-F421 HydrophobicContact CZ-CD1 3.96Å; F414-F421 HydrophobicContact CZ-CE1 4.21Å; F414-F421 HydrophobicContact CZ-CG 4.29Å
415	F	95.9	Very high	94.3	Very high	5 Å²	5	31.2 Å²	31.2	2%	0.022	16%	0.159	C	C	.	.	H	α-helix	trans	-68.3	-35.1	-178.4	-65.1	-25.9	0	0	0	113.7	L274 F277 L375 M376 V411 L412	L274-F415 HydrophobicContact CB-CB 4.42Å; L274-F415 HydrophobicContact CD1-CB 4.36Å; F277-F415 HydrophobicContact CB-CD2 3.59Å; F277-F415 HydrophobicContact CB-CE2 3.62Å; F277-F415 HydrophobicContact CD1-CD2 4.05Å; F277-F415 HydrophobicContact CD1-CE2 4.28Å; F277-F415 HydrophobicContact CD2-CD2 4.11Å; F277-F415 AromaticContact CD2-CE2 3.5Å; F277-F415 HydrophobicContact CD2-CE2 3.5Å; F277-F415 HydrophobicContact CE2-CE2 4.19Å; F277-F415 AromaticContact CG-CD2 3.65Å; F277-F415 HydrophobicContact CG-CD2 3.65Å; F277-F415 AromaticContact CG-CE2 3.53Å; F277-F415 HydrophobicContact CG-CE2 3.53Å; L375-F415 HydrophobicContact CB-CE1 4.45Å; L375-F415 HydrophobicContact CB-CZ 4.43Å; M376-F415 HydrophobicContact CB-CZ 3.95Å; M376-F415 HydrophobicContact CE-CE1 4.49Å; M376-F415 HydrophobicContact CE-CE2 4.21Å; M376-F415 HydrophobicContact CE-CZ 3.87Å; M376-F415 HydrophobicContact CG-CZ 4.46Å; V411-F415 HydrophobicContact CG1-CD2 3.8Å; V411-F415 HydrophobicContact CG1-CE1 4.28Å; V411-F415 HydrophobicContact CG1-CE2 3.17Å; V411-F415 HydrophobicContact CG1-CZ 3.45Å; V411-F415 VanDerWaalsContact CG1-CZ 3.45Å; V411-F415 WeakPolarHBondContact O-CG 3.41Å; V411-F415 PolarHBondContact O-N 3.44Å; L412-F415 PolarHBondContact O-N 3.43Å; L412-F415 VanDerWaalsContact O-N 3.1Å
416	I	95.3	Very high	94	Very high	85 Å²	85	28.3 Å²	28.3	44%	0.436	14%	0.143	S	C	.	.	H	α-helix	trans	-67.9	-43.8	175.6	-68.1	168.8	0	0	0	110.6	L274 L412	L274-I416 HydrophobicContact CD1-CG1 4.45Å; L412-I416 HydrophobicContact CD1-CD1 4.14Å; L412-I416 HydrophobicContact CD1-CG1 4.23Å; L412-I416 HydrophobicContact CD2-CD1 4.4Å; L412-I416 HydrophobicContact CG-CD1 3.8Å; L412-I416 HydrophobicContact CG-CG1 4.33Å; L412-I416 WeakPolarHBondContact O-CG1 3.48Å; L412-I416 PolarHBondContact O-N 2.84Å
417	F	94	Very high	93.5	Very high	53 Å²	53	28.3 Å²	28.3	23%	0.232	14%	0.143	C	C	.	.	T	Hydrogen-bonded Turn	trans	-102.6	26.6	-175.1	-63.8	-83.1	0	0	0	113.7	D413 F414 H419 A420 F421 R493	D413-F417 WeakPolarHBondContact O-CD2 3.37Å; D413-F417 PolarHBondContact O-N 3.11Å; F414-F417 CarbonylContact O-C 3.47Å; F414-F417 PolarHBondContact O-N 3.45Å; F417-H419 PolarHBondContact O-N 3.47Å; F417-H419 VanDerWaalsContact O-N 3.11Å; F417-A420 WeakPolarHBondContact O-CB 3.36Å; F417-A420 PolarHBondContact O-N 3.09Å; F417-F421 PolarHBondContact O-N 3Å; F417-F421 VanDerWaalsContact O-N 3.15Å; F417-R493 VanDerWaalsContact CB-CZ 3.43Å; F417-R493 VanDerWaalsContact CD2-NE 3.31Å; F417-R493 HydrophobicContact CE2-CG 4.33Å
418	E	94.1	Very high	93	Very high	4 Å²	4	33 Å²	33	2%	0.019	17%	0.165	C	C	.	.	H	α-helix	trans	-50.7	-39.1	-179.4	-175	-177.8	-170.5	0	0	113.1	Y269 C271 N272 S273 M368 R372 F414 A420 F421 S422	Y269-E418 HydrophobicContact CE1-CG 4.24Å; Y269-E418 VanDerWaalsContact CE1-OE1 3.31Å; Y269-E418 WeakPolarHBondContact CE1-OE1 3.39Å; Y269-E418 VanDerWaalsContact CZ-OE1 3.25Å; Y269-E418 PolarHBondContact OH-OE1 3.48Å; C271-E418 WeakPolarHBondContact CA-OE2 3.24Å; C271-E418 HydrophobicContact CB-CB 4.28Å; C271-E418 HydrophobicContact CB-CG 4.15Å; C271-E418 WeakPolarHBondContact CB-OE2 3.35Å; N272-E418 PolarHBondContact N-OE2 3.27Å; N272-E418 VanDerWaalsContact N-OE2 3.15Å; S273-E418 VanDerWaalsContact CB-CD 3.44Å; S273-E418 WeakPolarHBondContact CB-OE2 3.4Å; S273-E418 PolarHBondContact N-OE2 2.8Å; S273-E418 PolarHBondContact OG-OE1 2.9Å; S273-E418 PolarHBondContact OG-OE2 2.73Å; S273-E418 VanDerWaalsContact OG-OE2 3.1Å; M368-E418 HydrophobicContact CE-CB 4.46Å; M368-E418 HydrophobicContact CE-CG 3.2Å; R372-E418 IonicContact CZ-OE1 3.96Å; R372-E418 IonicContact NH1-OE1 3.6Å; F414-E418 WeakPolarHBondContact O-CA 3.3Å; F414-E418 PolarHBondContact O-N 3.38Å; E418-A420 VanDerWaalsContact C-N 3.34Å; E418-A420 PolarHBondContact O-N 2.88Å; E418-F421 WeakPolarHBondContact O-CB 3.46Å; E418-F421 PolarHBondContact O-N 3.45Å; E418-S422 PolarHBondContact O-N 2.88Å
419	H	91.2	Very high	92.4	Very high	33 Å²	33	33.7 Å²	33.7	15%	0.153	17%	0.168	C	C	.	.	H	α-helix	trans	-62.8	-38.8	179.1	69.5	-83.1	0	0	0	112.4	R258 V260 C271 F417 S422 F423 R504	R258-H419 PolarHBondContact NH1-CD2 2.88Å; V260-H419 HydrophobicContact CG2-CB 3.82Å; C271-H419 VanDerWaalsContact SG-CA 3.55Å; F417-H419 PolarHBondContact O-N 3.47Å; F417-H419 VanDerWaalsContact O-N 3.11Å; H419-S422 WeakPolarHBondContact O-CB 3.12Å; H419-F423 VanDerWaalsContact O-CD2 3.31Å; H419-F423 WeakPolarHBondContact O-CD2 3.29Å; H419-R504 PolarHBondContact CD2-NH2 3.41Å; H419-R504 PolarHBondContact NE2-NH2 3.39Å
420	A	90.6	Very high	92	Very high	15 Å²	15	31.9 Å²	31.9	12%	0.124	16%	0.159	C	C	.	.	H	α-helix	trans	-73	-34.2	176.3	0	0	0	0	0	110.9	F417 E418 S422 F423	F417-A420 WeakPolarHBondContact O-CB 3.36Å; F417-A420 PolarHBondContact O-N 3.09Å; E418-A420 VanDerWaalsContact C-N 3.34Å; E418-A420 PolarHBondContact O-N 2.88Å; A420-S422 PolarHBondContact O-N 2.88Å; A420-F423 PolarHBondContact O-N 3.35Å; A420-F423 VanDerWaalsContact O-N 3.08Å
421	F	91.4	Very high	91.5	Very high	46 Å²	46	31 Å²	31	20%	0.202	16%	0.156	C	C	.	.	H	α-helix	trans	-59.9	-32.8	176.9	-169.9	-97.4	0	0	0	112.8	M368 T371 F414 F417 E418 F423 T424 E426 M427	M368-F421 HydrophobicContact CE-CD1 4.2Å; M368-F421 HydrophobicContact SD-CD1 4.05Å; T371-F421 HydrophobicContact CG2-CE1 4.08Å; T371-F421 HydrophobicContact CG2-CZ 4.33Å; F414-F421 HydrophobicContact CD2-CB 4.4Å; F414-F421 HydrophobicContact CD2-CD1 4.33Å; F414-F421 AromaticContact CD2-CD2 3.82Å; F414-F421 HydrophobicContact CD2-CD2 3.82Å; F414-F421 HydrophobicContact CD2-CE2 4.13Å; F414-F421 AromaticContact CD2-CG 3.92Å; F414-F421 HydrophobicContact CD2-CG 3.92Å; F414-F421 HydrophobicContact CE2-CB 4.05Å; F414-F421 AromaticContact CE2-CD1 3.36Å; F414-F421 HydrophobicContact CE2-CD1 3.36Å; F414-F421 AromaticContact CE2-CD2 3.62Å; F414-F421 HydrophobicContact CE2-CD2 3.62Å; F414-F421 AromaticContact CE2-CE1 3.55Å; F414-F421 HydrophobicContact CE2-CE1 3.55Å; F414-F421 AromaticContact CE2-CE2 3.83Å; F414-F421 HydrophobicContact CE2-CE2 3.83Å; F414-F421 AromaticContact CE2-CG 3.38Å; F414-F421 HydrophobicContact CE2-CG 3.38Å; F414-F421 AromaticContact CE2-CZ 3.8Å; F414-F421 HydrophobicContact CE2-CZ 3.8Å; F414-F421 AromaticContact CZ-CD1 3.96Å; F414-F421 HydrophobicContact CZ-CD1 3.96Å; F414-F421 HydrophobicContact CZ-CE1 4.21Å; F414-F421 HydrophobicContact CZ-CG 4.29Å; F417-F421 PolarHBondContact O-N 3Å; F417-F421 VanDerWaalsContact O-N 3.15Å; E418-F421 WeakPolarHBondContact O-CB 3.46Å; E418-F421 PolarHBondContact O-N 3.45Å; F421-F423 PolarHBondContact O-N 3.11Å; F421-F423 VanDerWaalsContact O-N 3.08Å; F421-T424 HydrophobicContact CD2-CG2 3.87Å; F421-T424 HydrophobicContact CE2-CG2 4.31Å; F421-T424 HydrophobicContact CG-CG2 4.31Å; F421-T424 WeakPolarHBondContact O-CB 3.26Å; F421-T424 VanDerWaalsContact O-CG2 3.28Å; F421-T424 WeakPolarHBondContact O-CG2 3.39Å; F421-T424 PolarHBondContact O-N 2.97Å; F421-T424 PolarHBondContact O-OG1 3.26Å; F421-E426 HydrophobicContact CZ-CB 4.35Å; F421-E426 HydrophobicContact CZ-CG 4.31Å; F421-M427 HydrophobicContact CD1-CE 4.11Å; F421-M427 HydrophobicContact CD1-CG 3.71Å; F421-M427 HydrophobicContact CE1-CE 3.44Å; F421-M427 VanDerWaalsContact CE1-CE 3.44Å; F421-M427 HydrophobicContact CE1-CG 3.54Å; F421-M427 HydrophobicContact CE1-SD 4.31Å; F421-M427 HydrophobicContact CZ-CE 4.46Å; F421-M427 HydrophobicContact CZ-CG 4.48Å
422	S	88.6	Confident	91.3	Very high	1 Å²	1	31.1 Å²	31.1	1%	0.007	16%	0.156	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.7	-22	176.7	-68.9	0	0	0	0	114	E418 H419 A420	E418-S422 PolarHBondContact O-N 2.88Å; H419-S422 WeakPolarHBondContact O-CB 3.12Å; A420-S422 PolarHBondContact O-N 2.88Å
423	F	87.7	Confident	91	Very high	63 Å²	63	28.6 Å²	28.6	28%	0.276	14%	0.144	S	C	.	.	T	Hydrogen-bonded Turn	trans	-102.4	11	178.9	-58.6	-83.2	0	0	0	113.8	V260 H419 A420 F421 R503	V260-F423 HydrophobicContact CG1-CE2 3.52Å; V260-F423 HydrophobicContact CG1-CZ 3.49Å; V260-F423 VanDerWaalsContact CG1-CZ 3.49Å; H419-F423 VanDerWaalsContact O-CD2 3.31Å; H419-F423 WeakPolarHBondContact O-CD2 3.29Å; A420-F423 PolarHBondContact O-N 3.35Å; A420-F423 VanDerWaalsContact O-N 3.08Å; F421-F423 PolarHBondContact O-N 3.11Å; F421-F423 VanDerWaalsContact O-N 3.08Å; F423-R503 PolarHBondContact O-NH1 3.41Å
424	T	89.5	Confident	90.8	Very high	32 Å²	32	27.8 Å²	27.8	20%	0.196	14%	0.139	C	C	.	.	S	Bend	trans	-74.2	159.3	175.9	61.5	0	0	0	0	111.5	F421 E426 M427 Q428	F421-T424 HydrophobicContact CD2-CG2 3.87Å; F421-T424 HydrophobicContact CE2-CG2 4.31Å; F421-T424 HydrophobicContact CG-CG2 4.31Å; F421-T424 WeakPolarHBondContact O-CB 3.26Å; F421-T424 VanDerWaalsContact O-CG2 3.28Å; F421-T424 WeakPolarHBondContact O-CG2 3.39Å; F421-T424 PolarHBondContact O-N 2.97Å; F421-T424 PolarHBondContact O-OG1 3.26Å; T424-E426 PolarHBondContact O-N 2.95Å; T424-M427 PolarHBondContact O-N 2.88Å; T424-M427 VanDerWaalsContact O-N 3.17Å; T424-M427 PolarHBondContact OG1-N 3.3Å; T424-Q428 WeakPolarHBondContact O-CB 3.09Å; T424-Q428 WeakPolarHBondContact O-CG 3.19Å; T424-Q428 PolarHBondContact O-N 3.36Å
425	Y	88.5	Confident	90.6	Very high	32 Å²	32	28.9 Å²	28.9	13%	0.125	15%	0.149	C	C	.	.	H	α-helix	trans	-56.6	-38.3	172.1	177.9	-89.7	0	0	0	111.6	M427 Q428 S429 V430 V578 V581	Y425-M427 VanDerWaalsContact C-N 3.31Å; Y425-M427 PolarHBondContact O-N 2.99Å; Y425-Q428 PolarHBondContact O-N 3.09Å; Y425-S429 WeakPolarHBondContact CD2-OG 3.14Å; Y425-S429 VanDerWaalsContact CE2-CB 3.41Å; Y425-S429 WeakPolarHBondContact O-CB 3.49Å; Y425-S429 PolarHBondContact O-N 3.18Å; Y425-V430 HydrophobicContact CD1-CG2 4.05Å; Y425-V430 HydrophobicContact CE1-CG2 3.79Å; Y425-V430 PolarHBondContact O-N 2.77Å; Y425-V578 HydrophobicContact CD1-CG2 3.79Å; Y425-V578 HydrophobicContact CD2-CG2 4.02Å; Y425-V578 HydrophobicContact CE1-CG2 4.02Å; Y425-V578 HydrophobicContact CE2-CG2 4.23Å; Y425-V578 HydrophobicContact CG-CG2 3.79Å; Y425-V581 HydrophobicContact CE2-CB 4.2Å; Y425-V581 HydrophobicContact CE2-CG1 4.16Å; Y425-V581 HydrophobicContact CE2-CG2 4.02Å
426	E	89.7	Confident	90.5	Very high	27 Å²	27	29 Å²	29	13%	0.126	15%	0.15	C	C	.	.	H	α-helix	trans	-55.9	-48	177	-171	68.1	-175.4	0	0	110.6	K367 F421 T424 V430 F436 R440 R574	K367-E426 WeakPolarHBondContact CE-O 3.42Å; K367-E426 PolarHBondContact NZ-O 3.49Å; F421-E426 HydrophobicContact CZ-CB 4.35Å; F421-E426 HydrophobicContact CZ-CG 4.31Å; T424-E426 PolarHBondContact O-N 2.95Å; E426-V430 WeakPolarHBondContact O-CB 3.05Å; E426-V430 WeakPolarHBondContact OE2-CG2 3.35Å; E426-F436 HydrophobicContact CG-CE2 4.21Å; E426-F436 VanDerWaalsContact OE1-CE2 3.25Å; E426-F436 WeakPolarHBondContact OE1-CE2 3.09Å; E426-R440 IonicContact OE1-CZ 3.1Å; E426-R440 IonicContact OE1-NH2 3.89Å; E426-R440 PolarHBondContact OE1-NH2 3.46Å; E426-R574 IonicContact OE2-CZ 3.34Å; E426-R574 IonicContact OE2-NH1 3.21Å; E426-R574 PolarHBondContact OE2-NH1 3.19Å; E426-R574 IonicContact OE2-NH2 3.45Å; E426-R574 PolarHBondContact OE2-NH2 3.36Å
427	M	89	Confident	90.5	Very high	1 Å²	1	25 Å²	25	1%	0.005	13%	0.129	C	C	.	.	H	α-helix	trans	-76.8	-36.7	-178.9	-77.6	-65.1	162.8	0	0	113.9	K367 M368 T371 F421 T424 Y425 F436	K367-M427 HydrophobicContact CB-SD 4.4Å; K367-M427 HydrophobicContact CD-SD 3.88Å; K367-M427 HydrophobicContact CG-CE 3.91Å; K367-M427 HydrophobicContact CG-SD 3.77Å; K367-M427 PolarHBondContact NZ-O 2.86Å; M368-M427 HydrophobicContact SD-CE 3.66Å; M368-M427 HydrophobicContact SD-SD 4.19Å; T371-M427 HydrophobicContact CG2-CE 4.21Å; T371-M427 WeakPolarHBondContact OG1-CE 3.46Å; F421-M427 HydrophobicContact CD1-CE 4.11Å; F421-M427 HydrophobicContact CD1-CG 3.71Å; F421-M427 HydrophobicContact CE1-CE 3.44Å; F421-M427 VanDerWaalsContact CE1-CE 3.44Å; F421-M427 HydrophobicContact CE1-CG 3.54Å; F421-M427 HydrophobicContact CE1-SD 4.31Å; F421-M427 HydrophobicContact CZ-CE 4.46Å; F421-M427 HydrophobicContact CZ-CG 4.48Å; T424-M427 PolarHBondContact O-N 2.88Å; T424-M427 VanDerWaalsContact O-N 3.17Å; T424-M427 PolarHBondContact OG1-N 3.3Å; Y425-M427 VanDerWaalsContact C-N 3.31Å; Y425-M427 PolarHBondContact O-N 2.99Å; M427-F436 HydrophobicContact CE-CZ 4.46Å
428	Q	86.4	Confident	90.6	Very high	102 Å²	102	23.3 Å²	23.3	48%	0.477	12%	0.122	S	C	.	.	H	α-helix	trans	-90.4	-23.9	-171.5	-66.5	-172.6	-17.6	0	0	115.8	V357 T424 Y425	V357-Q428 VanDerWaalsContact CG1-O 3.32Å; V357-Q428 WeakPolarHBondContact CG1-O 3.44Å; T424-Q428 WeakPolarHBondContact O-CB 3.09Å; T424-Q428 WeakPolarHBondContact O-CG 3.19Å; T424-Q428 PolarHBondContact O-N 3.36Å; Y425-Q428 PolarHBondContact O-N 3.09Å
429	S	85.3	Confident	90.6	Very high	43 Å²	43	25 Å²	25	30%	0.301	14%	0.135	S	C	.	.	H	α-helix	trans	-124.5	-31.5	-169	-57.2	0	0	0	0	113.5	Y425	Y425-S429 WeakPolarHBondContact CD2-OG 3.14Å; Y425-S429 VanDerWaalsContact CE2-CB 3.41Å; Y425-S429 WeakPolarHBondContact O-CB 3.49Å; Y425-S429 PolarHBondContact O-N 3.18Å
430	V	88	Confident	90.9	Very high	13 Å²	13	26 Å²	26	8%	0.079	14%	0.137	C	C	.	.	S	Bend	trans	-73.4	134.2	179.6	-178.1	0	0	0	0	109.7	K367 Y425 E426 F436	K367-V430 PolarHBondContact NZ-O 2.87Å; Y425-V430 HydrophobicContact CD1-CG2 4.05Å; Y425-V430 HydrophobicContact CE1-CG2 3.79Å; Y425-V430 PolarHBondContact O-N 2.77Å; E426-V430 WeakPolarHBondContact O-CB 3.05Å; E426-V430 WeakPolarHBondContact OE2-CG2 3.35Å; V430-F436 HydrophobicContact CG1-CD2 4.08Å
431	T	89.1	Confident	91.2	Very high	3 Å²	3	25.9 Å²	25.9	2%	0.018	13%	0.134	C	C	.	.			trans	-79	146.2	176.2	39.8	0	0	0	0	112.5	Q339 C353 G354 V357 G433	Q339-T431 HydrophobicContact CB-CG2 4.19Å; C353-T431 CarbonylContact O-C 3.56Å; C353-T431 WeakPolarHBondContact O-CB 2.94Å; C353-T431 PolarHBondContact O-OG1 3.43Å; G354-T431 VanDerWaalsContact O-CB 3.32Å; G354-T431 WeakPolarHBondContact O-CB 3.41Å; G354-T431 PolarHBondContact O-OG1 2.95Å; V357-T431 HydrophobicContact CG2-CG2 4.07Å; T431-G433 PolarHBondContact O-N 3.35Å
432	F	91.9	Very high	91.4	Very high	4 Å²	4	23.7 Å²	23.7	2%	0.018	13%	0.125	C	C	.	.			trans	-86.1	88.2	177.6	-173.4	-99.2	0	0	0	109.4	A326 H356 P359 W361 W366 K367 I370 F436 I437	A326-F432 HydrophobicContact CB-CD1 3.89Å; A326-F432 HydrophobicContact CB-CE1 3.8Å; H356-F432 VanDerWaalsContact O-CB 3.28Å; H356-F432 WeakPolarHBondContact O-CB 3.5Å; H356-F432 PolarHBondContact O-N 3.35Å; P359-F432 HydrophobicContact CG-CB 3.94Å; P359-F432 HydrophobicContact CG-CD1 3.27Å; P359-F432 HydrophobicContact CG-CD2 4.39Å; P359-F432 HydrophobicContact CG-CE1 3.76Å; P359-F432 HydrophobicContact CG-CG 3.6Å; W361-F432 HydrophobicContact CH2-CD1 4.44Å; W361-F432 HydrophobicContact CH2-CE1 4.15Å; W361-F432 HydrophobicContact CZ3-CE1 4.36Å; W366-F432 HydrophobicContact CB-CE1 4.49Å; W366-F432 HydrophobicContact CB-CZ 4.14Å; K367-F432 HydrophobicContact CB-CD2 3.95Å; K367-F432 HydrophobicContact CB-CE2 4.41Å; K367-F432 HydrophobicContact CG-CD2 4.05Å; I370-F432 HydrophobicContact CD1-CE2 3.47Å; I370-F432 VanDerWaalsContact CD1-CE2 3.47Å; I370-F432 HydrophobicContact CD1-CZ 3.29Å; F432-F436 AromaticContact CD2-CD1 3.67Å; F432-F436 HydrophobicContact CD2-CD1 3.67Å; F432-F436 HydrophobicContact CD2-CE1 4.03Å; F432-F436 HydrophobicContact CD2-CG 4.45Å; F432-F436 AromaticContact CE2-CD1 3.89Å; F432-F436 HydrophobicContact CE2-CD1 3.89Å; F432-F436 HydrophobicContact CE2-CE1 4.16Å; F432-I437 HydrophobicContact CD1-CD1 4.38Å; F432-I437 HydrophobicContact CD2-CG1 4.44Å; F432-I437 HydrophobicContact CE1-CD1 3.73Å; F432-I437 HydrophobicContact CE1-CG1 4.1Å; F432-I437 HydrophobicContact CE2-CD1 4.31Å; F432-I437 HydrophobicContact CE2-CG1 3.75Å; F432-I437 HydrophobicContact CZ-CD1 3.68Å; F432-I437 HydrophobicContact CZ-CG1 3.57Å
433	G	92.2	Very high	91.6	Very high	3 Å²	3	24.7 Å²	24.7	3%	0.031	13%	0.133	C	C	.	.	S	Bend	trans	-126	-172	173.3	0	0	0	0	0	111.9	W352 C353 T431 C435 F436 I437	W352-G433 CarbonylContact O-C 3.6Å; C353-G433 PolarHBondContact O-N 2.85Å; T431-G433 PolarHBondContact O-N 3.35Å; G433-C435 VanDerWaalsContact C-N 3.28Å; G433-C435 PolarHBondContact O-N 3.17Å; G433-F436 WeakPolarHBondContact O-CB 3.14Å; G433-F436 PolarHBondContact O-N 3.07Å; G433-I437 WeakPolarHBondContact O-CG1 3.21Å; G433-I437 PolarHBondContact O-N 3.27Å; G433-I437 VanDerWaalsContact O-N 3.07Å
434	S	92.7	Very high	91.9	Very high	1 Å²	1	22.1 Å²	22.1	1%	0.007	12%	0.122	C	C	.	.	H	α-helix	trans	-58.5	-39.4	-175.7	-45.4	0	0	0	0	112.9	S323 F351 W352 F436 I437 I438	S323-S434 VanDerWaalsContact CB-OG 3.28Å; S323-S434 WeakPolarHBondContact CB-OG 3.25Å; S323-S434 WeakPolarHBondContact OG-CA 3.48Å; F351-S434 VanDerWaalsContact CD1-OG 3.31Å; F351-S434 WeakPolarHBondContact CD1-OG 3.34Å; F351-S434 WeakPolarHBondContact CE1-OG 3.33Å; F351-S434 WeakPolarHBondContact CE2-OG 3.3Å; F351-S434 WeakPolarHBondContact CZ-OG 3.49Å; F351-S434 PolarHBondContact O-N 2.72Å; F351-S434 VanDerWaalsContact O-N 3.09Å; F351-S434 PolarHBondContact O-OG 3.26Å; W352-S434 PolarHBondContact O-N 3.07Å; S434-F436 VanDerWaalsContact C-N 3.31Å; S434-F436 PolarHBondContact O-N 3.42Å; S434-I437 PolarHBondContact O-N 3.37Å; S434-I438 WeakPolarHBondContact O-CB 3.49Å; S434-I438 VanDerWaalsContact O-CG1 3.31Å; S434-I438 WeakPolarHBondContact O-CG1 3.47Å; S434-I438 PolarHBondContact O-N 3.03Å
435	C	91.8	Very high	92.2	Very high	41 Å²	41	20.9 Å²	20.9	28%	0.277	12%	0.115	S	C	.	.	H	α-helix	trans	-55.8	-46.8	176.1	-174.9	0	0	0	0	111.4	W352 G433 S439	W352-C435 HydrophobicContact CD2-CB 3.71Å; W352-C435 VanDerWaalsContact CE2-CB 3.5Å; W352-C435 HydrophobicContact CE3-CB 4.03Å; W352-C435 HydrophobicContact CG-CB 4.3Å; W352-C435 HydrophobicContact CH2-CB 4Å; W352-C435 HydrophobicContact CZ2-CB 3.66Å; W352-C435 HydrophobicContact CZ3-CB 4.19Å; W352-C435 WeakPolarHBondContact O-CB 3.28Å; W352-C435 PolarHBondContact O-N 3.07Å; G433-C435 VanDerWaalsContact C-N 3.28Å; G433-C435 PolarHBondContact O-N 3.17Å; C435-S439 WeakPolarHBondContact O-CB 3.31Å; C435-S439 PolarHBondContact O-N 3.16Å; C435-S439 PolarHBondContact O-OG 3.28Å
436	F	93.7	Very high	92.5	Very high	8 Å²	8	19.8 Å²	19.8	4%	0.035	11%	0.111	C	C	.	.	H	α-helix	trans	-65.9	-46.6	179.4	-176	-83.6	0	0	0	111.1	K367 T371 E426 M427 V430 F432 G433 S434 S439 R440	K367-F436 HydrophobicContact CD-CE2 4.42Å; K367-F436 HydrophobicContact CD-CZ 4.15Å; K367-F436 HydrophobicContact CG-CD1 4.43Å; K367-F436 HydrophobicContact CG-CE1 3.59Å; K367-F436 HydrophobicContact CG-CE2 4.15Å; K367-F436 HydrophobicContact CG-CZ 3.41Å; K367-F436 VanDerWaalsContact CG-CZ 3.41Å; T371-F436 WeakPolarHBondContact OG1-CZ 3.42Å; E426-F436 HydrophobicContact CG-CE2 4.21Å; E426-F436 VanDerWaalsContact OE1-CE2 3.25Å; E426-F436 WeakPolarHBondContact OE1-CE2 3.09Å; M427-F436 HydrophobicContact CE-CZ 4.46Å; V430-F436 HydrophobicContact CG1-CD2 4.08Å; F432-F436 AromaticContact CD2-CD1 3.67Å; F432-F436 HydrophobicContact CD2-CD1 3.67Å; F432-F436 HydrophobicContact CD2-CE1 4.03Å; F432-F436 HydrophobicContact CD2-CG 4.45Å; F432-F436 AromaticContact CE2-CD1 3.89Å; F432-F436 HydrophobicContact CE2-CD1 3.89Å; F432-F436 HydrophobicContact CE2-CE1 4.16Å; G433-F436 WeakPolarHBondContact O-CB 3.14Å; G433-F436 PolarHBondContact O-N 3.07Å; S434-F436 VanDerWaalsContact C-N 3.31Å; S434-F436 PolarHBondContact O-N 3.42Å; F436-S439 PolarHBondContact O-N 2.62Å; F436-R440 HydrophobicContact CD1-CG 4.28Å; F436-R440 HydrophobicContact CE1-CG 3.92Å; F436-R440 HydrophobicContact CZ-CG 4.21Å; F436-R440 VanDerWaalsContact O-CG 3.31Å; F436-R440 WeakPolarHBondContact O-CG 3.33Å; F436-R440 PolarHBondContact O-N 2.83Å
437	I	96.3	Very high	92.7	Very high	0 Å²	0	19.2 Å²	19.2	0%	0	11%	0.109	C	C	.	.	H	α-helix	trans	-63.7	-51	-177	-63.3	164.1	0	0	0	110.5	L322 S323 A326 F432 G433 S434 S439 R440 L441	L322-I437 HydrophobicContact CB-CD1 4.49Å; L322-I437 HydrophobicContact CB-CG2 4.43Å; L322-I437 HydrophobicContact CD2-CG2 4.33Å; L322-I437 HydrophobicContact CG-CD1 4.21Å; S323-I437 WeakPolarHBondContact OG-CD1 3.24Å; A326-I437 HydrophobicContact CB-CD1 4.4Å; F432-I437 HydrophobicContact CD1-CD1 4.38Å; F432-I437 HydrophobicContact CD2-CG1 4.44Å; F432-I437 HydrophobicContact CE1-CD1 3.73Å; F432-I437 HydrophobicContact CE1-CG1 4.1Å; F432-I437 HydrophobicContact CE2-CD1 4.31Å; F432-I437 HydrophobicContact CE2-CG1 3.75Å; F432-I437 HydrophobicContact CZ-CD1 3.68Å; F432-I437 HydrophobicContact CZ-CG1 3.57Å; G433-I437 WeakPolarHBondContact O-CG1 3.21Å; G433-I437 PolarHBondContact O-N 3.27Å; G433-I437 VanDerWaalsContact O-N 3.07Å; S434-I437 PolarHBondContact O-N 3.37Å; I437-S439 VanDerWaalsContact C-N 3.3Å; I437-S439 PolarHBondContact O-N 2.97Å; I437-R440 PolarHBondContact O-N 2.65Å; I437-L441 HydrophobicContact CG2-CD1 3.93Å; I437-L441 HydrophobicContact CG2-CG 4.43Å; I437-L441 PolarHBondContact O-N 3.43Å
438	I	95.5	Very high	92.9	Very high	17 Å²	17	21.1 Å²	21.1	9%	0.087	12%	0.116	C	C	.	.	H	α-helix	trans	-60.6	-41	178.2	-67.4	168.1	0	0	0	110.5	I165 W352 S434 R440 V442 A443	I165-I438 HydrophobicContact CG2-CG2 3.75Å; W352-I438 HydrophobicContact CZ3-CD1 4.08Å; S434-I438 WeakPolarHBondContact O-CB 3.49Å; S434-I438 VanDerWaalsContact O-CG1 3.31Å; S434-I438 WeakPolarHBondContact O-CG1 3.47Å; S434-I438 PolarHBondContact O-N 3.03Å; I438-R440 PolarHBondContact O-N 2.85Å; I438-R440 VanDerWaalsContact O-N 3.17Å; I438-V442 HydrophobicContact CG2-CB 4.08Å; I438-V442 HydrophobicContact CG2-CG2 4.38Å; I438-V442 WeakPolarHBondContact O-CA 3.03Å; I438-V442 VanDerWaalsContact O-CB 3.31Å; I438-V442 WeakPolarHBondContact O-CB 3.28Å; I438-V442 PolarHBondContact O-N 2.95Å; I438-A443 PolarHBondContact O-N 3.27Å
439	S	94.1	Very high	93.3	Very high	41 Å²	41	16.3 Å²	16.3	29%	0.287	9%	0.094	S	C	.	.	I	π-helix	trans	-60.7	-26.9	177.8	-64	0	0	0	0	113.3	C435 F436 I437 L444	C435-S439 WeakPolarHBondContact O-CB 3.31Å; C435-S439 PolarHBondContact O-N 3.16Å; C435-S439 PolarHBondContact O-OG 3.28Å; F436-S439 PolarHBondContact O-N 2.62Å; I437-S439 VanDerWaalsContact C-N 3.3Å; I437-S439 PolarHBondContact O-N 2.97Å; S439-L444 WeakPolarHBondContact O-CB 3.25Å; S439-L444 PolarHBondContact O-N 2.66Å
440	R	96.3	Very high	93.6	Very high	53 Å²	53	14.5 Å²	14.5	20%	0.2	8%	0.081	C	C	.	.	I	π-helix	trans	-98.7	-40.6	-177.3	-61.1	-63.3	168.8	-114.1	-1.1	113.2	I370 G374 E426 F436 I437 I438 P445	I370-R440 HydrophobicContact CG2-CB 3.51Å; I370-R440 HydrophobicContact CG2-CG 4.15Å; G374-R440 WeakPolarHBondContact CA-O 3.21Å; E426-R440 IonicContact OE1-CZ 3.1Å; E426-R440 IonicContact OE1-NH2 3.89Å; E426-R440 PolarHBondContact OE1-NH2 3.46Å; F436-R440 HydrophobicContact CD1-CG 4.28Å; F436-R440 HydrophobicContact CE1-CG 3.92Å; F436-R440 HydrophobicContact CZ-CG 4.21Å; F436-R440 VanDerWaalsContact O-CG 3.31Å; F436-R440 WeakPolarHBondContact O-CG 3.33Å; F436-R440 PolarHBondContact O-N 2.83Å; I437-R440 PolarHBondContact O-N 2.65Å; I438-R440 PolarHBondContact O-N 2.85Å; I438-R440 VanDerWaalsContact O-N 3.17Å; R440-P445 VanDerWaalsContact O-CD 3.3Å; R440-P445 WeakPolarHBondContact O-CD 3.4Å
441	L	96.8	Very high	93.7	Very high	12 Å²	12	13.9 Å²	13.9	6%	0.063	8%	0.077	C	C	.	.	I	π-helix	trans	-91.8	-19.7	-176.5	-64.7	-174.2	0	0	0	113.6	L244 S319 L322 I370 S373 I437 P445	L244-L441 HydrophobicContact CD1-CD1 4.46Å; L244-L441 HydrophobicContact CD2-CD2 3.88Å; S319-L441 VanDerWaalsContact OG-CB 3.29Å; S319-L441 WeakPolarHBondContact OG-CB 3.42Å; L322-L441 HydrophobicContact CD2-CD1 4.37Å; I370-L441 HydrophobicContact CG2-CD1 4.42Å; I370-L441 HydrophobicContact CG2-CD2 3.92Å; I370-L441 HydrophobicContact CG2-CG 3.84Å; S373-L441 WeakPolarHBondContact OG-CD2 3.27Å; I437-L441 HydrophobicContact CG2-CD1 3.93Å; I437-L441 HydrophobicContact CG2-CG 4.43Å; I437-L441 PolarHBondContact O-N 3.43Å; L441-P445 VanDerWaalsContact O-CG 3.23Å; L441-P445 WeakPolarHBondContact O-CG 3.13Å
442	V	96.1	Very high	93.9	Very high	0 Å²	0	13.8 Å²	13.8	0%	0	8%	0.076	C	C	.	.	I	π-helix	trans	-116.2	-65.5	-178.5	-178.2	0	0	0	0	110.3	V169 L312 C316 I438 L444 P445 F446	V169-V442 HydrophobicContact CB-CG1 4.42Å; V169-V442 HydrophobicContact CG1-CG1 4.01Å; V169-V442 HydrophobicContact CG2-CG1 4.33Å; L312-V442 HydrophobicContact CD1-CG1 3.73Å; C316-V442 HydrophobicContact CB-CG2 4.49Å; I438-V442 HydrophobicContact CG2-CB 4.08Å; I438-V442 HydrophobicContact CG2-CG2 4.38Å; I438-V442 WeakPolarHBondContact O-CA 3.03Å; I438-V442 VanDerWaalsContact O-CB 3.31Å; I438-V442 WeakPolarHBondContact O-CB 3.28Å; I438-V442 PolarHBondContact O-N 2.95Å; V442-L444 PolarHBondContact O-N 3.4Å; V442-P445 WeakPolarHBondContact O-CD 3.41Å; V442-F446 WeakPolarHBondContact O-CB 3.18Å; V442-F446 VanDerWaalsContact O-CD2 3.3Å; V442-F446 WeakPolarHBondContact O-CD2 3.24Å; V442-F446 PolarHBondContact O-N 2.72Å
443	A	93.6	Very high	93.8	Very high	22 Å²	22	13.7 Å²	13.7	18%	0.182	8%	0.076	C	C	.	.	I	π-helix	trans	-62.8	-42.8	-172.5	0	0	0	0	0	112	I438 V447	I438-A443 PolarHBondContact O-N 3.27Å; A443-V447 HydrophobicContact CB-CG2 4.32Å; A443-V447 WeakPolarHBondContact O-CA 3.5Å; A443-V447 WeakPolarHBondContact O-CB 3.16Å; A443-V447 WeakPolarHBondContact O-CG2 3.04Å; A443-V447 PolarHBondContact O-N 3.35Å
444	L	94.5	Very high	93.6	Very high	9 Å²	9	14.3 Å²	14.3	5%	0.047	8%	0.078	C	C	.	.	H	α-helix	trans	-61	-59.6	-178.8	-170.9	60.1	0	0	0	112.5	G374 L375 L378 W410 S439 V442 Y448	G374-L444 VanDerWaalsContact C-CD2 3.45Å; L375-L444 HydrophobicContact CD2-CD2 3.85Å; L375-L444 HydrophobicContact CG-CD2 3.86Å; L378-L444 HydrophobicContact CD1-CD1 3.77Å; L378-L444 HydrophobicContact CD1-CG 4Å; W410-L444 HydrophobicContact CH2-CD1 4.04Å; S439-L444 WeakPolarHBondContact O-CB 3.25Å; S439-L444 PolarHBondContact O-N 2.66Å; V442-L444 PolarHBondContact O-N 3.4Å; L444-Y448 HydrophobicContact CD1-CD2 3.83Å; L444-Y448 HydrophobicContact CD1-CE2 4.05Å; L444-Y448 HydrophobicContact CD1-CG 4.29Å; L444-Y448 WeakPolarHBondContact O-CB 3.45Å; L444-Y448 PolarHBondContact O-N 3.17Å
445	P	95	Very high	93.5	Very high	7 Å²	7	14.2 Å²	14.2	5%	0.045	8%	0.077	C	C	.	.	H	α-helix	trans	-69.2	-34.1	179.7	24	-32.8	0	0	0	114.4	A377 I381 R440 L441 V442 S449	A377-P445 HydrophobicContact CB-CB 3.91Å; I381-P445 HydrophobicContact CD1-CB 3.81Å; R440-P445 VanDerWaalsContact O-CD 3.3Å; R440-P445 WeakPolarHBondContact O-CD 3.4Å; L441-P445 VanDerWaalsContact O-CG 3.23Å; L441-P445 WeakPolarHBondContact O-CG 3.13Å; V442-P445 WeakPolarHBondContact O-CD 3.41Å; P445-S449 WeakPolarHBondContact O-CB 3.42Å; P445-S449 PolarHBondContact O-OG 3.32Å
446	F	95.2	Very high	93.4	Very high	9 Å²	9	13.2 Å²	13.2	4%	0.039	7%	0.07	C	C	.	.	H	α-helix	trans	-101.4	-11.2	-171.1	-61.9	-82.6	0	0	0	114.7	V169 N173 W308 L311 L312 S315 V442 I450	V169-F446 HydrophobicContact CG1-CB 4Å; N173-F446 PolarHBondContact ND2-O 3.02Å; N173-F446 PolarHBondContact OD1-O 3.44Å; W308-F446 HydrophobicContact CD2-CD1 4.42Å; W308-F446 HydrophobicContact CD2-CE1 4.48Å; W308-F446 AromaticContact CE2-CD1 3.89Å; W308-F446 HydrophobicContact CE3-CE1 4.38Å; W308-F446 AromaticContact CH2-CD1 3.72Å; W308-F446 HydrophobicContact CH2-CD1 3.72Å; W308-F446 HydrophobicContact CH2-CE1 4.15Å; W308-F446 AromaticContact CZ2-CD1 3.54Å; W308-F446 HydrophobicContact CZ2-CD1 3.54Å; W308-F446 HydrophobicContact CZ2-CE1 4.26Å; W308-F446 HydrophobicContact CZ2-CG 4.45Å; W308-F446 HydrophobicContact CZ3-CD1 4.24Å; W308-F446 HydrophobicContact CZ3-CE1 4.21Å; L311-F446 HydrophobicContact CB-CE1 4.19Å; L311-F446 HydrophobicContact CB-CZ 4.13Å; L312-F446 HydrophobicContact CB-CD1 3.85Å; L312-F446 HydrophobicContact CB-CE1 3.81Å; L312-F446 HydrophobicContact CB-CG 4.29Å; L312-F446 HydrophobicContact CB-CZ 4.22Å; L312-F446 HydrophobicContact CD1-CB 3.92Å; L312-F446 HydrophobicContact CD1-CD1 4.09Å; L312-F446 HydrophobicContact CD1-CD2 3.73Å; L312-F446 HydrophobicContact CD1-CE2 4.3Å; L312-F446 HydrophobicContact CD1-CG 3.64Å; L312-F446 HydrophobicContact CG-CD1 4.45Å; L312-F446 HydrophobicContact CG-CG 4.47Å; S315-F446 WeakPolarHBondContact OG-CE2 3.37Å; V442-F446 WeakPolarHBondContact O-CB 3.18Å; V442-F446 VanDerWaalsContact O-CD2 3.3Å; V442-F446 WeakPolarHBondContact O-CD2 3.24Å; V442-F446 PolarHBondContact O-N 2.72Å; F446-I450 WeakPolarHBondContact O-CD1 3.37Å; F446-I450 WeakPolarHBondContact O-CG1 3.26Å
447	V	93.8	Very high	92.9	Very high	14 Å²	14	15.8 Å²	15.8	9%	0.085	9%	0.09	C	C	.	.	H	α-helix	trans	-100.1	-41	171.9	-178.7	0	0	0	0	110.9	V169 L172 A443 I450 I563	V169-V447 HydrophobicContact CB-CG2 4.45Å; V169-V447 HydrophobicContact CG1-CG2 4.11Å; V169-V447 HydrophobicContact CG2-CG2 3.76Å; L172-V447 HydrophobicContact CD1-CG1 4.12Å; L172-V447 HydrophobicContact CD1-CG2 4.41Å; A443-V447 HydrophobicContact CB-CG2 4.32Å; A443-V447 WeakPolarHBondContact O-CA 3.5Å; A443-V447 WeakPolarHBondContact O-CB 3.16Å; A443-V447 WeakPolarHBondContact O-CG2 3.04Å; A443-V447 PolarHBondContact O-N 3.35Å; V447-I450 HydrophobicContact CB-CD1 4.48Å; V447-I450 HydrophobicContact CG1-CD1 4.38Å; V447-I450 VanDerWaalsContact O-CB 3.28Å; V447-I450 WeakPolarHBondContact O-CB 3.18Å; V447-I450 VanDerWaalsContact O-CG1 3.32Å; V447-I450 WeakPolarHBondContact O-CG1 3.44Å; V447-I450 PolarHBondContact O-N 3.49Å; V447-I563 HydrophobicContact CG1-CG1 4.3Å; V447-I563 HydrophobicContact CG1-CG2 4.39Å; V447-I563 WeakPolarHBondContact O-CD1 3.44Å
448	Y	93.4	Very high	92.4	Very high	42 Å²	42	19.4 Å²	19.4	17%	0.165	10%	0.103	C	C	.	.	H	α-helix	trans	-76.1	-26.6	-178.5	-71.2	-101.3	0	0	0	112.5	H407 W410 L444 I450 I563 T567	H407-Y448 PolarHBondContact CE1-O 2.7Å; W410-Y448 HydrophobicContact CH2-CD1 4.33Å; W410-Y448 HydrophobicContact CH2-CE1 4.27Å; W410-Y448 HydrophobicContact CZ3-CD1 4.15Å; W410-Y448 HydrophobicContact CZ3-CE1 4.47Å; L444-Y448 HydrophobicContact CD1-CD2 3.83Å; L444-Y448 HydrophobicContact CD1-CE2 4.05Å; L444-Y448 HydrophobicContact CD1-CG 4.29Å; L444-Y448 WeakPolarHBondContact O-CB 3.45Å; L444-Y448 PolarHBondContact O-N 3.17Å; Y448-I450 VanDerWaalsContact C-N 3.28Å; Y448-I450 PolarHBondContact O-N 2.84Å; Y448-I563 HydrophobicContact CD1-CG2 4.43Å; Y448-T567 PolarHBondContact OH-OG1 2.9Å
449	S	93.4	Very high	91.8	Very high	0 Å²	0	19 Å²	19	0%	0	10%	0.102	C	C	.	.	T	Hydrogen-bonded Turn	trans	-82.2	-1.7	176.2	-45.2	0	0	0	0	114.5	L378 P445 T451 S452 S453	L378-S449 WeakPolarHBondContact CD2-OG 3.32Å; P445-S449 WeakPolarHBondContact O-CB 3.42Å; P445-S449 PolarHBondContact O-OG 3.32Å; S449-T451 PolarHBondContact O-N 3.47Å; S449-S452 WeakPolarHBondContact O-CB 3.34Å; S449-S452 PolarHBondContact O-N 3.36Å; S449-S452 VanDerWaalsContact O-N 3.17Å; S449-S453 PolarHBondContact O-N 2.96Å
450	I	91.7	Very high	91.2	Very high	5 Å²	5	20 Å²	20	3%	0.026	10%	0.103	C	C	.	.	H	α-helix	trans	-58.4	-39.7	177.9	-73.3	-175.7	0	0	0	110.4	L172 I176 F446 V447 Y448 S453 Y454 L560 I563	L172-I450 HydrophobicContact CB-CD1 3.69Å; I176-I450 HydrophobicContact CD1-CB 4.38Å; I176-I450 HydrophobicContact CD1-CG2 3.04Å; I176-I450 HydrophobicContact CG1-CG2 3.83Å; F446-I450 WeakPolarHBondContact O-CD1 3.37Å; F446-I450 WeakPolarHBondContact O-CG1 3.26Å; V447-I450 HydrophobicContact CB-CD1 4.48Å; V447-I450 HydrophobicContact CG1-CD1 4.38Å; V447-I450 VanDerWaalsContact O-CB 3.28Å; V447-I450 WeakPolarHBondContact O-CB 3.18Å; V447-I450 VanDerWaalsContact O-CG1 3.32Å; V447-I450 WeakPolarHBondContact O-CG1 3.44Å; V447-I450 PolarHBondContact O-N 3.49Å; Y448-I450 VanDerWaalsContact C-N 3.28Å; Y448-I450 PolarHBondContact O-N 2.84Å; I450-S453 WeakPolarHBondContact O-CB 3.44Å; I450-S453 PolarHBondContact O-N 2.86Å; I450-Y454 WeakPolarHBondContact O-CB 3.35Å; I450-Y454 PolarHBondContact O-N 3.19Å; I450-L560 HydrophobicContact CG2-CD2 3.69Å; I450-I563 HydrophobicContact CB-CD1 3.92Å; I450-I563 HydrophobicContact CG2-CD1 3.94Å
451	T	91.5	Very high	90.4	Very high	1 Å²	1	17.7 Å²	17.7	1%	0.006	10%	0.095	C	C	.	.	H	α-helix	trans	-62	-44	176.3	-58.4	0	0	0	0	111.5	H403 S449 Y454 L455 Q550 C553	H403-T451 VanDerWaalsContact CE1-CG2 3.44Å; H403-T451 WeakPolarHBondContact CE1-CG2 3.35Å; S449-T451 PolarHBondContact O-N 3.47Å; T451-Y454 PolarHBondContact O-N 2.9Å; T451-L455 HydrophobicContact CG2-CD1 4.31Å; T451-L455 WeakPolarHBondContact O-CG 3.47Å; T451-L455 PolarHBondContact O-N 3.3Å; T451-Q550 PolarHBondContact OG1-OE1 3Å; T451-C553 WeakPolarHBondContact CG2-SG 3.2Å
452	S	92.8	Very high	89.3	Confident	0 Å²	0	17.2 Å²	17.2	0%	0	9%	0.094	C	C	.	.	H	α-helix	trans	-63	-44	175.2	-46.8	0	0	0	0	112.2	D382 H403 S449 L455 S456	D382-S452 VanDerWaalsContact OD1-CB 3.27Å; D382-S452 WeakPolarHBondContact OD1-CB 3.35Å; D382-S452 PolarHBondContact OD1-OG 3.48Å; H403-S452 PolarHBondContact CD2-OG 3.01Å; H403-S452 PolarHBondContact NE2-OG 3.25Å; S449-S452 WeakPolarHBondContact O-CB 3.34Å; S449-S452 PolarHBondContact O-N 3.36Å; S449-S452 VanDerWaalsContact O-N 3.17Å; S452-L455 PolarHBondContact O-N 2.9Å; S452-S456 WeakPolarHBondContact O-CB 3.48Å; S452-S456 PolarHBondContact O-N 3.23Å
453	S	89.7	Confident	88.2	Confident	2 Å²	2	22.4 Å²	22.4	1%	0.014	11%	0.113	C	C	.	.	H	α-helix	trans	-58.8	-48.4	173.8	166.7	0	0	0	0	111.5	F177 S449 I450 L455 S456	F177-S453 WeakPolarHBondContact CE1-OG 3.44Å; F177-S453 WeakPolarHBondContact CE2-OG 3.42Å; F177-S453 WeakPolarHBondContact CZ-OG 3.33Å; S449-S453 PolarHBondContact O-N 2.96Å; I450-S453 WeakPolarHBondContact O-CB 3.44Å; I450-S453 PolarHBondContact O-N 2.86Å; S453-L455 VanDerWaalsContact C-N 3.3Å; S453-L455 PolarHBondContact O-N 3.4Å; S453-S456 WeakPolarHBondContact O-CB 3.29Å; S453-S456 PolarHBondContact O-N 3.02Å; S453-S456 VanDerWaalsContact O-N 3.13Å; S453-S456 PolarHBondContact O-OG 3.16Å
454	Y	88	Confident	86.7	Confident	16 Å²	16	28.5 Å²	28.5	6%	0.063	14%	0.138	C	C	.	.	H	α-helix	trans	-58.8	-40.3	178.9	174.3	-96.9	0	0	0	113.1	I176 I450 T451 S457 R458 C553 L560	I176-Y454 HydrophobicContact CD1-CD2 4.41Å; I176-Y454 HydrophobicContact CG2-CD2 4.26Å; I450-Y454 WeakPolarHBondContact O-CB 3.35Å; I450-Y454 PolarHBondContact O-N 3.19Å; T451-Y454 PolarHBondContact O-N 2.9Å; Y454-S457 PolarHBondContact O-OG 3.13Å; Y454-R458 VanDerWaalsContact CE2-NH1 3.27Å; Y454-R458 VanDerWaalsContact CZ-CZ 3.44Å; Y454-R458 PolarHBondContact O-NH1 3.21Å; Y454-R458 PolarHBondContact OH-NE 3.29Å; Y454-C553 HydrophobicContact CD1-CB 4.33Å; Y454-C553 HydrophobicContact CE1-CB 4.25Å; Y454-L560 HydrophobicContact CD1-CD1 3.42Å; Y454-L560 VanDerWaalsContact CD1-CD1 3.42Å; Y454-L560 HydrophobicContact CD2-CD1 3.87Å; Y454-L560 HydrophobicContact CE1-CD1 3.79Å; Y454-L560 HydrophobicContact CE2-CD1 4.2Å; Y454-L560 HydrophobicContact CG-CD1 3.47Å; Y454-L560 VanDerWaalsContact CG-CD1 3.47Å
455	L	89.8	Confident	84.7	Confident	0 Å²	0	33.1 Å²	33.1	0%	0	16%	0.162	C	C	.	.	H	α-helix	trans	-75.9	-23.6	179.2	-69.2	171.7	0	0	0	112.7	Q389 A399 L400 H403 T451 S452 S453 S457 R458 V461 P552	Q389-L455 PolarHBondContact NE2-O 3.04Å; A399-L455 HydrophobicContact CB-CD2 4.13Å; L400-L455 HydrophobicContact CB-CB 4.02Å; L400-L455 HydrophobicContact CD1-CB 4Å; H403-L455 HydrophobicContact CB-CD1 4.08Å; T451-L455 HydrophobicContact CG2-CD1 4.31Å; T451-L455 WeakPolarHBondContact O-CG 3.47Å; T451-L455 PolarHBondContact O-N 3.3Å; S452-L455 PolarHBondContact O-N 2.9Å; S453-L455 VanDerWaalsContact C-N 3.3Å; S453-L455 PolarHBondContact O-N 3.4Å; L455-S457 VanDerWaalsContact C-N 3.29Å; L455-S457 PolarHBondContact O-N 2.94Å; L455-R458 PolarHBondContact O-N 3.09Å; L455-V461 HydrophobicContact CD2-CG1 4.36Å; L455-P552 HydrophobicContact CD1-CB 4.26Å
456	S	89.7	Confident	82.5	Confident	19 Å²	19	37.4 Å²	37.4	13%	0.133	19%	0.188	C	C	.	.	H	α-helix	trans	-62.1	-31.8	-178.2	76.1	0	0	0	0	113.9	Q389 S452 S453 R458	Q389-S456 WeakPolarHBondContact CG-O 3.27Å; Q389-S456 VanDerWaalsContact NE2-C 3.31Å; Q389-S456 PolarHBondContact NE2-O 3.38Å; S452-S456 WeakPolarHBondContact O-CB 3.48Å; S452-S456 PolarHBondContact O-N 3.23Å; S453-S456 WeakPolarHBondContact O-CB 3.29Å; S453-S456 PolarHBondContact O-N 3.02Å; S453-S456 VanDerWaalsContact O-N 3.13Å; S453-S456 PolarHBondContact O-OG 3.16Å; S456-R458 VanDerWaalsContact C-N 3.31Å; S456-R458 PolarHBondContact O-N 2.86Å
457	S	84.6	Confident	80.3	Confident	63 Å²	63	43.5 Å²	43.5	44%	0.441	23%	0.232	S	C	.	.	T	Hydrogen-bonded Turn	trans	-87	3.7	176.5	54.6	0	0	0	0	113.9	Y454 L455	Y454-S457 PolarHBondContact O-OG 3.13Å; L455-S457 VanDerWaalsContact C-N 3.29Å; L455-S457 PolarHBondContact O-N 2.94Å
458	R	84.7	Confident	78.1	Confident	76 Å²	76	48.1 Å²	48.1	29%	0.287	27%	0.265	S	S	.	.			trans	-127.9	76.1	-173.1	-67.4	179.6	173.1	68.9	3.8	111.9	S397 Y454 L455 S456 D460 V461	S397-R458 WeakPolarHBondContact CB-O 3.26Å; Y454-R458 VanDerWaalsContact CE2-NH1 3.27Å; Y454-R458 VanDerWaalsContact CZ-CZ 3.44Å; Y454-R458 PolarHBondContact O-NH1 3.21Å; Y454-R458 PolarHBondContact OH-NE 3.29Å; L455-R458 PolarHBondContact O-N 3.09Å; S456-R458 VanDerWaalsContact C-N 3.31Å; S456-R458 PolarHBondContact O-N 2.86Å; R458-D460 PolarHBondContact O-N 3.47Å; R458-V461 HydrophobicContact CB-CG2 3.7Å; R458-V461 HydrophobicContact CG-CG2 4.49Å
459	P	83.6	Confident	76.3	Confident	8 Å²	8	47.4 Å²	47.4	5%	0.052	27%	0.266	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66.8	-18.4	-175.1	27.6	-36.7	0	0	0	114.6	Q389 Y393 R395 S397	Q389-P459 HydrophobicContact CG-CB 4.5Å; Y393-P459 HydrophobicContact CD1-CG 3.9Å; Y393-P459 HydrophobicContact CD2-CB 4.2Å; Y393-P459 HydrophobicContact CD2-CG 4.09Å; Y393-P459 HydrophobicContact CE1-CG 4.18Å; Y393-P459 HydrophobicContact CE2-CG 4.36Å; Y393-P459 HydrophobicContact CG-CB 4.08Å; Y393-P459 HydrophobicContact CG-CG 3.83Å; R395-P459 HydrophobicContact CG-CB 4.02Å; S397-P459 WeakPolarHBondContact CA-O 3.23Å
460	D	80.8	Confident	74.6	Confident	61 Å²	61	57.1 Å²	57.1	33%	0.326	31%	0.309	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.5	-9.8	-173.9	-65.6	-59.6	0	0	0	114.7	R395 R458	R395-D460 IonicContact CZ-OD1 3.15Å; R395-D460 IonicContact CZ-OD2 3.83Å; R395-D460 IonicContact NH1-OD1 2.66Å; R395-D460 PolarHBondContact NH1-OD1 3.01Å; R395-D460 IonicContact NH2-OD1 2.94Å; R395-D460 PolarHBondContact NH2-OD1 3.44Å; R395-D460 IonicContact NH2-OD2 2.87Å; R395-D460 PolarHBondContact NH2-OD2 2.84Å; R458-D460 PolarHBondContact O-N 3.47Å
461	V	80.5	Confident	73.1	Confident	5 Å²	5	59.8 Å²	59.8	3%	0.03	32%	0.321	C	S	.	.	T	Hydrogen-bonded Turn	trans	-71.1	136.1	-176.9	-177.9	0	0	0	0	110.7	S397 P398 A399 L455 R458 R463 H471 C473	S397-V461 PolarHBondContact OG-O 3.18Å; P398-V461 WeakPolarHBondContact CD-O 3.31Å; A399-V461 HydrophobicContact CB-CB 4.16Å; A399-V461 HydrophobicContact CB-CG1 3.69Å; A399-V461 PolarHBondContact N-O 3.42Å; L455-V461 HydrophobicContact CD2-CG1 4.36Å; R458-V461 HydrophobicContact CB-CG2 3.7Å; R458-V461 HydrophobicContact CG-CG2 4.49Å; V461-R463 VanDerWaalsContact C-N 3.34Å; V461-H471 HydrophobicContact CG2-CB 4.34Å; V461-C473 HydrophobicContact CG1-CB 4.09Å
462	G	72.7	Confident	71.8	Confident	3 Å²	3	62.4 Å²	62.4	3%	0.031	34%	0.339	C	S	.	.	T	Hydrogen-bonded Turn	trans	84.3	-1.5	179.4	0	0	0	0	0	115.2	C473	G462-C473 WeakPolarHBondContact CA-O 3.43Å; G462-C473 PolarHBondContact N-O 3.01Å; G462-C473 VanDerWaalsContact N-O 3.12Å
463	R	73.9	Confident	70.7	Confident	109 Å²	109	62.6 Å²	62.6	41%	0.411	34%	0.34	S	S	.	.	S	Bend	trans	-75.1	153.6	171.3	-167.3	175.8	-71.9	-138.9	-2.5	110.1	V461 L465 N474	V461-R463 VanDerWaalsContact C-N 3.34Å; R463-L465 PolarHBondContact O-N 3.24Å; R463-N474 PolarHBondContact O-OD1 2.96Å
464	Q	61	Low	70.2	Confident	150 Å²	150	64 Å²	64	70%	0.701	35%	0.348	S	S	*	.			trans	-55.9	129	168.6	-71.5	-174.8	-15	0	0	108.8	T466 A475	Q464-T466 VanDerWaalsContact C-N 3.34Å; Q464-T466 PolarHBondContact O-N 3.46Å; Q464-A475 HydrophobicContact CG-CB 4.12Å
465	L	53.8	Low	70	Confident	106 Å²	106	64.6 Å²	64.6	56%	0.555	36%	0.356	S	S	*	.			trans	-45.4	92.9	177.5	-72.3	155.9	0	0	0	110.8	R463 N474	R463-L465 PolarHBondContact O-N 3.24Å; L465-N474 HydrophobicContact CD1-CB 4.45Å; L465-N474 VanDerWaalsContact CD1-ND2 3.26Å; L465-N474 WeakPolarHBondContact CD1-ND2 3.48Å; L465-N474 HydrophobicContact CG-CB 4.45Å
466	T	48.8	Very low	69.8	Low	96 Å²	96	74.2 Å²	74.2	59%	0.589	39%	0.392	S	S	*	.			trans	-67.3	135	145.6	40.8	0	0	0	0	105.5	Q464 S468 S469	Q464-T466 VanDerWaalsContact C-N 3.34Å; Q464-T466 PolarHBondContact O-N 3.46Å; T466-S468 PolarHBondContact O-N 2.84Å; T466-S469 PolarHBondContact O-N 3.27Å
467	S	49	Very low	69.7	Low	137 Å²	137	76.6 Å²	76.6	96%	0.958	40%	0.403	S	S	*	.	T	Hydrogen-bonded Turn	trans	-44.6	-14.1	-170.4	-137.3	0	0	0	0	116.8
468	S	47.7	Very low	69.9	Low	111 Å²	111	75.4 Å²	75.4	78%	0.776	39%	0.391	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.8	-8.2	179	-62.3	0	0	0	0	117	T466 K470	T466-S468 PolarHBondContact O-N 2.84Å; S468-K470 PolarHBondContact O-N 3.11Å; S468-K470 VanDerWaalsContact O-N 3.14Å
469	S	54	Low	70.1	Confident	28 Å²	28	73.5 Å²	73.5	20%	0.196	40%	0.395	C	S	.	.			trans	-83.7	94.7	-178.2	72.2	0	0	0	0	112	T466 H471	T466-S469 PolarHBondContact O-N 3.27Å; S469-H471 PolarHBondContact O-N 3.04Å
470	K	57.6	Low	70.6	Confident	204 Å²	204	78 Å²	78	89%	0.887	42%	0.417	S	S	*	.			trans	-72.5	43.7	171.7	-66.3	-178.1	179	176.8	0	113.2	S468	S468-K470 PolarHBondContact O-N 3.11Å; S468-K470 VanDerWaalsContact O-N 3.14Å
471	H	60.6	Low	71.2	Confident	61 Å²	61	75.1 Å²	75.1	28%	0.282	40%	0.402	S	S	.	.			trans	-106.9	135.7	176.4	-78.3	-57.4	0	0	0	111	V461 S469 C473 D556	V461-H471 HydrophobicContact CG2-CB 4.34Å; S469-H471 PolarHBondContact O-N 3.04Å; H471-C473 PolarHBondContact O-N 2.99Å; H471-D556 IonicContact CE1-OD2 4Å; H471-D556 IonicContact CG-OD2 3.85Å; H471-D556 IonicContact ND1-OD2 2.97Å; H471-D556 PolarHBondContact ND1-OD2 3.45Å
472	S	63.6	Low	72	Confident	55 Å²	55	76.6 Å²	76.6	39%	0.385	41%	0.409	S	S	.	.	S	Bend	trans	-64.2	-20.9	-177.1	-67.2	0	0	0	0	114.1	I477 D556	S472-I477 WeakPolarHBondContact O-CD1 3.46Å; S472-D556 VanDerWaalsContact CB-OD1 3.24Å; S472-D556 WeakPolarHBondContact CB-OD1 3.45Å; S472-D556 PolarHBondContact N-OD1 3.44Å; S472-D556 PolarHBondContact N-OD2 2.78Å; S472-D556 PolarHBondContact OG-OD1 3.23Å
473	C	70.7	Confident	73.2	Confident	4 Å²	4	81.2 Å²	81.2	3%	0.027	44%	0.436	C	S	.	.			trans	-103.9	102.6	-175.6	-160.9	0	0	0	0	112	V461 G462 H471	V461-C473 HydrophobicContact CG1-CB 4.09Å; G462-C473 WeakPolarHBondContact CA-O 3.43Å; G462-C473 PolarHBondContact N-O 3.01Å; G462-C473 VanDerWaalsContact N-O 3.12Å; H471-C473 PolarHBondContact O-N 2.99Å
474	N	78.3	Confident	74.3	Confident	32 Å²	32	79.2 Å²	79.2	17%	0.171	43%	0.433	C	S	.	.			trans	-91.9	165.7	171.9	-170.8	10.4	0	0	0	111	R463 L465 W476 I477 M478	R463-N474 PolarHBondContact O-OD1 2.96Å; L465-N474 HydrophobicContact CD1-CB 4.45Å; L465-N474 VanDerWaalsContact CD1-ND2 3.26Å; L465-N474 WeakPolarHBondContact CD1-ND2 3.48Å; L465-N474 HydrophobicContact CG-CB 4.45Å; N474-W476 PolarHBondContact O-N 3.05Å; N474-W476 VanDerWaalsContact O-N 3.1Å; N474-I477 PolarHBondContact O-N 2.7Å; N474-M478 PolarHBondContact O-N 3.25Å; N474-M478 VanDerWaalsContact O-N 3.11Å
475	A	84	Confident	76.1	Confident	28 Å²	28	72 Å²	72	23%	0.231	40%	0.4	C	S	.	.	H	α-helix	trans	-50.9	-35.9	178.9	0	0	0	0	0	113.8	Q464 M478 G479	Q464-A475 HydrophobicContact CG-CB 4.12Å; A475-M478 PolarHBondContact O-N 3.19Å; A475-G479 PolarHBondContact O-N 3.29Å
476	W	85.3	Confident	78.2	Confident	203 Å²	203	71.1 Å²	71.1	77%	0.769	40%	0.395	S	S	*	.	H	α-helix	trans	-63.5	-45.3	175.2	-73.6	106.9	0	0	0	113.2	N474 M478 G479 I480	N474-W476 PolarHBondContact O-N 3.05Å; N474-W476 VanDerWaalsContact O-N 3.1Å; W476-M478 VanDerWaalsContact C-N 3.3Å; W476-M478 PolarHBondContact O-N 3.25Å; W476-G479 PolarHBondContact O-N 2.86Å; W476-I480 WeakPolarHBondContact O-CG1 3.39Å; W476-I480 PolarHBondContact O-N 2.95Å
477	I	88.1	Confident	80.6	Confident	68 Å²	68	70.3 Å²	70.3	35%	0.349	39%	0.387	S	S	.	.	H	α-helix	trans	-65.7	-38.6	178.9	-66.4	169.4	0	0	0	109.9	S472 N474 I480 S481 V551	S472-I477 WeakPolarHBondContact O-CD1 3.46Å; N474-I477 PolarHBondContact O-N 2.7Å; I477-I480 PolarHBondContact O-N 3.07Å; I477-S481 WeakPolarHBondContact O-CB 3.46Å; I477-S481 PolarHBondContact O-N 2.98Å; I477-V551 HydrophobicContact CG2-CG1 3.46Å; I477-V551 VanDerWaalsContact CG2-CG1 3.46Å
478	M	88.4	Confident	82.9	Confident	38 Å²	38	63.8 Å²	63.8	19%	0.187	34%	0.341	C	S	.	.	H	α-helix	trans	-63.1	-41.5	173.1	-175.9	-176.4	69.5	0	0	112.1	P398 A402 N474 A475 W476 S481 M482	P398-M478 HydrophobicContact CB-CE 3.82Å; P398-M478 HydrophobicContact CB-SD 3.64Å; A402-M478 HydrophobicContact CB-CG 3.73Å; A402-M478 HydrophobicContact CB-SD 3.79Å; N474-M478 PolarHBondContact O-N 3.25Å; N474-M478 VanDerWaalsContact O-N 3.11Å; A475-M478 PolarHBondContact O-N 3.19Å; W476-M478 VanDerWaalsContact C-N 3.3Å; W476-M478 PolarHBondContact O-N 3.25Å; M478-S481 WeakPolarHBondContact O-CB 3.35Å; M478-S481 PolarHBondContact O-N 3.42Å; M478-M482 PolarHBondContact O-N 3.19Å
479	G	90.6	Very high	85.3	Confident	36 Å²	36	59.7 Å²	59.7	37%	0.371	31%	0.31	S	S	.	.	H	α-helix	trans	-60.3	-45.6	173.7	0	0	0	0	0	112.4	A475 W476 S481 M482 V483	A475-G479 PolarHBondContact O-N 3.29Å; W476-G479 PolarHBondContact O-N 2.86Å; G479-S481 VanDerWaalsContact C-N 3.35Å; G479-S481 PolarHBondContact O-N 3.16Å; G479-M482 PolarHBondContact O-N 3.18Å; G479-V483 WeakPolarHBondContact O-CG2 3.44Å; G479-V483 PolarHBondContact O-N 3.42Å
480	I	92.4	Very high	87.4	Confident	103 Å²	103	65.3 Å²	65.3	53%	0.528	33%	0.327	S	S	.	.	H	α-helix	trans	-61.1	-44.1	175.3	-66.8	166.1	0	0	0	110.9	W476 I477 M482 V483 L484	W476-I480 WeakPolarHBondContact O-CG1 3.39Å; W476-I480 PolarHBondContact O-N 2.95Å; I477-I480 PolarHBondContact O-N 3.07Å; I480-M482 VanDerWaalsContact C-N 3.35Å; I480-M482 PolarHBondContact O-N 3.29Å; I480-V483 PolarHBondContact O-N 3.1Å; I480-L484 HydrophobicContact CG2-CD1 3.88Å; I480-L484 HydrophobicContact CG2-CG 4.26Å; I480-L484 WeakPolarHBondContact O-CB 3.47Å; I480-L484 WeakPolarHBondContact O-CG 3.34Å; I480-L484 PolarHBondContact O-N 3.49Å
481	S	94.7	Very high	89.4	Confident	0 Å²	0	56.8 Å²	56.8	0%	0	29%	0.291	C	S	.	.	H	α-helix	trans	-55.5	-47.4	175.1	165.4	0	0	0	0	111.9	M406 I477 M478 G479 V483 L484 F485 A548	M406-S481 WeakPolarHBondContact CE-OG 3.44Å; I477-S481 WeakPolarHBondContact O-CB 3.46Å; I477-S481 PolarHBondContact O-N 2.98Å; M478-S481 WeakPolarHBondContact O-CB 3.35Å; M478-S481 PolarHBondContact O-N 3.42Å; G479-S481 VanDerWaalsContact C-N 3.35Å; G479-S481 PolarHBondContact O-N 3.16Å; S481-V483 PolarHBondContact O-N 3.19Å; S481-L484 PolarHBondContact O-N 2.57Å; S481-F485 WeakPolarHBondContact O-CB 3.03Å; S481-F485 PolarHBondContact O-N 2.86Å; S481-A548 PolarHBondContact OG-O 3.01Å
482	M	96.2	Very high	91.1	Very high	36 Å²	36	55.3 Å²	55.3	18%	0.177	28%	0.284	C	S	.	.	H	α-helix	trans	-63.7	-42.9	178.4	-171.7	59.7	65.2	0	0	112.1	A402 L405 M406 M478 G479 I480 L484 F485 L486	A402-M482 HydrophobicContact CB-CE 4.17Å; L405-M482 HydrophobicContact CB-CE 4.43Å; L405-M482 HydrophobicContact CD2-CE 3.87Å; L405-M482 HydrophobicContact CG-CE 4.29Å; M406-M482 HydrophobicContact CE-CE 4.41Å; M406-M482 HydrophobicContact CG-CE 3.83Å; M406-M482 HydrophobicContact CG-SD 4.02Å; M478-M482 PolarHBondContact O-N 3.19Å; G479-M482 PolarHBondContact O-N 3.18Å; I480-M482 VanDerWaalsContact C-N 3.35Å; I480-M482 PolarHBondContact O-N 3.29Å; M482-L484 PolarHBondContact O-N 3.45Å; M482-F485 PolarHBondContact O-N 3.08Å; M482-L486 HydrophobicContact CG-CD1 4.32Å; M482-L486 WeakPolarHBondContact O-CG 3.35Å; M482-L486 PolarHBondContact O-N 2.77Å
483	V	97.6	Very high	92.7	Very high	100 Å²	100	54.4 Å²	54.4	61%	0.606	27%	0.272	S	S	*	.	H	α-helix	trans	-61.9	-44.3	176.3	172.5	0	0	0	0	111.1	G479 I480 S481 F485 L486 L487	G479-V483 WeakPolarHBondContact O-CG2 3.44Å; G479-V483 PolarHBondContact O-N 3.42Å; I480-V483 PolarHBondContact O-N 3.1Å; S481-V483 PolarHBondContact O-N 3.19Å; V483-F485 VanDerWaalsContact C-N 3.35Å; V483-F485 PolarHBondContact O-N 3.43Å; V483-L486 PolarHBondContact O-N 3Å; V483-L487 WeakPolarHBondContact O-CB 3.22Å; V483-L487 PolarHBondContact O-N 3.37Å
484	L	97.7	Very high	93.9	Very high	67 Å²	67	60.9 Å²	60.9	35%	0.351	30%	0.296	S	S	.	.	H	α-helix	trans	-62.1	-42.5	175.8	-73.2	172.9	0	0	0	111.6	I480 S481 M482 L487 G488 I544 A548	I480-L484 HydrophobicContact CG2-CD1 3.88Å; I480-L484 HydrophobicContact CG2-CG 4.26Å; I480-L484 WeakPolarHBondContact O-CB 3.47Å; I480-L484 WeakPolarHBondContact O-CG 3.34Å; I480-L484 PolarHBondContact O-N 3.49Å; S481-L484 PolarHBondContact O-N 2.57Å; M482-L484 PolarHBondContact O-N 3.45Å; L484-L487 PolarHBondContact O-N 3.19Å; L484-G488 PolarHBondContact O-N 3.1Å; L484-I544 WeakPolarHBondContact O-CG2 3.38Å; L484-A548 HydrophobicContact CB-CB 3.98Å
485	F	98.5	Very high	94.8	Very high	0 Å²	0	59.4 Å²	59.4	0%	0	29%	0.288	C	S	.	.	H	α-helix	trans	-60.6	-48.5	176.9	177.1	-94.9	0	0	0	111.5	M406 L409 W410 S481 M482 V483 L487 G488 L489 M545 A548 M549	M406-F485 HydrophobicContact CB-CD1 4.18Å; M406-F485 HydrophobicContact CB-CD2 3.82Å; M406-F485 HydrophobicContact CB-CE1 4.16Å; M406-F485 HydrophobicContact CB-CE2 3.79Å; M406-F485 HydrophobicContact CB-CG 4.02Å; M406-F485 HydrophobicContact CB-CZ 3.97Å; M406-F485 HydrophobicContact CG-CB 3.98Å; M406-F485 HydrophobicContact CG-CD1 3.75Å; M406-F485 HydrophobicContact CG-CD2 3.84Å; M406-F485 HydrophobicContact CG-CE1 4.21Å; M406-F485 HydrophobicContact CG-CE2 4.28Å; M406-F485 HydrophobicContact CG-CG 3.56Å; M406-F485 HydrophobicContact CG-CZ 4.45Å; M406-F485 WeakPolarHBondContact O-CZ 3.17Å; M406-F485 HydrophobicContact SD-CB 3.58Å; M406-F485 VanDerWaalsContact SD-CB 3.58Å; M406-F485 HydrophobicContact SD-CD1 4.48Å; M406-F485 HydrophobicContact SD-CD2 3.9Å; M406-F485 HydrophobicContact SD-CG 3.73Å; L409-F485 HydrophobicContact CB-CE1 3.72Å; L409-F485 HydrophobicContact CB-CZ 4.1Å; L409-F485 HydrophobicContact CD1-CD1 4.46Å; L409-F485 HydrophobicContact CD1-CE1 3.95Å; W410-F485 HydrophobicContact CB-CE2 4.4Å; W410-F485 HydrophobicContact CB-CZ 4.07Å; S481-F485 WeakPolarHBondContact O-CB 3.03Å; S481-F485 PolarHBondContact O-N 2.86Å; M482-F485 PolarHBondContact O-N 3.08Å; V483-F485 VanDerWaalsContact C-N 3.35Å; V483-F485 PolarHBondContact O-N 3.43Å; F485-L487 VanDerWaalsContact C-N 3.33Å; F485-L487 PolarHBondContact O-N 3.27Å; F485-G488 PolarHBondContact O-N 2.95Å; F485-L489 HydrophobicContact CE1-CD2 4.12Å; F485-L489 WeakPolarHBondContact O-CB 3.18Å; F485-L489 PolarHBondContact O-N 3.39Å; F485-M545 HydrophobicContact CD2-CB 4.05Å; F485-M545 HydrophobicContact CD2-CG 4.15Å; F485-M545 HydrophobicContact CE2-CB 4.07Å; F485-M545 HydrophobicContact CE2-CE 3.67Å; F485-M545 HydrophobicContact CE2-CG 4.13Å; F485-M545 HydrophobicContact CZ-CE 3.82Å; F485-A548 HydrophobicContact CB-CB 3.71Å; F485-M549 HydrophobicContact CD2-CG 3.75Å; F485-M549 HydrophobicContact CD2-SD 4.33Å; F485-M549 HydrophobicContact CE2-CE 4.25Å; F485-M549 HydrophobicContact CE2-CG 3.81Å; F485-M549 HydrophobicContact CE2-SD 3.77Å
486	L	98.5	Very high	95.3	Very high	87 Å²	87	59.4 Å²	59.4	46%	0.455	29%	0.285	S	S	.	.	H	α-helix	trans	-63.2	-38.7	178.5	-68.6	174.8	0	0	0	112	L409 M482 V483 L489 W490	L409-L486 HydrophobicContact CD1-CD2 4.22Å; M482-L486 HydrophobicContact CG-CD1 4.32Å; M482-L486 WeakPolarHBondContact O-CG 3.35Å; M482-L486 PolarHBondContact O-N 2.77Å; V483-L486 PolarHBondContact O-N 3Å; L486-L489 PolarHBondContact O-N 3.48Å; L486-W490 VanDerWaalsContact O-CB 3.32Å; L486-W490 WeakPolarHBondContact O-CB 3.48Å; L486-W490 PolarHBondContact O-N 3.39Å
487	L	98.4	Very high	95.7	Very high	79 Å²	79	52.1 Å²	52.1	41%	0.414	26%	0.26	S	S	.	.	H	α-helix	trans	-62.2	-47.6	173.1	177.6	63.4	0	0	0	111.5	V483 L484 F485 L489 W490 I491	V483-L487 WeakPolarHBondContact O-CB 3.22Å; V483-L487 PolarHBondContact O-N 3.37Å; L484-L487 PolarHBondContact O-N 3.19Å; F485-L487 VanDerWaalsContact C-N 3.33Å; F485-L487 PolarHBondContact O-N 3.27Å; L487-L489 PolarHBondContact O-N 3.37Å; L487-W490 HydrophobicContact CD1-CE3 4.14Å; L487-W490 PolarHBondContact O-N 2.61Å; L487-I491 HydrophobicContact CD1-CD1 4.23Å; L487-I491 HydrophobicContact CD1-CG1 4.46Å; L487-I491 HydrophobicContact CG-CD1 4.19Å; L487-I491 WeakPolarHBondContact O-CG1 3.18Å; L487-I491 PolarHBondContact O-N 2.89Å
488	G	98.5	Very high	96	Very high	0 Å²	0	50.3 Å²	50.3	0%	0	25%	0.251	C	S	.	.	H	α-helix	trans	-60.2	-44.6	177	0	0	0	0	0	112.3	L484 F485 I491 H492 G541	L484-G488 PolarHBondContact O-N 3.1Å; F485-G488 PolarHBondContact O-N 2.95Å; G488-I491 PolarHBondContact O-N 3.4Å; G488-H492 VanDerWaalsContact O-CB 3.29Å; G488-H492 WeakPolarHBondContact O-CB 3.44Å; G488-H492 PolarHBondContact O-N 3.42Å; G488-G541 CarbonylContact C-O 3.51Å; G488-G541 WeakPolarHBondContact CA-O 3.06Å; G488-G541 CarbonylContact O-C 3.44Å; G488-G541 VanDerWaalsContact O-CA 3.26Å; G488-G541 WeakPolarHBondContact O-CA 3.47Å
489	L	98.5	Very high	96.2	Very high	25 Å²	25	50.6 Å²	50.6	13%	0.131	25%	0.251	C	S	.	.	H	α-helix	trans	-62.3	-42.5	176.2	-178.3	63	0	0	0	111.5	D413 F485 L486 L487 H492 R493 M545	D413-L489 HydrophobicContact CB-CD1 3.93Å; F485-L489 HydrophobicContact CE1-CD2 4.12Å; F485-L489 WeakPolarHBondContact O-CB 3.18Å; F485-L489 PolarHBondContact O-N 3.39Å; L486-L489 PolarHBondContact O-N 3.48Å; L487-L489 PolarHBondContact O-N 3.37Å; L489-H492 PolarHBondContact O-N 2.92Å; L489-R493 VanDerWaalsContact O-CB 3.24Å; L489-R493 WeakPolarHBondContact O-CB 3.47Å; L489-R493 PolarHBondContact O-N 2.84Å; L489-M545 HydrophobicContact CB-CE 4.33Å; L489-M545 HydrophobicContact CB-CG 4.37Å; L489-M545 HydrophobicContact CB-SD 4.07Å; L489-M545 HydrophobicContact CD1-CE 3.75Å; L489-M545 HydrophobicContact CD1-SD 4.06Å
490	W	98.3	Very high	96.2	Very high	146 Å²	146	50 Å²	50	55%	0.553	24%	0.239	S	C	*	.	H	α-helix	trans	-61.9	-48.6	176.1	175.5	80.7	0	0	0	112	L486 L487 H492 R493 R494 F530	L486-W490 VanDerWaalsContact O-CB 3.32Å; L486-W490 WeakPolarHBondContact O-CB 3.48Å; L486-W490 PolarHBondContact O-N 3.39Å; L487-W490 HydrophobicContact CD1-CE3 4.14Å; L487-W490 PolarHBondContact O-N 2.61Å; W490-H492 VanDerWaalsContact C-N 3.34Å; W490-H492 PolarHBondContact O-N 3.39Å; W490-R493 PolarHBondContact O-N 3.4Å; W490-R494 WeakPolarHBondContact O-CB 3.11Å; W490-R494 PolarHBondContact O-N 3.07Å; W490-F530 HydrophobicContact CH2-CE2 4.49Å; W490-F530 AromaticContact CH2-CZ 3.74Å; W490-F530 HydrophobicContact CH2-CZ 3.74Å; W490-F530 HydrophobicContact CZ2-CZ 4.42Å; W490-F530 HydrophobicContact CZ3-CE1 4.42Å; W490-F530 AromaticContact CZ3-CZ 3.8Å; W490-F530 HydrophobicContact CZ3-CZ 3.8Å
491	I	98	Very high	96.1	Very high	24 Å²	24	51 Å²	51	12%	0.123	24%	0.236	C	C	.	.	H	α-helix	trans	-59.7	-46.5	176.2	-65.3	170.5	0	0	0	110.2	L487 G488 S495 F530 P537 I544	L487-I491 HydrophobicContact CD1-CD1 4.23Å; L487-I491 HydrophobicContact CD1-CG1 4.46Å; L487-I491 HydrophobicContact CG-CD1 4.19Å; L487-I491 WeakPolarHBondContact O-CG1 3.18Å; L487-I491 PolarHBondContact O-N 2.89Å; G488-I491 PolarHBondContact O-N 3.4Å; I491-S495 VanDerWaalsContact O-CB 3.27Å; I491-S495 WeakPolarHBondContact O-CB 3.34Å; I491-S495 PolarHBondContact O-N 2.86Å; I491-S495 VanDerWaalsContact O-N 3.07Å; I491-S495 PolarHBondContact O-OG 3.25Å; I491-F530 HydrophobicContact CG1-CE1 4.26Å; I491-F530 HydrophobicContact CG2-CD1 4.31Å; I491-F530 HydrophobicContact CG2-CE1 4.08Å; I491-P537 WeakPolarHBondContact CG2-O 3.28Å; I491-I544 HydrophobicContact CD1-CD1 3.95Å
492	H	97.5	Very high	96	Very high	30 Å²	30	51.6 Å²	51.6	14%	0.139	24%	0.239	C	C	.	.	H	α-helix	trans	-59.4	-51.2	179.7	-176.6	80.6	0	0	0	111.6	G488 L489 W490 S495 N496 N538 M545	G488-H492 VanDerWaalsContact O-CB 3.29Å; G488-H492 WeakPolarHBondContact O-CB 3.44Å; G488-H492 PolarHBondContact O-N 3.42Å; L489-H492 PolarHBondContact O-N 2.92Å; W490-H492 VanDerWaalsContact C-N 3.34Å; W490-H492 PolarHBondContact O-N 3.39Å; H492-S495 PolarHBondContact O-OG 3.3Å; H492-S495 VanDerWaalsContact O-OG 3.09Å; H492-N496 PolarHBondContact CD2-ND2 3.38Å; H492-N496 PolarHBondContact CE1-ND2 3.47Å; H492-N496 VanDerWaalsContact CE1-ND2 3.3Å; H492-N496 PolarHBondContact NE2-ND2 3.33Å; H492-N496 WeakPolarHBondContact O-CB 3.14Å; H492-N496 PolarHBondContact O-N 3.37Å; H492-N496 VanDerWaalsContact O-N 3.11Å; H492-N496 PolarHBondContact O-ND2 3.22Å; H492-N538 PolarHBondContact ND1-O 3.27Å; H492-M545 HydrophobicContact CB-SD 4.2Å
493	R	96.4	Very high	95.7	Very high	36 Å²	36	56.1 Å²	56.1	14%	0.136	25%	0.254	C	S	.	.	H	α-helix	trans	-69.5	-46.8	-177	179.2	46.8	54.9	-168.1	3.2	111.8	D413 F417 L489 W490 S495 N496 N497	D413-R493 PolarHBondContact O-NH2 3.1Å; D413-R493 IonicContact OD1-CZ 2.7Å; D413-R493 VanDerWaalsContact OD1-CZ 3.29Å; D413-R493 IonicContact OD1-NE 3.44Å; D413-R493 PolarHBondContact OD1-NE 2.89Å; D413-R493 IonicContact OD1-NH2 2.67Å; D413-R493 PolarHBondContact OD1-NH2 2.88Å; D413-R493 VanDerWaalsContact OD1-NH2 3.1Å; D413-R493 IonicContact OD2-CZ 3.39Å; D413-R493 IonicContact OD2-NE 2.72Å; D413-R493 PolarHBondContact OD2-NE 2.84Å; D413-R493 IonicContact OD2-NH2 3.34Å; D413-R493 PolarHBondContact OD2-NH2 3.44Å; F417-R493 VanDerWaalsContact CB-CZ 3.43Å; F417-R493 VanDerWaalsContact CD2-NE 3.31Å; F417-R493 HydrophobicContact CE2-CG 4.33Å; L489-R493 VanDerWaalsContact O-CB 3.24Å; L489-R493 WeakPolarHBondContact O-CB 3.47Å; L489-R493 PolarHBondContact O-N 2.84Å; W490-R493 PolarHBondContact O-N 3.4Å; R493-S495 PolarHBondContact O-N 2.9Å; R493-N496 PolarHBondContact O-N 2.84Å; R493-N497 WeakPolarHBondContact CD-ND2 3.08Å; R493-N497 WeakPolarHBondContact CD-OD1 3.32Å; R493-N497 PolarHBondContact NH1-OD1 3.44Å; R493-N497 WeakPolarHBondContact O-CB 3.35Å; R493-N497 VanDerWaalsContact O-CG 3.26Å; R493-N497 PolarHBondContact O-N 2.82Å
494	R	96.4	Very high	95.1	Very high	141 Å²	141	57.7 Å²	57.7	53%	0.532	25%	0.249	S	C	.	.	H	α-helix	trans	-61.7	-45	-178.1	-173.2	61.5	175.3	151.2	1.3	111.4	W490 N497 Q498 F530	W490-R494 WeakPolarHBondContact O-CB 3.11Å; W490-R494 PolarHBondContact O-N 3.07Å; R494-N497 PolarHBondContact O-N 3.03Å; R494-Q498 PolarHBondContact O-N 3.24Å; R494-F530 HydrophobicContact CB-CE2 4.17Å; R494-F530 HydrophobicContact CG-CD2 4.22Å; R494-F530 HydrophobicContact CG-CE2 3.6Å; R494-F530 HydrophobicContact CG-CZ 4.42Å
495	S	96.4	Very high	94.8	Very high	0 Å²	0	57.8 Å²	57.8	0%	0	25%	0.25	C	S	.	.	H	α-helix	trans	-68	-38.3	178.2	61.7	0	0	0	0	113.3	I491 H492 R493 Q498 K499 W531 N538	I491-S495 VanDerWaalsContact O-CB 3.27Å; I491-S495 WeakPolarHBondContact O-CB 3.34Å; I491-S495 PolarHBondContact O-N 2.86Å; I491-S495 VanDerWaalsContact O-N 3.07Å; I491-S495 PolarHBondContact O-OG 3.25Å; H492-S495 PolarHBondContact O-OG 3.3Å; H492-S495 VanDerWaalsContact O-OG 3.09Å; R493-S495 PolarHBondContact O-N 2.9Å; S495-Q498 PolarHBondContact O-N 3.44Å; S495-K499 WeakPolarHBondContact O-CB 3.42Å; S495-K499 PolarHBondContact O-N 2.73Å; S495-W531 PolarHBondContact O-NE1 3.31Å; S495-N538 VanDerWaalsContact OG-CA 3.29Å; S495-N538 WeakPolarHBondContact OG-CA 3.24Å; S495-N538 WeakPolarHBondContact OG-CB 3.39Å; S495-N538 PolarHBondContact OG-N 3.02Å
496	N	95.2	Very high	94.3	Very high	29 Å²	29	59.6 Å²	59.6	16%	0.155	26%	0.261	C	S	.	.	H	α-helix	trans	-65.8	-41.5	173.8	-83.6	-46.3	0	0	0	112.3	H492 R493 Q498 K499 D500	H492-N496 PolarHBondContact CD2-ND2 3.38Å; H492-N496 PolarHBondContact CE1-ND2 3.47Å; H492-N496 VanDerWaalsContact CE1-ND2 3.3Å; H492-N496 PolarHBondContact NE2-ND2 3.33Å; H492-N496 WeakPolarHBondContact O-CB 3.14Å; H492-N496 PolarHBondContact O-N 3.37Å; H492-N496 VanDerWaalsContact O-N 3.11Å; H492-N496 PolarHBondContact O-ND2 3.22Å; R493-N496 PolarHBondContact O-N 2.84Å; N496-Q498 VanDerWaalsContact C-N 3.34Å; N496-K499 PolarHBondContact O-N 3.4Å; N496-D500 WeakPolarHBondContact O-CB 3.43Å; N496-D500 PolarHBondContact O-N 3.5Å
497	N	94.1	Very high	93.8	Very high	49 Å²	49	61.4 Å²	61.4	26%	0.262	27%	0.268	S	S	.	.	H	α-helix	trans	-65.7	-38	176.9	-72.5	-5.4	0	0	0	111.5	R493 R494 D500 R501	R493-N497 WeakPolarHBondContact CD-ND2 3.08Å; R493-N497 WeakPolarHBondContact CD-OD1 3.32Å; R493-N497 PolarHBondContact NH1-OD1 3.44Å; R493-N497 WeakPolarHBondContact O-CB 3.35Å; R493-N497 VanDerWaalsContact O-CG 3.26Å; R493-N497 PolarHBondContact O-N 2.82Å; R494-N497 PolarHBondContact O-N 3.03Å; N497-D500 PolarHBondContact O-N 3.43Å; N497-R501 WeakPolarHBondContact O-CB 3.32Å; N497-R501 PolarHBondContact O-N 3.21Å
498	Q	94.1	Very high	93.4	Very high	30 Å²	30	59 Å²	59	14%	0.14	26%	0.255	C	S	.	.	H	α-helix	trans	-60.2	-46.5	172.9	-168.7	-175.8	6.1	0	0	110.8	R494 S495 N496 F502 F511 L526 S528	R494-Q498 PolarHBondContact O-N 3.24Å; S495-Q498 PolarHBondContact O-N 3.44Å; N496-Q498 VanDerWaalsContact C-N 3.34Å; Q498-F502 WeakPolarHBondContact O-CB 3.34Å; Q498-F502 PolarHBondContact O-N 3.08Å; Q498-F511 HydrophobicContact CG-CE1 3.84Å; Q498-F511 HydrophobicContact CG-CZ 4.14Å; Q498-L526 HydrophobicContact CG-CD2 3.82Å; Q498-S528 PolarHBondContact NE2-O 3.15Å
499	K	92.2	Very high	93	Very high	45 Å²	45	64.3 Å²	64.3	20%	0.196	29%	0.29	C	S	.	.	H	α-helix	trans	-64.7	-42	177.7	173	172.7	169.9	178.3	0	113.2	S495 N496 R503 W531	S495-K499 WeakPolarHBondContact O-CB 3.42Å; S495-K499 PolarHBondContact O-N 2.73Å; N496-K499 PolarHBondContact O-N 3.4Å; K499-R503 WeakPolarHBondContact O-CB 3.39Å; K499-R503 VanDerWaalsContact O-CG 3.24Å; K499-R503 WeakPolarHBondContact O-CG 3.32Å; K499-R503 PolarHBondContact O-N 3.02Å; K499-R503 VanDerWaalsContact O-N 3.11Å; K499-W531 HydrophobicContact CB-CZ2 3.77Å; K499-W531 HydrophobicContact CD-CH2 3.61Å; K499-W531 HydrophobicContact CD-CZ2 3.42Å; K499-W531 VanDerWaalsContact CD-CZ2 3.42Å; K499-W531 HydrophobicContact CG-CZ2 4.19Å
500	D	90.3	Very high	92.6	Very high	23 Å²	23	66.6 Å²	66.6	12%	0.123	31%	0.308	C	S	.	.	H	α-helix	trans	-65.8	-46.5	178.2	179.5	62.9	0	0	0	111.2	N496 N497 F502 R503 R504	N496-D500 WeakPolarHBondContact O-CB 3.43Å; N496-D500 PolarHBondContact O-N 3.5Å; N497-D500 PolarHBondContact O-N 3.43Å; D500-F502 PolarHBondContact O-N 3.47Å; D500-R503 PolarHBondContact O-N 2.84Å; D500-R504 WeakPolarHBondContact O-CG 3.16Å; D500-R504 PolarHBondContact O-N 2.93Å; D500-R504 VanDerWaalsContact O-N 3.09Å; D500-R504 IonicContact OD1-CZ 3.49Å; D500-R504 IonicContact OD1-NE 2.73Å; D500-R504 PolarHBondContact OD1-NE 3.22Å; D500-R504 IonicContact OD1-NH2 2.6Å; D500-R504 PolarHBondContact OD1-NH2 2.89Å; D500-R504 IonicContact OD2-CZ 3.49Å; D500-R504 IonicContact OD2-NE 3.29Å; D500-R504 PolarHBondContact OD2-NE 2.95Å; D500-R504 IonicContact OD2-NH1 2.71Å; D500-R504 IonicContact OD2-NH2 3.04Å; D500-R504 PolarHBondContact OD2-NH2 3.3Å
501	R	92	Very high	92.2	Very high	124 Å²	124	60.3 Å²	60.3	47%	0.468	28%	0.284	S	S	.	.	H	α-helix	trans	-59.2	-48.2	176.1	-171.1	-176.3	-74.7	-116.5	3.6	111.7	N497 R503 R504 D505 D508 S510 F511	N497-R501 WeakPolarHBondContact O-CB 3.32Å; N497-R501 PolarHBondContact O-N 3.21Å; R501-R503 VanDerWaalsContact C-N 3.27Å; R501-R503 PolarHBondContact O-N 3.34Å; R501-R504 PolarHBondContact O-N 3.38Å; R501-R504 VanDerWaalsContact O-N 3.13Å; R501-D505 PolarHBondContact O-N 3.45Å; R501-D508 WeakPolarHBondContact CD-OD2 3.43Å; R501-D508 HydrophobicContact CG-CB 4.47Å; R501-D508 IonicContact CZ-OD2 3.84Å; R501-D508 IonicContact NH1-OD1 3.92Å; R501-D508 IonicContact NH1-OD2 3.57Å; R501-D508 PolarHBondContact NH1-OD2 2.97Å; R501-D508 VanDerWaalsContact NH1-OD2 3.11Å; R501-S510 WeakPolarHBondContact CD-OG 3.48Å; R501-F511 HydrophobicContact CB-CE2 4.18Å; R501-F511 HydrophobicContact CB-CZ 4.29Å; R501-F511 HydrophobicContact CG-CE2 3.91Å; R501-F511 HydrophobicContact CG-CZ 4.4Å
502	F	92.5	Very high	91.6	Very high	13 Å²	13	62.9 Å²	62.9	6%	0.057	31%	0.309	C	S	.	.	H	α-helix	trans	-61	-34	178.9	-175.1	-105.7	0	0	0	113.2	Q498 D500 D505 P506 F511 I516 R524 L526	Q498-F502 WeakPolarHBondContact O-CB 3.34Å; Q498-F502 PolarHBondContact O-N 3.08Å; D500-F502 PolarHBondContact O-N 3.47Å; F502-D505 CarbonylContact O-C 3.44Å; F502-P506 HydrophobicContact CD2-CB 4.4Å; F502-P506 HydrophobicContact CE2-CB 4.03Å; F502-P506 HydrophobicContact CZ-CB 4.33Å; F502-P506 WeakPolarHBondContact O-CD 3.24Å; F502-P506 WeakPolarHBondContact O-CG 3.48Å; F502-F511 HydrophobicContact CB-CD2 4.49Å; F502-F511 HydrophobicContact CB-CE1 4.35Å; F502-F511 HydrophobicContact CB-CE2 3.77Å; F502-F511 HydrophobicContact CB-CZ 3.7Å; F502-F511 HydrophobicContact CD2-CD1 4.24Å; F502-F511 AromaticContact CD2-CD2 3.91Å; F502-F511 HydrophobicContact CD2-CD2 3.91Å; F502-F511 HydrophobicContact CD2-CE1 4.35Å; F502-F511 HydrophobicContact CD2-CE2 4.03Å; F502-F511 HydrophobicContact CD2-CG 4.03Å; F502-F511 HydrophobicContact CD2-CZ 4.26Å; F502-F511 HydrophobicContact CG-CE2 4.44Å; F502-F511 HydrophobicContact CG-CZ 4.48Å; F502-I516 HydrophobicContact CE2-CD1 3.71Å; F502-I516 HydrophobicContact CE2-CG1 3.93Å; F502-I516 HydrophobicContact CZ-CD1 4.21Å; F502-I516 HydrophobicContact CZ-CG1 4.12Å; F502-I516 HydrophobicContact CZ-CG2 4.06Å; F502-R524 HydrophobicContact CE1-CB 4.08Å; F502-R524 HydrophobicContact CZ-CB 3.74Å; F502-L526 HydrophobicContact CB-CD2 4.39Å; F502-L526 HydrophobicContact CD1-CB 4.05Å; F502-L526 HydrophobicContact CD2-CB 4.37Å; F502-L526 HydrophobicContact CD2-CD1 4.01Å; F502-L526 HydrophobicContact CD2-CD2 4.43Å; F502-L526 HydrophobicContact CE1-CB 3.96Å; F502-L526 HydrophobicContact CE2-CB 4.29Å; F502-L526 HydrophobicContact CE2-CD1 3.95Å; F502-L526 HydrophobicContact CG-CB 4.25Å; F502-L526 HydrophobicContact CG-CD2 4.29Å; F502-L526 HydrophobicContact CZ-CB 4.06Å; F502-L526 HydrophobicContact CZ-CD1 4.48Å
503	R	88.1	Confident	91.1	Very high	131 Å²	131	69.7 Å²	69.7	49%	0.494	35%	0.346	S	S	.	.	H	α-helix	trans	-74.3	-31	177	-76.7	171.2	172.1	-165.3	-9.8	113.3	F423 K499 D500 R501	F423-R503 PolarHBondContact O-NH1 3.41Å; K499-R503 WeakPolarHBondContact O-CB 3.39Å; K499-R503 VanDerWaalsContact O-CG 3.24Å; K499-R503 WeakPolarHBondContact O-CG 3.32Å; K499-R503 PolarHBondContact O-N 3.02Å; K499-R503 VanDerWaalsContact O-N 3.11Å; D500-R503 PolarHBondContact O-N 2.84Å; R501-R503 VanDerWaalsContact C-N 3.27Å; R501-R503 PolarHBondContact O-N 3.34Å
504	R	86.8	Confident	90.7	Very high	132 Å²	132	69 Å²	69	50%	0.498	35%	0.348	S	S	.	.	H	α-helix	trans	-75.1	-48	176.7	-70.7	-179.1	-169.4	175.3	8.8	110.9	H419 D500 R501	H419-R504 PolarHBondContact CD2-NH2 3.41Å; H419-R504 PolarHBondContact NE2-NH2 3.39Å; D500-R504 WeakPolarHBondContact O-CG 3.16Å; D500-R504 PolarHBondContact O-N 2.93Å; D500-R504 VanDerWaalsContact O-N 3.09Å; D500-R504 IonicContact OD1-CZ 3.49Å; D500-R504 IonicContact OD1-NE 2.73Å; D500-R504 PolarHBondContact OD1-NE 3.22Å; D500-R504 IonicContact OD1-NH2 2.6Å; D500-R504 PolarHBondContact OD1-NH2 2.89Å; D500-R504 IonicContact OD2-CZ 3.49Å; D500-R504 IonicContact OD2-NE 3.29Å; D500-R504 PolarHBondContact OD2-NE 2.95Å; D500-R504 IonicContact OD2-NH1 2.71Å; D500-R504 IonicContact OD2-NH2 3.04Å; D500-R504 PolarHBondContact OD2-NH2 3.3Å; R501-R504 PolarHBondContact O-N 3.38Å; R501-R504 VanDerWaalsContact O-N 3.13Å
505	D	89.8	Confident	90.3	Very high	70 Å²	70	67.2 Å²	67.2	37%	0.374	35%	0.346	S	S	.	.			trans	-144.1	102.6	177.2	-174.4	8.1	0	0	0	110.9	R501 F502 H507 D508	R501-D505 PolarHBondContact O-N 3.45Å; F502-D505 CarbonylContact O-C 3.44Å; D505-H507 PolarHBondContact O-N 3.4Å; D505-H507 WeakPolarHBondContact OD1-CA 3.39Å; D505-H507 PolarHBondContact OD1-N 3.42Å; D505-H507 IonicContact OD1-ND1 3.84Å; D505-D508 HydrophobicContact CB-CB 4.28Å; D505-D508 WeakPolarHBondContact O-CB 3.47Å; D505-D508 PolarHBondContact O-N 3.34Å; D505-D508 PolarHBondContact OD2-N 3.44Å
506	P	88.8	Confident	90.1	Very high	37 Å²	37	69.4 Å²	69.4	24%	0.24	36%	0.357	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66.7	-11.5	173.4	-19.2	30.5	0	0	0	114.4	F502	F502-P506 HydrophobicContact CD2-CB 4.4Å; F502-P506 HydrophobicContact CE2-CB 4.03Å; F502-P506 HydrophobicContact CZ-CB 4.33Å; F502-P506 WeakPolarHBondContact O-CD 3.24Å; F502-P506 WeakPolarHBondContact O-CG 3.48Å
507	H	88.3	Confident	89.8	Confident	126 Å²	126	68.2 Å²	68.2	58%	0.583	35%	0.351	S	S	*	.	T	Hydrogen-bonded Turn	trans	-106.3	10.1	179.4	-52.9	78.6	0	0	0	112.2	D505 R524	D505-H507 PolarHBondContact O-N 3.4Å; D505-H507 WeakPolarHBondContact OD1-CA 3.39Å; D505-H507 PolarHBondContact OD1-N 3.42Å; D505-H507 IonicContact OD1-ND1 3.84Å; H507-R524 VanDerWaalsContact CE1-CZ 3.42Å; H507-R524 PolarHBondContact CE1-NH1 2.95Å; H507-R524 PolarHBondContact CE1-NH2 3.47Å; H507-R524 VanDerWaalsContact NE2-CZ 3.33Å; H507-R524 PolarHBondContact NE2-NH1 3.03Å; H507-R524 PolarHBondContact NE2-NH2 2.86Å
508	D	89.4	Confident	89.5	Confident	29 Å²	29	70.6 Å²	70.6	16%	0.155	37%	0.367	C	S	.	.			trans	-53.6	136.9	173.7	178.6	-64	0	0	0	109	R501 D505 S510 F511	R501-D508 WeakPolarHBondContact CD-OD2 3.43Å; R501-D508 HydrophobicContact CG-CB 4.47Å; R501-D508 IonicContact CZ-OD2 3.84Å; R501-D508 IonicContact NH1-OD1 3.92Å; R501-D508 IonicContact NH1-OD2 3.57Å; R501-D508 PolarHBondContact NH1-OD2 2.97Å; R501-D508 VanDerWaalsContact NH1-OD2 3.11Å; D505-D508 HydrophobicContact CB-CB 4.28Å; D505-D508 WeakPolarHBondContact O-CB 3.47Å; D505-D508 PolarHBondContact O-N 3.34Å; D505-D508 PolarHBondContact OD2-N 3.44Å; D508-S510 PolarHBondContact O-N 3.2Å; D508-S510 WeakPolarHBondContact OD1-CB 3.41Å; D508-S510 PolarHBondContact OD1-N 3.5Å; D508-S510 PolarHBondContact OD1-OG 2.96Å; D508-F511 HydrophobicContact CB-CD2 4.03Å; D508-F511 HydrophobicContact CB-CE2 4.37Å; D508-F511 PolarHBondContact O-N 3.03Å
509	P	90	Very high	89	Confident	111 Å²	111	69.7 Å²	69.7	72%	0.721	37%	0.366	S	S	*	.	G	3₁₀ helix	trans	-52	-26.2	-177.9	-29.3	34.9	0	0	0	114.6	F511 A512	P509-F511 PolarHBondContact O-N 3.19Å; P509-A512 WeakPolarHBondContact O-CB 3.43Å; P509-A512 PolarHBondContact O-N 2.89Å; P509-A512 VanDerWaalsContact O-N 3.16Å
510	S	89.2	Confident	88.2	Confident	73 Å²	73	71.5 Å²	71.5	51%	0.51	38%	0.383	S	S	.	.	G	3₁₀ helix	trans	-63.4	-16.9	174.4	62.2	0	0	0	0	114.4	R501 D508	R501-S510 WeakPolarHBondContact CD-OG 3.48Å; D508-S510 PolarHBondContact O-N 3.2Å; D508-S510 WeakPolarHBondContact OD1-CB 3.41Å; D508-S510 PolarHBondContact OD1-N 3.5Å; D508-S510 PolarHBondContact OD1-OG 2.96Å
511	F	91	Very high	87.3	Confident	14 Å²	14	74 Å²	74	6%	0.061	41%	0.413	C	S	.	.	G	3₁₀ helix	trans	-110.6	12.2	176.6	-55.2	-63.5	0	0	0	113.2	Q498 R501 F502 D508 P509 N513 A514 L526	Q498-F511 HydrophobicContact CG-CE1 3.84Å; Q498-F511 HydrophobicContact CG-CZ 4.14Å; R501-F511 HydrophobicContact CB-CE2 4.18Å; R501-F511 HydrophobicContact CB-CZ 4.29Å; R501-F511 HydrophobicContact CG-CE2 3.91Å; R501-F511 HydrophobicContact CG-CZ 4.4Å; F502-F511 HydrophobicContact CB-CD2 4.49Å; F502-F511 HydrophobicContact CB-CE1 4.35Å; F502-F511 HydrophobicContact CB-CE2 3.77Å; F502-F511 HydrophobicContact CB-CZ 3.7Å; F502-F511 HydrophobicContact CD2-CD1 4.24Å; F502-F511 AromaticContact CD2-CD2 3.91Å; F502-F511 HydrophobicContact CD2-CD2 3.91Å; F502-F511 HydrophobicContact CD2-CE1 4.35Å; F502-F511 HydrophobicContact CD2-CE2 4.03Å; F502-F511 HydrophobicContact CD2-CG 4.03Å; F502-F511 HydrophobicContact CD2-CZ 4.26Å; F502-F511 HydrophobicContact CG-CE2 4.44Å; F502-F511 HydrophobicContact CG-CZ 4.48Å; D508-F511 HydrophobicContact CB-CD2 4.03Å; D508-F511 HydrophobicContact CB-CE2 4.37Å; D508-F511 PolarHBondContact O-N 3.03Å; P509-F511 PolarHBondContact O-N 3.19Å; F511-N513 VanDerWaalsContact C-N 3.25Å; F511-N513 PolarHBondContact O-N 2.86Å; F511-A514 HydrophobicContact CB-CB 3.85Å; F511-A514 HydrophobicContact CD1-CB 4.14Å; F511-A514 HydrophobicContact CG-CB 4.5Å; F511-A514 VanDerWaalsContact O-CB 3.28Å; F511-A514 WeakPolarHBondContact O-CB 3.44Å; F511-A514 PolarHBondContact O-N 3.35Å; F511-L526 HydrophobicContact CD1-CD1 3.91Å; F511-L526 HydrophobicContact CD1-CD2 4.41Å; F511-L526 HydrophobicContact CE1-CD1 4.21Å; F511-L526 HydrophobicContact CE1-CD2 3.87Å
512	A	85.4	Confident	86.2	Confident	78 Å²	78	72.4 Å²	72.4	65%	0.645	43%	0.427	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.4	-38.2	-178	0	0	0	0	0	113.1	P509	P509-A512 WeakPolarHBondContact O-CB 3.43Å; P509-A512 PolarHBondContact O-N 2.89Å; P509-A512 VanDerWaalsContact O-N 3.16Å
513	N	86.6	Confident	85.7	Confident	172 Å²	172	74.7 Å²	74.7	92%	0.92	44%	0.438	S	S	*	.	T	Hydrogen-bonded Turn	trans	-102.8	12.6	177.7	-61	-25.9	0	0	0	112.8	F511	F511-N513 VanDerWaalsContact C-N 3.25Å; F511-N513 PolarHBondContact O-N 2.86Å
514	A	87.4	Confident	85.7	Confident	21 Å²	21	72.3 Å²	72.3	17%	0.174	43%	0.429	C	S	.	.			trans	-80	133.3	-177.2	0	0	0	0	0	111.3	F511 I516 L526 S528	F511-A514 HydrophobicContact CB-CB 3.85Å; F511-A514 HydrophobicContact CD1-CB 4.14Å; F511-A514 HydrophobicContact CG-CB 4.5Å; F511-A514 VanDerWaalsContact O-CB 3.28Å; F511-A514 WeakPolarHBondContact O-CB 3.44Å; F511-A514 PolarHBondContact O-N 3.35Å; A514-I516 HydrophobicContact CB-CG1 4.47Å; A514-I516 PolarHBondContact O-N 3.34Å; A514-L526 HydrophobicContact CB-CD1 3.94Å; A514-S528 WeakPolarHBondContact CB-OG 3.35Å
515	E	89.1	Confident	86	Confident	104 Å²	104	67.1 Å²	67.1	49%	0.486	41%	0.411	S	S	.	.			trans	-68.9	129.2	167.3	-171.2	178	178.7	0	0	110.5	V527	E515-V527 HydrophobicContact CB-CB 4.15Å; E515-V527 HydrophobicContact CG-CB 4.08Å; E515-V527 HydrophobicContact CG-CG2 4.2Å; E515-V527 PolarHBondContact O-N 3.4Å
516	I	91.3	Very high	86.2	Confident	46 Å²	46	64.4 Å²	64.4	24%	0.236	40%	0.396	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.6	129.8	-176.1	-63.5	165.8	0	0	0	109.1	F502 A514 R524 L525 L526	F502-I516 HydrophobicContact CE2-CD1 3.71Å; F502-I516 HydrophobicContact CE2-CG1 3.93Å; F502-I516 HydrophobicContact CZ-CD1 4.21Å; F502-I516 HydrophobicContact CZ-CG1 4.12Å; F502-I516 HydrophobicContact CZ-CG2 4.06Å; A514-I516 HydrophobicContact CB-CG1 4.47Å; A514-I516 PolarHBondContact O-N 3.34Å; I516-R524 HydrophobicContact CG2-CB 3.7Å; I516-R524 HydrophobicContact CG2-CG 4.08Å; I516-L525 CarbonylContact C-O 3.24Å; I516-L525 WeakPolarHBondContact CA-O 3.45Å; I516-L526 HydrophobicContact CG1-CD1 4.35Å
517	V	90.4	Very high	86.4	Confident	5 Å²	5	63.2 Å²	63.2	3%	0.03	39%	0.388	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.1	122.2	167.3	177.3	0	0	0	0	109.2	R524 L525 V527 A589 K592 L596	V517-R524 CarbonylContact O-C 3.59Å; V517-R524 WeakPolarHBondContact O-CA 3.13Å; V517-L525 HydrophobicContact CB-CB 4.35Å; V517-L525 PolarHBondContact N-O 3.39Å; V517-L525 PolarHBondContact O-N 3.23Å; V517-V527 HydrophobicContact CB-CG2 4.47Å; V517-V527 HydrophobicContact CG2-CG2 3.7Å; V517-A589 HydrophobicContact CG1-CB 3.94Å; V517-K592 HydrophobicContact CG1-CB 4.23Å; V517-K592 HydrophobicContact CG1-CD 4.07Å; V517-K592 HydrophobicContact CG1-CG 4.26Å; V517-K592 HydrophobicContact CG2-CD 4.26Å; V517-K592 HydrophobicContact CG2-CG 4.1Å; V517-L596 HydrophobicContact CG2-CD1 3.8Å
518	V	87.6	Confident	86.5	Confident	98 Å²	98	58.6 Å²	58.6	59%	0.594	37%	0.37	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-90.2	129.6	174.5	-174.3	0	0	0	0	109.4
519	G	82.5	Confident	86.6	Confident	12 Å²	12	59.9 Å²	59.9	12%	0.124	39%	0.39	C	S	.	.			trans	-112	-178.3	174.2	0	0	0	0	0	113.3	Q523 A589	G519-Q523 PolarHBondContact N-O 3Å; G519-A589 VanDerWaalsContact CA-CB 3.45Å
520	P	76.5	Confident	86.8	Confident	83 Å²	83	57.1 Å²	57.1	54%	0.539	37%	0.367	S	S	.	.	S	Bend	trans	-61.5	141.5	178.8	22.9	-30.8	0	0	0	111.9
521	G	70.8	Confident	87	Confident	74 Å²	74	54.8 Å²	54.8	76%	0.763	35%	0.347	S	S	*	.	T	Hydrogen-bonded Turn	trans	71	43.1	172.6	0	0	0	0	0	115.4	Q523	G521-Q523 PolarHBondContact O-N 3.13Å; G521-Q523 VanDerWaalsContact O-N 3.13Å
522	A	69.9	Low	87.2	Confident	92 Å²	92	55.3 Å²	55.3	76%	0.76	36%	0.356	S	S	*	.	T	Hydrogen-bonded Turn	trans	63.3	11	179	0	0	0	0	0	115.6
523	Q	80.9	Confident	87.5	Confident	61 Å²	61	59.2 Å²	59.2	29%	0.285	36%	0.355	S	S	.	.			trans	-77.1	136.1	177.2	-61.4	-174	0.4	0	0	110.5	G519 G521 H586	G519-Q523 PolarHBondContact N-O 3Å; G521-Q523 PolarHBondContact O-N 3.13Å; G521-Q523 VanDerWaalsContact O-N 3.13Å; Q523-H586 PolarHBondContact OE1-CE1 3.46Å; Q523-H586 PolarHBondContact OE1-ND1 2.85Å
524	R	89.2	Confident	88	Confident	81 Å²	81	51.3 Å²	51.3	31%	0.306	31%	0.313	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	143.6	-177.7	-64.2	-178.1	-178.8	-170.9	4.7	110.2	F502 H507 I516 V517	F502-R524 HydrophobicContact CE1-CB 4.08Å; F502-R524 HydrophobicContact CZ-CB 3.74Å; H507-R524 VanDerWaalsContact CE1-CZ 3.42Å; H507-R524 PolarHBondContact CE1-NH1 2.95Å; H507-R524 PolarHBondContact CE1-NH2 3.47Å; H507-R524 VanDerWaalsContact NE2-CZ 3.33Å; H507-R524 PolarHBondContact NE2-NH1 3.03Å; H507-R524 PolarHBondContact NE2-NH2 2.86Å; I516-R524 HydrophobicContact CG2-CB 3.7Å; I516-R524 HydrophobicContact CG2-CG 4.08Å; V517-R524 CarbonylContact O-C 3.59Å; V517-R524 WeakPolarHBondContact O-CA 3.13Å
525	L	92.4	Very high	88.4	Confident	23 Å²	23	51.6 Å²	51.6	12%	0.12	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	129.4	175.9	-63.6	173.8	0	0	0	109	I516 V517 H586 W590 Y593	I516-L525 CarbonylContact C-O 3.24Å; I516-L525 WeakPolarHBondContact CA-O 3.45Å; V517-L525 HydrophobicContact CB-CB 4.35Å; V517-L525 PolarHBondContact N-O 3.39Å; V517-L525 PolarHBondContact O-N 3.23Å; L525-H586 HydrophobicContact CD1-CB 4.32Å; L525-W590 HydrophobicContact CD1-CE3 3.94Å; L525-Y593 HydrophobicContact CB-CD2 4.33Å; L525-Y593 HydrophobicContact CB-CG 4.49Å; L525-Y593 HydrophobicContact CD1-CG 4.24Å
526	L	92.7	Very high	88.7	Confident	13 Å²	13	46.9 Å²	46.9	7%	0.068	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.3	124.8	-177.5	-176.4	65.9	0	0	0	110.4	Q498 F502 F511 A514 I516 S528 Y593	Q498-L526 HydrophobicContact CG-CD2 3.82Å; F502-L526 HydrophobicContact CB-CD2 4.39Å; F502-L526 HydrophobicContact CD1-CB 4.05Å; F502-L526 HydrophobicContact CD2-CB 4.37Å; F502-L526 HydrophobicContact CD2-CD1 4.01Å; F502-L526 HydrophobicContact CD2-CD2 4.43Å; F502-L526 HydrophobicContact CE1-CB 3.96Å; F502-L526 HydrophobicContact CE2-CB 4.29Å; F502-L526 HydrophobicContact CE2-CD1 3.95Å; F502-L526 HydrophobicContact CG-CB 4.25Å; F502-L526 HydrophobicContact CG-CD2 4.29Å; F502-L526 HydrophobicContact CZ-CB 4.06Å; F502-L526 HydrophobicContact CZ-CD1 4.48Å; F511-L526 HydrophobicContact CD1-CD1 3.91Å; F511-L526 HydrophobicContact CD1-CD2 4.41Å; F511-L526 HydrophobicContact CE1-CD1 4.21Å; F511-L526 HydrophobicContact CE1-CD2 3.87Å; A514-L526 HydrophobicContact CB-CD1 3.94Å; I516-L526 HydrophobicContact CG1-CD1 4.35Å; L526-S528 VanDerWaalsContact CD1-OG 3.28Å; L526-S528 WeakPolarHBondContact CD1-OG 3.26Å; L526-Y593 VanDerWaalsContact O-CE2 3.26Å; L526-Y593 WeakPolarHBondContact O-CE2 3.43Å
527	V	93.3	Very high	89	Confident	12 Å²	12	44.8 Å²	44.8	7%	0.073	28%	0.277	C	S	.	.			trans	-110.6	13.6	-179.8	-152.6	0	0	0	0	112.2	E515 V517 G532 Y593 L596 V597	E515-V527 HydrophobicContact CB-CB 4.15Å; E515-V527 HydrophobicContact CG-CB 4.08Å; E515-V527 HydrophobicContact CG-CG2 4.2Å; E515-V527 PolarHBondContact O-N 3.4Å; V517-V527 HydrophobicContact CB-CG2 4.47Å; V517-V527 HydrophobicContact CG2-CG2 3.7Å; V527-G532 VanDerWaalsContact C-CA 3.48Å; V527-G532 WeakPolarHBondContact O-CA 3.46Å; V527-Y593 HydrophobicContact CG1-CD2 4.41Å; V527-Y593 HydrophobicContact CG1-CE2 4.43Å; V527-Y593 HydrophobicContact CG2-CD2 4.09Å; V527-Y593 HydrophobicContact CG2-CE2 4.48Å; V527-L596 HydrophobicContact CG1-CB 3.75Å; V527-L596 HydrophobicContact CG1-CD1 3.99Å; V527-L596 HydrophobicContact CG2-CD1 4.25Å; V527-V597 HydrophobicContact CG1-CG2 3.59Å
528	S	91.2	Very high	89.3	Confident	28 Å²	28	45 Å²	45	20%	0.196	28%	0.278	C	S	.	.	S	Bend	trans	-123.2	163.7	-175.8	63.4	0	0	0	0	112.9	Q498 A514 L526	Q498-S528 PolarHBondContact NE2-O 3.15Å; A514-S528 WeakPolarHBondContact CB-OG 3.35Å; L526-S528 VanDerWaalsContact CD1-OG 3.28Å; L526-S528 WeakPolarHBondContact CD1-OG 3.26Å
529	G	91.3	Very high	89.7	Confident	56 Å²	56	42 Å²	42	58%	0.577	26%	0.256	S	S	*	.	T	Hydrogen-bonded Turn	trans	61.5	-140.3	-172.6	0	0	0	0	0	111.5	W531 G532 Y533	G529-W531 PolarHBondContact O-N 3.26Å; G529-G532 PolarHBondContact O-N 2.88Å; G529-G532 VanDerWaalsContact O-N 3.08Å; G529-Y533 PolarHBondContact O-N 2.87Å
530	F	93.4	Very high	90.4	Very high	53 Å²	53	42.8 Å²	42.8	23%	0.232	26%	0.259	C	S	.	.	H	α-helix	trans	-59	-33.9	-178.4	-78.1	-83.5	0	0	0	113.5	W490 I491 R494 G532 Y533 V534 P537	W490-F530 HydrophobicContact CH2-CE2 4.49Å; W490-F530 AromaticContact CH2-CZ 3.74Å; W490-F530 HydrophobicContact CH2-CZ 3.74Å; W490-F530 HydrophobicContact CZ2-CZ 4.42Å; W490-F530 HydrophobicContact CZ3-CE1 4.42Å; W490-F530 AromaticContact CZ3-CZ 3.8Å; W490-F530 HydrophobicContact CZ3-CZ 3.8Å; I491-F530 HydrophobicContact CG1-CE1 4.26Å; I491-F530 HydrophobicContact CG2-CD1 4.31Å; I491-F530 HydrophobicContact CG2-CE1 4.08Å; R494-F530 HydrophobicContact CB-CE2 4.17Å; R494-F530 HydrophobicContact CG-CD2 4.22Å; R494-F530 HydrophobicContact CG-CE2 3.6Å; R494-F530 HydrophobicContact CG-CZ 4.42Å; F530-G532 VanDerWaalsContact C-N 3.28Å; F530-G532 PolarHBondContact O-N 3.39Å; F530-Y533 PolarHBondContact O-N 3.21Å; F530-V534 PolarHBondContact O-N 3.46Å; F530-P537 HydrophobicContact CB-CB 3.7Å; F530-P537 HydrophobicContact CB-CG 3.75Å; F530-P537 HydrophobicContact CD1-CB 4.16Å; F530-P537 HydrophobicContact CG-CB 4.34Å
531	W	95.1	Very high	91.5	Very high	25 Å²	25	38.9 Å²	38.9	10%	0.095	23%	0.233	C	C	.	.	H	α-helix	trans	-79	-9.6	-178.9	-63.5	90.3	0	0	0	113.8	S495 K499 G529 R535 P537 N538 Y593	S495-W531 PolarHBondContact O-NE1 3.31Å; K499-W531 HydrophobicContact CB-CZ2 3.77Å; K499-W531 HydrophobicContact CD-CH2 3.61Å; K499-W531 HydrophobicContact CD-CZ2 3.42Å; K499-W531 VanDerWaalsContact CD-CZ2 3.42Å; K499-W531 HydrophobicContact CG-CZ2 4.19Å; G529-W531 PolarHBondContact O-N 3.26Å; W531-R535 VanDerWaalsContact CE3-O 3.31Å; W531-R535 WeakPolarHBondContact CZ3-O 3.45Å; W531-P537 HydrophobicContact CD2-CG 3.9Å; W531-P537 HydrophobicContact CE3-CG 4.26Å; W531-P537 HydrophobicContact CG-CG 4.22Å; W531-P537 HydrophobicContact CH2-CG 4.45Å; W531-P537 HydrophobicContact CZ2-CG 4.13Å; W531-N538 WeakPolarHBondContact CH2-OD1 3.25Å; W531-Y593 PolarHBondContact O-OH 3.46Å
532	G	93.4	Very high	92.7	Very high	24 Å²	24	37.5 Å²	37.5	25%	0.247	21%	0.205	C	C	.	.	H	α-helix	trans	-90.2	-24.8	169.6	0	0	0	0	0	113.6	V527 G529 F530	V527-G532 VanDerWaalsContact C-CA 3.48Å; V527-G532 WeakPolarHBondContact O-CA 3.46Å; G529-G532 PolarHBondContact O-N 2.88Å; G529-G532 VanDerWaalsContact O-N 3.08Å; F530-G532 VanDerWaalsContact C-N 3.28Å; F530-G532 PolarHBondContact O-N 3.39Å
533	Y	93.3	Very high	94	Very high	160 Å²	160	34.6 Å²	34.6	63%	0.627	18%	0.177	S	C	*	.	H	α-helix	trans	-80.5	-45.2	179.2	-170.6	-111.4	0	0	0	112	G529 F530 P603	G529-Y533 PolarHBondContact O-N 2.87Å; F530-Y533 PolarHBondContact O-N 3.21Å; Y533-P603 HydrophobicContact CD1-CG 4.32Å; Y533-P603 HydrophobicContact CE1-CG 3.56Å; Y533-P603 HydrophobicContact CE2-CG 4.15Å; Y533-P603 VanDerWaalsContact CZ-CG 3.48Å
534	V	96.3	Very high	94.8	Very high	6 Å²	6	33.7 Å²	33.7	4%	0.036	17%	0.173	C	C	.	.			trans	-143.5	153.3	178.6	-67.7	0	0	0	0	109.6	F530 H536 P537 V540 Y599 F601 P603	F530-V534 PolarHBondContact O-N 3.46Å; V534-H536 VanDerWaalsContact C-N 3.34Å; V534-H536 PolarHBondContact O-N 3.29Å; V534-P537 HydrophobicContact CG2-CB 3.82Å; V534-P537 WeakPolarHBondContact O-CD 3.31Å; V534-V540 HydrophobicContact CG2-CG2 4.41Å; V534-Y599 WeakPolarHBondContact CA-O 3.43Å; V534-F601 WeakPolarHBondContact CG1-O 2.97Å; V534-P603 HydrophobicContact CG1-CG 4.3Å
535	R	95.9	Very high	95.3	Very high	27 Å²	27	29.9 Å²	29.9	10%	0.102	16%	0.159	C	C	.	.	S	Bend	trans	-72.8	-23.8	-176.6	-66.1	-176.7	-85.1	169	-8.6	114	W531 E579 Y593 V597 P598 Y599 R600	W531-R535 VanDerWaalsContact CE3-O 3.31Å; W531-R535 WeakPolarHBondContact CZ3-O 3.45Å; R535-E579 IonicContact CZ-OE1 3.56Å; R535-E579 IonicContact CZ-OE2 3.78Å; R535-E579 IonicContact NE-OE1 2.84Å; R535-E579 VanDerWaalsContact NH1-CD 3.25Å; R535-E579 IonicContact NH1-OE1 2.72Å; R535-E579 PolarHBondContact NH1-OE1 3.2Å; R535-E579 IonicContact NH1-OE2 2.98Å; R535-E579 PolarHBondContact NH1-OE2 3.17Å; R535-Y593 HydrophobicContact CB-CE1 4.29Å; R535-Y593 HydrophobicContact CG-CE1 3.79Å; R535-V597 WeakPolarHBondContact CD-O 3.35Å; R535-V597 HydrophobicContact CG-CB 3.99Å; R535-V597 HydrophobicContact CG-CG1 3.72Å; R535-V597 WeakPolarHBondContact CG-O 3.28Å; R535-V597 PolarHBondContact NE-O 2.86Å; R535-P598 PolarHBondContact NE-O 3.39Å; R535-P598 PolarHBondContact NH2-O 2.71Å; R535-Y599 WeakPolarHBondContact CG-O 3.4Å; R535-Y599 PolarHBondContact N-O 3.19Å; R535-R600 PolarHBondContact N-O 3.32Å; R535-R600 VanDerWaalsContact NH2-CG 3.32Å
536	H	96.2	Very high	95.4	Very high	6 Å²	6	29 Å²	29	3%	0.028	16%	0.155	C	C	.	.			trans	-136.2	64	-178.4	-53.3	-88.8	0	0	0	112.8	V534 N538 Y539 V540 E579 R600 F601	V534-H536 VanDerWaalsContact C-N 3.34Å; V534-H536 PolarHBondContact O-N 3.29Å; H536-N538 PolarHBondContact O-N 2.86Å; H536-Y539 HydrophobicContact CB-CD2 3.45Å; H536-Y539 VanDerWaalsContact CB-CD2 3.45Å; H536-Y539 HydrophobicContact CB-CE2 4.15Å; H536-Y539 HydrophobicContact CB-CG 3.95Å; H536-Y539 AromaticContact CG-CD2 3.71Å; H536-Y539 AromaticContact CG-CE2 3.99Å; H536-Y539 AromaticContact ND1-CD2 3.76Å; H536-Y539 AromaticContact ND1-CE2 3.53Å; H536-Y539 WeakPolarHBondContact O-CB 3.3Å; H536-Y539 PolarHBondContact O-N 2.77Å; H536-V540 PolarHBondContact O-N 2.9Å; H536-E579 IonicContact CD2-OE1 3.33Å; H536-E579 IonicContact CE1-OE1 3.76Å; H536-E579 WeakPolarHBondContact NE2-CG 3.47Å; H536-E579 IonicContact NE2-OE1 3.29Å; H536-E579 PolarHBondContact NE2-OE1 3.4Å; H536-R600 PolarHBondContact N-O 3.03Å; H536-R600 VanDerWaalsContact N-O 3.07Å; H536-F601 HydrophobicContact CB-CD1 4.06Å; H536-F601 HydrophobicContact CB-CE1 3.77Å
537	P	97	Very high	95.6	Very high	2 Å²	2	30.7 Å²	30.7	1%	0.013	17%	0.166	C	C	.	.	H	α-helix	trans	-62.2	-31.9	-178	26.4	-36	0	0	0	112.9	I491 F530 W531 V534 Y539 V540 G541	I491-P537 WeakPolarHBondContact CG2-O 3.28Å; F530-P537 HydrophobicContact CB-CB 3.7Å; F530-P537 HydrophobicContact CB-CG 3.75Å; F530-P537 HydrophobicContact CD1-CB 4.16Å; F530-P537 HydrophobicContact CG-CB 4.34Å; W531-P537 HydrophobicContact CD2-CG 3.9Å; W531-P537 HydrophobicContact CE3-CG 4.26Å; W531-P537 HydrophobicContact CG-CG 4.22Å; W531-P537 HydrophobicContact CH2-CG 4.45Å; W531-P537 HydrophobicContact CZ2-CG 4.13Å; V534-P537 HydrophobicContact CG2-CB 3.82Å; V534-P537 WeakPolarHBondContact O-CD 3.31Å; P537-Y539 VanDerWaalsContact C-N 3.26Å; P537-Y539 PolarHBondContact O-N 3.42Å; P537-V540 WeakPolarHBondContact O-CB 3.12Å; P537-V540 PolarHBondContact O-N 2.85Å; P537-G541 PolarHBondContact O-N 3.07Å
538	N	96.3	Very high	95.8	Very high	10 Å²	10	30.2 Å²	30.2	5%	0.053	16%	0.163	C	C	.	.	H	α-helix	trans	-63.6	-32.9	175.5	64.4	-49.6	0	0	0	112.2	H492 S495 W531 H536 Y542	H492-N538 PolarHBondContact ND1-O 3.27Å; S495-N538 VanDerWaalsContact OG-CA 3.29Å; S495-N538 WeakPolarHBondContact OG-CA 3.24Å; S495-N538 WeakPolarHBondContact OG-CB 3.39Å; S495-N538 PolarHBondContact OG-N 3.02Å; W531-N538 WeakPolarHBondContact CH2-OD1 3.25Å; H536-N538 PolarHBondContact O-N 2.86Å; N538-Y542 WeakPolarHBondContact O-CB 3.2Å; N538-Y542 PolarHBondContact O-N 2.81Å
539	Y	96.9	Very high	96	Very high	33 Å²	33	29.3 Å²	29.3	13%	0.129	16%	0.156	C	C	.	.	H	α-helix	trans	-75.3	-37.6	175.2	-68.1	-14.6	0	0	0	111.6	H536 P537 Y542 I543 I571 F601	H536-Y539 HydrophobicContact CB-CD2 3.45Å; H536-Y539 VanDerWaalsContact CB-CD2 3.45Å; H536-Y539 HydrophobicContact CB-CE2 4.15Å; H536-Y539 HydrophobicContact CB-CG 3.95Å; H536-Y539 AromaticContact CG-CD2 3.71Å; H536-Y539 AromaticContact CG-CE2 3.99Å; H536-Y539 AromaticContact ND1-CD2 3.76Å; H536-Y539 AromaticContact ND1-CE2 3.53Å; H536-Y539 WeakPolarHBondContact O-CB 3.3Å; H536-Y539 PolarHBondContact O-N 2.77Å; P537-Y539 VanDerWaalsContact C-N 3.26Å; P537-Y539 PolarHBondContact O-N 3.42Å; Y539-Y542 PolarHBondContact O-N 2.87Å; Y539-I543 WeakPolarHBondContact O-CG1 3.45Å; Y539-I543 PolarHBondContact O-N 2.92Å; Y539-I571 HydrophobicContact CD1-CG2 4.4Å; Y539-I571 HydrophobicContact CD2-CG2 4.17Å; Y539-I571 HydrophobicContact CG-CG2 3.8Å; Y539-F601 AromaticContact CD2-CE1 3.96Å; Y539-F601 HydrophobicContact CD2-CE1 3.96Å; Y539-F601 HydrophobicContact CD2-CZ 4.29Å; Y539-F601 HydrophobicContact CG-CE1 4.44Å
540	V	97.5	Very high	96.1	Very high	30 Å²	30	26.9 Å²	26.9	18%	0.182	13%	0.129	C	C	.	.	H	α-helix	trans	-58	-50.2	172	178.6	0	0	0	0	110.9	V534 H536 P537 Y542 I543 I544 F601	V534-V540 HydrophobicContact CG2-CG2 4.41Å; H536-V540 PolarHBondContact O-N 2.9Å; P537-V540 WeakPolarHBondContact O-CB 3.12Å; P537-V540 PolarHBondContact O-N 2.85Å; V540-Y542 VanDerWaalsContact C-N 3.27Å; V540-Y542 PolarHBondContact O-N 3.02Å; V540-I543 PolarHBondContact O-N 2.94Å; V540-I543 VanDerWaalsContact O-N 3.16Å; V540-I544 HydrophobicContact CG1-CD1 4.06Å; V540-I544 WeakPolarHBondContact O-CG1 3.41Å; V540-I544 PolarHBondContact O-N 3.23Å; V540-F601 HydrophobicContact CG2-CB 3.86Å; V540-F601 HydrophobicContact CG2-CD1 4.25Å; V540-F601 HydrophobicContact CG2-CG 4.3Å; V540-F601 VanDerWaalsContact CG2-O 3.26Å; V540-F601 WeakPolarHBondContact CG2-O 3.34Å
541	G	97.8	Very high	96	Very high	0 Å²	0	25.3 Å²	25.3	0%	0	12%	0.124	C	C	.	.	H	α-helix	trans	-57.3	-40.9	176.8	0	0	0	0	0	112.6	G488 P537 I544 M545	G488-G541 CarbonylContact C-O 3.51Å; G488-G541 WeakPolarHBondContact CA-O 3.06Å; G488-G541 CarbonylContact O-C 3.44Å; G488-G541 VanDerWaalsContact O-CA 3.26Å; G488-G541 WeakPolarHBondContact O-CA 3.47Å; P537-G541 PolarHBondContact O-N 3.07Å; G541-I544 PolarHBondContact O-N 3.13Å; G541-M545 VanDerWaalsContact O-CG 3.3Å; G541-M545 WeakPolarHBondContact O-CG 3.37Å; G541-M545 PolarHBondContact O-N 2.9Å
542	Y	97.3	Very high	95.7	Very high	46 Å²	46	24.1 Å²	24.1	18%	0.18	12%	0.12	C	C	.	.	H	α-helix	trans	-70.5	-34.1	178.3	-169.1	-99.7	0	0	0	113.1	W410 N538 Y539 V540 M545 A546 T567 I571	W410-Y542 AromaticContact CE2-CE2 3.75Å; W410-Y542 WeakPolarHBondContact CH2-OH 3.46Å; W410-Y542 AromaticContact CZ2-CE2 3.7Å; W410-Y542 HydrophobicContact CZ2-CE2 3.7Å; W410-Y542 AromaticContact CZ2-CZ 3.84Å; W410-Y542 WeakPolarHBondContact CZ2-OH 3.49Å; W410-Y542 AromaticContact NE1-CE2 3.62Å; N538-Y542 WeakPolarHBondContact O-CB 3.2Å; N538-Y542 PolarHBondContact O-N 2.81Å; Y539-Y542 PolarHBondContact O-N 2.87Å; V540-Y542 VanDerWaalsContact C-N 3.27Å; V540-Y542 PolarHBondContact O-N 3.02Å; Y542-M545 PolarHBondContact O-N 2.86Å; Y542-A546 WeakPolarHBondContact O-CB 3.34Å; Y542-A546 PolarHBondContact O-N 3.17Å; Y542-T567 HydrophobicContact CD1-CG2 4.45Å; Y542-T567 HydrophobicContact CE1-CG2 3.71Å; Y542-I571 HydrophobicContact CD1-CD1 3.38Å; Y542-I571 HydrophobicContact CD1-CG1 3.94Å; Y542-I571 HydrophobicContact CE1-CD1 3.85Å; Y542-I571 HydrophobicContact CE1-CG1 4.27Å
543	I	97.4	Very high	95.3	Very high	31 Å²	31	23.1 Å²	23.1	16%	0.159	11%	0.109	C	C	.	.	H	α-helix	trans	-61.9	-46.8	171	-71.8	170	0	0	0	110.3	Y539 V540 M545 A546 V547 I568 I571 F601	Y539-I543 WeakPolarHBondContact O-CG1 3.45Å; Y539-I543 PolarHBondContact O-N 2.92Å; V540-I543 PolarHBondContact O-N 2.94Å; V540-I543 VanDerWaalsContact O-N 3.16Å; I543-M545 VanDerWaalsContact C-N 3.33Å; I543-M545 PolarHBondContact O-N 3.4Å; I543-A546 PolarHBondContact O-N 3.44Å; I543-V547 WeakPolarHBondContact O-CG2 3.45Å; I543-V547 PolarHBondContact O-N 3.39Å; I543-I568 HydrophobicContact CG1-CG1 4.24Å; I543-I568 HydrophobicContact CG2-CD1 4.18Å; I543-I568 HydrophobicContact CG2-CG1 3.96Å; I543-I571 HydrophobicContact CD1-CG2 4.02Å; I543-I571 HydrophobicContact CG1-CB 4.44Å; I543-I571 HydrophobicContact CG1-CD1 3.58Å; I543-I571 HydrophobicContact CG1-CG2 4.11Å; I543-F601 HydrophobicContact CD1-CD2 3.9Å; I543-F601 HydrophobicContact CD1-CE2 3.88Å
544	I	97.8	Very high	94.8	Very high	42 Å²	42	15.8 Å²	15.8	22%	0.215	8%	0.082	C	C	.	.	H	α-helix	trans	-59.9	-45.6	178.4	-65	166.8	0	0	0	110.1	L484 I491 V540 G541 A546 V547 A548	L484-I544 WeakPolarHBondContact O-CG2 3.38Å; I491-I544 HydrophobicContact CD1-CD1 3.95Å; V540-I544 HydrophobicContact CG1-CD1 4.06Å; V540-I544 WeakPolarHBondContact O-CG1 3.41Å; V540-I544 PolarHBondContact O-N 3.23Å; G541-I544 PolarHBondContact O-N 3.13Å; I544-A546 PolarHBondContact O-N 3.24Å; I544-V547 PolarHBondContact O-N 3.42Å; I544-A548 VanDerWaalsContact O-CB 3.25Å; I544-A548 WeakPolarHBondContact O-CB 3.47Å; I544-A548 PolarHBondContact O-N 3.07Å
545	M	98	Very high	94	Very high	0 Å²	0	21.3 Å²	21.3	0%	0	11%	0.111	C	C	.	.	H	α-helix	trans	-58.6	-47	174.6	-68.1	169.1	68.3	0	0	111.8	W410 F485 L489 H492 G541 Y542 I543 V547 A548 M549	W410-M545 HydrophobicContact CB-CE 3.9Å; W410-M545 HydrophobicContact CG-CE 3.86Å; F485-M545 HydrophobicContact CD2-CB 4.05Å; F485-M545 HydrophobicContact CD2-CG 4.15Å; F485-M545 HydrophobicContact CE2-CB 4.07Å; F485-M545 HydrophobicContact CE2-CE 3.67Å; F485-M545 HydrophobicContact CE2-CG 4.13Å; F485-M545 HydrophobicContact CZ-CE 3.82Å; L489-M545 HydrophobicContact CB-CE 4.33Å; L489-M545 HydrophobicContact CB-CG 4.37Å; L489-M545 HydrophobicContact CB-SD 4.07Å; L489-M545 HydrophobicContact CD1-CE 3.75Å; L489-M545 HydrophobicContact CD1-SD 4.06Å; H492-M545 HydrophobicContact CB-SD 4.2Å; G541-M545 VanDerWaalsContact O-CG 3.3Å; G541-M545 WeakPolarHBondContact O-CG 3.37Å; G541-M545 PolarHBondContact O-N 2.9Å; Y542-M545 PolarHBondContact O-N 2.86Å; I543-M545 VanDerWaalsContact C-N 3.33Å; I543-M545 PolarHBondContact O-N 3.4Å; M545-V547 VanDerWaalsContact C-N 3.31Å; M545-V547 PolarHBondContact O-N 3.08Å; M545-A548 PolarHBondContact O-N 3.05Å; M545-M549 HydrophobicContact CB-CE 4.1Å; M545-M549 WeakPolarHBondContact O-CB 3.42Å; M545-M549 WeakPolarHBondContact O-CE 3.44Å; M545-M549 WeakPolarHBondContact O-CG 3.45Å; M545-M549 PolarHBondContact O-N 3.35Å
546	A	96.4	Very high	92.9	Very high	6 Å²	6	23.2 Å²	23.2	5%	0.05	12%	0.123	C	C	.	.	H	α-helix	trans	-63.9	-34	-178.3	0	0	0	0	0	113.3	Y542 I543 I544 S564 T567	Y542-A546 WeakPolarHBondContact O-CB 3.34Å; Y542-A546 PolarHBondContact O-N 3.17Å; I543-A546 PolarHBondContact O-N 3.44Å; I544-A546 PolarHBondContact O-N 3.24Å; A546-S564 PolarHBondContact O-OG 2.97Å; A546-T567 HydrophobicContact CB-CG2 3.71Å
547	V	96.1	Very high	91.8	Very high	48 Å²	48	23.8 Å²	23.8	29%	0.291	13%	0.128	S	C	.	.	H	α-helix	trans	-71.9	-48.9	172.3	170.4	0	0	0	0	110.1	I543 I544 M545 M549 Q550 V551 W561 I568	I543-V547 WeakPolarHBondContact O-CG2 3.45Å; I543-V547 PolarHBondContact O-N 3.39Å; I544-V547 PolarHBondContact O-N 3.42Å; M545-V547 VanDerWaalsContact C-N 3.31Å; M545-V547 PolarHBondContact O-N 3.08Å; V547-M549 VanDerWaalsContact C-N 3.3Å; V547-M549 PolarHBondContact O-N 3.44Å; V547-Q550 PolarHBondContact O-N 3.23Å; V547-V551 PolarHBondContact O-N 3.27Å; V547-W561 HydrophobicContact CG1-CZ3 4.15Å; V547-I568 HydrophobicContact CG2-CD1 4.03Å
548	A	96.7	Very high	90.7	Very high	1 Å²	1	28 Å²	28	1%	0.008	16%	0.155	C	C	.	.	H	α-helix	trans	-58	-41.2	-177.6	0	0	0	0	0	112.6	S481 L484 F485 I544 M545 Q550 V551 P552	S481-A548 PolarHBondContact OG-O 3.01Å; L484-A548 HydrophobicContact CB-CB 3.98Å; F485-A548 HydrophobicContact CB-CB 3.71Å; I544-A548 VanDerWaalsContact O-CB 3.25Å; I544-A548 WeakPolarHBondContact O-CB 3.47Å; I544-A548 PolarHBondContact O-N 3.07Å; M545-A548 PolarHBondContact O-N 3.05Å; A548-Q550 PolarHBondContact O-N 2.95Å; A548-V551 PolarHBondContact O-N 3.38Å; A548-P552 WeakPolarHBondContact O-CD 3.47Å
549	M	95.5	Very high	89.8	Confident	9 Å²	9	32.6 Å²	32.6	4%	0.044	18%	0.179	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.2	-21.8	177.3	-75	-176.1	-74.3	0	0	113.8	H403 M406 H407 W410 F485 M545 V547 P552	H403-M549 PolarHBondContact CE1-O 3.26Å; H403-M549 PolarHBondContact ND1-O 2.88Å; M406-M549 HydrophobicContact CB-CG 3.74Å; M406-M549 HydrophobicContact CB-SD 4.39Å; M406-M549 HydrophobicContact SD-CG 4.11Å; H407-M549 VanDerWaalsContact CD2-SD 3.55Å; W410-M549 HydrophobicContact CD2-CE 4.44Å; W410-M549 HydrophobicContact CE3-CE 4.1Å; W410-M549 HydrophobicContact CE3-SD 4.08Å; F485-M549 HydrophobicContact CD2-CG 3.75Å; F485-M549 HydrophobicContact CD2-SD 4.33Å; F485-M549 HydrophobicContact CE2-CE 4.25Å; F485-M549 HydrophobicContact CE2-CG 3.81Å; F485-M549 HydrophobicContact CE2-SD 3.77Å; M545-M549 HydrophobicContact CB-CE 4.1Å; M545-M549 WeakPolarHBondContact O-CB 3.42Å; M545-M549 WeakPolarHBondContact O-CE 3.44Å; M545-M549 WeakPolarHBondContact O-CG 3.45Å; M545-M549 PolarHBondContact O-N 3.35Å; V547-M549 VanDerWaalsContact C-N 3.3Å; V547-M549 PolarHBondContact O-N 3.44Å; M549-P552 WeakPolarHBondContact O-CD 3.47Å
550	Q	93.1	Very high	89.3	Confident	5 Å²	5	31.3 Å²	31.3	2%	0.023	17%	0.174	C	C	.	.	T	Hydrogen-bonded Turn	trans	-95.6	-20.4	-176.8	-167.1	51.9	66.3	0	0	113.8	T451 V547 A548 P552 C553 L560 W561 S564	T451-Q550 PolarHBondContact OG1-OE1 3Å; V547-Q550 PolarHBondContact O-N 3.23Å; A548-Q550 PolarHBondContact O-N 2.95Å; Q550-P552 VanDerWaalsContact C-N 3.33Å; Q550-C553 PolarHBondContact NE2-SG 2.95Å; Q550-C553 VanDerWaalsContact NE2-SG 3.43Å; Q550-C553 PolarHBondContact O-N 3Å; Q550-L560 PolarHBondContact OE1-O 3.49Å; Q550-W561 HydrophobicContact CG-CD2 4.09Å; Q550-W561 HydrophobicContact CG-CE3 4.35Å; Q550-W561 HydrophobicContact CG-CG 4.25Å; Q550-S564 WeakPolarHBondContact CB-OG 3.26Å
551	V	91.9	Very high	88.8	Confident	20 Å²	20	33.4 Å²	33.4	12%	0.121	18%	0.179	C	C	.	.	G	3₁₀ helix	trans	-54.1	-37.3	177.6	176.1	0	0	0	0	113.9	I477 V547 A548 C553 G554 W561	I477-V551 HydrophobicContact CG2-CG1 3.46Å; I477-V551 VanDerWaalsContact CG2-CG1 3.46Å; V547-V551 PolarHBondContact O-N 3.27Å; A548-V551 PolarHBondContact O-N 3.38Å; V551-C553 PolarHBondContact O-N 3.26Å; V551-C553 VanDerWaalsContact O-N 3.07Å; V551-G554 PolarHBondContact O-N 3.27Å; V551-W561 HydrophobicContact CG2-CH2 4.01Å
552	P	88.9	Confident	88.4	Confident	0 Å²	0	34.8 Å²	34.8	0%	0	19%	0.193	C	C	.	.	G	3₁₀ helix	trans	-57.5	-22.8	178.6	-27.6	36.5	0	0	0	114.9	A399 H403 M406 L455 A548 M549 Q550 G554	A399-P552 HydrophobicContact CB-CB 3.98Å; H403-P552 HydrophobicContact CB-CB 4.41Å; H403-P552 HydrophobicContact CB-CG 4.32Å; M406-P552 HydrophobicContact CE-CG 3.55Å; L455-P552 HydrophobicContact CD1-CB 4.26Å; A548-P552 WeakPolarHBondContact O-CD 3.47Å; M549-P552 WeakPolarHBondContact O-CD 3.47Å; Q550-P552 VanDerWaalsContact C-N 3.33Å; P552-G554 VanDerWaalsContact C-N 3.25Å; P552-G554 PolarHBondContact O-N 3.16Å
553	C	85.5	Confident	88	Confident	3 Å²	3	33.1 Å²	33.1	2%	0.02	19%	0.187	C	C	.	.	G	3₁₀ helix	trans	-76.9	-8.2	175.1	-70	0	0	0	0	114.7	T451 Y454 Q550 V551 L560	T451-C553 WeakPolarHBondContact CG2-SG 3.2Å; Y454-C553 HydrophobicContact CD1-CB 4.33Å; Y454-C553 HydrophobicContact CE1-CB 4.25Å; Q550-C553 PolarHBondContact NE2-SG 2.95Å; Q550-C553 VanDerWaalsContact NE2-SG 3.43Å; Q550-C553 PolarHBondContact O-N 3Å; V551-C553 PolarHBondContact O-N 3.26Å; V551-C553 VanDerWaalsContact O-N 3.07Å; C553-L560 HydrophobicContact CB-CD1 3.72Å
554	G	82.8	Confident	87.9	Confident	7 Å²	7	31.9 Å²	31.9	7%	0.072	18%	0.181	C	C	.	.			trans	64.1	-162	-174.4	0	0	0	0	0	112.9	V551 P552 W561	V551-G554 PolarHBondContact O-N 3.27Å; P552-G554 VanDerWaalsContact C-N 3.25Å; P552-G554 PolarHBondContact O-N 3.16Å; G554-W561 PolarHBondContact O-NE1 2.93Å
555	L	80.3	Confident	87.6	Confident	121 Å²	121	32.2 Å²	32.2	63%	0.634	19%	0.19	S	C	*	.	S	Bend	trans	-99.9	-0.4	176.1	-62.5	177.6	0	0	0	112.7	S557 W561	L555-S557 PolarHBondContact O-N 3.12Å; L555-W561 HydrophobicContact CD2-CZ2 4Å
556	D	71.9	Confident	87.3	Confident	68 Å²	68	35 Å²	35	36%	0.364	20%	0.204	S	C	.	.	S	Bend	trans	-62.7	-26.3	-177.1	-57.7	-10.9	0	0	0	112	H471 S472	H471-D556 IonicContact CE1-OD2 4Å; H471-D556 IonicContact CG-OD2 3.85Å; H471-D556 IonicContact ND1-OD2 2.97Å; H471-D556 PolarHBondContact ND1-OD2 3.45Å; S472-D556 VanDerWaalsContact CB-OD1 3.24Å; S472-D556 WeakPolarHBondContact CB-OD1 3.45Å; S472-D556 PolarHBondContact N-OD1 3.44Å; S472-D556 PolarHBondContact N-OD2 2.78Å; S472-D556 PolarHBondContact OG-OD1 3.23Å
557	S	72.8	Confident	87.2	Confident	17 Å²	17	34.9 Å²	34.9	12%	0.119	20%	0.203	C	C	.	.			trans	-127.2	86.6	172.5	-178	0	0	0	0	110	L555 L559 L560	L555-S557 PolarHBondContact O-N 3.12Å; S557-L559 PolarHBondContact O-N 3.36Å; S557-L559 VanDerWaalsContact O-N 3.14Å; S557-L560 PolarHBondContact O-N 3Å
558	P	73.4	Confident	87.1	Confident	92 Å²	92	34.8 Å²	34.8	60%	0.597	20%	0.201	S	C	*	.	G	3₁₀ helix	trans	-62	-22.6	-179.6	24.5	-33.7	0	0	0	112.4	L560 W561	P558-L560 PolarHBondContact O-N 3.13Å; P558-W561 WeakPolarHBondContact O-CB 3.34Å; P558-W561 PolarHBondContact O-N 3.06Å; P558-W561 VanDerWaalsContact O-N 3.15Å
559	L	78.9	Confident	87	Confident	106 Å²	106	40.2 Å²	40.2	56%	0.555	23%	0.229	S	C	*	.	G	3₁₀ helix	trans	-63.2	-30.4	178.5	-65.3	167.9	0	0	0	112.6	L175 S557 W561 G562	L175-L559 HydrophobicContact CD1-CD1 4.05Å; L175-L559 HydrophobicContact CD2-CB 4.12Å; L175-L559 HydrophobicContact CD2-CD1 3.74Å; L175-L559 HydrophobicContact CG-CD1 4.33Å; S557-L559 PolarHBondContact O-N 3.36Å; S557-L559 VanDerWaalsContact O-N 3.14Å; L559-W561 VanDerWaalsContact C-N 3.29Å; L559-W561 PolarHBondContact O-N 3.3Å; L559-G562 WeakPolarHBondContact O-CA 3.3Å; L559-G562 PolarHBondContact O-N 3.27Å
560	L	85.3	Confident	86.8	Confident	5 Å²	5	44.3 Å²	44.3	3%	0.026	25%	0.251	C	S	.	.	G	3₁₀ helix	trans	-67.1	-30.2	176.3	-72.4	173.3	0	0	0	113.1	I176 I450 Y454 Q550 C553 S557 P558 G562 I563	I176-L560 HydrophobicContact CD1-CD2 3.32Å; I176-L560 HydrophobicContact CD1-CG 4.24Å; I450-L560 HydrophobicContact CG2-CD2 3.69Å; Y454-L560 HydrophobicContact CD1-CD1 3.42Å; Y454-L560 VanDerWaalsContact CD1-CD1 3.42Å; Y454-L560 HydrophobicContact CD2-CD1 3.87Å; Y454-L560 HydrophobicContact CE1-CD1 3.79Å; Y454-L560 HydrophobicContact CE2-CD1 4.2Å; Y454-L560 HydrophobicContact CG-CD1 3.47Å; Y454-L560 VanDerWaalsContact CG-CD1 3.47Å; Q550-L560 PolarHBondContact OE1-O 3.49Å; C553-L560 HydrophobicContact CB-CD1 3.72Å; S557-L560 PolarHBondContact O-N 3Å; P558-L560 PolarHBondContact O-N 3.13Å; L560-G562 PolarHBondContact O-N 3.35Å; L560-G562 VanDerWaalsContact O-N 3.12Å; L560-I563 HydrophobicContact CD2-CD1 4.19Å; L560-I563 WeakPolarHBondContact O-CB 3.49Å; L560-I563 PolarHBondContact O-N 2.72Å
561	W	88.3	Confident	86.9	Confident	75 Å²	75	44.7 Å²	44.7	28%	0.284	25%	0.253	S	S	.	.	H	α-helix	trans	-63.3	-16.9	171.9	-68.3	81.2	0	0	0	112.6	V547 Q550 V551 G554 L555 P558 L559 I563 S564 A565	V547-W561 HydrophobicContact CG1-CZ3 4.15Å; Q550-W561 HydrophobicContact CG-CD2 4.09Å; Q550-W561 HydrophobicContact CG-CE3 4.35Å; Q550-W561 HydrophobicContact CG-CG 4.25Å; V551-W561 HydrophobicContact CG2-CH2 4.01Å; G554-W561 PolarHBondContact O-NE1 2.93Å; L555-W561 HydrophobicContact CD2-CZ2 4Å; P558-W561 WeakPolarHBondContact O-CB 3.34Å; P558-W561 PolarHBondContact O-N 3.06Å; P558-W561 VanDerWaalsContact O-N 3.15Å; L559-W561 VanDerWaalsContact C-N 3.29Å; L559-W561 PolarHBondContact O-N 3.3Å; W561-I563 PolarHBondContact O-N 2.84Å; W561-S564 PolarHBondContact O-N 2.81Å; W561-A565 WeakPolarHBondContact O-CB 3.04Å; W561-A565 PolarHBondContact O-N 2.83Å
562	G	87.5	Confident	87	Confident	28 Å²	28	46 Å²	46	29%	0.289	26%	0.259	S	S	.	.	H	α-helix	trans	-55.5	-33.2	168.4	0	0	0	0	0	113.2	L559 L560 A565 I566	L559-G562 WeakPolarHBondContact O-CA 3.3Å; L559-G562 PolarHBondContact O-N 3.27Å; L560-G562 PolarHBondContact O-N 3.35Å; L560-G562 VanDerWaalsContact O-N 3.12Å; G562-A565 PolarHBondContact O-N 2.83Å; G562-I566 WeakPolarHBondContact O-CB 3Å; G562-I566 WeakPolarHBondContact O-CD1 3.22Å; G562-I566 WeakPolarHBondContact O-CG1 3.49Å; G562-I566 PolarHBondContact O-N 3.14Å
563	I	90.7	Very high	87.1	Confident	12 Å²	12	51.1 Å²	51.1	6%	0.062	28%	0.283	C	S	.	.	H	α-helix	trans	-65.9	-47.4	178.2	-58.8	166.7	0	0	0	110.4	V447 Y448 I450 L560 W561 I566 T567	V447-I563 HydrophobicContact CG1-CG1 4.3Å; V447-I563 HydrophobicContact CG1-CG2 4.39Å; V447-I563 WeakPolarHBondContact O-CD1 3.44Å; Y448-I563 HydrophobicContact CD1-CG2 4.43Å; I450-I563 HydrophobicContact CB-CD1 3.92Å; I450-I563 HydrophobicContact CG2-CD1 3.94Å; L560-I563 HydrophobicContact CD2-CD1 4.19Å; L560-I563 WeakPolarHBondContact O-CB 3.49Å; L560-I563 PolarHBondContact O-N 2.72Å; W561-I563 PolarHBondContact O-N 2.84Å; I563-I566 PolarHBondContact O-N 3.32Å; I563-T567 WeakPolarHBondContact O-CB 3.31Å; I563-T567 PolarHBondContact O-N 2.98Å; I563-T567 PolarHBondContact O-OG1 3.43Å
564	S	93.7	Very high	87.3	Confident	5 Å²	5	54.2 Å²	54.2	4%	0.035	29%	0.294	C	S	.	.	H	α-helix	trans	-64.3	-41.5	174.6	-56.6	0	0	0	0	111.2	A546 Q550 W561 T567 I568	A546-S564 PolarHBondContact O-OG 2.97Å; Q550-S564 WeakPolarHBondContact CB-OG 3.26Å; W561-S564 PolarHBondContact O-N 2.81Å; S564-T567 WeakPolarHBondContact O-CB 3.24Å; S564-T567 PolarHBondContact O-N 2.77Å; S564-I568 VanDerWaalsContact O-CG1 3.26Å; S564-I568 WeakPolarHBondContact O-CG1 3.32Å; S564-I568 PolarHBondContact O-N 2.87Å
565	A	93	Very high	87.9	Confident	48 Å²	48	53.9 Å²	53.9	40%	0.397	29%	0.29	S	S	.	.	H	α-helix	trans	-60.8	-47.2	177.1	0	0	0	0	0	112.1	W561 G562 T567 I568 L569	W561-A565 WeakPolarHBondContact O-CB 3.04Å; W561-A565 PolarHBondContact O-N 2.83Å; G562-A565 PolarHBondContact O-N 2.83Å; A565-T567 VanDerWaalsContact C-N 3.28Å; A565-T567 PolarHBondContact O-N 3.42Å; A565-I568 PolarHBondContact O-N 3.21Å; A565-L569 WeakPolarHBondContact O-CG 3.35Å; A565-L569 PolarHBondContact O-N 3.5Å
566	I	91.5	Very high	88.4	Confident	59 Å²	59	51.5 Å²	51.5	30%	0.303	28%	0.277	S	S	.	.	H	α-helix	trans	-59.8	-41.5	174.7	-70.8	163.3	0	0	0	110.4	F168 G562 I563 L569 N570	F168-I566 HydrophobicContact CE1-CD1 3.96Å; F168-I566 HydrophobicContact CZ-CD1 3.97Å; G562-I566 WeakPolarHBondContact O-CB 3Å; G562-I566 WeakPolarHBondContact O-CD1 3.22Å; G562-I566 WeakPolarHBondContact O-CG1 3.49Å; G562-I566 PolarHBondContact O-N 3.14Å; I563-I566 PolarHBondContact O-N 3.32Å; I566-L569 PolarHBondContact O-N 2.83Å; I566-N570 WeakPolarHBondContact CG2-ND2 3.41Å; I566-N570 WeakPolarHBondContact O-CB 3.25Å; I566-N570 PolarHBondContact O-N 3.48Å; I566-N570 PolarHBondContact O-ND2 3.18Å
567	T	93.8	Very high	89.3	Confident	4 Å²	4	49.8 Å²	49.8	3%	0.025	27%	0.269	C	S	.	.	H	α-helix	trans	-62.6	-46.1	177.4	-62.1	0	0	0	0	111.3	Y448 Y542 A546 I563 S564 A565 N570 I571	Y448-T567 PolarHBondContact OH-OG1 2.9Å; Y542-T567 HydrophobicContact CD1-CG2 4.45Å; Y542-T567 HydrophobicContact CE1-CG2 3.71Å; A546-T567 HydrophobicContact CB-CG2 3.71Å; I563-T567 WeakPolarHBondContact O-CB 3.31Å; I563-T567 PolarHBondContact O-N 2.98Å; I563-T567 PolarHBondContact O-OG1 3.43Å; S564-T567 WeakPolarHBondContact O-CB 3.24Å; S564-T567 PolarHBondContact O-N 2.77Å; A565-T567 VanDerWaalsContact C-N 3.28Å; A565-T567 PolarHBondContact O-N 3.42Å; T567-N570 PolarHBondContact O-N 3.39Å; T567-I571 HydrophobicContact CG2-CD1 3.85Å; T567-I571 VanDerWaalsContact O-CD1 3.24Å; T567-I571 WeakPolarHBondContact O-CD1 3.41Å; T567-I571 WeakPolarHBondContact O-CG1 3.38Å; T567-I571 PolarHBondContact O-N 3.27Å
568	I	94.9	Very high	90.2	Very high	46 Å²	46	49.6 Å²	49.6	24%	0.236	27%	0.267	C	S	.	.	H	α-helix	trans	-61.5	-47	176.9	-68.2	165.1	0	0	0	111.3	I543 V547 S564 A565 N570 I571 I572	I543-I568 HydrophobicContact CG1-CG1 4.24Å; I543-I568 HydrophobicContact CG2-CD1 4.18Å; I543-I568 HydrophobicContact CG2-CG1 3.96Å; V547-I568 HydrophobicContact CG2-CD1 4.03Å; S564-I568 VanDerWaalsContact O-CG1 3.26Å; S564-I568 WeakPolarHBondContact O-CG1 3.32Å; S564-I568 PolarHBondContact O-N 2.87Å; A565-I568 PolarHBondContact O-N 3.21Å; I568-N570 VanDerWaalsContact C-N 3.31Å; I568-N570 PolarHBondContact O-N 3.44Å; I568-I571 WeakPolarHBondContact O-CB 3.39Å; I568-I571 PolarHBondContact O-N 3.08Å; I568-I571 VanDerWaalsContact O-N 3.1Å; I568-I572 HydrophobicContact CG2-CD1 3.82Å; I568-I572 HydrophobicContact CG2-CG1 4.42Å; I568-I572 WeakPolarHBondContact O-CG1 3.41Å; I568-I572 PolarHBondContact O-N 2.66Å
569	L	94	Very high	91.1	Very high	115 Å²	115	45.7 Å²	45.7	60%	0.602	24%	0.24	S	C	*	.	H	α-helix	trans	-59.9	-41.8	177.2	-71.5	172	0	0	0	111.8	A565 I566 I571 I572 H573	A565-L569 WeakPolarHBondContact O-CG 3.35Å; A565-L569 PolarHBondContact O-N 3.5Å; I566-L569 PolarHBondContact O-N 2.83Å; L569-I571 VanDerWaalsContact C-N 3.32Å; L569-I571 PolarHBondContact O-N 2.99Å; L569-I572 PolarHBondContact O-N 2.85Å; L569-H573 WeakPolarHBondContact O-CB 3.41Å; L569-H573 PolarHBondContact O-N 3.14Å
570	N	91.8	Very high	91.7	Very high	94 Å²	94	44.9 Å²	44.9	50%	0.503	24%	0.237	S	C	.	.	H	α-helix	trans	-63.1	-37.3	175.1	-82.6	-54.7	0	0	0	112.4	I566 T567 I568 R574	I566-N570 WeakPolarHBondContact CG2-ND2 3.41Å; I566-N570 WeakPolarHBondContact O-CB 3.25Å; I566-N570 PolarHBondContact O-N 3.48Å; I566-N570 PolarHBondContact O-ND2 3.18Å; T567-N570 PolarHBondContact O-N 3.39Å; I568-N570 VanDerWaalsContact C-N 3.31Å; I568-N570 PolarHBondContact O-N 3.44Å; N570-R574 WeakPolarHBondContact O-CB 3.14Å; N570-R574 PolarHBondContact O-N 3.28Å
571	I	94.3	Very high	91.9	Very high	13 Å²	13	46.6 Å²	46.6	7%	0.067	25%	0.247	C	C	.	.	H	α-helix	trans	-70.2	-42.6	177.5	-66.1	155.5	0	0	0	111.3	Y539 Y542 I543 T567 I568 L569 R574 S575 F601	Y539-I571 HydrophobicContact CD1-CG2 4.4Å; Y539-I571 HydrophobicContact CD2-CG2 4.17Å; Y539-I571 HydrophobicContact CG-CG2 3.8Å; Y542-I571 HydrophobicContact CD1-CD1 3.38Å; Y542-I571 HydrophobicContact CD1-CG1 3.94Å; Y542-I571 HydrophobicContact CE1-CD1 3.85Å; Y542-I571 HydrophobicContact CE1-CG1 4.27Å; I543-I571 HydrophobicContact CD1-CG2 4.02Å; I543-I571 HydrophobicContact CG1-CB 4.44Å; I543-I571 HydrophobicContact CG1-CD1 3.58Å; I543-I571 HydrophobicContact CG1-CG2 4.11Å; T567-I571 HydrophobicContact CG2-CD1 3.85Å; T567-I571 VanDerWaalsContact O-CD1 3.24Å; T567-I571 WeakPolarHBondContact O-CD1 3.41Å; T567-I571 WeakPolarHBondContact O-CG1 3.38Å; T567-I571 PolarHBondContact O-N 3.27Å; I568-I571 WeakPolarHBondContact O-CB 3.39Å; I568-I571 PolarHBondContact O-N 3.08Å; I568-I571 VanDerWaalsContact O-N 3.1Å; L569-I571 VanDerWaalsContact C-N 3.32Å; L569-I571 PolarHBondContact O-N 2.99Å; I571-R574 PolarHBondContact O-N 2.99Å; I571-S575 PolarHBondContact O-N 3.04Å; I571-F601 HydrophobicContact CG2-CE2 4.26Å; I571-F601 HydrophobicContact CG2-CZ 3.88Å
572	I	93.9	Very high	92	Very high	49 Å²	49	44.2 Å²	44.2	25%	0.251	24%	0.242	S	C	.	.	H	α-helix	trans	-60.7	-49.1	174.1	-67	164.5	0	0	0	109.7	I568 L569 R574 S575 M576 F601 F606	I568-I572 HydrophobicContact CG2-CD1 3.82Å; I568-I572 HydrophobicContact CG2-CG1 4.42Å; I568-I572 WeakPolarHBondContact O-CG1 3.41Å; I568-I572 PolarHBondContact O-N 2.66Å; L569-I572 PolarHBondContact O-N 2.85Å; I572-R574 VanDerWaalsContact C-N 3.28Å; I572-R574 PolarHBondContact O-N 3.43Å; I572-S575 PolarHBondContact O-N 3.44Å; I572-S575 PolarHBondContact O-OG 3Å; I572-M576 HydrophobicContact CG2-CE 4.22Å; I572-M576 WeakPolarHBondContact O-CG 3.42Å; I572-M576 PolarHBondContact O-N 3.12Å; I572-F601 HydrophobicContact CB-CE2 4.43Å; I572-F601 HydrophobicContact CG1-CD2 4.44Å; I572-F601 HydrophobicContact CG1-CE2 3.63Å; I572-F606 HydrophobicContact CG2-CE1 4.34Å; I572-F606 HydrophobicContact CG2-CZ 4.06Å
573	H	90.5	Very high	92.2	Very high	107 Å²	107	46.2 Å²	46.2	50%	0.495	25%	0.245	S	C	.	.	H	α-helix	trans	-58	-44.4	175.8	179.4	67	0	0	0	111.4	L569 S575 M576 V577	L569-H573 WeakPolarHBondContact O-CB 3.41Å; L569-H573 PolarHBondContact O-N 3.14Å; H573-S575 PolarHBondContact O-N 3.17Å; H573-M576 PolarHBondContact O-N 3.21Å; H573-V577 WeakPolarHBondContact O-CG2 3.37Å; H573-V577 PolarHBondContact O-N 3.06Å; H573-V577 VanDerWaalsContact O-N 3.15Å
574	R	91	Very high	92.1	Very high	68 Å²	68	52.7 Å²	52.7	26%	0.257	27%	0.269	S	S	.	.	H	α-helix	trans	-63.6	-40.1	179.2	-177.9	53.6	58.2	124.7	8.6	112.6	E426 N570 I571 I572 V577 V578	E426-R574 IonicContact OE2-CZ 3.34Å; E426-R574 IonicContact OE2-NH1 3.21Å; E426-R574 PolarHBondContact OE2-NH1 3.19Å; E426-R574 IonicContact OE2-NH2 3.45Å; E426-R574 PolarHBondContact OE2-NH2 3.36Å; N570-R574 WeakPolarHBondContact O-CB 3.14Å; N570-R574 PolarHBondContact O-N 3.28Å; I571-R574 PolarHBondContact O-N 2.99Å; I572-R574 VanDerWaalsContact C-N 3.28Å; I572-R574 PolarHBondContact O-N 3.43Å; R574-V577 PolarHBondContact O-N 3.45Å; R574-V578 HydrophobicContact CG-CG2 4.43Å; R574-V578 WeakPolarHBondContact O-CG2 3.47Å; R574-V578 PolarHBondContact O-N 3.09Å
575	S	93.9	Very high	91.9	Very high	0 Å²	0	58.4 Å²	58.4	0%	0	29%	0.293	C	S	.	.	H	α-helix	trans	-62.4	-46.2	179.1	72	0	0	0	0	110.6	I571 I572 H573 V577 V578 E579 F601	I571-S575 PolarHBondContact O-N 3.04Å; I572-S575 PolarHBondContact O-N 3.44Å; I572-S575 PolarHBondContact O-OG 3Å; H573-S575 PolarHBondContact O-N 3.17Å; S575-V577 PolarHBondContact O-N 3.48Å; S575-V578 PolarHBondContact O-N 3.48Å; S575-V578 VanDerWaalsContact O-N 3.13Å; S575-E579 WeakPolarHBondContact O-CG 3.33Å; S575-E579 PolarHBondContact O-N 2.98Å; S575-F601 WeakPolarHBondContact OG-CZ 3.07Å
576	M	92	Very high	91.8	Very high	71 Å²	71	56.9 Å²	56.9	35%	0.35	28%	0.278	S	S	.	.	H	α-helix	trans	-56.6	-48.2	176.2	-64.4	-172.7	-67.9	0	0	112.3	I572 H573 V578 E579 D580	I572-M576 HydrophobicContact CG2-CE 4.22Å; I572-M576 WeakPolarHBondContact O-CG 3.42Å; I572-M576 PolarHBondContact O-N 3.12Å; H573-M576 PolarHBondContact O-N 3.21Å; M576-V578 VanDerWaalsContact C-N 3.3Å; M576-V578 PolarHBondContact O-N 2.82Å; M576-E579 PolarHBondContact O-N 3.45Å; M576-D580 PolarHBondContact O-N 2.97Å
577	V	90.2	Very high	91.7	Very high	31 Å²	31	55.1 Å²	55.1	19%	0.188	27%	0.274	C	S	.	.	H	α-helix	trans	-60.7	-40	178	173	0	0	0	0	111.9	H573 R574 S575 V581	H573-V577 WeakPolarHBondContact O-CG2 3.37Å; H573-V577 PolarHBondContact O-N 3.06Å; H573-V577 VanDerWaalsContact O-N 3.15Å; R574-V577 PolarHBondContact O-N 3.45Å; S575-V577 PolarHBondContact O-N 3.48Å; V577-V581 WeakPolarHBondContact O-CG2 3.42Å; V577-V581 PolarHBondContact O-N 3.28Å
578	V	91.3	Very high	91.6	Very high	14 Å²	14	59.6 Å²	59.6	9%	0.085	30%	0.304	C	S	.	.	H	α-helix	trans	-67.7	-40.7	177.9	170	0	0	0	0	111	Y425 R574 S575 M576 D580 V581 C582	Y425-V578 HydrophobicContact CD1-CG2 3.79Å; Y425-V578 HydrophobicContact CD2-CG2 4.02Å; Y425-V578 HydrophobicContact CE1-CG2 4.02Å; Y425-V578 HydrophobicContact CE2-CG2 4.23Å; Y425-V578 HydrophobicContact CG-CG2 3.79Å; R574-V578 HydrophobicContact CG-CG2 4.43Å; R574-V578 WeakPolarHBondContact O-CG2 3.47Å; R574-V578 PolarHBondContact O-N 3.09Å; S575-V578 PolarHBondContact O-N 3.48Å; S575-V578 VanDerWaalsContact O-N 3.13Å; M576-V578 VanDerWaalsContact C-N 3.3Å; M576-V578 PolarHBondContact O-N 2.82Å; V578-D580 PolarHBondContact O-N 3.13Å; V578-V581 PolarHBondContact O-N 3.31Å; V578-C582 PolarHBondContact O-N 3.05Å; V578-C582 PolarHBondContact O-SG 3.23Å; V578-C582 VanDerWaalsContact O-SG 3.35Å
579	E	93.4	Very high	91.6	Very high	9 Å²	9	57.7 Å²	57.7	4%	0.042	30%	0.295	C	S	.	.	H	α-helix	trans	-62.4	-41.8	176.1	-65.6	-161.3	166.8	0	0	112.2	R535 H536 S575 M576 V581 C582 L583 W590 R600	R535-E579 IonicContact CZ-OE1 3.56Å; R535-E579 IonicContact CZ-OE2 3.78Å; R535-E579 IonicContact NE-OE1 2.84Å; R535-E579 VanDerWaalsContact NH1-CD 3.25Å; R535-E579 IonicContact NH1-OE1 2.72Å; R535-E579 PolarHBondContact NH1-OE1 3.2Å; R535-E579 IonicContact NH1-OE2 2.98Å; R535-E579 PolarHBondContact NH1-OE2 3.17Å; H536-E579 IonicContact CD2-OE1 3.33Å; H536-E579 IonicContact CE1-OE1 3.76Å; H536-E579 WeakPolarHBondContact NE2-CG 3.47Å; H536-E579 IonicContact NE2-OE1 3.29Å; H536-E579 PolarHBondContact NE2-OE1 3.4Å; S575-E579 WeakPolarHBondContact O-CG 3.33Å; S575-E579 PolarHBondContact O-N 2.98Å; M576-E579 PolarHBondContact O-N 3.45Å; E579-V581 PolarHBondContact O-N 2.96Å; E579-C582 CarbonylContact O-C 3.38Å; E579-C582 PolarHBondContact O-N 3.21Å; E579-C582 VanDerWaalsContact O-N 3.12Å; E579-L583 WeakPolarHBondContact O-CB 3.31Å; E579-L583 PolarHBondContact O-N 3.32Å; E579-W590 HydrophobicContact CB-CZ2 4.01Å; E579-W590 HydrophobicContact CG-CH2 4.5Å; E579-W590 HydrophobicContact CG-CZ2 3.76Å; E579-R600 VanDerWaalsContact CD-NE 3.27Å; E579-R600 WeakPolarHBondContact OE1-CG 3.38Å; E579-R600 IonicContact OE1-NE 3.03Å; E579-R600 PolarHBondContact OE1-NE 2.85Å; E579-R600 IonicContact OE2-CZ 3.18Å; E579-R600 IonicContact OE2-NE 3.67Å; E579-R600 PolarHBondContact OE2-NE 3.24Å; E579-R600 IonicContact OE2-NH2 3.11Å; E579-R600 PolarHBondContact OE2-NH2 3.34Å
580	D	91.3	Very high	91.6	Very high	89 Å²	89	53.1 Å²	53.1	48%	0.476	27%	0.27	S	S	.	.	H	α-helix	trans	-62	-33.5	176	-70.8	-18	0	0	0	112.3	M576 V578 R584	M576-D580 PolarHBondContact O-N 2.97Å; V578-D580 PolarHBondContact O-N 3.13Å; D580-R584 WeakPolarHBondContact O-CG 2.73Å; D580-R584 PolarHBondContact O-N 3.25Å; D580-R584 PolarHBondContact O-NE 3Å
581	V	89	Confident	91.8	Very high	41 Å²	41	54.3 Å²	54.3	25%	0.248	27%	0.272	C	S	.	.	H	α-helix	trans	-73.4	-42.1	174.2	173.7	0	0	0	0	110.7	Y425 V577 V578 E579 R584 K585	Y425-V581 HydrophobicContact CE2-CB 4.2Å; Y425-V581 HydrophobicContact CE2-CG1 4.16Å; Y425-V581 HydrophobicContact CE2-CG2 4.02Å; V577-V581 WeakPolarHBondContact O-CG2 3.42Å; V577-V581 PolarHBondContact O-N 3.28Å; V578-V581 PolarHBondContact O-N 3.31Å; E579-V581 PolarHBondContact O-N 2.96Å; V581-R584 PolarHBondContact O-N 2.81Å; V581-K585 VanDerWaalsContact O-CB 3.25Å; V581-K585 WeakPolarHBondContact O-CB 2.82Å; V581-K585 PolarHBondContact O-N 3.45Å
582	C	90.7	Very high	91.8	Very high	25 Å²	25	59.8 Å²	59.8	17%	0.169	30%	0.295	C	S	.	.	H	α-helix	trans	-63	-42.8	176.7	-72.8	0	0	0	0	112	V578 E579 R584 K585 H586 W590	V578-C582 PolarHBondContact O-N 3.05Å; V578-C582 PolarHBondContact O-SG 3.23Å; V578-C582 VanDerWaalsContact O-SG 3.35Å; E579-C582 CarbonylContact O-C 3.38Å; E579-C582 PolarHBondContact O-N 3.21Å; E579-C582 VanDerWaalsContact O-N 3.12Å; C582-R584 PolarHBondContact O-N 3.41Å; C582-K585 PolarHBondContact O-N 3.17Å; C582-H586 WeakPolarHBondContact O-CB 3.31Å; C582-H586 PolarHBondContact O-CD2 3.3Å; C582-H586 PolarHBondContact O-N 3Å; C582-W590 HydrophobicContact CB-CD2 3.59Å; C582-W590 HydrophobicContact CB-CE3 3.52Å; C582-W590 HydrophobicContact CB-CG 4.33Å; C582-W590 HydrophobicContact CB-CH2 3.84Å; C582-W590 HydrophobicContact CB-CZ2 3.9Å; C582-W590 HydrophobicContact CB-CZ3 3.64Å
583	L	91.7	Very high	91.8	Very high	70 Å²	70	57.7 Å²	57.7	37%	0.366	29%	0.285	S	S	.	.	H	α-helix	trans	-59.6	-46.4	175.6	177.7	62.4	0	0	0	111.1	E579 K585 G587 W590 Q591	E579-L583 WeakPolarHBondContact O-CB 3.31Å; E579-L583 PolarHBondContact O-N 3.32Å; L583-K585 VanDerWaalsContact C-N 3.32Å; L583-K585 PolarHBondContact O-N 3.35Å; L583-G587 WeakPolarHBondContact O-CA 3.37Å; L583-G587 PolarHBondContact O-N 2.96Å; L583-W590 HydrophobicContact CB-CG 4.35Å; L583-Q591 HydrophobicContact CD1-CG 4.05Å
584	R	89.5	Confident	92.1	Very high	148 Å²	148	54.3 Å²	54.3	56%	0.558	27%	0.271	S	S	*	.	H	α-helix	trans	-66.9	-32.6	177.3	-75.2	180	-73.4	171.4	-9.7	113.4	S340 D580 V581 C582	S340-R584 PolarHBondContact OG-NH1 3.49Å; D580-R584 WeakPolarHBondContact O-CG 2.73Å; D580-R584 PolarHBondContact O-N 3.25Å; D580-R584 PolarHBondContact O-NE 3Å; V581-R584 PolarHBondContact O-N 2.81Å; C582-R584 PolarHBondContact O-N 3.41Å
585	K	88.5	Confident	92.2	Very high	125 Å²	125	54.7 Å²	54.7	54%	0.543	29%	0.289	S	S	.	.	H	α-helix	trans	-80.1	-43.3	-177.5	-177.4	179.5	175.6	-174.5	0	112.7	V581 C582 L583	V581-K585 VanDerWaalsContact O-CB 3.25Å; V581-K585 WeakPolarHBondContact O-CB 2.82Å; V581-K585 PolarHBondContact O-N 3.45Å; C582-K585 PolarHBondContact O-N 3.17Å; L583-K585 VanDerWaalsContact C-N 3.32Å; L583-K585 PolarHBondContact O-N 3.35Å
586	H	90	Very high	92.3	Very high	16 Å²	16	58.3 Å²	58.3	7%	0.074	31%	0.308	C	S	.	.	H	α-helix	trans	-105.8	-15.3	-171.3	-61.2	-69.4	0	0	0	113.1	Q523 L525 C582 A589 W590	Q523-H586 PolarHBondContact OE1-CE1 3.46Å; Q523-H586 PolarHBondContact OE1-ND1 2.85Å; L525-H586 HydrophobicContact CD1-CB 4.32Å; C582-H586 WeakPolarHBondContact O-CB 3.31Å; C582-H586 PolarHBondContact O-CD2 3.3Å; C582-H586 PolarHBondContact O-N 3Å; H586-A589 HydrophobicContact CB-CB 4.39Å; H586-A589 PolarHBondContact O-N 2.99Å; H586-A589 VanDerWaalsContact O-N 3.13Å; H586-W590 HydrophobicContact CB-CB 3.98Å
587	G	90.3	Very high	92.4	Very high	22 Å²	22	55 Å²	55	23%	0.227	29%	0.292	C	S	.	.	T	Hydrogen-bonded Turn	trans	53.2	-120.6	175.1	0	0	0	0	0	112.4	L583 A589 W590 Q591	L583-G587 WeakPolarHBondContact O-CA 3.37Å; L583-G587 PolarHBondContact O-N 2.96Å; G587-A589 VanDerWaalsContact C-N 3.26Å; G587-A589 PolarHBondContact O-N 3.07Å; G587-W590 WeakPolarHBondContact O-CB 3.37Å; G587-W590 PolarHBondContact O-N 2.96Å; G587-Q591 PolarHBondContact O-N 2.97Å
588	P	92.4	Very high	92.6	Very high	98 Å²	98	56.3 Å²	56.3	64%	0.636	30%	0.301	S	S	*	.	H	α-helix	trans	-57.2	-33.8	-179.5	-25.4	34.5	0	0	0	114.5	W590 Q591 K592	P588-W590 VanDerWaalsContact C-N 3.28Å; P588-W590 PolarHBondContact O-N 2.96Å; P588-Q591 PolarHBondContact O-N 3.41Å; P588-K592 PolarHBondContact O-N 3.21Å
589	A	93.6	Very high	92.8	Very high	7 Å²	7	59.5 Å²	59.5	6%	0.058	31%	0.312	C	S	.	.	H	α-helix	trans	-66.4	-32.9	178.5	0	0	0	0	0	112.1	V517 G519 H586 G587 Y593	V517-A589 HydrophobicContact CG1-CB 3.94Å; G519-A589 VanDerWaalsContact CA-CB 3.45Å; H586-A589 HydrophobicContact CB-CB 4.39Å; H586-A589 PolarHBondContact O-N 2.99Å; H586-A589 VanDerWaalsContact O-N 3.13Å; G587-A589 VanDerWaalsContact C-N 3.26Å; G587-A589 PolarHBondContact O-N 3.07Å; A589-Y593 WeakPolarHBondContact O-CB 3.17Å; A589-Y593 PolarHBondContact O-N 3Å
590	W	95.1	Very high	92.8	Very high	19 Å²	19	61.4 Å²	61.4	7%	0.072	32%	0.319	C	S	.	.	H	α-helix	trans	-67.6	-42.4	172.6	-175.2	-108.2	0	0	0	111.5	L525 E579 C582 L583 H586 G587 P588 K592 Y593 T594	L525-W590 HydrophobicContact CD1-CE3 3.94Å; E579-W590 HydrophobicContact CB-CZ2 4.01Å; E579-W590 HydrophobicContact CG-CH2 4.5Å; E579-W590 HydrophobicContact CG-CZ2 3.76Å; C582-W590 HydrophobicContact CB-CD2 3.59Å; C582-W590 HydrophobicContact CB-CE3 3.52Å; C582-W590 HydrophobicContact CB-CG 4.33Å; C582-W590 HydrophobicContact CB-CH2 3.84Å; C582-W590 HydrophobicContact CB-CZ2 3.9Å; C582-W590 HydrophobicContact CB-CZ3 3.64Å; L583-W590 HydrophobicContact CB-CG 4.35Å; H586-W590 HydrophobicContact CB-CB 3.98Å; G587-W590 WeakPolarHBondContact O-CB 3.37Å; G587-W590 PolarHBondContact O-N 2.96Å; P588-W590 VanDerWaalsContact C-N 3.28Å; P588-W590 PolarHBondContact O-N 2.96Å; W590-K592 VanDerWaalsContact C-N 3.34Å; W590-K592 PolarHBondContact O-N 3.35Å; W590-Y593 HydrophobicContact CD2-CD1 4.4Å; W590-Y593 AromaticContact CE3-CD1 3.72Å; W590-Y593 HydrophobicContact CE3-CD1 3.72Å; W590-Y593 HydrophobicContact CE3-CE1 4.41Å; W590-Y593 HydrophobicContact CE3-CG 4.48Å; W590-Y593 AromaticContact CH2-CD1 3.86Å; W590-Y593 HydrophobicContact CH2-CD1 3.86Å; W590-Y593 AromaticContact CH2-CE1 3.82Å; W590-Y593 HydrophobicContact CH2-CE1 3.82Å; W590-Y593 HydrophobicContact CZ2-CD1 4.5Å; W590-Y593 AromaticContact CZ3-CD1 3.42Å; W590-Y593 HydrophobicContact CZ3-CD1 3.42Å; W590-Y593 VanDerWaalsContact CZ3-CD1 3.42Å; W590-Y593 AromaticContact CZ3-CE1 3.66Å; W590-Y593 HydrophobicContact CZ3-CE1 3.66Å; W590-Y593 HydrophobicContact CZ3-CG 4.46Å; W590-Y593 WeakPolarHBondContact O-CB 3.39Å; W590-Y593 PolarHBondContact O-N 2.85Å; W590-Y593 VanDerWaalsContact O-N 3.14Å; W590-T594 HydrophobicContact CD2-CG2 4.23Å; W590-T594 HydrophobicContact CG-CG2 4.4Å; W590-T594 HydrophobicContact CZ2-CG2 4.02Å; W590-T594 WeakPolarHBondContact O-CG2 3.41Å; W590-T594 PolarHBondContact O-N 2.94Å; W590-T594 PolarHBondContact O-OG1 3.06Å
591	Q	94.2	Very high	92.9	Very high	118 Å²	118	57.9 Å²	57.9	55%	0.551	30%	0.299	S	S	*	.	H	α-helix	trans	-60.6	-44.2	177.6	-67.4	174.8	-23.6	0	0	111.5	L583 G587 P588 Y593 T594 A595	L583-Q591 HydrophobicContact CD1-CG 4.05Å; G587-Q591 PolarHBondContact O-N 2.97Å; P588-Q591 PolarHBondContact O-N 3.41Å; Q591-Y593 PolarHBondContact O-N 3.04Å; Q591-T594 WeakPolarHBondContact CA-OG1 3.38Å; Q591-T594 PolarHBondContact O-N 3.46Å; Q591-T594 PolarHBondContact O-OG1 3.29Å; Q591-A595 PolarHBondContact O-N 3.02Å
592	K	94.5	Very high	92.9	Very high	128 Å²	128	60.6 Å²	60.6	56%	0.557	31%	0.312	S	S	*	.	H	α-helix	trans	-60.4	-44.6	172.8	-176.6	172.4	177.7	178.2	0	111.7	V517 P588 W590 T594 A595 L596	V517-K592 HydrophobicContact CG1-CB 4.23Å; V517-K592 HydrophobicContact CG1-CD 4.07Å; V517-K592 HydrophobicContact CG1-CG 4.26Å; V517-K592 HydrophobicContact CG2-CD 4.26Å; V517-K592 HydrophobicContact CG2-CG 4.1Å; P588-K592 PolarHBondContact O-N 3.21Å; W590-K592 VanDerWaalsContact C-N 3.34Å; W590-K592 PolarHBondContact O-N 3.35Å; K592-T594 PolarHBondContact O-N 3.21Å; K592-A595 PolarHBondContact O-N 2.98Å; K592-L596 HydrophobicContact CG-CD1 4.35Å; K592-L596 WeakPolarHBondContact O-CG 3.4Å; K592-L596 PolarHBondContact O-N 3.17Å; K592-L596 VanDerWaalsContact O-N 3.14Å
593	Y	95.7	Very high	92.8	Very high	6 Å²	6	61.2 Å²	61.2	2%	0.024	32%	0.315	C	S	.	.	H	α-helix	trans	-59.4	-45.4	175.6	174.8	-106.3	0	0	0	112.5	L525 L526 V527 W531 R535 A589 W590 Q591 A595 L596 V597	L525-Y593 HydrophobicContact CB-CD2 4.33Å; L525-Y593 HydrophobicContact CB-CG 4.49Å; L525-Y593 HydrophobicContact CD1-CG 4.24Å; L526-Y593 VanDerWaalsContact O-CE2 3.26Å; L526-Y593 WeakPolarHBondContact O-CE2 3.43Å; V527-Y593 HydrophobicContact CG1-CD2 4.41Å; V527-Y593 HydrophobicContact CG1-CE2 4.43Å; V527-Y593 HydrophobicContact CG2-CD2 4.09Å; V527-Y593 HydrophobicContact CG2-CE2 4.48Å; W531-Y593 PolarHBondContact O-OH 3.46Å; R535-Y593 HydrophobicContact CB-CE1 4.29Å; R535-Y593 HydrophobicContact CG-CE1 3.79Å; A589-Y593 WeakPolarHBondContact O-CB 3.17Å; A589-Y593 PolarHBondContact O-N 3Å; W590-Y593 HydrophobicContact CD2-CD1 4.4Å; W590-Y593 AromaticContact CE3-CD1 3.72Å; W590-Y593 HydrophobicContact CE3-CD1 3.72Å; W590-Y593 HydrophobicContact CE3-CE1 4.41Å; W590-Y593 HydrophobicContact CE3-CG 4.48Å; W590-Y593 AromaticContact CH2-CD1 3.86Å; W590-Y593 HydrophobicContact CH2-CD1 3.86Å; W590-Y593 AromaticContact CH2-CE1 3.82Å; W590-Y593 HydrophobicContact CH2-CE1 3.82Å; W590-Y593 HydrophobicContact CZ2-CD1 4.5Å; W590-Y593 AromaticContact CZ3-CD1 3.42Å; W590-Y593 HydrophobicContact CZ3-CD1 3.42Å; W590-Y593 VanDerWaalsContact CZ3-CD1 3.42Å; W590-Y593 AromaticContact CZ3-CE1 3.66Å; W590-Y593 HydrophobicContact CZ3-CE1 3.66Å; W590-Y593 HydrophobicContact CZ3-CG 4.46Å; W590-Y593 WeakPolarHBondContact O-CB 3.39Å; W590-Y593 PolarHBondContact O-N 2.85Å; W590-Y593 VanDerWaalsContact O-N 3.14Å; Q591-Y593 PolarHBondContact O-N 3.04Å; Y593-A595 VanDerWaalsContact C-N 3.28Å; Y593-A595 PolarHBondContact O-N 2.91Å; Y593-L596 PolarHBondContact O-N 3.2Å; Y593-V597 HydrophobicContact CD2-CG2 4.34Å; Y593-V597 HydrophobicContact CE2-CB 4.37Å; Y593-V597 HydrophobicContact CE2-CG2 3.81Å; Y593-V597 PolarHBondContact O-N 2.99Å
594	T	95.2	Very high	92.5	Very high	35 Å²	35	66.7 Å²	66.7	22%	0.215	34%	0.336	C	S	.	.	H	α-helix	trans	-69.2	-24.9	178.6	53.8	0	0	0	0	113.5	W590 Q591 K592 V597 P598	W590-T594 HydrophobicContact CD2-CG2 4.23Å; W590-T594 HydrophobicContact CG-CG2 4.4Å; W590-T594 HydrophobicContact CZ2-CG2 4.02Å; W590-T594 WeakPolarHBondContact O-CG2 3.41Å; W590-T594 PolarHBondContact O-N 2.94Å; W590-T594 PolarHBondContact O-OG1 3.06Å; Q591-T594 WeakPolarHBondContact CA-OG1 3.38Å; Q591-T594 PolarHBondContact O-N 3.46Å; Q591-T594 PolarHBondContact O-OG1 3.29Å; K592-T594 PolarHBondContact O-N 3.21Å; T594-V597 CarbonylContact O-C 3.48Å; T594-P598 WeakPolarHBondContact O-CA 3.43Å
595	A	94.7	Very high	92.2	Very high	76 Å²	76	65 Å²	65	63%	0.628	34%	0.342	S	S	*	.	H	α-helix	trans	-72.1	-36.1	172.5	0	0	0	0	0	111.7	Q591 K592 Y593	Q591-A595 PolarHBondContact O-N 3.02Å; K592-A595 PolarHBondContact O-N 2.98Å; Y593-A595 VanDerWaalsContact C-N 3.28Å; Y593-A595 PolarHBondContact O-N 2.91Å
596	L	94.5	Very high	91.9	Very high	76 Å²	76	62.8 Å²	62.8	40%	0.398	33%	0.332	S	S	.	.	H	α-helix	trans	-76.7	-36.9	176.4	-64.6	169.9	0	0	0	112.2	V517 V527 K592 Y593 P598	V517-L596 HydrophobicContact CG2-CD1 3.8Å; V527-L596 HydrophobicContact CG1-CB 3.75Å; V527-L596 HydrophobicContact CG1-CD1 3.99Å; V527-L596 HydrophobicContact CG2-CD1 4.25Å; K592-L596 HydrophobicContact CG-CD1 4.35Å; K592-L596 WeakPolarHBondContact O-CG 3.4Å; K592-L596 PolarHBondContact O-N 3.17Å; K592-L596 VanDerWaalsContact O-N 3.14Å; Y593-L596 PolarHBondContact O-N 3.2Å; L596-P598 WeakPolarHBondContact O-CD 3.48Å
597	V	95.6	Very high	91.9	Very high	1 Å²	1	65.1 Å²	65.1	1%	0.006	35%	0.345	C	S	.	.	S	Bend	trans	-121.3	81.2	-179.6	-167.4	0	0	0	0	109.1	V527 R535 Y593 T594 Y599	V527-V597 HydrophobicContact CG1-CG2 3.59Å; R535-V597 WeakPolarHBondContact CD-O 3.35Å; R535-V597 HydrophobicContact CG-CB 3.99Å; R535-V597 HydrophobicContact CG-CG1 3.72Å; R535-V597 WeakPolarHBondContact CG-O 3.28Å; R535-V597 PolarHBondContact NE-O 2.86Å; Y593-V597 HydrophobicContact CD2-CG2 4.34Å; Y593-V597 HydrophobicContact CE2-CB 4.37Å; Y593-V597 HydrophobicContact CE2-CG2 3.81Å; Y593-V597 PolarHBondContact O-N 2.99Å; T594-V597 CarbonylContact O-C 3.48Å; V597-Y599 PolarHBondContact O-N 3.15Å
598	P	93.9	Very high	92	Very high	60 Å²	60	67.4 Å²	67.4	39%	0.39	35%	0.351	S	S	.	.			trans	-69.4	-31.5	-172.4	24.4	-33	0	0	0	113.2	R535 T594 L596	R535-P598 PolarHBondContact NE-O 3.39Å; R535-P598 PolarHBondContact NH2-O 2.71Å; T594-P598 WeakPolarHBondContact O-CA 3.43Å; L596-P598 WeakPolarHBondContact O-CD 3.48Å
599	Y	95.4	Very high	92	Very high	81 Å²	81	65.7 Å²	65.7	32%	0.318	34%	0.336	S	S	.	.			trans	-90.1	137.6	-171.2	-49.8	-65.8	0	0	0	112.5	V534 R535 V597 P603 K604	V534-Y599 WeakPolarHBondContact CA-O 3.43Å; R535-Y599 WeakPolarHBondContact CG-O 3.4Å; R535-Y599 PolarHBondContact N-O 3.19Å; V597-Y599 PolarHBondContact O-N 3.15Å; Y599-P603 HydrophobicContact CD2-CB 3.93Å; Y599-P603 HydrophobicContact CE2-CB 4.17Å; Y599-P603 HydrophobicContact CG-CB 4.32Å; Y599-K604 VanDerWaalsContact CE1-CA 3.44Å
600	R	93.7	Very high	91.9	Very high	49 Å²	49	69.1 Å²	69.1	19%	0.185	35%	0.352	C	S	.	.	S	Bend	trans	-79.1	-52.6	177.6	-67.3	-179	166.9	160.8	-2.2	111.7	R535 H536 E579 F606	R535-R600 PolarHBondContact N-O 3.32Å; R535-R600 VanDerWaalsContact NH2-CG 3.32Å; H536-R600 PolarHBondContact N-O 3.03Å; H536-R600 VanDerWaalsContact N-O 3.07Å; E579-R600 VanDerWaalsContact CD-NE 3.27Å; E579-R600 WeakPolarHBondContact OE1-CG 3.38Å; E579-R600 IonicContact OE1-NE 3.03Å; E579-R600 PolarHBondContact OE1-NE 2.85Å; E579-R600 IonicContact OE2-CZ 3.18Å; E579-R600 IonicContact OE2-NE 3.67Å; E579-R600 PolarHBondContact OE2-NE 3.24Å; E579-R600 IonicContact OE2-NH2 3.11Å; E579-R600 PolarHBondContact OE2-NH2 3.34Å; R600-F606 HydrophobicContact CB-CD1 3.67Å; R600-F606 HydrophobicContact CB-CE1 3.81Å; R600-F606 HydrophobicContact CB-CG 4.43Å; R600-F606 WeakPolarHBondContact CB-OXT 3.46Å; R600-F606 VanDerWaalsContact CD-CZ 3.46Å; R600-F606 HydrophobicContact CG-CD1 4.36Å; R600-F606 HydrophobicContact CG-CE1 4.2Å; R600-F606 PolarHBondContact N-O 3.26Å; R600-F606 PolarHBondContact N-OXT 3.43Å; R600-F606 VanDerWaalsContact NH1-CZ 3.27Å
601	F	93.1	Very high	91.7	Very high	15 Å²	15	72.3 Å²	72.3	7%	0.066	37%	0.369	C	S	.	.	S	Bend	trans	-128.4	-49.1	-170.1	-63.4	-14.8	0	0	0	113.1	V534 H536 Y539 V540 I543 I571 I572 S575 F606	V534-F601 WeakPolarHBondContact CG1-O 2.97Å; H536-F601 HydrophobicContact CB-CD1 4.06Å; H536-F601 HydrophobicContact CB-CE1 3.77Å; Y539-F601 AromaticContact CD2-CE1 3.96Å; Y539-F601 HydrophobicContact CD2-CE1 3.96Å; Y539-F601 HydrophobicContact CD2-CZ 4.29Å; Y539-F601 HydrophobicContact CG-CE1 4.44Å; V540-F601 HydrophobicContact CG2-CB 3.86Å; V540-F601 HydrophobicContact CG2-CD1 4.25Å; V540-F601 HydrophobicContact CG2-CG 4.3Å; V540-F601 VanDerWaalsContact CG2-O 3.26Å; V540-F601 WeakPolarHBondContact CG2-O 3.34Å; I543-F601 HydrophobicContact CD1-CD2 3.9Å; I543-F601 HydrophobicContact CD1-CE2 3.88Å; I571-F601 HydrophobicContact CG2-CE2 4.26Å; I571-F601 HydrophobicContact CG2-CZ 3.88Å; I572-F601 HydrophobicContact CB-CE2 4.43Å; I572-F601 HydrophobicContact CG1-CD2 4.44Å; I572-F601 HydrophobicContact CG1-CE2 3.63Å; S575-F601 WeakPolarHBondContact OG-CZ 3.07Å; F601-F606 HydrophobicContact CB-CD1 4.28Å; F601-F606 AromaticContact CD2-CD1 3.68Å; F601-F606 HydrophobicContact CD2-CD1 3.68Å; F601-F606 AromaticContact CD2-CE1 3.97Å; F601-F606 HydrophobicContact CD2-CE1 3.97Å; F601-F606 HydrophobicContact CE2-CD1 4.16Å; F601-F606 AromaticContact CE2-CE1 3.96Å; F601-F606 HydrophobicContact CE2-CE1 3.96Å; F601-F606 AromaticContact CG-CD1 3.97Å; F601-F606 HydrophobicContact CG-CD1 3.97Å; F601-F606 HydrophobicContact CG-CE1 4.43Å; F601-F606 HydrophobicContact CZ-CE1 4.34Å; F601-F606 PolarHBondContact N-O 3.16Å
602	I	89	Confident	91.5	Very high	98 Å²	98	69.2 Å²	69.2	50%	0.503	36%	0.357	S	S	.	.	S	Bend	trans	-128.9	119.3	-173.5	-59.8	175	0	0	0	107.5	K604 V605 F606	I602-K604 PolarHBondContact O-N 2.84Å; I602-V605 HydrophobicContact CB-CB 4.03Å; I602-V605 HydrophobicContact CB-CG2 4.46Å; I602-V605 HydrophobicContact CG2-CB 3.95Å; I602-V605 HydrophobicContact CG2-CG2 3.82Å; I602-V605 PolarHBondContact O-N 3.27Å; I602-F606 PolarHBondContact N-O 3.26Å; I602-F606 PolarHBondContact O-N 3.02Å
603	P	87.7	Confident	91.3	Very high	37 Å²	37	65 Å²	65	24%	0.24	34%	0.343	C	S	.	.	T	Hydrogen-bonded Turn	trans	-51.8	136	176.5	-26.8	34.9	0	0	0	111.9	Y533 V534 Y599 V605	Y533-P603 HydrophobicContact CD1-CG 4.32Å; Y533-P603 HydrophobicContact CE1-CG 3.56Å; Y533-P603 HydrophobicContact CE2-CG 4.15Å; Y533-P603 VanDerWaalsContact CZ-CG 3.48Å; V534-P603 HydrophobicContact CG1-CG 4.3Å; Y599-P603 HydrophobicContact CD2-CB 3.93Å; Y599-P603 HydrophobicContact CE2-CB 4.17Å; Y599-P603 HydrophobicContact CG-CB 4.32Å; P603-V605 PolarHBondContact O-N 3.11Å
604	K	85.5	Confident	91	Very high	185 Å²	185	69.5 Å²	69.5	80%	0.804	37%	0.368	S	S	*	.	T	Hydrogen-bonded Turn	trans	67.4	-0.5	-178.9	-49.4	178.1	178.9	-179.8	0	115.9	Y599 I602	Y599-K604 VanDerWaalsContact CE1-CA 3.44Å; I602-K604 PolarHBondContact O-N 2.84Å
605	V	83.7	Confident	90.7	Very high	113 Å²	113	72.4 Å²	72.4	69%	0.685	38%	0.38	S	S	*	.	T	Hydrogen-bonded Turn	trans	-116.2	-52.2	178.8	-179.6	0	0	0	0	111.7	I602 P603	I602-V605 HydrophobicContact CB-CB 4.03Å; I602-V605 HydrophobicContact CB-CG2 4.46Å; I602-V605 HydrophobicContact CG2-CB 3.95Å; I602-V605 HydrophobicContact CG2-CG2 3.82Å; I602-V605 PolarHBondContact O-N 3.27Å; P603-V605 PolarHBondContact O-N 3.11Å
606	F	81.1	Confident	90.3	Very high	78 Å²	78	72.1 Å²	72.1	34%	0.342	36%	0.358	S	S	.	.			trans	-152.8	0	-176.2	-172.2	-111.8	0	0	0	112.7	I572 R600 F601 I602	I572-F606 HydrophobicContact CG2-CE1 4.34Å; I572-F606 HydrophobicContact CG2-CZ 4.06Å; R600-F606 HydrophobicContact CB-CD1 3.67Å; R600-F606 HydrophobicContact CB-CE1 3.81Å; R600-F606 HydrophobicContact CB-CG 4.43Å; R600-F606 WeakPolarHBondContact CB-OXT 3.46Å; R600-F606 VanDerWaalsContact CD-CZ 3.46Å; R600-F606 HydrophobicContact CG-CD1 4.36Å; R600-F606 HydrophobicContact CG-CE1 4.2Å; R600-F606 PolarHBondContact N-O 3.26Å; R600-F606 PolarHBondContact N-OXT 3.43Å; R600-F606 VanDerWaalsContact NH1-CZ 3.27Å; F601-F606 HydrophobicContact CB-CD1 4.28Å; F601-F606 AromaticContact CD2-CD1 3.68Å; F601-F606 HydrophobicContact CD2-CD1 3.68Å; F601-F606 AromaticContact CD2-CE1 3.97Å; F601-F606 HydrophobicContact CD2-CE1 3.97Å; F601-F606 HydrophobicContact CE2-CD1 4.16Å; F601-F606 AromaticContact CE2-CE1 3.96Å; F601-F606 HydrophobicContact CE2-CE1 3.96Å; F601-F606 AromaticContact CG-CD1 3.97Å; F601-F606 HydrophobicContact CG-CD1 3.97Å; F601-F606 HydrophobicContact CG-CE1 4.43Å; F601-F606 HydrophobicContact CZ-CE1 4.34Å; F601-F606 PolarHBondContact N-O 3.16Å; I602-F606 PolarHBondContact N-O 3.26Å; I602-F606 PolarHBondContact O-N 3.02Å

Retrieved 606 of 606 residues in 368.7 ms (Link to these results)

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