A0A096MB15_POEFO Loading...

TBC1 domain family member 14

AlphaFold DB , UniProt , Accession A0A096MB15, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 712 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	31.8	Very low	41.4	Very low	245 Å²	245	144.8 Å²	144.8	100%	1.207	82%	0.824	S	S	*	*				0	158.9	0	-78.1	177.1	166.1	0	0	108.8
2	A	33.5	Very low	40.7	Very low	102 Å²	102	144.8 Å²	144.8	84%	0.843	81%	0.814	S	S	*	*			trans	59.3	117.6	167.9	0	0	0	0	0	118.8
3	N	45.8	Very low	40.1	Very low	163 Å²	163	144.5 Å²	144.5	87%	0.872	81%	0.81	S	S	*	*			trans	-117.6	134.3	156.5	-141.8	4.7	0	0	0	106.2
4	P	67.6	Low	39.5	Very low	111 Å²	111	139.4 Å²	139.4	72%	0.721	81%	0.806	S	S	*	*				-153	171.1	125.9	35.6	-17.7	0	0	0	114.3
5	S	46.2	Very low	39.1	Very low	94 Å²	94	146.4 Å²	146.4	66%	0.657	81%	0.814	S	S	*	*			cis	-176.1	-177.8	-29.1	63	0	0	0	0	109.5
6	L	38.9	Very low	38.8	Very low	170 Å²	170	144.9 Å²	144.9	89%	0.89	82%	0.817	S	S	*	*			trans	75.1	144.6	162.3	-64.7	159.1	0	0	0	119.5
7	G	31.1	Very low	38.5	Very low	65 Å²	65	140.4 Å²	140.4	67%	0.67	81%	0.809	S	S	*	*			trans	-119.5	-164.4	165.6	0	0	0	0	0	110.8
8	P	55.3	Low	38.3	Very low	140 Å²	140	140.6 Å²	140.6	91%	0.909	81%	0.813	S	S	*	*				-150.6	-163.6	103.8	39.6	-20.7	0	0	0	116.6
9	Q	36.4	Very low	38	Very low	165 Å²	165	139.1 Å²	139.1	77%	0.771	81%	0.811	S	S	*	*			trans	-96.3	163	-153.5	-59.9	167.2	-43.7	0	0	118.5
10	K	35.7	Very low	37.8	Very low	181 Å²	181	137.2 Å²	137.2	79%	0.787	81%	0.812	S	S	*	*			trans	66.9	139.4	141.9	-81.6	173.2	175.4	-174.9	0	119.1
11	Q	32.8	Very low	37.5	Very low	157 Å²	157	133.9 Å²	133.9	73%	0.734	81%	0.808	S	S	*	*			cis	-170	149.1	47.7	-125.6	174.9	-54.4	0	0	110.8
12	M	34	Very low	37.6	Very low	144 Å²	144	128.6 Å²	128.6	71%	0.709	79%	0.789	S	S	*	*				54.6	142.2	112.8	-70	175.5	142.8	0	0	119
13	D	32.4	Very low	37.9	Very low	141 Å²	141	130.7 Å²	130.7	75%	0.754	79%	0.791	S	S	*	*			cis	-165	153.6	-1.1	-113.7	-20.4	0	0	0	114.5
14	G	31.7	Very low	37.2	Very low	74 Å²	74	128.7 Å²	128.7	76%	0.763	78%	0.784	S	S	*	*			trans	85.7	158.1	155.1	0	0	0	0	0	119.9
15	R	33.9	Very low	35.9	Very low	244 Å²	244	132.6 Å²	132.6	92%	0.921	79%	0.79	S	S	*	*			cis	-164.3	154.5	-5.6	-161	178.5	-171.4	-172.5	3.8	112.5
16	S	33.4	Very low	35.2	Very low	123 Å²	123	136.5 Å²	136.5	86%	0.86	80%	0.803	S	S	*	*			trans	74.4	142.6	166.1	74.4	0	0	0	0	119.2
17	G	34.3	Very low	34.7	Very low	67 Å²	67	131.5 Å²	131.5	69%	0.691	79%	0.793	S	S	*	*			cis	167.3	162.4	-12.7	0	0	0	0	0	115.2
18	V	35	Very low	34.6	Very low	145 Å²	145	133.9 Å²	133.9	88%	0.879	80%	0.799	S	S	*	*			trans	70.8	132.8	171.3	-178	0	0	0	0	114.7
19	S	32.7	Very low	33.4	Very low	111 Å²	111	135.5 Å²	135.5	78%	0.776	80%	0.799	S	S	*	*			cis	-170.3	168.9	-12.1	-102.7	0	0	0	0	107.2
20	A	33.5	Very low	33.2	Very low	101 Å²	101	131.4 Å²	131.4	84%	0.835	80%	0.801	S	S	*	*			cis	-153.6	-174.9	-4.8	0	0	0	0	0	106.7
21	G	31.5	Very low	32.9	Very low	69 Å²	69	129.8 Å²	129.8	71%	0.711	80%	0.801	S	S	*	*			cis	-154.7	164.4	-0.9	0	0	0	0	0	110.1
22	V	33.4	Very low	32.9	Very low	134 Å²	134	131 Å²	131	81%	0.812	80%	0.804	S	S	*	*			trans	-113.5	141.3	-150.4	170	0	0	0	0	115.2	V24	V22-V24 HydrophobicContact CG1-CG2 3.8Å
23	V	40.7	Very low	32.7	Very low	146 Å²	146	129.5 Å²	129.5	89%	0.885	81%	0.808	S	S	*	*			trans	-95.3	116.7	165.1	174.7	0	0	0	0	110.1
24	V	31.9	Very low	32.7	Very low	120 Å²	120	128.1 Å²	128.1	73%	0.727	81%	0.809	S	S	*	*			trans	-141.7	148	162	177.6	0	0	0	0	110.7	V22	V22-V24 HydrophobicContact CG1-CG2 3.8Å
25	K	39.8	Very low	32.8	Very low	193 Å²	193	129.3 Å²	129.3	84%	0.839	81%	0.811	S	S	*	*			trans	-43.6	157.4	169.5	-57.1	165.1	177.7	174.2	0	113.9
26	N	30.8	Very low	32.6	Very low	177 Å²	177	123.3 Å²	123.3	95%	0.947	81%	0.807	S	S	*	*			trans	-143.5	165.5	140.7	-119.9	-17.1	0	0	0	110
27	G	28.1	Very low	32.4	Very low	65 Å²	65	124.2 Å²	124.2	67%	0.67	80%	0.802	S	S	*	*			trans	-167.6	167.4	176.2	0	0	0	0	0	114.2
28	S	29	Very low	32.1	Very low	114 Å²	114	126.5 Å²	126.5	80%	0.797	81%	0.808	S	S	*	*			trans	87.3	142.7	173.5	-142.1	0	0	0	0	118.4
29	L	31.4	Very low	31.9	Very low	174 Å²	174	129.6 Å²	129.6	91%	0.911	81%	0.805	S	S	*	*			trans	66.7	104.3	162.4	-63.3	159.4	0	0	0	119.3
30	G	30.7	Very low	31.8	Very low	79 Å²	79	131.7 Å²	131.7	81%	0.814	81%	0.808	S	S	*	*			trans	-170.5	118.8	167.2	0	0	0	0	0	111.6
31	N	31	Very low	31.9	Very low	148 Å²	148	136.2 Å²	136.2	79%	0.791	81%	0.808	S	S	*	*			trans	-82.1	145	-162.2	-120.4	-32.9	0	0	0	115.6
32	K	31.5	Very low	32.7	Very low	183 Å²	183	138.5 Å²	138.5	80%	0.796	81%	0.81	S	S	*	*			trans	58.4	114.7	150.6	-61.9	175.5	-179.1	-178.8	0	120.9
33	S	30.5	Very low	32.4	Very low	112 Å²	112	137.1 Å²	137.1	78%	0.783	81%	0.807	S	S	*	*				-162.4	128.7	114.8	49	0	0	0	0	113.9
34	S	31.4	Very low	31.7	Very low	112 Å²	112	135.6 Å²	135.6	78%	0.783	80%	0.802	S	S	*	*			trans	36.1	115.7	152.8	54.2	0	0	0	0	123.2
35	A	33.9	Very low	31.6	Very low	98 Å²	98	134 Å²	134	81%	0.81	80%	0.801	S	S	*	*				74.2	90.8	123.5	0	0	0	0	0	121.9
36	S	31	Very low	31	Very low	118 Å²	118	133.6 Å²	133.6	83%	0.825	81%	0.807	S	S	*	*				-168.3	115	117.1	60.3	0	0	0	0	110.9
37	N	29.5	Very low	30.8	Very low	143 Å²	143	128.6 Å²	128.6	77%	0.765	80%	0.797	S	S	*	*	P	Polyproline II helix	trans	-87	122.9	177.6	-82.9	13.9	0	0	0	111.7
38	S	28	Very low	31	Very low	115 Å²	115	130.3 Å²	130.3	80%	0.804	80%	0.799	S	S	*	*	P	Polyproline II helix	trans	-82.3	141.9	150.2	53	0	0	0	0	109.6
39	Y	29.9	Very low	31.2	Very low	210 Å²	210	132.3 Å²	132.3	82%	0.824	80%	0.796	S	S	*	*	P	Polyproline II helix	trans	-102	151.7	171	-94.8	-84.2	0	0	0	112
40	D	31.3	Very low	31.1	Very low	155 Å²	155	130.5 Å²	130.5	83%	0.829	79%	0.786	S	S	*	*	P	Polyproline II helix	trans	-74.3	167.4	-178.6	-68.5	-74.3	0	0	0	114.8
41	K	34.8	Very low	31	Very low	195 Å²	195	132.5 Å²	132.5	85%	0.848	78%	0.782	S	S	*	*	P	Polyproline II helix	trans	-63.8	163.3	154.1	-72.2	178.6	174.8	177.1	0	109.7
42	P	48.5	Very low	31	Very low	117 Å²	117	133.6 Å²	133.6	76%	0.76	79%	0.787	S	S	*	*			cis	-147.1	-179.1	24.5	43.1	-23.5	0	0	0	118
43	S	27.3	Very low	31.3	Very low	106 Å²	106	129.8 Å²	129.8	74%	0.741	78%	0.781	S	S	*	*			trans	81.1	132.6	140.9	-139	0	0	0	0	122.5
44	C	26.4	Very low	31	Very low	114 Å²	114	128.9 Å²	128.9	77%	0.77	78%	0.775	S	S	*	*			trans	60.9	98.8	147.7	-71.7	0	0	0	0	123.5
45	A	28.3	Very low	30.8	Very low	87 Å²	87	133.8 Å²	133.8	72%	0.719	78%	0.778	S	S	*	*				97	150.7	100.9	0	0	0	0	0	122.3
46	L	28.5	Very low	30.8	Very low	184 Å²	184	138.1 Å²	138.1	96%	0.963	78%	0.778	S	S	*	*			trans	74.5	131.1	163.1	-73.1	154.1	0	0	0	119.2
47	G	26.7	Very low	30.8	Very low	71 Å²	71	138.8 Å²	138.8	73%	0.732	78%	0.78	S	S	*	*			trans	131.4	65.7	169.3	0	0	0	0	0	116.7
48	S	31.1	Very low	30.7	Very low	102 Å²	102	137.2 Å²	137.2	71%	0.713	78%	0.78	S	S	*	*			trans	26.2	144.5	139.6	-59.9	0	0	0	0	121.6
49	E	32.8	Very low	30.7	Very low	156 Å²	156	138.1 Å²	138.1	73%	0.729	79%	0.785	S	S	*	*			cis	-175.4	-174.2	-5.3	-117	159.6	94.5	0	0	107.1
50	L	29	Very low	30.6	Very low	135 Å²	135	133.1 Å²	133.1	71%	0.707	78%	0.78	S	S	*	*			cis	-155.2	146.8	6.3	-124.1	170.3	0	0	0	107.9
51	V	29.7	Very low	30.5	Very low	122 Å²	122	131.5 Å²	131.5	74%	0.739	78%	0.781	S	S	*	*			trans	46	130.2	155.7	172.4	0	0	0	0	122.5
52	L	31.2	Very low	30.3	Very low	171 Å²	171	128.2 Å²	128.2	90%	0.895	78%	0.778	S	S	*	*			trans	-147.9	130.7	157.9	-133.9	179.2	0	0	0	110
53	P	36.9	Very low	29.4	Very low	102 Å²	102	128.8 Å²	128.8	66%	0.662	78%	0.782	S	S	*	*			trans	-143	139.3	161.5	35.7	-18.5	0	0	0	116.7
54	S	25.7	Very low	29.4	Very low	93 Å²	93	130.3 Å²	130.3	65%	0.65	78%	0.78	S	S	*	*			trans	61.4	123	149	-167.8	0	0	0	0	120.5
55	Y	25.6	Very low	29.4	Very low	216 Å²	216	136.1 Å²	136.1	85%	0.847	79%	0.787	S	S	*	*				-167.3	167.1	96.1	-114	-85.1	0	0	0	113.5
56	K	35.2	Very low	29.3	Very low	189 Å²	189	141.7 Å²	141.7	82%	0.822	79%	0.791	S	S	*	*			trans	-75.9	164.1	177.3	-57.6	173.6	-179.1	176	0	112.1
57	P	31.2	Very low	29.2	Very low	131 Å²	131	138.6 Å²	138.6	85%	0.851	79%	0.785	S	S	*	*			trans	-120.8	152.3	138.2	36.7	-30	0	0	0	113
58	S	25.8	Very low	29.3	Very low	110 Å²	110	140.4 Å²	140.4	77%	0.769	79%	0.786	S	S	*	*			trans	-129.1	146.9	164.7	53.8	0	0	0	0	107.9
59	C	28.3	Very low	29.7	Very low	135 Å²	135	141.4 Å²	141.4	91%	0.912	79%	0.79	S	S	*	*			trans	-171.8	161.9	141.7	-108.2	0	0	0	0	112.2
60	S	28.8	Very low	29.5	Very low	104 Å²	104	142.8 Å²	142.8	73%	0.727	80%	0.797	S	S	*	*			trans	-118.6	171.3	-178.3	54.8	0	0	0	0	111.6
61	S	29.5	Very low	29.5	Very low	122 Å²	122	146.3 Å²	146.3	85%	0.853	81%	0.807	S	S	*	*			trans	-162.9	120.7	155.2	-85.3	0	0	0	0	110.6
62	T	29	Very low	29.3	Very low	126 Å²	126	148.1 Å²	148.1	77%	0.773	81%	0.812	S	S	*	*			trans	-135.4	146.9	169.8	47	0	0	0	0	109
63	P	31	Very low	29	Very low	129 Å²	129	146.4 Å²	146.4	84%	0.838	81%	0.813	S	S	*	*			trans	-69.2	163.2	176.2	30.3	-34.8	0	0	0	112.4
64	I	26.5	Very low	28.6	Very low	137 Å²	137	145.9 Å²	145.9	70%	0.703	81%	0.812	S	S	*	*			trans	-94.4	142	-164.4	-65.7	165.4	0	0	0	112	Y66	I64-Y66 HydrophobicContact CG2-CD2 3.97Å; I64-Y66 HydrophobicContact CG2-CE2 4.3Å
65	Y	26.6	Very low	28.7	Very low	236 Å²	236	147.8 Å²	147.8	93%	0.925	81%	0.814	S	S	*	*			trans	-112.4	137	152	-111.4	-91.7	0	0	0	109.1
66	Y	26.6	Very low	28.9	Very low	205 Å²	205	145.1 Å²	145.1	80%	0.804	81%	0.814	S	S	*	*			trans	-87.3	123.4	-177.5	-103.7	-94.9	0	0	0	111.9	I64	I64-Y66 HydrophobicContact CG2-CD2 3.97Å; I64-Y66 HydrophobicContact CG2-CE2 4.3Å
67	S	25.7	Very low	28.6	Very low	118 Å²	118	143.6 Å²	143.6	83%	0.825	82%	0.815	S	S	*	*			trans	-142.3	145.4	156.9	-78.4	0	0	0	0	108.3
68	S	28.7	Very low	29.4	Very low	109 Å²	109	142.6 Å²	142.6	76%	0.762	81%	0.808	S	S	*	*			trans	-148.1	154.9	178.3	-79.5	0	0	0	0	111.3
69	P	40.9	Very low	29.5	Very low	124 Å²	124	144.6 Å²	144.6	81%	0.805	81%	0.811	S	S	*	*			trans	-106.1	169	-142.6	39.1	-36.2	0	0	0	115.4
70	Q	27.9	Very low	29.8	Very low	184 Å²	184	148.8 Å²	148.8	86%	0.86	81%	0.807	S	S	*	*			trans	-61.8	153.5	170.9	-64.2	165.9	-41.7	0	0	112.7
71	K	28.5	Very low	29.9	Very low	210 Å²	210	151.9 Å²	151.9	91%	0.913	81%	0.81	S	S	*	*			trans	-130.5	137.1	156.9	-84.6	-172.5	173.6	-176.9	0	108.9
72	N	26	Very low	30	Very low	160 Å²	160	151 Å²	151	86%	0.856	80%	0.803	S	S	*	*			trans	-92.8	138.1	167.4	-72.8	2.1	0	0	0	110.2
73	C	25	Very low	30.1	Very low	134 Å²	134	152.7 Å²	152.7	91%	0.905	81%	0.807	S	S	*	*			trans	-152.9	155.5	141.1	-146.9	0	0	0	0	107.9
74	S	27.7	Very low	30	Very low	92 Å²	92	153.1 Å²	153.1	64%	0.643	81%	0.807	S	S	*	*			trans	-95.1	156.2	-177	54.5	0	0	0	0	111.8
75	D	27.6	Very low	30.3	Very low	132 Å²	132	151.6 Å²	151.6	71%	0.706	81%	0.809	S	S	*	*				176.1	143.5	108.9	-90.4	-0.5	0	0	0	114.1
76	L	29.8	Very low	30.6	Very low	161 Å²	161	149.5 Å²	149.5	84%	0.843	81%	0.807	S	S	*	*			trans	59.9	109.3	148.1	-59.7	170.6	0	0	0	122.1
77	D	29.4	Very low	30.8	Very low	157 Å²	157	146.5 Å²	146.5	84%	0.84	81%	0.805	S	S	*	*			trans	-60	174.9	144.5	-98.6	-42.7	0	0	0	113.3
78	P	47.6	Very low	31.1	Very low	110 Å²	110	146.2 Å²	146.2	71%	0.714	80%	0.803	S	S	*	*			cis	-133.2	-173.6	-15	38.3	-22	0	0	0	113
79	D	29	Very low	31.1	Very low	152 Å²	152	144.5 Å²	144.5	81%	0.813	80%	0.803	S	S	*	*			trans	-155.7	174.5	131.9	-135.3	-30.1	0	0	0	114.5
80	R	33.4	Very low	30.7	Very low	223 Å²	223	145.9 Å²	145.9	84%	0.842	80%	0.802	S	S	*	*			trans	-125.6	-169.6	-162	-118.6	175.7	170.4	-171.5	-3.4	114.5
81	H	32.3	Very low	31.2	Very low	169 Å²	169	143 Å²	143	78%	0.782	80%	0.799	S	S	*	*			trans	83.5	120.4	175.3	-49.7	-79	0	0	0	115.8
82	S	30.5	Very low	31.3	Very low	102 Å²	102	138.4 Å²	138.4	71%	0.713	79%	0.789	S	S	*	*			cis	102.1	122.4	4.1	-154.3	0	0	0	0	117.7
83	L	31.4	Very low	31.4	Very low	162 Å²	162	139 Å²	139	85%	0.848	79%	0.791	S	S	*	*			trans	69.5	159.2	174.9	-44	179.5	0	0	0	115.2
84	T	29.8	Very low	31.6	Very low	138 Å²	138	140.7 Å²	140.7	85%	0.847	79%	0.785	S	S	*	*			cis	-134.6	-176.9	10.4	47.9	0	0	0	0	113.1
85	S	32.7	Very low	31.8	Very low	105 Å²	105	144.3 Å²	144.3	73%	0.734	80%	0.796	S	S	*	*			trans	-107.5	159.1	-178.6	51.5	0	0	0	0	114.7
86	Q	31.8	Very low	31.8	Very low	193 Å²	193	145.4 Å²	145.4	90%	0.902	80%	0.802	S	S	*	*			trans	165.3	164.9	146.6	-94.1	170.1	-12.5	0	0	110.3
87	D	30.6	Very low	32.9	Very low	142 Å²	142	142.9 Å²	142.9	76%	0.759	80%	0.795	S	S	*	*			cis	-173.2	171	-38.9	-174.5	30.4	0	0	0	110.2
88	S	33	Very low	33.5	Very low	112 Å²	112	141 Å²	141	78%	0.783	79%	0.791	S	S	*	*			trans	74.9	141.4	168.1	76.8	0	0	0	0	118.7
89	G	28.3	Very low	32.7	Very low	73 Å²	73	142 Å²	142	75%	0.753	79%	0.791	S	S	*	*			cis	-171.5	173.9	-3	0	0	0	0	0	114.2
90	I	32.7	Very low	32.7	Very low	153 Å²	153	143.2 Å²	143.2	79%	0.785	79%	0.791	S	S	*	*			trans	-132.4	143	-176.3	-58.1	170.6	0	0	0	110
91	P	37.3	Very low	32.4	Very low	122 Å²	122	135.8 Å²	135.8	79%	0.792	78%	0.784	S	S	*	*				-134.2	121.5	128.2	33.3	-21	0	0	0	110.9
92	T	31.4	Very low	32.2	Very low	115 Å²	115	135.9 Å²	135.9	71%	0.706	78%	0.784	S	S	*	*				75.2	115.3	62.4	-56.4	0	0	0	0	114
93	L	29.1	Very low	32	Very low	171 Å²	171	139.7 Å²	139.7	90%	0.895	79%	0.791	S	S	*	*			trans	-162.2	144	144	-111.4	171.5	0	0	0	110.7
94	E	28.6	Very low	31.7	Very low	170 Å²	170	140.6 Å²	140.6	79%	0.794	79%	0.79	S	S	*	*			trans	-109.3	172.7	-178.2	-55.6	174.2	117.9	0	0	111.5
95	I	31.6	Very low	32.2	Very low	169 Å²	169	140 Å²	140	87%	0.867	79%	0.789	S	S	*	*				-178.2	156.7	129.4	-93	154.8	0	0	0	110.1
96	N	27.3	Very low	31.9	Very low	154 Å²	154	137.8 Å²	137.8	82%	0.824	78%	0.782	S	S	*	*			trans	-117.1	180	-160.7	-111.9	-20	0	0	0	114
97	P	52.2	Low	31.7	Very low	108 Å²	108	136.7 Å²	136.7	70%	0.701	78%	0.783	S	S	*	*			trans	-100.9	-168.2	-159.6	42.4	-41.2	0	0	0	115.5
98	P	44	Very low	31.6	Very low	118 Å²	118	134.1 Å²	134.1	77%	0.766	78%	0.781	S	S	*	*			trans	-140.2	124.6	150.6	36.3	-19.6	0	0	0	117.3
99	D	28.8	Very low	31.4	Very low	132 Å²	132	132.9 Å²	132.9	71%	0.706	78%	0.777	S	S	*	*				46.7	127.7	121.9	-63.5	8.3	0	0	0	126.9
100	H	29.6	Very low	31.5	Very low	176 Å²	176	137.9 Å²	137.9	82%	0.815	78%	0.781	S	S	*	*				56	145.6	127.8	-59.4	-46.7	0	0	0	125.3
101	G	26.9	Very low	31.3	Very low	67 Å²	67	137.4 Å²	137.4	69%	0.691	78%	0.78	S	S	*	*			trans	170.4	35.3	161.1	0	0	0	0	0	126.2
102	H	27.9	Very low	30.9	Very low	171 Å²	171	137.1 Å²	137.1	79%	0.792	78%	0.78	S	S	*	*			trans	51.2	149.5	152.6	-64	-83.3	0	0	0	126.9
103	H	26.6	Very low	31.7	Very low	182 Å²	182	137.4 Å²	137.4	84%	0.843	78%	0.784	S	S	*	*			trans	114.9	121.4	140.6	-74	-62.7	0	0	0	123
104	H	25.9	Very low	31.7	Very low	182 Å²	182	133 Å²	133	84%	0.843	77%	0.772	S	S	*	*			trans	-91.3	179.2	157.6	-92.4	-62.3	0	0	0	110.4
105	P	40.8	Very low	31.8	Very low	126 Å²	126	131.6 Å²	131.6	82%	0.818	78%	0.775	S	S	*	*			cis	-126.8	-154.3	13	47.8	-31.6	0	0	0	112.1
106	G	26.2	Very low	31.9	Very low	58 Å²	58	130.7 Å²	130.7	60%	0.598	77%	0.771	S	S	*	*			cis	171.7	174.6	-0.3	0	0	0	0	0	113.2
107	D	27.2	Very low	32.6	Very low	170 Å²	170	128.8 Å²	128.8	91%	0.909	77%	0.767	S	S	*	*			trans	58.8	162.4	161.8	-58.6	-19.9	0	0	0	119.8
108	A	28.6	Very low	31.6	Very low	88 Å²	88	130 Å²	130	73%	0.727	77%	0.767	S	S	*	*			cis	-167.7	161.4	-36.2	0	0	0	0	0	111.1
109	A	28.4	Very low	31.1	Very low	85 Å²	85	130.8 Å²	130.8	70%	0.702	77%	0.765	S	S	*	*			trans	65.5	130.3	148.3	0	0	0	0	0	124.5
110	E	30.2	Very low	31.1	Very low	178 Å²	178	132 Å²	132	83%	0.832	77%	0.772	S	S	*	*				88.5	142.2	128.6	-76.3	171.7	179.8	0	0	126
111	D	29	Very low	31.3	Very low	143 Å²	143	130.8 Å²	130.8	77%	0.765	77%	0.771	S	S	*	*			trans	69.8	97.7	147.3	-71.6	14.7	0	0	0	125.9
112	C	29.5	Very low	32.5	Very low	116 Å²	116	133 Å²	133	78%	0.784	77%	0.773	S	S	*	*				-52.4	158.4	127	-76.7	0	0	0	0	111.4
113	P	47.8	Very low	32.6	Very low	122 Å²	122	129.1 Å²	129.1	79%	0.792	77%	0.77	S	S	*	*				-158.9	-171	52.8	41.2	-17.6	0	0	0	119.1
114	A	29.4	Very low	32.7	Very low	77 Å²	77	128 Å²	128	64%	0.636	77%	0.771	S	S	*	*			trans	103.5	110.6	136.1	0	0	0	0	0	122.6
115	T	29.1	Very low	32.8	Very low	141 Å²	141	125.4 Å²	125.4	87%	0.865	77%	0.773	S	S	*	*				77.4	122.5	127.8	53.9	0	0	0	0	124.7
116	L	33.7	Very low	32.2	Very low	151 Å²	151	127.6 Å²	127.6	79%	0.791	78%	0.778	S	S	*	*			trans	-50.1	167	150	-62.6	168.8	0	0	0	113.6
117	P	42.7	Very low	32.3	Very low	114 Å²	114	128.5 Å²	128.5	74%	0.74	79%	0.788	S	S	*	*				-126.1	170.9	51.4	19.7	6.5	0	0	0	114
118	L	32.2	Very low	32.3	Very low	133 Å²	133	128.6 Å²	128.6	70%	0.696	79%	0.785	S	S	*	*				63.5	140.8	50.2	-61.4	174.5	0	0	0	112.4
119	D	31.8	Very low	32.3	Very low	135 Å²	135	131.6 Å²	131.6	72%	0.722	78%	0.783	S	S	*	*			cis	-150.9	179.3	23.9	-106.4	-44.9	0	0	0	114.4
120	D	29.6	Very low	32.2	Very low	158 Å²	158	137.9 Å²	137.9	85%	0.845	79%	0.789	S	S	*	*			trans	87.3	150.3	145.5	-91.5	-31.8	0	0	0	125.9
121	N	33.1	Very low	32.2	Very low	150 Å²	150	134.5 Å²	134.5	80%	0.802	79%	0.785	S	S	*	*			trans	-130.4	-172.1	177.1	-115.6	-43.6	0	0	0	107.1
122	P	52.3	Low	32.2	Very low	114 Å²	114	132.9 Å²	132.9	74%	0.74	78%	0.784	S	S	*	*			cis	-138.5	-164.7	5.3	40.9	-19.7	0	0	0	115.8
123	A	30.7	Very low	32.3	Very low	88 Å²	88	133.3 Å²	133.3	73%	0.727	78%	0.784	S	S	*	*			trans	95.4	124.4	143.4	0	0	0	0	0	123.2
124	D	29	Very low	31.2	Very low	159 Å²	159	136.3 Å²	136.3	85%	0.85	79%	0.785	S	S	*	*			trans	17.9	133.1	150.9	-61.3	-16.7	0	0	0	123.9
125	S	28.1	Very low	31.8	Very low	127 Å²	127	138.5 Å²	138.5	89%	0.888	79%	0.792	S	S	*	*				-174.8	161.7	120.2	37.9	0	0	0	0	114.6
126	N	27.6	Very low	31.8	Very low	172 Å²	172	143 Å²	143	92%	0.92	79%	0.793	S	S	*	*			trans	-81.4	152.6	179.2	-77.9	-65.6	0	0	0	113.6
127	G	28.7	Very low	31.7	Very low	78 Å²	78	142 Å²	142	80%	0.804	80%	0.8	S	S	*	*			trans	177	89.2	164.5	0	0	0	0	0	118.3
128	M	27.9	Very low	30.9	Very low	172 Å²	172	140.1 Å²	140.1	85%	0.847	80%	0.8	S	S	*	*			trans	-20	148.9	166.3	-104.5	87	74.2	0	0	119.1
129	H	27.5	Very low	30.7	Very low	150 Å²	150	144.6 Å²	144.6	69%	0.694	81%	0.81	S	S	*	*				-172.9	109.1	113.1	-111.7	-91.8	0	0	0	116.1
130	R	27.5	Very low	30.6	Very low	217 Å²	217	144.9 Å²	144.9	82%	0.819	81%	0.811	S	S	*	*			trans	61.8	150.5	146.8	-65.5	-179.3	-169.8	179.6	2	119
131	S	28.7	Very low	30.4	Very low	107 Å²	107	141.7 Å²	141.7	75%	0.748	80%	0.801	S	S	*	*			cis	-164.1	151.1	2.4	37.1	0	0	0	0	112.9
132	S	29.7	Very low	30.1	Very low	109 Å²	109	140.5 Å²	140.5	76%	0.762	80%	0.799	S	S	*	*			trans	45.6	140.5	143.3	-137.5	0	0	0	0	120.9
133	T	30.5	Very low	28.8	Very low	125 Å²	125	145.8 Å²	145.8	77%	0.767	80%	0.804	S	S	*	*			cis	-153.4	154.9	22.5	-40.5	0	0	0	0	111.9
134	F	26.2	Very low	28.6	Very low	185 Å²	185	150.1 Å²	150.1	81%	0.811	81%	0.809	S	S	*	*			trans	-79	179.5	170.6	-92.3	-96.1	0	0	0	112.1
135	P	40.7	Very low	28.4	Very low	123 Å²	123	151.9 Å²	151.9	80%	0.799	81%	0.809	S	S	*	*			cis	-137.6	167.9	16.8	36.7	-15.2	0	0	0	119.8
136	R	29.9	Very low	28.3	Very low	235 Å²	235	150.6 Å²	150.6	89%	0.887	80%	0.8	S	S	*	*			trans	-89.8	154.3	153.6	-71.9	174	163.4	-177.4	-5.1	109.9
137	S	31.6	Very low	28.5	Very low	132 Å²	132	148.7 Å²	148.7	92%	0.923	80%	0.798	S	S	*	*				174	156.2	127.4	-166	0	0	0	0	111.3
138	G	25.2	Very low	28.3	Very low	73 Å²	73	151.4 Å²	151.4	75%	0.753	80%	0.799	S	S	*	*			trans	159.7	79	172.6	0	0	0	0	0	115.8
139	Y	28.1	Very low	28.3	Very low	228 Å²	228	149.1 Å²	149.1	89%	0.894	79%	0.794	S	S	*	*			trans	-92.6	147.1	156.5	-100.6	-107.1	0	0	0	108.3
140	D	29.4	Very low	28.3	Very low	140 Å²	140	153.6 Å²	153.6	75%	0.749	81%	0.805	S	S	*	*				173.9	155.8	98.6	-137	-44.3	0	0	0	115
141	S	26.6	Very low	28.3	Very low	91 Å²	91	151 Å²	151	64%	0.636	81%	0.806	S	S	*	*			trans	62.5	105.1	143.4	-76.8	0	0	0	0	125.8
142	V	25.7	Very low	28.2	Very low	125 Å²	125	152.8 Å²	152.8	76%	0.758	81%	0.813	S	S	*	*				52.1	119.5	120.3	-172.7	0	0	0	0	121.2
143	R	26.5	Very low	28.1	Very low	226 Å²	226	152.8 Å²	152.8	85%	0.853	82%	0.819	S	S	*	*				-171.6	142.5	114.8	-101.7	177.3	-163.4	-157.4	1.9	113.7
144	H	25.2	Very low	28.1	Very low	179 Å²	179	151.9 Å²	151.9	83%	0.829	83%	0.825	S	S	*	*			trans	-89	151.2	168.3	-63.9	-91.7	0	0	0	111.2
145	F	24.6	Very low	28.2	Very low	195 Å²	195	149.3 Å²	149.3	86%	0.855	83%	0.83	S	S	*	*			trans	-146.5	146.3	156.8	-102.2	-80.1	0	0	0	111.1
146	S	25.8	Very low	27.6	Very low	100 Å²	100	147 Å²	147	70%	0.699	83%	0.829	S	S	*	*			trans	-124.9	141.6	175.2	-52.5	0	0	0	0	109.7
147	P	31.5	Very low	27.5	Very low	133 Å²	133	144 Å²	144	86%	0.864	83%	0.829	S	S	*	*	P	Polyproline II helix	trans	-84.2	130.1	174	32.3	-31.6	0	0	0	111.1
148	T	26	Very low	27.3	Very low	135 Å²	135	143.6 Å²	143.6	83%	0.828	83%	0.826	S	S	*	*	P	Polyproline II helix	trans	-101.7	134.3	171	-50.4	0	0	0	0	110.2
149	V	27.9	Very low	27.5	Very low	123 Å²	123	147.4 Å²	147.4	75%	0.745	84%	0.835	S	S	*	*	P	Polyproline II helix	trans	-68.2	138.5	177.9	178.1	0	0	0	0	111.1
150	R	27.5	Very low	27.4	Very low	244 Å²	244	140 Å²	140	92%	0.921	83%	0.828	S	S	*	*			trans	-129.6	132.2	157.6	-82.1	-168.7	171.2	-166	-1.7	110.5
151	L	27.6	Very low	27.2	Very low	163 Å²	163	137.5 Å²	137.5	85%	0.853	84%	0.835	S	S	*	*			trans	-98.5	132.6	172.7	-73.9	161.7	0	0	0	109.6
152	T	26.8	Very low	27.1	Very low	144 Å²	144	137 Å²	137	88%	0.883	84%	0.844	S	S	*	*			trans	-146.1	125.3	157.9	45.6	0	0	0	0	108.7
153	A	27.6	Very low	27.2	Very low	109 Å²	109	136.1 Å²	136.1	90%	0.901	85%	0.85	S	S	*	*			trans	-105.3	145.2	175.8	0	0	0	0	0	110.8
154	A	30	Very low	27.4	Very low	106 Å²	106	133.2 Å²	133.2	88%	0.876	85%	0.851	S	S	*	*			trans	-150.4	145.5	167.2	0	0	0	0	0	109.3
155	S	28.4	Very low	27.5	Very low	131 Å²	131	132.7 Å²	132.7	92%	0.916	85%	0.854	S	S	*	*			trans	-106.2	150.9	-168.7	-49.6	0	0	0	0	112.6
156	G	27.8	Very low	27.8	Very low	76 Å²	76	134 Å²	134	78%	0.784	85%	0.853	S	S	*	*			trans	-167.7	135.1	169.8	0	0	0	0	0	112.6
157	L	27.9	Very low	28	Very low	171 Å²	171	134.9 Å²	134.9	90%	0.895	86%	0.86	S	S	*	*			trans	-101.8	142.2	175.8	-75	73.4	0	0	0	110.3
158	S	27.4	Very low	28	Very low	123 Å²	123	134.5 Å²	134.5	86%	0.86	85%	0.85	S	S	*	*			trans	-166.4	151.8	135	50.6	0	0	0	0	113.2
159	V	28.3	Very low	28	Very low	153 Å²	153	136.2 Å²	136.2	93%	0.927	86%	0.855	S	S	*	*			trans	-76.5	145.8	-178.8	176	0	0	0	0	112
160	G	26.4	Very low	28.2	Very low	74 Å²	74	137.5 Å²	137.5	76%	0.763	86%	0.856	S	S	*	*			trans	171.3	106.4	165.2	0	0	0	0	0	114.4
161	G	25.6	Very low	28.2	Very low	87 Å²	87	130.8 Å²	130.8	90%	0.897	85%	0.846	S	S	*	*			trans	-81.1	169.6	-166.8	0	0	0	0	0	118.5
162	G	24.8	Very low	28.4	Very low	79 Å²	79	129.6 Å²	129.6	81%	0.814	85%	0.845	S	S	*	*			trans	113.2	147.6	144.6	0	0	0	0	0	118
163	A	27.3	Very low	28.4	Very low	108 Å²	108	128 Å²	128	89%	0.893	84%	0.839	S	S	*	*			trans	69.5	129.1	163.6	0	0	0	0	0	119.5
164	L	30.7	Very low	28.4	Very low	164 Å²	164	128 Å²	128	86%	0.859	83%	0.832	S	S	*	*			trans	-69.8	143.2	169.9	-63.3	149.5	0	0	0	111.2
165	N	28.7	Very low	28.5	Very low	168 Å²	168	129.6 Å²	129.6	90%	0.898	83%	0.83	S	S	*	*				-160.8	161.3	120.6	-115.1	-29.7	0	0	0	113.5
166	R	30.8	Very low	28.6	Very low	222 Å²	222	128.1 Å²	128.1	84%	0.838	82%	0.82	S	S	*	*			trans	-87	149.7	175.8	-73.2	173.8	163.6	147.9	-9.8	111.6
167	S	29.6	Very low	28.8	Very low	120 Å²	120	129.5 Å²	129.5	84%	0.839	82%	0.818	S	S	*	*			trans	-153.2	126.4	150.8	47.6	0	0	0	0	107.9
168	D	30.2	Very low	28.9	Very low	124 Å²	124	128.4 Å²	128.4	66%	0.663	81%	0.81	S	S	*	*			trans	-92.9	139.1	-169.9	-52.2	-84.9	0	0	0	112.2
169	D	26.5	Very low	29.2	Very low	172 Å²	172	127.7 Å²	127.7	92%	0.92	81%	0.805	S	S	*	*			trans	-140.6	89.8	164.2	-104.1	-42.8	0	0	0	108.3
170	I	32.3	Very low	29.5	Very low	150 Å²	150	125.4 Å²	125.4	77%	0.769	79%	0.791	S	S	*	*			trans	-93.1	106.6	-177.7	-65.7	178.3	0	0	0	109.8
171	S	27	Very low	30.1	Very low	103 Å²	103	127.8 Å²	127.8	72%	0.72	78%	0.783	S	S	*	*			trans	-64.7	129.4	167.8	180	0	0	0	0	110.9	C173	S171-C173 PolarHBondContact O-N 3.08Å
172	V	32.9	Very low	30.3	Very low	138 Å²	138	131.3 Å²	131.3	84%	0.836	78%	0.78	S	S	*	*			trans	-73.9	118.8	177.8	-73.9	0	0	0	0	112.1
173	C	26.7	Very low	30.7	Very low	110 Å²	110	131.9 Å²	131.9	74%	0.743	77%	0.772	S	S	*	*			trans	-141	136.5	169.5	-77.9	0	0	0	0	111.3	S171	S171-C173 PolarHBondContact O-N 3.08Å
174	S	28.1	Very low	30.7	Very low	108 Å²	108	132.2 Å²	132.2	76%	0.755	76%	0.762	S	S	*	*			trans	46.7	100	161.4	-56.2	0	0	0	0	118.5	S176	S174-S176 PolarHBondContact O-N 2.9Å
175	V	30.7	Very low	30.6	Very low	140 Å²	140	129.2 Å²	129.2	85%	0.848	76%	0.755	S	S	*	*			trans	-72.6	97	167.6	-166.3	0	0	0	0	109.4
176	S	31	Very low	30.8	Very low	101 Å²	101	128.7 Å²	128.7	71%	0.706	75%	0.752	S	S	*	*			trans	-135.3	31.5	177.2	-53.9	0	0	0	0	112.2	S174	S174-S176 PolarHBondContact O-N 2.9Å
177	S	31.6	Very low	31	Very low	105 Å²	105	125.3 Å²	125.3	73%	0.734	75%	0.746	S	S	*	*			trans	-127.9	48.3	-179.2	-54.9	0	0	0	0	111.9
178	M	30.7	Very low	31.3	Very low	147 Å²	147	126.6 Å²	126.6	72%	0.724	74%	0.744	S	S	*	*			trans	-103.4	50.8	165.6	-72.6	-143.2	69.7	0	0	111.5
179	S	34.3	Very low	31.5	Very low	108 Å²	108	128.5 Å²	128.5	76%	0.755	75%	0.752	S	S	*	*			trans	-112.7	35.4	160.4	-55.3	0	0	0	0	110.1	E181	S179-E181 VanDerWaalsContact C-N 3.27Å; S179-E181 PolarHBondContact O-N 2.89Å; S179-E181 VanDerWaalsContact O-N 3.07Å
180	T	34.3	Very low	31.6	Very low	105 Å²	105	128.3 Å²	128.3	64%	0.644	75%	0.75	S	S	*	*			trans	-77.6	81.4	166.5	48.6	0	0	0	0	109	L182	T180-L182 PolarHBondContact O-N 3.44Å; T180-L182 VanDerWaalsContact O-N 3.15Å
181	E	39.1	Very low	31.4	Very low	125 Å²	125	128.5 Å²	128.5	58%	0.584	75%	0.753	S	S	*	*			trans	-46.2	114.1	168	-91.6	-70.5	122.5	0	0	111.3	S179 S183	S179-E181 VanDerWaalsContact C-N 3.27Å; S179-E181 PolarHBondContact O-N 2.89Å; S179-E181 VanDerWaalsContact O-N 3.07Å; E181-S183 PolarHBondContact O-N 2.79Å; E181-S183 PolarHBondContact OE2-OG 3.15Å
182	L	30	Very low	31.4	Very low	160 Å²	160	132.5 Å²	132.5	84%	0.838	76%	0.757	S	S	*	*			trans	-79.6	44.9	170.8	-78.7	173.6	0	0	0	111.4	T180 V184	T180-L182 PolarHBondContact O-N 3.44Å; T180-L182 VanDerWaalsContact O-N 3.15Å; L182-V184 PolarHBondContact O-N 3.39Å
183	S	32.8	Very low	31.2	Very low	92 Å²	92	131.2 Å²	131.2	64%	0.643	75%	0.75	S	S	*	*			trans	-73.6	69.5	173.2	-84.9	0	0	0	0	110.6	E181 S185	E181-S183 PolarHBondContact O-N 2.79Å; E181-S183 PolarHBondContact OE2-OG 3.15Å; S183-S185 PolarHBondContact O-N 3.5Å
184	V	26.5	Very low	31.3	Very low	114 Å²	114	132.5 Å²	132.5	69%	0.691	76%	0.755	S	S	*	*			trans	-72.9	105.6	167.3	-179.1	0	0	0	0	107.9	L182 N186	L182-V184 PolarHBondContact O-N 3.39Å; V184-N186 PolarHBondContact O-N 3.2Å
185	S	29.8	Very low	31.2	Very low	102 Å²	102	133.3 Å²	133.3	71%	0.713	76%	0.755	S	S	*	*			trans	-72.7	89.6	-175.6	61.2	0	0	0	0	112.3	S183 E187	S183-S185 PolarHBondContact O-N 3.5Å; S185-E187 PolarHBondContact O-N 2.88Å
186	N	31.4	Very low	31.1	Very low	156 Å²	156	131.8 Å²	131.8	83%	0.834	75%	0.75	S	S	*	*			trans	-78	56.6	163.2	-76.2	-10.1	0	0	0	110.6	V184	V184-N186 PolarHBondContact O-N 3.2Å
187	E	36.7	Very low	30.8	Very low	151 Å²	151	134.4 Å²	134.4	71%	0.706	76%	0.756	S	S	*	*			trans	-117.5	74.4	179.8	-81.9	-81.7	136.4	0	0	108.5	S185	S185-E187 PolarHBondContact O-N 2.88Å
188	D	34.3	Very low	30.6	Very low	148 Å²	148	134.1 Å²	134.1	79%	0.791	76%	0.755	S	S	*	*			trans	-173.5	71.6	164.2	-100	-29.7	0	0	0	110.5
189	I	34.7	Very low	30.4	Very low	164 Å²	164	132.6 Å²	132.6	84%	0.841	76%	0.759	S	S	*	*			trans	-178.5	105.1	148.7	-91	148.5	0	0	0	107.2
190	L	29.4	Very low	30.1	Very low	168 Å²	168	132.3 Å²	132.3	88%	0.88	76%	0.763	S	S	*	*			trans	173.8	61.9	146.6	-96.8	-177.8	0	0	0	108.9
191	D	28.3	Very low	29.7	Very low	153 Å²	153	134.7 Å²	134.7	82%	0.818	77%	0.77	S	S	*	*			trans	-105.5	98	162.6	-172.1	15.8	0	0	0	107.6
192	F	26.8	Very low	28.9	Very low	187 Å²	187	134.8 Å²	134.8	82%	0.82	78%	0.778	S	S	*	*			trans	-143.7	123.9	173.2	-115.1	-81	0	0	0	110.2	V194	F192-V194 PolarHBondContact O-N 2.96Å
193	T	29.1	Very low	28.7	Very low	112 Å²	112	133.3 Å²	133.3	69%	0.687	78%	0.776	S	S	*	*			trans	-66.4	123.5	-179.1	49.3	0	0	0	0	111.2	T195	T193-T195 PolarHBondContact O-N 3.05Å
194	V	27	Very low	28.3	Very low	137 Å²	137	136 Å²	136	83%	0.83	78%	0.783	S	S	*	*			trans	-73.6	96.7	170.8	-179	0	0	0	0	109.5	F192	F192-V194 PolarHBondContact O-N 2.96Å
195	T	27.2	Very low	28.3	Very low	125 Å²	125	139.7 Å²	139.7	77%	0.767	79%	0.792	S	S	*	*			trans	-100.2	108.9	157.5	53.3	0	0	0	0	108.3	T193	T193-T195 PolarHBondContact O-N 3.05Å
196	S	27.9	Very low	28.1	Very low	107 Å²	107	139.4 Å²	139.4	75%	0.748	79%	0.787	S	S	*	*			trans	-65	133.9	178.4	-48.8	0	0	0	0	111.7
197	D	24.7	Very low	27.8	Very low	156 Å²	156	139.6 Å²	139.6	83%	0.834	79%	0.787	S	S	*	*				-164.5	168.4	128.6	-129.7	-34	0	0	0	114.2
198	S	26.9	Very low	27.4	Very low	100 Å²	100	139 Å²	139	70%	0.699	79%	0.788	S	S	*	*			trans	65.3	95.1	161.6	-64.6	0	0	0	0	120
199	S	27.6	Very low	27.1	Very low	115 Å²	115	137.9 Å²	137.9	80%	0.804	79%	0.793	S	S	*	*			trans	-8.9	137.1	138.9	54.4	0	0	0	0	119.3
200	A	26.8	Very low	26.7	Very low	102 Å²	102	133.2 Å²	133.2	84%	0.843	79%	0.785	S	S	*	*			trans	-112.5	146.3	158.2	0	0	0	0	0	110.9
201	I	25.9	Very low	26.5	Very low	155 Å²	155	131.4 Å²	131.4	80%	0.795	79%	0.786	S	S	*	*			trans	-92	141.3	-174.2	-66.4	173.2	0	0	0	110.7	T203	I201-T203 PolarHBondContact O-N 3.22Å
202	V	23.6	Very low	26.6	Very low	126 Å²	126	128.6 Å²	128.6	76%	0.764	78%	0.784	S	S	*	*			trans	-83.3	109	171.5	178.1	0	0	0	0	109.8
203	T	26.1	Very low	26.5	Very low	129 Å²	129	128.2 Å²	128.2	79%	0.791	79%	0.785	S	S	*	*			trans	-84.2	107.4	165.8	46.3	0	0	0	0	110	I201	I201-T203 PolarHBondContact O-N 3.22Å
204	L	23.1	Very low	26.3	Very low	149 Å²	149	130.2 Å²	130.2	78%	0.78	78%	0.784	S	S	*	*			trans	-82.4	115	164.9	-90.9	152.6	0	0	0	109
205	E	27.2	Very low	26.3	Very low	191 Å²	191	129.5 Å²	129.5	89%	0.893	79%	0.785	S	S	*	*			trans	-86.7	147.4	157.9	-70.6	-170.8	144.1	0	0	109.5
206	T	25.8	Very low	26.2	Very low	97 Å²	97	130 Å²	130	60%	0.595	78%	0.783	S	S	*	*			trans	-144.9	116.5	-166.3	-65	0	0	0	0	110.2	L208	T206-L208 HydrophobicContact CG2-CD1 4.3Å; T206-L208 HydrophobicContact CG2-CG 4.08Å
207	D	24.7	Very low	26.1	Very low	159 Å²	159	131.6 Å²	131.6	85%	0.85	79%	0.788	S	S	*	*			trans	-153.6	119.5	155.9	-88.2	-44	0	0	0	106.1
208	L	28.2	Very low	26.1	Very low	138 Å²	138	128.3 Å²	128.3	72%	0.723	78%	0.782	S	S	*	*			cis	104.2	134.2	30.8	-76.8	173.6	0	0	0	113.5	T206	T206-L208 HydrophobicContact CG2-CD1 4.3Å; T206-L208 HydrophobicContact CG2-CG 4.08Å
209	S	28.3	Very low	26	Very low	126 Å²	126	132.1 Å²	132.1	88%	0.881	79%	0.794	S	S	*	*			trans	73.5	122.8	-179.5	75.9	0	0	0	0	117.4
210	G	25.4	Very low	25.9	Very low	66 Å²	66	132 Å²	132	68%	0.68	79%	0.793	S	S	*	*			cis	178.8	157.3	-12	0	0	0	0	0	117.3
211	S	26.7	Very low	25.9	Very low	129 Å²	129	132.5 Å²	132.5	90%	0.902	79%	0.791	S	S	*	*			trans	63.5	146.3	163.5	68.9	0	0	0	0	118.4
212	A	28.6	Very low	26	Very low	95 Å²	95	131 Å²	131	79%	0.785	79%	0.791	S	S	*	*			cis	-139	167.9	12.1	0	0	0	0	0	114.5
213	H	26.4	Very low	26.2	Very low	179 Å²	179	132.7 Å²	132.7	83%	0.829	80%	0.795	S	S	*	*			trans	-46.6	145.2	173.8	-72.8	-96.2	0	0	0	114.3
214	F	23.4	Very low	26.8	Very low	154 Å²	154	132.5 Å²	132.5	68%	0.675	80%	0.796	S	S	*	*			cis	73.7	112.3	18.5	-153.9	-76.5	0	0	0	117.4	D216	F214-D216 HydrophobicContact CE1-CB 4.21Å; F214-D216 WeakPolarHBondContact CE1-OD2 3.42Å; F214-D216 WeakPolarHBondContact CZ-OD2 3.43Å
215	S	27.3	Very low	27	Very low	121 Å²	121	128.9 Å²	128.9	85%	0.846	79%	0.794	S	S	*	*			trans	-146.8	103.9	168.8	-65.5	0	0	0	0	111.7
216	D	25.1	Very low	26.9	Very low	135 Å²	135	127 Å²	127	72%	0.722	79%	0.79	S	S	*	*			trans	-76	148.3	159.3	-83.8	-41.2	0	0	0	110.4	F214	F214-D216 HydrophobicContact CE1-CB 4.21Å; F214-D216 WeakPolarHBondContact CE1-OD2 3.42Å; F214-D216 WeakPolarHBondContact CZ-OD2 3.43Å
217	V	25.6	Very low	27	Very low	141 Å²	141	130.7 Å²	130.7	86%	0.855	80%	0.798	S	S	*	*			trans	-139.1	128.5	153	-176.8	0	0	0	0	109.4
218	A	26.6	Very low	27.1	Very low	87 Å²	87	133.6 Å²	133.6	72%	0.719	80%	0.797	S	S	*	*			trans	-76.2	158	-178.2	0	0	0	0	0	113.4	S220	A218-S220 PolarHBondContact O-N 3.05Å
219	L	23.2	Very low	27.1	Very low	180 Å²	180	132 Å²	132	94%	0.942	80%	0.798	S	S	*	*			trans	-68.4	127.1	172	-66	171.3	0	0	0	111
220	S	26.3	Very low	27.1	Very low	112 Å²	112	132.7 Å²	132.7	78%	0.783	80%	0.797	S	S	*	*			trans	-145.4	120.4	168.6	-75.2	0	0	0	0	109.6	A218	A218-S220 PolarHBondContact O-N 3.05Å
221	S	26.3	Very low	27.2	Very low	114 Å²	114	133 Å²	133	80%	0.797	80%	0.8	S	S	*	*	P	Polyproline II helix	trans	-91.2	124.7	-173.1	53.7	0	0	0	0	112.5
222	P	28.6	Very low	27.4	Very low	123 Å²	123	139.3 Å²	139.3	80%	0.799	80%	0.804	S	S	*	*	P	Polyproline II helix	trans	-80.9	148.3	170.5	-11.2	28.6	0	0	0	112.9
223	L	26.9	Very low	27.3	Very low	162 Å²	162	138.2 Å²	138.2	85%	0.848	80%	0.802	S	S	*	*	P	Polyproline II helix	trans	-91	170.7	161.8	-111.1	81.7	0	0	0	110.8
224	P	39.5	Very low	27.7	Very low	125 Å²	125	141.4 Å²	141.4	81%	0.812	81%	0.806	S	S	*	*	P	Polyproline II helix	trans	-92.3	171.3	-158.8	37.2	-39	0	0	0	116
225	G	26.3	Very low	28.6	Very low	72 Å²	72	139.6 Å²	139.6	74%	0.742	81%	0.81	S	S	*	*			trans	-148.2	143.7	166.6	0	0	0	0	0	112
226	D	26.7	Very low	28.6	Very low	151 Å²	151	137.1 Å²	137.1	81%	0.807	80%	0.804	S	S	*	*			trans	-72.1	156.5	-168.3	-60.2	-77.6	0	0	0	116
227	F	26.3	Very low	28.8	Very low	175 Å²	175	137.7 Å²	137.7	77%	0.768	81%	0.812	S	S	*	*				-174.5	150.6	98.7	-111.2	-91.4	0	0	0	114.6
228	R	28.1	Very low	28.8	Very low	220 Å²	220	134.9 Å²	134.9	83%	0.83	81%	0.812	S	S	*	*			trans	-14.9	144.3	167	-62	172.2	178.1	175.6	-2.3	116.8
229	S	27.2	Very low	28.8	Very low	105 Å²	105	134.5 Å²	134.5	73%	0.734	82%	0.817	S	S	*	*			cis	-163.9	-170	15	-136.1	0	0	0	0	108.9
230	T	28.7	Very low	28.9	Very low	140 Å²	140	134.4 Å²	134.4	86%	0.859	81%	0.814	S	S	*	*			cis	-159.5	168.2	15.4	-20.8	0	0	0	0	110.2
231	G	28.4	Very low	28.9	Very low	72 Å²	72	136.8 Å²	136.8	74%	0.742	81%	0.813	S	S	*	*			trans	125.3	122.5	154.7	0	0	0	0	0	116.9
232	R	30.4	Very low	28.9	Very low	263 Å²	263	137.8 Å²	137.8	99%	0.992	81%	0.808	S	S	*	*			trans	-70.3	148.2	-179.2	-57	168.5	174.5	-173.4	-2.8	112.4
233	G	27	Very low	28.9	Very low	71 Å²	71	139 Å²	139	73%	0.732	81%	0.808	S	S	*	*			cis	142.6	165.8	-15.2	0	0	0	0	0	116.4
234	R	33.8	Very low	28.9	Very low	246 Å²	246	139 Å²	139	93%	0.928	81%	0.809	S	S	*	*			trans	77.3	158.7	160.6	-102.1	-158.1	172.8	-146.9	-2.4	118.7
235	P	42.3	Very low	28.4	Very low	116 Å²	116	136.1 Å²	136.1	75%	0.753	80%	0.801	S	S	*	*				-138.5	-178.9	-109.6	43.9	-25.8	0	0	0	116.3
236	G	27.4	Very low	28.5	Very low	70 Å²	70	142.4 Å²	142.4	72%	0.722	81%	0.808	S	S	*	*			trans	-163.1	132.5	166.3	0	0	0	0	0	114
237	T	29.4	Very low	28.6	Very low	146 Å²	146	143.2 Å²	143.2	90%	0.896	81%	0.812	S	S	*	*			trans	-36.9	151.8	164.9	46.6	0	0	0	0	115.3
238	G	24.8	Very low	28.8	Very low	82 Å²	82	144.7 Å²	144.7	85%	0.845	82%	0.818	S	S	*	*			cis	122.5	123.3	12.5	0	0	0	0	0	110.8
239	G	26.8	Very low	28.9	Very low	80 Å²	80	144.1 Å²	144.1	83%	0.825	82%	0.822	S	S	*	*			trans	177.5	156.8	-176.9	0	0	0	0	0	111.9
240	M	25.3	Very low	29.2	Very low	177 Å²	177	146.2 Å²	146.2	87%	0.872	82%	0.824	S	S	*	*			trans	-118.5	156.7	-173.6	-67.6	166.7	54.7	0	0	112.4
241	Q	26.3	Very low	29.2	Very low	163 Å²	163	142.2 Å²	142.2	76%	0.762	81%	0.81	S	S	*	*			trans	108	130.3	133	-158.5	167.4	0.1	0	0	120.3
242	L	25.8	Very low	29.4	Very low	135 Å²	135	143 Å²	143	71%	0.707	81%	0.81	S	S	*	*			trans	73.6	136	156.7	-84.4	164.2	0	0	0	122.7
243	D	28.7	Very low	30	Very low	147 Å²	147	134.2 Å²	134.2	79%	0.786	78%	0.779	S	S	*	*			trans	19.6	130.7	156.7	-71.3	-17.3	0	0	0	122.1
244	D	26.8	Very low	30.3	Very low	164 Å²	164	134.1 Å²	134.1	88%	0.877	77%	0.767	S	S	*	*				-160.2	154.4	89.8	-149.8	-19.3	0	0	0	112.8	K246	D244-K246 PolarHBondContact O-N 2.76Å
245	G	29.2	Very low	30.5	Very low	63 Å²	63	127.9 Å²	127.9	65%	0.649	75%	0.752	S	S	*	*			trans	-91.3	92.1	-173.3	0	0	0	0	0	114.4
246	K	29.1	Very low	30.6	Very low	204 Å²	204	125.8 Å²	125.8	89%	0.887	73%	0.734	S	S	*	*	P	Polyproline II helix	trans	-64.8	135.2	178.8	-84.6	-178.5	173.9	174.9	0	113.9	D244	D244-K246 PolarHBondContact O-N 2.76Å
247	L	28.9	Very low	31.3	Very low	168 Å²	168	125.8 Å²	125.8	88%	0.88	71%	0.714	S	S	*	*	P	Polyproline II helix	trans	-56.2	141.1	-179.5	-80.1	70.9	0	0	0	112.8	K249	L247-K249 PolarHBondContact O-N 3.41Å
248	K	30.8	Very low	31.5	Very low	206 Å²	206	125.5 Å²	125.5	90%	0.896	71%	0.707	S	S	*	*	P	Polyproline II helix	trans	-73.1	126	167.8	-73.3	-179.3	177.5	176.7	0	110.4	L250	K248-L250 PolarHBondContact O-N 3.15Å
249	K	29.1	Very low	32	Very low	209 Å²	209	129.9 Å²	129.9	91%	0.909	70%	0.698	S	S	*	*	P	Polyproline II helix	trans	-59.9	117.9	177.6	-172	177.6	-176.6	179.4	0	110.6	L247	L247-K249 PolarHBondContact O-N 3.41Å
250	L	34.1	Very low	32.2	Very low	149 Å²	149	131.9 Å²	131.9	78%	0.78	69%	0.69	S	S	*	*	P	Polyproline II helix	trans	-64.4	144.9	174.8	-92.3	161.1	0	0	0	111.3	K248	K248-L250 PolarHBondContact O-N 3.15Å
251	G	29	Very low	32.8	Very low	55 Å²	55	129.6 Å²	129.6	57%	0.567	68%	0.68	S	S	*	*	P	Polyproline II helix	trans	-76.3	172	-173.4	0	0	0	0	0	114.7	F253	G251-F253 WeakPolarHBondContact O-CD2 3.36Å
252	A	33.6	Very low	33	Very low	89 Å²	89	131.1 Å²	131.1	74%	0.736	69%	0.685	S	S	*	*	P	Polyproline II helix	trans	-74.6	126.7	-177.9	0	0	0	0	0	112.5	S254	A252-S254 VanDerWaalsContact C-N 3.32Å
253	F	42.1	Very low	33.1	Very low	78 Å²	78	129.1 Å²	129.1	34%	0.342	69%	0.688	S	S	.	*	G	3₁₀ helix	trans	-83.9	-1.8	179.4	-71.1	-94	0	0	0	114.1	G251 N255 L256 H565	G251-F253 WeakPolarHBondContact O-CD2 3.36Å; F253-N255 PolarHBondContact O-N 3.01Å; F253-L256 HydrophobicContact CD1-CD1 3.96Å; F253-L256 PolarHBondContact O-N 3.42Å; F253-H565 VanDerWaalsContact CB-CE1 3.42Å; F253-H565 WeakPolarHBondContact CB-CE1 3.3Å
254	S	34.2	Very low	32.9	Very low	69 Å²	69	131.2 Å²	131.2	48%	0.483	69%	0.69	S	S	.	*	G	3₁₀ helix	trans	-56.3	-23	-177.9	54.6	0	0	0	0	114.6	A252	A252-S254 VanDerWaalsContact C-N 3.32Å
255	N	36.8	Very low	32.8	Very low	116 Å²	116	132.9 Å²	132.9	62%	0.62	69%	0.69	S	S	*	*	G	3₁₀ helix	trans	-92.4	0.4	-172.8	-65.5	9.5	0	0	0	113.7	F253 R259	F253-N255 PolarHBondContact O-N 3.01Å; N255-R259 WeakPolarHBondContact O-CG 2.81Å
256	L	44.2	Very low	32.8	Very low	72 Å²	72	135.4 Å²	135.4	38%	0.377	69%	0.692	S	S	.	*	S	Bend	trans	-76.6	-44.2	176.7	-84.3	163	0	0	0	112.5	F253 N258 R259	F253-L256 HydrophobicContact CD1-CD1 3.96Å; F253-L256 PolarHBondContact O-N 3.42Å; L256-N258 VanDerWaalsContact C-N 3.28Å; L256-N258 PolarHBondContact O-N 2.85Å; L256-R259 PolarHBondContact O-N 3.29Å
257	F	42.9	Very low	32.7	Very low	70 Å²	70	134.3 Å²	134.3	31%	0.307	69%	0.687	S	S	.	*	T	Hydrogen-bonded Turn	trans	-72.7	-18.7	-176	-70.4	-92.1	0	0	0	113.9	V563 M568	F257-V563 HydrophobicContact CD1-CG2 3.87Å; F257-V563 HydrophobicContact CD2-CG1 3.69Å; F257-V563 HydrophobicContact CD2-CG2 4.08Å; F257-V563 HydrophobicContact CE1-CG2 3.77Å; F257-V563 HydrophobicContact CE2-CB 4.27Å; F257-V563 HydrophobicContact CE2-CG1 3.37Å; F257-V563 HydrophobicContact CE2-CG2 4Å; F257-V563 HydrophobicContact CG-CG1 4.44Å; F257-V563 HydrophobicContact CG-CG2 4.02Å; F257-V563 HydrophobicContact CZ-CB 4.32Å; F257-V563 HydrophobicContact CZ-CG1 3.87Å; F257-V563 HydrophobicContact CZ-CG2 3.83Å; F257-M568 HydrophobicContact CZ-CE 3.96Å; F257-M568 HydrophobicContact CZ-SD 4.11Å
258	N	33.1	Very low	32.5	Very low	139 Å²	139	133.4 Å²	133.4	74%	0.743	68%	0.684	S	S	*	*	T	Hydrogen-bonded Turn	trans	-96.9	6.2	-179.7	-76.7	-31	0	0	0	114.6	L256 N260	L256-N258 VanDerWaalsContact C-N 3.28Å; L256-N258 PolarHBondContact O-N 2.85Å; N258-N260 PolarHBondContact O-N 3.03Å; N258-N260 VanDerWaalsContact O-N 3.1Å
259	R	35.8	Very low	32.2	Very low	175 Å²	175	128.7 Å²	128.7	66%	0.66	68%	0.676	S	S	*	*			trans	-83.2	90.7	179.9	-77.3	179.6	86.1	176.7	6.1	112.1	N255 L256 L261	N255-R259 WeakPolarHBondContact O-CG 2.81Å; L256-R259 PolarHBondContact O-N 3.29Å; R259-L261 PolarHBondContact O-N 3.02Å
260	N	31.5	Very low	32.1	Very low	122 Å²	122	126.6 Å²	126.6	65%	0.652	68%	0.675	S	S	*	*			trans	-56.3	97.5	158.3	-89.6	-30.9	0	0	0	110.4	N258	N258-N260 PolarHBondContact O-N 3.03Å; N258-N260 VanDerWaalsContact O-N 3.1Å
261	L	37.3	Very low	31.9	Very low	128 Å²	128	125.2 Å²	125.2	67%	0.67	68%	0.675	S	S	*	*			trans	-84.9	122.7	170.6	-68.2	171.5	0	0	0	109.1	R259	R259-L261 PolarHBondContact O-N 3.02Å
262	F	30.4	Very low	31.7	Very low	195 Å²	195	127.3 Å²	127.3	86%	0.855	69%	0.687	S	S	*	*			trans	68.5	65.3	-179.5	-54.1	-76	0	0	0	117.1	K264	F262-K264 VanDerWaalsContact C-N 3.32Å; F262-K264 PolarHBondContact O-N 2.83Å
263	A	26.7	Very low	31.4	Very low	94 Å²	94	132 Å²	132	78%	0.777	69%	0.694	S	S	*	*			trans	-68.2	89.4	151.4	0	0	0	0	0	110	K265	A263-K265 PolarHBondContact O-N 3.31Å
264	K	26.4	Very low	30.7	Very low	191 Å²	191	136.4 Å²	136.4	83%	0.83	72%	0.716	S	S	*	*			trans	-71.9	95	172	-174.8	177.9	179.5	-179.6	0	108.9	F262 V266	F262-K264 VanDerWaalsContact C-N 3.32Å; F262-K264 PolarHBondContact O-N 2.83Å; K264-V266 PolarHBondContact O-N 3.37Å
265	K	24	Very low	30.3	Very low	199 Å²	199	142.3 Å²	142.3	87%	0.865	73%	0.733	S	S	*	*			trans	-60.8	97.9	178.7	-170.1	174	-175	176.2	0	110.5	A263	A263-K265 PolarHBondContact O-N 3.31Å
266	V	28	Very low	29.9	Very low	115 Å²	115	144.4 Å²	144.4	70%	0.697	74%	0.744	S	S	*	*			trans	-64.4	135.8	162.9	177.8	0	0	0	0	107.1	K264	K264-V266 PolarHBondContact O-N 3.37Å
267	K	28.1	Very low	29.4	Very low	181 Å²	181	146.3 Å²	146.3	79%	0.787	76%	0.761	S	S	*	*			trans	-99.3	114.3	175.9	176.1	-176.9	174.6	-175.3	0	107.4
268	D	23.9	Very low	28.6	Very low	150 Å²	150	146 Å²	146	80%	0.802	78%	0.776	S	S	*	*			trans	-64.3	135.6	171.7	-63.4	-57.9	0	0	0	110.7
269	S	25.3	Very low	28.5	Very low	106 Å²	106	151.6 Å²	151.6	74%	0.741	79%	0.787	S	S	*	*			trans	-146.1	108.2	168.5	56.3	0	0	0	0	107.7
270	N	26.7	Very low	28.5	Very low	165 Å²	165	153 Å²	153	88%	0.882	80%	0.798	S	S	*	*			trans	-66.2	157.5	178.3	-109.3	-15.6	0	0	0	111.3
271	P	29.9	Very low	28.5	Very low	120 Å²	120	154 Å²	154	78%	0.779	80%	0.803	S	S	*	*			trans	-80.6	147.6	-157.5	31	-36.7	0	0	0	114.4
272	A	25.3	Very low	28.4	Very low	100 Å²	100	157 Å²	157	83%	0.826	81%	0.811	S	S	*	*			trans	-126.6	145.5	157.8	0	0	0	0	0	108.6
273	E	27.7	Very low	28.4	Very low	186 Å²	186	151.2 Å²	151.2	87%	0.869	81%	0.806	S	S	*	*			trans	-76.3	139.6	-175.7	-54.2	177.8	108.2	0	0	112.3
274	Q	26.2	Very low	28.6	Very low	172 Å²	172	156.8 Å²	156.8	80%	0.804	81%	0.813	S	S	*	*				-177.9	128.8	112	-97.9	172.9	48.5	0	0	114.9
275	K	26.8	Very low	28.9	Very low	193 Å²	193	155.2 Å²	155.2	84%	0.839	81%	0.812	S	S	*	*			trans	25.6	108.9	144.6	-62.4	172.1	-178.7	168.2	0	119.8
276	D	27.6	Very low	29.3	Very low	160 Å²	160	151 Å²	151	86%	0.856	81%	0.805	S	S	*	*			trans	-104.1	141.4	153.6	-97	-47.2	0	0	0	112.3	G278	D276-G278 PolarHBondContact O-N 3.42Å; D276-G278 VanDerWaalsContact O-N 3.08Å
277	P	33.5	Very low	29.6	Very low	112 Å²	112	151.7 Å²	151.7	73%	0.727	81%	0.812	S	S	*	*			trans	-83.1	75.1	177.4	34.3	-34.9	0	0	0	112.3	W279	P277-W279 PolarHBondContact O-N 2.82Å
278	G	27.4	Very low	29.5	Very low	62 Å²	62	155 Å²	155	64%	0.639	82%	0.82	S	S	*	*			trans	-65.5	115.2	-179.4	0	0	0	0	0	114.5	D276 K280	D276-G278 PolarHBondContact O-N 3.42Å; D276-G278 VanDerWaalsContact O-N 3.08Å; G278-K280 PolarHBondContact O-N 3.17Å
279	W	30.4	Very low	29.9	Very low	258 Å²	258	157.4 Å²	157.4	98%	0.977	83%	0.826	S	S	*	*			trans	-67.1	127.1	171.5	-75.8	61.6	0	0	0	110.8	P277	P277-W279 PolarHBondContact O-N 2.82Å
280	K	34.6	Very low	30.3	Very low	203 Å²	203	155.7 Å²	155.7	88%	0.883	83%	0.825	S	S	*	*			trans	-115.7	106.9	179.8	-70.3	-178.5	179.3	177.7	0	111.2	G278	G278-K280 PolarHBondContact O-N 3.17Å
281	L	33.1	Very low	30.8	Very low	145 Å²	145	154.1 Å²	154.1	76%	0.759	82%	0.823	S	S	*	*			trans	-84.3	145.8	170.1	-160.7	63.9	0	0	0	110
282	F	33.7	Very low	31.1	Very low	189 Å²	189	156.3 Å²	156.3	83%	0.829	83%	0.828	S	S	*	*			trans	65.9	65.4	178.3	-50.6	-63.3	0	0	0	117.5
283	G	30.7	Very low	31.4	Very low	74 Å²	74	161.5 Å²	161.5	76%	0.763	83%	0.832	S	S	*	*			trans	-77.3	133.6	155.8	0	0	0	0	0	111.9
284	K	32.1	Very low	31.7	Very low	211 Å²	211	159.8 Å²	159.8	92%	0.917	83%	0.829	S	S	*	*			trans	-83	145.1	172.3	-63.6	176.7	-178.9	176.4	0	110.5
285	I	33	Very low	32.3	Very low	159 Å²	159	157.3 Å²	157.3	82%	0.815	83%	0.828	S	S	*	*			trans	-122.5	135	173.7	-57.4	179.2	0	0	0	109
286	P	32.2	Very low	33	Very low	111 Å²	111	157.7 Å²	157.7	72%	0.721	83%	0.829	S	S	*	*			trans	-73.6	156.1	178	-14.5	30.1	0	0	0	113.2
287	P	32.9	Very low	33.6	Very low	129 Å²	129	159.8 Å²	159.8	84%	0.838	83%	0.83	S	S	*	*			trans	-72.7	153.7	173.6	32.2	-35.4	0	0	0	111.9
288	R	26.6	Very low	33.8	Very low	251 Å²	251	163 Å²	163	95%	0.947	84%	0.84	S	S	*	*			trans	-136.8	137.5	164.8	-163.6	173.1	-172.4	170.6	2.6	109.4
289	E	31.3	Very low	34.1	Very low	200 Å²	200	169.2 Å²	169.2	94%	0.935	85%	0.852	S	S	*	*			trans	-84.2	156.2	-161.5	-59.7	165.7	125	0	0	114.1
290	G	34.9	Very low	34.4	Very low	69 Å²	69	166.8 Å²	166.8	71%	0.711	85%	0.849	S	S	*	*			trans	-153.1	141.3	171.1	0	0	0	0	0	111
291	P	36.1	Very low	34.3	Very low	132 Å²	132	166.3 Å²	166.3	86%	0.857	85%	0.849	S	S	*	*			trans	-86.8	162.4	-165.3	33.4	-36.8	0	0	0	116.1
292	L	37.9	Very low	34.3	Very low	166 Å²	166	170.2 Å²	170.2	87%	0.869	86%	0.856	S	S	*	*			trans	-77.2	162.6	-169.2	-60.6	88.5	0	0	0	116.2
293	K	30.4	Very low	34.5	Very low	209 Å²	209	169.9 Å²	169.9	91%	0.909	86%	0.857	S	S	*	*			trans	-159	166.3	143.7	-111.2	157.9	-171.7	173.3	0	113.7
294	D	33.4	Very low	34.5	Very low	151 Å²	151	172.6 Å²	172.6	81%	0.807	86%	0.858	S	S	*	*			trans	-75	148	-153.1	-89.4	-73.7	0	0	0	119.8
295	P	39.4	Very low	34.6	Very low	120 Å²	120	171.7 Å²	171.7	78%	0.779	86%	0.855	S	S	*	*			trans	-100.1	69.1	-178.9	40	-35.9	0	0	0	114.5
296	K	41.7	Very low	34.6	Very low	201 Å²	201	170.3 Å²	170.3	87%	0.874	86%	0.859	S	S	*	*			trans	-137.8	35	175.5	-76.5	-164.7	175.9	178.5	0	116.2
297	K	40.7	Very low	34.5	Very low	203 Å²	203	168.4 Å²	168.4	88%	0.883	86%	0.86	S	S	*	*	S	Bend	trans	-143.9	24.8	-178.9	-139.3	-177.7	-179.4	-174.6	0	118.1
298	I	36.5	Very low	34.4	Very low	179 Å²	179	172.2 Å²	172.2	92%	0.918	86%	0.863	S	S	*	*	S	Bend	trans	-128.5	53.8	175.6	-42.4	-179	0	0	0	111
299	Q	35.5	Very low	34.7	Very low	194 Å²	194	165.6 Å²	165.6	91%	0.907	86%	0.862	S	S	*	*	S	Bend	trans	-152.1	47.4	171.8	-155.5	174.4	14.5	0	0	111.9
300	K	36.4	Very low	34.6	Very low	207 Å²	207	159.5 Å²	159.5	90%	0.9	85%	0.853	S	S	*	*	S	Bend	trans	-152.7	28.8	173.9	-146	-179.9	-179.2	179.1	0	115
301	E	32.4	Very low	35	Very low	192 Å²	192	163 Å²	163	90%	0.897	86%	0.863	S	S	*	*			trans	-139.6	15.1	178.3	-154.3	160.1	-144.5	0	0	113.2
302	Y	33.2	Very low	34.7	Very low	228 Å²	228	160.5 Å²	160.5	89%	0.894	86%	0.861	S	S	*	*	S	Bend	trans	-84.2	151.1	148.4	-98.8	-112.2	0	0	0	108
303	E	37	Very low	34.4	Very low	182 Å²	182	160.2 Å²	160.2	85%	0.85	86%	0.861	S	S	*	*			trans	69	81.8	-175.7	-53.6	-172.3	166.8	0	0	116.6
304	T	30.2	Very low	35.6	Very low	130 Å²	130	154.7 Å²	154.7	80%	0.798	85%	0.847	S	S	*	*				-164.9	145.3	112.8	11.6	0	0	0	0	115.4
305	K	34.3	Very low	35.5	Very low	193 Å²	193	154 Å²	154	84%	0.839	85%	0.848	S	S	*	*			trans	68.2	92.9	149.1	-68.8	169.7	-176.6	175.5	0	120.3
306	S	34.1	Very low	35.3	Very low	129 Å²	129	154 Å²	154	90%	0.902	85%	0.85	S	S	*	*				-42.3	144.1	129.7	169.2	0	0	0	0	113.1
307	G	29.3	Very low	35.6	Very low	72 Å²	72	149.6 Å²	149.6	74%	0.742	84%	0.843	S	S	*	*			trans	175.4	97.3	172.4	0	0	0	0	0	118.3
308	K	31.2	Very low	35.6	Very low	208 Å²	208	151.6 Å²	151.6	90%	0.904	85%	0.845	S	S	*	*			trans	23	115	154.1	-82	-180	169.1	178.9	0	122.5
309	A	33.3	Very low	35.7	Very low	112 Å²	112	152.2 Å²	152.2	93%	0.926	84%	0.844	S	S	*	*				27.6	133.4	128.8	0	0	0	0	0	123.5
310	G	28.9	Very low	35.5	Very low	73 Å²	73	147 Å²	147	75%	0.753	84%	0.841	S	S	*	*			trans	-149.9	160.9	158.8	0	0	0	0	0	110.9
311	P	42.4	Very low	35.8	Very low	141 Å²	141	143 Å²	143	92%	0.916	84%	0.835	S	S	*	*			trans	-103.6	150.4	-156.4	37.8	-35.1	0	0	0	116.9
312	G	30.6	Very low	36.2	Very low	80 Å²	80	144.7 Å²	144.7	83%	0.825	83%	0.833	S	S	*	*			trans	163.6	132.6	167	0	0	0	0	0	113.3
313	N	31.8	Very low	36.8	Very low	160 Å²	160	143.2 Å²	143.2	86%	0.856	83%	0.831	S	S	*	*			trans	-160.7	157.7	-177.7	-159.4	31.3	0	0	0	108.5
314	P	54.6	Low	36.8	Very low	94 Å²	94	141.3 Å²	141.3	61%	0.61	83%	0.826	S	S	*	*			cis	-124.6	173.2	-10.9	40.9	-27.6	0	0	0	114.1
315	T	31.9	Very low	37.3	Very low	137 Å²	137	142.1 Å²	142.1	84%	0.84	83%	0.825	S	S	*	*				179.1	137.7	124.6	23.1	0	0	0	0	114.2
316	S	35.1	Very low	37.4	Very low	118 Å²	118	140.3 Å²	140.3	83%	0.825	82%	0.824	S	S	*	*			trans	61.2	135	156.8	-145.6	0	0	0	0	121.1
317	P	48	Very low	37.7	Very low	110 Å²	110	142.6 Å²	142.6	71%	0.714	82%	0.819	S	S	*	*			trans	-105.2	140.1	-179.3	37.9	-31.2	0	0	0	114.4
318	R	41.4	Very low	38.1	Very low	245 Å²	245	146.1 Å²	146.1	93%	0.925	82%	0.816	S	S	*	*			trans	171.5	121.7	139.3	-97	158.4	-174	-153.8	1.5	111.9
319	Q	38	Very low	38.4	Very low	192 Å²	192	142.1 Å²	142.1	90%	0.897	81%	0.811	S	S	*	*			trans	148.6	77.4	144.1	-83.1	-179.9	1.8	0	0	111.2
320	G	32.3	Very low	38.9	Very low	83 Å²	83	143.7 Å²	143.7	86%	0.856	80%	0.803	S	S	*	*			trans	-113.5	72.6	168.8	0	0	0	0	0	110.5
321	V	41.3	Very low	39.8	Very low	125 Å²	125	142.8 Å²	142.8	76%	0.758	79%	0.785	S	S	*	*			trans	-92.6	108.1	-179.3	179.7	0	0	0	0	110.3
322	R	40.9	Very low	40.2	Very low	227 Å²	227	143 Å²	143	86%	0.857	78%	0.784	S	S	*	*			trans	44.4	98.4	153.3	-61.3	176.7	177.6	171.4	-3.4	116.9
323	K	45.7	Very low	41.3	Very low	197 Å²	197	141.3 Å²	141.3	86%	0.857	76%	0.758	S	S	*	*			trans	-109.1	161.4	139.2	-72.5	-168.8	175.3	-173.5	0	108.8
324	N	37	Very low	42.5	Very low	141 Å²	141	137.2 Å²	137.2	75%	0.754	75%	0.746	S	S	*	*			trans	71.4	77.5	177.7	-47.7	-2.1	0	0	0	114.2
325	L	40.8	Very low	42.8	Very low	148 Å²	148	136.1 Å²	136.1	78%	0.775	74%	0.735	S	S	*	*			trans	-125.4	89.9	140.5	-84.2	174.9	0	0	0	106.3	F327	L325-F327 PolarHBondContact O-N 3.4Å; L325-F327 VanDerWaalsContact O-N 3.08Å
326	D	36.7	Very low	44.5	Very low	154 Å²	154	135.7 Å²	135.7	82%	0.824	73%	0.726	S	S	*	*			trans	-70	101.3	167.1	-68.5	-56.5	0	0	0	107	E328	D326-E328 PolarHBondContact O-N 2.87Å
327	F	40	Very low	45.9	Very low	178 Å²	178	134.3 Å²	134.3	78%	0.781	71%	0.709	S	S	*	*			trans	-82.4	68.7	-168.3	-146.1	-81.7	0	0	0	110.8	L325	L325-F327 PolarHBondContact O-N 3.4Å; L325-F327 VanDerWaalsContact O-N 3.08Å
328	E	37.6	Very low	46.9	Very low	146 Å²	146	137.1 Å²	137.1	68%	0.682	71%	0.713	S	S	*	*			trans	-59.2	129.2	167.3	-171.6	170.9	-138.3	0	0	108.8	D326 L330	D326-E328 PolarHBondContact O-N 2.87Å; E328-L330 PolarHBondContact O-N 3.47Å
329	P	38.6	Very low	48.1	Very low	123 Å²	123	132.8 Å²	132.8	80%	0.799	71%	0.708	S	S	*	*			trans	-75.5	77.5	-175.2	30.8	-35.5	0	0	0	110.8
330	L	43.8	Very low	49.5	Very low	145 Å²	145	129.3 Å²	129.3	76%	0.759	69%	0.686	S	S	*	*			trans	-62.9	156.7	175	-70.9	168.4	0	0	0	111.7	E328	E328-L330 PolarHBondContact O-N 3.47Å
331	S	48.1	Very low	51.5	Low	54 Å²	54	129.4 Å²	129.4	38%	0.378	67%	0.672	S	S	.	*			trans	-51.9	159.3	-174.8	-166.2	0	0	0	0	113.7	T333 A334 E370	S331-T333 PolarHBondContact O-N 3.24Å; S331-A334 PolarHBondContact O-N 2.94Å; S331-E370 WeakPolarHBondContact CB-OE1 3.18Å; S331-E370 PolarHBondContact OG-OE1 3.46Å
332	T	51	Low	52.9	Low	147 Å²	147	128.3 Å²	128.3	90%	0.902	68%	0.676	S	S	*	*	S	Bend	trans	-56.3	-12.1	178	45.2	0	0	0	0	114.1	A334	T332-A334 PolarHBondContact O-N 2.95Å
333	T	52.8	Low	54.7	Low	43 Å²	43	125.3 Å²	125.3	26%	0.264	68%	0.677	S	S	.	*			trans	-67	28.3	169.5	-31.1	0	0	0	0	114	S331 L335 A366 E370	S331-T333 PolarHBondContact O-N 3.24Å; T333-L335 PolarHBondContact O-N 3Å; T333-A366 HydrophobicContact CG2-CB 3.47Å; T333-A366 VanDerWaalsContact CG2-CB 3.47Å; T333-E370 VanDerWaalsContact OG1-CD 3.31Å; T333-E370 PolarHBondContact OG1-OE2 3.41Å
334	A	56.2	Low	56.1	Low	74 Å²	74	120.5 Å²	120.5	61%	0.612	66%	0.66	S	S	*	*			trans	-77.5	60.7	-171	0	0	0	0	0	113.8	S331 T332 I336	S331-A334 PolarHBondContact O-N 2.94Å; T332-A334 PolarHBondContact O-N 2.95Å; A334-I336 PolarHBondContact O-N 3.33Å; A334-I336 VanDerWaalsContact O-N 3.12Å
335	L	60.6	Low	58	Low	71 Å²	71	118.4 Å²	118.4	37%	0.372	65%	0.654	S	S	.	*			trans	-66.6	102.2	163.3	-66	165.5	0	0	0	108.2	T333 Y359 M362 V363	T333-L335 PolarHBondContact O-N 3Å; L335-Y359 HydrophobicContact CB-CE2 4.05Å; L335-Y359 WeakPolarHBondContact O-CE2 3.33Å; L335-Y359 PolarHBondContact O-OH 3.48Å; L335-M362 HydrophobicContact CD1-CB 4.46Å; L335-M362 HydrophobicContact CD1-CG 3.73Å; L335-M362 HydrophobicContact CD1-SD 3.65Å; L335-M362 HydrophobicContact CD2-SD 3.83Å; L335-M362 HydrophobicContact CG-SD 4.36Å; L335-V363 HydrophobicContact CB-CG2 4.45Å; L335-V363 HydrophobicContact CD1-CG2 4.13Å
336	I	68.6	Low	59.4	Low	129 Å²	129	116 Å²	116	66%	0.662	66%	0.656	S	S	*	*			trans	-89.7	121.4	177.6	-60.7	174.9	0	0	0	108.8	A334 E338	A334-I336 PolarHBondContact O-N 3.33Å; A334-I336 VanDerWaalsContact O-N 3.12Å; I336-E338 HydrophobicContact CG2-CG 4.13Å; I336-E338 PolarHBondContact O-N 3.18Å; I336-E338 VanDerWaalsContact O-N 3.15Å
337	L	65.1	Low	61.1	Low	88 Å²	88	111.1 Å²	111.1	46%	0.461	63%	0.627	S	S	.	*			trans	-77.5	94.3	171.1	-170.3	80.4	0	0	0	109.5	Y359	L337-Y359 HydrophobicContact CB-CD2 4.17Å; L337-Y359 HydrophobicContact CB-CE1 4.32Å; L337-Y359 HydrophobicContact CB-CE2 3.89Å; L337-Y359 HydrophobicContact CB-CG 4.5Å; L337-Y359 HydrophobicContact CD1-CD1 4.4Å; L337-Y359 HydrophobicContact CD1-CD2 3.86Å; L337-Y359 HydrophobicContact CD1-CE2 4.45Å; L337-Y359 HydrophobicContact CD1-CG 3.83Å
338	E	67.3	Low	63.3	Low	170 Å²	170	106.3 Å²	106.3	79%	0.794	61%	0.614	S	S	*	*	P	Polyproline II helix	trans	-77.5	140.8	174.9	-64	-159.3	148.1	0	0	112.7	I336	I336-E338 HydrophobicContact CG2-CG 4.13Å; I336-E338 PolarHBondContact O-N 3.18Å; I336-E338 VanDerWaalsContact O-N 3.15Å
339	D	67.9	Low	65.4	Low	154 Å²	154	103.2 Å²	103.2	82%	0.824	61%	0.613	S	S	*	*	P	Polyproline II helix	trans	-72.9	148.5	174.8	-82.2	-49.2	0	0	0	112.3
340	R	68.1	Low	67.6	Low	119 Å²	119	105.4 Å²	105.4	45%	0.449	61%	0.613	S	S	.	*	P	Polyproline II helix	trans	-60.5	129.9	177.1	-169.1	-179	-130.1	172.4	10.7	110.3	A342 L344 P345	R340-A342 PolarHBondContact O-N 3.37Å; R340-L344 HydrophobicContact CG-CB 3.99Å; R340-L344 HydrophobicContact CG-CD1 4.05Å; R340-P345 WeakPolarHBondContact CD-O 3.36Å; R340-P345 PolarHBondContact NH1-O 2.9Å
341	P	72.9	Confident	69.4	Low	85 Å²	85	102.5 Å²	102.5	55%	0.552	60%	0.595	S	S	*	*	P	Polyproline II helix	trans	-53.9	136.8	176.2	-28.7	35.3	0	0	0	112.8	N343 L344	P341-N343 PolarHBondContact O-N 3.45Å; P341-L344 PolarHBondContact O-N 2.88Å
342	A	72.1	Confident	71	Confident	102 Å²	102	100.9 Å²	100.9	84%	0.843	59%	0.585	S	S	*	*	T	Hydrogen-bonded Turn	trans	-62.7	-5.3	-172	0	0	0	0	0	115.8	R340	R340-A342 PolarHBondContact O-N 3.37Å
343	N	77.6	Confident	72.7	Confident	163 Å²	163	99 Å²	99	87%	0.872	57%	0.566	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89.6	-6	177.5	-59.5	-11.3	0	0	0	112.9	P341	P341-N343 PolarHBondContact O-N 3.45Å
344	L	75.7	Confident	74.3	Confident	96 Å²	96	102.8 Å²	102.8	50%	0.503	58%	0.579	S	S	.	*	S	Bend	trans	-103.9	149.9	177.8	-74.3	162.5	0	0	0	110.9	R340 P341	R340-L344 HydrophobicContact CG-CB 3.99Å; R340-L344 HydrophobicContact CG-CD1 4.05Å; P341-L344 PolarHBondContact O-N 2.88Å
345	P	75.6	Confident	75.7	Confident	98 Å²	98	104 Å²	104	64%	0.636	57%	0.571	S	S	*	*	P	Polyproline II helix	trans	-53.8	146.8	175.5	-26.8	35.1	0	0	0	112.9	R340 K347	R340-P345 WeakPolarHBondContact CD-O 3.36Å; R340-P345 PolarHBondContact NH1-O 2.9Å; P345-K347 PolarHBondContact O-N 2.93Å
346	A	70.8	Confident	76.8	Confident	97 Å²	97	106.1 Å²	106.1	80%	0.802	57%	0.574	S	S	*	*	P	Polyproline II helix	trans	-55.6	135.9	176.5	0	0	0	0	0	110.8
347	K	73.4	Confident	77.8	Confident	51 Å²	51	105 Å²	105	22%	0.222	57%	0.567	C	S	.	*	P	Polyproline II helix	trans	-71.3	129.1	-179.5	-161.6	175.7	-164	-155	0	109.5	P345 E351 A352 H355	P345-K347 PolarHBondContact O-N 2.93Å; K347-E351 WeakPolarHBondContact CE-OE1 3.28Å; K347-E351 WeakPolarHBondContact CE-OE2 3.4Å; K347-E351 HydrophobicContact CG-CB 4.39Å; K347-E351 VanDerWaalsContact NZ-CD 3.32Å; K347-E351 PolarHBondContact NZ-O 3.01Å; K347-E351 IonicContact NZ-OE1 2.83Å; K347-E351 PolarHBondContact NZ-OE1 3.12Å; K347-E351 IonicContact NZ-OE2 3.98Å; K347-A352 HydrophobicContact CB-CB 4.38Å; K347-A352 HydrophobicContact CD-CB 4.19Å; K347-A352 HydrophobicContact CG-CB 4.31Å; K347-H355 PolarHBondContact NZ-CD2 2.85Å; K347-H355 PolarHBondContact NZ-CE1 3.41Å; K347-H355 VanDerWaalsContact NZ-CE1 3.31Å; K347-H355 PolarHBondContact NZ-ND1 2.63Å; K347-H355 PolarHBondContact NZ-NE2 2.88Å
348	P	85.6	Confident	78.9	Confident	78 Å²	78	105.4 Å²	105.4	51%	0.506	57%	0.566	S	S	.	*	P	Polyproline II helix	trans	-59.6	142.5	178.4	21.7	-30.2	0	0	0	110.8	E350 E351 A352	P348-E350 VanDerWaalsContact C-N 3.3Å; P348-E350 PolarHBondContact O-N 2.89Å; P348-E351 HydrophobicContact CG-CB 3.87Å; P348-E351 PolarHBondContact O-N 2.93Å; P348-A352 PolarHBondContact O-N 2.72Å
349	A	82.6	Confident	79.8	Confident	81 Å²	81	100.9 Å²	100.9	67%	0.669	54%	0.542	S	S	*	.	H	α-helix	trans	-57.9	-39.7	-164.4	0	0	0	0	0	113.7	A352 Q353	A349-A352 PolarHBondContact O-N 2.96Å; A349-Q353 WeakPolarHBondContact O-CB 3.3Å; A349-Q353 PolarHBondContact O-N 2.95Å
350	E	84.3	Confident	80.7	Confident	168 Å²	168	99.2 Å²	99.2	79%	0.785	53%	0.53	S	S	*	.	H	α-helix	trans	-63.8	-45.6	176.5	-175.2	174.4	-157.1	0	0	112.2	P348 A352 Q353 K354	P348-E350 VanDerWaalsContact C-N 3.3Å; P348-E350 PolarHBondContact O-N 2.89Å; E350-A352 VanDerWaalsContact C-N 3.3Å; E350-A352 PolarHBondContact O-N 3.48Å; E350-Q353 PolarHBondContact O-N 2.79Å; E350-K354 WeakPolarHBondContact O-CB 3.46Å; E350-K354 PolarHBondContact O-N 3.13Å
351	E	81.8	Confident	81.9	Confident	85 Å²	85	99 Å²	99	40%	0.397	53%	0.534	S	S	.	.	H	α-helix	trans	-71.1	-26.3	178.4	-151.7	-144.4	140.5	0	0	112.1	K347 P348 H355	K347-E351 WeakPolarHBondContact CE-OE1 3.28Å; K347-E351 WeakPolarHBondContact CE-OE2 3.4Å; K347-E351 HydrophobicContact CG-CB 4.39Å; K347-E351 VanDerWaalsContact NZ-CD 3.32Å; K347-E351 PolarHBondContact NZ-O 3.01Å; K347-E351 IonicContact NZ-OE1 2.83Å; K347-E351 PolarHBondContact NZ-OE1 3.12Å; K347-E351 IonicContact NZ-OE2 3.98Å; P348-E351 HydrophobicContact CG-CB 3.87Å; P348-E351 PolarHBondContact O-N 2.93Å; E351-H355 PolarHBondContact O-N 3.25Å
352	A	82.1	Confident	82.5	Confident	19 Å²	19	99.7 Å²	99.7	16%	0.157	53%	0.531	C	S	.	.	H	α-helix	trans	-75.3	-37.2	170.3	0	0	0	0	0	112.4	K347 P348 A349 E350 H355 R356	K347-A352 HydrophobicContact CB-CB 4.38Å; K347-A352 HydrophobicContact CD-CB 4.19Å; K347-A352 HydrophobicContact CG-CB 4.31Å; P348-A352 PolarHBondContact O-N 2.72Å; A349-A352 PolarHBondContact O-N 2.96Å; E350-A352 VanDerWaalsContact C-N 3.3Å; E350-A352 PolarHBondContact O-N 3.48Å; A352-H355 PolarHBondContact O-N 2.9Å; A352-R356 PolarHBondContact O-N 3.41Å; A352-R356 VanDerWaalsContact O-N 3.15Å
353	Q	85.2	Confident	83.3	Confident	107 Å²	107	96 Å²	96	50%	0.5	50%	0.498	S	S	.	.	H	α-helix	trans	-67	-41.6	173.6	-177.2	167.5	-11.1	0	0	111.5	A349 E350 H355 R356 Q357	A349-Q353 WeakPolarHBondContact O-CB 3.3Å; A349-Q353 PolarHBondContact O-N 2.95Å; E350-Q353 PolarHBondContact O-N 2.79Å; Q353-H355 PolarHBondContact O-N 2.94Å; Q353-R356 PolarHBondContact O-N 3.29Å; Q353-Q357 WeakPolarHBondContact O-CG 3.49Å; Q353-Q357 PolarHBondContact O-N 3Å
354	K	87.4	Confident	83.9	Confident	124 Å²	124	91 Å²	91	54%	0.539	48%	0.479	S	S	.	.	H	α-helix	trans	-58.4	-44.4	173.9	-170.9	175.3	-179.5	177.1	0	112.2	E350 R356 Q357 Q358	E350-K354 WeakPolarHBondContact O-CB 3.46Å; E350-K354 PolarHBondContact O-N 3.13Å; K354-R356 PolarHBondContact O-N 3.29Å; K354-Q357 PolarHBondContact O-N 2.95Å; K354-Q358 VanDerWaalsContact O-CG 3.3Å; K354-Q358 WeakPolarHBondContact O-CG 3.36Å; K354-Q358 PolarHBondContact O-N 2.62Å; K354-Q358 PolarHBondContact O-OE1 3.4Å
355	H	84.9	Confident	84.6	Confident	98 Å²	98	91.9 Å²	91.9	45%	0.454	48%	0.48	S	S	.	.	H	α-helix	trans	-62.6	-39.8	174.7	-93	-142.3	0	0	0	113.1	K347 E351 A352 Q353 Q358 Y359	K347-H355 PolarHBondContact NZ-CD2 2.85Å; K347-H355 PolarHBondContact NZ-CE1 3.41Å; K347-H355 VanDerWaalsContact NZ-CE1 3.31Å; K347-H355 PolarHBondContact NZ-ND1 2.63Å; K347-H355 PolarHBondContact NZ-NE2 2.88Å; E351-H355 PolarHBondContact O-N 3.25Å; A352-H355 PolarHBondContact O-N 2.9Å; Q353-H355 PolarHBondContact O-N 2.94Å; H355-Q358 PolarHBondContact O-N 3.42Å; H355-Y359 WeakPolarHBondContact O-CB 3.34Å; H355-Y359 PolarHBondContact O-N 2.85Å
356	R	84.1	Confident	85.1	Confident	116 Å²	116	88.6 Å²	88.6	44%	0.438	46%	0.461	S	S	.	.	H	α-helix	trans	-62.3	-45.4	175	-76	-173.2	-67.9	-88.5	-0.3	111.6	A352 Q353 K354 Q358 Y359 E360	A352-R356 PolarHBondContact O-N 3.41Å; A352-R356 VanDerWaalsContact O-N 3.15Å; Q353-R356 PolarHBondContact O-N 3.29Å; K354-R356 PolarHBondContact O-N 3.29Å; R356-Q358 PolarHBondContact O-N 2.8Å; R356-Y359 PolarHBondContact O-N 2.89Å; R356-E360 WeakPolarHBondContact O-CB 3.26Å; R356-E360 VanDerWaalsContact O-CG 3.28Å; R356-E360 WeakPolarHBondContact O-CG 3.39Å; R356-E360 PolarHBondContact O-N 3.41Å
357	Q	89.3	Confident	86	Confident	107 Å²	107	90.1 Å²	90.1	50%	0.5	45%	0.45	S	S	.	.	H	α-helix	trans	-60.1	-44.5	175.7	-70.7	171.2	-24.5	0	0	112.3	Q353 K354 Y359 E360 E361	Q353-Q357 WeakPolarHBondContact O-CG 3.49Å; Q353-Q357 PolarHBondContact O-N 3Å; K354-Q357 PolarHBondContact O-N 2.95Å; Q357-Y359 VanDerWaalsContact C-N 3.34Å; Q357-Y359 PolarHBondContact O-N 3.45Å; Q357-E360 PolarHBondContact O-N 2.9Å; Q357-E361 WeakPolarHBondContact O-CB 3.4Å; Q357-E361 PolarHBondContact O-N 3.39Å
358	Q	87.9	Confident	86.9	Confident	96 Å²	96	94.4 Å²	94.4	45%	0.449	47%	0.468	S	S	.	.	H	α-helix	trans	-64.6	-36.6	177	-70.5	173.2	-65.4	0	0	112.6	K354 H355 R356 M362	K354-Q358 VanDerWaalsContact O-CG 3.3Å; K354-Q358 WeakPolarHBondContact O-CG 3.36Å; K354-Q358 PolarHBondContact O-N 2.62Å; K354-Q358 PolarHBondContact O-OE1 3.4Å; H355-Q358 PolarHBondContact O-N 3.42Å; R356-Q358 PolarHBondContact O-N 2.8Å; Q358-M362 WeakPolarHBondContact O-CB 3.44Å; Q358-M362 PolarHBondContact O-N 2.73Å
359	Y	85.9	Confident	87.2	Confident	75 Å²	75	99 Å²	99	29%	0.294	48%	0.476	S	S	.	.	H	α-helix	trans	-70.1	-45.9	174.5	169.8	-95.8	0	0	0	112.2	L335 L337 H355 R356 Q357 E361 M362 V363	L335-Y359 HydrophobicContact CB-CE2 4.05Å; L335-Y359 WeakPolarHBondContact O-CE2 3.33Å; L335-Y359 PolarHBondContact O-OH 3.48Å; L337-Y359 HydrophobicContact CB-CD2 4.17Å; L337-Y359 HydrophobicContact CB-CE1 4.32Å; L337-Y359 HydrophobicContact CB-CE2 3.89Å; L337-Y359 HydrophobicContact CB-CG 4.5Å; L337-Y359 HydrophobicContact CD1-CD1 4.4Å; L337-Y359 HydrophobicContact CD1-CD2 3.86Å; L337-Y359 HydrophobicContact CD1-CE2 4.45Å; L337-Y359 HydrophobicContact CD1-CG 3.83Å; H355-Y359 WeakPolarHBondContact O-CB 3.34Å; H355-Y359 PolarHBondContact O-N 2.85Å; R356-Y359 PolarHBondContact O-N 2.89Å; Q357-Y359 VanDerWaalsContact C-N 3.34Å; Q357-Y359 PolarHBondContact O-N 3.45Å; Y359-E361 VanDerWaalsContact C-N 3.29Å; Y359-E361 PolarHBondContact O-N 3.17Å; Y359-M362 PolarHBondContact O-N 3.41Å; Y359-M362 VanDerWaalsContact O-N 3.17Å; Y359-V363 HydrophobicContact CD1-CG2 4.37Å; Y359-V363 HydrophobicContact CD2-CG2 4.2Å; Y359-V363 HydrophobicContact CE1-CG2 3.99Å; Y359-V363 HydrophobicContact CE2-CG2 3.81Å; Y359-V363 HydrophobicContact CG-CG2 4.47Å; Y359-V363 WeakPolarHBondContact O-CG2 3.5Å; Y359-V363 PolarHBondContact O-N 2.83Å
360	E	88.4	Confident	87.6	Confident	119 Å²	119	98.4 Å²	98.4	56%	0.556	46%	0.459	S	S	*	.	H	α-helix	trans	-58.2	-42	174.9	-74.6	164.5	-152	0	0	111.1	R356 Q357 A364	R356-E360 WeakPolarHBondContact O-CB 3.26Å; R356-E360 VanDerWaalsContact O-CG 3.28Å; R356-E360 WeakPolarHBondContact O-CG 3.39Å; R356-E360 PolarHBondContact O-N 3.41Å; Q357-E360 PolarHBondContact O-N 2.9Å; E360-A364 VanDerWaalsContact O-CB 3.26Å; E360-A364 WeakPolarHBondContact O-CB 3.46Å; E360-A364 PolarHBondContact O-N 3.01Å
361	E	91.4	Very high	88	Confident	114 Å²	114	95.3 Å²	95.3	53%	0.533	45%	0.447	S	S	.	.	H	α-helix	trans	-62.8	-49.2	172.6	-171.8	-177.7	175.5	0	0	111.6	Q357 Y359 V363 A364 Q365	Q357-E361 WeakPolarHBondContact O-CB 3.4Å; Q357-E361 PolarHBondContact O-N 3.39Å; Y359-E361 VanDerWaalsContact C-N 3.29Å; Y359-E361 PolarHBondContact O-N 3.17Å; E361-V363 VanDerWaalsContact C-N 3.35Å; E361-V363 PolarHBondContact O-N 2.97Å; E361-A364 CarbonylContact O-C 3.6Å; E361-A364 PolarHBondContact O-N 3.36Å; E361-A364 VanDerWaalsContact O-N 3.13Å; E361-Q365 HydrophobicContact CG-CG 4.27Å; E361-Q365 WeakPolarHBondContact O-CG 3.42Å; E361-Q365 PolarHBondContact O-N 2.96Å; E361-Q365 PolarHBondContact OE1-NE2 3.29Å
362	M	87.4	Confident	88.7	Confident	100 Å²	100	97.9 Å²	97.9	49%	0.493	46%	0.457	S	S	.	.	H	α-helix	trans	-58.5	-44.7	179.6	-168.9	-171.7	-60.4	0	0	111.8	L335 Q358 Y359 Q365 A366	L335-M362 HydrophobicContact CD1-CB 4.46Å; L335-M362 HydrophobicContact CD1-CG 3.73Å; L335-M362 HydrophobicContact CD1-SD 3.65Å; L335-M362 HydrophobicContact CD2-SD 3.83Å; L335-M362 HydrophobicContact CG-SD 4.36Å; Q358-M362 WeakPolarHBondContact O-CB 3.44Å; Q358-M362 PolarHBondContact O-N 2.73Å; Y359-M362 PolarHBondContact O-N 3.41Å; Y359-M362 VanDerWaalsContact O-N 3.17Å; M362-Q365 PolarHBondContact O-N 3.22Å; M362-A366 WeakPolarHBondContact O-CB 3.33Å; M362-A366 PolarHBondContact O-N 3.02Å
363	V	88.8	Confident	89.2	Confident	24 Å²	24	99.9 Å²	99.9	15%	0.145	46%	0.463	C	S	.	.	H	α-helix	trans	-65.9	-38.4	175.7	174.4	0	0	0	0	111.5	L335 Y359 E361 A366 K367	L335-V363 HydrophobicContact CB-CG2 4.45Å; L335-V363 HydrophobicContact CD1-CG2 4.13Å; Y359-V363 HydrophobicContact CD1-CG2 4.37Å; Y359-V363 HydrophobicContact CD2-CG2 4.2Å; Y359-V363 HydrophobicContact CE1-CG2 3.99Å; Y359-V363 HydrophobicContact CE2-CG2 3.81Å; Y359-V363 HydrophobicContact CG-CG2 4.47Å; Y359-V363 WeakPolarHBondContact O-CG2 3.5Å; Y359-V363 PolarHBondContact O-N 2.83Å; E361-V363 VanDerWaalsContact C-N 3.35Å; E361-V363 PolarHBondContact O-N 2.97Å; V363-A366 PolarHBondContact O-N 3.39Å; V363-K367 HydrophobicContact CG1-CD 4.08Å; V363-K367 HydrophobicContact CG1-CG 4.48Å; V363-K367 WeakPolarHBondContact O-CB 3.28Å; V363-K367 WeakPolarHBondContact O-CG 3.17Å; V363-K367 PolarHBondContact O-N 2.88Å
364	A	89.7	Confident	89.6	Confident	57 Å²	57	97.1 Å²	97.1	47%	0.471	46%	0.459	S	S	.	.	H	α-helix	trans	-67.1	-41.5	175.5	0	0	0	0	0	112.3	E360 E361 K368	E360-A364 VanDerWaalsContact O-CB 3.26Å; E360-A364 WeakPolarHBondContact O-CB 3.46Å; E360-A364 PolarHBondContact O-N 3.01Å; E361-A364 CarbonylContact O-C 3.6Å; E361-A364 PolarHBondContact O-N 3.36Å; E361-A364 VanDerWaalsContact O-N 3.13Å; A364-K368 WeakPolarHBondContact O-CB 3.49Å; A364-K368 PolarHBondContact O-N 2.91Å
365	Q	89.4	Confident	90	Very high	116 Å²	116	96.9 Å²	96.9	54%	0.542	46%	0.459	S	S	.	.	H	α-helix	trans	-63.5	-43.3	174	-70.2	-172.3	22	0	0	111.3	E361 M362 K368 R369	E361-Q365 HydrophobicContact CG-CG 4.27Å; E361-Q365 WeakPolarHBondContact O-CG 3.42Å; E361-Q365 PolarHBondContact O-N 2.96Å; E361-Q365 PolarHBondContact OE1-NE2 3.29Å; M362-Q365 PolarHBondContact O-N 3.22Å; Q365-K368 WeakPolarHBondContact O-CB 3.27Å; Q365-K368 PolarHBondContact O-N 3.36Å; Q365-R369 PolarHBondContact O-N 3.49Å
366	A	87.5	Confident	90.5	Very high	28 Å²	28	98.7 Å²	98.7	23%	0.231	47%	0.466	C	S	.	.	H	α-helix	trans	-64.1	-50.5	178.5	0	0	0	0	0	112	T333 M362 V363 K368 R369 E370	T333-A366 HydrophobicContact CG2-CB 3.47Å; T333-A366 VanDerWaalsContact CG2-CB 3.47Å; M362-A366 WeakPolarHBondContact O-CB 3.33Å; M362-A366 PolarHBondContact O-N 3.02Å; V363-A366 PolarHBondContact O-N 3.39Å; A366-K368 PolarHBondContact O-N 2.97Å; A366-R369 WeakPolarHBondContact O-CA 3.36Å; A366-R369 WeakPolarHBondContact O-CB 3.34Å; A366-R369 PolarHBondContact O-N 3.31Å; A366-E370 WeakPolarHBondContact O-CB 3.41Å; A366-E370 PolarHBondContact O-N 3.45Å
367	K	88.9	Confident	90.9	Very high	129 Å²	129	100.2 Å²	100.2	56%	0.561	47%	0.472	S	S	*	.	H	α-helix	trans	-58.3	-34.5	173.8	-73.4	177.3	178.4	179.4	0	112.7	V363 L371	V363-K367 HydrophobicContact CG1-CD 4.08Å; V363-K367 HydrophobicContact CG1-CG 4.48Å; V363-K367 WeakPolarHBondContact O-CB 3.28Å; V363-K367 WeakPolarHBondContact O-CG 3.17Å; V363-K367 PolarHBondContact O-N 2.88Å; K367-L371 VanDerWaalsContact O-CB 3.28Å; K367-L371 WeakPolarHBondContact O-CB 3.48Å; K367-L371 PolarHBondContact O-N 2.95Å
368	K	93.1	Very high	91.1	Very high	142 Å²	142	101.4 Å²	101.4	62%	0.617	48%	0.475	S	S	*	.	H	α-helix	trans	-71.1	-29.8	175.8	-174.9	178.7	-176.8	179.6	0	112.7	A364 Q365 A366 K372	A364-K368 WeakPolarHBondContact O-CB 3.49Å; A364-K368 PolarHBondContact O-N 2.91Å; Q365-K368 WeakPolarHBondContact O-CB 3.27Å; Q365-K368 PolarHBondContact O-N 3.36Å; A366-K368 PolarHBondContact O-N 2.97Å; K368-K372 WeakPolarHBondContact O-CG 3.47Å; K368-K372 PolarHBondContact O-N 3.27Å
369	R	90.9	Very high	91.5	Very high	175 Å²	175	103 Å²	103	66%	0.66	48%	0.481	S	S	*	.	H	α-helix	trans	-72.7	-52.3	170.1	-171.6	-172	-72.8	-162.4	-3.1	110.4	Q365 A366 L371 K372 E373	Q365-R369 PolarHBondContact O-N 3.49Å; A366-R369 WeakPolarHBondContact O-CA 3.36Å; A366-R369 WeakPolarHBondContact O-CB 3.34Å; A366-R369 PolarHBondContact O-N 3.31Å; R369-L371 VanDerWaalsContact C-N 3.32Å; R369-L371 PolarHBondContact O-N 2.69Å; R369-K372 WeakPolarHBondContact O-CB 3.37Å; R369-K372 PolarHBondContact O-N 3.46Å; R369-E373 WeakPolarHBondContact CG-OE1 3.46Å; R369-E373 PolarHBondContact O-N 3.36Å
370	E	91.7	Very high	91.8	Very high	67 Å²	67	104.8 Å²	104.8	31%	0.313	49%	0.492	S	S	.	.	H	α-helix	trans	-51.9	-46.8	177.9	-171.7	177.5	178.8	0	0	111.9	S331 T333 A366 E373 A374	S331-E370 WeakPolarHBondContact CB-OE1 3.18Å; S331-E370 PolarHBondContact OG-OE1 3.46Å; T333-E370 VanDerWaalsContact OG1-CD 3.31Å; T333-E370 PolarHBondContact OG1-OE2 3.41Å; A366-E370 WeakPolarHBondContact O-CB 3.41Å; A366-E370 PolarHBondContact O-N 3.45Å; E370-E373 PolarHBondContact O-N 3Å; E370-A374 WeakPolarHBondContact O-CB 3.29Å; E370-A374 PolarHBondContact O-N 3.41Å
371	L	93	Very high	92	Very high	103 Å²	103	103.7 Å²	103.7	54%	0.539	49%	0.489	S	S	.	.	H	α-helix	trans	-65.1	-39.9	176	-178.7	61.8	0	0	0	113.3	K367 R369 A374 Q375	K367-L371 VanDerWaalsContact O-CB 3.28Å; K367-L371 WeakPolarHBondContact O-CB 3.48Å; K367-L371 PolarHBondContact O-N 2.95Å; R369-L371 VanDerWaalsContact C-N 3.32Å; R369-L371 PolarHBondContact O-N 2.69Å; L371-A374 PolarHBondContact O-N 2.92Å; L371-Q375 WeakPolarHBondContact O-CB 3.3Å; L371-Q375 VanDerWaalsContact O-CG 3.27Å; L371-Q375 WeakPolarHBondContact O-CG 3.44Å; L371-Q375 PolarHBondContact O-N 2.97Å
372	K	94.9	Very high	92.2	Very high	139 Å²	139	102 Å²	102	60%	0.604	48%	0.481	S	S	*	.	H	α-helix	trans	-64.8	-43.4	175.7	-82.4	179.1	170	-166.7	0	111.6	K368 R369 Q375 K376	K368-K372 WeakPolarHBondContact O-CG 3.47Å; K368-K372 PolarHBondContact O-N 3.27Å; R369-K372 WeakPolarHBondContact O-CB 3.37Å; R369-K372 PolarHBondContact O-N 3.46Å; K372-Q375 PolarHBondContact O-N 3.36Å; K372-K376 PolarHBondContact O-N 2.93Å
373	E	93.8	Very high	92.4	Very high	61 Å²	61	100.4 Å²	100.4	29%	0.285	48%	0.475	S	S	.	.	H	α-helix	trans	-64.8	-43	175.8	-66.9	174.9	-144	0	0	111.5	R369 E370 Q375 K376 R377	R369-E373 WeakPolarHBondContact CG-OE1 3.46Å; R369-E373 PolarHBondContact O-N 3.36Å; E370-E373 PolarHBondContact O-N 3Å; E373-Q375 VanDerWaalsContact C-N 3.3Å; E373-Q375 PolarHBondContact O-N 3.38Å; E373-K376 WeakPolarHBondContact O-CB 3.42Å; E373-K376 PolarHBondContact O-N 2.95Å; E373-R377 VanDerWaalsContact CB-NH1 3.31Å; E373-R377 WeakPolarHBondContact O-CB 3.41Å; E373-R377 VanDerWaalsContact O-CG 3.3Å; E373-R377 WeakPolarHBondContact O-CG 3.33Å; E373-R377 PolarHBondContact O-N 2.95Å; E373-R377 IonicContact OE2-CZ 2.62Å; E373-R377 IonicContact OE2-NH1 3.19Å; E373-R377 PolarHBondContact OE2-NH1 3.18Å; E373-R377 IonicContact OE2-NH2 3.34Å; E373-R377 PolarHBondContact OE2-NH2 3.49Å
374	A	94	Very high	92.5	Very high	49 Å²	49	105.9 Å²	105.9	41%	0.405	49%	0.493	S	S	.	.	H	α-helix	trans	-60.4	-39.3	175.3	0	0	0	0	0	111.9	E370 L371 K378	E370-A374 WeakPolarHBondContact O-CB 3.29Å; E370-A374 PolarHBondContact O-N 3.41Å; L371-A374 PolarHBondContact O-N 2.92Å; A374-K378 VanDerWaalsContact O-CB 3.29Å; A374-K378 WeakPolarHBondContact O-CB 3.33Å; A374-K378 PolarHBondContact O-N 3.41Å
375	Q	95.2	Very high	92.7	Very high	119 Å²	119	106 Å²	106	56%	0.556	49%	0.489	S	S	*	.	H	α-helix	trans	-66.1	-42.1	172.6	-73.3	172.7	0.1	0	0	112.5	L371 K372 E373 K378 K379	L371-Q375 WeakPolarHBondContact O-CB 3.3Å; L371-Q375 VanDerWaalsContact O-CG 3.27Å; L371-Q375 WeakPolarHBondContact O-CG 3.44Å; L371-Q375 PolarHBondContact O-N 2.97Å; K372-Q375 PolarHBondContact O-N 3.36Å; E373-Q375 VanDerWaalsContact C-N 3.3Å; E373-Q375 PolarHBondContact O-N 3.38Å; Q375-K378 PolarHBondContact O-N 3.15Å; Q375-K379 PolarHBondContact O-N 2.68Å
376	K	94.5	Very high	93	Very high	137 Å²	137	105.4 Å²	105.4	60%	0.596	49%	0.485	S	S	*	.	H	α-helix	trans	-59.3	-50.9	174.2	-173.3	-176.2	178	-173.8	0	110.7	K372 E373 K379 Q380	K372-K376 PolarHBondContact O-N 2.93Å; E373-K376 WeakPolarHBondContact O-CB 3.42Å; E373-K376 PolarHBondContact O-N 2.95Å; K376-K379 PolarHBondContact O-N 2.89Å; K376-Q380 WeakPolarHBondContact O-CG 3.43Å; K376-Q380 PolarHBondContact O-N 2.82Å; K376-Q380 PolarHBondContact O-OE1 2.89Å
377	R	92.6	Very high	93.1	Very high	147 Å²	147	109 Å²	109	56%	0.555	50%	0.5	S	S	*	.	H	α-helix	trans	-60.4	-44.1	177.5	-70	172.3	-176.8	122.1	13.2	112	E373 Q380 L381	E373-R377 VanDerWaalsContact CB-NH1 3.31Å; E373-R377 WeakPolarHBondContact O-CB 3.41Å; E373-R377 VanDerWaalsContact O-CG 3.3Å; E373-R377 WeakPolarHBondContact O-CG 3.33Å; E373-R377 PolarHBondContact O-N 2.95Å; E373-R377 IonicContact OE2-CZ 2.62Å; E373-R377 IonicContact OE2-NH1 3.19Å; E373-R377 PolarHBondContact OE2-NH1 3.18Å; E373-R377 IonicContact OE2-NH2 3.34Å; E373-R377 PolarHBondContact OE2-NH2 3.49Å; R377-Q380 PolarHBondContact O-N 3.46Å; R377-L381 PolarHBondContact O-N 3.11Å
378	K	95	Very high	93.3	Very high	132 Å²	132	107.3 Å²	107.3	57%	0.574	49%	0.494	S	S	*	.	H	α-helix	trans	-61.7	-46	176	-175.3	174.9	-173	-81.3	0	111.8	A374 Q375 L381 E382	A374-K378 VanDerWaalsContact O-CB 3.29Å; A374-K378 WeakPolarHBondContact O-CB 3.33Å; A374-K378 PolarHBondContact O-N 3.41Å; Q375-K378 PolarHBondContact O-N 3.15Å; K378-L381 PolarHBondContact O-N 3.44Å; K378-E382 IonicContact NZ-OE1 2.71Å; K378-E382 PolarHBondContact NZ-OE1 3.15Å; K378-E382 WeakPolarHBondContact O-CG 3.45Å; K378-E382 PolarHBondContact O-N 3.26Å
379	K	95.5	Very high	93.4	Very high	130 Å²	130	107.2 Å²	107.2	57%	0.565	50%	0.496	S	S	*	.	H	α-helix	trans	-61.8	-45.6	176.9	-174.9	-175.4	172.4	-170.7	0	111.5	Q375 K376 L381 E382 D383	Q375-K379 PolarHBondContact O-N 2.68Å; K376-K379 PolarHBondContact O-N 2.89Å; K379-L381 VanDerWaalsContact C-N 3.28Å; K379-L381 PolarHBondContact O-N 3.24Å; K379-E382 PolarHBondContact O-N 2.98Å; K379-D383 WeakPolarHBondContact CE-OD2 3.47Å; K379-D383 WeakPolarHBondContact CG-OD2 3.48Å; K379-D383 WeakPolarHBondContact O-CB 3.1Å; K379-D383 PolarHBondContact O-N 2.84Å
380	Q	91.7	Very high	93.6	Very high	113 Å²	113	102.4 Å²	102.4	53%	0.528	49%	0.489	S	S	.	.	H	α-helix	trans	-57.5	-41.2	176.7	-73.2	169.9	-55.4	0	0	111.9	K376 R377 R384	K376-Q380 WeakPolarHBondContact O-CG 3.43Å; K376-Q380 PolarHBondContact O-N 2.82Å; K376-Q380 PolarHBondContact O-OE1 2.89Å; R377-Q380 PolarHBondContact O-N 3.46Å; Q380-R384 WeakPolarHBondContact O-CB 3.48Å; Q380-R384 PolarHBondContact O-N 3.35Å
381	L	93.9	Very high	93.8	Very high	95 Å²	95	102.4 Å²	102.4	50%	0.497	49%	0.49	S	S	.	.	H	α-helix	trans	-66.3	-45.3	175.6	-176	63.2	0	0	0	112.4	R377 K378 K379 D383 R384 C385	R377-L381 PolarHBondContact O-N 3.11Å; K378-L381 PolarHBondContact O-N 3.44Å; K379-L381 VanDerWaalsContact C-N 3.28Å; K379-L381 PolarHBondContact O-N 3.24Å; L381-D383 VanDerWaalsContact C-N 3.35Å; L381-D383 PolarHBondContact O-N 3.09Å; L381-R384 PolarHBondContact O-N 2.98Å; L381-C385 PolarHBondContact O-N 3.08Å; L381-C385 PolarHBondContact O-SG 3.38Å; L381-C385 VanDerWaalsContact O-SG 3.36Å
382	E	95	Very high	93.9	Very high	78 Å²	78	99 Å²	99	36%	0.364	48%	0.481	S	S	.	.	H	α-helix	trans	-59.9	-43	175.8	-74.5	175.2	-162	0	0	112.5	K378 K379 R384 C385 K386	K378-E382 IonicContact NZ-OE1 2.71Å; K378-E382 PolarHBondContact NZ-OE1 3.15Å; K378-E382 WeakPolarHBondContact O-CG 3.45Å; K378-E382 PolarHBondContact O-N 3.26Å; K379-E382 PolarHBondContact O-N 2.98Å; E382-R384 VanDerWaalsContact C-N 3.34Å; E382-C385 PolarHBondContact O-N 3.05Å; E382-K386 WeakPolarHBondContact O-CD 3.48Å; E382-K386 VanDerWaalsContact O-CE 3.27Å; E382-K386 WeakPolarHBondContact O-CE 3.27Å; E382-K386 VanDerWaalsContact O-CG 3.29Å; E382-K386 WeakPolarHBondContact O-CG 3.29Å; E382-K386 PolarHBondContact O-N 2.9Å; E382-K386 VanDerWaalsContact O-N 3.15Å
383	D	91.6	Very high	94	Very high	68 Å²	68	95.8 Å²	95.8	36%	0.364	47%	0.473	S	S	.	.	H	α-helix	trans	-70	-32.3	179.2	-68	-19.9	0	0	0	111.4	K379 L381 K386 L387	K379-D383 WeakPolarHBondContact CE-OD2 3.47Å; K379-D383 WeakPolarHBondContact CG-OD2 3.48Å; K379-D383 WeakPolarHBondContact O-CB 3.1Å; K379-D383 PolarHBondContact O-N 2.84Å; L381-D383 VanDerWaalsContact C-N 3.35Å; L381-D383 PolarHBondContact O-N 3.09Å; D383-K386 IonicContact OD1-NZ 2.69Å; D383-K386 PolarHBondContact OD1-NZ 3.26Å; D383-L387 PolarHBondContact O-N 2.83Å
384	R	90.2	Very high	94.2	Very high	139 Å²	139	93.5 Å²	93.5	53%	0.525	46%	0.464	S	S	.	.	H	α-helix	trans	-66.1	-44.9	171.4	-155.6	-168.2	80.7	-164.3	2.8	112.2	Q380 L381 E382 K386 L387 E388	Q380-R384 WeakPolarHBondContact O-CB 3.48Å; Q380-R384 PolarHBondContact O-N 3.35Å; L381-R384 PolarHBondContact O-N 2.98Å; E382-R384 VanDerWaalsContact C-N 3.34Å; R384-K386 VanDerWaalsContact C-N 3.33Å; R384-K386 PolarHBondContact O-N 3.31Å; R384-L387 WeakPolarHBondContact O-CB 3.42Å; R384-L387 PolarHBondContact O-N 3.41Å; R384-L387 VanDerWaalsContact O-N 3.11Å; R384-E388 IonicContact CZ-OE1 2.8Å; R384-E388 VanDerWaalsContact CZ-OE1 3.25Å; R384-E388 IonicContact NE-OE1 3.17Å; R384-E388 PolarHBondContact NE-OE1 3.45Å; R384-E388 IonicContact NH2-OE1 2.73Å; R384-E388 PolarHBondContact NH2-OE1 2.99Å; R384-E388 WeakPolarHBondContact O-CG 3.47Å; R384-E388 PolarHBondContact O-N 3.41Å
385	C	94.7	Very high	94.4	Very high	58 Å²	58	91.8 Å²	91.8	39%	0.392	45%	0.45	S	S	.	.	H	α-helix	trans	-62.5	-37.9	177.6	-67.4	0	0	0	0	112.6	L381 E382 L387 E388 E389	L381-C385 PolarHBondContact O-N 3.08Å; L381-C385 PolarHBondContact O-SG 3.38Å; L381-C385 VanDerWaalsContact O-SG 3.36Å; E382-C385 PolarHBondContact O-N 3.05Å; C385-L387 VanDerWaalsContact C-N 3.31Å; C385-L387 PolarHBondContact O-N 3.07Å; C385-E388 PolarHBondContact O-N 2.87Å; C385-E389 WeakPolarHBondContact O-CB 3.28Å; C385-E389 PolarHBondContact O-N 2.89Å
386	K	94.7	Very high	94.5	Very high	104 Å²	104	91.7 Å²	91.7	45%	0.452	45%	0.449	S	S	.	.	H	α-helix	trans	-63.2	-36.9	173.3	-65.9	161.5	-151	160.5	0	112.1	E382 D383 R384 S390	E382-K386 WeakPolarHBondContact O-CD 3.48Å; E382-K386 VanDerWaalsContact O-CE 3.27Å; E382-K386 WeakPolarHBondContact O-CE 3.27Å; E382-K386 VanDerWaalsContact O-CG 3.29Å; E382-K386 WeakPolarHBondContact O-CG 3.29Å; E382-K386 PolarHBondContact O-N 2.9Å; E382-K386 VanDerWaalsContact O-N 3.15Å; D383-K386 IonicContact OD1-NZ 2.69Å; D383-K386 PolarHBondContact OD1-NZ 3.26Å; R384-K386 VanDerWaalsContact C-N 3.33Å; R384-K386 PolarHBondContact O-N 3.31Å; K386-S390 VanDerWaalsContact O-CB 3.28Å; K386-S390 WeakPolarHBondContact O-CB 3.25Å; K386-S390 PolarHBondContact O-N 2.96Å
387	L	90.6	Very high	94.6	Very high	103 Å²	103	87.2 Å²	87.2	54%	0.539	43%	0.432	S	S	.	.	H	α-helix	trans	-68.4	-44.3	175.6	-179.3	60.3	0	0	0	111.4	D383 R384 C385 E389 S390 I391	D383-L387 PolarHBondContact O-N 2.83Å; R384-L387 WeakPolarHBondContact O-CB 3.42Å; R384-L387 PolarHBondContact O-N 3.41Å; R384-L387 VanDerWaalsContact O-N 3.11Å; C385-L387 VanDerWaalsContact C-N 3.31Å; C385-L387 PolarHBondContact O-N 3.07Å; L387-E389 PolarHBondContact O-N 3.18Å; L387-S390 PolarHBondContact O-N 3.25Å; L387-I391 HydrophobicContact CD1-CD1 4.03Å; L387-I391 HydrophobicContact CD1-CG1 4.28Å; L387-I391 HydrophobicContact CG-CD1 3.91Å; L387-I391 WeakPolarHBondContact O-CB 3.38Å; L387-I391 VanDerWaalsContact O-CG1 3.25Å; L387-I391 WeakPolarHBondContact O-CG1 3.41Å; L387-I391 PolarHBondContact O-N 3.06Å
388	E	93.6	Very high	94.9	Very high	95 Å²	95	80.2 Å²	80.2	44%	0.444	41%	0.405	S	S	.	.	H	α-helix	trans	-57.7	-46.1	173.9	-69.9	167.1	-158.2	0	0	111.7	R384 C385 I391 G392	R384-E388 IonicContact CZ-OE1 2.8Å; R384-E388 VanDerWaalsContact CZ-OE1 3.25Å; R384-E388 IonicContact NE-OE1 3.17Å; R384-E388 PolarHBondContact NE-OE1 3.45Å; R384-E388 IonicContact NH2-OE1 2.73Å; R384-E388 PolarHBondContact NH2-OE1 2.99Å; R384-E388 WeakPolarHBondContact O-CG 3.47Å; R384-E388 PolarHBondContact O-N 3.41Å; C385-E388 PolarHBondContact O-N 2.87Å; E388-I391 PolarHBondContact O-N 2.89Å; E388-G392 PolarHBondContact O-N 3.3Å
389	E	95.3	Very high	95	Very high	139 Å²	139	76.8 Å²	76.8	65%	0.65	39%	0.393	S	S	*	.	H	α-helix	trans	-63.9	-41.3	176.5	-176.6	175.9	-155.5	0	0	112.6	C385 L387 G392 T393	C385-E389 WeakPolarHBondContact O-CB 3.28Å; C385-E389 PolarHBondContact O-N 2.89Å; L387-E389 PolarHBondContact O-N 3.18Å; E389-G392 PolarHBondContact O-N 2.86Å; E389-T393 WeakPolarHBondContact O-CB 3.33Å; E389-T393 PolarHBondContact O-N 2.71Å; E389-T393 PolarHBondContact O-OG1 2.93Å
390	S	94.6	Very high	95	Very high	74 Å²	74	77.2 Å²	77.2	52%	0.517	40%	0.397	S	S	.	.	H	α-helix	trans	-63.1	-45.4	175.3	-175.8	0	0	0	0	112	K386 L387 T393 A394	K386-S390 VanDerWaalsContact O-CB 3.28Å; K386-S390 WeakPolarHBondContact O-CB 3.25Å; K386-S390 PolarHBondContact O-N 2.96Å; L387-S390 PolarHBondContact O-N 3.25Å; S390-T393 PolarHBondContact O-N 2.67Å; S390-A394 WeakPolarHBondContact O-CB 3.37Å; S390-A394 PolarHBondContact O-N 3.3Å
391	I	94.9	Very high	95.2	Very high	67 Å²	67	75.2 Å²	75.2	34%	0.344	39%	0.388	S	S	.	.	H	α-helix	trans	-62.4	-43.2	175.6	-69.6	167.2	0	0	0	110.6	L387 E388 A394 A395 P424	L387-I391 HydrophobicContact CD1-CD1 4.03Å; L387-I391 HydrophobicContact CD1-CG1 4.28Å; L387-I391 HydrophobicContact CG-CD1 3.91Å; L387-I391 WeakPolarHBondContact O-CB 3.38Å; L387-I391 VanDerWaalsContact O-CG1 3.25Å; L387-I391 WeakPolarHBondContact O-CG1 3.41Å; L387-I391 PolarHBondContact O-N 3.06Å; E388-I391 PolarHBondContact O-N 2.89Å; I391-A394 PolarHBondContact O-N 3.03Å; I391-A395 WeakPolarHBondContact O-CB 3.34Å; I391-A395 PolarHBondContact O-N 3.14Å; I391-P424 HydrophobicContact CG2-CB 3.98Å
392	G	96.4	Very high	95.4	Very high	33 Å²	33	70.7 Å²	70.7	34%	0.34	36%	0.364	S	S	.	.	H	α-helix	trans	-61.5	-45.2	175.7	0	0	0	0	0	112.8	E388 E389 A395 Q396	E388-G392 PolarHBondContact O-N 3.3Å; E389-G392 PolarHBondContact O-N 2.86Å; G392-A395 PolarHBondContact O-N 3.33Å; G392-Q396 WeakPolarHBondContact O-CG 3.29Å; G392-Q396 PolarHBondContact O-N 3.19Å; G392-Q396 VanDerWaalsContact O-N 3.09Å
393	T	96.9	Very high	95.5	Very high	71 Å²	71	68.4 Å²	68.4	44%	0.436	35%	0.354	S	S	.	.	H	α-helix	trans	-63	-46.3	176.8	-56.9	0	0	0	0	111.3	E389 S390 A395 Q396 I397	E389-T393 WeakPolarHBondContact O-CB 3.33Å; E389-T393 PolarHBondContact O-N 2.71Å; E389-T393 PolarHBondContact O-OG1 2.93Å; S390-T393 PolarHBondContact O-N 2.67Å; T393-A395 VanDerWaalsContact C-N 3.31Å; T393-A395 PolarHBondContact O-N 3.13Å; T393-Q396 PolarHBondContact O-N 3.43Å; T393-I397 HydrophobicContact CG2-CD1 4.39Å; T393-I397 WeakPolarHBondContact O-CG1 3.42Å; T393-I397 PolarHBondContact O-N 2.95Å
394	A	97	Very high	95.7	Very high	13 Å²	13	69.3 Å²	69.3	11%	0.107	36%	0.364	C	S	.	.	H	α-helix	trans	-60.6	-39.9	174.5	0	0	0	0	0	111.8	S390 I391 Q396 I397 W398 L418 P424	S390-A394 WeakPolarHBondContact O-CB 3.37Å; S390-A394 PolarHBondContact O-N 3.3Å; I391-A394 PolarHBondContact O-N 3.03Å; A394-Q396 VanDerWaalsContact C-N 3.31Å; A394-Q396 PolarHBondContact O-N 3.25Å; A394-I397 PolarHBondContact O-N 3.34Å; A394-W398 WeakPolarHBondContact O-CB 3.49Å; A394-W398 PolarHBondContact O-N 2.88Å; A394-L418 HydrophobicContact CB-CD1 4.11Å; A394-P424 HydrophobicContact CB-CG 3.71Å
395	A	97.7	Very high	96	Very high	13 Å²	13	66.2 Å²	66.2	11%	0.107	36%	0.358	C	S	.	.	H	α-helix	trans	-65.2	-33.2	178.9	0	0	0	0	0	112.6	I391 G392 T393 N399 P424 V427	I391-A395 WeakPolarHBondContact O-CB 3.34Å; I391-A395 PolarHBondContact O-N 3.14Å; G392-A395 PolarHBondContact O-N 3.33Å; T393-A395 VanDerWaalsContact C-N 3.31Å; T393-A395 PolarHBondContact O-N 3.13Å; A395-N399 PolarHBondContact O-N 3.11Å; A395-N399 PolarHBondContact O-ND2 3.2Å; A395-P424 HydrophobicContact CB-CB 3.83Å; A395-P424 HydrophobicContact CB-CG 4.03Å; A395-V427 HydrophobicContact CB-CG2 4.18Å
396	Q	97.8	Very high	95.9	Very high	116 Å²	116	65.7 Å²	65.7	54%	0.542	35%	0.348	S	S	.	.	H	α-helix	trans	-65.5	-51.6	172.2	-68.1	175.3	16.6	0	0	111	G392 T393 A394 W398 N399 Q400	G392-Q396 WeakPolarHBondContact O-CG 3.29Å; G392-Q396 PolarHBondContact O-N 3.19Å; G392-Q396 VanDerWaalsContact O-N 3.09Å; T393-Q396 PolarHBondContact O-N 3.43Å; A394-Q396 VanDerWaalsContact C-N 3.31Å; A394-Q396 PolarHBondContact O-N 3.25Å; Q396-W398 VanDerWaalsContact C-N 3.3Å; Q396-W398 PolarHBondContact O-N 2.76Å; Q396-N399 PolarHBondContact O-N 3.13Å; Q396-Q400 VanDerWaalsContact O-CB 3.29Å; Q396-Q400 WeakPolarHBondContact O-CB 3.4Å; Q396-Q400 WeakPolarHBondContact O-CG 3.39Å; Q396-Q400 PolarHBondContact O-N 2.91Å
397	I	97.1	Very high	95.7	Very high	44 Å²	44	65.8 Å²	65.8	23%	0.226	36%	0.361	C	S	.	.	H	α-helix	trans	-56.4	-45.1	177.5	-62.5	165.9	0	0	0	110.7	T393 A394 E401 I402 L418	T393-I397 HydrophobicContact CG2-CD1 4.39Å; T393-I397 WeakPolarHBondContact O-CG1 3.42Å; T393-I397 PolarHBondContact O-N 2.95Å; A394-I397 PolarHBondContact O-N 3.34Å; I397-E401 WeakPolarHBondContact O-CB 3.37Å; I397-E401 PolarHBondContact O-N 3.04Å; I397-I402 HydrophobicContact CG2-CD1 3.9Å; I397-I402 HydrophobicContact CG2-CG1 4.23Å; I397-I402 PolarHBondContact O-N 3.47Å; I397-L418 HydrophobicContact CG2-CD2 4.14Å
398	W	97.9	Very high	95.8	Very high	0 Å²	0	65.6 Å²	65.6	0%	0	36%	0.364	C	S	.	.	I	π-helix	trans	-61.4	-46.8	178.2	-88.3	109.5	0	0	0	113.4	A394 Q396 I402 L403 W406 V415 W419 I423 P424 V427 V431	A394-W398 WeakPolarHBondContact O-CB 3.49Å; A394-W398 PolarHBondContact O-N 2.88Å; Q396-W398 VanDerWaalsContact C-N 3.3Å; Q396-W398 PolarHBondContact O-N 2.76Å; W398-I402 HydrophobicContact CD2-CB 4.48Å; W398-I402 HydrophobicContact CD2-CD1 3.74Å; W398-I402 HydrophobicContact CE3-CB 3.81Å; W398-I402 HydrophobicContact CE3-CD1 3.85Å; W398-I402 HydrophobicContact CE3-CG1 4.42Å; W398-I402 HydrophobicContact CE3-CG2 3.64Å; W398-I402 HydrophobicContact CG-CD1 4.12Å; W398-I402 HydrophobicContact CH2-CG2 4.37Å; W398-I402 HydrophobicContact CZ3-CB 4.22Å; W398-I402 HydrophobicContact CZ3-CD1 4.28Å; W398-I402 HydrophobicContact CZ3-CG2 3.5Å; W398-L403 WeakPolarHBondContact O-CB 3.39Å; W398-L403 WeakPolarHBondContact O-CG 3.26Å; W398-L403 PolarHBondContact O-N 3.35Å; W398-W406 HydrophobicContact CZ3-CZ3 4.16Å; W398-V415 HydrophobicContact CH2-CG1 4.1Å; W398-W419 HydrophobicContact CH2-CB 4.43Å; W398-W419 AromaticContact CH2-CD2 3.8Å; W398-W419 HydrophobicContact CH2-CD2 3.8Å; W398-W419 AromaticContact CH2-CE3 3.76Å; W398-W419 HydrophobicContact CH2-CE3 3.76Å; W398-W419 HydrophobicContact CH2-CG 4.13Å; W398-W419 HydrophobicContact CH2-CZ3 4.36Å; W398-W419 HydrophobicContact CZ2-CB 4.01Å; W398-W419 HydrophobicContact CZ2-CD2 4.18Å; W398-W419 HydrophobicContact CZ2-CE3 4.46Å; W398-W419 AromaticContact CZ2-CG 4Å; W398-W419 HydrophobicContact CZ2-CG 4Å; W398-I423 HydrophobicContact CZ2-CG1 4.18Å; W398-P424 VanDerWaalsContact CD1-CD 3.5Å; W398-V427 HydrophobicContact CB-CB 4.43Å; W398-V427 HydrophobicContact CB-CG1 3.72Å; W398-V427 HydrophobicContact CB-CG2 4.17Å; W398-V427 HydrophobicContact CD2-CG1 4.44Å; W398-V427 HydrophobicContact CG-CG1 4.15Å; W398-V431 HydrophobicContact CD2-CG2 4.48Å; W398-V431 HydrophobicContact CE3-CG2 3.75Å; W398-V431 HydrophobicContact CH2-CG1 4.13Å; W398-V431 HydrophobicContact CH2-CG2 4.28Å; W398-V431 HydrophobicContact CZ3-CG1 4.07Å; W398-V431 HydrophobicContact CZ3-CG2 3.63Å
399	N	97.6	Very high	95.7	Very high	59 Å²	59	63.5 Å²	63.5	32%	0.316	36%	0.355	S	S	.	.	I	π-helix	trans	-77.9	-33.1	-178.7	-75.6	-79.6	0	0	0	113.8	A395 Q396 P404 V427 K430	A395-N399 PolarHBondContact O-N 3.11Å; A395-N399 PolarHBondContact O-ND2 3.2Å; Q396-N399 PolarHBondContact O-N 3.13Å; N399-P404 WeakPolarHBondContact O-CD 3.4Å; N399-P404 WeakPolarHBondContact O-CG 3.39Å; N399-V427 WeakPolarHBondContact ND2-CG2 3.41Å; N399-K430 PolarHBondContact OD1-NZ 3.17Å
400	Q	96.9	Very high	95.4	Very high	140 Å²	140	58.1 Å²	58.1	65%	0.654	33%	0.333	S	S	*	.	I	π-helix	trans	-93.1	-35.4	-172.7	-61.9	179.4	16.9	0	0	113.2	Q396	Q396-Q400 VanDerWaalsContact O-CB 3.29Å; Q396-Q400 WeakPolarHBondContact O-CB 3.4Å; Q396-Q400 WeakPolarHBondContact O-CG 3.39Å; Q396-Q400 PolarHBondContact O-N 2.91Å
401	E	95.5	Very high	95.3	Very high	71 Å²	71	59.7 Å²	59.7	33%	0.332	34%	0.34	S	S	.	.	I	π-helix	trans	-108	-46.9	-175.2	-56.1	178.9	-138.7	0	0	112.9	I397 N405 R414	I397-E401 WeakPolarHBondContact O-CB 3.37Å; I397-E401 PolarHBondContact O-N 3.04Å; E401-N405 PolarHBondContact O-ND2 3.49Å; E401-R414 IonicContact OE1-NH1 2.95Å; E401-R414 IonicContact OE2-CZ 2.81Å; E401-R414 IonicContact OE2-NH1 3.25Å; E401-R414 PolarHBondContact OE2-NH1 2.94Å; E401-R414 IonicContact OE2-NH2 2.69Å; E401-R414 PolarHBondContact OE2-NH2 2.93Å
402	I	97	Very high	95.3	Very high	0 Å²	0	58.2 Å²	58.2	0%	0	34%	0.335	C	S	.	.	I	π-helix	trans	-85.1	-56.4	-165.6	-54.2	172	0	0	0	111.7	I397 W398 N405 W406 M409 V415 L418	I397-I402 HydrophobicContact CG2-CD1 3.9Å; I397-I402 HydrophobicContact CG2-CG1 4.23Å; I397-I402 PolarHBondContact O-N 3.47Å; W398-I402 HydrophobicContact CD2-CB 4.48Å; W398-I402 HydrophobicContact CD2-CD1 3.74Å; W398-I402 HydrophobicContact CE3-CB 3.81Å; W398-I402 HydrophobicContact CE3-CD1 3.85Å; W398-I402 HydrophobicContact CE3-CG1 4.42Å; W398-I402 HydrophobicContact CE3-CG2 3.64Å; W398-I402 HydrophobicContact CG-CD1 4.12Å; W398-I402 HydrophobicContact CH2-CG2 4.37Å; W398-I402 HydrophobicContact CZ3-CB 4.22Å; W398-I402 HydrophobicContact CZ3-CD1 4.28Å; W398-I402 HydrophobicContact CZ3-CG2 3.5Å; I402-N405 CarbonylContact O-C 3.27Å; I402-N405 VanDerWaalsContact O-C 3.27Å; I402-N405 PolarHBondContact O-N 2.97Å; I402-N405 VanDerWaalsContact O-N 3.13Å; I402-W406 WeakPolarHBondContact O-CA 3.44Å; I402-W406 PolarHBondContact O-N 3.21Å; I402-M409 HydrophobicContact CG2-CB 4.12Å; I402-V415 HydrophobicContact CD1-CB 4.44Å; I402-V415 HydrophobicContact CD1-CG1 4.15Å; I402-V415 HydrophobicContact CD1-CG2 3.72Å; I402-V415 HydrophobicContact CG1-CG2 3.76Å; I402-V415 HydrophobicContact CG2-CG1 3.87Å; I402-V415 HydrophobicContact CG2-CG2 4.11Å; I402-L418 HydrophobicContact CD1-CD2 3.85Å
403	L	97.1	Very high	95.2	Very high	30 Å²	30	66 Å²	66	16%	0.157	35%	0.354	C	S	.	.	G	3₁₀ helix	trans	-59.4	-43	-177.5	-76.6	176.5	0	0	0	113.7	W398 N405 W406 V427 K430 V431 L434	W398-L403 WeakPolarHBondContact O-CB 3.39Å; W398-L403 WeakPolarHBondContact O-CG 3.26Å; W398-L403 PolarHBondContact O-N 3.35Å; L403-N405 PolarHBondContact O-N 2.89Å; L403-W406 HydrophobicContact CD2-CE3 4.5Å; L403-W406 PolarHBondContact O-N 2.82Å; L403-V427 HydrophobicContact CD1-CG1 3.74Å; L403-V427 HydrophobicContact CG-CG1 4.44Å; L403-K430 HydrophobicContact CD1-CB 4.01Å; L403-K430 HydrophobicContact CD1-CD 3.71Å; L403-K430 HydrophobicContact CD2-CB 4.25Å; L403-V431 HydrophobicContact CD2-CG2 3.98Å; L403-L434 HydrophobicContact CD2-CD1 3.85Å
404	P	97.1	Very high	95.1	Very high	87 Å²	87	68.2 Å²	68.2	57%	0.565	35%	0.354	S	S	*	.	G	3₁₀ helix	trans	-63.9	-22.9	177.6	-23.4	35.9	0	0	0	113.7	N399	N399-P404 WeakPolarHBondContact O-CD 3.4Å; N399-P404 WeakPolarHBondContact O-CG 3.39Å
405	N	95.2	Very high	95.1	Very high	74 Å²	74	67.6 Å²	67.6	40%	0.396	35%	0.35	S	S	.	.	G	3₁₀ helix	trans	-117.5	27.7	-176.9	-58.7	-75.6	0	0	0	111.7	E401 I402 L403 S407 T408 M409	E401-N405 PolarHBondContact O-ND2 3.49Å; I402-N405 CarbonylContact O-C 3.27Å; I402-N405 VanDerWaalsContact O-C 3.27Å; I402-N405 PolarHBondContact O-N 2.97Å; I402-N405 VanDerWaalsContact O-N 3.13Å; L403-N405 PolarHBondContact O-N 2.89Å; N405-S407 VanDerWaalsContact C-N 3.32Å; N405-S407 PolarHBondContact O-N 3.12Å; N405-S407 VanDerWaalsContact O-N 3.12Å; N405-T408 PolarHBondContact O-N 2.93Å; N405-T408 PolarHBondContact O-OG1 3.2Å; N405-T408 VanDerWaalsContact O-OG1 3.1Å; N405-M409 HydrophobicContact CB-CB 4.42Å; N405-M409 HydrophobicContact CB-CG 3.64Å; N405-M409 WeakPolarHBondContact O-CB 3.4Å; N405-M409 PolarHBondContact O-N 3.03Å
406	W	94.2	Very high	95	Very high	47 Å²	47	70.8 Å²	70.8	18%	0.178	36%	0.359	C	S	.	.	H	α-helix	trans	-46.7	-49.6	-167.1	172.3	-107.7	0	0	0	114.1	W398 I402 L403 T408 M409 C410 W419 V431 L434 A435	W398-W406 HydrophobicContact CZ3-CZ3 4.16Å; I402-W406 WeakPolarHBondContact O-CA 3.44Å; I402-W406 PolarHBondContact O-N 3.21Å; L403-W406 HydrophobicContact CD2-CE3 4.5Å; L403-W406 PolarHBondContact O-N 2.82Å; W406-T408 PolarHBondContact O-N 3.14Å; W406-M409 PolarHBondContact O-N 3.13Å; W406-C410 HydrophobicContact CD2-CB 4.01Å; W406-C410 HydrophobicContact CE3-CB 3.91Å; W406-C410 HydrophobicContact CH2-CB 4.21Å; W406-C410 HydrophobicContact CZ2-CB 4.28Å; W406-C410 HydrophobicContact CZ3-CB 4.01Å; W406-C410 VanDerWaalsContact O-CB 3.23Å; W406-C410 WeakPolarHBondContact O-CB 3.48Å; W406-C410 PolarHBondContact O-N 3.08Å; W406-C410 PolarHBondContact O-SG 2.97Å; W406-W419 AromaticContact CH2-CH2 3.52Å; W406-W419 HydrophobicContact CH2-CH2 3.52Å; W406-W419 HydrophobicContact CH2-CZ2 4.36Å; W406-W419 AromaticContact CH2-CZ3 3.98Å; W406-W419 HydrophobicContact CH2-CZ3 3.98Å; W406-W419 HydrophobicContact CZ2-CH2 4.44Å; W406-W419 HydrophobicContact CZ3-CH2 4.13Å; W406-W419 HydrophobicContact CZ3-CZ3 4.18Å; W406-V431 HydrophobicContact CH2-CG1 3.71Å; W406-V431 HydrophobicContact CZ3-CG1 3.76Å; W406-L434 HydrophobicContact CB-CD1 4.49Å; W406-L434 HydrophobicContact CD2-CB 4.34Å; W406-L434 HydrophobicContact CD2-CD1 3.91Å; W406-L434 HydrophobicContact CE3-CD1 4.28Å; W406-L434 HydrophobicContact CG-CD1 4Å; W406-L434 HydrophobicContact CH2-CB 4.35Å; W406-L434 HydrophobicContact CZ2-CB 3.73Å; W406-A435 HydrophobicContact CH2-CB 4.49Å; W406-A435 HydrophobicContact CZ2-CB 4.4Å
407	S	90.4	Very high	94.9	Very high	105 Å²	105	69.2 Å²	69.2	73%	0.734	35%	0.354	S	S	*	.	H	α-helix	trans	-64.3	-21.7	-175	54.1	0	0	0	0	114.9	N405	N405-S407 VanDerWaalsContact C-N 3.32Å; N405-S407 PolarHBondContact O-N 3.12Å; N405-S407 VanDerWaalsContact O-N 3.12Å
408	T	91.3	Very high	94.9	Very high	99 Å²	99	69 Å²	69	61%	0.607	35%	0.353	S	S	*	.	H	α-helix	trans	-104.9	-33	175.9	58.8	0	0	0	0	112.2	N405 W406	N405-T408 PolarHBondContact O-N 2.93Å; N405-T408 PolarHBondContact O-OG1 3.2Å; N405-T408 VanDerWaalsContact O-OG1 3.1Å; W406-T408 PolarHBondContact O-N 3.14Å
409	M	92	Very high	94.8	Very high	51 Å²	51	69.3 Å²	69.3	25%	0.251	35%	0.354	S	S	.	.	H	α-helix	trans	-82.6	-33.1	-175.2	-77.2	-69.1	-163.5	0	0	114.3	I402 N405 W406 T411 S412 V415	I402-M409 HydrophobicContact CG2-CB 4.12Å; N405-M409 HydrophobicContact CB-CB 4.42Å; N405-M409 HydrophobicContact CB-CG 3.64Å; N405-M409 WeakPolarHBondContact O-CB 3.4Å; N405-M409 PolarHBondContact O-N 3.03Å; W406-M409 PolarHBondContact O-N 3.13Å; M409-T411 VanDerWaalsContact C-N 3.26Å; M409-T411 PolarHBondContact O-N 3.04Å; M409-S412 VanDerWaalsContact O-CB 3.3Å; M409-S412 WeakPolarHBondContact O-CB 3.43Å; M409-S412 PolarHBondContact O-N 3.22Å; M409-S412 PolarHBondContact O-OG 3.4Å; M409-V415 HydrophobicContact CB-CG2 4.31Å; M409-V415 WeakPolarHBondContact O-CB 3.45Å; M409-V415 WeakPolarHBondContact O-CG2 3.11Å
410	C	89.7	Confident	94.8	Very high	27 Å²	27	68.5 Å²	68.5	18%	0.182	35%	0.347	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.3	-29	-168.9	68.5	0	0	0	0	114.3	W406 W419	W406-C410 HydrophobicContact CD2-CB 4.01Å; W406-C410 HydrophobicContact CE3-CB 3.91Å; W406-C410 HydrophobicContact CH2-CB 4.21Å; W406-C410 HydrophobicContact CZ2-CB 4.28Å; W406-C410 HydrophobicContact CZ3-CB 4.01Å; W406-C410 VanDerWaalsContact O-CB 3.23Å; W406-C410 WeakPolarHBondContact O-CB 3.48Å; W406-C410 PolarHBondContact O-N 3.08Å; W406-C410 PolarHBondContact O-SG 2.97Å; C410-W419 HydrophobicContact CB-CZ3 4.34Å
411	T	90.9	Very high	94.7	Very high	107 Å²	107	67.7 Å²	67.7	66%	0.656	34%	0.343	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.1	-14	177.1	58.4	0	0	0	0	113.3	M409 R416	M409-T411 VanDerWaalsContact C-N 3.26Å; M409-T411 PolarHBondContact O-N 3.04Å; T411-R416 WeakPolarHBondContact O-CD 3.16Å
412	S	95.4	Very high	94.8	Very high	35 Å²	35	65 Å²	65	25%	0.245	33%	0.334	C	S	.	.	S	Bend	trans	-66.2	143.2	-174.2	75.8	0	0	0	0	111.9	M409 R414 V415 R416	M409-S412 VanDerWaalsContact O-CB 3.3Å; M409-S412 WeakPolarHBondContact O-CB 3.43Å; M409-S412 PolarHBondContact O-N 3.22Å; M409-S412 PolarHBondContact O-OG 3.4Å; S412-R414 VanDerWaalsContact C-N 3.35Å; S412-R414 PolarHBondContact O-N 3.37Å; S412-V415 PolarHBondContact O-N 2.81Å; S412-V415 VanDerWaalsContact O-N 3.12Å; S412-V415 WeakPolarHBondContact OG-CB 3.49Å; S412-V415 VanDerWaalsContact OG-CG2 3.26Å; S412-V415 WeakPolarHBondContact OG-CG2 3.06Å; S412-R416 WeakPolarHBondContact O-CG 3.38Å; S412-R416 PolarHBondContact O-N 3.37Å
413	R	95.1	Very high	94.8	Very high	197 Å²	197	65.1 Å²	65.1	74%	0.743	33%	0.334	S	S	*	.	H	α-helix	trans	-55.7	-46.1	-176.1	179.1	174.5	176.4	174.5	3.3	112.7	V415 R416 D417	R413-V415 VanDerWaalsContact C-N 3.3Å; R413-V415 PolarHBondContact O-N 3.16Å; R413-R416 PolarHBondContact O-N 3.45Å; R413-D417 VanDerWaalsContact CG-OD2 3.26Å; R413-D417 WeakPolarHBondContact CG-OD2 3.28Å; R413-D417 IonicContact NE-OD2 3.58Å; R413-D417 PolarHBondContact NE-OD2 3.24Å; R413-D417 WeakPolarHBondContact O-CB 3.44Å; R413-D417 VanDerWaalsContact O-CG 3.24Å; R413-D417 PolarHBondContact O-N 2.91Å
414	R	94.9	Very high	94.8	Very high	117 Å²	117	63.9 Å²	63.9	44%	0.442	33%	0.329	S	S	.	.	H	α-helix	trans	-56.8	-43.6	178.5	-175.2	-172.5	66.4	134.9	-2.4	112	E401 S412 D417 L418	E401-R414 IonicContact OE1-NH1 2.95Å; E401-R414 IonicContact OE2-CZ 2.81Å; E401-R414 IonicContact OE2-NH1 3.25Å; E401-R414 PolarHBondContact OE2-NH1 2.94Å; E401-R414 IonicContact OE2-NH2 2.69Å; E401-R414 PolarHBondContact OE2-NH2 2.93Å; S412-R414 VanDerWaalsContact C-N 3.35Å; S412-R414 PolarHBondContact O-N 3.37Å; R414-D417 PolarHBondContact O-N 3.41Å; R414-L418 WeakPolarHBondContact O-CB 3.48Å; R414-L418 PolarHBondContact O-N 3.27Å
415	V	95.8	Very high	94.8	Very high	1 Å²	1	62.7 Å²	62.7	1%	0.006	32%	0.321	C	S	.	.	H	α-helix	trans	-69.7	-41.9	179.1	173	0	0	0	0	110.7	W398 I402 M409 S412 R413 D417 L418 W419	W398-V415 HydrophobicContact CH2-CG1 4.1Å; I402-V415 HydrophobicContact CD1-CB 4.44Å; I402-V415 HydrophobicContact CD1-CG1 4.15Å; I402-V415 HydrophobicContact CD1-CG2 3.72Å; I402-V415 HydrophobicContact CG1-CG2 3.76Å; I402-V415 HydrophobicContact CG2-CG1 3.87Å; I402-V415 HydrophobicContact CG2-CG2 4.11Å; M409-V415 HydrophobicContact CB-CG2 4.31Å; M409-V415 WeakPolarHBondContact O-CB 3.45Å; M409-V415 WeakPolarHBondContact O-CG2 3.11Å; S412-V415 PolarHBondContact O-N 2.81Å; S412-V415 VanDerWaalsContact O-N 3.12Å; S412-V415 WeakPolarHBondContact OG-CB 3.49Å; S412-V415 VanDerWaalsContact OG-CG2 3.26Å; S412-V415 WeakPolarHBondContact OG-CG2 3.06Å; R413-V415 VanDerWaalsContact C-N 3.3Å; R413-V415 PolarHBondContact O-N 3.16Å; V415-D417 PolarHBondContact O-N 2.84Å; V415-L418 PolarHBondContact O-N 3.29Å; V415-W419 HydrophobicContact CG1-CE3 4.14Å; V415-W419 WeakPolarHBondContact O-CB 3.33Å; V415-W419 PolarHBondContact O-N 2.78Å
416	R	96.1	Very high	94.8	Very high	80 Å²	80	63.4 Å²	63.4	30%	0.302	33%	0.332	S	S	.	.	H	α-helix	trans	-61.6	-42.2	174.6	-66.9	-177.9	57.9	78.5	6.6	112.1	T411 S412 R413 W419 W420 R627 D628	T411-R416 WeakPolarHBondContact O-CD 3.16Å; S412-R416 WeakPolarHBondContact O-CG 3.38Å; S412-R416 PolarHBondContact O-N 3.37Å; R413-R416 PolarHBondContact O-N 3.45Å; R416-W419 PolarHBondContact O-N 3.07Å; R416-W420 PolarHBondContact O-N 2.78Å; R416-W420 VanDerWaalsContact O-N 3.08Å; R416-R627 PolarHBondContact O-NH1 3.01Å; R416-D628 IonicContact CZ-OD1 3.46Å; R416-D628 IonicContact NH1-OD1 3.6Å; R416-D628 PolarHBondContact NH1-OD1 3.36Å; R416-D628 IonicContact NH2-OD1 3.73Å; R416-D628 PolarHBondContact NH2-OD1 3.27Å; R416-D628 IonicContact NH2-OD2 2.75Å; R416-D628 PolarHBondContact NH2-OD2 3.33Å
417	D	95.7	Very high	95	Very high	83 Å²	83	61.2 Å²	61.2	44%	0.444	32%	0.323	S	S	.	.	H	α-helix	trans	-68	-36.2	178.6	-67.7	-16.2	0	0	0	111.7	R413 R414 V415	R413-D417 VanDerWaalsContact CG-OD2 3.26Å; R413-D417 WeakPolarHBondContact CG-OD2 3.28Å; R413-D417 IonicContact NE-OD2 3.58Å; R413-D417 PolarHBondContact NE-OD2 3.24Å; R413-D417 WeakPolarHBondContact O-CB 3.44Å; R413-D417 VanDerWaalsContact O-CG 3.24Å; R413-D417 PolarHBondContact O-N 2.91Å; R414-D417 PolarHBondContact O-N 3.41Å; V415-D417 PolarHBondContact O-N 2.84Å
418	L	96.3	Very high	95.3	Very high	40 Å²	40	57.2 Å²	57.2	21%	0.209	29%	0.292	C	S	.	.	H	α-helix	trans	-67.5	-46.8	171.3	178.4	67.4	0	0	0	111.8	A394 I397 I402 R414 V415 W420 Q421	A394-L418 HydrophobicContact CB-CD1 4.11Å; I397-L418 HydrophobicContact CG2-CD2 4.14Å; I402-L418 HydrophobicContact CD1-CD2 3.85Å; R414-L418 WeakPolarHBondContact O-CB 3.48Å; R414-L418 PolarHBondContact O-N 3.27Å; V415-L418 PolarHBondContact O-N 3.29Å; L418-W420 PolarHBondContact O-N 3.09Å; L418-Q421 WeakPolarHBondContact O-CB 3.17Å; L418-Q421 PolarHBondContact O-N 3.22Å
419	W	97	Very high	95.6	Very high	6 Å²	6	52.8 Å²	52.8	2%	0.023	27%	0.267	C	S	.	.	H	α-helix	trans	-60.8	-27.1	179.9	-161.9	-21.7	0	0	0	112	W398 W406 C410 V415 R416 Q421 G422 I423 V431 D623 C626 R627	W398-W419 HydrophobicContact CH2-CB 4.43Å; W398-W419 AromaticContact CH2-CD2 3.8Å; W398-W419 HydrophobicContact CH2-CD2 3.8Å; W398-W419 AromaticContact CH2-CE3 3.76Å; W398-W419 HydrophobicContact CH2-CE3 3.76Å; W398-W419 HydrophobicContact CH2-CG 4.13Å; W398-W419 HydrophobicContact CH2-CZ3 4.36Å; W398-W419 HydrophobicContact CZ2-CB 4.01Å; W398-W419 HydrophobicContact CZ2-CD2 4.18Å; W398-W419 HydrophobicContact CZ2-CE3 4.46Å; W398-W419 AromaticContact CZ2-CG 4Å; W398-W419 HydrophobicContact CZ2-CG 4Å; W406-W419 AromaticContact CH2-CH2 3.52Å; W406-W419 HydrophobicContact CH2-CH2 3.52Å; W406-W419 HydrophobicContact CH2-CZ2 4.36Å; W406-W419 AromaticContact CH2-CZ3 3.98Å; W406-W419 HydrophobicContact CH2-CZ3 3.98Å; W406-W419 HydrophobicContact CZ2-CH2 4.44Å; W406-W419 HydrophobicContact CZ3-CH2 4.13Å; W406-W419 HydrophobicContact CZ3-CZ3 4.18Å; C410-W419 HydrophobicContact CB-CZ3 4.34Å; V415-W419 HydrophobicContact CG1-CE3 4.14Å; V415-W419 WeakPolarHBondContact O-CB 3.33Å; V415-W419 PolarHBondContact O-N 2.78Å; R416-W419 PolarHBondContact O-N 3.07Å; W419-Q421 VanDerWaalsContact C-N 3.27Å; W419-Q421 PolarHBondContact O-N 3.18Å; W419-G422 PolarHBondContact O-N 2.96Å; W419-G422 VanDerWaalsContact O-N 3.14Å; W419-I423 HydrophobicContact CG-CG1 4.43Å; W419-V431 HydrophobicContact CH2-CG1 4.14Å; W419-V431 HydrophobicContact CZ2-CG1 3.77Å; W419-D623 PolarHBondContact NE1-O 3.46Å; W419-C626 HydrophobicContact CZ2-CB 4.36Å; W419-R627 HydrophobicContact CD2-CB 3.92Å; W419-R627 HydrophobicContact CD2-CG 3.67Å; W419-R627 HydrophobicContact CE3-CB 4.28Å; W419-R627 HydrophobicContact CE3-CG 3.61Å; W419-R627 HydrophobicContact CG-CB 4.46Å; W419-R627 HydrophobicContact CG-CG 4.29Å; W419-R627 HydrophobicContact CH2-CB 4.02Å; W419-R627 HydrophobicContact CH2-CG 3.94Å; W419-R627 HydrophobicContact CZ2-CB 3.66Å; W419-R627 HydrophobicContact CZ2-CG 4.02Å; W419-R627 HydrophobicContact CZ3-CB 4.33Å; W419-R627 HydrophobicContact CZ3-CG 3.76Å
420	W	97.3	Very high	95.9	Very high	42 Å²	42	55.8 Å²	55.8	16%	0.159	28%	0.278	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66.1	-24.8	171.9	-172.7	-97	0	0	0	114.3	R416 L418 G422 R620 V624 F632 F673 I676 A677	R416-W420 PolarHBondContact O-N 2.78Å; R416-W420 VanDerWaalsContact O-N 3.08Å; L418-W420 PolarHBondContact O-N 3.09Å; W420-G422 PolarHBondContact O-N 3.39Å; W420-R620 PolarHBondContact O-NE 3.4Å; W420-R620 PolarHBondContact O-NH2 3.44Å; W420-R620 VanDerWaalsContact O-NH2 3.15Å; W420-V624 HydrophobicContact CE3-CG1 3.9Å; W420-V624 HydrophobicContact CE3-CG2 4.1Å; W420-V624 HydrophobicContact CZ3-CG1 3.88Å; W420-F632 AromaticContact CH2-CE2 3.89Å; W420-F632 HydrophobicContact CH2-CE2 3.89Å; W420-F632 HydrophobicContact CH2-CZ 4.44Å; W420-F632 HydrophobicContact CZ3-CD2 4.48Å; W420-F632 AromaticContact CZ3-CE2 3.6Å; W420-F632 HydrophobicContact CZ3-CE2 3.6Å; W420-F632 HydrophobicContact CZ3-CZ 4.22Å; W420-F673 HydrophobicContact CD2-CD1 4.36Å; W420-F673 AromaticContact CE2-CD1 3.91Å; W420-F673 HydrophobicContact CH2-CD1 4.49Å; W420-F673 AromaticContact CZ2-CD1 3.97Å; W420-F673 HydrophobicContact CZ2-CD1 3.97Å; W420-I676 HydrophobicContact CH2-CB 4.49Å; W420-I676 HydrophobicContact CH2-CG2 3.9Å; W420-A677 HydrophobicContact CZ2-CB 3.88Å
421	Q	95	Very high	96.3	Very high	123 Å²	123	54.5 Å²	54.5	58%	0.575	27%	0.269	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.9	-12.7	174.6	-49.1	-53.3	-17.4	0	0	112.5	L418 W419 R620	L418-Q421 WeakPolarHBondContact O-CB 3.17Å; L418-Q421 PolarHBondContact O-N 3.22Å; W419-Q421 VanDerWaalsContact C-N 3.27Å; W419-Q421 PolarHBondContact O-N 3.18Å; Q421-R620 PolarHBondContact O-NE 2.82Å
422	G	96.4	Very high	96.6	Very high	13 Å²	13	49.5 Å²	49.5	13%	0.134	24%	0.238	C	C	.	.			trans	107.9	153.1	-172.3	0	0	0	0	0	111.7	W419 W420 D623	W419-G422 PolarHBondContact O-N 2.96Å; W419-G422 VanDerWaalsContact O-N 3.14Å; W420-G422 PolarHBondContact O-N 3.39Å; G422-D623 WeakPolarHBondContact CA-OD2 3.44Å
423	I	97.9	Very high	96.7	Very high	3 Å²	3	50 Å²	50	2%	0.015	24%	0.242	C	C	.	.			trans	-89.7	135.1	173.6	-53.6	167.7	0	0	0	107.8	W398 W419 V427 R428 V431 D623	W398-I423 HydrophobicContact CZ2-CG1 4.18Å; W419-I423 HydrophobicContact CG-CG1 4.43Å; I423-V427 HydrophobicContact CG2-CB 4.01Å; I423-V427 HydrophobicContact CG2-CG1 4.35Å; I423-R428 HydrophobicContact CB-CG 3.86Å; I423-R428 HydrophobicContact CG2-CG 3.98Å; I423-R428 PolarHBondContact O-NE 3.29Å; I423-R428 VanDerWaalsContact O-NE 3.11Å; I423-R428 PolarHBondContact O-NH2 3.03Å; I423-V431 HydrophobicContact CD1-CB 3.86Å; I423-V431 HydrophobicContact CD1-CG1 3.61Å; I423-V431 HydrophobicContact CD1-CG2 4.47Å; I423-V431 HydrophobicContact CG2-CB 4.47Å; I423-V431 HydrophobicContact CG2-CG2 4.14Å; I423-D623 WeakPolarHBondContact CB-OD1 3.36Å; I423-D623 HydrophobicContact CD1-CB 3.92Å; I423-D623 WeakPolarHBondContact CD1-OD1 3.29Å; I423-D623 HydrophobicContact CG1-CB 3.9Å; I423-D623 WeakPolarHBondContact CG1-OD1 3.35Å; I423-D623 PolarHBondContact N-OD2 2.85Å
424	P	97.8	Very high	96.7	Very high	5 Å²	5	44.8 Å²	44.8	3%	0.032	23%	0.229	C	C	.	.			trans	-55.6	136.6	172.9	-27.7	36.7	0	0	0	111.7	I391 A394 A395 W398 S426 V427 R428	I391-P424 HydrophobicContact CG2-CB 3.98Å; A394-P424 HydrophobicContact CB-CG 3.71Å; A395-P424 HydrophobicContact CB-CB 3.83Å; A395-P424 HydrophobicContact CB-CG 4.03Å; W398-P424 VanDerWaalsContact CD1-CD 3.5Å; P424-S426 VanDerWaalsContact C-N 3.27Å; P424-S426 PolarHBondContact O-N 3.14Å; P424-S426 VanDerWaalsContact O-N 3.14Å; P424-V427 HydrophobicContact CB-CG2 4.12Å; P424-V427 PolarHBondContact O-N 3.49Å; P424-R428 PolarHBondContact O-N 3.18Å; P424-R428 VanDerWaalsContact O-N 3.13Å
425	P	96.1	Very high	96.8	Very high	61 Å²	61	40.8 Å²	40.8	40%	0.396	22%	0.22	S	C	.	.	H	α-helix	trans	-52.7	-41.2	-174.3	-28.8	34.3	0	0	0	114.2	V427 R428	P425-V427 PolarHBondContact O-N 3.26Å; P425-R428 PolarHBondContact O-N 3.42Å
426	S	96.3	Very high	96.8	Very high	90 Å²	90	41.3 Å²	41.3	63%	0.629	22%	0.223	S	C	*	.	H	α-helix	trans	-66.4	-3	177.6	55.9	0	0	0	0	115.4	P424	P424-S426 VanDerWaalsContact C-N 3.27Å; P424-S426 PolarHBondContact O-N 3.14Å; P424-S426 VanDerWaalsContact O-N 3.14Å
427	V	97.5	Very high	96.8	Very high	1 Å²	1	38.9 Å²	38.9	1%	0.006	22%	0.223	C	C	.	.	H	α-helix	trans	-121.6	-22.9	-179.8	-166.2	0	0	0	0	111.6	A395 W398 N399 L403 I423 P424 P425 G429 K430 V431	A395-V427 HydrophobicContact CB-CG2 4.18Å; W398-V427 HydrophobicContact CB-CB 4.43Å; W398-V427 HydrophobicContact CB-CG1 3.72Å; W398-V427 HydrophobicContact CB-CG2 4.17Å; W398-V427 HydrophobicContact CD2-CG1 4.44Å; W398-V427 HydrophobicContact CG-CG1 4.15Å; N399-V427 WeakPolarHBondContact ND2-CG2 3.41Å; L403-V427 HydrophobicContact CD1-CG1 3.74Å; L403-V427 HydrophobicContact CG-CG1 4.44Å; I423-V427 HydrophobicContact CG2-CB 4.01Å; I423-V427 HydrophobicContact CG2-CG1 4.35Å; P424-V427 HydrophobicContact CB-CG2 4.12Å; P424-V427 PolarHBondContact O-N 3.49Å; P425-V427 PolarHBondContact O-N 3.26Å; V427-G429 PolarHBondContact O-N 3.39Å; V427-K430 PolarHBondContact O-N 3.2Å; V427-K430 VanDerWaalsContact O-N 3.09Å; V427-V431 HydrophobicContact CG1-CG2 3.78Å; V427-V431 PolarHBondContact O-N 3.4Å
428	R	97.9	Very high	96.9	Very high	20 Å²	20	37.8 Å²	37.8	8%	0.075	22%	0.217	C	C	.	.	H	α-helix	trans	-45	-54.1	-177.2	-83	178.8	-179.7	148.2	4.9	113.1	I423 P424 P425 K430 V431 W432 N538 D616 D623	I423-R428 HydrophobicContact CB-CG 3.86Å; I423-R428 HydrophobicContact CG2-CG 3.98Å; I423-R428 PolarHBondContact O-NE 3.29Å; I423-R428 VanDerWaalsContact O-NE 3.11Å; I423-R428 PolarHBondContact O-NH2 3.03Å; P424-R428 PolarHBondContact O-N 3.18Å; P424-R428 VanDerWaalsContact O-N 3.13Å; P425-R428 PolarHBondContact O-N 3.42Å; R428-K430 PolarHBondContact O-N 3.39Å; R428-V431 PolarHBondContact O-N 3.15Å; R428-V431 VanDerWaalsContact O-N 3.07Å; R428-W432 HydrophobicContact CB-CD2 4.22Å; R428-W432 HydrophobicContact CB-CZ2 4.19Å; R428-W432 HydrophobicContact CG-CZ2 3.96Å; R428-W432 WeakPolarHBondContact O-CB 3.46Å; R428-W432 VanDerWaalsContact O-CG 3.23Å; R428-W432 PolarHBondContact O-N 3.38Å; R428-N538 HydrophobicContact CB-CB 4.15Å; R428-N538 VanDerWaalsContact CB-OD1 3.28Å; R428-N538 WeakPolarHBondContact CB-OD1 3.47Å; R428-N538 WeakPolarHBondContact CD-OD1 3.45Å; R428-D616 IonicContact NH1-OD1 3.64Å; R428-D623 IonicContact NE-OD1 2.83Å; R428-D623 IonicContact NE-OD2 2.69Å; R428-D623 IonicContact NH2-OD2 3.14Å
429	G	97.4	Very high	96.9	Very high	7 Å²	7	42 Å²	42	7%	0.072	24%	0.236	C	C	.	.	H	α-helix	trans	-51.7	-49.6	-179.9	0	0	0	0	0	114.2	V427 V431 W432 S433 N538 L539	V427-G429 PolarHBondContact O-N 3.39Å; G429-V431 VanDerWaalsContact C-N 3.33Å; G429-V431 PolarHBondContact O-N 3.47Å; G429-W432 PolarHBondContact O-N 2.91Å; G429-S433 WeakPolarHBondContact O-CB 3.45Å; G429-S433 PolarHBondContact O-N 2.87Å; G429-S433 PolarHBondContact O-OG 3.4Å; G429-S433 VanDerWaalsContact O-OG 3.05Å; G429-N538 WeakPolarHBondContact CA-O 3.32Å; G429-N538 PolarHBondContact N-O 3.3Å; G429-L539 VanDerWaalsContact CA-CD2 3.49Å; G429-L539 WeakPolarHBondContact O-CD2 3.29Å
430	K	97.2	Very high	96.9	Very high	113 Å²	113	43.9 Å²	43.9	49%	0.491	25%	0.247	S	C	.	.	H	α-helix	trans	-63.7	-37.6	179.6	-61.6	179.4	-172.5	172.1	0	112.3	N399 L403 V427 R428 S433 L434	N399-K430 PolarHBondContact OD1-NZ 3.17Å; L403-K430 HydrophobicContact CD1-CB 4.01Å; L403-K430 HydrophobicContact CD1-CD 3.71Å; L403-K430 HydrophobicContact CD2-CB 4.25Å; V427-K430 PolarHBondContact O-N 3.2Å; V427-K430 VanDerWaalsContact O-N 3.09Å; R428-K430 PolarHBondContact O-N 3.39Å; K430-S433 PolarHBondContact O-OG 3.46Å; K430-L434 WeakPolarHBondContact O-CB 3.43Å; K430-L434 WeakPolarHBondContact O-CD1 3.38Å; K430-L434 WeakPolarHBondContact O-CG 3.27Å; K430-L434 PolarHBondContact O-N 2.9Å
431	V	97.9	Very high	96.9	Very high	0 Å²	0	48.1 Å²	48.1	0%	0	27%	0.272	C	S	.	.	H	α-helix	trans	-77.8	-41.4	-179.4	-176.9	0	0	0	0	111.2	W398 L403 W406 W419 I423 V427 R428 G429 L434 A435	W398-V431 HydrophobicContact CD2-CG2 4.48Å; W398-V431 HydrophobicContact CE3-CG2 3.75Å; W398-V431 HydrophobicContact CH2-CG1 4.13Å; W398-V431 HydrophobicContact CH2-CG2 4.28Å; W398-V431 HydrophobicContact CZ3-CG1 4.07Å; W398-V431 HydrophobicContact CZ3-CG2 3.63Å; L403-V431 HydrophobicContact CD2-CG2 3.98Å; W406-V431 HydrophobicContact CH2-CG1 3.71Å; W406-V431 HydrophobicContact CZ3-CG1 3.76Å; W419-V431 HydrophobicContact CH2-CG1 4.14Å; W419-V431 HydrophobicContact CZ2-CG1 3.77Å; I423-V431 HydrophobicContact CD1-CB 3.86Å; I423-V431 HydrophobicContact CD1-CG1 3.61Å; I423-V431 HydrophobicContact CD1-CG2 4.47Å; I423-V431 HydrophobicContact CG2-CB 4.47Å; I423-V431 HydrophobicContact CG2-CG2 4.14Å; V427-V431 HydrophobicContact CG1-CG2 3.78Å; V427-V431 PolarHBondContact O-N 3.4Å; R428-V431 PolarHBondContact O-N 3.15Å; R428-V431 VanDerWaalsContact O-N 3.07Å; G429-V431 VanDerWaalsContact C-N 3.33Å; G429-V431 PolarHBondContact O-N 3.47Å; V431-L434 PolarHBondContact O-N 3.08Å; V431-A435 WeakPolarHBondContact O-CB 3.42Å; V431-A435 PolarHBondContact O-N 2.77Å
432	W	98	Very high	97.1	Very high	2 Å²	2	42.4 Å²	42.4	1%	0.008	25%	0.245	C	C	.	.	H	α-helix	trans	-66.3	-42	178.3	-66.8	0.5	0	0	0	111.8	R428 G429 A435 V436 V534 L535 N538 C619 W622 D623	R428-W432 HydrophobicContact CB-CD2 4.22Å; R428-W432 HydrophobicContact CB-CZ2 4.19Å; R428-W432 HydrophobicContact CG-CZ2 3.96Å; R428-W432 WeakPolarHBondContact O-CB 3.46Å; R428-W432 VanDerWaalsContact O-CG 3.23Å; R428-W432 PolarHBondContact O-N 3.38Å; G429-W432 PolarHBondContact O-N 2.91Å; W432-A435 PolarHBondContact O-N 3.33Å; W432-V436 WeakPolarHBondContact O-CB 3.33Å; W432-V436 WeakPolarHBondContact O-CG2 3.2Å; W432-V436 PolarHBondContact O-N 2.85Å; W432-V534 HydrophobicContact CH2-CG1 3.66Å; W432-V534 HydrophobicContact CZ3-CG1 3.7Å; W432-L535 HydrophobicContact CE3-CD2 4.29Å; W432-N538 HydrophobicContact CE3-CB 4.05Å; W432-N538 HydrophobicContact CH2-CB 4.47Å; W432-N538 HydrophobicContact CZ3-CB 3.77Å; W432-C619 HydrophobicContact CH2-CB 4.34Å; W432-C619 HydrophobicContact CZ2-CB 4.36Å; W432-W622 HydrophobicContact CE3-CE3 4.26Å; W432-W622 HydrophobicContact CH2-CB 4.32Å; W432-W622 HydrophobicContact CH2-CE3 4.18Å; W432-W622 HydrophobicContact CZ2-CB 3.9Å; W432-W622 AromaticContact CZ3-CE3 3.99Å; W432-W622 HydrophobicContact CZ3-CE3 3.99Å; W432-W622 HydrophobicContact CZ3-CZ3 4.42Å; W432-D623 PolarHBondContact NE1-OD1 2.89Å
433	S	96.8	Very high	97.2	Very high	47 Å²	47	45.1 Å²	45.1	33%	0.329	26%	0.26	S	S	.	.	H	α-helix	trans	-65.6	-40.3	177.1	64	0	0	0	0	112.3	G429 K430 A435 G437	G429-S433 WeakPolarHBondContact O-CB 3.45Å; G429-S433 PolarHBondContact O-N 2.87Å; G429-S433 PolarHBondContact O-OG 3.4Å; G429-S433 VanDerWaalsContact O-OG 3.05Å; K430-S433 PolarHBondContact O-OG 3.46Å; S433-A435 VanDerWaalsContact C-N 3.31Å; S433-A435 PolarHBondContact O-N 3.38Å; S433-G437 PolarHBondContact O-N 3.1Å
434	L	96.5	Very high	97.2	Very high	87 Å²	87	49.3 Å²	49.3	46%	0.455	28%	0.279	S	S	.	.	H	α-helix	trans	-66	-29.2	173.5	-73.3	173.2	0	0	0	113.6	L403 W406 K430 V431	L403-L434 HydrophobicContact CD2-CD1 3.85Å; W406-L434 HydrophobicContact CB-CD1 4.49Å; W406-L434 HydrophobicContact CD2-CB 4.34Å; W406-L434 HydrophobicContact CD2-CD1 3.91Å; W406-L434 HydrophobicContact CE3-CD1 4.28Å; W406-L434 HydrophobicContact CG-CD1 4Å; W406-L434 HydrophobicContact CH2-CB 4.35Å; W406-L434 HydrophobicContact CZ2-CB 3.73Å; K430-L434 WeakPolarHBondContact O-CB 3.43Å; K430-L434 WeakPolarHBondContact O-CD1 3.38Å; K430-L434 WeakPolarHBondContact O-CG 3.27Å; K430-L434 PolarHBondContact O-N 2.9Å; V431-L434 PolarHBondContact O-N 3.08Å
435	A	95.9	Very high	97.2	Very high	32 Å²	32	55.8 Å²	55.8	26%	0.264	31%	0.309	S	S	.	.	H	α-helix	trans	-91.3	-38.1	-176.8	0	0	0	0	0	113.9	W406 V431 W432 S433 C626	W406-A435 HydrophobicContact CH2-CB 4.49Å; W406-A435 HydrophobicContact CZ2-CB 4.4Å; V431-A435 WeakPolarHBondContact O-CB 3.42Å; V431-A435 PolarHBondContact O-N 2.77Å; W432-A435 PolarHBondContact O-N 3.33Å; S433-A435 VanDerWaalsContact C-N 3.31Å; S433-A435 PolarHBondContact O-N 3.38Å; A435-C626 HydrophobicContact CB-CB 3.73Å
436	V	96.3	Very high	97.3	Very high	12 Å²	12	55.4 Å²	55.4	7%	0.073	30%	0.303	C	S	.	.	H	α-helix	trans	-70	-39	172	173.7	0	0	0	0	110.3	W432 N550 L551 K554	W432-V436 WeakPolarHBondContact O-CB 3.33Å; W432-V436 WeakPolarHBondContact O-CG2 3.2Å; W432-V436 PolarHBondContact O-N 2.85Å; V436-N550 HydrophobicContact CG1-CB 3.89Å; V436-L551 HydrophobicContact CG1-CB 4.24Å; V436-K554 WeakPolarHBondContact O-CE 3.26Å; V436-K554 PolarHBondContact O-NZ 2.92Å
437	G	95.9	Very high	97.4	Very high	29 Å²	29	51.6 Å²	51.6	30%	0.299	28%	0.275	S	S	.	.			trans	73.4	-177.9	-178.4	0	0	0	0	0	113.8	S433 N550	S433-G437 PolarHBondContact O-N 3.1Å; G437-N550 WeakPolarHBondContact O-CB 3.47Å
438	N	97.4	Very high	97.5	Very high	60 Å²	60	56 Å²	56	32%	0.321	30%	0.298	S	S	.	.			trans	-130.6	56.7	178.1	-166.8	9.4	0	0	0	111.6	L440 N441 I442 I546 N550	N438-L440 PolarHBondContact O-N 3.12Å; N438-N441 PolarHBondContact O-N 2.99Å; N438-N441 PolarHBondContact OD1-N 2.75Å; N438-I442 PolarHBondContact ND2-N 3.19Å; N438-I442 PolarHBondContact ND2-O 3.12Å; N438-I442 PolarHBondContact OD1-N 2.94Å; N438-I546 HydrophobicContact CB-CG2 4.03Å; N438-N550 WeakPolarHBondContact CA-OD1 3.15Å; N438-N550 PolarHBondContact OD1-ND2 3.21Å
439	E	96.8	Very high	97.5	Very high	130 Å²	130	58.2 Å²	58.2	61%	0.607	31%	0.311	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.8	-29.8	175.9	-68	167.9	-134.5	0	0	112.5	N441 N550 K554	E439-N441 VanDerWaalsContact C-N 3.26Å; E439-N441 PolarHBondContact O-N 2.98Å; E439-N441 PolarHBondContact O-ND2 3.18Å; E439-N550 PolarHBondContact N-OD1 3.13Å; E439-K554 IonicContact OE1-NZ 2.67Å; E439-K554 PolarHBondContact OE1-NZ 3.05Å
440	L	97.1	Very high	97.5	Very high	45 Å²	45	58 Å²	58	24%	0.236	31%	0.309	C	S	.	.	T	Hydrogen-bonded Turn	trans	-76.7	-6.6	175.7	-65.9	176.4	0	0	0	114.3	N438 I442 Y518 A549 N550 N553	N438-L440 PolarHBondContact O-N 3.12Å; L440-I442 HydrophobicContact CB-CD1 3.8Å; L440-I442 HydrophobicContact CB-CG1 3.74Å; L440-I442 HydrophobicContact CD1-CD1 3.8Å; L440-I442 HydrophobicContact CG-CD1 4.49Å; L440-I442 PolarHBondContact O-N 3.34Å; L440-Y518 HydrophobicContact CD1-CE1 4.32Å; L440-A549 HydrophobicContact CD1-CB 4.26Å; L440-A549 WeakPolarHBondContact CD1-O 3.46Å; L440-N550 WeakPolarHBondContact CB-OD1 3.36Å; L440-N550 WeakPolarHBondContact CG-OD1 3.3Å; L440-N550 PolarHBondContact N-OD1 3.21Å; L440-N553 HydrophobicContact CD1-CB 3.88Å; L440-N553 HydrophobicContact CD2-CB 4.38Å; L440-N553 HydrophobicContact CG-CB 4.38Å
441	N	97.8	Very high	97.5	Very high	130 Å²	130	53.6 Å²	53.6	70%	0.695	29%	0.29	S	S	*	.			trans	53.4	34.2	-179	-61.6	-93.2	0	0	0	113.8	N438 E439	N438-N441 PolarHBondContact O-N 2.99Å; N438-N441 PolarHBondContact OD1-N 2.75Å; E439-N441 VanDerWaalsContact C-N 3.26Å; E439-N441 PolarHBondContact O-N 2.98Å; E439-N441 PolarHBondContact O-ND2 3.18Å
442	I	98	Very high	97.5	Very high	3 Å²	3	56.3 Å²	56.3	2%	0.015	31%	0.313	C	S	.	.			trans	-70.8	133.7	-178.9	-63.4	169.1	0	0	0	109.6	N438 L440 L446 Y518 F545 I546 A549	N438-I442 PolarHBondContact ND2-N 3.19Å; N438-I442 PolarHBondContact ND2-O 3.12Å; N438-I442 PolarHBondContact OD1-N 2.94Å; L440-I442 HydrophobicContact CB-CD1 3.8Å; L440-I442 HydrophobicContact CB-CG1 3.74Å; L440-I442 HydrophobicContact CD1-CD1 3.8Å; L440-I442 HydrophobicContact CG-CD1 4.49Å; L440-I442 PolarHBondContact O-N 3.34Å; I442-L446 HydrophobicContact CG1-CD2 4.43Å; I442-L446 HydrophobicContact CG2-CD2 4.27Å; I442-Y518 HydrophobicContact CD1-CD1 4.42Å; I442-Y518 HydrophobicContact CD1-CE1 3.63Å; I442-Y518 HydrophobicContact CG1-CE1 4.38Å; I442-Y518 HydrophobicContact CG1-CE2 4.42Å; I442-F545 HydrophobicContact CG2-CD1 3.92Å; I442-F545 HydrophobicContact CG2-CE1 3.74Å; I442-I546 HydrophobicContact CB-CG1 3.98Å; I442-I546 HydrophobicContact CG2-CG1 3.66Å; I442-I546 WeakPolarHBondContact O-CD1 3.36Å; I442-A549 HydrophobicContact CD1-CB 3.36Å
443	T	98.3	Very high	97.3	Very high	71 Å²	71	62.8 Å²	62.8	44%	0.436	34%	0.338	S	S	.	.			trans	-104.8	160	178	65.2	0	0	0	0	111.8	E445 L446 Y447	T443-E445 PolarHBondContact O-N 3.23Å; T443-L446 PolarHBondContact O-N 2.82Å; T443-L446 WeakPolarHBondContact OG1-CB 3.43Å; T443-L446 PolarHBondContact OG1-N 3.35Å; T443-Y447 PolarHBondContact O-N 3.3Å; T443-Y447 VanDerWaalsContact O-N 3.1Å
444	H	98.4	Very high	97.2	Very high	91 Å²	91	60.6 Å²	60.6	42%	0.421	32%	0.322	S	S	.	.	H	α-helix	trans	-59.2	-32.9	171	-73.6	-150.7	0	0	0	111.7	Y447 N448 A542 D543	H444-Y447 PolarHBondContact O-N 3.22Å; H444-N448 VanDerWaalsContact O-CG 3.3Å; H444-N448 PolarHBondContact O-N 3.29Å; H444-N448 PolarHBondContact O-ND2 2.82Å; H444-N448 VanDerWaalsContact O-ND2 3.17Å; H444-A542 HydrophobicContact CB-CB 4.23Å; H444-D543 IonicContact CD2-OD1 3.54Å; H444-D543 IonicContact CE1-OD1 3.6Å; H444-D543 IonicContact CE1-OD2 3.64Å; H444-D543 IonicContact NE2-OD1 2.8Å; H444-D543 PolarHBondContact NE2-OD1 2.92Å; H444-D543 IonicContact NE2-OD2 2.64Å
445	E	98.4	Very high	96.9	Very high	141 Å²	141	61.6 Å²	61.6	66%	0.659	32%	0.323	S	S	*	.	H	α-helix	trans	-64.7	-45.4	173.8	-175.2	179.9	-170	0	0	112	T443 Y447 N448 I449	T443-E445 PolarHBondContact O-N 3.23Å; E445-Y447 VanDerWaalsContact C-N 3.31Å; E445-Y447 PolarHBondContact O-N 3.31Å; E445-N448 PolarHBondContact O-N 2.87Å; E445-N448 VanDerWaalsContact O-N 3.12Å; E445-I449 HydrophobicContact CG-CD1 4.02Å; E445-I449 WeakPolarHBondContact O-CG1 3.45Å; E445-I449 PolarHBondContact O-N 3.46Å
446	L	98.3	Very high	96.7	Very high	53 Å²	53	65.4 Å²	65.4	28%	0.277	34%	0.335	S	S	.	.	H	α-helix	trans	-61.6	-40.3	176.6	179.8	57.9	0	0	0	111.5	I442 T443 I449 C450 Y518	I442-L446 HydrophobicContact CG1-CD2 4.43Å; I442-L446 HydrophobicContact CG2-CD2 4.27Å; T443-L446 PolarHBondContact O-N 2.82Å; T443-L446 WeakPolarHBondContact OG1-CB 3.43Å; T443-L446 PolarHBondContact OG1-N 3.35Å; L446-I449 PolarHBondContact O-N 3.07Å; L446-C450 WeakPolarHBondContact O-CB 3.3Å; L446-C450 PolarHBondContact O-N 2.84Å; L446-C450 PolarHBondContact O-SG 2.91Å; L446-Y518 HydrophobicContact CD2-CD2 4.17Å; L446-Y518 HydrophobicContact CD2-CE2 3.92Å
447	Y	98.3	Very high	96.1	Very high	9 Å²	9	70 Å²	70	4%	0.035	35%	0.354	C	S	.	.	H	α-helix	trans	-56.8	-49.8	171	170.9	-113.1	0	0	0	111.7	T443 H444 E445 I449 C450 L451 I511 A514 T541 A542 F545	T443-Y447 PolarHBondContact O-N 3.3Å; T443-Y447 VanDerWaalsContact O-N 3.1Å; H444-Y447 PolarHBondContact O-N 3.22Å; E445-Y447 VanDerWaalsContact C-N 3.31Å; E445-Y447 PolarHBondContact O-N 3.31Å; Y447-I449 VanDerWaalsContact C-N 3.34Å; Y447-I449 PolarHBondContact O-N 3.01Å; Y447-C450 PolarHBondContact O-N 2.94Å; Y447-L451 HydrophobicContact CE1-CD2 4.13Å; Y447-L451 HydrophobicContact CE2-CB 4.43Å; Y447-L451 WeakPolarHBondContact O-CB 3.4Å; Y447-L451 PolarHBondContact O-N 2.99Å; Y447-I511 HydrophobicContact CE2-CD1 4.24Å; Y447-A514 HydrophobicContact CD2-CB 3.8Å; Y447-A514 HydrophobicContact CE2-CB 3.6Å; Y447-T541 HydrophobicContact CE1-CG2 4.11Å; Y447-T541 WeakPolarHBondContact OH-CG2 3.34Å; Y447-A542 HydrophobicContact CD1-CB 3.96Å; Y447-F545 HydrophobicContact CD2-CB 3.54Å; Y447-F545 AromaticContact CD2-CD1 3.58Å; Y447-F545 HydrophobicContact CD2-CD1 3.58Å; Y447-F545 AromaticContact CD2-CD2 3.64Å; Y447-F545 HydrophobicContact CD2-CD2 3.64Å; Y447-F545 HydrophobicContact CD2-CE1 4.14Å; Y447-F545 HydrophobicContact CD2-CE2 4.2Å; Y447-F545 AromaticContact CD2-CG 3.28Å; Y447-F545 HydrophobicContact CD2-CG 3.28Å; Y447-F545 HydrophobicContact CD2-CZ 4.43Å; Y447-F545 HydrophobicContact CE2-CB 3.94Å; Y447-F545 HydrophobicContact CE2-CD2 4Å; Y447-F545 AromaticContact CE2-CG 3.95Å; Y447-F545 HydrophobicContact CE2-CG 3.95Å; Y447-F545 HydrophobicContact CG-CB 4.11Å; Y447-F545 AromaticContact CG-CD1 4Å; Y447-F545 HydrophobicContact CG-CD1 4Å; Y447-F545 HydrophobicContact CG-CG 4.04Å
448	N	98.3	Very high	95.5	Very high	93 Å²	93	71 Å²	71	50%	0.497	35%	0.349	S	S	.	.	H	α-helix	trans	-61.5	-39.4	-179.9	-70.7	-32.1	0	0	0	112.6	H444 E445 L451 A452	H444-N448 VanDerWaalsContact O-CG 3.3Å; H444-N448 PolarHBondContact O-N 3.29Å; H444-N448 PolarHBondContact O-ND2 2.82Å; H444-N448 VanDerWaalsContact O-ND2 3.17Å; E445-N448 PolarHBondContact O-N 2.87Å; E445-N448 VanDerWaalsContact O-N 3.12Å; N448-L451 PolarHBondContact O-N 2.96Å; N448-A452 WeakPolarHBondContact O-CB 3.5Å; N448-A452 PolarHBondContact O-N 3.23Å
449	I	98.2	Very high	94.8	Very high	68 Å²	68	76.1 Å²	76.1	35%	0.349	36%	0.364	S	S	.	.	H	α-helix	trans	-64.4	-46.4	175.1	-67.1	164.7	0	0	0	110.9	E445 L446 Y447 A452 R453	E445-I449 HydrophobicContact CG-CD1 4.02Å; E445-I449 WeakPolarHBondContact O-CG1 3.45Å; E445-I449 PolarHBondContact O-N 3.46Å; L446-I449 PolarHBondContact O-N 3.07Å; Y447-I449 VanDerWaalsContact C-N 3.34Å; Y447-I449 PolarHBondContact O-N 3.01Å; I449-A452 PolarHBondContact O-N 3.49Å; I449-R453 WeakPolarHBondContact O-CG 3.44Å; I449-R453 PolarHBondContact O-N 3.04Å; I449-R453 VanDerWaalsContact O-N 3.13Å
450	C	98	Very high	93.8	Very high	2 Å²	2	72.4 Å²	72.4	1%	0.014	35%	0.352	C	S	.	.	H	α-helix	trans	-65.9	-36.8	177.6	-75.4	0	0	0	0	112.3	L446 Y447 R453 A454 A514 C517	L446-C450 WeakPolarHBondContact O-CB 3.3Å; L446-C450 PolarHBondContact O-N 2.84Å; L446-C450 PolarHBondContact O-SG 2.91Å; Y447-C450 PolarHBondContact O-N 2.94Å; C450-R453 PolarHBondContact O-N 3.4Å; C450-A454 WeakPolarHBondContact O-CB 3.37Å; C450-A454 PolarHBondContact O-N 2.78Å; C450-A514 HydrophobicContact CB-CB 4.04Å; C450-A514 WeakPolarHBondContact CB-O 3.35Å; C450-C517 HydrophobicContact CB-CB 4.28Å
451	L	97.4	Very high	92.3	Very high	20 Å²	20	71.7 Å²	71.7	11%	0.105	35%	0.351	C	S	.	.	H	α-helix	trans	-66.7	-41.9	174.7	-179.2	61	0	0	0	112.4	Y447 N448 R453 A454 K455 S510 A514	Y447-L451 HydrophobicContact CE1-CD2 4.13Å; Y447-L451 HydrophobicContact CE2-CB 4.43Å; Y447-L451 WeakPolarHBondContact O-CB 3.4Å; Y447-L451 PolarHBondContact O-N 2.99Å; N448-L451 PolarHBondContact O-N 2.96Å; L451-R453 VanDerWaalsContact C-N 3.35Å; L451-A454 PolarHBondContact O-N 3.4Å; L451-K455 HydrophobicContact CD1-CD 4.32Å; L451-K455 HydrophobicContact CD1-CG 4.34Å; L451-K455 HydrophobicContact CG-CD 4.25Å; L451-K455 WeakPolarHBondContact O-CG 3.3Å; L451-K455 PolarHBondContact O-N 3.05Å; L451-S510 VanDerWaalsContact CD1-CB 3.46Å; L451-A514 HydrophobicContact CB-CB 4.35Å
452	A	97.1	Very high	90.5	Very high	58 Å²	58	69 Å²	69	48%	0.479	35%	0.347	S	S	.	.	H	α-helix	trans	-60	-46.5	175.9	0	0	0	0	0	111	N448 I449 A454 K455 E456	N448-A452 WeakPolarHBondContact O-CB 3.5Å; N448-A452 PolarHBondContact O-N 3.23Å; I449-A452 PolarHBondContact O-N 3.49Å; A452-A454 VanDerWaalsContact C-N 3.34Å; A452-A454 PolarHBondContact O-N 2.87Å; A452-K455 PolarHBondContact O-N 3.33Å; A452-E456 WeakPolarHBondContact O-CB 3.33Å; A452-E456 PolarHBondContact O-N 3.42Å
453	R	95	Very high	88.7	Confident	138 Å²	138	73.7 Å²	73.7	52%	0.521	38%	0.375	S	S	.	.	H	α-helix	trans	-60.5	-39.3	174.4	-69.3	170.7	-179.7	177	1.2	112.7	I449 C450 L451 K457 C517	I449-R453 WeakPolarHBondContact O-CG 3.44Å; I449-R453 PolarHBondContact O-N 3.04Å; I449-R453 VanDerWaalsContact O-N 3.13Å; C450-R453 PolarHBondContact O-N 3.4Å; L451-R453 VanDerWaalsContact C-N 3.35Å; R453-K457 WeakPolarHBondContact O-CG 3.26Å; R453-K457 PolarHBondContact O-N 2.81Å; R453-C517 HydrophobicContact CB-CB 4.3Å
454	A	93.1	Very high	86.7	Confident	1 Å²	1	75.7 Å²	75.7	1%	0.008	38%	0.383	C	S	.	.	H	α-helix	trans	-64.4	-48.5	176.6	0	0	0	0	0	111.8	C450 L451 A452 E456 K457 W458 G513	C450-A454 WeakPolarHBondContact O-CB 3.37Å; C450-A454 PolarHBondContact O-N 2.78Å; L451-A454 PolarHBondContact O-N 3.4Å; A452-A454 VanDerWaalsContact C-N 3.34Å; A452-A454 PolarHBondContact O-N 2.87Å; A454-E456 VanDerWaalsContact C-N 3.32Å; A454-E456 PolarHBondContact O-N 2.93Å; A454-K457 PolarHBondContact O-N 3.24Å; A454-W458 HydrophobicContact CB-CH2 4.05Å; A454-W458 HydrophobicContact CB-CZ2 4Å; A454-W458 VanDerWaalsContact O-CG 3.23Å; A454-W458 PolarHBondContact O-N 2.83Å; A454-W458 VanDerWaalsContact O-N 3.09Å; A454-G513 VanDerWaalsContact CB-C 3.43Å; A454-G513 WeakPolarHBondContact CB-O 3.49Å
455	K	91.8	Very high	84.5	Confident	108 Å²	108	77.2 Å²	77.2	47%	0.47	40%	0.399	S	S	.	.	H	α-helix	trans	-62.7	-37.1	177.5	-72.8	178.8	174.5	178.6	0	112.6	L451 A452 W458 R459	L451-K455 HydrophobicContact CD1-CD 4.32Å; L451-K455 HydrophobicContact CD1-CG 4.34Å; L451-K455 HydrophobicContact CG-CD 4.25Å; L451-K455 WeakPolarHBondContact O-CG 3.3Å; L451-K455 PolarHBondContact O-N 3.05Å; A452-K455 PolarHBondContact O-N 3.33Å; K455-W458 HydrophobicContact CB-CE3 4.47Å; K455-W458 HydrophobicContact CG-CE3 4.03Å; K455-W458 HydrophobicContact CG-CZ3 3.83Å; K455-R459 WeakPolarHBondContact O-CB 3.19Å; K455-R459 PolarHBondContact O-N 2.83Å; K455-R459 VanDerWaalsContact O-N 3.12Å
456	E	90.9	Very high	82.1	Confident	111 Å²	111	75.2 Å²	75.2	52%	0.519	40%	0.396	S	S	.	.	H	α-helix	trans	-64.6	-48.2	174	-178.4	162.7	-127.3	0	0	112.1	A452 A454 W458 R459 S460	A452-E456 WeakPolarHBondContact O-CB 3.33Å; A452-E456 PolarHBondContact O-N 3.42Å; A454-E456 VanDerWaalsContact C-N 3.32Å; A454-E456 PolarHBondContact O-N 2.93Å; E456-W458 PolarHBondContact O-N 3.48Å; E456-R459 PolarHBondContact O-N 3.47Å; E456-S460 PolarHBondContact O-N 2.98Å; E456-S460 PolarHBondContact O-OG 3Å
457	K	83.9	Confident	79.8	Confident	108 Å²	108	79.9 Å²	79.9	47%	0.47	42%	0.421	S	S	.	.	H	α-helix	trans	-54.7	-47.8	175.8	-75.3	173.7	179.1	-177.5	0	112.3	R453 A454 R459 S460 S461 C517	R453-K457 WeakPolarHBondContact O-CG 3.26Å; R453-K457 PolarHBondContact O-N 2.81Å; A454-K457 PolarHBondContact O-N 3.24Å; K457-R459 VanDerWaalsContact C-N 3.35Å; K457-R459 PolarHBondContact O-N 3.1Å; K457-S460 PolarHBondContact O-N 3.5Å; K457-S461 WeakPolarHBondContact O-CB 3.47Å; K457-S461 PolarHBondContact O-N 3.45Å; K457-C517 PolarHBondContact NZ-SG 3.5Å
458	W	83.6	Confident	77.4	Confident	52 Å²	52	85 Å²	85	20%	0.197	45%	0.454	C	S	.	.	H	α-helix	trans	-63.6	-39.3	179.6	-56.7	-30.7	0	0	0	112.6	A454 K455 E456 A462 L481 H509 G513	A454-W458 HydrophobicContact CB-CH2 4.05Å; A454-W458 HydrophobicContact CB-CZ2 4Å; A454-W458 VanDerWaalsContact O-CG 3.23Å; A454-W458 PolarHBondContact O-N 2.83Å; A454-W458 VanDerWaalsContact O-N 3.09Å; K455-W458 HydrophobicContact CB-CE3 4.47Å; K455-W458 HydrophobicContact CG-CE3 4.03Å; K455-W458 HydrophobicContact CG-CZ3 3.83Å; E456-W458 PolarHBondContact O-N 3.48Å; W458-A462 WeakPolarHBondContact O-CB 3.49Å; W458-A462 PolarHBondContact O-N 3.25Å; W458-A462 VanDerWaalsContact O-N 3.1Å; W458-L481 HydrophobicContact CG-CD1 4.46Å; W458-L481 HydrophobicContact CG-CD2 4.48Å; W458-H509 AromaticContact CD2-CE1 3.91Å; W458-H509 AromaticContact CE2-CE1 3.59Å; W458-H509 AromaticContact CE2-ND1 3.87Å; W458-H509 AromaticContact CE3-ND1 3.99Å; W458-H509 AromaticContact CH2-CE1 3.7Å; W458-H509 AromaticContact CH2-ND1 3.09Å; W458-H509 WeakPolarHBondContact CH2-ND1 3.45Å; W458-H509 VanDerWaalsContact CH2-O 3.32Å; W458-H509 WeakPolarHBondContact CH2-O 3.39Å; W458-H509 AromaticContact CZ2-CE1 3.44Å; W458-H509 VanDerWaalsContact CZ2-CE1 3.44Å; W458-H509 WeakPolarHBondContact CZ2-CE1 3.09Å; W458-H509 AromaticContact CZ2-ND1 3.27Å; W458-H509 VanDerWaalsContact CZ2-ND1 3.27Å; W458-H509 WeakPolarHBondContact CZ2-ND1 3.33Å; W458-H509 AromaticContact CZ3-CE1 3.98Å; W458-H509 AromaticContact CZ3-ND1 3.47Å; W458-H509 WeakPolarHBondContact CZ3-ND1 3.5Å; W458-G513 VanDerWaalsContact CZ2-CA 3.47Å
459	R	82.3	Confident	75	Confident	167 Å²	167	89.3 Å²	89.3	63%	0.63	47%	0.471	S	S	*	.	H	α-helix	trans	-65.4	-38.3	176.1	-174.5	-174.2	64.4	124.6	-0.1	111.9	K455 E456 K457 V463	K455-R459 WeakPolarHBondContact O-CB 3.19Å; K455-R459 PolarHBondContact O-N 2.83Å; K455-R459 VanDerWaalsContact O-N 3.12Å; E456-R459 PolarHBondContact O-N 3.47Å; K457-R459 VanDerWaalsContact C-N 3.35Å; K457-R459 PolarHBondContact O-N 3.1Å; R459-V463 WeakPolarHBondContact O-CG2 3.16Å
460	S	74.8	Confident	72.4	Confident	51 Å²	51	92.9 Å²	92.9	36%	0.357	49%	0.49	S	S	.	.	H	α-helix	trans	-73.1	-41.4	178.2	-60.1	0	0	0	0	112.4	E456 K457 A462 V463 L464	E456-S460 PolarHBondContact O-N 2.98Å; E456-S460 PolarHBondContact O-OG 3Å; K457-S460 PolarHBondContact O-N 3.5Å; S460-A462 VanDerWaalsContact C-N 3.31Å; S460-A462 PolarHBondContact O-N 3.21Å; S460-V463 PolarHBondContact O-N 2.7Å; S460-L464 WeakPolarHBondContact O-CD1 3.48Å; S460-L464 PolarHBondContact O-N 2.87Å
461	S	66.2	Low	70.2	Confident	31 Å²	31	97.3 Å²	97.3	22%	0.217	52%	0.517	C	S	.	.	H	α-helix	trans	-54.7	-46.5	171.8	146.5	0	0	0	0	111.2	K457 V463 L464 E478	K457-S461 WeakPolarHBondContact O-CB 3.47Å; K457-S461 PolarHBondContact O-N 3.45Å; S461-V463 PolarHBondContact O-N 3.4Å; S461-L464 PolarHBondContact O-N 3.29Å; S461-E478 VanDerWaalsContact CB-OE2 3.24Å; S461-E478 WeakPolarHBondContact CB-OE2 3.18Å; S461-E478 VanDerWaalsContact OG-CD 3.29Å; S461-E478 PolarHBondContact OG-OE1 2.92Å; S461-E478 PolarHBondContact OG-OE2 3.36Å
462	A	60.7	Low	67.8	Low	73 Å²	73	104.6 Å²	104.6	60%	0.603	56%	0.556	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.1	1.6	176.3	0	0	0	0	0	115.8	W458 S460	W458-A462 WeakPolarHBondContact O-CB 3.49Å; W458-A462 PolarHBondContact O-N 3.25Å; W458-A462 VanDerWaalsContact O-N 3.1Å; S460-A462 VanDerWaalsContact C-N 3.31Å; S460-A462 PolarHBondContact O-N 3.21Å
463	V	59.9	Low	65.5	Low	101 Å²	101	106.4 Å²	106.4	61%	0.612	56%	0.557	S	S	*	*	T	Hydrogen-bonded Turn	trans	-118.8	-24.4	176.9	172.2	0	0	0	0	112	R459 S460 S461 T465	R459-V463 WeakPolarHBondContact O-CG2 3.16Å; S460-V463 PolarHBondContact O-N 2.7Å; S461-V463 PolarHBondContact O-N 3.4Å; V463-T465 PolarHBondContact O-N 3.48Å
464	L	55.5	Low	63.4	Low	114 Å²	114	102.6 Å²	102.6	60%	0.597	55%	0.552	S	S	*	*			trans	-83.1	14.7	-179.9	-94.3	74.7	0	0	0	114.2	S460 S461 T466	S460-L464 WeakPolarHBondContact O-CD1 3.48Å; S460-L464 PolarHBondContact O-N 2.87Å; S461-L464 PolarHBondContact O-N 3.29Å; L464-T466 PolarHBondContact O-N 3.39Å
465	T	52.8	Low	61.5	Low	123 Å²	123	105.5 Å²	105.5	76%	0.755	57%	0.572	S	S	*	*	S	Bend	trans	-72	14	173.4	56.5	0	0	0	0	114.2	V463	V463-T465 PolarHBondContact O-N 3.48Å
466	T	48.8	Very low	59.8	Low	99 Å²	99	105.8 Å²	105.8	61%	0.607	58%	0.578	S	S	*	*	S	Bend	trans	-140.8	117.8	170.6	29.4	0	0	0	0	108.8	L464	L464-T466 PolarHBondContact O-N 3.39Å
467	D	48.3	Very low	58.1	Low	151 Å²	151	107.7 Å²	107.7	81%	0.807	58%	0.581	S	S	*	*	S	Bend	trans	60.5	75.3	156	-47.9	-24.9	0	0	0	119.5
468	T	48.6	Very low	57	Low	117 Å²	117	106 Å²	106	72%	0.718	58%	0.575	S	S	*	*			trans	-166.5	138.1	137.2	3.3	0	0	0	0	113.9	D470	T468-D470 PolarHBondContact O-N 3.38Å
469	E	48.8	Very low	56.3	Low	182 Å²	182	106 Å²	106	85%	0.85	58%	0.583	S	S	*	*			trans	-92.8	62.5	-179.1	-66.6	-161.9	149.7	0	0	114.3	V471	E469-V471 HydrophobicContact CB-CG2 3.96Å; E469-V471 PolarHBondContact O-N 3.43Å
470	D	43.3	Very low	56.3	Low	143 Å²	143	99.4 Å²	99.4	77%	0.765	56%	0.562	S	S	*	*			trans	-92.5	78.2	165.7	-97.4	-39.6	0	0	0	110.3	T468 S474	T468-D470 PolarHBondContact O-N 3.38Å; D470-S474 WeakPolarHBondContact O-CB 3.09Å; D470-S474 PolarHBondContact O-OG 2.86Å
471	V	51.1	Low	56.8	Low	95 Å²	95	97.6 Å²	97.6	58%	0.576	55%	0.548	S	S	*	.			trans	-84.6	-20.2	-157.4	-177.3	0	0	0	0	115.5	E469 S474	E469-V471 HydrophobicContact CB-CG2 3.96Å; E469-V471 PolarHBondContact O-N 3.43Å; V471-S474 PolarHBondContact O-OG 3.06Å
472	L	46.9	Very low	57.9	Low	174 Å²	174	102 Å²	102	91%	0.911	57%	0.566	S	S	*	*	T	Hydrogen-bonded Turn	trans	-95.7	-5.2	-161.1	-140.4	76.1	0	0	0	117.1
473	D	49.7	Very low	59.4	Low	96 Å²	96	101.1 Å²	101.1	51%	0.513	55%	0.55	S	S	.	*	T	Hydrogen-bonded Turn	trans	-137.2	-2.9	177.8	-166.5	-13	0	0	0	110.9	R477	D473-R477 VanDerWaalsContact CG-CZ 3.48Å; D473-R477 WeakPolarHBondContact O-CD 3.41Å; D473-R477 VanDerWaalsContact O-CG 3.27Å; D473-R477 WeakPolarHBondContact O-CG 3.2Å; D473-R477 PolarHBondContact O-NE 2.84Å; D473-R477 IonicContact OD1-CZ 3.65Å; D473-R477 IonicContact OD1-NE 2.82Å; D473-R477 PolarHBondContact OD1-NE 3.43Å; D473-R477 IonicContact OD1-NH2 3.21Å; D473-R477 PolarHBondContact OD1-NH2 3.28Å; D473-R477 IonicContact OD2-CZ 2.78Å; D473-R477 IonicContact OD2-NH2 3.8Å; D473-R477 PolarHBondContact OD2-NH2 3.15Å
474	S	49.9	Very low	61.1	Low	58 Å²	58	96.4 Å²	96.4	41%	0.406	52%	0.522	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.8	-36.7	175.8	47.2	0	0	0	0	112.5	D470 V471 D476 R477 E478	D470-S474 WeakPolarHBondContact O-CB 3.09Å; D470-S474 PolarHBondContact O-OG 2.86Å; V471-S474 PolarHBondContact O-OG 3.06Å; S474-D476 PolarHBondContact O-N 3.11Å; S474-R477 PolarHBondContact O-N 3.39Å; S474-E478 PolarHBondContact O-N 3.4Å; S474-E478 VanDerWaalsContact O-N 3.17Å
475	S	53	Low	63	Low	61 Å²	61	95.5 Å²	95.5	43%	0.427	51%	0.513	S	S	.	.	H	α-helix	trans	-51.1	-52.2	-177.4	54.4	0	0	0	0	113.7	R477 S479	S475-R477 PolarHBondContact O-N 2.95Å; S475-S479 WeakPolarHBondContact O-CB 3.48Å; S475-S479 PolarHBondContact O-N 3.17Å
476	D	56.5	Low	65	Low	114 Å²	114	93.3 Å²	93.3	61%	0.61	50%	0.496	S	S	*	.	H	α-helix	trans	-74.3	-21.8	-170.2	-63.8	16	0	0	0	111.1	S474 S480	S474-D476 PolarHBondContact O-N 3.11Å; D476-S480 WeakPolarHBondContact O-CB 3.19Å; D476-S480 PolarHBondContact O-N 3.39Å; D476-S480 VanDerWaalsContact O-N 3.1Å; D476-S480 PolarHBondContact O-OG 2.94Å
477	R	55.3	Low	67.3	Low	152 Å²	152	88.7 Å²	88.7	57%	0.574	47%	0.468	S	S	*	.	H	α-helix	trans	-81.5	-43.7	-179.8	-59	173.3	-174.7	-174.6	-4.9	111.6	D473 S474 S475 S480 L481	D473-R477 VanDerWaalsContact CG-CZ 3.48Å; D473-R477 WeakPolarHBondContact O-CD 3.41Å; D473-R477 VanDerWaalsContact O-CG 3.27Å; D473-R477 WeakPolarHBondContact O-CG 3.2Å; D473-R477 PolarHBondContact O-NE 2.84Å; D473-R477 IonicContact OD1-CZ 3.65Å; D473-R477 IonicContact OD1-NE 2.82Å; D473-R477 PolarHBondContact OD1-NE 3.43Å; D473-R477 IonicContact OD1-NH2 3.21Å; D473-R477 PolarHBondContact OD1-NH2 3.28Å; D473-R477 IonicContact OD2-CZ 2.78Å; D473-R477 IonicContact OD2-NH2 3.8Å; D473-R477 PolarHBondContact OD2-NH2 3.15Å; S474-R477 PolarHBondContact O-N 3.39Å; S475-R477 PolarHBondContact O-N 2.95Å; R477-S480 PolarHBondContact O-N 2.88Å; R477-L481 PolarHBondContact O-N 3.15Å
478	E	60.2	Low	69.6	Low	72 Å²	72	81.5 Å²	81.5	34%	0.336	43%	0.429	S	S	.	.	H	α-helix	trans	-69.2	-45.1	174.5	-160.6	59.3	-128	0	0	110.2	S461 S474 S480 L481 E482	S461-E478 VanDerWaalsContact CB-OE2 3.24Å; S461-E478 WeakPolarHBondContact CB-OE2 3.18Å; S461-E478 VanDerWaalsContact OG-CD 3.29Å; S461-E478 PolarHBondContact OG-OE1 2.92Å; S461-E478 PolarHBondContact OG-OE2 3.36Å; S474-E478 PolarHBondContact O-N 3.4Å; S474-E478 VanDerWaalsContact O-N 3.17Å; E478-S480 VanDerWaalsContact C-N 3.28Å; E478-S480 PolarHBondContact O-N 2.97Å; E478-L481 WeakPolarHBondContact O-CA 3.5Å; E478-L481 WeakPolarHBondContact O-CB 3.4Å; E478-L481 PolarHBondContact O-N 2.64Å; E478-E482 PolarHBondContact O-N 3.38Å
479	S	70.4	Confident	71.9	Confident	53 Å²	53	79.2 Å²	79.2	37%	0.371	42%	0.418	S	S	.	.	H	α-helix	trans	-50.7	-44.6	171.1	175.5	0	0	0	0	112.7	S475 L481 E482 L483	S475-S479 WeakPolarHBondContact O-CB 3.48Å; S475-S479 PolarHBondContact O-N 3.17Å; S479-L481 VanDerWaalsContact C-N 3.28Å; S479-L481 PolarHBondContact O-N 3.01Å; S479-E482 PolarHBondContact O-N 3.1Å; S479-L483 WeakPolarHBondContact O-CB 3.36Å; S479-L483 VanDerWaalsContact O-CG 3.26Å; S479-L483 WeakPolarHBondContact O-CG 3.49Å; S479-L483 PolarHBondContact O-N 2.65Å
480	S	81.2	Confident	74.2	Confident	27 Å²	27	74.7 Å²	74.7	19%	0.189	39%	0.393	C	S	.	.	H	α-helix	trans	-59.8	-35.1	176.1	-67.7	0	0	0	0	113.3	D476 R477 E478 I484	D476-S480 WeakPolarHBondContact O-CB 3.19Å; D476-S480 PolarHBondContact O-N 3.39Å; D476-S480 VanDerWaalsContact O-N 3.1Å; D476-S480 PolarHBondContact O-OG 2.94Å; R477-S480 PolarHBondContact O-N 2.88Å; E478-S480 VanDerWaalsContact C-N 3.28Å; E478-S480 PolarHBondContact O-N 2.97Å; S480-I484 WeakPolarHBondContact O-CD1 3.42Å; S480-I484 VanDerWaalsContact O-CG1 3.24Å; S480-I484 WeakPolarHBondContact O-CG1 3.47Å; S480-I484 PolarHBondContact O-N 3.02Å
481	L	85.6	Confident	76.7	Confident	13 Å²	13	67.9 Å²	67.9	7%	0.068	36%	0.357	C	S	.	.	H	α-helix	trans	-75.7	-40.6	177.6	176.6	58.3	0	0	0	111.8	W458 R477 E478 S479 I484 K485	W458-L481 HydrophobicContact CG-CD1 4.46Å; W458-L481 HydrophobicContact CG-CD2 4.48Å; R477-L481 PolarHBondContact O-N 3.15Å; E478-L481 WeakPolarHBondContact O-CA 3.5Å; E478-L481 WeakPolarHBondContact O-CB 3.4Å; E478-L481 PolarHBondContact O-N 2.64Å; S479-L481 VanDerWaalsContact C-N 3.28Å; S479-L481 PolarHBondContact O-N 3.01Å; L481-I484 PolarHBondContact O-N 2.63Å; L481-K485 HydrophobicContact CD1-CD 4.42Å; L481-K485 HydrophobicContact CD1-CG 4.47Å; L481-K485 HydrophobicContact CG-CD 4.31Å; L481-K485 WeakPolarHBondContact O-CG 3.18Å; L481-K485 PolarHBondContact O-N 3.27Å
482	E	88.5	Confident	78.9	Confident	125 Å²	125	63.8 Å²	63.8	58%	0.584	33%	0.331	S	S	*	.	H	α-helix	trans	-62.7	-44.1	174.6	-65.2	-165.4	137.6	0	0	111.8	E478 S479 I484 K485 L486	E478-E482 PolarHBondContact O-N 3.38Å; S479-E482 PolarHBondContact O-N 3.1Å; E482-I484 PolarHBondContact O-N 3.21Å; E482-K485 PolarHBondContact O-N 3.49Å; E482-L486 VanDerWaalsContact O-CB 3.3Å; E482-L486 WeakPolarHBondContact O-CB 3.33Å; E482-L486 PolarHBondContact O-N 2.97Å
483	L	93.2	Very high	81.2	Confident	53 Å²	53	58.4 Å²	58.4	28%	0.277	31%	0.307	S	S	.	.	H	α-helix	trans	-61.8	-40	176.2	-70.9	171.1	0	0	0	112.3	S479 D487 Y524	S479-L483 WeakPolarHBondContact O-CB 3.36Å; S479-L483 VanDerWaalsContact O-CG 3.26Å; S479-L483 WeakPolarHBondContact O-CG 3.49Å; S479-L483 PolarHBondContact O-N 2.65Å; L483-D487 WeakPolarHBondContact O-CB 3.44Å; L483-D487 PolarHBondContact O-N 3.07Å; L483-Y524 HydrophobicContact CB-CD1 3.71Å; L483-Y524 HydrophobicContact CB-CE1 4.03Å
484	I	95.9	Very high	83.2	Confident	3 Å²	3	60.1 Å²	60.1	2%	0.015	31%	0.312	C	S	.	.	H	α-helix	trans	-59.7	-51.2	172.7	-75.3	167.2	0	0	0	110.7	S480 L481 E482 L486 D487 I488 L512 T516 Y524	S480-I484 WeakPolarHBondContact O-CD1 3.42Å; S480-I484 VanDerWaalsContact O-CG1 3.24Å; S480-I484 WeakPolarHBondContact O-CG1 3.47Å; S480-I484 PolarHBondContact O-N 3.02Å; L481-I484 PolarHBondContact O-N 2.63Å; E482-I484 PolarHBondContact O-N 3.21Å; I484-L486 PolarHBondContact O-N 3.17Å; I484-D487 PolarHBondContact O-N 3.12Å; I484-I488 HydrophobicContact CG2-CD1 3.66Å; I484-I488 HydrophobicContact CG2-CG1 4.42Å; I484-I488 WeakPolarHBondContact O-CB 3.26Å; I484-I488 VanDerWaalsContact O-CG1 3.24Å; I484-I488 WeakPolarHBondContact O-CG1 3.42Å; I484-I488 PolarHBondContact O-N 2.71Å; I484-L512 HydrophobicContact CD1-CB 3.99Å; I484-L512 HydrophobicContact CG1-CB 4.15Å; I484-L512 HydrophobicContact CG1-CD1 4.49Å; I484-L512 HydrophobicContact CG2-CB 4.39Å; I484-L512 HydrophobicContact CG2-CD1 4.14Å; I484-T516 HydrophobicContact CD1-CG2 4.29Å; I484-Y524 HydrophobicContact CD1-CD2 3.99Å; I484-Y524 HydrophobicContact CD1-CG 4.13Å; I484-Y524 HydrophobicContact CG1-CD1 3.91Å; I484-Y524 HydrophobicContact CG1-CD2 3.38Å; I484-Y524 HydrophobicContact CG1-CE1 4.23Å; I484-Y524 HydrophobicContact CG1-CE2 3.73Å; I484-Y524 HydrophobicContact CG1-CG 3.48Å; I484-Y524 VanDerWaalsContact CG1-CG 3.48Å
485	K	94.3	Very high	85.3	Confident	94 Å²	94	59.7 Å²	59.7	41%	0.409	30%	0.304	S	S	.	.	H	α-helix	trans	-60.3	-45.6	179.8	-69.6	164.5	-179.3	165.5	0	111.6	L481 E482 I488 S489	L481-K485 HydrophobicContact CD1-CD 4.42Å; L481-K485 HydrophobicContact CD1-CG 4.47Å; L481-K485 HydrophobicContact CG-CD 4.31Å; L481-K485 WeakPolarHBondContact O-CG 3.18Å; L481-K485 PolarHBondContact O-N 3.27Å; E482-K485 PolarHBondContact O-N 3.49Å; K485-I488 PolarHBondContact O-N 3.32Å; K485-S489 PolarHBondContact O-N 3.1Å; K485-S489 VanDerWaalsContact O-N 3.1Å
486	L	95.4	Very high	87.4	Confident	78 Å²	78	61.1 Å²	61.1	41%	0.408	31%	0.314	S	S	.	.	H	α-helix	trans	-59.7	-46.6	178.5	176.8	62.7	0	0	0	111.3	E482 I484 S489	E482-L486 VanDerWaalsContact O-CB 3.3Å; E482-L486 WeakPolarHBondContact O-CB 3.33Å; E482-L486 PolarHBondContact O-N 2.97Å; I484-L486 PolarHBondContact O-N 3.17Å; L486-S489 WeakPolarHBondContact O-CB 3.43Å; L486-S489 PolarHBondContact O-N 3.17Å; L486-S489 PolarHBondContact O-OG 3.43Å
487	D	96.7	Very high	89.4	Confident	2 Å²	2	57.2 Å²	57.2	1%	0.011	29%	0.292	C	S	.	.	H	α-helix	trans	-69.4	-42.8	-179.8	-100.3	-16.9	0	0	0	113	L483 I484 S489 R490 T491 Y524 Q526 G527 S529	L483-D487 WeakPolarHBondContact O-CB 3.44Å; L483-D487 PolarHBondContact O-N 3.07Å; I484-D487 PolarHBondContact O-N 3.12Å; D487-S489 PolarHBondContact O-N 3.49Å; D487-R490 CarbonylContact O-C 3.23Å; D487-R490 VanDerWaalsContact O-CG 3.31Å; D487-R490 WeakPolarHBondContact O-CG 3.5Å; D487-R490 PolarHBondContact O-N 3.45Å; D487-R490 IonicContact OD1-CZ 2.68Å; D487-R490 IonicContact OD1-NE 2.68Å; D487-R490 PolarHBondContact OD1-NE 3Å; D487-R490 IonicContact OD1-NH2 2.68Å; D487-R490 PolarHBondContact OD1-NH2 3.12Å; D487-T491 PolarHBondContact O-N 3.28Å; D487-T491 PolarHBondContact O-OG1 2.96Å; D487-Y524 HydrophobicContact CB-CE1 4.39Å; D487-Y524 VanDerWaalsContact CB-OH 3.24Å; D487-Y524 WeakPolarHBondContact CB-OH 3.39Å; D487-Y524 VanDerWaalsContact CG-OH 3.31Å; D487-Y524 WeakPolarHBondContact OD2-CE1 3.47Å; D487-Y524 PolarHBondContact OD2-OH 3.41Å; D487-Q526 VanDerWaalsContact OD2-CA 3.23Å; D487-Q526 WeakPolarHBondContact OD2-CA 3.32Å; D487-Q526 WeakPolarHBondContact OD2-CG 3.29Å; D487-G527 PolarHBondContact OD2-N 3.3Å; D487-S529 WeakPolarHBondContact CB-OG 3.41Å
488	I	97.6	Very high	91.4	Very high	0 Å²	0	50 Å²	50	0%	0	27%	0.265	C	S	.	.	H	α-helix	trans	-56.1	-39.6	174.9	-70	173.9	0	0	0	110.4	I484 K485 R490 T491 F498 Q499 Y505 L508 H509 L512	I484-I488 HydrophobicContact CG2-CD1 3.66Å; I484-I488 HydrophobicContact CG2-CG1 4.42Å; I484-I488 WeakPolarHBondContact O-CB 3.26Å; I484-I488 VanDerWaalsContact O-CG1 3.24Å; I484-I488 WeakPolarHBondContact O-CG1 3.42Å; I484-I488 PolarHBondContact O-N 2.71Å; K485-I488 PolarHBondContact O-N 3.32Å; I488-R490 PolarHBondContact O-N 2.81Å; I488-R490 VanDerWaalsContact O-N 3.15Å; I488-T491 PolarHBondContact O-N 3.47Å; I488-F498 WeakPolarHBondContact CG2-O 3.48Å; I488-Q499 PolarHBondContact O-NE2 3.23Å; I488-Y505 HydrophobicContact CG2-CD2 3.68Å; I488-Y505 HydrophobicContact CG2-CE2 3.81Å; I488-L508 HydrophobicContact CD1-CD2 4.42Å; I488-L508 HydrophobicContact CD1-CG 4.12Å; I488-L508 HydrophobicContact CG1-CD2 3.83Å; I488-L508 HydrophobicContact CG1-CG 3.99Å; I488-L508 HydrophobicContact CG2-CD2 4.34Å; I488-H509 HydrophobicContact CD1-CB 4.09Å; I488-L512 HydrophobicContact CD1-CD1 4.27Å; I488-L512 HydrophobicContact CG1-CD1 4.29Å
489	S	97.1	Very high	93.2	Very high	68 Å²	68	48.1 Å²	48.1	48%	0.476	26%	0.256	S	S	.	.	H	α-helix	trans	-57.8	-29.6	177.4	83.8	0	0	0	0	114	K485 L486 D487	K485-S489 PolarHBondContact O-N 3.1Å; K485-S489 VanDerWaalsContact O-N 3.1Å; L486-S489 WeakPolarHBondContact O-CB 3.43Å; L486-S489 PolarHBondContact O-N 3.17Å; L486-S489 PolarHBondContact O-OG 3.43Å; D487-S489 PolarHBondContact O-N 3.49Å
490	R	95.8	Very high	94.3	Very high	88 Å²	88	53.6 Å²	53.6	33%	0.332	28%	0.276	S	S	.	.	T	Hydrogen-bonded Turn	trans	-110.4	10.6	-179.7	64.8	178.1	171.1	-152.3	-11.7	114.8	D487 I488 F492 P493 Q526 F530	D487-R490 CarbonylContact O-C 3.23Å; D487-R490 VanDerWaalsContact O-CG 3.31Å; D487-R490 WeakPolarHBondContact O-CG 3.5Å; D487-R490 PolarHBondContact O-N 3.45Å; D487-R490 IonicContact OD1-CZ 2.68Å; D487-R490 IonicContact OD1-NE 2.68Å; D487-R490 PolarHBondContact OD1-NE 3Å; D487-R490 IonicContact OD1-NH2 2.68Å; D487-R490 PolarHBondContact OD1-NH2 3.12Å; I488-R490 PolarHBondContact O-N 2.81Å; I488-R490 VanDerWaalsContact O-N 3.15Å; R490-F492 PolarHBondContact O-N 3.4Å; R490-P493 WeakPolarHBondContact O-CD 3.29Å; R490-Q526 VanDerWaalsContact NH2-CG 3.28Å; R490-F530 VanDerWaalsContact O-CZ 3.26Å; R490-F530 WeakPolarHBondContact O-CZ 3.1Å
491	T	97.4	Very high	95	Very high	0 Å²	0	56.1 Å²	56.1	0%	0	31%	0.306	C	S	.	.	S	Bend	trans	-88.7	103.6	179.8	-61.6	0	0	0	0	110.4	D487 I488 F498 Q499 L508 S529 F530 A533	D487-T491 PolarHBondContact O-N 3.28Å; D487-T491 PolarHBondContact O-OG1 2.96Å; I488-T491 PolarHBondContact O-N 3.47Å; T491-F498 WeakPolarHBondContact O-CD2 3.13Å; T491-Q499 PolarHBondContact O-NE2 3.14Å; T491-L508 HydrophobicContact CG2-CD2 4.33Å; T491-S529 VanDerWaalsContact OG1-CB 3.22Å; T491-S529 WeakPolarHBondContact OG1-CB 3.44Å; T491-S529 PolarHBondContact OG1-OG 2.89Å; T491-F530 HydrophobicContact CG2-CD1 4.2Å; T491-F530 HydrophobicContact CG2-CG 4.25Å; T491-A533 HydrophobicContact CG2-CB 3.52Å
492	F	95.6	Very high	95.6	Very high	8 Å²	8	56 Å²	56	4%	0.035	31%	0.309	C	S	.	.	S	Bend	trans	45.6	52.4	-173.9	-51.7	-72	0	0	0	114.3	R490 Q494 L495 F498 F530 A533 V534 S610 L615	R490-F492 PolarHBondContact O-N 3.4Å; F492-Q494 PolarHBondContact O-N 3.21Å; F492-Q494 VanDerWaalsContact O-N 3.13Å; F492-L495 HydrophobicContact CB-CD1 3.82Å; F492-L495 HydrophobicContact CB-CG 4.2Å; F492-L495 HydrophobicContact CG-CD1 4.45Å; F492-L495 WeakPolarHBondContact O-CB 3.47Å; F492-L495 PolarHBondContact O-N 3.26Å; F492-F498 HydrophobicContact CB-CD2 4.02Å; F492-F498 HydrophobicContact CB-CE2 3.99Å; F492-F498 HydrophobicContact CD2-CD2 4.2Å; F492-F498 AromaticContact CD2-CE2 3.71Å; F492-F498 HydrophobicContact CD2-CE2 3.71Å; F492-F498 HydrophobicContact CD2-CZ 4.49Å; F492-F498 HydrophobicContact CG-CE2 4.27Å; F492-F530 HydrophobicContact CE1-CD1 4.49Å; F492-F530 HydrophobicContact CE2-CD1 4.2Å; F492-F530 HydrophobicContact CZ-CD1 4.17Å; F492-A533 HydrophobicContact CD2-CB 4.1Å; F492-A533 HydrophobicContact CE2-CB 4.02Å; F492-V534 HydrophobicContact CE2-CG2 4.05Å; F492-V534 HydrophobicContact CZ-CG2 3.97Å; F492-S610 WeakPolarHBondContact CE1-O 3.23Å; F492-S610 WeakPolarHBondContact CZ-O 3.31Å; F492-L615 HydrophobicContact CD1-CB 4.22Å; F492-L615 HydrophobicContact CE1-CB 4.03Å; F492-L615 HydrophobicContact CE1-CD1 4.17Å; F492-L615 HydrophobicContact CE2-CD1 4.14Å; F492-L615 HydrophobicContact CZ-CD1 3.86Å
493	P	95.2	Very high	96	Very high	62 Å²	62	54.8 Å²	54.8	40%	0.403	31%	0.311	S	S	.	.	G	3₁₀ helix	trans	-62.7	-24.7	-170.2	28.4	-36.6	0	0	0	113.8	R490 L495 C496	R490-P493 WeakPolarHBondContact O-CD 3.29Å; P493-L495 PolarHBondContact O-N 3.04Å; P493-C496 PolarHBondContact O-N 3.29Å; P493-C496 VanDerWaalsContact O-N 3.14Å
494	Q	92.8	Very high	96.2	Very high	131 Å²	131	56 Å²	56	61%	0.612	31%	0.313	S	S	*	.	G	3₁₀ helix	trans	-63.8	-17.3	175.7	73.3	-80.9	18.5	0	0	113.9	F492	F492-Q494 PolarHBondContact O-N 3.21Å; F492-Q494 VanDerWaalsContact O-N 3.13Å
495	L	94.1	Very high	96.3	Very high	49 Å²	49	57.8 Å²	57.8	26%	0.257	32%	0.32	S	S	.	.	G	3₁₀ helix	trans	-89.5	-17.2	177.1	-56.1	179.4	0	0	0	112.8	F492 P493 I497 F498 L615	F492-L495 HydrophobicContact CB-CD1 3.82Å; F492-L495 HydrophobicContact CB-CG 4.2Å; F492-L495 HydrophobicContact CG-CD1 4.45Å; F492-L495 WeakPolarHBondContact O-CB 3.47Å; F492-L495 PolarHBondContact O-N 3.26Å; P493-L495 PolarHBondContact O-N 3.04Å; L495-I497 HydrophobicContact CB-CD1 4.21Å; L495-I497 HydrophobicContact CB-CG1 3.83Å; L495-I497 HydrophobicContact CD1-CD1 4.3Å; L495-I497 WeakPolarHBondContact O-CG2 3.39Å; L495-I497 PolarHBondContact O-N 3.32Å; L495-F498 HydrophobicContact CD1-CE2 4.32Å; L495-L615 HydrophobicContact CD1-CD2 3.59Å
496	C	96.6	Very high	96.4	Very high	92 Å²	92	59 Å²	59	62%	0.622	33%	0.331	S	S	*	.			trans	55.4	7.5	-177.5	-60.6	0	0	0	0	116.6	P493	P493-C496 PolarHBondContact O-N 3.29Å; P493-C496 VanDerWaalsContact O-N 3.14Å
497	I	97.7	Very high	96.5	Very high	32 Å²	32	57 Å²	57	16%	0.164	32%	0.321	C	S	.	.	S	Bend	trans	-92	-21	-174.5	56.3	175.4	0	0	0	114.9	L495 G502 P503 Y504 L537	L495-I497 HydrophobicContact CB-CD1 4.21Å; L495-I497 HydrophobicContact CB-CG1 3.83Å; L495-I497 HydrophobicContact CD1-CD1 4.3Å; L495-I497 WeakPolarHBondContact O-CG2 3.39Å; L495-I497 PolarHBondContact O-N 3.32Å; I497-G502 CarbonylContact O-C 3.46Å; I497-G502 VanDerWaalsContact O-C 3.23Å; I497-G502 WeakPolarHBondContact O-CA 3.27Å; I497-P503 HydrophobicContact CB-CG 4.3Å; I497-P503 HydrophobicContact CG2-CG 4.18Å; I497-Y504 HydrophobicContact CB-CD2 4.23Å; I497-Y504 HydrophobicContact CD1-CD2 4.27Å; I497-Y504 PolarHBondContact O-N 3.04Å; I497-L537 HydrophobicContact CD1-CD2 3.81Å
498	F	97.8	Very high	96.6	Very high	0 Å²	0	56.9 Å²	56.9	0%	0	32%	0.321	C	S	.	.	S	Bend	trans	-99.1	-19.9	-178.3	-60.7	-65.5	0	0	0	113.2	I488 T491 F492 L495 Y504 Y505 L508 A533 I536 L537	I488-F498 WeakPolarHBondContact CG2-O 3.48Å; T491-F498 WeakPolarHBondContact O-CD2 3.13Å; F492-F498 HydrophobicContact CB-CD2 4.02Å; F492-F498 HydrophobicContact CB-CE2 3.99Å; F492-F498 HydrophobicContact CD2-CD2 4.2Å; F492-F498 AromaticContact CD2-CE2 3.71Å; F492-F498 HydrophobicContact CD2-CE2 3.71Å; F492-F498 HydrophobicContact CD2-CZ 4.49Å; F492-F498 HydrophobicContact CG-CE2 4.27Å; L495-F498 HydrophobicContact CD1-CE2 4.32Å; F498-Y504 HydrophobicContact CE1-CG 4.32Å; F498-Y505 WeakPolarHBondContact O-CA 3.46Å; F498-Y505 WeakPolarHBondContact O-CD2 3.31Å; F498-L508 HydrophobicContact CB-CD2 4.06Å; F498-L508 HydrophobicContact CD1-CD2 3.95Å; F498-L508 HydrophobicContact CG-CD2 4.24Å; F498-A533 HydrophobicContact CD1-CB 4.12Å; F498-A533 HydrophobicContact CD2-CB 4.45Å; F498-A533 HydrophobicContact CE1-CB 3.71Å; F498-A533 HydrophobicContact CE2-CB 4.07Å; F498-A533 HydrophobicContact CG-CB 4.47Å; F498-A533 HydrophobicContact CZ-CB 3.66Å; F498-I536 HydrophobicContact CD1-CD1 4.3Å; F498-I536 HydrophobicContact CE1-CD1 4Å; F498-I536 HydrophobicContact CE1-CG1 4.13Å; F498-L537 HydrophobicContact CE1-CD2 4.44Å; F498-L537 HydrophobicContact CE1-CG 4.3Å; F498-L537 HydrophobicContact CE2-CD1 4.4Å; F498-L537 HydrophobicContact CZ-CD1 3.72Å; F498-L537 HydrophobicContact CZ-CD2 4.02Å; F498-L537 HydrophobicContact CZ-CG 3.73Å
499	Q	97.6	Very high	96.6	Very high	32 Å²	32	57.8 Å²	57.8	15%	0.15	33%	0.325	C	S	.	.	S	Bend	trans	-75.7	163.9	-178.8	-69.3	62.2	47.1	0	0	110.5	I488 T491 G501 G502	I488-Q499 PolarHBondContact O-NE2 3.23Å; T491-Q499 PolarHBondContact O-NE2 3.14Å; Q499-G501 PolarHBondContact O-N 3.1Å; Q499-G502 WeakPolarHBondContact O-CA 3.47Å; Q499-G502 PolarHBondContact O-N 2.83Å
500	Q	95.1	Very high	96.6	Very high	168 Å²	168	55.2 Å²	55.2	79%	0.785	31%	0.307	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.2	124.9	-174.7	-170.5	177.1	-0.8	0	0	111.9	Y505	Q500-Y505 VanDerWaalsContact CA-CD2 3.47Å; Q500-Y505 HydrophobicContact CB-CD2 4.11Å; Q500-Y505 HydrophobicContact CB-CE2 3.85Å; Q500-Y505 HydrophobicContact CG-CE1 4.25Å; Q500-Y505 HydrophobicContact CG-CE2 4.37Å
501	G	95.3	Very high	96.7	Very high	80 Å²	80	51.1 Å²	51.1	83%	0.825	29%	0.292	S	S	*	.	T	Hydrogen-bonded Turn	trans	92.6	-12.3	-172.4	0	0	0	0	0	114.9	Q499	Q499-G501 PolarHBondContact O-N 3.1Å
502	G	97.1	Very high	96.7	Very high	12 Å²	12	51.1 Å²	51.1	12%	0.124	29%	0.292	C	S	.	.	S	Bend	trans	-77.3	149.8	170.5	0	0	0	0	0	112.6	I497 Q499 Y504 Y505	I497-G502 CarbonylContact O-C 3.46Å; I497-G502 VanDerWaalsContact O-C 3.23Å; I497-G502 WeakPolarHBondContact O-CA 3.27Å; Q499-G502 WeakPolarHBondContact O-CA 3.47Å; Q499-G502 PolarHBondContact O-N 2.83Å; G502-Y504 PolarHBondContact O-N 2.82Å; G502-Y504 VanDerWaalsContact O-N 3.08Å; G502-Y505 WeakPolarHBondContact O-CB 3.09Å; G502-Y505 PolarHBondContact O-N 2.86Å; G502-Y505 VanDerWaalsContact O-N 3.12Å
503	P	97.6	Very high	96.8	Very high	98 Å²	98	50.8 Å²	50.8	64%	0.636	29%	0.29	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.8	-18.6	-170.5	23.5	-35.2	0	0	0	115.5	I497	I497-P503 HydrophobicContact CB-CG 4.3Å; I497-P503 HydrophobicContact CG2-CG 4.18Å
504	Y	98	Very high	96.9	Very high	80 Å²	80	47.8 Å²	47.8	31%	0.314	27%	0.271	S	S	.	.	T	Hydrogen-bonded Turn	trans	-104.6	1.2	179.2	-69.8	-85.3	0	0	0	113.9	I497 F498 G502 V507 L508 I536 L537	I497-Y504 HydrophobicContact CB-CD2 4.23Å; I497-Y504 HydrophobicContact CD1-CD2 4.27Å; I497-Y504 PolarHBondContact O-N 3.04Å; F498-Y504 HydrophobicContact CE1-CG 4.32Å; G502-Y504 PolarHBondContact O-N 2.82Å; G502-Y504 VanDerWaalsContact O-N 3.08Å; Y504-V507 PolarHBondContact O-N 2.85Å; Y504-L508 VanDerWaalsContact O-CB 3.3Å; Y504-L508 WeakPolarHBondContact O-CB 3.32Å; Y504-L508 PolarHBondContact O-N 3.3Å; Y504-I536 HydrophobicContact CD1-CB 4.47Å; Y504-I536 HydrophobicContact CD1-CD1 4.07Å; Y504-I536 HydrophobicContact CD1-CG1 4.09Å; Y504-I536 WeakPolarHBondContact CE1-O 3.24Å; Y504-I536 HydrophobicContact CG-CD1 4.48Å; Y504-L537 HydrophobicContact CD2-CD2 4.4Å; Y504-L537 HydrophobicContact CE2-CD2 4.05Å
505	Y	97.7	Very high	97.1	Very high	39 Å²	39	41.7 Å²	41.7	15%	0.153	24%	0.242	C	C	.	.	H	α-helix	trans	-57.2	-57.7	-179.2	177.7	-98	0	0	0	112.5	I488 F498 Q500 G502 V507 L508 H509	I488-Y505 HydrophobicContact CG2-CD2 3.68Å; I488-Y505 HydrophobicContact CG2-CE2 3.81Å; F498-Y505 WeakPolarHBondContact O-CA 3.46Å; F498-Y505 WeakPolarHBondContact O-CD2 3.31Å; Q500-Y505 VanDerWaalsContact CA-CD2 3.47Å; Q500-Y505 HydrophobicContact CB-CD2 4.11Å; Q500-Y505 HydrophobicContact CB-CE2 3.85Å; Q500-Y505 HydrophobicContact CG-CE1 4.25Å; Q500-Y505 HydrophobicContact CG-CE2 4.37Å; G502-Y505 WeakPolarHBondContact O-CB 3.09Å; G502-Y505 PolarHBondContact O-N 2.86Å; G502-Y505 VanDerWaalsContact O-N 3.12Å; Y505-V507 PolarHBondContact O-N 3.46Å; Y505-L508 PolarHBondContact O-N 2.95Å; Y505-H509 WeakPolarHBondContact O-CB 3.47Å; Y505-H509 PolarHBondContact O-N 3.37Å
506	D	96.8	Very high	97.2	Very high	119 Å²	119	40.2 Å²	40.2	64%	0.636	24%	0.235	S	C	*	.	H	α-helix	trans	-65.2	-30.7	-178.8	-68.9	-39.1	0	0	0	112.2	S510	D506-S510 WeakPolarHBondContact O-CB 3.34Å; D506-S510 PolarHBondContact O-N 2.87Å; D506-S510 PolarHBondContact O-OG 3.33Å
507	V	98.1	Very high	97.1	Very high	36 Å²	36	36.5 Å²	36.5	22%	0.218	21%	0.211	C	C	.	.	H	α-helix	trans	-67.3	-51.3	176.7	-174.8	0	0	0	0	109.7	Y504 Y505 S510 I511 I536 T541	Y504-V507 PolarHBondContact O-N 2.85Å; Y505-V507 PolarHBondContact O-N 3.46Å; V507-S510 WeakPolarHBondContact O-CB 3.22Å; V507-S510 PolarHBondContact O-N 3.01Å; V507-S510 VanDerWaalsContact O-N 3.17Å; V507-I511 WeakPolarHBondContact O-CG1 3.26Å; V507-I511 PolarHBondContact O-N 2.94Å; V507-I536 HydrophobicContact CB-CD1 4.28Å; V507-I536 HydrophobicContact CG1-CB 4.13Å; V507-I536 HydrophobicContact CG1-CD1 4.09Å; V507-I536 HydrophobicContact CG1-CG2 3.97Å; V507-T541 HydrophobicContact CG1-CG2 3.81Å
508	L	98.2	Very high	97	Very high	0 Å²	0	37.5 Å²	37.5	0%	0	21%	0.213	C	C	.	.	H	α-helix	trans	-61.5	-46.7	178.1	-175.1	53.2	0	0	0	111.4	I488 T491 F498 Y504 Y505 S510 I511 L512 A532 A533 I536	I488-L508 HydrophobicContact CD1-CD2 4.42Å; I488-L508 HydrophobicContact CD1-CG 4.12Å; I488-L508 HydrophobicContact CG1-CD2 3.83Å; I488-L508 HydrophobicContact CG1-CG 3.99Å; I488-L508 HydrophobicContact CG2-CD2 4.34Å; T491-L508 HydrophobicContact CG2-CD2 4.33Å; F498-L508 HydrophobicContact CB-CD2 4.06Å; F498-L508 HydrophobicContact CD1-CD2 3.95Å; F498-L508 HydrophobicContact CG-CD2 4.24Å; Y504-L508 VanDerWaalsContact O-CB 3.3Å; Y504-L508 WeakPolarHBondContact O-CB 3.32Å; Y504-L508 PolarHBondContact O-N 3.3Å; Y505-L508 PolarHBondContact O-N 2.95Å; L508-S510 VanDerWaalsContact C-N 3.27Å; L508-S510 PolarHBondContact O-N 3.06Å; L508-I511 PolarHBondContact O-N 2.9Å; L508-L512 HydrophobicContact CD1-CD1 4.1Å; L508-L512 HydrophobicContact CD1-CG 4.35Å; L508-L512 HydrophobicContact CG-CD1 4.21Å; L508-L512 WeakPolarHBondContact O-CG 3.26Å; L508-L512 PolarHBondContact O-N 2.79Å; L508-L512 VanDerWaalsContact O-N 3.12Å; L508-A532 HydrophobicContact CD1-CB 3.49Å; L508-A532 VanDerWaalsContact CD1-CB 3.49Å; L508-A533 HydrophobicContact CD1-CB 4.31Å; L508-A533 HydrophobicContact CD2-CB 4.25Å; L508-I536 HydrophobicContact CB-CD1 3.69Å; L508-I536 HydrophobicContact CD1-CD1 4.12Å; L508-I536 HydrophobicContact CG-CD1 4.41Å
509	H	96.8	Very high	96.8	Very high	20 Å²	20	38.8 Å²	38.8	9%	0.093	22%	0.218	C	C	.	.	H	α-helix	trans	-59.8	-38.7	175.3	-157.3	-77.3	0	0	0	111.4	W458 I488 Y505 G513	W458-H509 AromaticContact CD2-CE1 3.91Å; W458-H509 AromaticContact CE2-CE1 3.59Å; W458-H509 AromaticContact CE2-ND1 3.87Å; W458-H509 AromaticContact CE3-ND1 3.99Å; W458-H509 AromaticContact CH2-CE1 3.7Å; W458-H509 AromaticContact CH2-ND1 3.09Å; W458-H509 WeakPolarHBondContact CH2-ND1 3.45Å; W458-H509 VanDerWaalsContact CH2-O 3.32Å; W458-H509 WeakPolarHBondContact CH2-O 3.39Å; W458-H509 AromaticContact CZ2-CE1 3.44Å; W458-H509 VanDerWaalsContact CZ2-CE1 3.44Å; W458-H509 WeakPolarHBondContact CZ2-CE1 3.09Å; W458-H509 AromaticContact CZ2-ND1 3.27Å; W458-H509 VanDerWaalsContact CZ2-ND1 3.27Å; W458-H509 WeakPolarHBondContact CZ2-ND1 3.33Å; W458-H509 AromaticContact CZ3-CE1 3.98Å; W458-H509 AromaticContact CZ3-ND1 3.47Å; W458-H509 WeakPolarHBondContact CZ3-ND1 3.5Å; I488-H509 HydrophobicContact CD1-CB 4.09Å; Y505-H509 WeakPolarHBondContact O-CB 3.47Å; Y505-H509 PolarHBondContact O-N 3.37Å; H509-G513 PolarHBondContact O-N 2.61Å
510	S	97.4	Very high	96.4	Very high	14 Å²	14	42.1 Å²	42.1	10%	0.098	24%	0.242	C	C	.	.	H	α-helix	trans	-66.3	-42	176.4	-67	0	0	0	0	113.4	L451 D506 V507 L508 A514	L451-S510 VanDerWaalsContact CD1-CB 3.46Å; D506-S510 WeakPolarHBondContact O-CB 3.34Å; D506-S510 PolarHBondContact O-N 2.87Å; D506-S510 PolarHBondContact O-OG 3.33Å; V507-S510 WeakPolarHBondContact O-CB 3.22Å; V507-S510 PolarHBondContact O-N 3.01Å; V507-S510 VanDerWaalsContact O-N 3.17Å; L508-S510 VanDerWaalsContact C-N 3.27Å; L508-S510 PolarHBondContact O-N 3.06Å; S510-A514 VanDerWaalsContact O-CB 3.26Å; S510-A514 WeakPolarHBondContact O-CB 3.48Å; S510-A514 PolarHBondContact O-N 3.44Å
511	I	98.4	Very high	96	Very high	1 Å²	1	38.2 Å²	38.2	1%	0.005	23%	0.227	C	C	.	.	H	α-helix	trans	-59.9	-52.8	174.7	-65.3	-59.8	0	0	0	110.7	Y447 V507 L508 A514 Y515 A532 I536 T541 A544 F545 F548	Y447-I511 HydrophobicContact CE2-CD1 4.24Å; V507-I511 WeakPolarHBondContact O-CG1 3.26Å; V507-I511 PolarHBondContact O-N 2.94Å; L508-I511 PolarHBondContact O-N 2.9Å; I511-A514 PolarHBondContact O-N 3.17Å; I511-Y515 PolarHBondContact O-N 3.34Å; I511-A532 HydrophobicContact CG2-CB 3.9Å; I511-I536 HydrophobicContact CD1-CG2 4.25Å; I511-I536 HydrophobicContact CG1-CG2 3.68Å; I511-T541 HydrophobicContact CD1-CG2 3.63Å; I511-T541 WeakPolarHBondContact CD1-O 3.44Å; I511-T541 HydrophobicContact CG1-CG2 4.31Å; I511-A544 HydrophobicContact CD1-CB 4.27Å; I511-F545 HydrophobicContact CD1-CB 3.82Å; I511-F548 HydrophobicContact CG2-CD1 3.91Å; I511-F548 HydrophobicContact CG2-CE1 4.26Å; I511-F548 HydrophobicContact CG2-CG 4.2Å
512	L	97.9	Very high	95.7	Very high	1 Å²	1	35.5 Å²	35.5	1%	0.005	19%	0.194	C	C	.	.	H	α-helix	trans	-66.4	-42.4	-174.4	-61.7	174.8	0	0	0	111.1	I484 I488 L508 Y515 T516 Y524 M528 A532 F548	I484-L512 HydrophobicContact CD1-CB 3.99Å; I484-L512 HydrophobicContact CG1-CB 4.15Å; I484-L512 HydrophobicContact CG1-CD1 4.49Å; I484-L512 HydrophobicContact CG2-CB 4.39Å; I484-L512 HydrophobicContact CG2-CD1 4.14Å; I488-L512 HydrophobicContact CD1-CD1 4.27Å; I488-L512 HydrophobicContact CG1-CD1 4.29Å; L508-L512 HydrophobicContact CD1-CD1 4.1Å; L508-L512 HydrophobicContact CD1-CG 4.35Å; L508-L512 HydrophobicContact CG-CD1 4.21Å; L508-L512 WeakPolarHBondContact O-CG 3.26Å; L508-L512 PolarHBondContact O-N 2.79Å; L508-L512 VanDerWaalsContact O-N 3.12Å; L512-Y515 PolarHBondContact O-N 2.94Å; L512-T516 WeakPolarHBondContact O-CG2 3.49Å; L512-T516 PolarHBondContact O-N 2.8Å; L512-T516 VanDerWaalsContact O-N 3.1Å; L512-Y524 HydrophobicContact CB-CD2 4.36Å; L512-Y524 HydrophobicContact CB-CE2 4.33Å; L512-Y524 HydrophobicContact CD1-CE2 3.8Å; L512-Y524 HydrophobicContact CD2-CD2 4.33Å; L512-Y524 HydrophobicContact CD2-CE2 3.82Å; L512-Y524 HydrophobicContact CG-CE2 4.17Å; L512-M528 HydrophobicContact CD2-CB 4.09Å; L512-A532 HydrophobicContact CD2-CB 3.74Å; L512-A532 HydrophobicContact CG-CB 4.35Å; L512-F548 HydrophobicContact CD2-CE1 4.21Å; L512-F548 HydrophobicContact CD2-CE2 4.44Å; L512-F548 HydrophobicContact CD2-CZ 3.73Å
513	G	96.1	Very high	95.4	Very high	0 Å²	0	35.6 Å²	35.6	0%	0	20%	0.195	C	C	.	.	H	α-helix	trans	-61.2	-45.3	173.9	0	0	0	0	0	114.3	A454 W458 H509 Y515 T516 C517	A454-G513 VanDerWaalsContact CB-C 3.43Å; A454-G513 WeakPolarHBondContact CB-O 3.49Å; W458-G513 VanDerWaalsContact CZ2-CA 3.47Å; H509-G513 PolarHBondContact O-N 2.61Å; G513-Y515 PolarHBondContact O-N 3.03Å; G513-T516 PolarHBondContact O-N 3.25Å; G513-T516 PolarHBondContact O-OG1 3.22Å; G513-T516 VanDerWaalsContact O-OG1 3.09Å; G513-C517 PolarHBondContact O-N 2.88Å; G513-C517 PolarHBondContact O-SG 2.8Å; G513-C517 VanDerWaalsContact O-SG 3.4Å
514	A	97.9	Very high	95.2	Very high	0 Å²	0	31.5 Å²	31.5	0%	0	17%	0.167	C	C	.	.	H	α-helix	trans	-61.6	-36.1	174.8	0	0	0	0	0	110.9	Y447 C450 L451 S510 I511 C517 Y518 F545	Y447-A514 HydrophobicContact CD2-CB 3.8Å; Y447-A514 HydrophobicContact CE2-CB 3.6Å; C450-A514 HydrophobicContact CB-CB 4.04Å; C450-A514 WeakPolarHBondContact CB-O 3.35Å; L451-A514 HydrophobicContact CB-CB 4.35Å; S510-A514 VanDerWaalsContact O-CB 3.26Å; S510-A514 WeakPolarHBondContact O-CB 3.48Å; S510-A514 PolarHBondContact O-N 3.44Å; I511-A514 PolarHBondContact O-N 3.17Å; A514-C517 CarbonylContact O-C 3.58Å; A514-C517 PolarHBondContact O-N 3.43Å; A514-Y518 WeakPolarHBondContact O-CB 3.49Å; A514-Y518 PolarHBondContact O-N 3.24Å; A514-F545 HydrophobicContact CB-CD2 4.07Å; A514-F545 HydrophobicContact CB-CE2 3.7Å; A514-F545 HydrophobicContact CB-CZ 4.31Å
515	Y	97.3	Very high	94.9	Very high	2 Å²	2	29.2 Å²	29.2	1%	0.008	16%	0.161	C	C	.	.	H	α-helix	trans	-67.5	-43.9	179.5	-172.2	-94.6	0	0	0	112.8	I511 L512 G513 C517 Y518 R519 V522 M528 F548 A549 L552	I511-Y515 PolarHBondContact O-N 3.34Å; L512-Y515 PolarHBondContact O-N 2.94Å; G513-Y515 PolarHBondContact O-N 3.03Å; Y515-C517 PolarHBondContact O-N 2.81Å; Y515-C517 VanDerWaalsContact O-N 3.16Å; Y515-Y518 HydrophobicContact CD2-CD1 4.29Å; Y515-Y518 HydrophobicContact CE2-CD1 4.33Å; Y515-Y518 PolarHBondContact O-N 3.42Å; Y515-R519 HydrophobicContact CE1-CB 3.97Å; Y515-R519 HydrophobicContact CE1-CG 4.49Å; Y515-R519 HydrophobicContact CE2-CB 4.31Å; Y515-R519 HydrophobicContact CE2-CG 3.97Å; Y515-R519 PolarHBondContact O-N 3.16Å; Y515-V522 HydrophobicContact CE1-CB 4.44Å; Y515-V522 HydrophobicContact CE1-CG1 4.41Å; Y515-M528 HydrophobicContact CD1-CE 4.25Å; Y515-M528 HydrophobicContact CD1-SD 4.09Å; Y515-M528 HydrophobicContact CE1-CE 3.72Å; Y515-M528 HydrophobicContact CE1-SD 4.17Å; Y515-F548 HydrophobicContact CD1-CE1 4.14Å; Y515-F548 AromaticContact CD2-CD1 3.84Å; Y515-F548 HydrophobicContact CD2-CD1 3.84Å; Y515-F548 AromaticContact CD2-CE1 3.74Å; Y515-F548 HydrophobicContact CD2-CE1 3.74Å; Y515-F548 HydrophobicContact CE2-CE1 4.41Å; Y515-F548 HydrophobicContact CG-CD1 4.12Å; Y515-F548 AromaticContact CG-CE1 3.57Å; Y515-F548 HydrophobicContact CG-CE1 3.57Å; Y515-A549 HydrophobicContact CD2-CB 4.18Å; Y515-A549 HydrophobicContact CE2-CB 4.04Å; Y515-L552 HydrophobicContact CD1-CD1 4.4Å; Y515-L552 HydrophobicContact CD2-CD1 4.33Å; Y515-L552 HydrophobicContact CE1-CD1 3.86Å; Y515-L552 HydrophobicContact CE2-CD1 3.77Å
516	T	95.2	Very high	94.6	Very high	18 Å²	18	30.5 Å²	30.5	11%	0.11	17%	0.168	C	C	.	.	H	α-helix	trans	-62.6	-23.7	174.5	70.7	0	0	0	0	112.7	I484 L512 G513	I484-T516 HydrophobicContact CD1-CG2 4.29Å; L512-T516 WeakPolarHBondContact O-CG2 3.49Å; L512-T516 PolarHBondContact O-N 2.8Å; L512-T516 VanDerWaalsContact O-N 3.1Å; G513-T516 PolarHBondContact O-N 3.25Å; G513-T516 PolarHBondContact O-OG1 3.22Å; G513-T516 VanDerWaalsContact O-OG1 3.09Å
517	C	94.8	Very high	94.4	Very high	15 Å²	15	24.9 Å²	24.9	10%	0.101	14%	0.139	C	C	.	.	H	α-helix	trans	-88.7	-11	174	-62.6	0	0	0	0	114.4	C450 R453 K457 G513 A514 Y515	C450-C517 HydrophobicContact CB-CB 4.28Å; R453-C517 HydrophobicContact CB-CB 4.3Å; K457-C517 PolarHBondContact NZ-SG 3.5Å; G513-C517 PolarHBondContact O-N 2.88Å; G513-C517 PolarHBondContact O-SG 2.8Å; G513-C517 VanDerWaalsContact O-SG 3.4Å; A514-C517 CarbonylContact O-C 3.58Å; A514-C517 PolarHBondContact O-N 3.43Å; Y515-C517 PolarHBondContact O-N 2.81Å; Y515-C517 VanDerWaalsContact O-N 3.16Å
518	Y	96.3	Very high	94.3	Very high	52 Å²	52	23.2 Å²	23.2	20%	0.204	13%	0.129	C	C	.	.	H	α-helix	trans	-97.5	-38.8	174.4	172.6	-119.4	0	0	0	111.8	L440 I442 L446 A514 Y515 P520 F545 A549	L440-Y518 HydrophobicContact CD1-CE1 4.32Å; I442-Y518 HydrophobicContact CD1-CD1 4.42Å; I442-Y518 HydrophobicContact CD1-CE1 3.63Å; I442-Y518 HydrophobicContact CG1-CE1 4.38Å; I442-Y518 HydrophobicContact CG1-CE2 4.42Å; L446-Y518 HydrophobicContact CD2-CD2 4.17Å; L446-Y518 HydrophobicContact CD2-CE2 3.92Å; A514-Y518 WeakPolarHBondContact O-CB 3.49Å; A514-Y518 PolarHBondContact O-N 3.24Å; Y515-Y518 HydrophobicContact CD2-CD1 4.29Å; Y515-Y518 HydrophobicContact CE2-CD1 4.33Å; Y515-Y518 PolarHBondContact O-N 3.42Å; Y518-P520 VanDerWaalsContact C-CD 3.46Å; Y518-P520 WeakPolarHBondContact O-CD 3.42Å; Y518-F545 HydrophobicContact CD1-CZ 4.14Å; Y518-F545 HydrophobicContact CG-CZ 4.1Å; Y518-A549 HydrophobicContact CD1-CB 4.2Å; Y518-A549 HydrophobicContact CE1-CB 3.94Å
519	R	92.6	Very high	94.3	Very high	28 Å²	28	23.2 Å²	23.2	11%	0.106	13%	0.129	C	C	.	.			trans	-125.6	67.6	178.6	-64.8	-61.4	-60.3	-79.4	-16	111.2	Y515 D521 V522 G523 N553	Y515-R519 HydrophobicContact CE1-CB 3.97Å; Y515-R519 HydrophobicContact CE1-CG 4.49Å; Y515-R519 HydrophobicContact CE2-CB 4.31Å; Y515-R519 HydrophobicContact CE2-CG 3.97Å; Y515-R519 PolarHBondContact O-N 3.16Å; R519-D521 WeakPolarHBondContact CA-OD1 3.36Å; R519-D521 IonicContact CZ-OD1 3.65Å; R519-D521 IonicContact CZ-OD2 3.63Å; R519-D521 IonicContact NE-OD1 3.1Å; R519-D521 PolarHBondContact NE-OD1 3.29Å; R519-D521 IonicContact NE-OD2 3.52Å; R519-D521 PolarHBondContact NE-OD2 3.33Å; R519-D521 IonicContact NH2-OD1 2.72Å; R519-D521 IonicContact NH2-OD2 2.75Å; R519-D521 PolarHBondContact NH2-OD2 3.04Å; R519-D521 PolarHBondContact O-N 2.93Å; R519-D521 VanDerWaalsContact O-N 3.14Å; R519-V522 HydrophobicContact CB-CB 4.34Å; R519-V522 HydrophobicContact CB-CG2 4.33Å; R519-V522 PolarHBondContact O-N 2.75Å; R519-G523 PolarHBondContact O-N 2.85Å; R519-N553 PolarHBondContact NH1-OD1 3.49Å; R519-N553 VanDerWaalsContact NH1-OD1 3.16Å
520	P	89.9	Confident	94.4	Very high	102 Å²	102	23 Å²	23	66%	0.662	13%	0.127	S	C	*	.	T	Hydrogen-bonded Turn	trans	-63.4	-15.4	175.2	28.9	-36.1	0	0	0	112.9	Y518 V522	Y518-P520 VanDerWaalsContact C-CD 3.46Å; Y518-P520 WeakPolarHBondContact O-CD 3.42Å; P520-V522 PolarHBondContact O-N 3.46Å
521	D	86.4	Confident	94.4	Very high	86 Å²	86	22.3 Å²	22.3	46%	0.46	12%	0.123	S	C	.	.	T	Hydrogen-bonded Turn	trans	-74.3	-10.2	171.6	69.5	-66.7	0	0	0	114.3	R519 R562	R519-D521 WeakPolarHBondContact CA-OD1 3.36Å; R519-D521 IonicContact CZ-OD1 3.65Å; R519-D521 IonicContact CZ-OD2 3.63Å; R519-D521 IonicContact NE-OD1 3.1Å; R519-D521 PolarHBondContact NE-OD1 3.29Å; R519-D521 IonicContact NE-OD2 3.52Å; R519-D521 PolarHBondContact NE-OD2 3.33Å; R519-D521 IonicContact NH2-OD1 2.72Å; R519-D521 IonicContact NH2-OD2 2.75Å; R519-D521 PolarHBondContact NH2-OD2 3.04Å; R519-D521 PolarHBondContact O-N 2.93Å; R519-D521 VanDerWaalsContact O-N 3.14Å; D521-R562 IonicContact OD2-CZ 3.68Å; D521-R562 IonicContact OD2-NE 3.22Å; D521-R562 IonicContact OD2-NH2 2.9Å; D521-R562 PolarHBondContact OD2-NH2 2.96Å
522	V	88.6	Confident	94.4	Very high	22 Å²	22	22.3 Å²	22.3	13%	0.133	12%	0.123	C	C	.	.	T	Hydrogen-bonded Turn	trans	-118.3	-32.1	174.7	-175.5	0	0	0	0	110.7	Y515 R519 P520 V525 M528 R562	Y515-V522 HydrophobicContact CE1-CB 4.44Å; Y515-V522 HydrophobicContact CE1-CG1 4.41Å; R519-V522 HydrophobicContact CB-CB 4.34Å; R519-V522 HydrophobicContact CB-CG2 4.33Å; R519-V522 PolarHBondContact O-N 2.75Å; P520-V522 PolarHBondContact O-N 3.46Å; V522-V525 HydrophobicContact CG1-CG2 4.05Å; V522-M528 HydrophobicContact CG1-CE 3.81Å; V522-R562 HydrophobicContact CG2-CG 4.38Å
523	G	90.8	Very high	94.4	Very high	14 Å²	14	22.3 Å²	22.3	14%	0.144	12%	0.123	C	C	.	.			trans	64.7	-144.1	-177.7	0	0	0	0	0	111.9	R519	R519-G523 PolarHBondContact O-N 2.85Å
524	Y	93.4	Very high	94.5	Very high	13 Å²	13	22.3 Å²	22.3	5%	0.051	12%	0.123	C	C	.	.			trans	-103.9	130.4	167.6	-178	-97.3	0	0	0	109.7	L483 I484 D487 L512 M528 S529	L483-Y524 HydrophobicContact CB-CD1 3.71Å; L483-Y524 HydrophobicContact CB-CE1 4.03Å; I484-Y524 HydrophobicContact CD1-CD2 3.99Å; I484-Y524 HydrophobicContact CD1-CG 4.13Å; I484-Y524 HydrophobicContact CG1-CD1 3.91Å; I484-Y524 HydrophobicContact CG1-CD2 3.38Å; I484-Y524 HydrophobicContact CG1-CE1 4.23Å; I484-Y524 HydrophobicContact CG1-CE2 3.73Å; I484-Y524 HydrophobicContact CG1-CG 3.48Å; I484-Y524 VanDerWaalsContact CG1-CG 3.48Å; D487-Y524 HydrophobicContact CB-CE1 4.39Å; D487-Y524 VanDerWaalsContact CB-OH 3.24Å; D487-Y524 WeakPolarHBondContact CB-OH 3.39Å; D487-Y524 VanDerWaalsContact CG-OH 3.31Å; D487-Y524 WeakPolarHBondContact OD2-CE1 3.47Å; D487-Y524 PolarHBondContact OD2-OH 3.41Å; L512-Y524 HydrophobicContact CB-CD2 4.36Å; L512-Y524 HydrophobicContact CB-CE2 4.33Å; L512-Y524 HydrophobicContact CD1-CE2 3.8Å; L512-Y524 HydrophobicContact CD2-CD2 4.33Å; L512-Y524 HydrophobicContact CD2-CE2 3.82Å; L512-Y524 HydrophobicContact CG-CE2 4.17Å; Y524-M528 HydrophobicContact CD2-CB 4.08Å; Y524-M528 HydrophobicContact CD2-SD 4.01Å; Y524-M528 HydrophobicContact CE2-CB 3.46Å; Y524-M528 VanDerWaalsContact CE2-CB 3.46Å; Y524-M528 HydrophobicContact CE2-CG 4.38Å; Y524-M528 HydrophobicContact CE2-SD 4.36Å; Y524-S529 WeakPolarHBondContact OH-CB 3.36Å; Y524-S529 PolarHBondContact OH-N 3.43Å
525	V	92.1	Very high	94.6	Very high	31 Å²	31	22.4 Å²	22.4	19%	0.188	12%	0.123	C	C	.	.			trans	-115.6	132.9	175	-170.1	0	0	0	0	109.3	V522 G527 M528 F561 F606	V522-V525 HydrophobicContact CG1-CG2 4.05Å; V525-G527 PolarHBondContact O-N 3.12Å; V525-M528 HydrophobicContact CB-CE 4Å; V525-M528 HydrophobicContact CG2-CE 3.89Å; V525-M528 WeakPolarHBondContact O-CB 3.21Å; V525-M528 VanDerWaalsContact O-CG 3.3Å; V525-M528 WeakPolarHBondContact O-CG 3.49Å; V525-M528 PolarHBondContact O-N 3.43Å; V525-M528 VanDerWaalsContact O-N 3.08Å; V525-F561 HydrophobicContact CB-CD1 3.89Å; V525-F561 HydrophobicContact CB-CE1 4.17Å; V525-F561 HydrophobicContact CG1-CD1 4.3Å; V525-F561 HydrophobicContact CG2-CD1 4.17Å; V525-F606 HydrophobicContact CB-CZ 4.4Å; V525-F606 HydrophobicContact CG1-CE2 4.03Å; V525-F606 HydrophobicContact CG1-CZ 3.81Å
526	Q	91.8	Very high	94.6	Very high	66 Å²	66	22.7 Å²	22.7	31%	0.308	13%	0.125	S	C	.	.	T	Hydrogen-bonded Turn	trans	-53.7	123.7	-175.1	-171.3	-171.8	-112.4	0	0	112	D487 R490 F606	D487-Q526 VanDerWaalsContact OD2-CA 3.23Å; D487-Q526 WeakPolarHBondContact OD2-CA 3.32Å; D487-Q526 WeakPolarHBondContact OD2-CG 3.29Å; R490-Q526 VanDerWaalsContact NH2-CG 3.28Å; Q526-F606 WeakPolarHBondContact O-CE1 3.36Å; Q526-F606 VanDerWaalsContact O-CZ 3.23Å; Q526-F606 WeakPolarHBondContact O-CZ 3.32Å
527	G	93.1	Very high	94.7	Very high	2 Å²	2	24.2 Å²	24.2	2%	0.021	13%	0.132	C	C	.	.	T	Hydrogen-bonded Turn	trans	103.6	-9.5	-176.5	0	0	0	0	0	115.1	D487 V525 S529 F530	D487-G527 PolarHBondContact OD2-N 3.3Å; V525-G527 PolarHBondContact O-N 3.12Å; G527-S529 PolarHBondContact O-N 3.18Å; G527-F530 PolarHBondContact O-N 3.33Å
528	M	96.3	Very high	94.9	Very high	1 Å²	1	24.8 Å²	24.8	1%	0.005	13%	0.134	C	C	.	.	H	α-helix	trans	-54.5	-32.9	170.3	-85.2	-171.9	-175.6	0	0	113	L512 Y515 V522 Y524 V525 F530 I531 A532 F548 L552 F561	L512-M528 HydrophobicContact CD2-CB 4.09Å; Y515-M528 HydrophobicContact CD1-CE 4.25Å; Y515-M528 HydrophobicContact CD1-SD 4.09Å; Y515-M528 HydrophobicContact CE1-CE 3.72Å; Y515-M528 HydrophobicContact CE1-SD 4.17Å; V522-M528 HydrophobicContact CG1-CE 3.81Å; Y524-M528 HydrophobicContact CD2-CB 4.08Å; Y524-M528 HydrophobicContact CD2-SD 4.01Å; Y524-M528 HydrophobicContact CE2-CB 3.46Å; Y524-M528 VanDerWaalsContact CE2-CB 3.46Å; Y524-M528 HydrophobicContact CE2-CG 4.38Å; Y524-M528 HydrophobicContact CE2-SD 4.36Å; V525-M528 HydrophobicContact CB-CE 4Å; V525-M528 HydrophobicContact CG2-CE 3.89Å; V525-M528 WeakPolarHBondContact O-CB 3.21Å; V525-M528 VanDerWaalsContact O-CG 3.3Å; V525-M528 WeakPolarHBondContact O-CG 3.49Å; V525-M528 PolarHBondContact O-N 3.43Å; V525-M528 VanDerWaalsContact O-N 3.08Å; M528-F530 VanDerWaalsContact C-N 3.3Å; M528-F530 PolarHBondContact O-N 3.36Å; M528-I531 PolarHBondContact O-N 3.31Å; M528-A532 PolarHBondContact O-N 2.96Å; M528-F548 HydrophobicContact CB-CE2 4.45Å; M528-F548 HydrophobicContact CB-CZ 4.02Å; M528-F548 HydrophobicContact CG-CZ 4.12Å; M528-F548 HydrophobicContact SD-CZ 4.12Å; M528-L552 HydrophobicContact CE-CD1 3.96Å; M528-L552 HydrophobicContact CG-CD1 4.46Å; M528-L552 HydrophobicContact SD-CD1 4.23Å; M528-F561 HydrophobicContact CE-CD1 3.6Å; M528-F561 HydrophobicContact CE-CE1 3.81Å; M528-F561 HydrophobicContact CG-CD1 4.24Å; M528-F561 HydrophobicContact CG-CE1 3.46Å; M528-F561 VanDerWaalsContact CG-CE1 3.46Å; M528-F561 HydrophobicContact CG-CZ 4.17Å
529	S	97.7	Very high	95	Very high	0 Å²	0	23.4 Å²	23.4	0%	0	13%	0.13	C	C	.	.	H	α-helix	trans	-55.9	-39	179.5	63.1	0	0	0	0	113.9	D487 T491 Y524 G527 A532 A533	D487-S529 WeakPolarHBondContact CB-OG 3.41Å; T491-S529 VanDerWaalsContact OG1-CB 3.22Å; T491-S529 WeakPolarHBondContact OG1-CB 3.44Å; T491-S529 PolarHBondContact OG1-OG 2.89Å; Y524-S529 WeakPolarHBondContact OH-CB 3.36Å; Y524-S529 PolarHBondContact OH-N 3.43Å; G527-S529 PolarHBondContact O-N 3.18Å; S529-A532 PolarHBondContact O-N 3.12Å; S529-A533 WeakPolarHBondContact O-CB 3.48Å; S529-A533 PolarHBondContact O-N 3.44Å
530	F	97.9	Very high	95.2	Very high	15 Å²	15	28.3 Å²	28.3	7%	0.066	16%	0.158	C	C	.	.	H	α-helix	trans	-68.7	-39.4	-178.3	-65.1	-100.6	0	0	0	111.1	R490 T491 F492 G527 M528 A533 V534 S610 K611	R490-F530 VanDerWaalsContact O-CZ 3.26Å; R490-F530 WeakPolarHBondContact O-CZ 3.1Å; T491-F530 HydrophobicContact CG2-CD1 4.2Å; T491-F530 HydrophobicContact CG2-CG 4.25Å; F492-F530 HydrophobicContact CE1-CD1 4.49Å; F492-F530 HydrophobicContact CE2-CD1 4.2Å; F492-F530 HydrophobicContact CZ-CD1 4.17Å; G527-F530 PolarHBondContact O-N 3.33Å; M528-F530 VanDerWaalsContact C-N 3.3Å; M528-F530 PolarHBondContact O-N 3.36Å; F530-A533 PolarHBondContact O-N 3.18Å; F530-V534 WeakPolarHBondContact O-CG2 3.35Å; F530-V534 PolarHBondContact O-N 2.82Å; F530-S610 WeakPolarHBondContact CB-OG 3.41Å; F530-S610 WeakPolarHBondContact CD1-O 3.14Å; F530-K611 HydrophobicContact CD1-CB 4.08Å; F530-K611 HydrophobicContact CD2-CB 4.24Å; F530-K611 HydrophobicContact CD2-CG 4.45Å; F530-K611 HydrophobicContact CE1-CB 4.26Å; F530-K611 HydrophobicContact CE1-CG 4.28Å; F530-K611 HydrophobicContact CE2-CB 4.43Å; F530-K611 HydrophobicContact CE2-CG 4.18Å; F530-K611 HydrophobicContact CG-CB 4.07Å; F530-K611 HydrophobicContact CZ-CB 4.44Å; F530-K611 HydrophobicContact CZ-CG 4.08Å
531	I	98.2	Very high	95.6	Very high	0 Å²	0	25.7 Å²	25.7	0%	0	14%	0.141	C	C	.	.	H	α-helix	trans	-64.3	-47.2	174.6	-55.6	176.5	0	0	0	110.2	M528 V534 L535 F548 L551 L552 F561 F606 L608 W622	M528-I531 PolarHBondContact O-N 3.31Å; I531-V534 PolarHBondContact O-N 2.71Å; I531-L535 HydrophobicContact CG2-CD1 4.36Å; I531-L535 WeakPolarHBondContact O-CG 3.37Å; I531-L535 PolarHBondContact O-N 2.9Å; I531-F548 HydrophobicContact CB-CD2 4.35Å; I531-F548 HydrophobicContact CB-CE2 4.08Å; I531-F548 HydrophobicContact CG2-CD2 3.83Å; I531-F548 HydrophobicContact CG2-CE2 4Å; I531-L551 HydrophobicContact CG2-CD2 3.83Å; I531-L552 HydrophobicContact CD1-CD2 4.04Å; I531-F561 HydrophobicContact CD1-CE2 3.93Å; I531-F561 HydrophobicContact CD1-CZ 3.6Å; I531-F606 WeakPolarHBondContact CD1-O 3.48Å; I531-L608 HydrophobicContact CD1-CD1 4.09Å; I531-L608 HydrophobicContact CG1-CD1 4.46Å; I531-W622 HydrophobicContact CB-CH2 4.22Å; I531-W622 HydrophobicContact CB-CZ2 4.36Å; I531-W622 HydrophobicContact CG1-CZ2 4.48Å; I531-W622 HydrophobicContact CG2-CH2 3.58Å; I531-W622 HydrophobicContact CG2-CZ2 4.05Å; I531-W622 WeakPolarHBondContact O-CH2 3.48Å
532	A	98.4	Very high	96.1	Very high	1 Å²	1	22.3 Å²	22.3	1%	0.008	13%	0.125	C	C	.	.	H	α-helix	trans	-65.1	-39	178	0	0	0	0	0	112.3	L508 I511 L512 M528 S529 L535 I536 F548	L508-A532 HydrophobicContact CD1-CB 3.49Å; L508-A532 VanDerWaalsContact CD1-CB 3.49Å; I511-A532 HydrophobicContact CG2-CB 3.9Å; L512-A532 HydrophobicContact CD2-CB 3.74Å; L512-A532 HydrophobicContact CG-CB 4.35Å; M528-A532 PolarHBondContact O-N 2.96Å; S529-A532 PolarHBondContact O-N 3.12Å; A532-L535 PolarHBondContact O-N 3.09Å; A532-I536 WeakPolarHBondContact O-CG1 3.48Å; A532-I536 PolarHBondContact O-N 3.34Å; A532-F548 HydrophobicContact CB-CD2 4.03Å; A532-F548 HydrophobicContact CB-CE2 3.83Å; A532-F548 HydrophobicContact CB-CZ 4.31Å
533	A	98.4	Very high	96.6	Very high	0 Å²	0	24 Å²	24	0%	0	13%	0.133	C	C	.	.	H	α-helix	trans	-62.9	-44.1	177	0	0	0	0	0	112.6	T491 F492 F498 L508 S529 F530 L535 L537	T491-A533 HydrophobicContact CG2-CB 3.52Å; F492-A533 HydrophobicContact CD2-CB 4.1Å; F492-A533 HydrophobicContact CE2-CB 4.02Å; F498-A533 HydrophobicContact CD1-CB 4.12Å; F498-A533 HydrophobicContact CD2-CB 4.45Å; F498-A533 HydrophobicContact CE1-CB 3.71Å; F498-A533 HydrophobicContact CE2-CB 4.07Å; F498-A533 HydrophobicContact CG-CB 4.47Å; F498-A533 HydrophobicContact CZ-CB 3.66Å; L508-A533 HydrophobicContact CD1-CB 4.31Å; L508-A533 HydrophobicContact CD2-CB 4.25Å; S529-A533 WeakPolarHBondContact O-CB 3.48Å; S529-A533 PolarHBondContact O-N 3.44Å; F530-A533 PolarHBondContact O-N 3.18Å; A533-L535 VanDerWaalsContact C-N 3.28Å; A533-L535 PolarHBondContact O-N 2.67Å; A533-L537 WeakPolarHBondContact O-CG 3.41Å; A533-L537 PolarHBondContact O-N 3.18Å
534	V	98.4	Very high	96.9	Very high	0 Å²	0	23.3 Å²	23.3	0%	0	13%	0.126	C	C	.	.	H	α-helix	trans	-60.8	-38.3	173.8	170.8	0	0	0	0	111.2	W432 F492 F530 I531 N538 L615 W622	W432-V534 HydrophobicContact CH2-CG1 3.66Å; W432-V534 HydrophobicContact CZ3-CG1 3.7Å; F492-V534 HydrophobicContact CE2-CG2 4.05Å; F492-V534 HydrophobicContact CZ-CG2 3.97Å; F530-V534 WeakPolarHBondContact O-CG2 3.35Å; F530-V534 PolarHBondContact O-N 2.82Å; I531-V534 PolarHBondContact O-N 2.71Å; V534-N538 PolarHBondContact O-ND2 3.21Å; V534-L615 HydrophobicContact CG2-CD1 3.84Å; V534-W622 HydrophobicContact CB-CH2 3.92Å; V534-W622 HydrophobicContact CB-CZ2 4.05Å; V534-W622 HydrophobicContact CB-CZ3 4.24Å; V534-W622 HydrophobicContact CG1-CD2 3.79Å; V534-W622 HydrophobicContact CG1-CE3 3.67Å; V534-W622 HydrophobicContact CG1-CH2 3.83Å; V534-W622 HydrophobicContact CG1-CZ2 3.97Å; V534-W622 HydrophobicContact CG1-CZ3 3.69Å; V534-W622 HydrophobicContact CG2-CZ2 4.44Å
535	L	98.6	Very high	97.2	Very high	3 Å²	3	22.7 Å²	22.7	2%	0.016	12%	0.124	C	C	.	.	H	α-helix	trans	-70	-48.8	179.2	-71.4	166.8	0	0	0	113	W432 I531 A532 A533 L537 N538 L539 A544 A547 F548 W622	W432-L535 HydrophobicContact CE3-CD2 4.29Å; I531-L535 HydrophobicContact CG2-CD1 4.36Å; I531-L535 WeakPolarHBondContact O-CG 3.37Å; I531-L535 PolarHBondContact O-N 2.9Å; A532-L535 PolarHBondContact O-N 3.09Å; A533-L535 VanDerWaalsContact C-N 3.28Å; A533-L535 PolarHBondContact O-N 2.67Å; L535-L537 PolarHBondContact O-N 2.94Å; L535-N538 CarbonylContact O-C 3.1Å; L535-N538 PolarHBondContact O-N 3.04Å; L535-L539 HydrophobicContact CD2-CD1 3.94Å; L535-L539 WeakPolarHBondContact O-CB 3.43Å; L535-L539 PolarHBondContact O-N 3.01Å; L535-A544 HydrophobicContact CB-CB 4.21Å; L535-A547 HydrophobicContact CD1-CB 4.39Å; L535-A547 HydrophobicContact CD2-CB 3.84Å; L535-F548 VanDerWaalsContact CD1-CA 3.46Å; L535-F548 HydrophobicContact CD1-CB 3.58Å; L535-F548 HydrophobicContact CD1-CD2 4.06Å; L535-F548 HydrophobicContact CD1-CG 4.34Å; L535-W622 HydrophobicContact CD1-CZ3 4.44Å; L535-W622 HydrophobicContact CD2-CZ3 3.77Å; L535-W622 HydrophobicContact CG-CH2 4.13Å; L535-W622 HydrophobicContact CG-CZ3 3.79Å
536	I	98.3	Very high	97.5	Very high	7 Å²	7	22.1 Å²	22.1	4%	0.036	12%	0.119	C	C	.	.	H	α-helix	trans	-69.6	-14.5	-176.8	65.8	-178.8	0	0	0	114.4	F498 Y504 V507 L508 I511 A532 N538 A544	F498-I536 HydrophobicContact CD1-CD1 4.3Å; F498-I536 HydrophobicContact CE1-CD1 4Å; F498-I536 HydrophobicContact CE1-CG1 4.13Å; Y504-I536 HydrophobicContact CD1-CB 4.47Å; Y504-I536 HydrophobicContact CD1-CD1 4.07Å; Y504-I536 HydrophobicContact CD1-CG1 4.09Å; Y504-I536 WeakPolarHBondContact CE1-O 3.24Å; Y504-I536 HydrophobicContact CG-CD1 4.48Å; V507-I536 HydrophobicContact CB-CD1 4.28Å; V507-I536 HydrophobicContact CG1-CB 4.13Å; V507-I536 HydrophobicContact CG1-CD1 4.09Å; V507-I536 HydrophobicContact CG1-CG2 3.97Å; L508-I536 HydrophobicContact CB-CD1 3.69Å; L508-I536 HydrophobicContact CD1-CD1 4.12Å; L508-I536 HydrophobicContact CG-CD1 4.41Å; I511-I536 HydrophobicContact CD1-CG2 4.25Å; I511-I536 HydrophobicContact CG1-CG2 3.68Å; A532-I536 WeakPolarHBondContact O-CG1 3.48Å; A532-I536 PolarHBondContact O-N 3.34Å; I536-N538 VanDerWaalsContact C-N 3.31Å; I536-A544 HydrophobicContact CG2-CB 3.73Å
537	L	97.7	Very high	97.8	Very high	51 Å²	51	19.1 Å²	19.1	27%	0.267	11%	0.106	S	C	.	.	T	Hydrogen-bonded Turn	trans	-74.9	-21	168.1	-74.4	177.8	0	0	0	113.5	I497 F498 Y504 A533 L535 L615	I497-L537 HydrophobicContact CD1-CD2 3.81Å; F498-L537 HydrophobicContact CE1-CD2 4.44Å; F498-L537 HydrophobicContact CE1-CG 4.3Å; F498-L537 HydrophobicContact CE2-CD1 4.4Å; F498-L537 HydrophobicContact CZ-CD1 3.72Å; F498-L537 HydrophobicContact CZ-CD2 4.02Å; F498-L537 HydrophobicContact CZ-CG 3.73Å; Y504-L537 HydrophobicContact CD2-CD2 4.4Å; Y504-L537 HydrophobicContact CE2-CD2 4.05Å; A533-L537 WeakPolarHBondContact O-CG 3.41Å; A533-L537 PolarHBondContact O-N 3.18Å; L535-L537 PolarHBondContact O-N 2.94Å; L537-L615 HydrophobicContact CD1-CD1 4.16Å; L537-L615 HydrophobicContact CD1-CD2 3.59Å; L537-L615 HydrophobicContact CD1-CG 4.48Å
538	N	97.9	Very high	98.1	Very high	26 Å²	26	19 Å²	19	14%	0.139	11%	0.105	C	C	.	.	T	Hydrogen-bonded Turn	trans	-119.1	-12.1	-171	-66.8	-87.3	0	0	0	113	R428 G429 W432 V534 L535 I536	R428-N538 HydrophobicContact CB-CB 4.15Å; R428-N538 VanDerWaalsContact CB-OD1 3.28Å; R428-N538 WeakPolarHBondContact CB-OD1 3.47Å; R428-N538 WeakPolarHBondContact CD-OD1 3.45Å; G429-N538 WeakPolarHBondContact CA-O 3.32Å; G429-N538 PolarHBondContact N-O 3.3Å; W432-N538 HydrophobicContact CE3-CB 4.05Å; W432-N538 HydrophobicContact CH2-CB 4.47Å; W432-N538 HydrophobicContact CZ3-CB 3.77Å; V534-N538 PolarHBondContact O-ND2 3.21Å; L535-N538 CarbonylContact O-C 3.1Å; L535-N538 PolarHBondContact O-N 3.04Å; I536-N538 VanDerWaalsContact C-N 3.31Å
539	L	97.9	Very high	98.2	Very high	23 Å²	23	19 Å²	19	12%	0.12	11%	0.105	C	C	.	.	S	Bend	trans	-138.1	146.1	-174.8	-75.7	167.2	0	0	0	111.9	G429 L535 D543 A544 A547	G429-L539 VanDerWaalsContact CA-CD2 3.49Å; G429-L539 WeakPolarHBondContact O-CD2 3.29Å; L535-L539 HydrophobicContact CD2-CD1 3.94Å; L535-L539 WeakPolarHBondContact O-CB 3.43Å; L535-L539 PolarHBondContact O-N 3.01Å; L539-D543 HydrophobicContact CD2-CB 4.15Å; L539-A544 HydrophobicContact CB-CB 3.85Å; L539-A547 HydrophobicContact CD1-CB 3.72Å
540	D	97.4	Very high	98.2	Very high	131 Å²	131	19.2 Å²	19.2	70%	0.701	11%	0.106	S	C	*	.			trans	-60	145.3	166	-72.6	-56.4	0	0	0	111.1	A542 D543 A544	D540-A542 VanDerWaalsContact C-N 3.32Å; D540-A542 PolarHBondContact O-N 3.12Å; D540-D543 PolarHBondContact O-N 2.82Å; D540-A544 PolarHBondContact O-N 3.47Å
541	T	97.9	Very high	98.1	Very high	48 Å²	48	18.6 Å²	18.6	29%	0.294	10%	0.104	S	C	.	.	H	α-helix	trans	-49.3	-43.4	-166.1	-45.9	0	0	0	0	115	Y447 V507 I511 F545	Y447-T541 HydrophobicContact CE1-CG2 4.11Å; Y447-T541 WeakPolarHBondContact OH-CG2 3.34Å; V507-T541 HydrophobicContact CG1-CG2 3.81Å; I511-T541 HydrophobicContact CD1-CG2 3.63Å; I511-T541 WeakPolarHBondContact CD1-O 3.44Å; I511-T541 HydrophobicContact CG1-CG2 4.31Å; T541-F545 PolarHBondContact O-N 3.21Å
542	A	97.8	Very high	97.9	Very high	15 Å²	15	18.7 Å²	18.7	12%	0.124	10%	0.104	C	C	.	.	H	α-helix	trans	-70.5	-36.4	-179.4	0	0	0	0	0	112.7	H444 Y447 D540 F545 I546	H444-A542 HydrophobicContact CB-CB 4.23Å; Y447-A542 HydrophobicContact CD1-CB 3.96Å; D540-A542 VanDerWaalsContact C-N 3.32Å; D540-A542 PolarHBondContact O-N 3.12Å; A542-F545 WeakPolarHBondContact O-CB 3.42Å; A542-F545 PolarHBondContact O-N 3.47Å; A542-I546 WeakPolarHBondContact O-CG1 3.46Å; A542-I546 PolarHBondContact O-N 3.1Å; A542-I546 VanDerWaalsContact O-N 3.1Å
543	D	98.3	Very high	97.7	Very high	56 Å²	56	20.9 Å²	20.9	30%	0.299	12%	0.116	S	C	.	.	H	α-helix	trans	-77.3	-32	176.1	-65.9	-42.4	0	0	0	111.7	H444 L539 D540 F545 I546 A547	H444-D543 IonicContact CD2-OD1 3.54Å; H444-D543 IonicContact CE1-OD1 3.6Å; H444-D543 IonicContact CE1-OD2 3.64Å; H444-D543 IonicContact NE2-OD1 2.8Å; H444-D543 PolarHBondContact NE2-OD1 2.92Å; H444-D543 IonicContact NE2-OD2 2.64Å; L539-D543 HydrophobicContact CD2-CB 4.15Å; D540-D543 PolarHBondContact O-N 2.82Å; D543-F545 VanDerWaalsContact C-N 3.31Å; D543-F545 PolarHBondContact O-N 2.93Å; D543-I546 PolarHBondContact O-N 3.45Å; D543-A547 WeakPolarHBondContact O-CB 3.43Å; D543-A547 PolarHBondContact O-N 3.4Å
544	A	98.6	Very high	97.5	Very high	1 Å²	1	23 Å²	23	1%	0.008	13%	0.125	C	C	.	.	H	α-helix	trans	-59.9	-41.6	168.5	0	0	0	0	0	111.2	I511 L535 I536 L539 D540 F548	I511-A544 HydrophobicContact CD1-CB 4.27Å; L535-A544 HydrophobicContact CB-CB 4.21Å; I536-A544 HydrophobicContact CG2-CB 3.73Å; L539-A544 HydrophobicContact CB-CB 3.85Å; D540-A544 PolarHBondContact O-N 3.47Å; A544-F548 WeakPolarHBondContact O-CB 3.44Å; A544-F548 PolarHBondContact O-N 2.95Å
545	F	98.7	Very high	97.1	Very high	0 Å²	0	27 Å²	27	0%	0	15%	0.151	C	C	.	.	H	α-helix	trans	-63.8	-45.1	173.6	178.9	-101.9	0	0	0	112.6	I442 Y447 I511 A514 Y518 T541 A542 D543 F548 A549	I442-F545 HydrophobicContact CG2-CD1 3.92Å; I442-F545 HydrophobicContact CG2-CE1 3.74Å; Y447-F545 HydrophobicContact CD2-CB 3.54Å; Y447-F545 AromaticContact CD2-CD1 3.58Å; Y447-F545 HydrophobicContact CD2-CD1 3.58Å; Y447-F545 AromaticContact CD2-CD2 3.64Å; Y447-F545 HydrophobicContact CD2-CD2 3.64Å; Y447-F545 HydrophobicContact CD2-CE1 4.14Å; Y447-F545 HydrophobicContact CD2-CE2 4.2Å; Y447-F545 AromaticContact CD2-CG 3.28Å; Y447-F545 HydrophobicContact CD2-CG 3.28Å; Y447-F545 HydrophobicContact CD2-CZ 4.43Å; Y447-F545 HydrophobicContact CE2-CB 3.94Å; Y447-F545 HydrophobicContact CE2-CD2 4Å; Y447-F545 AromaticContact CE2-CG 3.95Å; Y447-F545 HydrophobicContact CE2-CG 3.95Å; Y447-F545 HydrophobicContact CG-CB 4.11Å; Y447-F545 AromaticContact CG-CD1 4Å; Y447-F545 HydrophobicContact CG-CD1 4Å; Y447-F545 HydrophobicContact CG-CG 4.04Å; I511-F545 HydrophobicContact CD1-CB 3.82Å; A514-F545 HydrophobicContact CB-CD2 4.07Å; A514-F545 HydrophobicContact CB-CE2 3.7Å; A514-F545 HydrophobicContact CB-CZ 4.31Å; Y518-F545 HydrophobicContact CD1-CZ 4.14Å; Y518-F545 HydrophobicContact CG-CZ 4.1Å; T541-F545 PolarHBondContact O-N 3.21Å; A542-F545 WeakPolarHBondContact O-CB 3.42Å; A542-F545 PolarHBondContact O-N 3.47Å; D543-F545 VanDerWaalsContact C-N 3.31Å; D543-F545 PolarHBondContact O-N 2.93Å; F545-F548 PolarHBondContact O-N 3.42Å; F545-A549 WeakPolarHBondContact O-CB 3.2Å; F545-A549 PolarHBondContact O-N 3.24Å
546	I	98.6	Very high	96.9	Very high	18 Å²	18	26.9 Å²	26.9	9%	0.092	15%	0.151	C	C	.	.	H	α-helix	trans	-60	-49	177	-71.5	165.1	0	0	0	110.5	N438 I442 A542 D543 N550	N438-I546 HydrophobicContact CB-CG2 4.03Å; I442-I546 HydrophobicContact CB-CG1 3.98Å; I442-I546 HydrophobicContact CG2-CG1 3.66Å; I442-I546 WeakPolarHBondContact O-CD1 3.36Å; A542-I546 WeakPolarHBondContact O-CG1 3.46Å; A542-I546 PolarHBondContact O-N 3.1Å; A542-I546 VanDerWaalsContact O-N 3.1Å; D543-I546 PolarHBondContact O-N 3.45Å; I546-N550 WeakPolarHBondContact O-CB 3.31Å; I546-N550 PolarHBondContact O-N 2.85Å; I546-N550 PolarHBondContact O-ND2 3.05Å
547	A	98.5	Very high	96.5	Very high	4 Å²	4	26.7 Å²	26.7	3%	0.033	15%	0.149	C	C	.	.	H	α-helix	trans	-62.3	-44.7	177.8	0	0	0	0	0	111.6	L535 L539 D543 N550 L551	L535-A547 HydrophobicContact CD1-CB 4.39Å; L535-A547 HydrophobicContact CD2-CB 3.84Å; L539-A547 HydrophobicContact CD1-CB 3.72Å; D543-A547 WeakPolarHBondContact O-CB 3.43Å; D543-A547 PolarHBondContact O-N 3.4Å; A547-N550 PolarHBondContact O-N 3.01Å; A547-L551 WeakPolarHBondContact O-CB 3.44Å; A547-L551 PolarHBondContact O-N 3.34Å
548	F	98.3	Very high	96.2	Very high	0 Å²	0	25.9 Å²	25.9	0%	0	15%	0.145	C	C	.	.	H	α-helix	trans	-58	-52	178.1	179.8	-112.8	0	0	0	111.6	I511 L512 Y515 M528 I531 A532 L535 A544 F545 L551 L552	I511-F548 HydrophobicContact CG2-CD1 3.91Å; I511-F548 HydrophobicContact CG2-CE1 4.26Å; I511-F548 HydrophobicContact CG2-CG 4.2Å; L512-F548 HydrophobicContact CD2-CE1 4.21Å; L512-F548 HydrophobicContact CD2-CE2 4.44Å; L512-F548 HydrophobicContact CD2-CZ 3.73Å; Y515-F548 HydrophobicContact CD1-CE1 4.14Å; Y515-F548 AromaticContact CD2-CD1 3.84Å; Y515-F548 HydrophobicContact CD2-CD1 3.84Å; Y515-F548 AromaticContact CD2-CE1 3.74Å; Y515-F548 HydrophobicContact CD2-CE1 3.74Å; Y515-F548 HydrophobicContact CE2-CE1 4.41Å; Y515-F548 HydrophobicContact CG-CD1 4.12Å; Y515-F548 AromaticContact CG-CE1 3.57Å; Y515-F548 HydrophobicContact CG-CE1 3.57Å; M528-F548 HydrophobicContact CB-CE2 4.45Å; M528-F548 HydrophobicContact CB-CZ 4.02Å; M528-F548 HydrophobicContact CG-CZ 4.12Å; M528-F548 HydrophobicContact SD-CZ 4.12Å; I531-F548 HydrophobicContact CB-CD2 4.35Å; I531-F548 HydrophobicContact CB-CE2 4.08Å; I531-F548 HydrophobicContact CG2-CD2 3.83Å; I531-F548 HydrophobicContact CG2-CE2 4Å; A532-F548 HydrophobicContact CB-CD2 4.03Å; A532-F548 HydrophobicContact CB-CE2 3.83Å; A532-F548 HydrophobicContact CB-CZ 4.31Å; L535-F548 VanDerWaalsContact CD1-CA 3.46Å; L535-F548 HydrophobicContact CD1-CB 3.58Å; L535-F548 HydrophobicContact CD1-CD2 4.06Å; L535-F548 HydrophobicContact CD1-CG 4.34Å; A544-F548 WeakPolarHBondContact O-CB 3.44Å; A544-F548 PolarHBondContact O-N 2.95Å; F545-F548 PolarHBondContact O-N 3.42Å; F548-L551 PolarHBondContact O-N 3.43Å; F548-L552 HydrophobicContact CD1-CD1 4.07Å; F548-L552 HydrophobicContact CD2-CD1 4.24Å; F548-L552 HydrophobicContact CD2-CG 4.44Å; F548-L552 HydrophobicContact CE1-CD1 3.61Å; F548-L552 HydrophobicContact CE2-CD1 3.79Å; F548-L552 HydrophobicContact CE2-CG 4.27Å; F548-L552 HydrophobicContact CG-CD1 4.37Å; F548-L552 HydrophobicContact CZ-CD1 3.46Å; F548-L552 VanDerWaalsContact CZ-CD1 3.46Å; F548-L552 HydrophobicContact CZ-CG 4.41Å; F548-L552 WeakPolarHBondContact O-CB 3.46Å; F548-L552 WeakPolarHBondContact O-CG 3.38Å; F548-L552 PolarHBondContact O-N 3.36Å
549	A	97.9	Very high	95.8	Very high	1 Å²	1	24.7 Å²	24.7	1%	0.008	14%	0.138	C	C	.	.	H	α-helix	trans	-66.9	-39.4	-178.2	0	0	0	0	0	113	L440 I442 Y515 Y518 F545 N553	L440-A549 HydrophobicContact CD1-CB 4.26Å; L440-A549 WeakPolarHBondContact CD1-O 3.46Å; I442-A549 HydrophobicContact CD1-CB 3.36Å; Y515-A549 HydrophobicContact CD2-CB 4.18Å; Y515-A549 HydrophobicContact CE2-CB 4.04Å; Y518-A549 HydrophobicContact CD1-CB 4.2Å; Y518-A549 HydrophobicContact CE1-CB 3.94Å; F545-A549 WeakPolarHBondContact O-CB 3.2Å; F545-A549 PolarHBondContact O-N 3.24Å; A549-N553 WeakPolarHBondContact O-CB 3.41Å; A549-N553 PolarHBondContact O-N 3.25Å
550	N	97.9	Very high	95.2	Very high	4 Å²	4	23.6 Å²	23.6	2%	0.021	13%	0.133	C	C	.	.	H	α-helix	trans	-70.2	-35.5	175.8	-79.1	-85.9	0	0	0	112.4	V436 G437 N438 E439 L440 I546 A547 N553 K554	V436-N550 HydrophobicContact CG1-CB 3.89Å; G437-N550 WeakPolarHBondContact O-CB 3.47Å; N438-N550 WeakPolarHBondContact CA-OD1 3.15Å; N438-N550 PolarHBondContact OD1-ND2 3.21Å; E439-N550 PolarHBondContact N-OD1 3.13Å; L440-N550 WeakPolarHBondContact CB-OD1 3.36Å; L440-N550 WeakPolarHBondContact CG-OD1 3.3Å; L440-N550 PolarHBondContact N-OD1 3.21Å; I546-N550 WeakPolarHBondContact O-CB 3.31Å; I546-N550 PolarHBondContact O-N 2.85Å; I546-N550 PolarHBondContact O-ND2 3.05Å; A547-N550 PolarHBondContact O-N 3.01Å; N550-N553 PolarHBondContact O-N 2.98Å; N550-K554 PolarHBondContact O-N 3.5Å
551	L	96.4	Very high	94.6	Very high	2 Å²	2	17.7 Å²	17.7	1%	0.01	10%	0.101	C	C	.	.	H	α-helix	trans	-66.3	-47.7	175.6	179.6	59.4	0	0	0	111.6	V436 I531 A547 F548 N553 K554 L608 W622 F625	V436-L551 HydrophobicContact CG1-CB 4.24Å; I531-L551 HydrophobicContact CG2-CD2 3.83Å; A547-L551 WeakPolarHBondContact O-CB 3.44Å; A547-L551 PolarHBondContact O-N 3.34Å; F548-L551 PolarHBondContact O-N 3.43Å; L551-N553 PolarHBondContact O-N 3.41Å; L551-K554 WeakPolarHBondContact O-CB 3.41Å; L551-K554 WeakPolarHBondContact O-CG 3.4Å; L551-K554 PolarHBondContact O-N 2.93Å; L551-K554 VanDerWaalsContact O-N 3.16Å; L551-L608 HydrophobicContact CD1-CD2 3.99Å; L551-L608 HydrophobicContact CD2-CD1 4.4Å; L551-L608 HydrophobicContact CD2-CD2 4.33Å; L551-W622 HydrophobicContact CD2-CH2 3.89Å; L551-W622 HydrophobicContact CD2-CZ3 3.94Å; L551-F625 HydrophobicContact CD1-CE1 3.55Å; L551-F625 HydrophobicContact CD1-CZ 3.69Å
552	L	94.8	Very high	94.1	Very high	1 Å²	1	21.8 Å²	21.8	1%	0.005	11%	0.111	C	C	.	.	H	α-helix	trans	-62.1	-24.8	175.9	-71.2	-178	0	0	0	113	Y515 M528 I531 F548 M558 F561	Y515-L552 HydrophobicContact CD1-CD1 4.4Å; Y515-L552 HydrophobicContact CD2-CD1 4.33Å; Y515-L552 HydrophobicContact CE1-CD1 3.86Å; Y515-L552 HydrophobicContact CE2-CD1 3.77Å; M528-L552 HydrophobicContact CE-CD1 3.96Å; M528-L552 HydrophobicContact CG-CD1 4.46Å; M528-L552 HydrophobicContact SD-CD1 4.23Å; I531-L552 HydrophobicContact CD1-CD2 4.04Å; F548-L552 HydrophobicContact CD1-CD1 4.07Å; F548-L552 HydrophobicContact CD2-CD1 4.24Å; F548-L552 HydrophobicContact CD2-CG 4.44Å; F548-L552 HydrophobicContact CE1-CD1 3.61Å; F548-L552 HydrophobicContact CE2-CD1 3.79Å; F548-L552 HydrophobicContact CE2-CG 4.27Å; F548-L552 HydrophobicContact CG-CD1 4.37Å; F548-L552 HydrophobicContact CZ-CD1 3.46Å; F548-L552 VanDerWaalsContact CZ-CD1 3.46Å; F548-L552 HydrophobicContact CZ-CG 4.41Å; F548-L552 WeakPolarHBondContact O-CB 3.46Å; F548-L552 WeakPolarHBondContact O-CG 3.38Å; F548-L552 PolarHBondContact O-N 3.36Å; L552-M558 VanDerWaalsContact O-CG 3.31Å; L552-M558 WeakPolarHBondContact O-CG 3.44Å; L552-F561 HydrophobicContact CD2-CD1 4.28Å; L552-F561 HydrophobicContact CD2-CD2 3.63Å; L552-F561 HydrophobicContact CD2-CE1 3.97Å; L552-F561 HydrophobicContact CD2-CE2 3.28Å; L552-F561 HydrophobicContact CD2-CG 4.15Å; L552-F561 HydrophobicContact CD2-CZ 3.48Å; L552-F561 VanDerWaalsContact CD2-CZ 3.48Å
553	N	94.3	Very high	93.4	Very high	47 Å²	47	23.4 Å²	23.4	25%	0.251	12%	0.119	S	C	.	.	T	Hydrogen-bonded Turn	trans	-86	-3.8	178.8	-162	80.2	0	0	0	114.3	L440 R519 A549 N550 L551 M558	L440-N553 HydrophobicContact CD1-CB 3.88Å; L440-N553 HydrophobicContact CD2-CB 4.38Å; L440-N553 HydrophobicContact CG-CB 4.38Å; R519-N553 PolarHBondContact NH1-OD1 3.49Å; R519-N553 VanDerWaalsContact NH1-OD1 3.16Å; A549-N553 WeakPolarHBondContact O-CB 3.41Å; A549-N553 PolarHBondContact O-N 3.25Å; N550-N553 PolarHBondContact O-N 2.98Å; L551-N553 PolarHBondContact O-N 3.41Å; N553-M558 WeakPolarHBondContact O-CG 3.48Å
554	K	93.1	Very high	93	Very high	44 Å²	44	24 Å²	24	19%	0.191	12%	0.123	C	C	.	.	S	Bend	trans	-66.1	149.8	174.7	-59.3	-65.7	175.2	169.7	0	110.5	V436 E439 N550 L551 C556 Q557 M558	V436-K554 WeakPolarHBondContact O-CE 3.26Å; V436-K554 PolarHBondContact O-NZ 2.92Å; E439-K554 IonicContact OE1-NZ 2.67Å; E439-K554 PolarHBondContact OE1-NZ 3.05Å; N550-K554 PolarHBondContact O-N 3.5Å; L551-K554 WeakPolarHBondContact O-CB 3.41Å; L551-K554 WeakPolarHBondContact O-CG 3.4Å; L551-K554 PolarHBondContact O-N 2.93Å; L551-K554 VanDerWaalsContact O-N 3.16Å; K554-C556 VanDerWaalsContact C-N 3.32Å; K554-C556 PolarHBondContact O-N 3.47Å; K554-Q557 PolarHBondContact O-N 2.93Å; K554-M558 WeakPolarHBondContact O-CB 3.42Å; K554-M558 WeakPolarHBondContact O-CG 3.24Å; K554-M558 PolarHBondContact O-N 2.81Å
555	P	91	Very high	92.5	Very high	86 Å²	86	27 Å²	27	56%	0.558	14%	0.136	S	C	*	.	H	α-helix	trans	-56.6	-39.4	-171	-28.5	36.1	0	0	0	114.9	A559	P555-A559 PolarHBondContact O-N 2.97Å
556	C	92.9	Very high	92.1	Very high	0 Å²	0	29.9 Å²	29.9	0%	0	16%	0.156	C	C	.	.	H	α-helix	trans	-63.2	-57.8	176.4	-166.3	0	0	0	0	110.9	K554 M558 A559 F560 Y571 I605 E630	K554-C556 VanDerWaalsContact C-N 3.32Å; K554-C556 PolarHBondContact O-N 3.47Å; C556-M558 PolarHBondContact O-N 3.23Å; C556-A559 VanDerWaalsContact O-CB 3.28Å; C556-A559 WeakPolarHBondContact O-CB 3.43Å; C556-A559 PolarHBondContact O-N 3.21Å; C556-F560 WeakPolarHBondContact O-CD2 3.45Å; C556-F560 PolarHBondContact O-N 2.97Å; C556-Y571 VanDerWaalsContact CA-OH 3.28Å; C556-Y571 WeakPolarHBondContact CA-OH 3.36Å; C556-Y571 HydrophobicContact CB-CE1 4.23Å; C556-Y571 HydrophobicContact CB-CE2 4.35Å; C556-Y571 PolarHBondContact N-OH 2.99Å; C556-I605 VanDerWaalsContact SG-CG2 3.52Å; C556-E630 HydrophobicContact CB-CB 4.05Å; C556-E630 WeakPolarHBondContact CB-OE2 3.46Å
557	Q	91.6	Very high	91.7	Very high	2 Å²	2	31.1 Å²	31.1	1%	0.009	16%	0.163	C	C	.	.	H	α-helix	trans	-55.1	-49.1	179.6	-78.3	60	40.5	0	0	111.1	K554 A559 F560 F561 L608	K554-Q557 PolarHBondContact O-N 2.93Å; Q557-A559 PolarHBondContact O-N 3.39Å; Q557-A559 VanDerWaalsContact O-N 3.16Å; Q557-F560 PolarHBondContact O-N 3.39Å; Q557-F560 VanDerWaalsContact O-N 3.12Å; Q557-F561 HydrophobicContact CB-CD2 4.1Å; Q557-F561 HydrophobicContact CB-CE2 4.48Å; Q557-F561 WeakPolarHBondContact O-CB 3.47Å; Q557-F561 VanDerWaalsContact O-CD2 3.3Å; Q557-F561 WeakPolarHBondContact O-CD2 3.49Å; Q557-F561 PolarHBondContact O-N 3.46Å; Q557-L608 HydrophobicContact CG-CD1 4.11Å
558	M	89.8	Confident	91.5	Very high	34 Å²	34	31.2 Å²	31.2	17%	0.167	16%	0.163	C	C	.	.	H	α-helix	trans	-54.5	-35.8	177.1	-75	-72.8	-86.9	0	0	113.4	L552 N553 K554 C556 R562	L552-M558 VanDerWaalsContact O-CG 3.31Å; L552-M558 WeakPolarHBondContact O-CG 3.44Å; N553-M558 WeakPolarHBondContact O-CG 3.48Å; K554-M558 WeakPolarHBondContact O-CB 3.42Å; K554-M558 WeakPolarHBondContact O-CG 3.24Å; K554-M558 PolarHBondContact O-N 2.81Å; C556-M558 PolarHBondContact O-N 3.23Å; M558-R562 WeakPolarHBondContact O-CB 3.24Å; M558-R562 PolarHBondContact O-N 3Å
559	A	89.3	Confident	91.3	Very high	1 Å²	1	35 Å²	35	1%	0.008	18%	0.182	C	C	.	.	H	α-helix	trans	-63.7	-46.1	178.2	0	0	0	0	0	112.4	P555 C556 Q557 V563 D564 L567 M568 Y571	P555-A559 PolarHBondContact O-N 2.97Å; C556-A559 VanDerWaalsContact O-CB 3.28Å; C556-A559 WeakPolarHBondContact O-CB 3.43Å; C556-A559 PolarHBondContact O-N 3.21Å; Q557-A559 PolarHBondContact O-N 3.39Å; Q557-A559 VanDerWaalsContact O-N 3.16Å; A559-V563 PolarHBondContact O-N 2.97Å; A559-D564 PolarHBondContact O-N 3.38Å; A559-L567 HydrophobicContact CB-CB 3.95Å; A559-L567 HydrophobicContact CB-CD2 3.65Å; A559-L567 HydrophobicContact CB-CG 3.62Å; A559-M568 HydrophobicContact CB-CG 4.48Å; A559-Y571 HydrophobicContact CB-CD2 4.21Å; A559-Y571 HydrophobicContact CB-CE2 4.02Å
560	F	87.3	Confident	91.2	Very high	0 Å²	0	35.3 Å²	35.3	0%	0	18%	0.184	C	C	.	.	H	α-helix	trans	-78.2	-39.5	179.9	-66.7	-95.3	0	0	0	111.9	C556 Q557 V563 M568 Y571 F572 I602 I605 F606	C556-F560 WeakPolarHBondContact O-CD2 3.45Å; C556-F560 PolarHBondContact O-N 2.97Å; Q557-F560 PolarHBondContact O-N 3.39Å; Q557-F560 VanDerWaalsContact O-N 3.12Å; F560-V563 PolarHBondContact O-N 3.22Å; F560-M568 HydrophobicContact CD1-CE 3.74Å; F560-M568 HydrophobicContact CD1-CG 3.99Å; F560-M568 HydrophobicContact CD1-SD 4.21Å; F560-M568 HydrophobicContact CE1-CE 3.97Å; F560-M568 HydrophobicContact CE1-CG 4.16Å; F560-M568 HydrophobicContact CG-CG 4.19Å; F560-Y571 HydrophobicContact CE2-CD2 4.34Å; F560-Y571 HydrophobicContact CE2-CG 4.5Å; F560-F572 AromaticContact CE1-CE1 3.73Å; F560-F572 HydrophobicContact CE1-CE1 3.73Å; F560-F572 AromaticContact CE1-CZ 3.9Å; F560-F572 HydrophobicContact CE1-CZ 3.9Å; F560-F572 AromaticContact CZ-CE1 3.9Å; F560-F572 HydrophobicContact CZ-CE1 3.9Å; F560-F572 HydrophobicContact CZ-CZ 4.45Å; F560-I602 HydrophobicContact CD1-CG1 4.38Å; F560-I602 HydrophobicContact CD1-CG2 4.32Å; F560-I602 HydrophobicContact CE1-CG1 4.21Å; F560-I605 HydrophobicContact CD2-CG2 4.12Å; F560-I605 HydrophobicContact CE2-CB 4.29Å; F560-I605 HydrophobicContact CE2-CG2 3.64Å; F560-I605 HydrophobicContact CZ-CB 4.22Å; F560-I605 HydrophobicContact CZ-CG2 4.04Å; F560-F606 HydrophobicContact CB-CB 4.09Å; F560-F606 HydrophobicContact CB-CD2 3.78Å; F560-F606 HydrophobicContact CB-CG 4.42Å; F560-F606 HydrophobicContact CG-CB 4.48Å
561	F	84.5	Confident	91.1	Very high	8 Å²	8	35.3 Å²	35.3	4%	0.035	18%	0.184	C	C	.	.	H	α-helix	trans	-70	-30.7	-179	-85.1	-77	0	0	0	114.5	V525 M528 I531 L552 Q557 F606	V525-F561 HydrophobicContact CB-CD1 3.89Å; V525-F561 HydrophobicContact CB-CE1 4.17Å; V525-F561 HydrophobicContact CG1-CD1 4.3Å; V525-F561 HydrophobicContact CG2-CD1 4.17Å; M528-F561 HydrophobicContact CE-CD1 3.6Å; M528-F561 HydrophobicContact CE-CE1 3.81Å; M528-F561 HydrophobicContact CG-CD1 4.24Å; M528-F561 HydrophobicContact CG-CE1 3.46Å; M528-F561 VanDerWaalsContact CG-CE1 3.46Å; M528-F561 HydrophobicContact CG-CZ 4.17Å; I531-F561 HydrophobicContact CD1-CE2 3.93Å; I531-F561 HydrophobicContact CD1-CZ 3.6Å; L552-F561 HydrophobicContact CD2-CD1 4.28Å; L552-F561 HydrophobicContact CD2-CD2 3.63Å; L552-F561 HydrophobicContact CD2-CE1 3.97Å; L552-F561 HydrophobicContact CD2-CE2 3.28Å; L552-F561 HydrophobicContact CD2-CG 4.15Å; L552-F561 HydrophobicContact CD2-CZ 3.48Å; L552-F561 VanDerWaalsContact CD2-CZ 3.48Å; Q557-F561 HydrophobicContact CB-CD2 4.1Å; Q557-F561 HydrophobicContact CB-CE2 4.48Å; Q557-F561 WeakPolarHBondContact O-CB 3.47Å; Q557-F561 VanDerWaalsContact O-CD2 3.3Å; Q557-F561 WeakPolarHBondContact O-CD2 3.49Å; Q557-F561 PolarHBondContact O-N 3.46Å; F561-F606 HydrophobicContact CB-CE2 4.48Å; F561-F606 HydrophobicContact CD1-CD2 4.08Å; F561-F606 AromaticContact CD1-CE2 3.28Å; F561-F606 HydrophobicContact CD1-CE2 3.28Å; F561-F606 AromaticContact CD1-CZ 3.76Å; F561-F606 HydrophobicContact CD1-CZ 3.76Å; F561-F606 AromaticContact CD2-CD2 3.85Å; F561-F606 HydrophobicContact CD2-CD2 3.85Å; F561-F606 AromaticContact CD2-CE2 3.92Å; F561-F606 HydrophobicContact CD2-CE2 3.92Å; F561-F606 AromaticContact CE1-CD2 3.89Å; F561-F606 HydrophobicContact CE1-CD2 3.89Å; F561-F606 AromaticContact CE1-CE1 3.98Å; F561-F606 HydrophobicContact CE1-CE1 3.98Å; F561-F606 AromaticContact CE1-CE2 3.12Å; F561-F606 HydrophobicContact CE1-CE2 3.12Å; F561-F606 AromaticContact CE1-CZ 3.16Å; F561-F606 HydrophobicContact CE1-CZ 3.16Å; F561-F606 AromaticContact CE2-CD2 3.66Å; F561-F606 HydrophobicContact CE2-CD2 3.66Å; F561-F606 AromaticContact CE2-CE2 3.79Å; F561-F606 HydrophobicContact CE2-CE2 3.79Å; F561-F606 HydrophobicContact CE2-CG 4.17Å; F561-F606 HydrophobicContact CE2-CZ 4.33Å; F561-F606 WeakPolarHBondContact CE2-O 3.48Å; F561-F606 HydrophobicContact CG-CD2 4.04Å; F561-F606 AromaticContact CG-CE2 3.66Å; F561-F606 HydrophobicContact CG-CE2 3.66Å; F561-F606 HydrophobicContact CZ-CD1 4.2Å; F561-F606 AromaticContact CZ-CD2 3.67Å; F561-F606 HydrophobicContact CZ-CD2 3.67Å; F561-F606 AromaticContact CZ-CE1 3.9Å; F561-F606 HydrophobicContact CZ-CE1 3.9Å; F561-F606 AromaticContact CZ-CE2 3.38Å; F561-F606 HydrophobicContact CZ-CE2 3.38Å; F561-F606 HydrophobicContact CZ-CG 4.09Å; F561-F606 AromaticContact CZ-CZ 3.49Å; F561-F606 HydrophobicContact CZ-CZ 3.49Å; F561-F606 VanDerWaalsContact CZ-CZ 3.49Å
562	R	86.1	Confident	91.2	Very high	133 Å²	133	35.9 Å²	35.9	50%	0.502	19%	0.187	S	C	.	.	T	Hydrogen-bonded Turn	trans	-97.1	7	174.1	-72.3	175.6	152	-172.6	-6.1	114	D521 V522 M558 D564	D521-R562 IonicContact OD2-CZ 3.68Å; D521-R562 IonicContact OD2-NE 3.22Å; D521-R562 IonicContact OD2-NH2 2.9Å; D521-R562 PolarHBondContact OD2-NH2 2.96Å; V522-R562 HydrophobicContact CG2-CG 4.38Å; M558-R562 WeakPolarHBondContact O-CB 3.24Å; M558-R562 PolarHBondContact O-N 3Å; R562-D564 VanDerWaalsContact C-N 3.26Å; R562-D564 PolarHBondContact O-N 3.18Å
563	V	84.4	Confident	91.3	Very high	49 Å²	49	37.8 Å²	37.8	30%	0.297	20%	0.202	S	C	.	.	T	Hydrogen-bonded Turn	trans	55.3	41.6	-178.7	-168.5	0	0	0	0	111.8	F257 A559 F560 H565	F257-V563 HydrophobicContact CD1-CG2 3.87Å; F257-V563 HydrophobicContact CD2-CG1 3.69Å; F257-V563 HydrophobicContact CD2-CG2 4.08Å; F257-V563 HydrophobicContact CE1-CG2 3.77Å; F257-V563 HydrophobicContact CE2-CB 4.27Å; F257-V563 HydrophobicContact CE2-CG1 3.37Å; F257-V563 HydrophobicContact CE2-CG2 4Å; F257-V563 HydrophobicContact CG-CG1 4.44Å; F257-V563 HydrophobicContact CG-CG2 4.02Å; F257-V563 HydrophobicContact CZ-CB 4.32Å; F257-V563 HydrophobicContact CZ-CG1 3.87Å; F257-V563 HydrophobicContact CZ-CG2 3.83Å; A559-V563 PolarHBondContact O-N 2.97Å; F560-V563 PolarHBondContact O-N 3.22Å; V563-H565 VanDerWaalsContact CG1-CE1 3.4Å; V563-H565 WeakPolarHBondContact CG1-CE1 3.45Å; V563-H565 PolarHBondContact O-N 3.38Å
564	D	88.6	Confident	91.4	Very high	70 Å²	70	35.5 Å²	35.5	37%	0.374	19%	0.19	S	C	.	.			trans	-73.5	82	170.4	-175.2	-13.7	0	0	0	109	A559 R562 S566 L567 M568	A559-D564 PolarHBondContact O-N 3.38Å; R562-D564 VanDerWaalsContact C-N 3.26Å; R562-D564 PolarHBondContact O-N 3.18Å; D564-S566 PolarHBondContact O-N 3.31Å; D564-S566 WeakPolarHBondContact OD1-CA 3.38Å; D564-S566 WeakPolarHBondContact OD1-CB 3.23Å; D564-S566 PolarHBondContact OD1-N 3.09Å; D564-L567 HydrophobicContact CB-CB 4.13Å; D564-L567 PolarHBondContact O-N 3.18Å; D564-L567 VanDerWaalsContact O-N 3.09Å; D564-L567 PolarHBondContact OD1-N 3.22Å; D564-L567 WeakPolarHBondContact OD2-CB 3.34Å; D564-M568 WeakPolarHBondContact O-CB 3.34Å; D564-M568 VanDerWaalsContact O-CG 3.31Å; D564-M568 WeakPolarHBondContact O-CG 3.39Å; D564-M568 PolarHBondContact O-N 3.25Å
565	H	88.2	Confident	91.7	Very high	62 Å²	62	33.4 Å²	33.4	29%	0.287	18%	0.181	S	C	.	.	H	α-helix	trans	-51.3	-29.5	174.4	-64.7	-55.8	0	0	0	112.4	F253 V563 L569	F253-H565 VanDerWaalsContact CB-CE1 3.42Å; F253-H565 WeakPolarHBondContact CB-CE1 3.3Å; V563-H565 VanDerWaalsContact CG1-CE1 3.4Å; V563-H565 WeakPolarHBondContact CG1-CE1 3.45Å; V563-H565 PolarHBondContact O-N 3.38Å; H565-L569 VanDerWaalsContact O-CB 3.25Å; H565-L569 WeakPolarHBondContact O-CB 3.5Å; H565-L569 WeakPolarHBondContact O-CD1 3.44Å; H565-L569 WeakPolarHBondContact O-CG 3.47Å; H565-L569 PolarHBondContact O-N 2.81Å
566	S	89.9	Confident	92	Very high	61 Å²	61	31.4 Å²	31.4	43%	0.427	16%	0.164	S	C	.	.	H	α-helix	trans	-71.1	-45.9	179.3	-164	0	0	0	0	111.3	D564 T570 K699	D564-S566 PolarHBondContact O-N 3.31Å; D564-S566 WeakPolarHBondContact OD1-CA 3.38Å; D564-S566 WeakPolarHBondContact OD1-CB 3.23Å; D564-S566 PolarHBondContact OD1-N 3.09Å; S566-T570 PolarHBondContact O-N 3.45Å; S566-T570 PolarHBondContact O-OG1 3.5Å; S566-K699 PolarHBondContact O-NZ 3.1Å; S566-K699 VanDerWaalsContact OG-CE 3.27Å; S566-K699 WeakPolarHBondContact OG-CE 3.44Å
567	L	91.3	Very high	92.3	Very high	45 Å²	45	33.4 Å²	33.4	24%	0.236	18%	0.176	C	C	.	.	H	α-helix	trans	-75.6	-40.2	178.2	-173.9	51.6	0	0	0	111.7	A559 D564 L569 T570 Y571	A559-L567 HydrophobicContact CB-CB 3.95Å; A559-L567 HydrophobicContact CB-CD2 3.65Å; A559-L567 HydrophobicContact CB-CG 3.62Å; D564-L567 HydrophobicContact CB-CB 4.13Å; D564-L567 PolarHBondContact O-N 3.18Å; D564-L567 VanDerWaalsContact O-N 3.09Å; D564-L567 PolarHBondContact OD1-N 3.22Å; D564-L567 WeakPolarHBondContact OD2-CB 3.34Å; L567-L569 PolarHBondContact O-N 3.06Å; L567-T570 WeakPolarHBondContact O-CA 3.41Å; L567-T570 VanDerWaalsContact O-CB 3.31Å; L567-T570 WeakPolarHBondContact O-CB 3.33Å; L567-T570 PolarHBondContact O-N 2.59Å; L567-Y571 HydrophobicContact CD1-CD2 4.16Å; L567-Y571 HydrophobicContact CD1-CE2 3.87Å; L567-Y571 HydrophobicContact CD2-CE2 4.3Å; L567-Y571 HydrophobicContact CG-CD2 4Å; L567-Y571 HydrophobicContact CG-CE2 3.73Å; L567-Y571 WeakPolarHBondContact O-CD2 3.42Å; L567-Y571 PolarHBondContact O-N 2.76Å
568	M	93.8	Very high	92.6	Very high	6 Å²	6	33.3 Å²	33.3	3%	0.03	18%	0.176	C	C	.	.	H	α-helix	trans	-55.2	-48.3	172.1	-71.7	174.9	62.2	0	0	112.5	F257 A559 F560 D564 T570 Y571 F572 I602	F257-M568 HydrophobicContact CZ-CE 3.96Å; F257-M568 HydrophobicContact CZ-SD 4.11Å; A559-M568 HydrophobicContact CB-CG 4.48Å; F560-M568 HydrophobicContact CD1-CE 3.74Å; F560-M568 HydrophobicContact CD1-CG 3.99Å; F560-M568 HydrophobicContact CD1-SD 4.21Å; F560-M568 HydrophobicContact CE1-CE 3.97Å; F560-M568 HydrophobicContact CE1-CG 4.16Å; F560-M568 HydrophobicContact CG-CG 4.19Å; D564-M568 WeakPolarHBondContact O-CB 3.34Å; D564-M568 VanDerWaalsContact O-CG 3.31Å; D564-M568 WeakPolarHBondContact O-CG 3.39Å; D564-M568 PolarHBondContact O-N 3.25Å; M568-T570 PolarHBondContact O-N 2.69Å; M568-Y571 WeakPolarHBondContact O-CB 3.41Å; M568-Y571 PolarHBondContact O-N 3.08Å; M568-Y571 VanDerWaalsContact O-N 3.13Å; M568-F572 HydrophobicContact CB-CE2 4.41Å; M568-F572 HydrophobicContact CE-CE2 4.3Å; M568-F572 HydrophobicContact CE-CZ 3.99Å; M568-F572 WeakPolarHBondContact O-CG 3.24Å; M568-F572 PolarHBondContact O-N 3.22Å; M568-I602 HydrophobicContact CE-CD1 3.78Å; M568-I602 HydrophobicContact CE-CG1 4.02Å
569	L	94.1	Very high	93	Very high	79 Å²	79	31.9 Å²	31.9	41%	0.414	17%	0.169	S	C	.	.	H	α-helix	trans	-62.9	-27.9	176.2	-75.4	169	0	0	0	112.5	H565 L567 F572 A573	H565-L569 VanDerWaalsContact O-CB 3.25Å; H565-L569 WeakPolarHBondContact O-CB 3.5Å; H565-L569 WeakPolarHBondContact O-CD1 3.44Å; H565-L569 WeakPolarHBondContact O-CG 3.47Å; H565-L569 PolarHBondContact O-N 2.81Å; L567-L569 PolarHBondContact O-N 3.06Å; L569-F572 HydrophobicContact CD2-CD2 4.31Å; L569-A573 WeakPolarHBondContact O-CB 3.35Å; L569-A573 PolarHBondContact O-N 2.95Å
570	T	95.4	Very high	93.5	Very high	7 Å²	7	36.7 Å²	36.7	4%	0.043	19%	0.191	C	C	.	.	H	α-helix	trans	-73.7	-39.2	175	-50.4	0	0	0	0	111.1	S566 L567 M568 A573 A574 L692 L695	S566-T570 PolarHBondContact O-N 3.45Å; S566-T570 PolarHBondContact O-OG1 3.5Å; L567-T570 WeakPolarHBondContact O-CA 3.41Å; L567-T570 VanDerWaalsContact O-CB 3.31Å; L567-T570 WeakPolarHBondContact O-CB 3.33Å; L567-T570 PolarHBondContact O-N 2.59Å; M568-T570 PolarHBondContact O-N 2.69Å; T570-A573 PolarHBondContact O-N 3.47Å; T570-A574 WeakPolarHBondContact O-CB 3.44Å; T570-A574 PolarHBondContact O-N 3.42Å; T570-L692 HydrophobicContact CG2-CD1 4.25Å; T570-L695 HydrophobicContact CG2-CB 3.81Å
571	Y	97.1	Very high	94	Very high	4 Å²	4	41.5 Å²	41.5	2%	0.016	21%	0.214	C	C	.	.	H	α-helix	trans	-62.2	-43.1	170.3	-83.2	-67.2	0	0	0	112.4	C556 A559 F560 L567 M568 A574 F575 E630 F634 W688 L692	C556-Y571 VanDerWaalsContact CA-OH 3.28Å; C556-Y571 WeakPolarHBondContact CA-OH 3.36Å; C556-Y571 HydrophobicContact CB-CE1 4.23Å; C556-Y571 HydrophobicContact CB-CE2 4.35Å; C556-Y571 PolarHBondContact N-OH 2.99Å; A559-Y571 HydrophobicContact CB-CD2 4.21Å; A559-Y571 HydrophobicContact CB-CE2 4.02Å; F560-Y571 HydrophobicContact CE2-CD2 4.34Å; F560-Y571 HydrophobicContact CE2-CG 4.5Å; L567-Y571 HydrophobicContact CD1-CD2 4.16Å; L567-Y571 HydrophobicContact CD1-CE2 3.87Å; L567-Y571 HydrophobicContact CD2-CE2 4.3Å; L567-Y571 HydrophobicContact CG-CD2 4Å; L567-Y571 HydrophobicContact CG-CE2 3.73Å; L567-Y571 WeakPolarHBondContact O-CD2 3.42Å; L567-Y571 PolarHBondContact O-N 2.76Å; M568-Y571 WeakPolarHBondContact O-CB 3.41Å; M568-Y571 PolarHBondContact O-N 3.08Å; M568-Y571 VanDerWaalsContact O-N 3.13Å; Y571-A574 PolarHBondContact O-N 2.69Å; Y571-F575 WeakPolarHBondContact O-CB 3.37Å; Y571-F575 PolarHBondContact O-N 2.69Å; Y571-E630 WeakPolarHBondContact CE1-OE1 3.27Å; Y571-E630 PolarHBondContact OH-OE2 3.24Å; Y571-F634 HydrophobicContact CD1-CE1 4.48Å; Y571-F634 AromaticContact CD1-CE2 3.75Å; Y571-F634 HydrophobicContact CD1-CE2 3.75Å; Y571-F634 AromaticContact CD1-CZ 3.53Å; Y571-F634 HydrophobicContact CD1-CZ 3.53Å; Y571-F634 HydrophobicContact CE1-CE2 4.09Å; Y571-F634 HydrophobicContact CE1-CZ 4.26Å; Y571-F634 HydrophobicContact CG-CZ 4.05Å; Y571-W688 HydrophobicContact CD1-CH2 4.4Å; Y571-W688 AromaticContact CD1-CZ2 3.77Å; Y571-W688 HydrophobicContact CD1-CZ2 3.77Å; Y571-W688 HydrophobicContact CE1-CZ2 4.05Å; Y571-L692 HydrophobicContact CD1-CD1 3.7Å; Y571-L692 HydrophobicContact CD1-CD2 4.24Å; Y571-L692 HydrophobicContact CE1-CD1 3.9Å; Y571-L692 HydrophobicContact CE1-CD2 3.57Å; Y571-L692 HydrophobicContact CE1-CG 4.41Å; Y571-L692 HydrophobicContact CG-CD1 4.2Å
572	F	97.3	Very high	94.6	Very high	15 Å²	15	42.1 Å²	42.1	7%	0.066	22%	0.217	C	C	.	.	H	α-helix	trans	-64.8	-43.6	175.7	-59.9	-25.8	0	0	0	112.1	F560 M568 L569 A574 F575 E576 P597 D598 L601 I602	F560-F572 AromaticContact CE1-CE1 3.73Å; F560-F572 HydrophobicContact CE1-CE1 3.73Å; F560-F572 AromaticContact CE1-CZ 3.9Å; F560-F572 HydrophobicContact CE1-CZ 3.9Å; F560-F572 AromaticContact CZ-CE1 3.9Å; F560-F572 HydrophobicContact CZ-CE1 3.9Å; F560-F572 HydrophobicContact CZ-CZ 4.45Å; M568-F572 HydrophobicContact CB-CE2 4.41Å; M568-F572 HydrophobicContact CE-CE2 4.3Å; M568-F572 HydrophobicContact CE-CZ 3.99Å; M568-F572 WeakPolarHBondContact O-CG 3.24Å; M568-F572 PolarHBondContact O-N 3.22Å; L569-F572 HydrophobicContact CD2-CD2 4.31Å; F572-A574 VanDerWaalsContact C-N 3.33Å; F572-A574 PolarHBondContact O-N 2.69Å; F572-F575 PolarHBondContact O-N 3.45Å; F572-E576 WeakPolarHBondContact O-CG 3.42Å; F572-E576 PolarHBondContact O-N 3.44Å; F572-P597 HydrophobicContact CB-CB 4.29Å; F572-P597 HydrophobicContact CB-CG 4.41Å; F572-P597 HydrophobicContact CD1-CB 4.04Å; F572-P597 HydrophobicContact CG-CB 4.12Å; F572-D598 HydrophobicContact CE2-CB 3.79Å; F572-D598 HydrophobicContact CZ-CB 4.16Å; F572-L601 HydrophobicContact CD1-CD2 4.07Å; F572-L601 HydrophobicContact CE1-CB 4.44Å; F572-L601 HydrophobicContact CE1-CD2 4.35Å; F572-I602 HydrophobicContact CE1-CG1 4.49Å; F572-I602 HydrophobicContact CZ-CD1 4.35Å; F572-I602 HydrophobicContact CZ-CG1 3.8Å
573	A	97.1	Very high	95.2	Very high	40 Å²	40	35.9 Å²	35.9	33%	0.331	19%	0.194	S	C	.	.	H	α-helix	trans	-62.8	-38	175	0	0	0	0	0	112.5	L569 T570 V577 L695	L569-A573 WeakPolarHBondContact O-CB 3.35Å; L569-A573 PolarHBondContact O-N 2.95Å; T570-A573 PolarHBondContact O-N 3.47Å; A573-V577 WeakPolarHBondContact O-CG2 3.45Å; A573-V577 PolarHBondContact O-N 3.21Å; A573-L695 HydrophobicContact CB-CD1 4.04Å
574	A	97.7	Very high	95.8	Very high	0 Å²	0	37.1 Å²	37.1	0%	0	20%	0.203	C	C	.	.	H	α-helix	trans	-64.8	-45.7	173.7	0	0	0	0	0	111.4	T570 Y571 F572 E576 V577 F578 W688 V691 L692 L695	T570-A574 WeakPolarHBondContact O-CB 3.44Å; T570-A574 PolarHBondContact O-N 3.42Å; Y571-A574 PolarHBondContact O-N 2.69Å; F572-A574 VanDerWaalsContact C-N 3.33Å; F572-A574 PolarHBondContact O-N 2.69Å; A574-E576 PolarHBondContact O-N 3.14Å; A574-V577 PolarHBondContact O-N 3.49Å; A574-F578 WeakPolarHBondContact O-CD2 3.29Å; A574-W688 HydrophobicContact CB-CH2 3.79Å; A574-W688 HydrophobicContact CB-CZ2 4.39Å; A574-W688 HydrophobicContact CB-CZ3 3.9Å; A574-V691 HydrophobicContact CB-CG1 4.41Å; A574-L692 HydrophobicContact CB-CB 4.44Å; A574-L692 HydrophobicContact CB-CD1 3.79Å; A574-L695 HydrophobicContact CB-CD1 3.92Å
575	F	98.4	Very high	96.3	Very high	0 Å²	0	41.9 Å²	41.9	0%	0	22%	0.22	C	C	.	.	H	α-helix	trans	-58.3	-45.6	174.9	168.5	-99.1	0	0	0	112.5	Y571 F572 V577 F578 F579 P597 L601 F634 A637 L638 L641	Y571-F575 WeakPolarHBondContact O-CB 3.37Å; Y571-F575 PolarHBondContact O-N 2.69Å; F572-F575 PolarHBondContact O-N 3.45Å; F575-V577 VanDerWaalsContact C-N 3.29Å; F575-V577 PolarHBondContact O-N 2.83Å; F575-F578 PolarHBondContact O-N 3.42Å; F575-F578 VanDerWaalsContact O-N 3.09Å; F575-F579 HydrophobicContact CE1-CB 4.31Å; F575-F579 AromaticContact CE1-CD1 3.75Å; F575-F579 HydrophobicContact CE1-CD1 3.75Å; F575-F579 HydrophobicContact CE1-CE1 4.49Å; F575-F579 HydrophobicContact CE1-CG 4.3Å; F575-F579 HydrophobicContact CZ-CB 4.43Å; F575-F579 HydrophobicContact CZ-CD1 4.12Å; F575-F579 HydrophobicContact CZ-CG 4.35Å; F575-F579 WeakPolarHBondContact O-CB 3.48Å; F575-F579 PolarHBondContact O-N 3.18Å; F575-P597 HydrophobicContact CD1-CB 4.27Å; F575-P597 HydrophobicContact CD1-CG 4.12Å; F575-P597 HydrophobicContact CE1-CB 4.4Å; F575-P597 HydrophobicContact CE1-CG 4.28Å; F575-L601 HydrophobicContact CB-CD2 4.16Å; F575-L601 HydrophobicContact CD1-CD2 3.64Å; F575-L601 HydrophobicContact CD2-CD2 3.96Å; F575-L601 HydrophobicContact CE1-CD2 3.95Å; F575-L601 HydrophobicContact CE2-CD1 4.48Å; F575-L601 HydrophobicContact CE2-CD2 4.24Å; F575-L601 HydrophobicContact CG-CD2 3.63Å; F575-L601 HydrophobicContact CZ-CD2 4.24Å; F575-F634 HydrophobicContact CB-CD1 3.96Å; F575-F634 HydrophobicContact CB-CE1 4.47Å; F575-F634 HydrophobicContact CD2-CB 4.32Å; F575-F634 HydrophobicContact CD2-CD1 4.01Å; F575-F634 HydrophobicContact CG-CD1 4.31Å; F575-A637 HydrophobicContact CE2-CB 3.73Å; F575-A637 HydrophobicContact CZ-CB 4.37Å; F575-L638 HydrophobicContact CD2-CD2 4.32Å; F575-L638 HydrophobicContact CD2-CG 4.4Å; F575-L638 HydrophobicContact CE2-CD2 3.54Å; F575-L638 HydrophobicContact CE2-CG 3.81Å; F575-L638 HydrophobicContact CZ-CD2 3.88Å; F575-L641 HydrophobicContact CZ-CD1 3.85Å
576	E	98.2	Very high	96.8	Very high	43 Å²	43	39 Å²	39	20%	0.201	21%	0.207	C	C	.	.	H	α-helix	trans	-61.2	-34.4	-179.6	-75.5	-163.7	157.1	0	0	113.2	F572 A574 F578 F579 E580 F587 K591 P597	F572-E576 WeakPolarHBondContact O-CG 3.42Å; F572-E576 PolarHBondContact O-N 3.44Å; A574-E576 PolarHBondContact O-N 3.14Å; E576-F578 PolarHBondContact O-N 2.94Å; E576-F579 PolarHBondContact O-N 3.42Å; E576-E580 WeakPolarHBondContact O-CB 3.46Å; E576-E580 PolarHBondContact O-N 2.85Å; E576-F587 HydrophobicContact CB-CE2 3.93Å; E576-F587 HydrophobicContact CB-CZ 4.47Å; E576-F587 HydrophobicContact CG-CE2 4.08Å; E576-K591 IonicContact OE1-NZ 3.88Å; E576-K591 PolarHBondContact OE1-NZ 2.93Å; E576-K591 IonicContact OE2-NZ 3.75Å; E576-K591 PolarHBondContact OE2-NZ 2.96Å; E576-P597 HydrophobicContact CG-CG 3.94Å; E576-P597 WeakPolarHBondContact OE1-CD 3.32Å
577	V	98.2	Very high	97.2	Very high	43 Å²	43	37.1 Å²	37.1	26%	0.261	19%	0.191	S	C	.	.	H	α-helix	trans	-60.5	-43.4	173.5	170	0	0	0	0	111.6	A573 A574 F575 E581 V691	A573-V577 WeakPolarHBondContact O-CG2 3.45Å; A573-V577 PolarHBondContact O-N 3.21Å; A574-V577 PolarHBondContact O-N 3.49Å; F575-V577 VanDerWaalsContact C-N 3.29Å; F575-V577 PolarHBondContact O-N 2.83Å; V577-E581 WeakPolarHBondContact O-CB 3.48Å; V577-E581 PolarHBondContact O-N 2.96Å; V577-V691 HydrophobicContact CB-CG1 4.39Å; V577-V691 HydrophobicContact CG1-CG1 4.32Å; V577-V691 HydrophobicContact CG2-CG1 4.47Å
578	F	98.5	Very high	97.6	Very high	0 Å²	0	37.8 Å²	37.8	0%	0	20%	0.203	C	C	.	.	H	α-helix	trans	-78	-25.5	177.3	-61.2	-74.3	0	0	0	112.5	A574 F575 E576 N582 L638 M681 W688 V691	A574-F578 WeakPolarHBondContact O-CD2 3.29Å; F575-F578 PolarHBondContact O-N 3.42Å; F575-F578 VanDerWaalsContact O-N 3.09Å; E576-F578 PolarHBondContact O-N 2.94Å; F578-N582 VanDerWaalsContact O-CB 3.3Å; F578-N582 WeakPolarHBondContact O-CB 3.31Å; F578-N582 PolarHBondContact O-N 3.22Å; F578-N582 PolarHBondContact O-ND2 3.35Å; F578-L638 HydrophobicContact CB-CD1 3.74Å; F578-M681 HydrophobicContact CD2-CE 4.31Å; F578-M681 HydrophobicContact CG-CE 4.32Å; F578-W688 AromaticContact CD2-CE3 3.58Å; F578-W688 HydrophobicContact CD2-CE3 3.58Å; F578-W688 AromaticContact CD2-CZ3 3.81Å; F578-W688 HydrophobicContact CD2-CZ3 3.81Å; F578-W688 HydrophobicContact CE2-CD2 4.37Å; F578-W688 AromaticContact CE2-CE3 3.42Å; F578-W688 HydrophobicContact CE2-CE3 3.42Å; F578-W688 VanDerWaalsContact CE2-CE3 3.42Å; F578-W688 AromaticContact CE2-CZ3 4Å; F578-W688 HydrophobicContact CE2-CZ3 4Å; F578-W688 HydrophobicContact CZ-CE3 4.42Å; F578-V691 HydrophobicContact CE2-CB 4.08Å; F578-V691 HydrophobicContact CE2-CG1 4.14Å; F578-V691 HydrophobicContact CE2-CG2 4.23Å; F578-V691 HydrophobicContact CZ-CB 4.01Å; F578-V691 HydrophobicContact CZ-CG1 4.43Å; F578-V691 HydrophobicContact CZ-CG2 3.7Å
579	F	98.6	Very high	97.8	Very high	3 Å²	3	39 Å²	39	1%	0.013	21%	0.209	C	C	.	.	H	α-helix	trans	-68.3	-46.5	173.8	-170.6	-170.4	0	0	0	111.4	F575 E576 N582 L583 L586 F587 F590 L638 L641	F575-F579 HydrophobicContact CE1-CB 4.31Å; F575-F579 AromaticContact CE1-CD1 3.75Å; F575-F579 HydrophobicContact CE1-CD1 3.75Å; F575-F579 HydrophobicContact CE1-CE1 4.49Å; F575-F579 HydrophobicContact CE1-CG 4.3Å; F575-F579 HydrophobicContact CZ-CB 4.43Å; F575-F579 HydrophobicContact CZ-CD1 4.12Å; F575-F579 HydrophobicContact CZ-CG 4.35Å; F575-F579 WeakPolarHBondContact O-CB 3.48Å; F575-F579 PolarHBondContact O-N 3.18Å; E576-F579 PolarHBondContact O-N 3.42Å; F579-N582 PolarHBondContact O-N 3.05Å; F579-L583 HydrophobicContact CD2-CB 3.92Å; F579-L583 HydrophobicContact CD2-CD1 4.03Å; F579-L583 HydrophobicContact CD2-CG 4.41Å; F579-L583 HydrophobicContact CE2-CB 3.91Å; F579-L583 HydrophobicContact CE2-CD1 3.95Å; F579-L583 CarbonylContact O-C 3.52Å; F579-L583 PolarHBondContact O-N 2.71Å; F579-L586 HydrophobicContact CE2-CB 4.17Å; F579-L586 HydrophobicContact CE2-CD2 4.05Å; F579-L586 HydrophobicContact CE2-CG 4.16Å; F579-L586 HydrophobicContact CZ-CD2 4.26Å; F579-L586 HydrophobicContact CZ-CG 4.17Å; F579-F587 HydrophobicContact CB-CD2 4.15Å; F579-F587 AromaticContact CD1-CD2 3.65Å; F579-F587 HydrophobicContact CD1-CD2 3.65Å; F579-F587 HydrophobicContact CD1-CE2 4.4Å; F579-F587 HydrophobicContact CD2-CB 4.21Å; F579-F587 HydrophobicContact CE1-CD2 4.09Å; F579-F587 HydrophobicContact CE2-CB 4.21Å; F579-F587 HydrophobicContact CG-CB 4.38Å; F579-F587 AromaticContact CG-CD2 3.87Å; F579-F587 HydrophobicContact CG-CD2 3.87Å; F579-F587 HydrophobicContact CZ-CB 4.4Å; F579-F590 HydrophobicContact CE1-CB 4.42Å; F579-F590 AromaticContact CE1-CD2 3.54Å; F579-F590 HydrophobicContact CE1-CD2 3.54Å; F579-F590 AromaticContact CE1-CE2 3.96Å; F579-F590 HydrophobicContact CE1-CE2 3.96Å; F579-F590 HydrophobicContact CE1-CG 4.09Å; F579-F590 HydrophobicContact CZ-CD1 4.38Å; F579-F590 AromaticContact CZ-CD2 3.66Å; F579-F590 HydrophobicContact CZ-CD2 3.66Å; F579-F590 AromaticContact CZ-CE2 3.85Å; F579-F590 HydrophobicContact CZ-CE2 3.85Å; F579-F590 AromaticContact CZ-CG 3.94Å; F579-F590 HydrophobicContact CZ-CG 3.94Å; F579-F590 HydrophobicContact CZ-CZ 4.31Å; F579-L638 HydrophobicContact CB-CD2 3.71Å; F579-L638 HydrophobicContact CD2-CD2 3.93Å; F579-L638 HydrophobicContact CG-CD2 3.96Å; F579-L641 HydrophobicContact CD1-CD1 4.49Å; F579-L641 HydrophobicContact CD2-CD1 4.39Å; F579-L641 HydrophobicContact CE1-CD1 4.11Å; F579-L641 HydrophobicContact CE2-CD1 4.01Å; F579-L641 HydrophobicContact CZ-CD1 3.86Å
580	E	98.3	Very high	98	Very high	103 Å²	103	35.4 Å²	35.4	48%	0.481	19%	0.189	S	C	.	.	H	α-helix	trans	-60.5	-45.5	174	-174	173.3	-132.5	0	0	111.8	E576 P584 F587	E576-E580 WeakPolarHBondContact O-CB 3.46Å; E576-E580 PolarHBondContact O-N 2.85Å; E580-P584 WeakPolarHBondContact O-CA 3.48Å; E580-P584 WeakPolarHBondContact O-CB 3.29Å; E580-P584 WeakPolarHBondContact O-CD 3.37Å; E580-F587 HydrophobicContact CB-CD1 3.67Å; E580-F587 HydrophobicContact CB-CD2 4.39Å; E580-F587 HydrophobicContact CB-CE1 3.69Å; E580-F587 HydrophobicContact CB-CE2 4.4Å; E580-F587 HydrophobicContact CB-CG 4.03Å; E580-F587 HydrophobicContact CB-CZ 4.06Å; E580-F587 HydrophobicContact CG-CD1 3.71Å; E580-F587 HydrophobicContact CG-CE1 3.75Å; E580-F587 HydrophobicContact CG-CG 4.49Å
581	E	97.3	Very high	98.1	Very high	101 Å²	101	39.3 Å²	39.3	47%	0.472	21%	0.206	S	C	.	.	H	α-helix	trans	-64.4	-39.7	179.7	-169.3	89.4	-124.3	0	0	112.5	V577 S683	V577-E581 WeakPolarHBondContact O-CB 3.48Å; V577-E581 PolarHBondContact O-N 2.96Å; E581-S683 VanDerWaalsContact OE2-CA 3.29Å; E581-S683 WeakPolarHBondContact OE2-CA 3.34Å; E581-S683 WeakPolarHBondContact OE2-CB 3.15Å; E581-S683 PolarHBondContact OE2-OG 2.88Å
582	N	98.2	Very high	98.2	Very high	20 Å²	20	47.2 Å²	47.2	11%	0.107	24%	0.24	C	C	.	.	H	α-helix	trans	-91.1	-33.4	-174.1	-76.6	-91.5	0	0	0	114.6	F578 F579 V679 H680	F578-N582 VanDerWaalsContact O-CB 3.3Å; F578-N582 WeakPolarHBondContact O-CB 3.31Å; F578-N582 PolarHBondContact O-N 3.22Å; F578-N582 PolarHBondContact O-ND2 3.35Å; F579-N582 PolarHBondContact O-N 3.05Å; N582-V679 WeakPolarHBondContact OD1-CA 3.36Å; N582-H680 PolarHBondContact ND2-O 3.33Å; N582-H680 PolarHBondContact OD1-N 3Å
583	L	98.2	Very high	98.2	Very high	2 Å²	2	48.2 Å²	48.2	1%	0.01	25%	0.246	C	C	.	.			trans	-137.7	51.4	-170.5	-52.1	172	0	0	0	112	F579 K585 L586 F587 L641 R642	F579-L583 HydrophobicContact CD2-CB 3.92Å; F579-L583 HydrophobicContact CD2-CD1 4.03Å; F579-L583 HydrophobicContact CD2-CG 4.41Å; F579-L583 HydrophobicContact CE2-CB 3.91Å; F579-L583 HydrophobicContact CE2-CD1 3.95Å; F579-L583 CarbonylContact O-C 3.52Å; F579-L583 PolarHBondContact O-N 2.71Å; L583-K585 VanDerWaalsContact C-N 3.26Å; L583-K585 PolarHBondContact O-N 3.22Å; L583-L586 HydrophobicContact CB-CB 4.2Å; L583-L586 HydrophobicContact CD1-CD2 4.31Å; L583-L586 PolarHBondContact O-N 3.34Å; L583-F587 PolarHBondContact O-N 3.15Å; L583-L641 HydrophobicContact CD1-CB 3.84Å; L583-R642 HydrophobicContact CD1-CB 4.23Å; L583-R642 HydrophobicContact CD2-CB 3.82Å; L583-R642 HydrophobicContact CD2-CG 3.71Å
584	P	98.1	Very high	98.2	Very high	76 Å²	76	52.4 Å²	52.4	49%	0.494	26%	0.263	S	S	.	.	H	α-helix	trans	-57.7	-32.9	-167.1	19.6	-32.2	0	0	0	114.5	E580 A588	E580-P584 WeakPolarHBondContact O-CA 3.48Å; E580-P584 WeakPolarHBondContact O-CB 3.29Å; E580-P584 WeakPolarHBondContact O-CD 3.37Å; P584-A588 WeakPolarHBondContact O-CB 3.3Å; P584-A588 PolarHBondContact O-N 2.98Å
585	K	98.3	Very high	98.2	Very high	170 Å²	170	52.7 Å²	52.7	74%	0.739	26%	0.264	S	S	*	.	H	α-helix	trans	-64.5	-45	175.2	-65.7	-175	-179.8	-178.3	0	112.2	L583 H589	L583-K585 VanDerWaalsContact C-N 3.26Å; L583-K585 PolarHBondContact O-N 3.22Å; K585-H589 PolarHBondContact O-N 2.96Å; K585-H589 VanDerWaalsContact O-N 3.09Å
586	L	98.6	Very high	98.2	Very high	0 Å²	0	55.3 Å²	55.3	0%	0	28%	0.281	C	S	.	.	H	α-helix	trans	-73	-39.1	-179.4	-170.3	67.7	0	0	0	110.9	F579 L583 A588 H589 F590 L641 Q645 L648	F579-L586 HydrophobicContact CE2-CB 4.17Å; F579-L586 HydrophobicContact CE2-CD2 4.05Å; F579-L586 HydrophobicContact CE2-CG 4.16Å; F579-L586 HydrophobicContact CZ-CD2 4.26Å; F579-L586 HydrophobicContact CZ-CG 4.17Å; L583-L586 HydrophobicContact CB-CB 4.2Å; L583-L586 HydrophobicContact CD1-CD2 4.31Å; L583-L586 PolarHBondContact O-N 3.34Å; L586-A588 PolarHBondContact O-N 3.11Å; L586-H589 WeakPolarHBondContact O-CB 3.46Å; L586-H589 PolarHBondContact O-N 2.95Å; L586-F590 HydrophobicContact CD1-CD1 4.08Å; L586-F590 HydrophobicContact CD1-CE1 3.64Å; L586-F590 HydrophobicContact CD2-CE1 4.21Å; L586-F590 HydrophobicContact CD2-CZ 4.41Å; L586-F590 HydrophobicContact CG-CD1 4.01Å; L586-F590 HydrophobicContact CG-CE1 3.7Å; L586-F590 HydrophobicContact CG-CZ 4.34Å; L586-F590 VanDerWaalsContact O-CD1 3.27Å; L586-F590 WeakPolarHBondContact O-CD1 3.13Å; L586-F590 PolarHBondContact O-N 2.97Å; L586-L641 HydrophobicContact CD2-CB 4.04Å; L586-L641 WeakPolarHBondContact CD2-O 3.48Å; L586-Q645 HydrophobicContact CB-CG 4.18Å; L586-Q645 HydrophobicContact CD1-CG 4.41Å; L586-Q645 HydrophobicContact CD2-CB 4.5Å; L586-Q645 HydrophobicContact CD2-CG 4.18Å; L586-Q645 HydrophobicContact CG-CG 4.5Å; L586-L648 HydrophobicContact CD1-CB 3.75Å; L586-L648 HydrophobicContact CD2-CD1 4.25Å
587	F	98.7	Very high	98.1	Very high	23 Å²	23	53.5 Å²	53.5	10%	0.101	27%	0.273	C	S	.	.	H	α-helix	trans	-57.3	-48.2	172	-179.7	-107.1	0	0	0	111.6	E576 F579 E580 L583 H589 F590 K591	E576-F587 HydrophobicContact CB-CE2 3.93Å; E576-F587 HydrophobicContact CB-CZ 4.47Å; E576-F587 HydrophobicContact CG-CE2 4.08Å; F579-F587 HydrophobicContact CB-CD2 4.15Å; F579-F587 AromaticContact CD1-CD2 3.65Å; F579-F587 HydrophobicContact CD1-CD2 3.65Å; F579-F587 HydrophobicContact CD1-CE2 4.4Å; F579-F587 HydrophobicContact CD2-CB 4.21Å; F579-F587 HydrophobicContact CE1-CD2 4.09Å; F579-F587 HydrophobicContact CE2-CB 4.21Å; F579-F587 HydrophobicContact CG-CB 4.38Å; F579-F587 AromaticContact CG-CD2 3.87Å; F579-F587 HydrophobicContact CG-CD2 3.87Å; F579-F587 HydrophobicContact CZ-CB 4.4Å; E580-F587 HydrophobicContact CB-CD1 3.67Å; E580-F587 HydrophobicContact CB-CD2 4.39Å; E580-F587 HydrophobicContact CB-CE1 3.69Å; E580-F587 HydrophobicContact CB-CE2 4.4Å; E580-F587 HydrophobicContact CB-CG 4.03Å; E580-F587 HydrophobicContact CB-CZ 4.06Å; E580-F587 HydrophobicContact CG-CD1 3.71Å; E580-F587 HydrophobicContact CG-CE1 3.75Å; E580-F587 HydrophobicContact CG-CG 4.49Å; L583-F587 PolarHBondContact O-N 3.15Å; F587-H589 VanDerWaalsContact C-N 3.32Å; F587-H589 PolarHBondContact O-N 3.35Å; F587-F590 PolarHBondContact O-N 3.43Å; F587-K591 HydrophobicContact CD1-CG 4.49Å; F587-K591 HydrophobicContact CE1-CG 4.23Å; F587-K591 HydrophobicContact CE2-CG 4.42Å; F587-K591 HydrophobicContact CZ-CD 4.42Å; F587-K591 HydrophobicContact CZ-CG 4.21Å; F587-K591 WeakPolarHBondContact O-CG 3.3Å; F587-K591 PolarHBondContact O-N 2.93Å
588	A	98.6	Very high	98	Very high	58 Å²	58	53.3 Å²	53.3	48%	0.479	27%	0.27	S	S	.	.	H	α-helix	trans	-61.5	-37.9	175.6	0	0	0	0	0	112.7	P584 L586 K592	P584-A588 WeakPolarHBondContact O-CB 3.3Å; P584-A588 PolarHBondContact O-N 2.98Å; L586-A588 PolarHBondContact O-N 3.11Å; A588-K592 VanDerWaalsContact O-CB 3.32Å; A588-K592 WeakPolarHBondContact O-CB 3.31Å; A588-K592 PolarHBondContact O-N 3.16Å
589	H	98.6	Very high	97.8	Very high	33 Å²	33	55.8 Å²	55.8	15%	0.153	28%	0.283	C	S	.	.	H	α-helix	trans	-65.9	-42.9	174.1	-174.7	69.6	0	0	0	112.3	K585 L586 F587 K592 N593 L648 T649 M651	K585-H589 PolarHBondContact O-N 2.96Å; K585-H589 VanDerWaalsContact O-N 3.09Å; L586-H589 WeakPolarHBondContact O-CB 3.46Å; L586-H589 PolarHBondContact O-N 2.95Å; F587-H589 VanDerWaalsContact C-N 3.32Å; F587-H589 PolarHBondContact O-N 3.35Å; H589-K592 PolarHBondContact O-N 3.21Å; H589-N593 PolarHBondContact CE1-ND2 2.95Å; H589-N593 VanDerWaalsContact CE1-ND2 3.27Å; H589-N593 PolarHBondContact ND1-ND2 2.72Å; H589-N593 PolarHBondContact O-N 3.22Å; H589-N593 PolarHBondContact O-ND2 3.38Å; H589-L648 PolarHBondContact CD2-O 3.48Å; H589-L648 PolarHBondContact NE2-O 3.35Å; H589-L648 VanDerWaalsContact NE2-O 3.16Å; H589-T649 PolarHBondContact CE1-O 3.14Å; H589-T649 PolarHBondContact NE2-O 2.92Å; H589-M651 PolarHBondContact CE1-O 3.46Å; H589-M651 PolarHBondContact NE2-O 2.75Å
590	F	98.6	Very high	97.7	Very high	3 Å²	3	55.9 Å²	55.9	1%	0.013	28%	0.283	C	S	.	.	H	α-helix	trans	-62.4	-46.5	176	-83.7	35.9	0	0	0	110.9	F579 L586 F587 K592 N593 N594 L595 Y600 L641 L648 M656 L660	F579-F590 HydrophobicContact CE1-CB 4.42Å; F579-F590 AromaticContact CE1-CD2 3.54Å; F579-F590 HydrophobicContact CE1-CD2 3.54Å; F579-F590 AromaticContact CE1-CE2 3.96Å; F579-F590 HydrophobicContact CE1-CE2 3.96Å; F579-F590 HydrophobicContact CE1-CG 4.09Å; F579-F590 HydrophobicContact CZ-CD1 4.38Å; F579-F590 AromaticContact CZ-CD2 3.66Å; F579-F590 HydrophobicContact CZ-CD2 3.66Å; F579-F590 AromaticContact CZ-CE2 3.85Å; F579-F590 HydrophobicContact CZ-CE2 3.85Å; F579-F590 AromaticContact CZ-CG 3.94Å; F579-F590 HydrophobicContact CZ-CG 3.94Å; F579-F590 HydrophobicContact CZ-CZ 4.31Å; L586-F590 HydrophobicContact CD1-CD1 4.08Å; L586-F590 HydrophobicContact CD1-CE1 3.64Å; L586-F590 HydrophobicContact CD2-CE1 4.21Å; L586-F590 HydrophobicContact CD2-CZ 4.41Å; L586-F590 HydrophobicContact CG-CD1 4.01Å; L586-F590 HydrophobicContact CG-CE1 3.7Å; L586-F590 HydrophobicContact CG-CZ 4.34Å; L586-F590 VanDerWaalsContact O-CD1 3.27Å; L586-F590 WeakPolarHBondContact O-CD1 3.13Å; L586-F590 PolarHBondContact O-N 2.97Å; F587-F590 PolarHBondContact O-N 3.43Å; F590-K592 PolarHBondContact O-N 3.24Å; F590-N593 CarbonylContact O-C 3.59Å; F590-N593 PolarHBondContact O-N 2.94Å; F590-N594 PolarHBondContact O-N 3.07Å; F590-L595 HydrophobicContact CB-CB 4.38Å; F590-L595 HydrophobicContact CD1-CD2 4.09Å; F590-L595 HydrophobicContact CD2-CB 4.39Å; F590-L595 HydrophobicContact CD2-CD2 3.74Å; F590-L595 HydrophobicContact CD2-CG 4.19Å; F590-L595 HydrophobicContact CE1-CD2 3.98Å; F590-L595 HydrophobicContact CE2-CD2 3.65Å; F590-L595 HydrophobicContact CE2-CG 4.42Å; F590-L595 HydrophobicContact CG-CB 4.35Å; F590-L595 HydrophobicContact CG-CD2 3.97Å; F590-L595 HydrophobicContact CZ-CD2 3.78Å; F590-L595 PolarHBondContact O-N 3.43Å; F590-Y600 HydrophobicContact CD2-CE1 4.4Å; F590-Y600 AromaticContact CE2-CE1 3.99Å; F590-Y600 HydrophobicContact CE2-CE1 3.99Å; F590-Y600 AromaticContact CE2-CZ 3.98Å; F590-L641 HydrophobicContact CE2-CD1 4.49Å; F590-L641 HydrophobicContact CE2-CD2 3.97Å; F590-L641 HydrophobicContact CZ-CD2 3.72Å; F590-L648 HydrophobicContact CE1-CB 4.38Å; F590-L648 HydrophobicContact CZ-CD1 4.35Å; F590-M656 HydrophobicContact CD1-SD 3.74Å; F590-M656 HydrophobicContact CE1-SD 3.46Å; F590-M656 WeakPolarHBondContact CE1-SD 3.06Å; F590-M656 HydrophobicContact CZ-SD 4.31Å; F590-L660 HydrophobicContact CE2-CD1 3.96Å; F590-L660 HydrophobicContact CZ-CD1 3.79Å
591	K	98.3	Very high	97.7	Very high	89 Å²	89	51 Å²	51	39%	0.387	26%	0.26	S	S	.	.	H	α-helix	trans	-60.5	-44	174.7	-67.5	-58.1	-169.4	-175.1	0	112.1	E576 F587 N593 N594	E576-K591 IonicContact OE1-NZ 3.88Å; E576-K591 PolarHBondContact OE1-NZ 2.93Å; E576-K591 IonicContact OE2-NZ 3.75Å; E576-K591 PolarHBondContact OE2-NZ 2.96Å; F587-K591 HydrophobicContact CD1-CG 4.49Å; F587-K591 HydrophobicContact CE1-CG 4.23Å; F587-K591 HydrophobicContact CE2-CG 4.42Å; F587-K591 HydrophobicContact CZ-CD 4.42Å; F587-K591 HydrophobicContact CZ-CG 4.21Å; F587-K591 WeakPolarHBondContact O-CG 3.3Å; F587-K591 PolarHBondContact O-N 2.93Å; K591-N593 VanDerWaalsContact C-N 3.28Å; K591-N593 PolarHBondContact O-N 3.48Å; K591-N594 PolarHBondContact O-N 3.33Å; K591-N594 VanDerWaalsContact O-N 3.15Å
592	K	98.3	Very high	97.5	Very high	170 Å²	170	47.4 Å²	47.4	74%	0.739	24%	0.244	S	C	*	.	H	α-helix	trans	-58.8	-37.9	175.7	-177.9	-171.2	173.7	-167.2	0	112.5	A588 H589 F590	A588-K592 VanDerWaalsContact O-CB 3.32Å; A588-K592 WeakPolarHBondContact O-CB 3.31Å; A588-K592 PolarHBondContact O-N 3.16Å; H589-K592 PolarHBondContact O-N 3.21Å; F590-K592 PolarHBondContact O-N 3.24Å
593	N	98.1	Very high	97.2	Very high	36 Å²	36	48.8 Å²	48.8	19%	0.193	25%	0.252	C	S	.	.	T	Hydrogen-bonded Turn	trans	-89	1.3	179.7	-72.9	-83.6	0	0	0	113.7	H589 F590 K591 L595 F653 M656	H589-N593 PolarHBondContact CE1-ND2 2.95Å; H589-N593 VanDerWaalsContact CE1-ND2 3.27Å; H589-N593 PolarHBondContact ND1-ND2 2.72Å; H589-N593 PolarHBondContact O-N 3.22Å; H589-N593 PolarHBondContact O-ND2 3.38Å; F590-N593 CarbonylContact O-C 3.59Å; F590-N593 PolarHBondContact O-N 2.94Å; K591-N593 VanDerWaalsContact C-N 3.28Å; K591-N593 PolarHBondContact O-N 3.48Å; N593-L595 PolarHBondContact O-N 3.45Å; N593-F653 HydrophobicContact CB-CB 4.29Å; N593-F653 VanDerWaalsContact O-CD2 3.28Å; N593-F653 WeakPolarHBondContact O-CD2 3.28Å; N593-M656 HydrophobicContact CB-CE 3.68Å
594	N	97.3	Very high	97.1	Very high	128 Å²	128	48.8 Å²	48.8	68%	0.684	25%	0.252	S	S	*	.	T	Hydrogen-bonded Turn	trans	56.6	29.7	-173	-53.2	-79.9	0	0	0	114.3	F590 K591 T596	F590-N594 PolarHBondContact O-N 3.07Å; K591-N594 PolarHBondContact O-N 3.33Å; K591-N594 VanDerWaalsContact O-N 3.15Å; N594-T596 PolarHBondContact O-N 3.34Å
595	L	98	Very high	97	Very high	5 Å²	5	45.2 Å²	45.2	3%	0.026	23%	0.228	C	C	.	.			trans	-84	100.4	177.4	-173	71.8	0	0	0	110.2	F590 N593 I599 F653 M656 A657 L660	F590-L595 HydrophobicContact CB-CB 4.38Å; F590-L595 HydrophobicContact CD1-CD2 4.09Å; F590-L595 HydrophobicContact CD2-CB 4.39Å; F590-L595 HydrophobicContact CD2-CD2 3.74Å; F590-L595 HydrophobicContact CD2-CG 4.19Å; F590-L595 HydrophobicContact CE1-CD2 3.98Å; F590-L595 HydrophobicContact CE2-CD2 3.65Å; F590-L595 HydrophobicContact CE2-CG 4.42Å; F590-L595 HydrophobicContact CG-CB 4.35Å; F590-L595 HydrophobicContact CG-CD2 3.97Å; F590-L595 HydrophobicContact CZ-CD2 3.78Å; F590-L595 PolarHBondContact O-N 3.43Å; N593-L595 PolarHBondContact O-N 3.45Å; L595-I599 HydrophobicContact CD1-CD1 3.97Å; L595-I599 HydrophobicContact CD1-CG2 4.25Å; L595-F653 HydrophobicContact CB-CD2 4.19Å; L595-F653 HydrophobicContact CD1-CD2 3.98Å; L595-F653 HydrophobicContact CD1-CE2 3.99Å; L595-M656 HydrophobicContact CD2-CB 3.47Å; L595-M656 VanDerWaalsContact CD2-CB 3.47Å; L595-M656 HydrophobicContact CD2-CE 4.02Å; L595-M656 HydrophobicContact CD2-CG 4.21Å; L595-M656 HydrophobicContact CD2-SD 3.75Å; L595-A657 HydrophobicContact CD1-CB 3.99Å; L595-L660 HydrophobicContact CD2-CD1 4Å
596	T	97.1	Very high	96.7	Very high	55 Å²	55	37.5 Å²	37.5	34%	0.337	20%	0.195	S	C	.	.			trans	-93.3	155	-174.6	50.1	0	0	0	0	112.8	N594 D598 I599	N594-T596 PolarHBondContact O-N 3.34Å; T596-D598 VanDerWaalsContact C-N 3.28Å; T596-D598 WeakPolarHBondContact CB-OD1 3.32Å; T596-D598 PolarHBondContact O-N 2.94Å; T596-D598 PolarHBondContact OG1-OD1 3.16Å; T596-I599 PolarHBondContact O-N 3.38Å
597	P	97.3	Very high	96.5	Very high	6 Å²	6	37.5 Å²	37.5	4%	0.039	20%	0.195	C	C	.	.	G	3₁₀ helix	trans	-60.5	-29.4	-174.4	-26.4	35.8	0	0	0	115.2	F572 F575 E576 I599 Y600 L601	F572-P597 HydrophobicContact CB-CB 4.29Å; F572-P597 HydrophobicContact CB-CG 4.41Å; F572-P597 HydrophobicContact CD1-CB 4.04Å; F572-P597 HydrophobicContact CG-CB 4.12Å; F575-P597 HydrophobicContact CD1-CB 4.27Å; F575-P597 HydrophobicContact CD1-CG 4.12Å; F575-P597 HydrophobicContact CE1-CB 4.4Å; F575-P597 HydrophobicContact CE1-CG 4.28Å; E576-P597 HydrophobicContact CG-CG 3.94Å; E576-P597 WeakPolarHBondContact OE1-CD 3.32Å; P597-I599 PolarHBondContact O-N 2.64Å; P597-I599 VanDerWaalsContact O-N 3.14Å; P597-Y600 PolarHBondContact O-N 3Å; P597-L601 HydrophobicContact CB-CB 4.23Å; P597-L601 HydrophobicContact CB-CD2 4.01Å; P597-L601 WeakPolarHBondContact O-CA 3.37Å; P597-L601 WeakPolarHBondContact O-CB 3.49Å; P597-L601 PolarHBondContact O-N 3Å
598	D	94.4	Very high	96.4	Very high	38 Å²	38	36.4 Å²	36.4	20%	0.203	19%	0.19	C	C	.	.	G	3₁₀ helix	trans	-59.7	-24.5	-179.9	57.4	-67.4	0	0	0	113.8	F572 T596 Y600 I602	F572-D598 HydrophobicContact CE2-CB 3.79Å; F572-D598 HydrophobicContact CZ-CB 4.16Å; T596-D598 VanDerWaalsContact C-N 3.28Å; T596-D598 WeakPolarHBondContact CB-OD1 3.32Å; T596-D598 PolarHBondContact O-N 2.94Å; T596-D598 PolarHBondContact OG1-OD1 3.16Å; D598-Y600 VanDerWaalsContact C-N 3.35Å; D598-Y600 PolarHBondContact O-N 3.39Å; D598-I602 HydrophobicContact CB-CD1 4.16Å; D598-I602 WeakPolarHBondContact O-CD1 3.36Å; D598-I602 WeakPolarHBondContact O-CG1 3.24Å
599	I	95.8	Very high	96.4	Very high	52 Å²	52	33.7 Å²	33.7	27%	0.267	17%	0.167	S	C	.	.	G	3₁₀ helix	trans	-69	-30.6	-178.7	-65	170.1	0	0	0	112.4	L595 T596 P597 F653 A657 T661	L595-I599 HydrophobicContact CD1-CD1 3.97Å; L595-I599 HydrophobicContact CD1-CG2 4.25Å; T596-I599 PolarHBondContact O-N 3.38Å; P597-I599 PolarHBondContact O-N 2.64Å; P597-I599 VanDerWaalsContact O-N 3.14Å; I599-F653 HydrophobicContact CD1-CE2 3.69Å; I599-F653 HydrophobicContact CD1-CZ 3.95Å; I599-A657 HydrophobicContact CG2-CB 3.89Å; I599-T661 WeakPolarHBondContact O-CG2 3.42Å
600	Y	96.6	Very high	96.3	Very high	5 Å²	5	32.1 Å²	32.1	2%	0.02	16%	0.16	C	C	.	.	T	Hydrogen-bonded Turn	trans	-130.4	-36.2	-174.4	60.1	-87.9	0	0	0	114.1	F590 P597 D598 I602 W604 L641 L660	F590-Y600 HydrophobicContact CD2-CE1 4.4Å; F590-Y600 AromaticContact CE2-CE1 3.99Å; F590-Y600 HydrophobicContact CE2-CE1 3.99Å; F590-Y600 AromaticContact CE2-CZ 3.98Å; P597-Y600 PolarHBondContact O-N 3Å; D598-Y600 VanDerWaalsContact C-N 3.35Å; D598-Y600 PolarHBondContact O-N 3.39Å; Y600-I602 VanDerWaalsContact C-N 3.3Å; Y600-I602 PolarHBondContact O-N 3.11Å; Y600-W604 HydrophobicContact CD2-CD2 4.36Å; Y600-W604 HydrophobicContact CD2-CE3 4.14Å; Y600-W604 AromaticContact CD2-CH2 3.8Å; Y600-W604 HydrophobicContact CD2-CH2 3.8Å; Y600-W604 HydrophobicContact CD2-CZ2 4Å; Y600-W604 AromaticContact CD2-CZ3 3.85Å; Y600-W604 HydrophobicContact CD2-CZ3 3.85Å; Y600-W604 HydrophobicContact CE2-CH2 4.31Å; Y600-W604 HydrophobicContact CE2-CZ3 4.13Å; Y600-W604 VanDerWaalsContact O-CD1 3.25Å; Y600-L641 HydrophobicContact CE2-CD1 4.3Å; Y600-L660 HydrophobicContact CD1-CB 4.49Å; Y600-L660 HydrophobicContact CD1-CD1 3.87Å; Y600-L660 HydrophobicContact CD2-CD1 4.45Å; Y600-L660 HydrophobicContact CE1-CD1 4.2Å; Y600-L660 HydrophobicContact CG-CB 4.01Å; Y600-L660 HydrophobicContact CG-CD1 4.02Å
601	L	96.7	Very high	96.2	Very high	0 Å²	0	35.8 Å²	35.8	0%	0	18%	0.176	C	C	.	.	H	α-helix	trans	-74.5	-19.4	-170.2	-166.8	60.1	0	0	0	113	F572 F575 P597 W604 I605 F634 A637	F572-L601 HydrophobicContact CD1-CD2 4.07Å; F572-L601 HydrophobicContact CE1-CB 4.44Å; F572-L601 HydrophobicContact CE1-CD2 4.35Å; F575-L601 HydrophobicContact CB-CD2 4.16Å; F575-L601 HydrophobicContact CD1-CD2 3.64Å; F575-L601 HydrophobicContact CD2-CD2 3.96Å; F575-L601 HydrophobicContact CE1-CD2 3.95Å; F575-L601 HydrophobicContact CE2-CD1 4.48Å; F575-L601 HydrophobicContact CE2-CD2 4.24Å; F575-L601 HydrophobicContact CG-CD2 3.63Å; F575-L601 HydrophobicContact CZ-CD2 4.24Å; P597-L601 HydrophobicContact CB-CB 4.23Å; P597-L601 HydrophobicContact CB-CD2 4.01Å; P597-L601 WeakPolarHBondContact O-CA 3.37Å; P597-L601 WeakPolarHBondContact O-CB 3.49Å; P597-L601 PolarHBondContact O-N 3Å; L601-W604 HydrophobicContact CD1-CB 4.46Å; L601-W604 HydrophobicContact CD1-CE3 3.97Å; L601-I605 HydrophobicContact CD1-CD1 3.96Å; L601-I605 HydrophobicContact CD1-CG1 3.72Å; L601-I605 HydrophobicContact CG-CD1 4.49Å; L601-I605 HydrophobicContact CG-CG1 3.78Å; L601-I605 VanDerWaalsContact O-CG1 3.29Å; L601-I605 WeakPolarHBondContact O-CG1 3.44Å; L601-I605 PolarHBondContact O-N 3.14Å; L601-I605 VanDerWaalsContact O-N 3.07Å; L601-F634 HydrophobicContact CD2-CD1 4.2Å; L601-F634 HydrophobicContact CD2-CE1 4.14Å; L601-A637 HydrophobicContact CD1-CB 3.51Å
602	I	93.8	Very high	96	Very high	27 Å²	27	32.7 Å²	32.7	14%	0.138	17%	0.165	C	C	.	.	H	α-helix	trans	-58.6	-64.1	176.9	-67.7	178	0	0	0	109.9	F560 M568 F572 D598 Y600 W604 I605 F606	F560-I602 HydrophobicContact CD1-CG1 4.38Å; F560-I602 HydrophobicContact CD1-CG2 4.32Å; F560-I602 HydrophobicContact CE1-CG1 4.21Å; M568-I602 HydrophobicContact CE-CD1 3.78Å; M568-I602 HydrophobicContact CE-CG1 4.02Å; F572-I602 HydrophobicContact CE1-CG1 4.49Å; F572-I602 HydrophobicContact CZ-CD1 4.35Å; F572-I602 HydrophobicContact CZ-CG1 3.8Å; D598-I602 HydrophobicContact CB-CD1 4.16Å; D598-I602 WeakPolarHBondContact O-CD1 3.36Å; D598-I602 WeakPolarHBondContact O-CG1 3.24Å; Y600-I602 VanDerWaalsContact C-N 3.3Å; Y600-I602 PolarHBondContact O-N 3.11Å; I602-W604 PolarHBondContact O-N 2.9Å; I602-I605 PolarHBondContact O-N 3.14Å; I602-F606 WeakPolarHBondContact O-CB 3.42Å; I602-F606 PolarHBondContact O-N 2.82Å
603	D	91.6	Very high	95.9	Very high	49 Å²	49	25 Å²	25	26%	0.262	13%	0.133	S	C	.	.	H	α-helix	trans	-56.7	-39.6	-177	-93.6	-28.6	0	0	0	112.6	T607 K611	D603-T607 WeakPolarHBondContact O-CB 3.4Å; D603-T607 PolarHBondContact O-N 3.03Å; D603-T607 PolarHBondContact O-OG1 2.95Å; D603-K611 WeakPolarHBondContact OD1-CD 3.15Å; D603-K611 IonicContact OD1-NZ 3.69Å; D603-K611 PolarHBondContact OD1-NZ 3.27Å; D603-K611 IonicContact OD2-NZ 2.71Å; D603-K611 PolarHBondContact OD2-NZ 3.41Å
604	W	97.3	Very high	95.7	Very high	2 Å²	2	25.7 Å²	25.7	1%	0.008	14%	0.139	C	C	.	.	H	α-helix	trans	-60.8	-49.3	179.4	-66.9	13.2	0	0	0	112.1	Y600 L601 I602 L608 Y609 A637 V640 L641 L660 L663	Y600-W604 HydrophobicContact CD2-CD2 4.36Å; Y600-W604 HydrophobicContact CD2-CE3 4.14Å; Y600-W604 AromaticContact CD2-CH2 3.8Å; Y600-W604 HydrophobicContact CD2-CH2 3.8Å; Y600-W604 HydrophobicContact CD2-CZ2 4Å; Y600-W604 AromaticContact CD2-CZ3 3.85Å; Y600-W604 HydrophobicContact CD2-CZ3 3.85Å; Y600-W604 HydrophobicContact CE2-CH2 4.31Å; Y600-W604 HydrophobicContact CE2-CZ3 4.13Å; Y600-W604 VanDerWaalsContact O-CD1 3.25Å; L601-W604 HydrophobicContact CD1-CB 4.46Å; L601-W604 HydrophobicContact CD1-CE3 3.97Å; I602-W604 PolarHBondContact O-N 2.9Å; W604-L608 CarbonylContact O-C 3.57Å; W604-L608 WeakPolarHBondContact O-CA 3.4Å; W604-L608 PolarHBondContact O-N 2.94Å; W604-Y609 HydrophobicContact CB-CD1 4.05Å; W604-Y609 HydrophobicContact CB-CE1 3.56Å; W604-Y609 AromaticContact CD2-CE1 3.88Å; W604-Y609 HydrophobicContact CD2-CE1 3.88Å; W604-Y609 AromaticContact CE3-CE1 3.89Å; W604-Y609 HydrophobicContact CE3-CE1 3.89Å; W604-Y609 HydrophobicContact CG-CD1 4.23Å; W604-Y609 AromaticContact CG-CE1 3.76Å; W604-Y609 HydrophobicContact CG-CE1 3.76Å; W604-Y609 WeakPolarHBondContact O-CD2 3.26Å; W604-Y609 PolarHBondContact O-N 3.09Å; W604-A637 HydrophobicContact CE3-CB 3.69Å; W604-A637 HydrophobicContact CZ3-CB 3.78Å; W604-V640 HydrophobicContact CH2-CB 4.14Å; W604-V640 HydrophobicContact CH2-CG1 3.71Å; W604-V640 HydrophobicContact CZ2-CG1 4.21Å; W604-V640 HydrophobicContact CZ3-CB 4.23Å; W604-V640 HydrophobicContact CZ3-CG1 4.29Å; W604-L641 HydrophobicContact CH2-CD2 4.38Å; W604-L660 HydrophobicContact CH2-CD2 3.92Å; W604-L660 HydrophobicContact CZ2-CB 4.19Å; W604-L660 HydrophobicContact CZ2-CD2 4.01Å; W604-L660 PolarHBondContact NE1-O 3.33Å; W604-L660 VanDerWaalsContact NE1-O 3.15Å; W604-L663 HydrophobicContact CZ2-CD1 3.95Å; W604-L663 HydrophobicContact CZ2-CD2 4.02Å; W604-L663 HydrophobicContact CZ2-CG 4.2Å
605	I	95.8	Very high	95.6	Very high	0 Å²	0	21 Å²	21	0%	0	11%	0.114	C	C	.	.	H	α-helix	trans	-80.7	-43.7	-177.7	-58.1	-61.9	0	0	0	111.4	C556 F560 L601 I602 L608 L633 F634	C556-I605 VanDerWaalsContact SG-CG2 3.52Å; F560-I605 HydrophobicContact CD2-CG2 4.12Å; F560-I605 HydrophobicContact CE2-CB 4.29Å; F560-I605 HydrophobicContact CE2-CG2 3.64Å; F560-I605 HydrophobicContact CZ-CB 4.22Å; F560-I605 HydrophobicContact CZ-CG2 4.04Å; L601-I605 HydrophobicContact CD1-CD1 3.96Å; L601-I605 HydrophobicContact CD1-CG1 3.72Å; L601-I605 HydrophobicContact CG-CD1 4.49Å; L601-I605 HydrophobicContact CG-CG1 3.78Å; L601-I605 VanDerWaalsContact O-CG1 3.29Å; L601-I605 WeakPolarHBondContact O-CG1 3.44Å; L601-I605 PolarHBondContact O-N 3.14Å; L601-I605 VanDerWaalsContact O-N 3.07Å; I602-I605 PolarHBondContact O-N 3.14Å; I605-L608 PolarHBondContact O-N 3.07Å; I605-L633 HydrophobicContact CD1-CB 3.54Å; I605-L633 HydrophobicContact CG2-CD1 4.35Å; I605-F634 HydrophobicContact CD1-CD1 3.79Å; I605-F634 HydrophobicContact CD1-CD2 4.32Å; I605-F634 HydrophobicContact CD1-CE1 3.74Å; I605-F634 HydrophobicContact CD1-CE2 4.25Å; I605-F634 HydrophobicContact CD1-CG 4.1Å; I605-F634 HydrophobicContact CD1-CZ 3.98Å; I605-F634 HydrophobicContact CG1-CD1 4.25Å; I605-F634 HydrophobicContact CG1-CE1 3.76Å; I605-F634 HydrophobicContact CG1-CZ 4.01Å; I605-F634 HydrophobicContact CG2-CE2 4.38Å; I605-F634 HydrophobicContact CG2-CZ 3.92Å
606	F	90.6	Very high	95.4	Very high	9 Å²	9	25.6 Å²	25.6	4%	0.039	14%	0.138	C	C	.	.	H	α-helix	trans	-62.3	-45.4	-177.3	168	-92	0	0	0	112.1	V525 Q526 I531 F560 F561 I602 L608	V525-F606 HydrophobicContact CB-CZ 4.4Å; V525-F606 HydrophobicContact CG1-CE2 4.03Å; V525-F606 HydrophobicContact CG1-CZ 3.81Å; Q526-F606 WeakPolarHBondContact O-CE1 3.36Å; Q526-F606 VanDerWaalsContact O-CZ 3.23Å; Q526-F606 WeakPolarHBondContact O-CZ 3.32Å; I531-F606 WeakPolarHBondContact CD1-O 3.48Å; F560-F606 HydrophobicContact CB-CB 4.09Å; F560-F606 HydrophobicContact CB-CD2 3.78Å; F560-F606 HydrophobicContact CB-CG 4.42Å; F560-F606 HydrophobicContact CG-CB 4.48Å; F561-F606 HydrophobicContact CB-CE2 4.48Å; F561-F606 HydrophobicContact CD1-CD2 4.08Å; F561-F606 AromaticContact CD1-CE2 3.28Å; F561-F606 HydrophobicContact CD1-CE2 3.28Å; F561-F606 AromaticContact CD1-CZ 3.76Å; F561-F606 HydrophobicContact CD1-CZ 3.76Å; F561-F606 AromaticContact CD2-CD2 3.85Å; F561-F606 HydrophobicContact CD2-CD2 3.85Å; F561-F606 AromaticContact CD2-CE2 3.92Å; F561-F606 HydrophobicContact CD2-CE2 3.92Å; F561-F606 AromaticContact CE1-CD2 3.89Å; F561-F606 HydrophobicContact CE1-CD2 3.89Å; F561-F606 AromaticContact CE1-CE1 3.98Å; F561-F606 HydrophobicContact CE1-CE1 3.98Å; F561-F606 AromaticContact CE1-CE2 3.12Å; F561-F606 HydrophobicContact CE1-CE2 3.12Å; F561-F606 AromaticContact CE1-CZ 3.16Å; F561-F606 HydrophobicContact CE1-CZ 3.16Å; F561-F606 AromaticContact CE2-CD2 3.66Å; F561-F606 HydrophobicContact CE2-CD2 3.66Å; F561-F606 AromaticContact CE2-CE2 3.79Å; F561-F606 HydrophobicContact CE2-CE2 3.79Å; F561-F606 HydrophobicContact CE2-CG 4.17Å; F561-F606 HydrophobicContact CE2-CZ 4.33Å; F561-F606 WeakPolarHBondContact CE2-O 3.48Å; F561-F606 HydrophobicContact CG-CD2 4.04Å; F561-F606 AromaticContact CG-CE2 3.66Å; F561-F606 HydrophobicContact CG-CE2 3.66Å; F561-F606 HydrophobicContact CZ-CD1 4.2Å; F561-F606 AromaticContact CZ-CD2 3.67Å; F561-F606 HydrophobicContact CZ-CD2 3.67Å; F561-F606 AromaticContact CZ-CE1 3.9Å; F561-F606 HydrophobicContact CZ-CE1 3.9Å; F561-F606 AromaticContact CZ-CE2 3.38Å; F561-F606 HydrophobicContact CZ-CE2 3.38Å; F561-F606 HydrophobicContact CZ-CG 4.09Å; F561-F606 AromaticContact CZ-CZ 3.49Å; F561-F606 HydrophobicContact CZ-CZ 3.49Å; F561-F606 VanDerWaalsContact CZ-CZ 3.49Å; I602-F606 WeakPolarHBondContact O-CB 3.42Å; I602-F606 PolarHBondContact O-N 2.82Å; F606-L608 VanDerWaalsContact C-N 3.32Å
607	T	95.5	Very high	95.4	Very high	0 Å²	0	23.3 Å²	23.3	0%	0	12%	0.124	C	C	.	.	T	Hydrogen-bonded Turn	trans	-87.1	2	176	70.9	0	0	0	0	113.8	D603 Y609 S610 K611	D603-T607 WeakPolarHBondContact O-CB 3.4Å; D603-T607 PolarHBondContact O-N 3.03Å; D603-T607 PolarHBondContact O-OG1 2.95Å; T607-Y609 PolarHBondContact O-N 2.89Å; T607-S610 WeakPolarHBondContact O-CB 3.11Å; T607-S610 PolarHBondContact O-N 3.04Å; T607-S610 PolarHBondContact O-OG 3.03Å; T607-S610 PolarHBondContact OG1-N 3.28Å; T607-K611 HydrophobicContact CG2-CB 3.64Å; T607-K611 HydrophobicContact CG2-CD 4.03Å; T607-K611 HydrophobicContact CG2-CG 4.5Å; T607-K611 WeakPolarHBondContact OG1-CB 3.32Å; T607-K611 PolarHBondContact OG1-N 3.25Å
608	L	97.4	Very high	95.4	Very high	0 Å²	0	23 Å²	23	0%	0	12%	0.122	C	C	.	.	T	Hydrogen-bonded Turn	trans	48.6	48.4	-168.1	-60.1	87.2	0	0	0	110.9	I531 L551 Q557 W604 I605 F606 S610 W622 F625 L633	I531-L608 HydrophobicContact CD1-CD1 4.09Å; I531-L608 HydrophobicContact CG1-CD1 4.46Å; L551-L608 HydrophobicContact CD1-CD2 3.99Å; L551-L608 HydrophobicContact CD2-CD1 4.4Å; L551-L608 HydrophobicContact CD2-CD2 4.33Å; Q557-L608 HydrophobicContact CG-CD1 4.11Å; W604-L608 CarbonylContact O-C 3.57Å; W604-L608 WeakPolarHBondContact O-CA 3.4Å; W604-L608 PolarHBondContact O-N 2.94Å; I605-L608 PolarHBondContact O-N 3.07Å; F606-L608 VanDerWaalsContact C-N 3.32Å; L608-S610 PolarHBondContact O-N 3.01Å; L608-W622 HydrophobicContact CB-CZ2 4.16Å; L608-W622 VanDerWaalsContact CB-NE1 3.34Å; L608-W622 VanDerWaalsContact O-CD1 3.29Å; L608-W622 PolarHBondContact O-NE1 3.12Å; L608-F625 HydrophobicContact CD2-CD1 3.65Å; L608-F625 HydrophobicContact CD2-CD2 4.32Å; L608-F625 HydrophobicContact CD2-CE1 3.4Å; L608-F625 VanDerWaalsContact CD2-CE1 3.4Å; L608-F625 HydrophobicContact CD2-CE2 4.09Å; L608-F625 HydrophobicContact CD2-CG 4.11Å; L608-F625 HydrophobicContact CD2-CZ 3.63Å; L608-L633 HydrophobicContact CB-CD2 4.26Å; L608-L633 HydrophobicContact CD2-CD1 4.23Å; L608-L633 HydrophobicContact CD2-CD2 4.36Å; L608-L633 HydrophobicContact CG-CD1 4.08Å; L608-L633 HydrophobicContact CG-CD2 4.33Å
609	Y	97.9	Very high	95.6	Very high	0 Å²	0	21.3 Å²	21.3	0%	0	11%	0.113	C	C	.	.	T	Hydrogen-bonded Turn	trans	61.5	-2	-175.6	-60.6	-90.7	0	0	0	117.2	W604 T607 K611 S612 L613 V621 L633 T636 A637	W604-Y609 HydrophobicContact CB-CD1 4.05Å; W604-Y609 HydrophobicContact CB-CE1 3.56Å; W604-Y609 AromaticContact CD2-CE1 3.88Å; W604-Y609 HydrophobicContact CD2-CE1 3.88Å; W604-Y609 AromaticContact CE3-CE1 3.89Å; W604-Y609 HydrophobicContact CE3-CE1 3.89Å; W604-Y609 HydrophobicContact CG-CD1 4.23Å; W604-Y609 AromaticContact CG-CE1 3.76Å; W604-Y609 HydrophobicContact CG-CE1 3.76Å; W604-Y609 WeakPolarHBondContact O-CD2 3.26Å; W604-Y609 PolarHBondContact O-N 3.09Å; T607-Y609 PolarHBondContact O-N 2.89Å; Y609-K611 PolarHBondContact O-N 2.99Å; Y609-K611 VanDerWaalsContact O-N 3.14Å; Y609-S612 PolarHBondContact O-N 2.94Å; Y609-L613 HydrophobicContact CD1-CD1 3.71Å; Y609-L613 HydrophobicContact CD1-CG 3.97Å; Y609-L613 HydrophobicContact CG-CD1 3.82Å; Y609-L613 HydrophobicContact CG-CG 4.31Å; Y609-L613 PolarHBondContact O-N 2.62Å; Y609-V621 HydrophobicContact CD2-CG1 3.74Å; Y609-V621 HydrophobicContact CE2-CG1 4.32Å; Y609-V621 HydrophobicContact CG-CG1 4.44Å; Y609-L633 HydrophobicContact CD2-CD2 4.3Å; Y609-L633 HydrophobicContact CE2-CB 4.34Å; Y609-L633 HydrophobicContact CE2-CD2 4.21Å; Y609-L633 PolarHBondContact OH-O 2.92Å; Y609-T636 HydrophobicContact CD1-CG2 4.33Å; Y609-T636 HydrophobicContact CD2-CG2 4.14Å; Y609-T636 HydrophobicContact CE1-CG2 3.88Å; Y609-T636 HydrophobicContact CE2-CG2 3.69Å; Y609-T636 HydrophobicContact CG-CG2 4.46Å; Y609-A637 VanDerWaalsContact OH-CA 3.29Å; Y609-A637 WeakPolarHBondContact OH-CA 3.49Å; Y609-A637 VanDerWaalsContact OH-CB 3.31Å; Y609-A637 WeakPolarHBondContact OH-CB 3.23Å; Y609-A637 PolarHBondContact OH-N 3.3Å
610	S	96.9	Very high	95.7	Very high	1 Å²	1	20 Å²	20	1%	0.007	11%	0.105	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.2	-21	-176.4	61.5	0	0	0	0	114.4	F492 F530 T607 L608	F492-S610 WeakPolarHBondContact CE1-O 3.23Å; F492-S610 WeakPolarHBondContact CZ-O 3.31Å; F530-S610 WeakPolarHBondContact CB-OG 3.41Å; F530-S610 WeakPolarHBondContact CD1-O 3.14Å; T607-S610 WeakPolarHBondContact O-CB 3.11Å; T607-S610 PolarHBondContact O-N 3.04Å; T607-S610 PolarHBondContact O-OG 3.03Å; T607-S610 PolarHBondContact OG1-N 3.28Å; L608-S610 PolarHBondContact O-N 3.01Å
611	K	95	Very high	95.8	Very high	79 Å²	79	19.7 Å²	19.7	34%	0.343	10%	0.104	S	C	.	.	T	Hydrogen-bonded Turn	trans	-90.3	-17.6	170.3	-179	-171.3	177.5	-159.8	0	113.7	F530 D603 T607 Y609	F530-K611 HydrophobicContact CD1-CB 4.08Å; F530-K611 HydrophobicContact CD2-CB 4.24Å; F530-K611 HydrophobicContact CD2-CG 4.45Å; F530-K611 HydrophobicContact CE1-CB 4.26Å; F530-K611 HydrophobicContact CE1-CG 4.28Å; F530-K611 HydrophobicContact CE2-CB 4.43Å; F530-K611 HydrophobicContact CE2-CG 4.18Å; F530-K611 HydrophobicContact CG-CB 4.07Å; F530-K611 HydrophobicContact CZ-CB 4.44Å; F530-K611 HydrophobicContact CZ-CG 4.08Å; D603-K611 WeakPolarHBondContact OD1-CD 3.15Å; D603-K611 IonicContact OD1-NZ 3.69Å; D603-K611 PolarHBondContact OD1-NZ 3.27Å; D603-K611 IonicContact OD2-NZ 2.71Å; D603-K611 PolarHBondContact OD2-NZ 3.41Å; T607-K611 HydrophobicContact CG2-CB 3.64Å; T607-K611 HydrophobicContact CG2-CD 4.03Å; T607-K611 HydrophobicContact CG2-CG 4.5Å; T607-K611 WeakPolarHBondContact OG1-CB 3.32Å; T607-K611 PolarHBondContact OG1-N 3.25Å; Y609-K611 PolarHBondContact O-N 2.99Å; Y609-K611 VanDerWaalsContact O-N 3.14Å
612	S	94.8	Very high	95.9	Very high	24 Å²	24	19.9 Å²	19.9	17%	0.168	10%	0.104	C	C	.	.	T	Hydrogen-bonded Turn	trans	-117.4	-8.3	-163.9	-53.9	0	0	0	0	114.9	Y609	Y609-S612 PolarHBondContact O-N 2.94Å
613	L	96	Very high	96.1	Very high	10 Å²	10	18.6 Å²	18.6	5%	0.052	10%	0.098	C	C	.	.	S	Bend	trans	-132.8	155.8	175.7	-61.5	178	0	0	0	110	Y609 L617 A618 V621 L663 I667	Y609-L613 HydrophobicContact CD1-CD1 3.71Å; Y609-L613 HydrophobicContact CD1-CG 3.97Å; Y609-L613 HydrophobicContact CG-CD1 3.82Å; Y609-L613 HydrophobicContact CG-CG 4.31Å; Y609-L613 PolarHBondContact O-N 2.62Å; L613-L617 HydrophobicContact CB-CD2 4.44Å; L613-L617 HydrophobicContact CB-CG 4.49Å; L613-L617 HydrophobicContact CD1-CD2 4.34Å; L613-L617 HydrophobicContact CD1-CG 4.19Å; L613-L617 HydrophobicContact CD2-CD2 4.21Å; L613-A618 HydrophobicContact CB-CB 4.42Å; L613-V621 HydrophobicContact CD1-CG2 4.16Å; L613-L663 HydrophobicContact CD2-CD1 3.97Å; L613-I667 HydrophobicContact CD2-CD1 3.65Å
614	P	94.5	Very high	96.4	Very high	50 Å²	50	16.3 Å²	16.3	33%	0.325	9%	0.085	S	C	.	.			trans	-54.1	147.2	169.5	-27	36.1	0	0	0	112.6	D616 L617 A618 D665	P614-D616 PolarHBondContact O-N 3.28Å; P614-L617 WeakPolarHBondContact O-CB 3.47Å; P614-L617 PolarHBondContact O-N 3.39Å; P614-A618 PolarHBondContact O-N 3.09Å; P614-D665 WeakPolarHBondContact CG-O 3.41Å
615	L	94.7	Very high	96.4	Very high	30 Å²	30	16.9 Å²	16.9	16%	0.157	9%	0.088	C	C	.	.	H	α-helix	trans	-51.1	-49.2	-170.1	174.3	62.1	0	0	0	113.8	F492 L495 V534 L537 L617 A618 C619	F492-L615 HydrophobicContact CD1-CB 4.22Å; F492-L615 HydrophobicContact CE1-CB 4.03Å; F492-L615 HydrophobicContact CE1-CD1 4.17Å; F492-L615 HydrophobicContact CE2-CD1 4.14Å; F492-L615 HydrophobicContact CZ-CD1 3.86Å; L495-L615 HydrophobicContact CD1-CD2 3.59Å; V534-L615 HydrophobicContact CG2-CD1 3.84Å; L537-L615 HydrophobicContact CD1-CD1 4.16Å; L537-L615 HydrophobicContact CD1-CD2 3.59Å; L537-L615 HydrophobicContact CD1-CG 4.48Å; L615-L617 VanDerWaalsContact C-N 3.33Å; L615-L617 PolarHBondContact O-N 3.22Å; L615-A618 PolarHBondContact O-N 3Å; L615-C619 WeakPolarHBondContact O-CB 3.3Å; L615-C619 PolarHBondContact O-N 3.03Å; L615-C619 PolarHBondContact O-SG 3.28Å
616	D	93.8	Very high	96.5	Very high	100 Å²	100	17.8 Å²	17.8	54%	0.535	9%	0.094	S	C	.	.	H	α-helix	trans	-66.5	-35	-179.5	-86.2	-35.3	0	0	0	113	R428 P614 C619 R620	R428-D616 IonicContact NH1-OD1 3.64Å; P614-D616 PolarHBondContact O-N 3.28Å; D616-C619 PolarHBondContact O-N 3Å; D616-R620 PolarHBondContact O-N 3.25Å
617	L	96.9	Very high	96.7	Very high	8 Å²	8	19.1 Å²	19.1	4%	0.042	10%	0.099	C	C	.	.	H	α-helix	trans	-71.8	-40.7	177	-173.5	59	0	0	0	111	L613 P614 L615 R620 V621 I667 P669 L672 F673	L613-L617 HydrophobicContact CB-CD2 4.44Å; L613-L617 HydrophobicContact CB-CG 4.49Å; L613-L617 HydrophobicContact CD1-CD2 4.34Å; L613-L617 HydrophobicContact CD1-CG 4.19Å; L613-L617 HydrophobicContact CD2-CD2 4.21Å; P614-L617 WeakPolarHBondContact O-CB 3.47Å; P614-L617 PolarHBondContact O-N 3.39Å; L615-L617 VanDerWaalsContact C-N 3.33Å; L615-L617 PolarHBondContact O-N 3.22Å; L617-R620 PolarHBondContact O-N 2.93Å; L617-V621 WeakPolarHBondContact O-CG2 3.05Å; L617-V621 PolarHBondContact O-N 3.3Å; L617-I667 HydrophobicContact CD2-CB 3.84Å; L617-I667 HydrophobicContact CD2-CG2 4.04Å; L617-P669 HydrophobicContact CD1-CB 3.82Å; L617-P669 HydrophobicContact CD1-CG 4.18Å; L617-L672 HydrophobicContact CD1-CD2 4.24Å; L617-L672 HydrophobicContact CD2-CD2 3.94Å; L617-L672 HydrophobicContact CG-CD2 4.32Å; L617-F673 HydrophobicContact CD1-CD2 4.32Å; L617-F673 HydrophobicContact CD1-CE2 3.93Å
618	A	97.6	Very high	96.7	Very high	0 Å²	0	21.3 Å²	21.3	0%	0	11%	0.11	C	C	.	.	H	α-helix	trans	-59.8	-44.7	169.8	0	0	0	0	0	111	L613 P614 L615 R620 V621 W622	L613-A618 HydrophobicContact CB-CB 4.42Å; P614-A618 PolarHBondContact O-N 3.09Å; L615-A618 PolarHBondContact O-N 3Å; A618-R620 VanDerWaalsContact C-N 3.34Å; A618-R620 PolarHBondContact O-N 3.32Å; A618-V621 CarbonylContact O-C 3.55Å; A618-V621 WeakPolarHBondContact O-CB 3.31Å; A618-V621 PolarHBondContact O-N 2.9Å; A618-V621 VanDerWaalsContact O-N 3.1Å; A618-W622 PolarHBondContact O-N 3.16Å
619	C	98.1	Very high	96.6	Very high	2 Å²	2	22.8 Å²	22.8	1%	0.014	13%	0.126	C	C	.	.	H	α-helix	trans	-59.9	-40.9	175.3	-68.5	0	0	0	0	112.3	W432 L615 D616 V621 W622 D623	W432-C619 HydrophobicContact CH2-CB 4.34Å; W432-C619 HydrophobicContact CZ2-CB 4.36Å; L615-C619 WeakPolarHBondContact O-CB 3.3Å; L615-C619 PolarHBondContact O-N 3.03Å; L615-C619 PolarHBondContact O-SG 3.28Å; D616-C619 PolarHBondContact O-N 3Å; C619-V621 VanDerWaalsContact C-N 3.32Å; C619-V621 PolarHBondContact O-N 2.93Å; C619-W622 WeakPolarHBondContact O-CB 3.2Å; C619-W622 PolarHBondContact O-N 2.82Å; C619-D623 PolarHBondContact O-N 3.23Å
620	R	98	Very high	96.5	Very high	23 Å²	23	24.7 Å²	24.7	9%	0.087	14%	0.135	C	C	.	.	H	α-helix	trans	-67.1	-31.9	175.1	-164.8	-175.7	174.8	165.1	1.2	112.6	W420 Q421 D616 L617 A618 V624 E670 F673	W420-R620 PolarHBondContact O-NE 3.4Å; W420-R620 PolarHBondContact O-NH2 3.44Å; W420-R620 VanDerWaalsContact O-NH2 3.15Å; Q421-R620 PolarHBondContact O-NE 2.82Å; D616-R620 PolarHBondContact O-N 3.25Å; L617-R620 PolarHBondContact O-N 2.93Å; A618-R620 VanDerWaalsContact C-N 3.34Å; A618-R620 PolarHBondContact O-N 3.32Å; R620-V624 PolarHBondContact O-N 3.32Å; R620-E670 IonicContact CZ-OE1 2.69Å; R620-E670 IonicContact NH1-OE1 3.93Å; R620-E670 PolarHBondContact NH1-OE1 3.13Å; R620-F673 HydrophobicContact CB-CE2 4.27Å; R620-F673 HydrophobicContact CB-CZ 4.02Å; R620-F673 HydrophobicContact CG-CE1 3.91Å; R620-F673 HydrophobicContact CG-CE2 3.97Å; R620-F673 HydrophobicContact CG-CZ 3.54Å
621	V	98.6	Very high	96.5	Very high	0 Å²	0	27.1 Å²	27.1	0%	0	15%	0.146	C	C	.	.	H	α-helix	trans	-68.9	-42.1	171.3	169.9	0	0	0	0	110.9	Y609 L613 L617 A618 C619 V624 F625 F632 L633 T636 F673	Y609-V621 HydrophobicContact CD2-CG1 3.74Å; Y609-V621 HydrophobicContact CE2-CG1 4.32Å; Y609-V621 HydrophobicContact CG-CG1 4.44Å; L613-V621 HydrophobicContact CD1-CG2 4.16Å; L617-V621 WeakPolarHBondContact O-CG2 3.05Å; L617-V621 PolarHBondContact O-N 3.3Å; A618-V621 CarbonylContact O-C 3.55Å; A618-V621 WeakPolarHBondContact O-CB 3.31Å; A618-V621 PolarHBondContact O-N 2.9Å; A618-V621 VanDerWaalsContact O-N 3.1Å; C619-V621 VanDerWaalsContact C-N 3.32Å; C619-V621 PolarHBondContact O-N 2.93Å; V621-V624 PolarHBondContact O-N 3.35Å; V621-F625 WeakPolarHBondContact O-CB 3.4Å; V621-F625 PolarHBondContact O-N 2.95Å; V621-F632 HydrophobicContact CB-CE1 4.5Å; V621-F632 HydrophobicContact CG1-CD1 4.43Å; V621-F632 HydrophobicContact CG1-CE1 4.12Å; V621-L633 HydrophobicContact CG1-CD2 4.39Å; V621-T636 HydrophobicContact CG1-CG2 4.16Å; V621-T636 HydrophobicContact CG2-CG2 3.93Å; V621-F673 HydrophobicContact CG2-CE2 4.15Å; V621-F673 HydrophobicContact CG2-CZ 4.07Å
622	W	98.4	Very high	96.6	Very high	4 Å²	4	23.4 Å²	23.4	2%	0.015	13%	0.13	C	C	.	.	H	α-helix	trans	-62.1	-42.2	174.8	-80.7	46.1	0	0	0	112.5	W432 I531 V534 L535 L551 L608 A618 C619 V624 F625 C626	W432-W622 HydrophobicContact CE3-CE3 4.26Å; W432-W622 HydrophobicContact CH2-CB 4.32Å; W432-W622 HydrophobicContact CH2-CE3 4.18Å; W432-W622 HydrophobicContact CZ2-CB 3.9Å; W432-W622 AromaticContact CZ3-CE3 3.99Å; W432-W622 HydrophobicContact CZ3-CE3 3.99Å; W432-W622 HydrophobicContact CZ3-CZ3 4.42Å; I531-W622 HydrophobicContact CB-CH2 4.22Å; I531-W622 HydrophobicContact CB-CZ2 4.36Å; I531-W622 HydrophobicContact CG1-CZ2 4.48Å; I531-W622 HydrophobicContact CG2-CH2 3.58Å; I531-W622 HydrophobicContact CG2-CZ2 4.05Å; I531-W622 WeakPolarHBondContact O-CH2 3.48Å; V534-W622 HydrophobicContact CB-CH2 3.92Å; V534-W622 HydrophobicContact CB-CZ2 4.05Å; V534-W622 HydrophobicContact CB-CZ3 4.24Å; V534-W622 HydrophobicContact CG1-CD2 3.79Å; V534-W622 HydrophobicContact CG1-CE3 3.67Å; V534-W622 HydrophobicContact CG1-CH2 3.83Å; V534-W622 HydrophobicContact CG1-CZ2 3.97Å; V534-W622 HydrophobicContact CG1-CZ3 3.69Å; V534-W622 HydrophobicContact CG2-CZ2 4.44Å; L535-W622 HydrophobicContact CD1-CZ3 4.44Å; L535-W622 HydrophobicContact CD2-CZ3 3.77Å; L535-W622 HydrophobicContact CG-CH2 4.13Å; L535-W622 HydrophobicContact CG-CZ3 3.79Å; L551-W622 HydrophobicContact CD2-CH2 3.89Å; L551-W622 HydrophobicContact CD2-CZ3 3.94Å; L608-W622 HydrophobicContact CB-CZ2 4.16Å; L608-W622 VanDerWaalsContact CB-NE1 3.34Å; L608-W622 VanDerWaalsContact O-CD1 3.29Å; L608-W622 PolarHBondContact O-NE1 3.12Å; A618-W622 PolarHBondContact O-N 3.16Å; C619-W622 WeakPolarHBondContact O-CB 3.2Å; C619-W622 PolarHBondContact O-N 2.82Å; W622-V624 VanDerWaalsContact C-N 3.33Å; W622-V624 PolarHBondContact O-N 3.31Å; W622-F625 PolarHBondContact O-N 2.85Å; W622-C626 WeakPolarHBondContact O-CB 3.28Å; W622-C626 PolarHBondContact O-N 3.16Å; W622-C626 PolarHBondContact O-SG 2.81Å
623	D	98.3	Very high	96.8	Very high	0 Å²	0	22.3 Å²	22.3	0%	0	12%	0.122	C	C	.	.	H	α-helix	trans	-50.5	-55.2	174.9	-71.9	-28	0	0	0	109.7	W419 G422 I423 R428 W432 C619 C626 R627	W419-D623 PolarHBondContact NE1-O 3.46Å; G422-D623 WeakPolarHBondContact CA-OD2 3.44Å; I423-D623 WeakPolarHBondContact CB-OD1 3.36Å; I423-D623 HydrophobicContact CD1-CB 3.92Å; I423-D623 WeakPolarHBondContact CD1-OD1 3.29Å; I423-D623 HydrophobicContact CG1-CB 3.9Å; I423-D623 WeakPolarHBondContact CG1-OD1 3.35Å; I423-D623 PolarHBondContact N-OD2 2.85Å; R428-D623 IonicContact NE-OD1 2.83Å; R428-D623 IonicContact NE-OD2 2.69Å; R428-D623 IonicContact NH2-OD2 3.14Å; W432-D623 PolarHBondContact NE1-OD1 2.89Å; C619-D623 PolarHBondContact O-N 3.23Å; D623-C626 WeakPolarHBondContact O-CB 3.5Å; D623-C626 PolarHBondContact O-N 3.26Å; D623-R627 PolarHBondContact O-N 2.98Å
624	V	98.3	Very high	96.9	Very high	0 Å²	0	21.8 Å²	21.8	0%	0	12%	0.119	C	C	.	.	H	α-helix	trans	-77.4	-28.8	-177.2	-176.2	0	0	0	0	112.9	W420 R620 V621 W622 C626 R627 D628 F632 F673	W420-V624 HydrophobicContact CE3-CG1 3.9Å; W420-V624 HydrophobicContact CE3-CG2 4.1Å; W420-V624 HydrophobicContact CZ3-CG1 3.88Å; R620-V624 PolarHBondContact O-N 3.32Å; V621-V624 PolarHBondContact O-N 3.35Å; W622-V624 VanDerWaalsContact C-N 3.33Å; W622-V624 PolarHBondContact O-N 3.31Å; V624-C626 VanDerWaalsContact C-N 3.35Å; V624-C626 PolarHBondContact O-N 3.21Å; V624-R627 VanDerWaalsContact O-CB 3.31Å; V624-R627 WeakPolarHBondContact O-CB 3.45Å; V624-R627 PolarHBondContact O-N 2.85Å; V624-D628 PolarHBondContact O-N 2.91Å; V624-F632 HydrophobicContact CB-CD1 3.9Å; V624-F632 HydrophobicContact CB-CD2 4.38Å; V624-F632 HydrophobicContact CB-CE1 3.61Å; V624-F632 HydrophobicContact CB-CE2 4.12Å; V624-F632 HydrophobicContact CB-CG 4.28Å; V624-F632 HydrophobicContact CB-CZ 3.73Å; V624-F632 HydrophobicContact CG1-CD1 3.93Å; V624-F632 HydrophobicContact CG1-CD2 3.54Å; V624-F632 HydrophobicContact CG1-CE1 3.86Å; V624-F632 HydrophobicContact CG1-CE2 3.47Å; V624-F632 VanDerWaalsContact CG1-CE2 3.47Å; V624-F632 HydrophobicContact CG1-CG 3.79Å; V624-F632 HydrophobicContact CG1-CZ 3.63Å; V624-F632 HydrophobicContact CG2-CZ 4.46Å; V624-F673 HydrophobicContact CG2-CE1 4.15Å
625	F	97.9	Very high	97.1	Very high	15 Å²	15	21.6 Å²	21.6	7%	0.066	11%	0.112	C	C	.	.	H	α-helix	trans	-59.5	-42.8	168.5	158.8	-98	0	0	0	111.9	L551 L608 V621 W622 R627 D628 G629 F632 L633	L551-F625 HydrophobicContact CD1-CE1 3.55Å; L551-F625 HydrophobicContact CD1-CZ 3.69Å; L608-F625 HydrophobicContact CD2-CD1 3.65Å; L608-F625 HydrophobicContact CD2-CD2 4.32Å; L608-F625 HydrophobicContact CD2-CE1 3.4Å; L608-F625 VanDerWaalsContact CD2-CE1 3.4Å; L608-F625 HydrophobicContact CD2-CE2 4.09Å; L608-F625 HydrophobicContact CD2-CG 4.11Å; L608-F625 HydrophobicContact CD2-CZ 3.63Å; V621-F625 WeakPolarHBondContact O-CB 3.4Å; V621-F625 PolarHBondContact O-N 2.95Å; W622-F625 PolarHBondContact O-N 2.85Å; F625-R627 PolarHBondContact O-N 3.21Å; F625-R627 VanDerWaalsContact O-N 3.16Å; F625-D628 PolarHBondContact O-N 3.03Å; F625-G629 WeakPolarHBondContact CD2-O 3.34Å; F625-G629 VanDerWaalsContact O-CA 3.29Å; F625-G629 WeakPolarHBondContact O-CA 3.28Å; F625-G629 PolarHBondContact O-N 3.42Å; F625-F632 HydrophobicContact CB-CD1 4.31Å; F625-L633 HydrophobicContact CB-CD2 4.06Å; F625-L633 HydrophobicContact CD2-CD1 3.87Å; F625-L633 HydrophobicContact CD2-CD2 3.82Å; F625-L633 HydrophobicContact CD2-CG 3.65Å; F625-L633 HydrophobicContact CE2-CD1 3.87Å; F625-L633 HydrophobicContact CE2-CG 4.17Å; F625-L633 HydrophobicContact CG-CD2 4.04Å; F625-L633 HydrophobicContact CG-CG 4.38Å
626	C	96.4	Very high	97.3	Very high	19 Å²	19	20.1 Å²	20.1	13%	0.128	11%	0.105	C	C	.	.	H	α-helix	trans	-61.2	-24	174.6	-69.9	0	0	0	0	112.4	W419 A435 W622 D623 V624	W419-C626 HydrophobicContact CZ2-CB 4.36Å; A435-C626 HydrophobicContact CB-CB 3.73Å; W622-C626 WeakPolarHBondContact O-CB 3.28Å; W622-C626 PolarHBondContact O-N 3.16Å; W622-C626 PolarHBondContact O-SG 2.81Å; D623-C626 WeakPolarHBondContact O-CB 3.5Å; D623-C626 PolarHBondContact O-N 3.26Å; V624-C626 VanDerWaalsContact C-N 3.35Å; V624-C626 PolarHBondContact O-N 3.21Å
627	R	95.8	Very high	97.6	Very high	37 Å²	37	15.4 Å²	15.4	14%	0.14	8%	0.079	C	C	.	.	H	α-helix	trans	-88	-39.1	-179.3	-163.4	-168.8	72.4	-166.5	-4.3	114.1	R416 W419 D623 V624 F625	R416-R627 PolarHBondContact O-NH1 3.01Å; W419-R627 HydrophobicContact CD2-CB 3.92Å; W419-R627 HydrophobicContact CD2-CG 3.67Å; W419-R627 HydrophobicContact CE3-CB 4.28Å; W419-R627 HydrophobicContact CE3-CG 3.61Å; W419-R627 HydrophobicContact CG-CB 4.46Å; W419-R627 HydrophobicContact CG-CG 4.29Å; W419-R627 HydrophobicContact CH2-CB 4.02Å; W419-R627 HydrophobicContact CH2-CG 3.94Å; W419-R627 HydrophobicContact CZ2-CB 3.66Å; W419-R627 HydrophobicContact CZ2-CG 4.02Å; W419-R627 HydrophobicContact CZ3-CB 4.33Å; W419-R627 HydrophobicContact CZ3-CG 3.76Å; D623-R627 PolarHBondContact O-N 2.98Å; V624-R627 VanDerWaalsContact O-CB 3.31Å; V624-R627 WeakPolarHBondContact O-CB 3.45Å; V624-R627 PolarHBondContact O-N 2.85Å; F625-R627 PolarHBondContact O-N 3.21Å; F625-R627 VanDerWaalsContact O-N 3.16Å
628	D	95.5	Very high	97.7	Very high	45 Å²	45	15 Å²	15	24%	0.241	8%	0.077	C	C	.	.	H	α-helix	trans	-120.3	-4.6	-167	-69.1	-0.1	0	0	0	113.5	R416 V624 F625 F632	R416-D628 IonicContact CZ-OD1 3.46Å; R416-D628 IonicContact NH1-OD1 3.6Å; R416-D628 PolarHBondContact NH1-OD1 3.36Å; R416-D628 IonicContact NH2-OD1 3.73Å; R416-D628 PolarHBondContact NH2-OD1 3.27Å; R416-D628 IonicContact NH2-OD2 2.75Å; R416-D628 PolarHBondContact NH2-OD2 3.33Å; V624-D628 PolarHBondContact O-N 2.91Å; F625-D628 PolarHBondContact O-N 3.03Å; D628-F632 HydrophobicContact CB-CB 4.19Å
629	G	95.1	Very high	97.7	Very high	31 Å²	31	15 Å²	15	32%	0.32	8%	0.077	S	C	.	.			trans	76.1	-165.1	176.8	0	0	0	0	0	114.7	F625 E631 F632	F625-G629 WeakPolarHBondContact CD2-O 3.34Å; F625-G629 VanDerWaalsContact O-CA 3.29Å; F625-G629 WeakPolarHBondContact O-CA 3.28Å; F625-G629 PolarHBondContact O-N 3.42Å; G629-E631 PolarHBondContact O-N 2.82Å; G629-E631 VanDerWaalsContact O-N 3.14Å; G629-F632 WeakPolarHBondContact O-CB 3.41Å; G629-F632 PolarHBondContact O-N 2.67Å
630	E	95.4	Very high	97.7	Very high	40 Å²	40	15 Å²	15	19%	0.187	8%	0.077	C	C	.	.	T	Hydrogen-bonded Turn	trans	-54.6	-31.1	-176.5	49	160.7	-113.2	0	0	114.4	C556 Y571 F632 L633 F634 W688 L692	C556-E630 HydrophobicContact CB-CB 4.05Å; C556-E630 WeakPolarHBondContact CB-OE2 3.46Å; Y571-E630 WeakPolarHBondContact CE1-OE1 3.27Å; Y571-E630 PolarHBondContact OH-OE2 3.24Å; E630-F632 PolarHBondContact O-N 3.23Å; E630-F632 VanDerWaalsContact O-N 3.11Å; E630-L633 WeakPolarHBondContact O-CB 3.39Å; E630-L633 PolarHBondContact O-N 2.92Å; E630-F634 VanDerWaalsContact O-CD2 3.3Å; E630-F634 WeakPolarHBondContact O-CD2 3.08Å; E630-W688 PolarHBondContact OE1-NE1 2.83Å; E630-L692 WeakPolarHBondContact OE1-CD2 3.49Å
631	E	97.1	Very high	97.8	Very high	53 Å²	53	13.9 Å²	13.9	25%	0.248	7%	0.073	C	C	.	.	H	α-helix	trans	-50.2	-38.7	174.3	179.6	-178.4	117.8	0	0	111.2	G629 L633 F634 R635 M681 W688	G629-E631 PolarHBondContact O-N 2.82Å; G629-E631 VanDerWaalsContact O-N 3.14Å; E631-L633 VanDerWaalsContact C-N 3.32Å; E631-L633 PolarHBondContact O-N 3.4Å; E631-F634 PolarHBondContact O-N 3.5Å; E631-R635 WeakPolarHBondContact O-CB 3.49Å; E631-R635 PolarHBondContact O-N 3.2Å; E631-M681 HydrophobicContact CG-CB 3.88Å; E631-M681 HydrophobicContact CG-CE 3.82Å; E631-M681 HydrophobicContact CG-CG 3.82Å; E631-M681 VanDerWaalsContact OE1-CB 3.31Å; E631-M681 WeakPolarHBondContact OE1-CB 3.46Å; E631-W688 HydrophobicContact CB-CB 4.01Å; E631-W688 HydrophobicContact CB-CG 3.85Å; E631-W688 HydrophobicContact CG-CB 3.64Å; E631-W688 HydrophobicContact CG-CG 3.92Å; E631-W688 WeakPolarHBondContact OE2-CB 3.45Å
632	F	98.3	Very high	97.8	Very high	1 Å²	1	17.8 Å²	17.8	0%	0.004	9%	0.087	C	C	.	.	H	α-helix	trans	-68.8	-27.7	-177.5	-169.1	-103	0	0	0	113.6	W420 V621 V624 F625 D628 G629 E630 R635 T636 F673 I676	W420-F632 AromaticContact CH2-CE2 3.89Å; W420-F632 HydrophobicContact CH2-CE2 3.89Å; W420-F632 HydrophobicContact CH2-CZ 4.44Å; W420-F632 HydrophobicContact CZ3-CD2 4.48Å; W420-F632 AromaticContact CZ3-CE2 3.6Å; W420-F632 HydrophobicContact CZ3-CE2 3.6Å; W420-F632 HydrophobicContact CZ3-CZ 4.22Å; V621-F632 HydrophobicContact CB-CE1 4.5Å; V621-F632 HydrophobicContact CG1-CD1 4.43Å; V621-F632 HydrophobicContact CG1-CE1 4.12Å; V624-F632 HydrophobicContact CB-CD1 3.9Å; V624-F632 HydrophobicContact CB-CD2 4.38Å; V624-F632 HydrophobicContact CB-CE1 3.61Å; V624-F632 HydrophobicContact CB-CE2 4.12Å; V624-F632 HydrophobicContact CB-CG 4.28Å; V624-F632 HydrophobicContact CB-CZ 3.73Å; V624-F632 HydrophobicContact CG1-CD1 3.93Å; V624-F632 HydrophobicContact CG1-CD2 3.54Å; V624-F632 HydrophobicContact CG1-CE1 3.86Å; V624-F632 HydrophobicContact CG1-CE2 3.47Å; V624-F632 VanDerWaalsContact CG1-CE2 3.47Å; V624-F632 HydrophobicContact CG1-CG 3.79Å; V624-F632 HydrophobicContact CG1-CZ 3.63Å; V624-F632 HydrophobicContact CG2-CZ 4.46Å; F625-F632 HydrophobicContact CB-CD1 4.31Å; D628-F632 HydrophobicContact CB-CB 4.19Å; G629-F632 WeakPolarHBondContact O-CB 3.41Å; G629-F632 PolarHBondContact O-N 2.67Å; E630-F632 PolarHBondContact O-N 3.23Å; E630-F632 VanDerWaalsContact O-N 3.11Å; F632-R635 HydrophobicContact CD2-CB 4.46Å; F632-R635 PolarHBondContact O-N 2.85Å; F632-T636 VanDerWaalsContact CE1-OG1 3.29Å; F632-T636 WeakPolarHBondContact CE1-OG1 3.27Å; F632-T636 WeakPolarHBondContact O-CB 3.4Å; F632-T636 PolarHBondContact O-N 3.25Å; F632-T636 PolarHBondContact O-OG1 3.31Å; F632-F673 HydrophobicContact CZ-CE1 4.14Å; F632-F673 HydrophobicContact CZ-CZ 4.42Å; F632-I676 HydrophobicContact CE2-CG2 3.62Å; F632-I676 HydrophobicContact CZ-CD1 4.42Å; F632-I676 HydrophobicContact CZ-CG2 3.94Å
633	L	98.4	Very high	97.8	Very high	0 Å²	0	19 Å²	19	0%	0	9%	0.094	C	C	.	.	H	α-helix	trans	-67.8	-42.7	175.9	-57.7	177.4	0	0	0	110.6	I605 L608 Y609 V621 F625 E630 E631 T636 A637	I605-L633 HydrophobicContact CD1-CB 3.54Å; I605-L633 HydrophobicContact CG2-CD1 4.35Å; L608-L633 HydrophobicContact CB-CD2 4.26Å; L608-L633 HydrophobicContact CD2-CD1 4.23Å; L608-L633 HydrophobicContact CD2-CD2 4.36Å; L608-L633 HydrophobicContact CG-CD1 4.08Å; L608-L633 HydrophobicContact CG-CD2 4.33Å; Y609-L633 HydrophobicContact CD2-CD2 4.3Å; Y609-L633 HydrophobicContact CE2-CB 4.34Å; Y609-L633 HydrophobicContact CE2-CD2 4.21Å; Y609-L633 PolarHBondContact OH-O 2.92Å; V621-L633 HydrophobicContact CG1-CD2 4.39Å; F625-L633 HydrophobicContact CB-CD2 4.06Å; F625-L633 HydrophobicContact CD2-CD1 3.87Å; F625-L633 HydrophobicContact CD2-CD2 3.82Å; F625-L633 HydrophobicContact CD2-CG 3.65Å; F625-L633 HydrophobicContact CE2-CD1 3.87Å; F625-L633 HydrophobicContact CE2-CG 4.17Å; F625-L633 HydrophobicContact CG-CD2 4.04Å; F625-L633 HydrophobicContact CG-CG 4.38Å; E630-L633 WeakPolarHBondContact O-CB 3.39Å; E630-L633 PolarHBondContact O-N 2.92Å; E631-L633 VanDerWaalsContact C-N 3.32Å; E631-L633 PolarHBondContact O-N 3.4Å; L633-T636 WeakPolarHBondContact O-CB 3.11Å; L633-T636 PolarHBondContact O-N 3.09Å; L633-A637 PolarHBondContact O-N 3.36Å; L633-A637 VanDerWaalsContact O-N 3.12Å
634	F	98.5	Very high	97.8	Very high	0 Å²	0	20.6 Å²	20.6	0%	0	10%	0.1	C	C	.	.	H	α-helix	trans	-72.7	-33.8	175.8	-62.4	-81	0	0	0	112.2	Y571 F575 L601 I605 E630 E631 T636 A637 L638 M681 W688	Y571-F634 HydrophobicContact CD1-CE1 4.48Å; Y571-F634 AromaticContact CD1-CE2 3.75Å; Y571-F634 HydrophobicContact CD1-CE2 3.75Å; Y571-F634 AromaticContact CD1-CZ 3.53Å; Y571-F634 HydrophobicContact CD1-CZ 3.53Å; Y571-F634 HydrophobicContact CE1-CE2 4.09Å; Y571-F634 HydrophobicContact CE1-CZ 4.26Å; Y571-F634 HydrophobicContact CG-CZ 4.05Å; F575-F634 HydrophobicContact CB-CD1 3.96Å; F575-F634 HydrophobicContact CB-CE1 4.47Å; F575-F634 HydrophobicContact CD2-CB 4.32Å; F575-F634 HydrophobicContact CD2-CD1 4.01Å; F575-F634 HydrophobicContact CG-CD1 4.31Å; L601-F634 HydrophobicContact CD2-CD1 4.2Å; L601-F634 HydrophobicContact CD2-CE1 4.14Å; I605-F634 HydrophobicContact CD1-CD1 3.79Å; I605-F634 HydrophobicContact CD1-CD2 4.32Å; I605-F634 HydrophobicContact CD1-CE1 3.74Å; I605-F634 HydrophobicContact CD1-CE2 4.25Å; I605-F634 HydrophobicContact CD1-CG 4.1Å; I605-F634 HydrophobicContact CD1-CZ 3.98Å; I605-F634 HydrophobicContact CG1-CD1 4.25Å; I605-F634 HydrophobicContact CG1-CE1 3.76Å; I605-F634 HydrophobicContact CG1-CZ 4.01Å; I605-F634 HydrophobicContact CG2-CE2 4.38Å; I605-F634 HydrophobicContact CG2-CZ 3.92Å; E630-F634 VanDerWaalsContact O-CD2 3.3Å; E630-F634 WeakPolarHBondContact O-CD2 3.08Å; E631-F634 PolarHBondContact O-N 3.5Å; F634-T636 VanDerWaalsContact C-N 3.31Å; F634-T636 PolarHBondContact O-N 3.47Å; F634-A637 WeakPolarHBondContact O-CB 3.47Å; F634-A637 PolarHBondContact O-N 2.9Å; F634-L638 PolarHBondContact O-N 3.45Å; F634-L638 VanDerWaalsContact O-N 3.14Å; F634-M681 HydrophobicContact CB-CE 4.18Å; F634-W688 HydrophobicContact CB-CE3 4.44Å; F634-W688 HydrophobicContact CB-CH2 3.84Å; F634-W688 HydrophobicContact CB-CZ2 4.41Å; F634-W688 HydrophobicContact CB-CZ3 3.84Å; F634-W688 AromaticContact CD1-CH2 3.7Å; F634-W688 HydrophobicContact CD1-CH2 3.7Å; F634-W688 HydrophobicContact CD1-CZ2 4.35Å; F634-W688 HydrophobicContact CD1-CZ3 4.39Å; F634-W688 AromaticContact CD2-CE2 3.92Å; F634-W688 AromaticContact CD2-CH2 3.33Å; F634-W688 HydrophobicContact CD2-CH2 3.33Å; F634-W688 AromaticContact CD2-CZ2 3.18Å; F634-W688 HydrophobicContact CD2-CZ2 3.18Å; F634-W688 HydrophobicContact CD2-CZ3 4.14Å; F634-W688 HydrophobicContact CE1-CH2 4.06Å; F634-W688 HydrophobicContact CE1-CZ2 4.47Å; F634-W688 AromaticContact CE2-CH2 3.75Å; F634-W688 HydrophobicContact CE2-CH2 3.75Å; F634-W688 AromaticContact CE2-CZ2 3.38Å; F634-W688 HydrophobicContact CE2-CZ2 3.38Å; F634-W688 AromaticContact CG-CH2 3.31Å; F634-W688 HydrophobicContact CG-CH2 3.31Å; F634-W688 AromaticContact CG-CZ2 3.73Å; F634-W688 HydrophobicContact CG-CZ2 3.73Å; F634-W688 AromaticContact CG-CZ3 3.86Å; F634-W688 HydrophobicContact CG-CZ3 3.86Å; F634-W688 HydrophobicContact CZ-CH2 4.09Å; F634-W688 HydrophobicContact CZ-CZ2 4.04Å
635	R	98.8	Very high	97.7	Very high	45 Å²	45	23 Å²	23	17%	0.17	11%	0.112	C	C	.	.	H	α-helix	trans	-62.5	-38.1	169.7	-163.1	-174.1	-179.5	-179.2	2	112.2	E631 F632 L638 G639 I676 A677 V679 M681	E631-R635 WeakPolarHBondContact O-CB 3.49Å; E631-R635 PolarHBondContact O-N 3.2Å; F632-R635 HydrophobicContact CD2-CB 4.46Å; F632-R635 PolarHBondContact O-N 2.85Å; R635-L638 PolarHBondContact O-N 3.33Å; R635-G639 PolarHBondContact O-N 2.99Å; R635-I676 HydrophobicContact CG-CG2 3.91Å; R635-I676 PolarHBondContact NE-O 3.09Å; R635-I676 PolarHBondContact NH2-O 2.77Å; R635-A677 PolarHBondContact NH2-O 2.92Å; R635-V679 HydrophobicContact CG-CB 3.87Å; R635-V679 HydrophobicContact CG-CG1 3.78Å; R635-V679 PolarHBondContact NE-O 2.78Å; R635-V679 PolarHBondContact NH2-O 2.86Å; R635-M681 HydrophobicContact CB-CE 4.32Å; R635-M681 HydrophobicContact CB-CG 3.88Å; R635-M681 HydrophobicContact CB-SD 3.72Å; R635-M681 HydrophobicContact CG-CG 3.74Å; R635-M681 HydrophobicContact CG-SD 3.84Å
636	T	98.8	Very high	97.7	Very high	0 Å²	0	28.4 Å²	28.4	0%	0	14%	0.141	C	C	.	.	H	α-helix	trans	-63.4	-43	175	-61.2	0	0	0	0	110.9	Y609 V621 F632 L633 F634 L638 G639 V640 I676	Y609-T636 HydrophobicContact CD1-CG2 4.33Å; Y609-T636 HydrophobicContact CD2-CG2 4.14Å; Y609-T636 HydrophobicContact CE1-CG2 3.88Å; Y609-T636 HydrophobicContact CE2-CG2 3.69Å; Y609-T636 HydrophobicContact CG-CG2 4.46Å; V621-T636 HydrophobicContact CG1-CG2 4.16Å; V621-T636 HydrophobicContact CG2-CG2 3.93Å; F632-T636 VanDerWaalsContact CE1-OG1 3.29Å; F632-T636 WeakPolarHBondContact CE1-OG1 3.27Å; F632-T636 WeakPolarHBondContact O-CB 3.4Å; F632-T636 PolarHBondContact O-N 3.25Å; F632-T636 PolarHBondContact O-OG1 3.31Å; L633-T636 WeakPolarHBondContact O-CB 3.11Å; L633-T636 PolarHBondContact O-N 3.09Å; F634-T636 VanDerWaalsContact C-N 3.31Å; F634-T636 PolarHBondContact O-N 3.47Å; T636-L638 PolarHBondContact O-N 3.5Å; T636-G639 WeakPolarHBondContact O-CA 3.43Å; T636-G639 PolarHBondContact O-N 3.19Å; T636-V640 PolarHBondContact O-N 3.28Å; T636-I676 HydrophobicContact CG2-CD1 4.03Å
637	A	98.8	Very high	97.7	Very high	0 Å²	0	30.6 Å²	30.6	0%	0	15%	0.154	C	C	.	.	H	α-helix	trans	-59.4	-46.2	176.6	0	0	0	0	0	111.6	F575 L601 W604 Y609 L633 F634 G639 V640 L641	F575-A637 HydrophobicContact CE2-CB 3.73Å; F575-A637 HydrophobicContact CZ-CB 4.37Å; L601-A637 HydrophobicContact CD1-CB 3.51Å; W604-A637 HydrophobicContact CE3-CB 3.69Å; W604-A637 HydrophobicContact CZ3-CB 3.78Å; Y609-A637 VanDerWaalsContact OH-CA 3.29Å; Y609-A637 WeakPolarHBondContact OH-CA 3.49Å; Y609-A637 VanDerWaalsContact OH-CB 3.31Å; Y609-A637 WeakPolarHBondContact OH-CB 3.23Å; Y609-A637 PolarHBondContact OH-N 3.3Å; L633-A637 PolarHBondContact O-N 3.36Å; L633-A637 VanDerWaalsContact O-N 3.12Å; F634-A637 WeakPolarHBondContact O-CB 3.47Å; F634-A637 PolarHBondContact O-N 2.9Å; A637-G639 VanDerWaalsContact C-N 3.28Å; A637-G639 PolarHBondContact O-N 3.03Å; A637-V640 PolarHBondContact O-N 2.87Å; A637-L641 WeakPolarHBondContact O-CG 3.5Å; A637-L641 PolarHBondContact O-N 3.07Å
638	L	98.8	Very high	97.9	Very high	0 Å²	0	28.8 Å²	28.8	0%	0	15%	0.147	C	C	.	.	H	α-helix	trans	-64.5	-32.3	174.8	-65.7	179.1	0	0	0	112.5	F575 F578 F579 F634 R635 T636 R642 V679 M681	F575-L638 HydrophobicContact CD2-CD2 4.32Å; F575-L638 HydrophobicContact CD2-CG 4.4Å; F575-L638 HydrophobicContact CE2-CD2 3.54Å; F575-L638 HydrophobicContact CE2-CG 3.81Å; F575-L638 HydrophobicContact CZ-CD2 3.88Å; F578-L638 HydrophobicContact CB-CD1 3.74Å; F579-L638 HydrophobicContact CB-CD2 3.71Å; F579-L638 HydrophobicContact CD2-CD2 3.93Å; F579-L638 HydrophobicContact CG-CD2 3.96Å; F634-L638 PolarHBondContact O-N 3.45Å; F634-L638 VanDerWaalsContact O-N 3.14Å; R635-L638 PolarHBondContact O-N 3.33Å; T636-L638 PolarHBondContact O-N 3.5Å; L638-R642 WeakPolarHBondContact O-CB 3.35Å; L638-R642 PolarHBondContact O-N 3.23Å; L638-V679 HydrophobicContact CB-CB 4.43Å; L638-V679 HydrophobicContact CB-CG1 3.79Å; L638-V679 HydrophobicContact CB-CG2 3.71Å; L638-V679 HydrophobicContact CD1-CG1 3.68Å; L638-V679 HydrophobicContact CG-CG1 4.38Å; L638-M681 HydrophobicContact CD1-SD 4.14Å
639	G	98.7	Very high	98	Very high	0 Å²	0	29.6 Å²	29.6	0%	0	15%	0.153	C	C	.	.	H	α-helix	trans	-64.8	-44.9	172.4	0	0	0	0	0	113.1	R635 T636 A637 R642 L643	R635-G639 PolarHBondContact O-N 2.99Å; T636-G639 WeakPolarHBondContact O-CA 3.43Å; T636-G639 PolarHBondContact O-N 3.19Å; A637-G639 VanDerWaalsContact C-N 3.28Å; A637-G639 PolarHBondContact O-N 3.03Å; G639-R642 PolarHBondContact O-N 2.96Å; G639-L643 WeakPolarHBondContact O-CB 3.44Å; G639-L643 PolarHBondContact O-N 2.54Å
640	V	98.7	Very high	98.1	Very high	1 Å²	1	33 Å²	33	1%	0.006	17%	0.172	C	C	.	.	H	α-helix	trans	-62.3	-47.6	174.8	175	0	0	0	0	110.7	W604 T636 A637 R642 L643 Y644 L663 L672	W604-V640 HydrophobicContact CH2-CB 4.14Å; W604-V640 HydrophobicContact CH2-CG1 3.71Å; W604-V640 HydrophobicContact CZ2-CG1 4.21Å; W604-V640 HydrophobicContact CZ3-CB 4.23Å; W604-V640 HydrophobicContact CZ3-CG1 4.29Å; T636-V640 PolarHBondContact O-N 3.28Å; A637-V640 PolarHBondContact O-N 2.87Å; V640-R642 VanDerWaalsContact C-N 3.28Å; V640-R642 PolarHBondContact O-N 2.89Å; V640-L643 PolarHBondContact O-N 2.99Å; V640-Y644 HydrophobicContact CG1-CD2 4.05Å; V640-Y644 HydrophobicContact CG1-CE2 4.28Å; V640-Y644 WeakPolarHBondContact O-CD2 3.18Å; V640-Y644 PolarHBondContact O-N 3.06Å; V640-Y644 VanDerWaalsContact O-N 3.12Å; V640-L663 HydrophobicContact CG1-CD1 3.93Å; V640-L663 HydrophobicContact CG1-CD2 3.72Å; V640-L672 HydrophobicContact CB-CD1 4.42Å; V640-L672 HydrophobicContact CG2-CD1 3.73Å; V640-L672 HydrophobicContact CG2-CD2 4.31Å
641	L	98.6	Very high	98.2	Very high	0 Å²	0	33.2 Å²	33.2	0%	0	17%	0.174	C	C	.	.	H	α-helix	trans	-63.2	-32.8	177	-68.6	177.3	0	0	0	112.7	F575 F579 L583 L586 F590 Y600 W604 A637 Q645 L648 L660	F575-L641 HydrophobicContact CZ-CD1 3.85Å; F579-L641 HydrophobicContact CD1-CD1 4.49Å; F579-L641 HydrophobicContact CD2-CD1 4.39Å; F579-L641 HydrophobicContact CE1-CD1 4.11Å; F579-L641 HydrophobicContact CE2-CD1 4.01Å; F579-L641 HydrophobicContact CZ-CD1 3.86Å; L583-L641 HydrophobicContact CD1-CB 3.84Å; L586-L641 HydrophobicContact CD2-CB 4.04Å; L586-L641 WeakPolarHBondContact CD2-O 3.48Å; F590-L641 HydrophobicContact CE2-CD1 4.49Å; F590-L641 HydrophobicContact CE2-CD2 3.97Å; F590-L641 HydrophobicContact CZ-CD2 3.72Å; Y600-L641 HydrophobicContact CE2-CD1 4.3Å; W604-L641 HydrophobicContact CH2-CD2 4.38Å; A637-L641 WeakPolarHBondContact O-CG 3.5Å; A637-L641 PolarHBondContact O-N 3.07Å; L641-Q645 VanDerWaalsContact O-CA 3.31Å; L641-Q645 WeakPolarHBondContact O-CA 3.35Å; L641-Q645 PolarHBondContact O-N 3.31Å; L641-Q645 VanDerWaalsContact O-N 3.09Å; L641-L648 HydrophobicContact CD2-CD1 3.83Å; L641-L660 HydrophobicContact CD2-CD1 4.21Å; L641-L660 HydrophobicContact CD2-CD2 3.71Å
642	R	98.6	Very high	98.2	Very high	82 Å²	82	33.9 Å²	33.9	31%	0.309	18%	0.179	S	C	.	.	H	α-helix	trans	-73.6	-35	174.2	-167.5	-174.4	-175.6	101.5	-0.4	112.4	L583 L638 G639 V640 H675	L583-R642 HydrophobicContact CD1-CB 4.23Å; L583-R642 HydrophobicContact CD2-CB 3.82Å; L583-R642 HydrophobicContact CD2-CG 3.71Å; L638-R642 WeakPolarHBondContact O-CB 3.35Å; L638-R642 PolarHBondContact O-N 3.23Å; G639-R642 PolarHBondContact O-N 2.96Å; V640-R642 VanDerWaalsContact C-N 3.28Å; V640-R642 PolarHBondContact O-N 2.89Å; R642-H675 VanDerWaalsContact C-ND1 3.29Å; R642-H675 HydrophobicContact CB-CB 4.4Å; R642-H675 WeakPolarHBondContact CG-ND1 3.27Å; R642-H675 PolarHBondContact O-CE1 3.22Å; R642-H675 PolarHBondContact O-ND1 3.19Å
643	L	98.4	Very high	98.2	Very high	30 Å²	30	37.8 Å²	37.8	16%	0.157	20%	0.197	C	C	.	.	H	α-helix	trans	-65.5	-40.9	177.7	178.4	62.7	0	0	0	111.2	G639 V640 I667 Q671 L672 H675	G639-L643 WeakPolarHBondContact O-CB 3.44Å; G639-L643 PolarHBondContact O-N 2.54Å; V640-L643 PolarHBondContact O-N 2.99Å; L643-I667 HydrophobicContact CD2-CG2 3.78Å; L643-Q671 HydrophobicContact CD1-CB 4.17Å; L643-L672 HydrophobicContact CD2-CB 4.23Å; L643-L672 HydrophobicContact CD2-CD1 4.18Å; L643-H675 WeakPolarHBondContact CA-ND1 3.1Å; L643-H675 HydrophobicContact CB-CB 4.44Å; L643-H675 PolarHBondContact N-ND1 3.17Å
644	Y	98.2	Very high	98.2	Very high	34 Å²	34	42.4 Å²	42.4	13%	0.133	22%	0.22	C	C	.	.	S	Bend	trans	-101.7	15.3	-179	-60.6	-65.2	0	0	0	114.1	V640 D646 V647 L648 F659 P664	V640-Y644 HydrophobicContact CG1-CD2 4.05Å; V640-Y644 HydrophobicContact CG1-CE2 4.28Å; V640-Y644 WeakPolarHBondContact O-CD2 3.18Å; V640-Y644 PolarHBondContact O-N 3.06Å; V640-Y644 VanDerWaalsContact O-N 3.12Å; Y644-D646 VanDerWaalsContact C-N 3.33Å; Y644-D646 PolarHBondContact O-N 3.36Å; Y644-V647 PolarHBondContact O-N 3.23Å; Y644-V647 VanDerWaalsContact O-N 3.17Å; Y644-L648 WeakPolarHBondContact O-CB 3.34Å; Y644-L648 VanDerWaalsContact O-CG 3.32Å; Y644-L648 WeakPolarHBondContact O-CG 3.29Å; Y644-L648 PolarHBondContact O-N 3.01Å; Y644-F659 HydrophobicContact CD1-CE1 4.06Å; Y644-F659 AromaticContact CD1-CZ 3.59Å; Y644-F659 HydrophobicContact CD1-CZ 3.59Å; Y644-F659 AromaticContact CD2-CE1 3.75Å; Y644-F659 HydrophobicContact CD2-CE1 3.75Å; Y644-F659 HydrophobicContact CD2-CZ 4.02Å; Y644-F659 AromaticContact CE1-CZ 3.92Å; Y644-F659 HydrophobicContact CE1-CZ 3.92Å; Y644-F659 HydrophobicContact CE2-CE1 4.33Å; Y644-F659 HydrophobicContact CE2-CZ 4.32Å; Y644-F659 AromaticContact CG-CE1 3.59Å; Y644-F659 HydrophobicContact CG-CE1 3.59Å; Y644-F659 AromaticContact CG-CZ 3.64Å; Y644-F659 HydrophobicContact CG-CZ 3.64Å; Y644-P664 HydrophobicContact CE1-CG 4.37Å
645	Q	98	Very high	98.2	Very high	50 Å²	50	47.1 Å²	47.1	23%	0.234	24%	0.242	C	C	.	.	H	α-helix	trans	-52.4	-47.5	-172.2	-173.4	-167.2	-89.4	0	0	113	L586 L641 L648 T649	L586-Q645 HydrophobicContact CB-CG 4.18Å; L586-Q645 HydrophobicContact CD1-CG 4.41Å; L586-Q645 HydrophobicContact CD2-CB 4.5Å; L586-Q645 HydrophobicContact CD2-CG 4.18Å; L586-Q645 HydrophobicContact CG-CG 4.5Å; L641-Q645 VanDerWaalsContact O-CA 3.31Å; L641-Q645 WeakPolarHBondContact O-CA 3.35Å; L641-Q645 PolarHBondContact O-N 3.31Å; L641-Q645 VanDerWaalsContact O-N 3.09Å; Q645-L648 PolarHBondContact O-N 3.47Å; Q645-T649 WeakPolarHBondContact O-CB 3.38Å; Q645-T649 PolarHBondContact O-N 2.8Å; Q645-T649 PolarHBondContact O-OG1 2.74Å
646	D	96.8	Very high	98.2	Very high	128 Å²	128	45 Å²	45	68%	0.684	23%	0.234	S	C	*	.	H	α-helix	trans	-72.8	-31.9	-173.4	-58.2	-29.4	0	0	0	111.8	Y644	Y644-D646 VanDerWaalsContact C-N 3.33Å; Y644-D646 PolarHBondContact O-N 3.36Å
647	V	97.2	Very high	98.1	Very high	65 Å²	65	45.7 Å²	45.7	39%	0.394	24%	0.24	S	C	.	.	H	α-helix	trans	-70	-47.6	172.3	177.9	0	0	0	0	110.6	Y644 T649 S650 M651	Y644-V647 PolarHBondContact O-N 3.23Å; Y644-V647 VanDerWaalsContact O-N 3.17Å; V647-T649 VanDerWaalsContact C-N 3.27Å; V647-T649 PolarHBondContact O-N 3.47Å; V647-S650 PolarHBondContact O-N 3.1Å; V647-S650 PolarHBondContact O-OG 3.1Å; V647-M651 HydrophobicContact CG1-CE 3.59Å; V647-M651 HydrophobicContact CG1-SD 4.24Å; V647-M651 WeakPolarHBondContact O-CG 3.38Å
648	L	98.4	Very high	98.1	Very high	0 Å²	0	51.3 Å²	51.3	0%	0	27%	0.266	C	S	.	.	H	α-helix	trans	-65.5	-30.2	179.6	-68.2	166	0	0	0	112.4	L586 H589 F590 L641 Y644 Q645 S650 M651 M656 F659 L660	L586-L648 HydrophobicContact CD1-CB 3.75Å; L586-L648 HydrophobicContact CD2-CD1 4.25Å; H589-L648 PolarHBondContact CD2-O 3.48Å; H589-L648 PolarHBondContact NE2-O 3.35Å; H589-L648 VanDerWaalsContact NE2-O 3.16Å; F590-L648 HydrophobicContact CE1-CB 4.38Å; F590-L648 HydrophobicContact CZ-CD1 4.35Å; L641-L648 HydrophobicContact CD2-CD1 3.83Å; Y644-L648 WeakPolarHBondContact O-CB 3.34Å; Y644-L648 VanDerWaalsContact O-CG 3.32Å; Y644-L648 WeakPolarHBondContact O-CG 3.29Å; Y644-L648 PolarHBondContact O-N 3.01Å; Q645-L648 PolarHBondContact O-N 3.47Å; L648-S650 VanDerWaalsContact C-N 3.3Å; L648-S650 PolarHBondContact O-N 2.99Å; L648-M651 HydrophobicContact CD2-SD 4.38Å; L648-M651 PolarHBondContact O-N 3.16Å; L648-M656 HydrophobicContact CD2-CB 4.3Å; L648-M656 HydrophobicContact CD2-CG 4Å; L648-M656 VanDerWaalsContact O-SD 3.37Å; L648-F659 HydrophobicContact CD2-CD1 3.86Å; L648-F659 HydrophobicContact CD2-CE1 4.48Å; L648-L660 HydrophobicContact CD1-CD2 4.07Å; L648-L660 HydrophobicContact CD2-CD1 4.31Å; L648-L660 HydrophobicContact CD2-CD2 3.95Å; L648-L660 HydrophobicContact CD2-CG 4.03Å
649	T	98	Very high	98	Very high	61 Å²	61	53.1 Å²	53.1	37%	0.374	27%	0.274	S	S	.	.	H	α-helix	trans	-70.8	-22.5	178.5	-56.4	0	0	0	0	112.9	H589 Q645 V647	H589-T649 PolarHBondContact CE1-O 3.14Å; H589-T649 PolarHBondContact NE2-O 2.92Å; Q645-T649 WeakPolarHBondContact O-CB 3.38Å; Q645-T649 PolarHBondContact O-N 2.8Å; Q645-T649 PolarHBondContact O-OG1 2.74Å; V647-T649 VanDerWaalsContact C-N 3.27Å; V647-T649 PolarHBondContact O-N 3.47Å
650	S	97.4	Very high	98	Very high	103 Å²	103	53.1 Å²	53.1	72%	0.72	27%	0.274	S	S	*	.	H	α-helix	trans	-89.7	-12.1	174.8	68	0	0	0	0	114	V647 L648	V647-S650 PolarHBondContact O-N 3.1Å; V647-S650 PolarHBondContact O-OG 3.1Å; L648-S650 VanDerWaalsContact C-N 3.3Å; L648-S650 PolarHBondContact O-N 2.99Å
651	M	98.3	Very high	97.8	Very high	44 Å²	44	56.9 Å²	56.9	22%	0.217	30%	0.297	C	S	.	.			trans	-88	154.3	-177.8	-73.1	175.7	171.3	0	0	113.5	H589 V647 L648 H655 M656 F659	H589-M651 PolarHBondContact CE1-O 3.46Å; H589-M651 PolarHBondContact NE2-O 2.75Å; V647-M651 HydrophobicContact CG1-CE 3.59Å; V647-M651 HydrophobicContact CG1-SD 4.24Å; V647-M651 WeakPolarHBondContact O-CG 3.38Å; L648-M651 HydrophobicContact CD2-SD 4.38Å; L648-M651 PolarHBondContact O-N 3.16Å; M651-H655 HydrophobicContact CB-CB 3.95Å; M651-H655 HydrophobicContact CG-CB 3.88Å; M651-H655 HydrophobicContact SD-CB 4.18Å; M651-M656 HydrophobicContact CB-CG 3.48Å; M651-M656 VanDerWaalsContact CB-CG 3.48Å; M651-M656 HydrophobicContact SD-CG 4.43Å; M651-F659 HydrophobicContact CE-CB 4.37Å; M651-F659 HydrophobicContact CE-CD2 4.05Å; M651-F659 HydrophobicContact CE-CG 4.36Å; M651-F659 HydrophobicContact SD-CB 4.15Å; M651-F659 HydrophobicContact SD-CG 4.42Å
652	D	97.6	Very high	97.6	Very high	68 Å²	68	66.2 Å²	66.2	36%	0.364	33%	0.332	S	S	.	.			trans	-85.9	-178.8	167.2	69.2	25.6	0	0	0	112.3	I654 H655 M656	D652-I654 VanDerWaalsContact C-N 3.31Å; D652-I654 PolarHBondContact O-N 2.68Å; D652-I654 WeakPolarHBondContact OD1-CA 3.31Å; D652-I654 PolarHBondContact OD1-N 3.07Å; D652-H655 IonicContact OD1-CE1 3.13Å; D652-H655 IonicContact OD1-CG 3.96Å; D652-H655 PolarHBondContact OD1-N 3.42Å; D652-H655 IonicContact OD1-ND1 3.91Å; D652-H655 PolarHBondContact OD1-ND1 2.89Å; D652-H655 IonicContact OD2-CE1 2.67Å; D652-H655 IonicContact OD2-ND1 2.76Å; D652-H655 PolarHBondContact OD2-ND1 3.14Å; D652-H655 VanDerWaalsContact OD2-ND1 3.14Å; D652-M656 WeakPolarHBondContact O-CB 3.32Å; D652-M656 WeakPolarHBondContact O-CE 3.49Å; D652-M656 VanDerWaalsContact O-CG 3.29Å; D652-M656 WeakPolarHBondContact O-CG 3.33Å; D652-M656 PolarHBondContact O-N 3.27Å
653	F	98.1	Very high	97.5	Very high	83 Å²	83	62.9 Å²	62.9	36%	0.364	32%	0.32	S	S	.	.	H	α-helix	trans	-50.1	-45.4	175.2	173.1	-97.6	0	0	0	114.1	N593 L595 I599 A657	N593-F653 HydrophobicContact CB-CB 4.29Å; N593-F653 VanDerWaalsContact O-CD2 3.28Å; N593-F653 WeakPolarHBondContact O-CD2 3.28Å; L595-F653 HydrophobicContact CB-CD2 4.19Å; L595-F653 HydrophobicContact CD1-CD2 3.98Å; L595-F653 HydrophobicContact CD1-CE2 3.99Å; I599-F653 HydrophobicContact CD1-CE2 3.69Å; I599-F653 HydrophobicContact CD1-CZ 3.95Å; F653-A657 WeakPolarHBondContact O-CB 3.46Å; F653-A657 PolarHBondContact O-N 3.21Å
654	I	97.8	Very high	97.2	Very high	96 Å²	96	63.7 Å²	63.7	49%	0.492	33%	0.328	S	S	.	.	H	α-helix	trans	-72.1	-48.2	-172.4	-59.7	177.9	0	0	0	109.6	D652 A657 Q658	D652-I654 VanDerWaalsContact C-N 3.31Å; D652-I654 PolarHBondContact O-N 2.68Å; D652-I654 WeakPolarHBondContact OD1-CA 3.31Å; D652-I654 PolarHBondContact OD1-N 3.07Å; I654-A657 PolarHBondContact O-N 3.34Å; I654-Q658 WeakPolarHBondContact O-CG 3.36Å; I654-Q658 PolarHBondContact O-N 2.82Å
655	H	98.3	Very high	96.7	Very high	99 Å²	99	68.6 Å²	68.6	46%	0.458	36%	0.356	S	S	.	.	H	α-helix	trans	-67.7	-40.3	-178.4	-64.7	87.4	0	0	0	111.4	M651 D652 Q658 F659	M651-H655 HydrophobicContact CB-CB 3.95Å; M651-H655 HydrophobicContact CG-CB 3.88Å; M651-H655 HydrophobicContact SD-CB 4.18Å; D652-H655 IonicContact OD1-CE1 3.13Å; D652-H655 IonicContact OD1-CG 3.96Å; D652-H655 PolarHBondContact OD1-N 3.42Å; D652-H655 IonicContact OD1-ND1 3.91Å; D652-H655 PolarHBondContact OD1-ND1 2.89Å; D652-H655 IonicContact OD2-CE1 2.67Å; D652-H655 IonicContact OD2-ND1 2.76Å; D652-H655 PolarHBondContact OD2-ND1 3.14Å; D652-H655 VanDerWaalsContact OD2-ND1 3.14Å; H655-Q658 PolarHBondContact O-N 2.62Å; H655-F659 VanDerWaalsContact O-CB 3.27Å; H655-F659 WeakPolarHBondContact O-CB 3.31Å; H655-F659 PolarHBondContact O-N 2.92Å
656	M	98.4	Very high	96.3	Very high	0 Å²	0	73.1 Å²	73.1	0%	0	38%	0.381	C	S	.	.	H	α-helix	trans	-63.3	-44.3	172.1	-70.8	-172.1	-78.1	0	0	112.1	F590 N593 L595 L648 M651 D652 Q658 F659 L660	F590-M656 HydrophobicContact CD1-SD 3.74Å; F590-M656 HydrophobicContact CE1-SD 3.46Å; F590-M656 WeakPolarHBondContact CE1-SD 3.06Å; F590-M656 HydrophobicContact CZ-SD 4.31Å; N593-M656 HydrophobicContact CB-CE 3.68Å; L595-M656 HydrophobicContact CD2-CB 3.47Å; L595-M656 VanDerWaalsContact CD2-CB 3.47Å; L595-M656 HydrophobicContact CD2-CE 4.02Å; L595-M656 HydrophobicContact CD2-CG 4.21Å; L595-M656 HydrophobicContact CD2-SD 3.75Å; L648-M656 HydrophobicContact CD2-CB 4.3Å; L648-M656 HydrophobicContact CD2-CG 4Å; L648-M656 VanDerWaalsContact O-SD 3.37Å; M651-M656 HydrophobicContact CB-CG 3.48Å; M651-M656 VanDerWaalsContact CB-CG 3.48Å; M651-M656 HydrophobicContact SD-CG 4.43Å; D652-M656 WeakPolarHBondContact O-CB 3.32Å; D652-M656 WeakPolarHBondContact O-CE 3.49Å; D652-M656 VanDerWaalsContact O-CG 3.29Å; D652-M656 WeakPolarHBondContact O-CG 3.33Å; D652-M656 PolarHBondContact O-N 3.27Å; M656-Q658 PolarHBondContact O-N 3.22Å; M656-F659 PolarHBondContact O-N 3.02Å; M656-L660 WeakPolarHBondContact O-CB 3.43Å; M656-L660 VanDerWaalsContact O-CG 3.24Å; M656-L660 WeakPolarHBondContact O-CG 3.4Å; M656-L660 PolarHBondContact O-N 3.15Å
657	A	97.8	Very high	96.2	Very high	16 Å²	16	67.6 Å²	67.6	13%	0.132	35%	0.351	C	S	.	.	H	α-helix	trans	-62.3	-42.2	179.1	0	0	0	0	0	112	L595 I599 F653 I654 T661	L595-A657 HydrophobicContact CD1-CB 3.99Å; I599-A657 HydrophobicContact CG2-CB 3.89Å; F653-A657 WeakPolarHBondContact O-CB 3.46Å; F653-A657 PolarHBondContact O-N 3.21Å; I654-A657 PolarHBondContact O-N 3.34Å; A657-T661 WeakPolarHBondContact O-CB 3.41Å; A657-T661 WeakPolarHBondContact O-CG2 3.43Å; A657-T661 PolarHBondContact O-N 3.49Å; A657-T661 VanDerWaalsContact O-N 3.11Å; A657-T661 PolarHBondContact O-OG1 3.23Å
658	Q	97.3	Very high	96	Very high	117 Å²	117	67.1 Å²	67.1	55%	0.547	35%	0.35	S	S	.	.	H	α-helix	trans	-64.1	-46.8	174.8	-71.6	175.1	1.2	0	0	111.9	I654 H655 M656 L660 T661 R662	I654-Q658 WeakPolarHBondContact O-CG 3.36Å; I654-Q658 PolarHBondContact O-N 2.82Å; H655-Q658 PolarHBondContact O-N 2.62Å; M656-Q658 PolarHBondContact O-N 3.22Å; Q658-L660 PolarHBondContact O-N 3.31Å; Q658-T661 PolarHBondContact O-N 3.31Å; Q658-T661 PolarHBondContact O-OG1 3.01Å; Q658-R662 PolarHBondContact O-N 3.35Å
659	F	97.8	Very high	95.8	Very high	39 Å²	39	69.3 Å²	69.3	17%	0.171	36%	0.364	C	S	.	.	H	α-helix	trans	-63.9	-37.6	-179.7	-174.6	-85.5	0	0	0	113.2	Y644 L648 M651 H655 M656 R662 L663 P664	Y644-F659 HydrophobicContact CD1-CE1 4.06Å; Y644-F659 AromaticContact CD1-CZ 3.59Å; Y644-F659 HydrophobicContact CD1-CZ 3.59Å; Y644-F659 AromaticContact CD2-CE1 3.75Å; Y644-F659 HydrophobicContact CD2-CE1 3.75Å; Y644-F659 HydrophobicContact CD2-CZ 4.02Å; Y644-F659 AromaticContact CE1-CZ 3.92Å; Y644-F659 HydrophobicContact CE1-CZ 3.92Å; Y644-F659 HydrophobicContact CE2-CE1 4.33Å; Y644-F659 HydrophobicContact CE2-CZ 4.32Å; Y644-F659 AromaticContact CG-CE1 3.59Å; Y644-F659 HydrophobicContact CG-CE1 3.59Å; Y644-F659 AromaticContact CG-CZ 3.64Å; Y644-F659 HydrophobicContact CG-CZ 3.64Å; L648-F659 HydrophobicContact CD2-CD1 3.86Å; L648-F659 HydrophobicContact CD2-CE1 4.48Å; M651-F659 HydrophobicContact CE-CB 4.37Å; M651-F659 HydrophobicContact CE-CD2 4.05Å; M651-F659 HydrophobicContact CE-CG 4.36Å; M651-F659 HydrophobicContact SD-CB 4.15Å; M651-F659 HydrophobicContact SD-CG 4.42Å; H655-F659 VanDerWaalsContact O-CB 3.27Å; H655-F659 WeakPolarHBondContact O-CB 3.31Å; H655-F659 PolarHBondContact O-N 2.92Å; M656-F659 PolarHBondContact O-N 3.02Å; F659-R662 CarbonylContact O-C 3.5Å; F659-L663 HydrophobicContact CE1-CD2 4.23Å; F659-L663 WeakPolarHBondContact O-CA 3.32Å; F659-L663 PolarHBondContact O-N 3Å; F659-P664 HydrophobicContact CE2-CG 4.02Å; F659-P664 HydrophobicContact CZ-CG 3.94Å
660	L	97.7	Very high	95.7	Very high	0 Å²	0	72 Å²	72	0%	0	37%	0.372	C	S	.	.	H	α-helix	trans	-82.5	-25.2	-178.6	-62.7	171.7	0	0	0	113.2	F590 L595 Y600 W604 L641 L648 M656 Q658 L663	F590-L660 HydrophobicContact CE2-CD1 3.96Å; F590-L660 HydrophobicContact CZ-CD1 3.79Å; L595-L660 HydrophobicContact CD2-CD1 4Å; Y600-L660 HydrophobicContact CD1-CB 4.49Å; Y600-L660 HydrophobicContact CD1-CD1 3.87Å; Y600-L660 HydrophobicContact CD2-CD1 4.45Å; Y600-L660 HydrophobicContact CE1-CD1 4.2Å; Y600-L660 HydrophobicContact CG-CB 4.01Å; Y600-L660 HydrophobicContact CG-CD1 4.02Å; W604-L660 HydrophobicContact CH2-CD2 3.92Å; W604-L660 HydrophobicContact CZ2-CB 4.19Å; W604-L660 HydrophobicContact CZ2-CD2 4.01Å; W604-L660 PolarHBondContact NE1-O 3.33Å; W604-L660 VanDerWaalsContact NE1-O 3.15Å; L641-L660 HydrophobicContact CD2-CD1 4.21Å; L641-L660 HydrophobicContact CD2-CD2 3.71Å; L648-L660 HydrophobicContact CD1-CD2 4.07Å; L648-L660 HydrophobicContact CD2-CD1 4.31Å; L648-L660 HydrophobicContact CD2-CD2 3.95Å; L648-L660 HydrophobicContact CD2-CG 4.03Å; M656-L660 WeakPolarHBondContact O-CB 3.43Å; M656-L660 VanDerWaalsContact O-CG 3.24Å; M656-L660 WeakPolarHBondContact O-CG 3.4Å; M656-L660 PolarHBondContact O-N 3.15Å; Q658-L660 PolarHBondContact O-N 3.31Å; L660-L663 HydrophobicContact CD2-CD2 4.47Å
661	T	95.9	Very high	95.6	Very high	80 Å²	80	71.9 Å²	71.9	49%	0.491	36%	0.361	S	S	.	.	H	α-helix	trans	-83.1	-23	173.3	52.8	0	0	0	0	113.1	I599 A657 Q658	I599-T661 WeakPolarHBondContact O-CG2 3.42Å; A657-T661 WeakPolarHBondContact O-CB 3.41Å; A657-T661 WeakPolarHBondContact O-CG2 3.43Å; A657-T661 PolarHBondContact O-N 3.49Å; A657-T661 VanDerWaalsContact O-N 3.11Å; A657-T661 PolarHBondContact O-OG1 3.23Å; Q658-T661 PolarHBondContact O-N 3.31Å; Q658-T661 PolarHBondContact O-OG1 3.01Å
662	R	94.6	Very high	95.6	Very high	196 Å²	196	69.8 Å²	69.8	74%	0.74	35%	0.35	S	S	*	.	S	Bend	trans	-130.8	89.2	164.2	-177.4	-179.6	-72	-170.9	-5.6	109.9	Q658 F659	Q658-R662 PolarHBondContact O-N 3.35Å; F659-R662 CarbonylContact O-C 3.5Å
663	L	95.2	Very high	95.7	Very high	11 Å²	11	66.7 Å²	66.7	6%	0.058	33%	0.334	C	S	.	.			trans	-61.2	156.5	169.1	-65.3	173.9	0	0	0	110.6	W604 L613 V640 F659 L660 I667	W604-L663 HydrophobicContact CZ2-CD1 3.95Å; W604-L663 HydrophobicContact CZ2-CD2 4.02Å; W604-L663 HydrophobicContact CZ2-CG 4.2Å; L613-L663 HydrophobicContact CD2-CD1 3.97Å; V640-L663 HydrophobicContact CG1-CD1 3.93Å; V640-L663 HydrophobicContact CG1-CD2 3.72Å; F659-L663 HydrophobicContact CE1-CD2 4.23Å; F659-L663 WeakPolarHBondContact O-CA 3.32Å; F659-L663 PolarHBondContact O-N 3Å; L660-L663 HydrophobicContact CD2-CD2 4.47Å; L663-I667 HydrophobicContact CB-CD1 4.11Å; L663-I667 HydrophobicContact CD1-CD1 4.47Å
664	P	93.1	Very high	95.7	Very high	47 Å²	47	69.3 Å²	69.3	31%	0.305	35%	0.347	S	S	.	.			trans	-59.8	143.3	176.9	-23.6	34.6	0	0	0	112.7	Y644 F659 L666 I667	Y644-P664 HydrophobicContact CE1-CG 4.37Å; F659-P664 HydrophobicContact CE2-CG 4.02Å; F659-P664 HydrophobicContact CZ-CG 3.94Å; P664-L666 PolarHBondContact O-N 2.93Å; P664-I667 WeakPolarHBondContact O-CD1 3.49Å; P664-I667 WeakPolarHBondContact O-CG1 3.48Å
665	D	87.2	Confident	95.7	Very high	138 Å²	138	67.2 Å²	67.2	74%	0.738	34%	0.335	S	S	*	.	S	Bend	trans	-66.4	-22.6	177.6	-59	-66.2	0	0	0	113	P614	P614-D665 WeakPolarHBondContact CG-O 3.41Å
666	L	89.9	Confident	95.7	Very high	145 Å²	145	62.5 Å²	62.5	76%	0.759	31%	0.313	S	S	*	.			trans	-111.1	97.5	178.7	-63.4	179.7	0	0	0	110.9	P664	P664-L666 PolarHBondContact O-N 2.93Å
667	I	94.6	Very high	95.7	Very high	11 Å²	11	64.6 Å²	64.6	6%	0.056	33%	0.331	C	S	.	.			trans	-116.8	111.2	176.7	-50.6	-172.6	0	0	0	108.7	L613 L617 L643 L663 P664 P669 L672	L613-I667 HydrophobicContact CD2-CD1 3.65Å; L617-I667 HydrophobicContact CD2-CB 3.84Å; L617-I667 HydrophobicContact CD2-CG2 4.04Å; L643-I667 HydrophobicContact CD2-CG2 3.78Å; L663-I667 HydrophobicContact CB-CD1 4.11Å; L663-I667 HydrophobicContact CD1-CD1 4.47Å; P664-I667 WeakPolarHBondContact O-CD1 3.49Å; P664-I667 WeakPolarHBondContact O-CG1 3.48Å; I667-P669 VanDerWaalsContact O-CD 3.27Å; I667-P669 WeakPolarHBondContact O-CD 3.28Å; I667-P669 VanDerWaalsContact O-N 3.16Å; I667-L672 HydrophobicContact CG2-CB 4.18Å; I667-L672 HydrophobicContact CG2-CD2 4.25Å
668	P	93.1	Very high	95.7	Very high	56 Å²	56	65.5 Å²	65.5	36%	0.364	34%	0.338	S	S	.	.			trans	-60.6	115.8	-178.4	-24.9	34.8	0	0	0	111.7	E670 Q671 L672	P668-E670 VanDerWaalsContact C-N 3.31Å; P668-E670 PolarHBondContact O-N 3.47Å; P668-Q671 HydrophobicContact CB-CB 4.12Å; P668-Q671 HydrophobicContact CB-CG 3.93Å; P668-Q671 PolarHBondContact O-N 2.99Å; P668-L672 PolarHBondContact O-N 2.88Å
669	P	94.2	Very high	95.8	Very high	46 Å²	46	60 Å²	60	30%	0.299	31%	0.312	S	S	.	.	H	α-helix	trans	-58.6	-40.9	-172.2	-27.4	36.3	0	0	0	113.2	L617 I667 Q671 L672 F673	L617-P669 HydrophobicContact CD1-CB 3.82Å; L617-P669 HydrophobicContact CD1-CG 4.18Å; I667-P669 VanDerWaalsContact O-CD 3.27Å; I667-P669 WeakPolarHBondContact O-CD 3.28Å; I667-P669 VanDerWaalsContact O-N 3.16Å; P669-Q671 PolarHBondContact O-N 2.95Å; P669-L672 PolarHBondContact O-N 2.68Å; P669-F673 WeakPolarHBondContact O-CB 3.41Å; P669-F673 WeakPolarHBondContact O-CD2 3.01Å; P669-F673 PolarHBondContact O-N 3.36Å
670	E	94.6	Very high	95.7	Very high	116 Å²	116	64 Å²	64	54%	0.542	33%	0.332	S	S	.	.	H	α-helix	trans	-65.5	-39.8	-178.1	-74.3	50.5	-112.5	0	0	111.3	R620 P668 Q674	R620-E670 IonicContact CZ-OE1 2.69Å; R620-E670 IonicContact NH1-OE1 3.93Å; R620-E670 PolarHBondContact NH1-OE1 3.13Å; P668-E670 VanDerWaalsContact C-N 3.31Å; P668-E670 PolarHBondContact O-N 3.47Å; E670-Q674 VanDerWaalsContact O-CB 3.26Å; E670-Q674 WeakPolarHBondContact O-CB 3.22Å; E670-Q674 PolarHBondContact O-N 2.91Å
671	Q	96.8	Very high	95.6	Very high	102 Å²	102	64.6 Å²	64.6	48%	0.477	33%	0.334	S	S	.	.	H	α-helix	trans	-69.4	-47.6	176.9	-61.6	-179.2	9.3	0	0	110.2	L643 P668 P669 F673 Q674 H675	L643-Q671 HydrophobicContact CD1-CB 4.17Å; P668-Q671 HydrophobicContact CB-CB 4.12Å; P668-Q671 HydrophobicContact CB-CG 3.93Å; P668-Q671 PolarHBondContact O-N 2.99Å; P669-Q671 PolarHBondContact O-N 2.95Å; Q671-F673 VanDerWaalsContact C-N 3.34Å; Q671-F673 PolarHBondContact O-N 3.26Å; Q671-Q674 WeakPolarHBondContact O-CB 3.43Å; Q671-Q674 PolarHBondContact O-N 2.88Å; Q671-Q674 VanDerWaalsContact O-N 3.17Å; Q671-H675 PolarHBondContact O-CD2 3.27Å; Q671-H675 PolarHBondContact O-N 3.45Å
672	L	98.2	Very high	95.5	Very high	0 Å²	0	64.1 Å²	64.1	0%	0	33%	0.332	C	S	.	.	H	α-helix	trans	-58.5	-47.4	177	179.9	59.8	0	0	0	111	L617 V640 L643 I667 P668 P669 Q674 H675 I676	L617-L672 HydrophobicContact CD1-CD2 4.24Å; L617-L672 HydrophobicContact CD2-CD2 3.94Å; L617-L672 HydrophobicContact CG-CD2 4.32Å; V640-L672 HydrophobicContact CB-CD1 4.42Å; V640-L672 HydrophobicContact CG2-CD1 3.73Å; V640-L672 HydrophobicContact CG2-CD2 4.31Å; L643-L672 HydrophobicContact CD2-CB 4.23Å; L643-L672 HydrophobicContact CD2-CD1 4.18Å; I667-L672 HydrophobicContact CG2-CB 4.18Å; I667-L672 HydrophobicContact CG2-CD2 4.25Å; P668-L672 PolarHBondContact O-N 2.88Å; P669-L672 PolarHBondContact O-N 2.68Å; L672-Q674 VanDerWaalsContact C-N 3.32Å; L672-Q674 PolarHBondContact O-N 2.67Å; L672-H675 PolarHBondContact O-N 2.92Å; L672-H675 VanDerWaalsContact O-N 3.11Å; L672-I676 HydrophobicContact CD1-CD1 4.17Å; L672-I676 HydrophobicContact CD1-CG1 4.19Å; L672-I676 HydrophobicContact CD2-CD1 4.4Å; L672-I676 HydrophobicContact CG-CD1 3.83Å; L672-I676 HydrophobicContact CG-CG1 4.31Å; L672-I676 VanDerWaalsContact O-CG1 3.26Å; L672-I676 WeakPolarHBondContact O-CG1 3.4Å; L672-I676 PolarHBondContact O-N 2.74Å
673	F	98.3	Very high	95.4	Very high	3 Å²	3	55 Å²	55	1%	0.013	30%	0.298	C	S	.	.	H	α-helix	trans	-67.2	-29.7	178.7	-85.9	-108.5	0	0	0	113	W420 L617 R620 V621 V624 F632 P669 Q671 I676 A677	W420-F673 HydrophobicContact CD2-CD1 4.36Å; W420-F673 AromaticContact CE2-CD1 3.91Å; W420-F673 HydrophobicContact CH2-CD1 4.49Å; W420-F673 AromaticContact CZ2-CD1 3.97Å; W420-F673 HydrophobicContact CZ2-CD1 3.97Å; L617-F673 HydrophobicContact CD1-CD2 4.32Å; L617-F673 HydrophobicContact CD1-CE2 3.93Å; R620-F673 HydrophobicContact CB-CE2 4.27Å; R620-F673 HydrophobicContact CB-CZ 4.02Å; R620-F673 HydrophobicContact CG-CE1 3.91Å; R620-F673 HydrophobicContact CG-CE2 3.97Å; R620-F673 HydrophobicContact CG-CZ 3.54Å; V621-F673 HydrophobicContact CG2-CE2 4.15Å; V621-F673 HydrophobicContact CG2-CZ 4.07Å; V624-F673 HydrophobicContact CG2-CE1 4.15Å; F632-F673 HydrophobicContact CZ-CE1 4.14Å; F632-F673 HydrophobicContact CZ-CZ 4.42Å; P669-F673 WeakPolarHBondContact O-CB 3.41Å; P669-F673 WeakPolarHBondContact O-CD2 3.01Å; P669-F673 PolarHBondContact O-N 3.36Å; Q671-F673 VanDerWaalsContact C-N 3.34Å; Q671-F673 PolarHBondContact O-N 3.26Å; F673-I676 HydrophobicContact CD2-CD1 4.3Å; F673-I676 HydrophobicContact CE2-CD1 4.32Å; F673-A677 VanDerWaalsContact O-CB 3.29Å; F673-A677 WeakPolarHBondContact O-CB 3.42Å; F673-A677 PolarHBondContact O-N 3.02Å
674	Q	98.3	Very high	95.2	Very high	137 Å²	137	64.1 Å²	64.1	64%	0.64	33%	0.331	S	S	*	.	H	α-helix	trans	-65.4	-41.9	168.8	-176.4	178.2	1	0	0	111.9	E670 Q671 L672 A677 A678	E670-Q674 VanDerWaalsContact O-CB 3.26Å; E670-Q674 WeakPolarHBondContact O-CB 3.22Å; E670-Q674 PolarHBondContact O-N 2.91Å; Q671-Q674 WeakPolarHBondContact O-CB 3.43Å; Q671-Q674 PolarHBondContact O-N 2.88Å; Q671-Q674 VanDerWaalsContact O-N 3.17Å; L672-Q674 VanDerWaalsContact C-N 3.32Å; L672-Q674 PolarHBondContact O-N 2.67Å; Q674-A677 PolarHBondContact O-N 3.21Å; Q674-A678 PolarHBondContact O-N 2.97Å; Q674-A678 VanDerWaalsContact O-N 3.15Å
675	H	98.5	Very high	95	Very high	52 Å²	52	69.9 Å²	69.9	24%	0.241	36%	0.359	C	S	.	.	H	α-helix	trans	-68.2	-39.5	176.1	-80.5	-109.7	0	0	0	112.1	R642 L643 Q671 L672 A678 V679	R642-H675 VanDerWaalsContact C-ND1 3.29Å; R642-H675 HydrophobicContact CB-CB 4.4Å; R642-H675 WeakPolarHBondContact CG-ND1 3.27Å; R642-H675 PolarHBondContact O-CE1 3.22Å; R642-H675 PolarHBondContact O-ND1 3.19Å; L643-H675 WeakPolarHBondContact CA-ND1 3.1Å; L643-H675 HydrophobicContact CB-CB 4.44Å; L643-H675 PolarHBondContact N-ND1 3.17Å; Q671-H675 PolarHBondContact O-CD2 3.27Å; Q671-H675 PolarHBondContact O-N 3.45Å; L672-H675 PolarHBondContact O-N 2.92Å; L672-H675 VanDerWaalsContact O-N 3.11Å; H675-A678 PolarHBondContact O-N 3.47Å; H675-V679 PolarHBondContact O-N 3.35Å
676	I	98.6	Very high	95.4	Very high	0 Å²	0	67.4 Å²	67.4	0%	0	34%	0.34	C	S	.	.	H	α-helix	trans	-63.2	-42	172.1	-62.1	168.5	0	0	0	110.9	W420 F632 R635 T636 L672 F673 A678 V679	W420-I676 HydrophobicContact CH2-CB 4.49Å; W420-I676 HydrophobicContact CH2-CG2 3.9Å; F632-I676 HydrophobicContact CE2-CG2 3.62Å; F632-I676 HydrophobicContact CZ-CD1 4.42Å; F632-I676 HydrophobicContact CZ-CG2 3.94Å; R635-I676 HydrophobicContact CG-CG2 3.91Å; R635-I676 PolarHBondContact NE-O 3.09Å; R635-I676 PolarHBondContact NH2-O 2.77Å; T636-I676 HydrophobicContact CG2-CD1 4.03Å; L672-I676 HydrophobicContact CD1-CD1 4.17Å; L672-I676 HydrophobicContact CD1-CG1 4.19Å; L672-I676 HydrophobicContact CD2-CD1 4.4Å; L672-I676 HydrophobicContact CG-CD1 3.83Å; L672-I676 HydrophobicContact CG-CG1 4.31Å; L672-I676 VanDerWaalsContact O-CG1 3.26Å; L672-I676 WeakPolarHBondContact O-CG1 3.4Å; L672-I676 PolarHBondContact O-N 2.74Å; F673-I676 HydrophobicContact CD2-CD1 4.3Å; F673-I676 HydrophobicContact CE2-CD1 4.32Å; I676-A678 PolarHBondContact O-N 2.68Å; I676-V679 WeakPolarHBondContact O-CB 3.34Å; I676-V679 PolarHBondContact O-N 3.41Å
677	A	98.2	Very high	95.6	Very high	45 Å²	45	66.7 Å²	66.7	37%	0.372	33%	0.331	S	S	.	.	H	α-helix	trans	-58.4	-37	176.4	0	0	0	0	0	111.9	W420 R635 F673 Q674 V679	W420-A677 HydrophobicContact CZ2-CB 3.88Å; R635-A677 PolarHBondContact NH2-O 2.92Å; F673-A677 VanDerWaalsContact O-CB 3.29Å; F673-A677 WeakPolarHBondContact O-CB 3.42Å; F673-A677 PolarHBondContact O-N 3.02Å; Q674-A677 PolarHBondContact O-N 3.21Å; A677-V679 VanDerWaalsContact C-N 3.28Å; A677-V679 PolarHBondContact O-N 3.45Å
678	A	98	Very high	95.7	Very high	35 Å²	35	66.4 Å²	66.4	29%	0.289	33%	0.329	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.2	-1.5	177	0	0	0	0	0	115	Q674 H675 I676	Q674-A678 PolarHBondContact O-N 2.97Å; Q674-A678 VanDerWaalsContact O-N 3.15Å; H675-A678 PolarHBondContact O-N 3.47Å; I676-A678 PolarHBondContact O-N 2.68Å
679	V	98.1	Very high	95.8	Very high	1 Å²	1	66.8 Å²	66.8	1%	0.006	34%	0.337	C	S	.	.			trans	-86.3	131.7	170.9	176.6	0	0	0	0	110.4	N582 R635 L638 H675 I676 A677 M681	N582-V679 WeakPolarHBondContact OD1-CA 3.36Å; R635-V679 HydrophobicContact CG-CB 3.87Å; R635-V679 HydrophobicContact CG-CG1 3.78Å; R635-V679 PolarHBondContact NE-O 2.78Å; R635-V679 PolarHBondContact NH2-O 2.86Å; L638-V679 HydrophobicContact CB-CB 4.43Å; L638-V679 HydrophobicContact CB-CG1 3.79Å; L638-V679 HydrophobicContact CB-CG2 3.71Å; L638-V679 HydrophobicContact CD1-CG1 3.68Å; L638-V679 HydrophobicContact CG-CG1 4.38Å; H675-V679 PolarHBondContact O-N 3.35Å; I676-V679 WeakPolarHBondContact O-CB 3.34Å; I676-V679 PolarHBondContact O-N 3.41Å; A677-V679 VanDerWaalsContact C-N 3.28Å; A677-V679 PolarHBondContact O-N 3.45Å; V679-M681 HydrophobicContact CG1-SD 3.77Å
680	H	95.9	Very high	95.9	Very high	124 Å²	124	69.1 Å²	69.1	57%	0.574	34%	0.343	S	S	*	.			trans	-102.3	113.2	174.7	-59.4	-66.6	0	0	0	111.2	N582 T682	N582-H680 PolarHBondContact ND2-O 3.33Å; N582-H680 PolarHBondContact OD1-N 3Å; H680-T682 PolarHBondContact O-N 2.68Å; H680-T682 VanDerWaalsContact O-N 3.09Å
681	M	96.3	Very high	96	Very high	11 Å²	11	63.7 Å²	63.7	5%	0.054	32%	0.319	C	S	.	.			trans	-85.7	41.2	177.3	-59.3	-56.8	-72	0	0	112.6	F578 E631 F634 R635 L638 V679 W688	F578-M681 HydrophobicContact CD2-CE 4.31Å; F578-M681 HydrophobicContact CG-CE 4.32Å; E631-M681 HydrophobicContact CG-CB 3.88Å; E631-M681 HydrophobicContact CG-CE 3.82Å; E631-M681 HydrophobicContact CG-CG 3.82Å; E631-M681 VanDerWaalsContact OE1-CB 3.31Å; E631-M681 WeakPolarHBondContact OE1-CB 3.46Å; F634-M681 HydrophobicContact CB-CE 4.18Å; R635-M681 HydrophobicContact CB-CE 4.32Å; R635-M681 HydrophobicContact CB-CG 3.88Å; R635-M681 HydrophobicContact CB-SD 3.72Å; R635-M681 HydrophobicContact CG-CG 3.74Å; R635-M681 HydrophobicContact CG-SD 3.84Å; L638-M681 HydrophobicContact CD1-SD 4.14Å; V679-M681 HydrophobicContact CG1-SD 3.77Å; M681-W688 HydrophobicContact CE-CD2 4.36Å; M681-W688 HydrophobicContact CE-CE3 3.67Å; M681-W688 HydrophobicContact CE-CZ3 4.26Å
682	T	94.6	Very high	95.9	Very high	71 Å²	71	59.7 Å²	59.7	44%	0.436	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.7	119.8	179.8	50.1	0	0	0	0	110.7	H680 R686 K687	H680-T682 PolarHBondContact O-N 2.68Å; H680-T682 VanDerWaalsContact O-N 3.09Å; T682-R686 WeakPolarHBondContact CA-O 3.18Å; T682-K687 HydrophobicContact CG2-CG 4.18Å
683	S	91.9	Very high	95.8	Very high	4 Å²	4	65 Å²	65	3%	0.028	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	130	176.7	175.5	0	0	0	0	109.9	E581 N685 R686	E581-S683 VanDerWaalsContact OE2-CA 3.29Å; E581-S683 WeakPolarHBondContact OE2-CA 3.34Å; E581-S683 WeakPolarHBondContact OE2-CB 3.15Å; E581-S683 PolarHBondContact OE2-OG 2.88Å; S683-N685 VanDerWaalsContact C-N 3.26Å; S683-N685 PolarHBondContact O-N 3.47Å; S683-R686 PolarHBondContact N-O 2.9Å; S683-R686 PolarHBondContact O-N 2.72Å
684	R	90.1	Very high	95.6	Very high	203 Å²	203	66.6 Å²	66.6	77%	0.766	34%	0.335	S	S	*	.	T	Hydrogen-bonded Turn	trans	46.7	47.6	-177.3	-51	-176	-167.5	-174.4	4.2	112.9	R686	R684-R686 PolarHBondContact O-N 2.75Å
685	N	90.4	Very high	95.4	Very high	167 Å²	167	62 Å²	62	89%	0.893	32%	0.315	S	S	*	.	T	Hydrogen-bonded Turn	trans	61.2	11.9	-175.6	-59.6	-31	0	0	0	116.6	S683	S683-N685 VanDerWaalsContact C-N 3.26Å; S683-N685 PolarHBondContact O-N 3.47Å
686	R	94	Very high	95	Very high	86 Å²	86	61 Å²	61	33%	0.325	31%	0.312	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	136.3	174.3	-64	-179.7	-64.5	173.5	1.7	111.1	T682 S683 R684 Q690 V691 T694	T682-R686 WeakPolarHBondContact CA-O 3.18Å; S683-R686 PolarHBondContact N-O 2.9Å; S683-R686 PolarHBondContact O-N 2.72Å; R684-R686 PolarHBondContact O-N 2.75Å; R686-Q690 HydrophobicContact CB-CB 4.14Å; R686-V691 HydrophobicContact CB-CG2 3.83Å; R686-T694 PolarHBondContact NH1-OG1 2.91Å
687	K	96.1	Very high	94.6	Very high	131 Å²	131	65.8 Å²	65.8	57%	0.57	34%	0.335	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-79.3	166	171.7	-64.3	-173.5	176.6	-172.1	0	111.5	T682 A689 Q690 V691	T682-K687 HydrophobicContact CG2-CG 4.18Å; K687-A689 PolarHBondContact O-N 2.92Å; K687-Q690 WeakPolarHBondContact O-CB 3.25Å; K687-Q690 PolarHBondContact O-N 3.09Å; K687-V691 PolarHBondContact O-N 3.25Å; K687-V691 VanDerWaalsContact O-N 3.07Å
688	W	96.1	Very high	94.1	Very high	4 Å²	4	69.1 Å²	69.1	2%	0.015	34%	0.343	C	S	.	.	H	α-helix	trans	-38.7	-61.1	174.9	176.1	-102.1	0	0	0	114	Y571 A574 F578 E630 E631 F634 M681 Q690 V691 L692	Y571-W688 HydrophobicContact CD1-CH2 4.4Å; Y571-W688 AromaticContact CD1-CZ2 3.77Å; Y571-W688 HydrophobicContact CD1-CZ2 3.77Å; Y571-W688 HydrophobicContact CE1-CZ2 4.05Å; A574-W688 HydrophobicContact CB-CH2 3.79Å; A574-W688 HydrophobicContact CB-CZ2 4.39Å; A574-W688 HydrophobicContact CB-CZ3 3.9Å; F578-W688 AromaticContact CD2-CE3 3.58Å; F578-W688 HydrophobicContact CD2-CE3 3.58Å; F578-W688 AromaticContact CD2-CZ3 3.81Å; F578-W688 HydrophobicContact CD2-CZ3 3.81Å; F578-W688 HydrophobicContact CE2-CD2 4.37Å; F578-W688 AromaticContact CE2-CE3 3.42Å; F578-W688 HydrophobicContact CE2-CE3 3.42Å; F578-W688 VanDerWaalsContact CE2-CE3 3.42Å; F578-W688 AromaticContact CE2-CZ3 4Å; F578-W688 HydrophobicContact CE2-CZ3 4Å; F578-W688 HydrophobicContact CZ-CE3 4.42Å; E630-W688 PolarHBondContact OE1-NE1 2.83Å; E631-W688 HydrophobicContact CB-CB 4.01Å; E631-W688 HydrophobicContact CB-CG 3.85Å; E631-W688 HydrophobicContact CG-CB 3.64Å; E631-W688 HydrophobicContact CG-CG 3.92Å; E631-W688 WeakPolarHBondContact OE2-CB 3.45Å; F634-W688 HydrophobicContact CB-CE3 4.44Å; F634-W688 HydrophobicContact CB-CH2 3.84Å; F634-W688 HydrophobicContact CB-CZ2 4.41Å; F634-W688 HydrophobicContact CB-CZ3 3.84Å; F634-W688 AromaticContact CD1-CH2 3.7Å; F634-W688 HydrophobicContact CD1-CH2 3.7Å; F634-W688 HydrophobicContact CD1-CZ2 4.35Å; F634-W688 HydrophobicContact CD1-CZ3 4.39Å; F634-W688 AromaticContact CD2-CE2 3.92Å; F634-W688 AromaticContact CD2-CH2 3.33Å; F634-W688 HydrophobicContact CD2-CH2 3.33Å; F634-W688 AromaticContact CD2-CZ2 3.18Å; F634-W688 HydrophobicContact CD2-CZ2 3.18Å; F634-W688 HydrophobicContact CD2-CZ3 4.14Å; F634-W688 HydrophobicContact CE1-CH2 4.06Å; F634-W688 HydrophobicContact CE1-CZ2 4.47Å; F634-W688 AromaticContact CE2-CH2 3.75Å; F634-W688 HydrophobicContact CE2-CH2 3.75Å; F634-W688 AromaticContact CE2-CZ2 3.38Å; F634-W688 HydrophobicContact CE2-CZ2 3.38Å; F634-W688 AromaticContact CG-CH2 3.31Å; F634-W688 HydrophobicContact CG-CH2 3.31Å; F634-W688 AromaticContact CG-CZ2 3.73Å; F634-W688 HydrophobicContact CG-CZ2 3.73Å; F634-W688 AromaticContact CG-CZ3 3.86Å; F634-W688 HydrophobicContact CG-CZ3 3.86Å; F634-W688 HydrophobicContact CZ-CH2 4.09Å; F634-W688 HydrophobicContact CZ-CZ2 4.04Å; M681-W688 HydrophobicContact CE-CD2 4.36Å; M681-W688 HydrophobicContact CE-CE3 3.67Å; M681-W688 HydrophobicContact CE-CZ3 4.26Å; W688-Q690 VanDerWaalsContact C-N 3.25Å; W688-Q690 PolarHBondContact O-N 2.9Å; W688-V691 PolarHBondContact O-N 3.03Å; W688-L692 HydrophobicContact CZ2-CD1 4.48Å; W688-L692 WeakPolarHBondContact O-CB 3.45Å; W688-L692 PolarHBondContact O-N 3.31Å
689	A	95.4	Very high	93.2	Very high	64 Å²	64	71.1 Å²	71.1	53%	0.529	35%	0.345	S	S	.	.	H	α-helix	trans	-58.7	-34.5	-176.3	0	0	0	0	0	113.3	K687 Q693	K687-A689 PolarHBondContact O-N 2.92Å; A689-Q693 WeakPolarHBondContact O-CB 3.38Å; A689-Q693 PolarHBondContact O-N 2.75Å
690	Q	96.3	Very high	92.3	Very high	95 Å²	95	79.1 Å²	79.1	44%	0.444	38%	0.375	S	S	.	.	H	α-helix	trans	-73.8	-36.3	178.3	-64.6	170.4	-47.1	0	0	111.7	R686 K687 W688 T694	R686-Q690 HydrophobicContact CB-CB 4.14Å; K687-Q690 WeakPolarHBondContact O-CB 3.25Å; K687-Q690 PolarHBondContact O-N 3.09Å; W688-Q690 VanDerWaalsContact C-N 3.25Å; W688-Q690 PolarHBondContact O-N 2.9Å; Q690-T694 WeakPolarHBondContact O-CB 3.36Å; Q690-T694 PolarHBondContact O-N 3.02Å; Q690-T694 PolarHBondContact O-OG1 3.33Å
691	V	96.6	Very high	91.3	Very high	3 Å²	3	76 Å²	76	2%	0.018	37%	0.367	C	S	.	.	H	α-helix	trans	-67.9	-48.6	173.9	174.1	0	0	0	0	110.2	A574 V577 F578 R686 K687 W688 Q693 T694 L695	A574-V691 HydrophobicContact CB-CG1 4.41Å; V577-V691 HydrophobicContact CB-CG1 4.39Å; V577-V691 HydrophobicContact CG1-CG1 4.32Å; V577-V691 HydrophobicContact CG2-CG1 4.47Å; F578-V691 HydrophobicContact CE2-CB 4.08Å; F578-V691 HydrophobicContact CE2-CG1 4.14Å; F578-V691 HydrophobicContact CE2-CG2 4.23Å; F578-V691 HydrophobicContact CZ-CB 4.01Å; F578-V691 HydrophobicContact CZ-CG1 4.43Å; F578-V691 HydrophobicContact CZ-CG2 3.7Å; R686-V691 HydrophobicContact CB-CG2 3.83Å; K687-V691 PolarHBondContact O-N 3.25Å; K687-V691 VanDerWaalsContact O-N 3.07Å; W688-V691 PolarHBondContact O-N 3.03Å; V691-Q693 PolarHBondContact O-N 3.34Å; V691-T694 PolarHBondContact O-N 3.49Å; V691-L695 HydrophobicContact CG1-CD1 3.92Å; V691-L695 WeakPolarHBondContact O-CG 3.27Å; V691-L695 PolarHBondContact O-N 3.06Å
692	L	94.9	Very high	90.1	Very high	18 Å²	18	77.3 Å²	77.3	9%	0.094	38%	0.383	C	S	.	.	H	α-helix	trans	-59.8	-44.2	177.7	-171.1	73.2	0	0	0	111.9	T570 Y571 A574 E630 W688 L695 T696	T570-L692 HydrophobicContact CG2-CD1 4.25Å; Y571-L692 HydrophobicContact CD1-CD1 3.7Å; Y571-L692 HydrophobicContact CD1-CD2 4.24Å; Y571-L692 HydrophobicContact CE1-CD1 3.9Å; Y571-L692 HydrophobicContact CE1-CD2 3.57Å; Y571-L692 HydrophobicContact CE1-CG 4.41Å; Y571-L692 HydrophobicContact CG-CD1 4.2Å; A574-L692 HydrophobicContact CB-CB 4.44Å; A574-L692 HydrophobicContact CB-CD1 3.79Å; E630-L692 WeakPolarHBondContact OE1-CD2 3.49Å; W688-L692 HydrophobicContact CZ2-CD1 4.48Å; W688-L692 WeakPolarHBondContact O-CB 3.45Å; W688-L692 PolarHBondContact O-N 3.31Å; L692-L695 PolarHBondContact O-N 3.06Å; L692-T696 WeakPolarHBondContact O-CB 3.39Å; L692-T696 PolarHBondContact O-N 3.43Å; L692-T696 PolarHBondContact O-OG1 2.81Å
693	Q	94.5	Very high	88.6	Confident	110 Å²	110	77.1 Å²	77.1	51%	0.514	39%	0.389	S	S	.	.	H	α-helix	trans	-60.7	-48.9	173.6	-179.4	178	-2.9	0	0	111.5	A689 V691 L695 T696 E697	A689-Q693 WeakPolarHBondContact O-CB 3.38Å; A689-Q693 PolarHBondContact O-N 2.75Å; V691-Q693 PolarHBondContact O-N 3.34Å; Q693-L695 VanDerWaalsContact C-N 3.31Å; Q693-L695 PolarHBondContact O-N 2.94Å; Q693-T696 WeakPolarHBondContact O-CB 3.32Å; Q693-T696 PolarHBondContact O-N 3.16Å; Q693-T696 VanDerWaalsContact O-N 3.16Å; Q693-E697 HydrophobicContact CG-CG 4.37Å; Q693-E697 VanDerWaalsContact CG-OE1 3.28Å; Q693-E697 WeakPolarHBondContact CG-OE1 3.42Å; Q693-E697 PolarHBondContact NE2-OE1 3.16Å; Q693-E697 WeakPolarHBondContact O-CG 3.41Å; Q693-E697 PolarHBondContact O-N 3.16Å
694	T	94.9	Very high	87.2	Confident	38 Å²	38	86.5 Å²	86.5	23%	0.233	42%	0.424	C	S	.	.	H	α-helix	trans	-55.9	-46.5	179.7	-54.5	0	0	0	0	111.2	R686 Q690 V691 E697 Q698	R686-T694 PolarHBondContact NH1-OG1 2.91Å; Q690-T694 WeakPolarHBondContact O-CB 3.36Å; Q690-T694 PolarHBondContact O-N 3.02Å; Q690-T694 PolarHBondContact O-OG1 3.33Å; V691-T694 PolarHBondContact O-N 3.49Å; T694-E697 PolarHBondContact O-N 3.41Å; T694-Q698 HydrophobicContact CG2-CG 4.42Å; T694-Q698 WeakPolarHBondContact O-CB 3.29Å; T694-Q698 VanDerWaalsContact O-CG 3.29Å; T694-Q698 WeakPolarHBondContact O-CG 3.45Å; T694-Q698 PolarHBondContact O-N 3.36Å
695	L	93.5	Very high	85.7	Confident	40 Å²	40	82.3 Å²	82.3	21%	0.209	42%	0.416	C	S	.	.	H	α-helix	trans	-67.1	-38.9	-180	-67.5	167.3	0	0	0	111.9	T570 A573 A574 V691 L692 Q693 E697 K699	T570-L695 HydrophobicContact CG2-CB 3.81Å; A573-L695 HydrophobicContact CB-CD1 4.04Å; A574-L695 HydrophobicContact CB-CD1 3.92Å; V691-L695 HydrophobicContact CG1-CD1 3.92Å; V691-L695 WeakPolarHBondContact O-CG 3.27Å; V691-L695 PolarHBondContact O-N 3.06Å; L692-L695 PolarHBondContact O-N 3.06Å; Q693-L695 VanDerWaalsContact C-N 3.31Å; Q693-L695 PolarHBondContact O-N 2.94Å; L695-E697 VanDerWaalsContact C-N 3.34Å; L695-E697 PolarHBondContact O-N 3.39Å; L695-K699 WeakPolarHBondContact O-CB 3.43Å; L695-K699 PolarHBondContact O-N 3.15Å
696	T	91.3	Very high	84.2	Confident	30 Å²	30	78 Å²	78	18%	0.184	40%	0.398	C	S	.	.	H	α-helix	trans	-61.2	-42.5	174.4	-56.9	0	0	0	0	111.6	L692 Q693 R700	L692-T696 WeakPolarHBondContact O-CB 3.39Å; L692-T696 PolarHBondContact O-N 3.43Å; L692-T696 PolarHBondContact O-OG1 2.81Å; Q693-T696 WeakPolarHBondContact O-CB 3.32Å; Q693-T696 PolarHBondContact O-N 3.16Å; Q693-T696 VanDerWaalsContact O-N 3.16Å; T696-R700 WeakPolarHBondContact O-CG 3.34Å; T696-R700 PolarHBondContact O-N 3.4Å; T696-R700 VanDerWaalsContact O-N 3.15Å
697	E	90.3	Very high	82.2	Confident	101 Å²	101	75.4 Å²	75.4	47%	0.472	40%	0.399	S	S	.	.	H	α-helix	trans	-71.1	-43.2	179.7	-72.4	173.2	-178.1	0	0	112.1	Q693 T694 L695 K699 R700 S701	Q693-E697 HydrophobicContact CG-CG 4.37Å; Q693-E697 VanDerWaalsContact CG-OE1 3.28Å; Q693-E697 WeakPolarHBondContact CG-OE1 3.42Å; Q693-E697 PolarHBondContact NE2-OE1 3.16Å; Q693-E697 WeakPolarHBondContact O-CG 3.41Å; Q693-E697 PolarHBondContact O-N 3.16Å; T694-E697 PolarHBondContact O-N 3.41Å; L695-E697 VanDerWaalsContact C-N 3.34Å; L695-E697 PolarHBondContact O-N 3.39Å; E697-K699 VanDerWaalsContact C-N 3.31Å; E697-K699 PolarHBondContact O-N 3.33Å; E697-R700 PolarHBondContact O-N 3.34Å; E697-R700 VanDerWaalsContact O-N 3.16Å; E697-S701 PolarHBondContact O-N 3.1Å; E697-S701 PolarHBondContact O-OG 3Å
698	Q	86.8	Confident	80.2	Confident	116 Å²	116	72 Å²	72	54%	0.542	40%	0.395	S	S	.	.	H	α-helix	trans	-59.2	-40.4	174	-75.5	175.1	-17.2	0	0	112.3	T694 S701 G702	T694-Q698 HydrophobicContact CG2-CG 4.42Å; T694-Q698 WeakPolarHBondContact O-CB 3.29Å; T694-Q698 VanDerWaalsContact O-CG 3.29Å; T694-Q698 WeakPolarHBondContact O-CG 3.45Å; T694-Q698 PolarHBondContact O-N 3.36Å; Q698-S701 PolarHBondContact O-N 3.43Å; Q698-S701 PolarHBondContact O-OG 3.03Å; Q698-G702 PolarHBondContact O-N 3.38Å
699	K	80.1	Confident	78	Confident	77 Å²	77	78.5 Å²	78.5	34%	0.335	43%	0.426	S	S	.	.	H	α-helix	trans	-66.4	-37.8	176.3	-163.2	168.3	-171.2	168.3	0	112	S566 L695 E697 A703	S566-K699 PolarHBondContact O-NZ 3.1Å; S566-K699 VanDerWaalsContact OG-CE 3.27Å; S566-K699 WeakPolarHBondContact OG-CE 3.44Å; L695-K699 WeakPolarHBondContact O-CB 3.43Å; L695-K699 PolarHBondContact O-N 3.15Å; E697-K699 VanDerWaalsContact C-N 3.31Å; E697-K699 PolarHBondContact O-N 3.33Å; K699-A703 WeakPolarHBondContact O-CB 3.41Å; K699-A703 PolarHBondContact O-N 3.49Å; K699-A703 VanDerWaalsContact O-N 3.16Å
700	R	78.4	Confident	75.8	Confident	168 Å²	168	79.4 Å²	79.4	63%	0.634	43%	0.433	S	S	*	.	H	α-helix	trans	-70	-35.2	175.5	-74.4	172.2	174.7	-177.7	-0.6	113.2	T696 E697 R704	T696-R700 WeakPolarHBondContact O-CG 3.34Å; T696-R700 PolarHBondContact O-N 3.4Å; T696-R700 VanDerWaalsContact O-N 3.15Å; E697-R700 PolarHBondContact O-N 3.34Å; E697-R700 VanDerWaalsContact O-N 3.16Å; R700-R704 WeakPolarHBondContact O-CG 3.35Å; R700-R704 PolarHBondContact O-N 2.91Å
701	S	75.1	Confident	73.6	Confident	60 Å²	60	82.4 Å²	82.4	42%	0.42	45%	0.452	S	S	.	.	H	α-helix	trans	-74.6	-43.1	176.2	59.7	0	0	0	0	112.1	E697 Q698 A703 R704 L705	E697-S701 PolarHBondContact O-N 3.1Å; E697-S701 PolarHBondContact O-OG 3Å; Q698-S701 PolarHBondContact O-N 3.43Å; Q698-S701 PolarHBondContact O-OG 3.03Å; S701-A703 VanDerWaalsContact C-N 3.34Å; S701-A703 PolarHBondContact O-N 3.33Å; S701-R704 PolarHBondContact O-N 3.17Å; S701-R704 VanDerWaalsContact O-N 3.1Å; S701-L705 PolarHBondContact O-N 3.01Å
702	G	70.1	Confident	71	Confident	37 Å²	37	89.3 Å²	89.3	38%	0.381	50%	0.5	S	S	.	.	H	α-helix	trans	-57.8	-43.5	174.6	0	0	0	0	0	113	Q698 R704 L705 S706	Q698-G702 PolarHBondContact O-N 3.38Å; G702-R704 VanDerWaalsContact C-N 3.32Å; G702-R704 PolarHBondContact O-N 3.25Å; G702-L705 PolarHBondContact O-N 3.4Å; G702-S706 PolarHBondContact O-N 3.05Å
703	A	64.1	Low	69.8	Low	68 Å²	68	92.9 Å²	92.9	56%	0.562	52%	0.52	S	S	*	.	H	α-helix	trans	-63.2	-33.9	175.3	0	0	0	0	0	113.4	K699 S701 G707	K699-A703 WeakPolarHBondContact O-CB 3.41Å; K699-A703 PolarHBondContact O-N 3.49Å; K699-A703 VanDerWaalsContact O-N 3.16Å; S701-A703 VanDerWaalsContact C-N 3.34Å; S701-A703 PolarHBondContact O-N 3.33Å; A703-G707 PolarHBondContact O-N 3.47Å
704	R	61.3	Low	68.5	Low	200 Å²	200	92 Å²	92	76%	0.755	52%	0.521	S	S	*	.	H	α-helix	trans	-71.8	-37.2	176.3	-75.8	173.7	176.9	-172.7	-1.1	112.8	R700 S701 G702 A708	R700-R704 WeakPolarHBondContact O-CG 3.35Å; R700-R704 PolarHBondContact O-N 2.91Å; S701-R704 PolarHBondContact O-N 3.17Å; S701-R704 VanDerWaalsContact O-N 3.1Å; G702-R704 VanDerWaalsContact C-N 3.32Å; G702-R704 PolarHBondContact O-N 3.25Å; R704-A708 PolarHBondContact O-N 3.01Å; R704-A708 VanDerWaalsContact O-N 3.09Å
705	L	59.8	Low	67	Low	116 Å²	116	95 Å²	95	61%	0.607	54%	0.537	S	S	*	.	H	α-helix	trans	-67.4	-51.8	176.5	-68.6	168.7	0	0	0	110.7	S701 G702 G707 A708 E709	S701-L705 PolarHBondContact O-N 3.01Å; G702-L705 PolarHBondContact O-N 3.4Å; L705-G707 PolarHBondContact O-N 3.03Å; L705-A708 WeakPolarHBondContact O-CB 3.36Å; L705-A708 PolarHBondContact O-N 2.99Å; L705-E709 PolarHBondContact O-N 3.05Å
706	S	57.9	Low	65.5	Low	75 Å²	75	98.2 Å²	98.2	52%	0.524	56%	0.556	S	S	.	*	H	α-helix	trans	-60.5	-32.6	176	174.5	0	0	0	0	113	G702 A710	G702-S706 PolarHBondContact O-N 3.05Å; S706-A710 WeakPolarHBondContact O-CB 3.47Å; S706-A710 PolarHBondContact O-N 3.09Å; S706-A710 VanDerWaalsContact O-N 3.17Å
707	G	52.8	Low	63.8	Low	33 Å²	33	102.5 Å²	102.5	34%	0.34	58%	0.579	S	S	.	*	H	α-helix	trans	-71.8	-27	173.6	0	0	0	0	0	114.3	A703 L705 L711	A703-G707 PolarHBondContact O-N 3.47Å; L705-G707 PolarHBondContact O-N 3.03Å; G707-L711 WeakPolarHBondContact O-CD1 3.37Å; G707-L711 WeakPolarHBondContact O-CG 3.43Å
708	A	53.3	Low	62.1	Low	59 Å²	59	102.6 Å²	102.6	49%	0.488	59%	0.586	S	S	.	*	H	α-helix	trans	-77.5	-42.8	174	0	0	0	0	0	111.5	R704 L705 A710 L711 S712	R704-A708 PolarHBondContact O-N 3.01Å; R704-A708 VanDerWaalsContact O-N 3.09Å; L705-A708 WeakPolarHBondContact O-CB 3.36Å; L705-A708 PolarHBondContact O-N 2.99Å; A708-A710 PolarHBondContact O-N 3.36Å; A708-L711 PolarHBondContact O-N 3.39Å; A708-S712 PolarHBondContact O-N 3.28Å
709	E	50.8	Low	60.3	Low	141 Å²	141	101.6 Å²	101.6	66%	0.659	59%	0.589	S	S	*	*	H	α-helix	trans	-65.2	-20.4	174.8	-66.4	173	156.9	0	0	113.2	L705 S712	L705-E709 PolarHBondContact O-N 3.05Å; E709-S712 PolarHBondContact O-OG 3.45Å
710	A	48.7	Very low	58.8	Low	82 Å²	82	103.5 Å²	103.5	68%	0.678	61%	0.609	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.9	-0.8	173.3	0	0	0	0	0	113.9	S706 A708	S706-A710 WeakPolarHBondContact O-CB 3.47Å; S706-A710 PolarHBondContact O-N 3.09Å; S706-A710 VanDerWaalsContact O-N 3.17Å; A708-A710 PolarHBondContact O-N 3.36Å
711	L	49.8	Very low	57.2	Low	159 Å²	159	98.2 Å²	98.2	83%	0.832	61%	0.607	S	S	*	*			trans	-119.5	7.2	178.7	-70.5	173.2	0	0	0	112.8	G707 A708	G707-L711 WeakPolarHBondContact O-CD1 3.37Å; G707-L711 WeakPolarHBondContact O-CG 3.43Å; A708-L711 PolarHBondContact O-N 3.39Å
712	S	42.3	Very low	55.5	Low	148 Å²	148	101.6 Å²	101.6	100%	1.035	62%	0.624	S	S	*	*			trans	-114.2	0	176.4	63	0	0	0	0	111.7	A708 E709	A708-S712 PolarHBondContact O-N 3.28Å; E709-S712 PolarHBondContact O-OG 3.45Å

Retrieved 712 of 712 residues in 566.6 ms (Link to these results)

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