A0A087XHH7_POEFO Loading...

Pre-mRNA-processing factor 40 homolog A

Binds to WASL/N-WASP and suppresses its translocation from the nucleus to the cytoplasm, thereby inhibiting its cytoplasmic function. Plays a role in the regulation of cell morphology and cytoskeletal organization. Required in the control of cell shape and migration. May play a role in cytokinesis. May be involved in pre-mRNA splicing.

AlphaFold DB , UniProt , Accession A0A087XHH7, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 889 aa.

						>A0A087XHH7_POEFO|A0A087XHH7
MSSTETNNGPSQAAPYAAVPPAAIPPPYMGPPGIPPHFPPMGIPPMAQRPPSMTPLPPGIMPPGIMPPMAAPPMGQMPSMIPPMIPGMMLPPRIPAATVQPTGPPGVDTTVPAAAAPGTTSGTNGSPPEEQPKKKSVWTEHKSLDGKTYYYNTETKQSTWEKPDELKSPAEQMLSKCPWKEYKSDTGKPYYYNSQTKESRWTKPKELEDLEAMIKAEESGTTEAAAPGTTAAPTAQADQNTTAMVTVKEAETAAAVPEEQQSQVTSHQTAEVKAVEAPVTSSESAVVAESKPSVEVKEEERPELQKKTYKWNTKEEAKQAFKELLKEKGVSSNSSWEQAMKLIINDPRYSALPKLSEKKQAFNAYKVQTEKEEKEEARIKYKESKEKFQRFLENHEKMTSTTRYKKAEQMFNELEVWSCVPERDRLEIYEDVLFYLAKKEKEQAKQLRKRNWEALKNILDNMANVTYRTTWSEAQQYLLDNPTFAEDEELQNMDKEDALICFEEHIRALEKEEEEDKQKTLLRERRRQRKNRESFQKFLDELHDHGQLHSMSSWMEMYPTLSSDMRFSSMLGQPGSTPLDLFKFYVEDLKARYHDEKRIIKDILKDKGFLVEVNTSFDDFGSVISSDKRATTLDAGNIKLAFNSLLEKAEAREREREKEEARKMKRKEAAFKTMLKQATPPLEPEASWEEVRERFLKEAAFEDVTLESERKRIFKDFMHVLEHECQHHHSKTKKHSKKSKKHHRKRSRSRSSSKASESEEEEYHKKKKRSQSKSPSERSSSGESERSYKKSKKHKKKGKKRRHNHDKQASPDSDGEKKGRERDGKRERDSEKDKENDKIRGKSRSESKQKSPKRKAAKEEGGWDTSGSELSEGELEKRRRTLLEQLDAP
					

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	33.1	Very low	39.5	Very low	249 Å²	249	138.2 Å²	138.2	100%	1.227	83%	0.829	S	S	*	*				0	169.8	0	-83.5	171.4	159.1	0	0	108.5
2	S	34.5	Very low	39.2	Very low	107 Å²	107	142.7 Å²	142.7	75%	0.748	84%	0.835	S	S	*	*			trans	-54	141.8	-166.4	-45	0	0	0	0	116.8
3	S	38.7	Very low	38.6	Very low	108 Å²	108	139.3 Å²	139.3	76%	0.755	83%	0.834	S	S	*	*				57.7	165.8	124.4	-44.2	0	0	0	0	120.3
4	T	41.5	Very low	38.5	Very low	119 Å²	119	135.9 Å²	135.9	73%	0.73	83%	0.828	S	S	*	*			cis	-149.7	176.4	6.5	-24.1	0	0	0	0	111.1
5	E	46.2	Very low	39.3	Very low	166 Å²	166	135.3 Å²	135.3	78%	0.776	83%	0.828	S	S	*	*			trans	-60.8	166.8	172.3	-54.2	136.6	105.6	0	0	114.3
6	T	37.2	Very low	39	Very low	150 Å²	150	141.6 Å²	141.6	92%	0.92	83%	0.834	S	S	*	*				-152.1	138.3	127.9	-5.7	0	0	0	0	111
7	N	41.9	Very low	38.7	Very low	149 Å²	149	139 Å²	139	80%	0.797	83%	0.832	S	S	*	*			trans	-110.6	145.1	174.8	176.8	19.2	0	0	0	108.1
8	N	37.2	Very low	38.6	Very low	163 Å²	163	136.8 Å²	136.8	87%	0.872	83%	0.832	S	S	*	*			trans	-152.2	140.3	167.3	-138.2	-12.4	0	0	0	112.6
9	G	29.9	Very low	39.1	Very low	60 Å²	60	137 Å²	137	62%	0.619	83%	0.833	S	S	*	*			trans	-116.8	-140	-172.9	0	0	0	0	0	113.8
10	P	61.5	Low	39.6	Very low	125 Å²	125	135.6 Å²	135.6	81%	0.812	83%	0.827	S	S	*	*				-128.6	169.4	-117	39.2	-25	0	0	0	115.2
11	S	32.2	Very low	40	Very low	124 Å²	124	135.2 Å²	135.2	87%	0.867	83%	0.827	S	S	*	*			trans	-161.2	162.1	156.7	-87	0	0	0	0	113.5
12	Q	36	Very low	40.3	Very low	192 Å²	192	128.1 Å²	128.1	90%	0.897	81%	0.808	S	S	*	*			trans	-95	-179.7	-177.4	-58.8	172.8	-5.8	0	0	110
13	A	32.1	Very low	40.7	Very low	99 Å²	99	127.9 Å²	127.9	82%	0.818	81%	0.812	S	S	*	*			cis	-152	-173.3	17.2	0	0	0	0	0	113.3
14	A	37.1	Very low	41	Very low	92 Å²	92	130.4 Å²	130.4	76%	0.76	82%	0.815	S	S	*	*			trans	-90.4	177.5	-170.9	0	0	0	0	0	114.7
15	P	49.9	Very low	41.5	Very low	126 Å²	126	129.7 Å²	129.7	82%	0.818	81%	0.813	S	S	*	*				-142.3	-175.1	82.1	38.5	-21	0	0	0	116.3
16	Y	34.7	Very low	41.8	Very low	236 Å²	236	127.5 Å²	127.5	93%	0.925	81%	0.813	S	S	*	*			trans	-67.3	151.6	-168.3	-65	-96.8	0	0	0	117.8
17	A	34.7	Very low	42.4	Very low	98 Å²	98	126 Å²	126	81%	0.81	81%	0.806	S	S	*	*			trans	-153.1	135.2	150.8	0	0	0	0	0	113.8
18	A	36.6	Very low	42.3	Very low	99 Å²	99	129.1 Å²	129.1	82%	0.818	81%	0.808	S	S	*	*			trans	25.9	137.2	156.6	0	0	0	0	0	123.7
19	V	48.3	Very low	42.7	Very low	141 Å²	141	130 Å²	130	86%	0.855	81%	0.809	S	S	*	*	P	Polyproline II helix	trans	-90.8	133.4	168.1	173.8	0	0	0	0	111.2
20	P	48	Very low	43.3	Very low	109 Å²	109	129.5 Å²	129.5	71%	0.708	80%	0.804	S	S	*	*	P	Polyproline II helix	trans	-85	156.5	168.5	33.8	-33	0	0	0	112.9
21	P	48.5	Very low	42.6	Very low	128 Å²	128	129.6 Å²	129.6	83%	0.831	81%	0.805	S	S	*	*	P	Polyproline II helix	trans	-86.9	166.5	-157.1	34.3	-38.2	0	0	0	116.5
22	A	39.6	Very low	43.3	Very low	100 Å²	100	129.9 Å²	129.9	83%	0.826	80%	0.803	S	S	*	*	P	Polyproline II helix	trans	-68.5	144.5	179.5	0	0	0	0	0	114
23	A	41.9	Very low	43.3	Very low	101 Å²	101	124.4 Å²	124.4	84%	0.835	80%	0.798	S	S	*	*	P	Polyproline II helix	trans	-85.4	142.2	172.2	0	0	0	0	0	111.8
24	I	46.9	Very low	43.5	Very low	161 Å²	161	127.5 Å²	127.5	83%	0.826	80%	0.8	S	S	*	*	P	Polyproline II helix	trans	-82.7	136.7	-175.7	-60.5	169.4	0	0	0	110.1
25	P	50.2	Low	44.6	Very low	105 Å²	105	128 Å²	128	68%	0.682	80%	0.796	S	S	*	*	P	Polyproline II helix	trans	-71.7	150.2	176.9	29.7	-35.6	0	0	0	112.8
26	P	53.8	Low	44.6	Very low	119 Å²	119	127.5 Å²	127.5	77%	0.773	79%	0.792	S	S	*	*	P	Polyproline II helix	trans	-68.9	155	177.3	29.5	-35.3	0	0	0	112.6
27	P	49.8	Very low	44.6	Very low	120 Å²	120	124.9 Å²	124.9	78%	0.779	79%	0.788	S	S	*	*	P	Polyproline II helix	trans	-77.2	152.8	-166.9	30.2	-36.5	0	0	0	115.1
28	Y	38.6	Very low	44.6	Very low	214 Å²	214	129.4 Å²	129.4	84%	0.839	79%	0.789	S	S	*	*	P	Polyproline II helix	trans	-72.5	124.5	177.7	-177.4	-91.3	0	0	0	112
29	M	46.2	Very low	44.8	Very low	180 Å²	180	130.2 Å²	130.2	89%	0.887	79%	0.787	S	S	*	*			trans	-91.4	114.2	172.3	-79.1	-73.6	-178.4	0	0	110.6
30	G	43.7	Very low	44.9	Very low	50 Å²	50	128.4 Å²	128.4	52%	0.515	78%	0.778	S	S	.	*	P	Polyproline II helix	trans	-84.5	159.5	173.8	0	0	0	0	0	113.6
31	P	45.6	Very low	44.2	Very low	127 Å²	127	132.2 Å²	132.2	83%	0.825	79%	0.789	S	S	*	*	P	Polyproline II helix	trans	-82.3	144.6	-179.1	33.2	-35.1	0	0	0	113.2
32	P	47.4	Very low	43.4	Very low	130 Å²	130	129.5 Å²	129.5	84%	0.844	78%	0.784	S	S	*	*	P	Polyproline II helix	trans	-103.4	139.3	-179.7	36.3	-32.5	0	0	0	115.6
33	G	36.3	Very low	43.2	Very low	77 Å²	77	132.6 Å²	132.6	79%	0.794	78%	0.784	S	S	*	*			trans	93.8	115.8	138.9	0	0	0	0	0	120.5
34	I	37	Very low	43	Very low	164 Å²	164	133.3 Å²	133.3	84%	0.841	78%	0.781	S	S	*	*			trans	-156.3	152.1	171.9	-62.2	-177.2	0	0	0	106.9
35	P	59.4	Low	42.9	Very low	104 Å²	104	131.4 Å²	131.4	68%	0.675	78%	0.779	S	S	*	*			cis	-120.1	-152.6	-20.1	35.3	-13.1	0	0	0	111.3
36	P	49.8	Very low	42.3	Very low	115 Å²	115	135.2 Å²	135.2	75%	0.747	79%	0.79	S	S	*	*				-147.8	137.8	72.2	36.3	-14.7	0	0	0	119.1
37	H	33.8	Very low	41.4	Very low	181 Å²	181	133.9 Å²	133.9	84%	0.838	79%	0.789	S	S	*	*			trans	62	152.5	147.3	-78.7	-90.3	0	0	0	125.8
38	F	35.3	Very low	40.6	Very low	192 Å²	192	136.9 Å²	136.9	84%	0.842	79%	0.792	S	S	*	*			trans	-90.1	178	-172.5	-90.7	-95.4	0	0	0	113.6
39	P	41.8	Very low	40.3	Very low	117 Å²	117	137.8 Å²	137.8	76%	0.76	79%	0.794	S	S	*	*			cis	-142.7	-151.2	33.1	41.6	-15.9	0	0	0	116.1
40	P	49.2	Very low	39.7	Very low	103 Å²	103	135 Å²	135	67%	0.669	79%	0.789	S	S	*	*				-129.6	-155.2	-95.9	43.6	-24.3	0	0	0	115.4
41	M	33.3	Very low	39.7	Very low	189 Å²	189	138.7 Å²	138.7	93%	0.931	80%	0.804	S	S	*	*			trans	87.6	140.7	178.5	-49.7	-78.9	-90.4	0	0	114.7
42	G	31.2	Very low	39	Very low	71 Å²	71	137.8 Å²	137.8	73%	0.732	80%	0.801	S	S	*	*			cis	-172	168	-4.2	0	0	0	0	0	110.9
43	I	35.7	Very low	38.3	Very low	164 Å²	164	140.2 Å²	140.2	84%	0.841	80%	0.804	S	S	*	*			trans	-136.5	133.2	-165.1	-60.6	160.6	0	0	0	112.4
44	P	39.3	Very low	38.2	Very low	117 Å²	117	142.6 Å²	142.6	76%	0.76	80%	0.803	S	S	*	*			trans	-139.3	-139	132.5	35.9	-15.3	0	0	0	113.5
45	P	44	Very low	38.8	Very low	120 Å²	120	139.7 Å²	139.7	78%	0.779	80%	0.795	S	S	*	*				-135.8	179.6	-112.7	43.5	-24	0	0	0	118.8
46	M	37.1	Very low	37.4	Very low	186 Å²	186	142.3 Å²	142.3	92%	0.916	80%	0.802	S	S	*	*			trans	-78.6	160.3	161.3	-66.7	-179.1	170.5	0	0	113
47	A	35.7	Very low	37	Very low	91 Å²	91	142.1 Å²	142.1	75%	0.752	80%	0.801	S	S	*	*				174.4	127.6	123.2	0	0	0	0	0	117.1
48	Q	33.4	Very low	37.3	Very low	183 Å²	183	139.3 Å²	139.3	86%	0.855	80%	0.799	S	S	*	*			trans	45.8	139.2	131.9	-52.4	-167.3	25	0	0	126.4
49	R	31.5	Very low	37.1	Very low	233 Å²	233	133.7 Å²	133.7	88%	0.879	80%	0.795	S	S	*	*			trans	36.7	140.8	142.7	-92.1	-173.3	170.8	-166.2	-1.5	123.7
50	P	34.5	Very low	36.8	Very low	120 Å²	120	136.3 Å²	136.3	78%	0.779	80%	0.801	S	S	*	*			trans	-88.1	156.3	165.3	36.9	-34.8	0	0	0	114.3
51	P	43.2	Very low	35.9	Very low	128 Å²	128	139.5 Å²	139.5	83%	0.831	81%	0.809	S	S	*	*			trans	-100.9	-179.4	179.1	39.9	-36.4	0	0	0	114.9
52	S	30.5	Very low	36.5	Very low	109 Å²	109	135.6 Å²	135.6	76%	0.762	80%	0.798	S	S	*	*			trans	-107.3	175.5	176.3	57.4	0	0	0	0	113.5
53	M	32.6	Very low	37.1	Very low	181 Å²	181	138.2 Å²	138.2	89%	0.892	80%	0.802	S	S	*	*			trans	-141.3	153	-178.3	-85.8	-80.5	148.7	0	0	112.1
54	T	33.2	Very low	36.8	Very low	126 Å²	126	133.7 Å²	133.7	77%	0.773	80%	0.796	S	S	*	*			trans	-159.8	173.3	-174.6	51.3	0	0	0	0	110
55	P	49.5	Very low	36.5	Very low	104 Å²	104	136.2 Å²	136.2	68%	0.675	80%	0.801	S	S	*	*			cis	-138	-165.6	-38.3	35.4	-14.6	0	0	0	114.5
56	L	30.5	Very low	35.8	Very low	158 Å²	158	138.5 Å²	138.5	83%	0.827	80%	0.803	S	S	*	*			trans	76.8	163.9	157.3	-66.2	163.5	0	0	0	119.7
57	P	42.7	Very low	36.3	Very low	112 Å²	112	134.9 Å²	134.9	73%	0.727	79%	0.793	S	S	*	*			cis	-132	-148	-30.8	33.7	-10.1	0	0	0	113
58	P	40.3	Very low	36.9	Very low	121 Å²	121	136.4 Å²	136.4	79%	0.786	80%	0.796	S	S	*	*				-130.7	149.5	-85.3	40.8	-24.1	0	0	0	118.7
59	G	31	Very low	37	Very low	74 Å²	74	136.7 Å²	136.7	76%	0.763	80%	0.799	S	S	*	*			trans	65.7	126.6	130.5	0	0	0	0	0	124.8
60	I	35.5	Very low	37	Very low	173 Å²	173	130.6 Å²	130.6	89%	0.887	80%	0.799	S	S	*	*			trans	-164.2	157.5	144.1	-101.1	156.7	0	0	0	108.5
61	M	29.8	Very low	36.8	Very low	169 Å²	169	129.3 Å²	129.3	83%	0.833	80%	0.799	S	S	*	*			trans	-127.5	-157.8	-175.7	-62.4	-148	-53.6	0	0	113.6
62	P	46.5	Very low	36.8	Very low	108 Å²	108	129.1 Å²	129.1	70%	0.701	80%	0.797	S	S	*	*				-118.5	-164.7	-96.5	43.3	-25.9	0	0	0	111.8
63	P	42.7	Very low	37.5	Very low	126 Å²	126	129.7 Å²	129.7	82%	0.818	80%	0.798	S	S	*	*				-154.3	161.8	75.3	40.1	-19.7	0	0	0	118.3
64	G	30.2	Very low	37.5	Very low	69 Å²	69	130.3 Å²	130.3	71%	0.711	80%	0.801	S	S	*	*				94.4	111.4	129.2	0	0	0	0	0	121.6
65	I	33	Very low	37.3	Very low	170 Å²	170	128 Å²	128	87%	0.872	80%	0.803	S	S	*	*			trans	138	127.4	133.1	-70.9	164.4	0	0	0	112.9
66	M	28.2	Very low	36.4	Very low	168 Å²	168	132.4 Å²	132.4	83%	0.828	81%	0.814	S	S	*	*			trans	-133.9	-168	164	-62.5	-152.1	-52.3	0	0	108.8
67	P	47.4	Very low	36.5	Very low	109 Å²	109	133.4 Å²	133.4	71%	0.708	82%	0.817	S	S	*	*				-107.2	-155.8	-96.4	35.1	-15.4	0	0	0	110.6
68	P	49.1	Very low	36	Very low	123 Å²	123	133.6 Å²	133.6	80%	0.799	82%	0.818	S	S	*	*				-147.3	174.9	78.2	38.2	-19	0	0	0	115.7
69	M	36	Very low	35.5	Very low	189 Å²	189	133.4 Å²	133.4	93%	0.931	82%	0.82	S	S	*	*			trans	-76.5	159.1	161.7	-77.7	-178.8	156	0	0	111.7
70	A	31.1	Very low	35.6	Very low	106 Å²	106	138.9 Å²	138.9	88%	0.876	83%	0.828	S	S	*	*			trans	-147.2	144.5	158.9	0	0	0	0	0	112.1
71	A	29.6	Very low	35.6	Very low	93 Å²	93	137.3 Å²	137.3	77%	0.769	82%	0.819	S	S	*	*			trans	-164.2	172.5	172.7	0	0	0	0	0	107.6
72	P	43.9	Very low	35.9	Very low	123 Å²	123	134.3 Å²	134.3	80%	0.799	81%	0.813	S	S	*	*			cis	-109.7	-120.4	-10.7	27.2	-3.2	0	0	0	109.7
73	P	45.1	Very low	35.3	Very low	121 Å²	121	135.1 Å²	135.1	79%	0.786	82%	0.818	S	S	*	*			cis	-124.8	-172.2	25.6	41.2	-23.6	0	0	0	115.7
74	M	31.5	Very low	34.7	Very low	194 Å²	194	137 Å²	137	96%	0.956	82%	0.818	S	S	*	*			trans	-81.5	161.3	178.3	-61.5	173.9	173.2	0	0	113.8
75	G	30.1	Very low	35.5	Very low	78 Å²	78	142 Å²	142	80%	0.804	83%	0.826	S	S	*	*			trans	-170.9	119.6	166.8	0	0	0	0	0	113.4
76	Q	31.2	Very low	35.5	Very low	196 Å²	196	139.3 Å²	139.3	92%	0.916	82%	0.82	S	S	*	*			trans	-55.1	145.8	-171.9	-63	160.3	-33	0	0	116.4
77	M	30.8	Very low	35.5	Very low	180 Å²	180	134.5 Å²	134.5	89%	0.887	81%	0.813	S	S	*	*			trans	-149.8	154.1	140.5	-93.4	-50.7	-136.5	0	0	109.7
78	P	32.9	Very low	34.9	Very low	115 Å²	115	137.9 Å²	137.9	75%	0.747	82%	0.822	S	S	*	*			trans	-86.3	152.2	-160.9	33.2	-36.8	0	0	0	115.5
79	S	30.2	Very low	33.9	Very low	118 Å²	118	141.3 Å²	141.3	83%	0.825	83%	0.83	S	S	*	*			trans	-78.4	128	174.6	-52	0	0	0	0	111.8
80	M	32.7	Very low	33.7	Very low	189 Å²	189	138.8 Å²	138.8	93%	0.931	82%	0.819	S	S	*	*			trans	-107.9	123.7	163.1	-92.9	-169	169.5	0	0	112.4
81	I	35.2	Very low	35.2	Very low	139 Å²	139	137.9 Å²	137.9	71%	0.713	81%	0.805	S	S	*	*	P	Polyproline II helix	trans	-58.2	136.2	178.7	-65.5	153.2	0	0	0	111.1
82	P	36.1	Very low	35.7	Very low	106 Å²	106	139.6 Å²	139.6	69%	0.688	81%	0.808	S	S	*	*	P	Polyproline II helix	trans	-72.2	132.2	159.4	31.2	-31.6	0	0	0	109.1	M84	P82-M84 PolarHBondContact O-N 3.41Å
83	P	34.8	Very low	35	Very low	126 Å²	126	144.6 Å²	144.6	82%	0.818	81%	0.811	S	S	*	*	P	Polyproline II helix	trans	-61	133.2	178.9	25.6	-33.5	0	0	0	110.5
84	M	30.5	Very low	34.7	Very low	165 Å²	165	145.4 Å²	145.4	81%	0.813	81%	0.807	S	S	*	*	P	Polyproline II helix	trans	-71.4	157.2	-177.8	-66.1	-175.4	177.1	0	0	112.2	P82 P86	P82-M84 PolarHBondContact O-N 3.41Å; M84-P86 WeakPolarHBondContact O-CD 3.17Å
85	I	45.9	Very low	35.4	Very low	173 Å²	173	142.3 Å²	142.3	89%	0.887	80%	0.802	S	S	*	*			trans	-103.7	106.3	152.3	-57.7	171.4	0	0	0	107.9
86	P	32.2	Very low	35.4	Very low	114 Å²	114	143.4 Å²	143.4	74%	0.74	80%	0.803	S	S	*	*			trans	-106.5	143.2	157.7	28.7	-15	0	0	0	110.4	M84	M84-P86 WeakPolarHBondContact O-CD 3.17Å
87	G	30.2	Very low	35.2	Very low	67 Å²	67	138.8 Å²	138.8	69%	0.691	80%	0.798	S	S	*	*			cis	153.1	121	-7.2	0	0	0	0	0	112
88	M	33.7	Very low	35.2	Very low	181 Å²	181	136.4 Å²	136.4	89%	0.892	79%	0.794	S	S	*	*			trans	46.1	122.1	157.2	-63.1	163.6	51.4	0	0	120
89	M	29.1	Very low	35.1	Very low	194 Å²	194	137.4 Å²	137.4	96%	0.956	80%	0.798	S	S	*	*				-166.5	-179.1	114.9	-110.5	-177.1	173.7	0	0	114.3
90	L	31.5	Very low	35.1	Very low	137 Å²	137	140 Å²	140	72%	0.717	80%	0.797	S	S	*	*			trans	-108.4	166.4	-169.2	-83.2	162.1	0	0	0	112.3
91	P	61.2	Low	35.6	Very low	87 Å²	87	136 Å²	136	57%	0.565	79%	0.785	S	S	*	*			trans	-88.4	171.2	-175.9	36.8	-38.4	0	0	0	114.1
92	P	40.4	Very low	35.4	Very low	129 Å²	129	135.5 Å²	135.5	84%	0.838	79%	0.789	S	S	*	*			trans	-105.8	177.6	156.9	37.6	-28.6	0	0	0	113.1
93	R	29.7	Very low	35.1	Very low	227 Å²	227	133.7 Å²	133.7	86%	0.857	79%	0.789	S	S	*	*			trans	-108.7	160.5	-163.2	-75.2	167.8	66.5	166.5	2	114.8
94	I	38.3	Very low	36	Very low	138 Å²	138	133.7 Å²	133.7	71%	0.708	79%	0.789	S	S	*	*			trans	-22.2	150.4	152.2	13	168.1	0	0	0	116.3
95	P	46	Very low	36.9	Very low	130 Å²	130	131.4 Å²	131.4	84%	0.844	79%	0.786	S	S	*	*				-143.7	168.5	83.4	39.4	-22.8	0	0	0	118
96	A	30	Very low	36.2	Very low	100 Å²	100	126.4 Å²	126.4	83%	0.826	78%	0.777	S	S	*	*			trans	-84.8	168.6	-169.3	0	0	0	0	0	116.3
97	A	26.8	Very low	36.3	Very low	100 Å²	100	127.4 Å²	127.4	83%	0.826	78%	0.781	S	S	*	*			trans	-147.5	145.3	153.2	0	0	0	0	0	111.8
98	T	30.9	Very low	36.3	Very low	130 Å²	130	130.6 Å²	130.6	80%	0.798	78%	0.782	S	S	*	*			trans	-72.9	170.1	165.1	43.3	0	0	0	0	110.1
99	V	31.7	Very low	35.9	Very low	135 Å²	135	127.2 Å²	127.2	82%	0.818	77%	0.772	S	S	*	*			cis	-155	159.8	39.7	-156.4	0	0	0	0	112.1
100	Q	30.2	Very low	35.9	Very low	174 Å²	174	124.3 Å²	124.3	81%	0.813	77%	0.766	S	S	*	*			trans	-57.4	170.6	157	-99.9	-177.6	17.5	0	0	112.7
101	P	43.5	Very low	35.9	Very low	103 Å²	103	124.4 Å²	124.4	67%	0.669	77%	0.771	S	S	*	*			cis	-156.5	179.8	47.3	43.6	-20.7	0	0	0	120.9
102	T	30.6	Very low	35.5	Very low	130 Å²	130	126 Å²	126	80%	0.798	78%	0.782	S	S	*	*			trans	57.3	118.7	151.6	50.1	0	0	0	0	122.4
103	G	28.9	Very low	34.9	Very low	67 Å²	67	124 Å²	124	69%	0.691	78%	0.776	S	S	*	*			trans	-93.9	-144.8	137.8	0	0	0	0	0	109.9
104	P	53.9	Low	35.1	Very low	126 Å²	126	118.2 Å²	118.2	82%	0.818	78%	0.777	S	S	*	*			cis	-127.5	-131.5	-10.3	40.8	-20.1	0	0	0	109
105	P	49.7	Very low	34.6	Very low	117 Å²	117	116.6 Å²	116.6	76%	0.76	78%	0.784	S	S	*	*			cis	-131.5	177	-34.3	38.2	-21.7	0	0	0	115.6
106	G	31.3	Very low	33.9	Very low	68 Å²	68	114.9 Å²	114.9	70%	0.701	78%	0.781	S	S	*	*			trans	89.6	160.5	147.1	0	0	0	0	0	118.7
107	V	35.6	Very low	35	Very low	135 Å²	135	116.2 Å²	116.2	82%	0.818	78%	0.781	S	S	*	*			cis	-158.5	156	-9.9	-97.1	0	0	0	0	110.5
108	D	28.3	Very low	35.1	Very low	134 Å²	134	114.8 Å²	114.8	72%	0.717	78%	0.776	S	S	*	*			trans	37.2	126.3	154.2	-72.8	-79.5	0	0	0	123.6
109	T	26.6	Very low	35	Very low	110 Å²	110	114.8 Å²	114.8	68%	0.675	78%	0.776	S	S	*	*				77	110.7	75.7	-47.6	0	0	0	0	113.3
110	T	29.2	Very low	34.8	Very low	134 Å²	134	113.9 Å²	113.9	82%	0.822	77%	0.771	S	S	*	*				-173	168.6	94.5	35.7	0	0	0	0	113.4
111	V	31.6	Very low	34.9	Very low	138 Å²	138	111.4 Å²	111.4	84%	0.836	77%	0.773	S	S	*	*			trans	-122.6	-173.8	171.7	-114.3	0	0	0	0	109.2
112	P	51.5	Low	34.2	Very low	122 Å²	122	109.6 Å²	109.6	79%	0.792	77%	0.773	S	S	*	*			cis	-122.6	-136.6	-5.3	25.5	2.5	0	0	0	110.9
113	A	29.4	Very low	34	Very low	86 Å²	86	110.4 Å²	110.4	71%	0.711	78%	0.778	S	S	*	*			cis	-165	153.5	1	0	0	0	0	0	114.1
114	A	33	Very low	34	Very low	106 Å²	106	115.2 Å²	115.2	88%	0.876	79%	0.788	S	S	*	*			trans	60.8	160.5	155.1	0	0	0	0	0	119.6
115	A	28	Very low	32.6	Very low	103 Å²	103	112.1 Å²	112.1	85%	0.851	78%	0.779	S	S	*	*			cis	-146.6	-171.8	3.2	0	0	0	0	0	112.3
116	A	31.2	Very low	31.6	Very low	95 Å²	95	112.1 Å²	112.1	79%	0.785	78%	0.782	S	S	*	*			trans	-131.6	-161.9	-178.6	0	0	0	0	0	111
117	P	52.5	Low	32.2	Very low	128 Å²	128	114.5 Å²	114.5	83%	0.831	79%	0.785	S	S	*	*			cis	-141	179.4	-10.4	42.6	-24	0	0	0	117.4
118	G	29.2	Very low	32.9	Very low	70 Å²	70	113.6 Å²	113.6	72%	0.722	78%	0.782	S	S	*	*			trans	92.6	162.9	152.7	0	0	0	0	0	119.7
119	T	30	Very low	32.8	Very low	129 Å²	129	115.5 Å²	115.5	79%	0.791	79%	0.786	S	S	*	*			cis	-161.7	151.2	-15.6	-43.4	0	0	0	0	111.1
120	T	27.7	Very low	33	Very low	116 Å²	116	118.2 Å²	118.2	71%	0.712	79%	0.791	S	S	*	*			trans	3.7	125.9	167.1	57	0	0	0	0	122.1
121	S	31.9	Very low	33.3	Very low	123 Å²	123	118.6 Å²	118.6	86%	0.86	78%	0.784	S	S	*	*				70.7	137	85.8	-45.7	0	0	0	0	117.1
122	G	28.4	Very low	33.6	Very low	64 Å²	64	117.8 Å²	117.8	66%	0.66	78%	0.781	S	S	*	*			cis	169.5	178.8	-5	0	0	0	0	0	114.6
123	T	26.6	Very low	32.9	Very low	147 Å²	147	120.7 Å²	120.7	90%	0.902	78%	0.781	S	S	*	*			trans	69.9	151.3	177.8	76.1	0	0	0	0	116.2
124	N	27.8	Very low	33.4	Very low	168 Å²	168	126.4 Å²	126.4	90%	0.898	79%	0.79	S	S	*	*			cis	-159.2	161.8	19.3	-168.9	12	0	0	0	111.4
125	G	26.3	Very low	33.8	Very low	62 Å²	62	130.6 Å²	130.6	64%	0.639	79%	0.789	S	S	*	*			trans	129.5	151.5	168.2	0	0	0	0	0	117.9
126	S	28	Very low	34.8	Very low	117 Å²	117	129.7 Å²	129.7	82%	0.818	78%	0.776	S	S	*	*			trans	-153.8	-172.1	-174.8	-40.3	0	0	0	0	110.6
127	P	44.2	Very low	36.7	Very low	117 Å²	117	126.6 Å²	126.6	76%	0.76	75%	0.747	S	S	*	*			cis	-120.5	-149.5	-43	40.7	-24	0	0	0	109.7
128	P	49.5	Very low	37.7	Very low	117 Å²	117	122.8 Å²	122.8	76%	0.76	72%	0.716	S	S	*	*			cis	-101.7	-168.4	-35.8	35.3	-17	0	0	0	110.8
129	E	27.1	Very low	39.8	Very low	173 Å²	173	121.6 Å²	121.6	81%	0.808	70%	0.695	S	S	*	*			cis	-166.5	162.5	43.3	-177.6	157.4	-151.3	0	0	113.4
130	E	30.2	Very low	42.4	Very low	168 Å²	168	120.1 Å²	120.1	79%	0.785	68%	0.679	S	S	*	*			trans	33.3	117.6	173.8	-67.5	-152.8	122.1	0	0	125.6
131	Q	36.2	Very low	44.5	Very low	142 Å²	142	118.4 Å²	118.4	66%	0.664	66%	0.663	S	S	*	*			trans	41.1	130.3	131	-65.2	-69.6	-26	0	0	120.8
132	P	36.2	Very low	46.9	Very low	120 Å²	120	118.8 Å²	118.8	78%	0.779	65%	0.649	S	S	*	*				-143.4	167.5	66.5	39.5	-23.2	0	0	0	117.4	K134	P132-K134 PolarHBondContact O-N 2.87Å
133	K	37.9	Very low	49	Very low	183 Å²	183	117.3 Å²	117.3	80%	0.796	63%	0.629	S	S	*	*	P	Polyproline II helix	trans	-63.3	122	178.9	-61.5	170.6	-177.3	173.8	0	112.5
134	K	39.9	Very low	50.5	Low	207 Å²	207	119.5 Å²	119.5	90%	0.9	63%	0.634	S	S	*	*	P	Polyproline II helix	trans	-70.1	144.7	166	-70.7	-169.5	175.7	-170.9	0	110.9	P132	P132-K134 PolarHBondContact O-N 2.87Å
135	K	41.1	Very low	52	Low	194 Å²	194	116.7 Å²	116.7	84%	0.843	62%	0.619	S	S	*	*	P	Polyproline II helix	trans	-94.9	146.4	170	-60.7	175.5	-176.6	175.7	0	108.6
136	S	49.4	Very low	53.8	Low	84 Å²	84	116.2 Å²	116.2	59%	0.587	61%	0.614	S	S	*	*	P	Polyproline II helix	trans	-65.7	133.8	-178.6	-51	0	0	0	0	111.9
137	V	69.6	Low	55.3	Low	30 Å²	30	116.4 Å²	116.4	18%	0.182	60%	0.6	C	S	.	*	S	Bend	trans	-78.3	-23.6	-175.6	171.9	0	0	0	0	112.6	N152 T153 E154	V137-N152 VanDerWaalsContact CG1-OD1 3.23Å; V137-N152 WeakPolarHBondContact CG1-OD1 3.46Å; V137-T153 PolarHBondContact O-N 2.99Å; V137-T153 PolarHBondContact O-OG1 3.01Å; V137-E154 HydrophobicContact CG1-CB 3.86Å; V137-E154 HydrophobicContact CG1-CG 3.69Å; V137-E154 HydrophobicContact CG2-CG 4.43Å
138	W	74.4	Confident	57.1	Low	47 Å²	47	112.7 Å²	112.7	18%	0.178	58%	0.575	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-95.3	140.7	178.8	-67.3	92.7	0	0	0	112.6	Y151 N152 T159 P163 L166	W138-Y151 WeakPolarHBondContact CA-O 3.1Å; W138-N152 HydrophobicContact CD2-CB 3.87Å; W138-N152 HydrophobicContact CE3-CB 3.64Å; W138-N152 HydrophobicContact CH2-CB 3.73Å; W138-N152 HydrophobicContact CZ2-CB 3.92Å; W138-N152 VanDerWaalsContact CZ2-ND2 3.3Å; W138-N152 WeakPolarHBondContact CZ2-ND2 2.97Å; W138-N152 HydrophobicContact CZ3-CB 3.56Å; W138-N152 PolarHBondContact NE1-ND2 3.04Å; W138-T159 HydrophobicContact CH2-CG2 4.1Å; W138-T159 HydrophobicContact CZ3-CG2 3.7Å; W138-P163 HydrophobicContact CB-CG 4.26Å; W138-P163 HydrophobicContact CD2-CB 3.88Å; W138-P163 HydrophobicContact CD2-CG 3.4Å; W138-P163 HydrophobicContact CE3-CB 4.39Å; W138-P163 HydrophobicContact CE3-CG 3.44Å; W138-P163 VanDerWaalsContact CE3-CG 3.44Å; W138-P163 HydrophobicContact CG-CB 3.99Å; W138-P163 HydrophobicContact CG-CG 3.8Å; W138-P163 HydrophobicContact CH2-CG 4.23Å; W138-P163 HydrophobicContact CZ2-CB 4.39Å; W138-P163 HydrophobicContact CZ2-CG 4.22Å; W138-P163 HydrophobicContact CZ3-CG 3.88Å; W138-L166 HydrophobicContact CB-CD1 3.72Å; W138-L166 HydrophobicContact CB-CG 4.31Å
139	T	73.6	Confident	58.4	Low	45 Å²	45	110 Å²	110	28%	0.276	55%	0.55	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-134.6	129.7	-172.6	50.9	0	0	0	0	111.5	H141 Y151 T153	T139-H141 PolarHBondContact O-ND1 2.8Å; T139-H141 PolarHBondContact OG1-CE1 3.39Å; T139-H141 VanDerWaalsContact OG1-CE1 3.25Å; T139-Y151 PolarHBondContact N-O 2.89Å; T139-Y151 PolarHBondContact O-N 2.83Å; T139-Y151 PolarHBondContact OG1-O 3.44Å; T139-T153 HydrophobicContact CG2-CG2 3.78Å
140	E	83.8	Confident	61	Low	98 Å²	98	103.1 Å²	103.1	46%	0.458	52%	0.517	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.1	131.1	176.7	-167.3	176	135.3	0	0	111	K142 T148 Y150	E140-K142 IonicContact OE1-NZ 2.83Å; E140-K142 PolarHBondContact OE1-NZ 3.11Å; E140-T148 VanDerWaalsContact CD-CG2 3.4Å; E140-T148 HydrophobicContact CG-CG2 3.51Å; E140-T148 WeakPolarHBondContact OE1-CG2 2.79Å; E140-T148 PolarHBondContact OE1-OG1 3.04Å; E140-Y150 HydrophobicContact CB-CD1 4Å; E140-Y150 HydrophobicContact CB-CE1 3.71Å; E140-Y150 HydrophobicContact CG-CD1 4.12Å; E140-Y150 HydrophobicContact CG-CE1 3.59Å; E140-Y150 VanDerWaalsContact OE2-CE1 3.29Å; E140-Y150 WeakPolarHBondContact OE2-CE1 3.11Å; E140-Y150 PolarHBondContact OE2-OH 3.07Å
141	H	72.7	Confident	63	Low	80 Å²	80	98.6 Å²	98.6	37%	0.37	49%	0.493	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	160.9	174.1	-71.9	77.6	0	0	0	109.8	T139 T148 Y149	T139-H141 PolarHBondContact O-ND1 2.8Å; T139-H141 PolarHBondContact OG1-CE1 3.39Å; T139-H141 VanDerWaalsContact OG1-CE1 3.25Å; H141-T148 CarbonylContact O-C 3.6Å; H141-T148 WeakPolarHBondContact O-CA 3.49Å; H141-Y149 HydrophobicContact CB-CD1 4.36Å; H141-Y149 HydrophobicContact CB-CD2 4.25Å; H141-Y149 HydrophobicContact CB-CE1 3.84Å; H141-Y149 HydrophobicContact CB-CE2 3.73Å; H141-Y149 PolarHBondContact N-O 2.88Å; H141-Y149 PolarHBondContact O-N 2.99Å
142	K	82.1	Confident	64.9	Low	131 Å²	131	92.4 Å²	92.4	57%	0.57	47%	0.465	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-121.9	136.6	173.6	-58.7	-167.9	-169	-55.5	0	110	E140 T148	E140-K142 IonicContact OE1-NZ 2.83Å; E140-K142 PolarHBondContact OE1-NZ 3.11Å; K142-T148 PolarHBondContact NZ-OG1 2.97Å
143	S	71.8	Confident	66.5	Low	33 Å²	33	89.3 Å²	89.3	23%	0.231	44%	0.444	C	S	.	.			trans	-75.4	167.5	174.2	60.1	0	0	0	0	111.6	D145 G146 K147	S143-D145 PolarHBondContact O-N 2.73Å; S143-G146 WeakPolarHBondContact O-CA 3.44Å; S143-G146 PolarHBondContact O-N 3.02Å; S143-K147 PolarHBondContact N-O 3.16Å; S143-K147 PolarHBondContact OG-N 3.17Å; S143-K147 PolarHBondContact OG-O 3.32Å
144	L	58	Low	68	Low	193 Å²	193	87.5 Å²	87.5	100%	1.01	44%	0.438	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.7	-21.9	177.8	-61.9	173.6	0	0	0	113.1	G146	L144-G146 PolarHBondContact O-N 2.66Å
145	D	60.2	Low	69.7	Low	110 Å²	110	81 Å²	81	59%	0.588	42%	0.416	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.5	21.5	172.3	-173.1	37.6	0	0	0	112.3	S143 K147	S143-D145 PolarHBondContact O-N 2.73Å; D145-K147 PolarHBondContact O-N 3.44Å; D145-K147 WeakPolarHBondContact OD2-CD 3.19Å; D145-K147 WeakPolarHBondContact OD2-CE 3.33Å; D145-K147 IonicContact OD2-NZ 2.75Å; D145-K147 PolarHBondContact OD2-NZ 2.9Å
146	G	63.7	Low	71.3	Confident	51 Å²	51	78.3 Å²	78.3	53%	0.526	40%	0.404	S	S	.	.	S	Bend	trans	69.5	-16.6	177.5	0	0	0	0	0	116.4	S143 L144 T148	S143-G146 WeakPolarHBondContact O-CA 3.44Å; S143-G146 PolarHBondContact O-N 3.02Å; L144-G146 PolarHBondContact O-N 2.66Å; G146-T148 PolarHBondContact O-N 3.05Å
147	K	60.2	Low	72	Confident	121 Å²	121	80.3 Å²	80.3	53%	0.526	40%	0.404	S	S	.	.			trans	-66.4	127.6	-177.3	-67.9	162.6	-178.1	158.1	0	111.3	S143 D145 W160	S143-K147 PolarHBondContact N-O 3.16Å; S143-K147 PolarHBondContact OG-N 3.17Å; S143-K147 PolarHBondContact OG-O 3.32Å; D145-K147 PolarHBondContact O-N 3.44Å; D145-K147 WeakPolarHBondContact OD2-CD 3.19Å; D145-K147 WeakPolarHBondContact OD2-CE 3.33Å; D145-K147 IonicContact OD2-NZ 2.75Å; D145-K147 PolarHBondContact OD2-NZ 2.9Å; K147-W160 HydrophobicContact CB-CE3 4.47Å; K147-W160 HydrophobicContact CB-CZ3 3.76Å
148	T	81.6	Confident	72.4	Confident	39 Å²	39	82.5 Å²	82.5	24%	0.239	42%	0.421	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.5	138.6	171.9	-79.8	0	0	0	0	111.5	E140 H141 K142 G146 Y150 W160	E140-T148 VanDerWaalsContact CD-CG2 3.4Å; E140-T148 HydrophobicContact CG-CG2 3.51Å; E140-T148 WeakPolarHBondContact OE1-CG2 2.79Å; E140-T148 PolarHBondContact OE1-OG1 3.04Å; H141-T148 CarbonylContact O-C 3.6Å; H141-T148 WeakPolarHBondContact O-CA 3.49Å; K142-T148 PolarHBondContact NZ-OG1 2.97Å; G146-T148 PolarHBondContact O-N 3.05Å; T148-Y150 HydrophobicContact CG2-CD2 4.38Å; T148-Y150 HydrophobicContact CG2-CE1 4.27Å; T148-Y150 HydrophobicContact CG2-CE2 3.69Å; T148-W160 VanDerWaalsContact O-CE3 3.23Å
149	Y	77.4	Confident	72.3	Confident	61 Å²	61	82.4 Å²	82.4	24%	0.239	43%	0.426	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.5	158.2	161.4	65.5	-85.8	0	0	0	110.5	H141 W160	H141-Y149 HydrophobicContact CB-CD1 4.36Å; H141-Y149 HydrophobicContact CB-CD2 4.25Å; H141-Y149 HydrophobicContact CB-CE1 3.84Å; H141-Y149 HydrophobicContact CB-CE2 3.73Å; H141-Y149 PolarHBondContact N-O 2.88Å; H141-Y149 PolarHBondContact O-N 2.99Å; Y149-W160 HydrophobicContact CD1-CH2 4.23Å; Y149-W160 HydrophobicContact CD1-CZ3 4.23Å; Y149-W160 HydrophobicContact CG-CZ3 4.48Å
150	Y	82.3	Confident	72.2	Confident	29 Å²	29	88 Å²	88	11%	0.114	44%	0.442	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108	127	179.5	-61.4	-81.1	0	0	0	109.7	E140 T148 S158 T159 K162 P163 L166	E140-Y150 HydrophobicContact CB-CD1 4Å; E140-Y150 HydrophobicContact CB-CE1 3.71Å; E140-Y150 HydrophobicContact CG-CD1 4.12Å; E140-Y150 HydrophobicContact CG-CE1 3.59Å; E140-Y150 VanDerWaalsContact OE2-CE1 3.29Å; E140-Y150 WeakPolarHBondContact OE2-CE1 3.11Å; E140-Y150 PolarHBondContact OE2-OH 3.07Å; T148-Y150 HydrophobicContact CG2-CD2 4.38Å; T148-Y150 HydrophobicContact CG2-CE1 4.27Å; T148-Y150 HydrophobicContact CG2-CE2 3.69Å; Y150-S158 CarbonylContact O-C 3.58Å; Y150-S158 WeakPolarHBondContact O-CA 3.12Å; Y150-T159 PolarHBondContact N-O 2.73Å; Y150-T159 PolarHBondContact O-N 3.31Å; Y150-K162 HydrophobicContact CD2-CB 4.19Å; Y150-K162 HydrophobicContact CE1-CG 4.34Å; Y150-K162 HydrophobicContact CE2-CB 3.72Å; Y150-K162 HydrophobicContact CE2-CG 4.11Å; Y150-P163 HydrophobicContact CG-CG 4.49Å; Y150-L166 HydrophobicContact CD1-CD1 3.89Å; Y150-L166 HydrophobicContact CE1-CD1 4.36Å
151	Y	70.1	Confident	71.3	Confident	73 Å²	73	90.9 Å²	90.9	29%	0.286	46%	0.455	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	125.5	-174.4	-179.4	-112.6	0	0	0	111.2	W138 T139 T153 K156	W138-Y151 WeakPolarHBondContact CA-O 3.1Å; T139-Y151 PolarHBondContact N-O 2.89Å; T139-Y151 PolarHBondContact O-N 2.83Å; T139-Y151 PolarHBondContact OG1-O 3.44Å; Y151-T153 HydrophobicContact CD1-CG2 4.36Å; Y151-K156 WeakPolarHBondContact CE2-O 3.35Å; Y151-K156 WeakPolarHBondContact OH-CD 3.38Å
152	N	77.6	Confident	71.2	Confident	11 Å²	11	90.3 Å²	90.3	6%	0.059	45%	0.452	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.1	116.9	174.1	-169.5	-51.8	0	0	0	109.3	V137 W138 E154 T155 K156 Q157	V137-N152 VanDerWaalsContact CG1-OD1 3.23Å; V137-N152 WeakPolarHBondContact CG1-OD1 3.46Å; W138-N152 HydrophobicContact CD2-CB 3.87Å; W138-N152 HydrophobicContact CE3-CB 3.64Å; W138-N152 HydrophobicContact CH2-CB 3.73Å; W138-N152 HydrophobicContact CZ2-CB 3.92Å; W138-N152 VanDerWaalsContact CZ2-ND2 3.3Å; W138-N152 WeakPolarHBondContact CZ2-ND2 2.97Å; W138-N152 HydrophobicContact CZ3-CB 3.56Å; W138-N152 PolarHBondContact NE1-ND2 3.04Å; N152-E154 VanDerWaalsContact C-N 3.29Å; N152-E154 PolarHBondContact O-N 3.21Å; N152-E154 WeakPolarHBondContact OD1-CA 3.47Å; N152-E154 WeakPolarHBondContact OD1-CB 3.38Å; N152-E154 PolarHBondContact OD1-N 3.3Å; N152-T155 VanDerWaalsContact CB-OG1 3.26Å; N152-T155 WeakPolarHBondContact CB-OG1 3.34Å; N152-T155 PolarHBondContact ND2-OG1 2.91Å; N152-T155 PolarHBondContact OD1-N 3.44Å; N152-K156 VanDerWaalsContact O-CA 3.31Å; N152-K156 WeakPolarHBondContact O-CA 3.12Å; N152-K156 PolarHBondContact O-N 3.25Å; N152-Q157 PolarHBondContact N-O 3.3Å
153	T	70.1	Confident	70.6	Confident	56 Å²	56	84.9 Å²	84.9	34%	0.344	43%	0.43	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73	-20.7	-177	57.3	0	0	0	0	113.5	V137 T139 Y151 K156	V137-T153 PolarHBondContact O-N 2.99Å; V137-T153 PolarHBondContact O-OG1 3.01Å; T139-T153 HydrophobicContact CG2-CG2 3.78Å; Y151-T153 HydrophobicContact CD1-CG2 4.36Å; T153-K156 WeakPolarHBondContact O-CE 3.21Å; T153-K156 PolarHBondContact O-NZ 3.31Å
154	E	69.4	Low	69.9	Low	144 Å²	144	88 Å²	88	67%	0.673	44%	0.444	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.3	-57.2	176	-69.9	176	176.1	0	0	111.6	V137 N152 K156	V137-E154 HydrophobicContact CG1-CB 3.86Å; V137-E154 HydrophobicContact CG1-CG 3.69Å; V137-E154 HydrophobicContact CG2-CG 4.43Å; N152-E154 VanDerWaalsContact C-N 3.29Å; N152-E154 PolarHBondContact O-N 3.21Å; N152-E154 WeakPolarHBondContact OD1-CA 3.47Å; N152-E154 WeakPolarHBondContact OD1-CB 3.38Å; N152-E154 PolarHBondContact OD1-N 3.3Å; E154-K156 VanDerWaalsContact C-N 3.31Å; E154-K156 PolarHBondContact O-N 3.06Å
155	T	75.1	Confident	69.9	Low	72 Å²	72	85.5 Å²	85.5	44%	0.442	43%	0.427	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80	-7.8	-176	74.3	0	0	0	0	114.5	N152 Q157	N152-T155 VanDerWaalsContact CB-OG1 3.26Å; N152-T155 WeakPolarHBondContact CB-OG1 3.34Å; N152-T155 PolarHBondContact ND2-OG1 2.91Å; N152-T155 PolarHBondContact OD1-N 3.44Å; T155-Q157 PolarHBondContact O-N 3.41Å; T155-Q157 VanDerWaalsContact O-N 3.11Å; T155-Q157 PolarHBondContact OG1-OE1 3.08Å
156	K	73.6	Confident	69.8	Low	137 Å²	137	83 Å²	83	60%	0.596	41%	0.413	S	S	*	.			trans	60.4	12.4	-176.8	-46.8	-57.4	176.7	-170.5	0	115	Y151 N152 T153 E154	Y151-K156 WeakPolarHBondContact CE2-O 3.35Å; Y151-K156 WeakPolarHBondContact OH-CD 3.38Å; N152-K156 VanDerWaalsContact O-CA 3.31Å; N152-K156 WeakPolarHBondContact O-CA 3.12Å; N152-K156 PolarHBondContact O-N 3.25Å; T153-K156 WeakPolarHBondContact O-CE 3.21Å; T153-K156 PolarHBondContact O-NZ 3.31Å; E154-K156 VanDerWaalsContact C-N 3.31Å; E154-K156 PolarHBondContact O-N 3.06Å
157	Q	64.7	Low	69.5	Low	125 Å²	125	83.4 Å²	83.4	58%	0.584	40%	0.401	S	S	*	.			trans	-83.3	141.8	177.8	-68.5	169.6	-19.2	0	0	111.1	N152 T155	N152-Q157 PolarHBondContact N-O 3.3Å; T155-Q157 PolarHBondContact O-N 3.41Å; T155-Q157 VanDerWaalsContact O-N 3.11Å; T155-Q157 PolarHBondContact OG1-OE1 3.08Å
158	S	78.3	Confident	69.3	Low	77 Å²	77	80.2 Å²	80.2	54%	0.538	39%	0.394	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	143.9	166.6	50.4	0	0	0	0	110.1	Y150	Y150-S158 CarbonylContact O-C 3.58Å; Y150-S158 WeakPolarHBondContact O-CA 3.12Å
159	T	71.6	Confident	67.8	Low	44 Å²	44	82.7 Å²	82.7	27%	0.27	41%	0.411	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136	146.3	172.9	177.2	0	0	0	0	110.2	W138 Y150 E161 P163	W138-T159 HydrophobicContact CH2-CG2 4.1Å; W138-T159 HydrophobicContact CZ3-CG2 3.7Å; Y150-T159 PolarHBondContact N-O 2.73Å; Y150-T159 PolarHBondContact O-N 3.31Å; T159-E161 VanDerWaalsContact C-N 3.34Å; T159-E161 WeakPolarHBondContact CG2-O 3.47Å; T159-E161 PolarHBondContact OG1-N 3.37Å; T159-E161 VanDerWaalsContact OG1-N 3.12Å; T159-E161 PolarHBondContact OG1-O 2.92Å; T159-P163 HydrophobicContact CG2-CG 4.15Å
160	W	72.6	Confident	66.3	Low	164 Å²	164	81.3 Å²	81.3	62%	0.621	41%	0.411	S	S	*	.	S	Bend	trans	-84.5	-12.8	174	-58.1	96.8	0	0	0	112.1	K147 T148 Y149	K147-W160 HydrophobicContact CB-CE3 4.47Å; K147-W160 HydrophobicContact CB-CZ3 3.76Å; T148-W160 VanDerWaalsContact O-CE3 3.23Å; Y149-W160 HydrophobicContact CD1-CH2 4.23Å; Y149-W160 HydrophobicContact CD1-CZ3 4.23Å; Y149-W160 HydrophobicContact CG-CZ3 4.48Å
161	E	63.4	Low	65.1	Low	158 Å²	158	83.5 Å²	83.5	74%	0.738	42%	0.423	S	S	*	.	S	Bend	trans	-97.9	130.7	175.5	-62.7	-165.9	156.4	0	0	111.4	T159 P163	T159-E161 VanDerWaalsContact C-N 3.34Å; T159-E161 WeakPolarHBondContact CG2-O 3.47Å; T159-E161 PolarHBondContact OG1-N 3.37Å; T159-E161 VanDerWaalsContact OG1-N 3.12Å; T159-E161 PolarHBondContact OG1-O 2.92Å; E161-P163 VanDerWaalsContact O-CD 3.31Å; E161-P163 WeakPolarHBondContact O-CD 3.28Å
162	K	71.8	Confident	64.2	Low	68 Å²	68	84.2 Å²	84.2	30%	0.296	43%	0.429	S	S	.	.	P	Polyproline II helix	trans	-58.7	118.2	-178.9	-171.7	-178.1	176.9	-164.7	0	111.3	Y150 L166 K167 E171	Y150-K162 HydrophobicContact CD2-CB 4.19Å; Y150-K162 HydrophobicContact CE1-CG 4.34Å; Y150-K162 HydrophobicContact CE2-CB 3.72Å; Y150-K162 HydrophobicContact CE2-CG 4.11Å; K162-L166 WeakPolarHBondContact CE-O 3.35Å; K162-L166 HydrophobicContact CG-CB 4.32Å; K162-L166 PolarHBondContact NZ-O 3.43Å; K162-K167 HydrophobicContact CD-CG 4.41Å; K162-K167 WeakPolarHBondContact O-CE 3.3Å; K162-E171 VanDerWaalsContact NZ-CD 3.3Å; K162-E171 IonicContact NZ-OE1 3.2Å; K162-E171 PolarHBondContact NZ-OE1 2.94Å; K162-E171 IonicContact NZ-OE2 3.18Å; K162-E171 PolarHBondContact NZ-OE2 3.49Å
163	P	69	Low	62.9	Low	16 Å²	16	89.2 Å²	89.2	10%	0.104	45%	0.453	C	S	.	.	P	Polyproline II helix	trans	-61.1	149.1	179.9	-24	33	0	0	0	113.4	W138 Y150 T159 E161 E165 L166 K167	W138-P163 HydrophobicContact CB-CG 4.26Å; W138-P163 HydrophobicContact CD2-CB 3.88Å; W138-P163 HydrophobicContact CD2-CG 3.4Å; W138-P163 HydrophobicContact CE3-CB 4.39Å; W138-P163 HydrophobicContact CE3-CG 3.44Å; W138-P163 VanDerWaalsContact CE3-CG 3.44Å; W138-P163 HydrophobicContact CG-CB 3.99Å; W138-P163 HydrophobicContact CG-CG 3.8Å; W138-P163 HydrophobicContact CH2-CG 4.23Å; W138-P163 HydrophobicContact CZ2-CB 4.39Å; W138-P163 HydrophobicContact CZ2-CG 4.22Å; W138-P163 HydrophobicContact CZ3-CG 3.88Å; Y150-P163 HydrophobicContact CG-CG 4.49Å; T159-P163 HydrophobicContact CG2-CG 4.15Å; E161-P163 VanDerWaalsContact O-CD 3.31Å; E161-P163 WeakPolarHBondContact O-CD 3.28Å; P163-E165 PolarHBondContact O-N 3.17Å; P163-E165 VanDerWaalsContact O-N 3.15Å; P163-L166 PolarHBondContact O-N 3.12Å; P163-K167 PolarHBondContact O-N 3.34Å
164	D	58.2	Low	62	Low	100 Å²	100	91.8 Å²	91.8	54%	0.535	46%	0.464	S	S	.	.	G	3₁₀ helix	trans	-62.6	-23.9	-174.5	-69	-44.4	0	0	0	114.6	L166 K167 Q172	D164-L166 VanDerWaalsContact C-N 3.28Å; D164-L166 PolarHBondContact O-N 3.33Å; D164-K167 PolarHBondContact O-N 3.08Å; D164-K167 WeakPolarHBondContact OD1-CD 3.33Å; D164-K167 VanDerWaalsContact OD1-CE 3.3Å; D164-K167 WeakPolarHBondContact OD1-CE 3.46Å; D164-K167 IonicContact OD1-NZ 2.63Å; D164-K167 PolarHBondContact OD1-NZ 2.79Å; D164-Q172 PolarHBondContact O-NE2 2.81Å; D164-Q172 VanDerWaalsContact O-NE2 3.13Å
165	E	57.1	Low	61.2	Low	139 Å²	139	89 Å²	89	65%	0.65	46%	0.46	S	S	*	.	G	3₁₀ helix	trans	-73.4	-15.8	174.8	-60.6	-176.6	159.6	0	0	113.7	P163	P163-E165 PolarHBondContact O-N 3.17Å; P163-E165 VanDerWaalsContact O-N 3.15Å
166	L	58.9	Low	60.2	Low	57 Å²	57	92.9 Å²	92.9	30%	0.298	47%	0.471	S	S	.	.	G	3₁₀ helix	trans	-103.9	-2.1	174.8	-71.2	173.6	0	0	0	112.5	W138 Y150 K162 P163 D164	W138-L166 HydrophobicContact CB-CD1 3.72Å; W138-L166 HydrophobicContact CB-CG 4.31Å; Y150-L166 HydrophobicContact CD1-CD1 3.89Å; Y150-L166 HydrophobicContact CE1-CD1 4.36Å; K162-L166 WeakPolarHBondContact CE-O 3.35Å; K162-L166 HydrophobicContact CG-CB 4.32Å; K162-L166 PolarHBondContact NZ-O 3.43Å; P163-L166 PolarHBondContact O-N 3.12Å; D164-L166 VanDerWaalsContact C-N 3.28Å; D164-L166 PolarHBondContact O-N 3.33Å
167	K	56.4	Low	59.3	Low	60 Å²	60	87.8 Å²	87.8	26%	0.261	45%	0.452	S	S	.	.	S	Bend	trans	-78.7	137	177.5	-71.7	-179.2	-167.1	163.7	0	111.3	K162 P163 D164 E171 Q172	K162-K167 HydrophobicContact CD-CG 4.41Å; K162-K167 WeakPolarHBondContact O-CE 3.3Å; P163-K167 PolarHBondContact O-N 3.34Å; D164-K167 PolarHBondContact O-N 3.08Å; D164-K167 WeakPolarHBondContact OD1-CD 3.33Å; D164-K167 VanDerWaalsContact OD1-CE 3.3Å; D164-K167 WeakPolarHBondContact OD1-CE 3.46Å; D164-K167 IonicContact OD1-NZ 2.63Å; D164-K167 PolarHBondContact OD1-NZ 2.79Å; K167-E171 VanDerWaalsContact CA-OE2 3.24Å; K167-E171 WeakPolarHBondContact CA-OE2 3.31Å; K167-E171 HydrophobicContact CB-CB 4.03Å; K167-E171 HydrophobicContact CG-CB 4.39Å; K167-Q172 HydrophobicContact CB-CG 4.17Å
168	S	56.5	Low	59.1	Low	54 Å²	54	83.1 Å²	83.1	38%	0.378	43%	0.433	S	S	.	.			trans	-61.1	149.7	170.9	171.9	0	0	0	0	110.6	A170 E171 Q172	S168-A170 PolarHBondContact O-N 2.97Å; S168-A170 VanDerWaalsContact O-N 3.11Å; S168-A170 PolarHBondContact OG-N 2.89Å; S168-E171 PolarHBondContact N-OE2 3.26Å; S168-E171 WeakPolarHBondContact O-CA 3.45Å; S168-E171 WeakPolarHBondContact O-CB 3.41Å; S168-E171 PolarHBondContact O-N 2.67Å; S168-Q172 PolarHBondContact O-N 3.48Å
169	P	49.2	Very low	58.8	Low	92 Å²	92	80.1 Å²	80.1	60%	0.597	41%	0.41	S	S	*	.	H	α-helix	trans	-49.1	-35.6	170.4	-29.2	36.6	0	0	0	113.6	Q172 M173	P169-Q172 PolarHBondContact O-N 2.85Å; P169-M173 WeakPolarHBondContact O-CG 3.46Å; P169-M173 PolarHBondContact O-N 3.27Å
170	A	46.2	Very low	59	Low	31 Å²	31	83.3 Å²	83.3	26%	0.256	42%	0.42	S	S	.	.	H	α-helix	trans	-66.3	-39.7	174.9	0	0	0	0	0	113	S168 M173 L174	S168-A170 PolarHBondContact O-N 2.97Å; S168-A170 VanDerWaalsContact O-N 3.11Å; S168-A170 PolarHBondContact OG-N 2.89Å; A170-M173 PolarHBondContact O-N 2.83Å; A170-L174 PolarHBondContact O-N 2.8Å
171	E	58.1	Low	59.5	Low	75 Å²	75	79.4 Å²	79.4	35%	0.35	41%	0.409	S	S	.	.	H	α-helix	trans	-67	-36.1	175.4	-67.8	174.4	124	0	0	111.2	K162 K167 S168 L174 S175	K162-E171 VanDerWaalsContact NZ-CD 3.3Å; K162-E171 IonicContact NZ-OE1 3.2Å; K162-E171 PolarHBondContact NZ-OE1 2.94Å; K162-E171 IonicContact NZ-OE2 3.18Å; K162-E171 PolarHBondContact NZ-OE2 3.49Å; K167-E171 VanDerWaalsContact CA-OE2 3.24Å; K167-E171 WeakPolarHBondContact CA-OE2 3.31Å; K167-E171 HydrophobicContact CB-CB 4.03Å; K167-E171 HydrophobicContact CG-CB 4.39Å; S168-E171 PolarHBondContact N-OE2 3.26Å; S168-E171 WeakPolarHBondContact O-CA 3.45Å; S168-E171 WeakPolarHBondContact O-CB 3.41Å; S168-E171 PolarHBondContact O-N 2.67Å; E171-L174 PolarHBondContact O-N 3.43Å; E171-S175 PolarHBondContact O-N 3.47Å; E171-S175 PolarHBondContact O-OG 2.91Å
172	Q	51.1	Low	60.2	Low	88 Å²	88	76.6 Å²	76.6	41%	0.411	39%	0.392	S	S	.	.	H	α-helix	trans	-69.3	-29.9	173.5	-68.5	-168.7	0.2	0	0	113.2	D164 K167 S168 P169	D164-Q172 PolarHBondContact O-NE2 2.81Å; D164-Q172 VanDerWaalsContact O-NE2 3.13Å; K167-Q172 HydrophobicContact CB-CG 4.17Å; S168-Q172 PolarHBondContact O-N 3.48Å; P169-Q172 PolarHBondContact O-N 2.85Å
173	M	50.4	Low	60.6	Low	117 Å²	117	80.1 Å²	80.1	58%	0.576	41%	0.407	S	S	*	.	H	α-helix	trans	-73.8	-41	172.4	-70.8	-60.9	176.1	0	0	112.2	P169 A170 S175 K176	P169-M173 WeakPolarHBondContact O-CG 3.46Å; P169-M173 PolarHBondContact O-N 3.27Å; A170-M173 PolarHBondContact O-N 2.83Å; M173-S175 PolarHBondContact O-N 2.89Å; M173-K176 PolarHBondContact O-N 2.96Å
174	L	49.5	Very low	60.9	Low	110 Å²	110	80.2 Å²	80.2	58%	0.576	41%	0.408	S	S	*	.	H	α-helix	trans	-58.3	-38.6	173.2	-127.5	71.5	0	0	0	111.7	A170 E171 K176 C177 I214	A170-L174 PolarHBondContact O-N 2.8Å; E171-L174 PolarHBondContact O-N 3.43Å; L174-K176 PolarHBondContact O-N 3.46Å; L174-K176 VanDerWaalsContact O-N 3.11Å; L174-C177 PolarHBondContact O-N 2.66Å; L174-C177 VanDerWaalsContact O-N 3.16Å; L174-I214 HydrophobicContact CD1-CD1 3.57Å
175	S	53.1	Low	61.1	Low	84 Å²	84	83.1 Å²	83.1	59%	0.587	42%	0.424	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.8	-15.9	176.5	-57.5	0	0	0	0	114.2	E171 M173	E171-S175 PolarHBondContact O-N 3.47Å; E171-S175 PolarHBondContact O-OG 2.91Å; M173-S175 PolarHBondContact O-N 2.89Å
176	K	54.2	Low	61.2	Low	154 Å²	154	80.8 Å²	80.8	67%	0.67	42%	0.419	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100.5	-6.1	178.7	-71.4	174.8	179.6	169.3	0	114.1	M173 L174	M173-K176 PolarHBondContact O-N 2.96Å; L174-K176 PolarHBondContact O-N 3.46Å; L174-K176 VanDerWaalsContact O-N 3.11Å
177	C	55.3	Low	61.7	Low	30 Å²	30	80.5 Å²	80.5	20%	0.203	43%	0.43	C	S	.	.			trans	-83.2	124.2	179.4	-165.3	0	0	0	0	111.4	L174 L210	L174-C177 PolarHBondContact O-N 2.66Å; L174-C177 VanDerWaalsContact O-N 3.16Å; C177-L210 HydrophobicContact CB-CD1 4.05Å
178	P	60.2	Low	62.6	Low	27 Å²	27	83.9 Å²	83.9	18%	0.175	45%	0.445	C	S	.	.			trans	-83.8	-13.8	-177.9	33.7	-36.3	0	0	0	114	S194 Q195	P178-S194 WeakPolarHBondContact O-CB 3.37Å; P178-S194 PolarHBondContact O-N 3.23Å; P178-S194 PolarHBondContact O-OG 3.11Å; P178-Q195 HydrophobicContact CB-CB 4.28Å; P178-Q195 HydrophobicContact CB-CG 3.75Å
179	W	71.9	Confident	63.8	Low	14 Å²	14	83.7 Å²	83.7	5%	0.053	44%	0.442	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.6	131.7	179.6	-66.1	97.6	0	0	0	111.6	Y192 N193 E198 R200 P204 E206 L207	W179-Y192 WeakPolarHBondContact CA-O 3.43Å; W179-N193 HydrophobicContact CD2-CB 3.81Å; W179-N193 VanDerWaalsContact CE2-ND2 3.28Å; W179-N193 HydrophobicContact CE3-CB 3.67Å; W179-N193 HydrophobicContact CH2-CB 3.54Å; W179-N193 HydrophobicContact CZ2-CB 3.72Å; W179-N193 VanDerWaalsContact CZ2-ND2 3.28Å; W179-N193 WeakPolarHBondContact CZ2-ND2 3.4Å; W179-N193 HydrophobicContact CZ3-CB 3.54Å; W179-E198 HydrophobicContact CH2-CB 4.34Å; W179-R200 HydrophobicContact CH2-CG 4.36Å; W179-R200 VanDerWaalsContact CH2-CZ 3.42Å; W179-R200 HydrophobicContact CZ3-CG 3.85Å; W179-P204 HydrophobicContact CB-CG 4.18Å; W179-P204 HydrophobicContact CD2-CB 3.9Å; W179-P204 HydrophobicContact CD2-CG 3.44Å; W179-P204 VanDerWaalsContact CD2-CG 3.44Å; W179-P204 HydrophobicContact CE3-CB 4.37Å; W179-P204 HydrophobicContact CE3-CG 3.52Å; W179-P204 HydrophobicContact CG-CB 4.08Å; W179-P204 HydrophobicContact CG-CG 3.73Å; W179-P204 HydrophobicContact CZ3-CG 4.2Å; W179-E206 PolarHBondContact NE1-OE2 3.41Å; W179-L207 HydrophobicContact CB-CD1 4.09Å
180	K	76.4	Confident	65.3	Low	111 Å²	111	82.4 Å²	82.4	48%	0.483	43%	0.426	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	138.6	174.5	-67.3	179.7	179.1	-179	0	110.2	Y182 Y191 Y192	K180-Y182 HydrophobicContact CB-CD2 4.29Å; K180-Y182 HydrophobicContact CB-CE2 3.61Å; K180-Y191 WeakPolarHBondContact O-CA 3.12Å; K180-Y192 PolarHBondContact N-O 3.25Å; K180-Y192 PolarHBondContact O-N 2.95Å
181	E	82.8	Confident	67.1	Low	82 Å²	82	82 Å²	82	38%	0.383	42%	0.418	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.9	129	170.1	-169.2	-173.7	116.8	0	0	109.9	K183 P189 Y191	E181-K183 IonicContact OE1-NZ 2.56Å; E181-K183 PolarHBondContact OE1-NZ 3.46Å; E181-P189 HydrophobicContact CG-CB 3.78Å; E181-P189 WeakPolarHBondContact OE1-CB 3.42Å; E181-Y191 HydrophobicContact CB-CD1 3.93Å; E181-Y191 HydrophobicContact CB-CE1 3.79Å; E181-Y191 HydrophobicContact CG-CD1 4.12Å; E181-Y191 HydrophobicContact CG-CE1 3.72Å; E181-Y191 WeakPolarHBondContact OE2-CE1 3.39Å; E181-Y191 PolarHBondContact OE2-OH 3.05Å
182	Y	77.4	Confident	67.9	Low	100 Å²	100	81.8 Å²	81.8	39%	0.392	42%	0.415	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121	155.5	168.8	-68.1	-84.9	0	0	0	109.1	K180 P189 Y190 Y192	K180-Y182 HydrophobicContact CB-CD2 4.29Å; K180-Y182 HydrophobicContact CB-CE2 3.61Å; Y182-P189 CarbonylContact O-C 3.59Å; Y182-P189 VanDerWaalsContact O-CA 3.29Å; Y182-P189 WeakPolarHBondContact O-CA 3.28Å; Y182-Y190 PolarHBondContact N-O 3.29Å; Y182-Y190 WeakPolarHBondContact O-CD1 3.46Å; Y182-Y190 PolarHBondContact O-N 3.06Å; Y182-Y190 VanDerWaalsContact O-O 3.1Å; Y182-Y192 HydrophobicContact CE2-CD1 4.11Å; Y182-Y192 HydrophobicContact CE2-CG 4.43Å
183	K	81.7	Confident	69.1	Low	141 Å²	141	78 Å²	78	61%	0.613	40%	0.397	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-108.8	130	176.1	-56.9	-172.3	-165	-63.5	0	109.1	E181	E181-K183 IonicContact OE1-NZ 2.56Å; E181-K183 PolarHBondContact OE1-NZ 3.46Å
184	S	73.9	Confident	70.1	Confident	18 Å²	18	75 Å²	75	13%	0.126	39%	0.388	C	S	.	.			trans	-70.4	165.5	175.7	56.5	0	0	0	0	111.8	T186 G187 K188	S184-T186 PolarHBondContact O-N 3.11Å; S184-T186 PolarHBondContact OG-OG1 3.34Å; S184-G187 WeakPolarHBondContact O-CA 3.42Å; S184-G187 PolarHBondContact O-N 3.37Å; S184-K188 PolarHBondContact N-O 2.98Å; S184-K188 PolarHBondContact OG-N 3.02Å; S184-K188 PolarHBondContact OG-O 2.87Å
185	D	62.5	Low	71	Confident	162 Å²	162	76.9 Å²	76.9	87%	0.866	39%	0.394	S	S	*	.	T	Hydrogen-bonded Turn	trans	-46.5	-36.2	167.3	62.8	-25.2	0	0	0	113.8	G187	D185-G187 PolarHBondContact O-N 2.83Å
186	T	60.1	Low	72	Confident	89 Å²	89	76.5 Å²	76.5	55%	0.546	39%	0.388	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.3	10	175.4	66.1	0	0	0	0	114.5	S184 K188	S184-T186 PolarHBondContact O-N 3.11Å; S184-T186 PolarHBondContact OG-OG1 3.34Å; T186-K188 PolarHBondContact O-N 3.33Å
187	G	69.9	Low	73	Confident	52 Å²	52	76.9 Å²	76.9	54%	0.536	39%	0.389	S	S	.	.	S	Bend	trans	73.8	-3.4	-179	0	0	0	0	0	115.2	S184 D185	S184-G187 WeakPolarHBondContact O-CA 3.42Å; S184-G187 PolarHBondContact O-N 3.37Å; D185-G187 PolarHBondContact O-N 2.83Å
188	K	73.3	Confident	73.7	Confident	130 Å²	130	80.4 Å²	80.4	57%	0.565	40%	0.403	S	S	*	.			trans	-77.9	133.3	-179.5	-65	174.9	-176.1	170.1	0	110.9	S184 T186 W201	S184-K188 PolarHBondContact N-O 2.98Å; S184-K188 PolarHBondContact OG-N 3.02Å; S184-K188 PolarHBondContact OG-O 2.87Å; T186-K188 PolarHBondContact O-N 3.33Å; K188-W201 HydrophobicContact CB-CZ3 3.99Å
189	P	82.3	Confident	74.7	Confident	50 Å²	50	83 Å²	83	33%	0.325	42%	0.421	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.9	145.4	173.1	30.5	-34.6	0	0	0	111.5	E181 Y182	E181-P189 HydrophobicContact CG-CB 3.78Å; E181-P189 WeakPolarHBondContact OE1-CB 3.42Å; Y182-P189 CarbonylContact O-C 3.59Å; Y182-P189 VanDerWaalsContact O-CA 3.29Å; Y182-P189 WeakPolarHBondContact O-CA 3.28Å
190	Y	80.3	Confident	75.1	Confident	66 Å²	66	86 Å²	86	26%	0.259	43%	0.433	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.9	151.2	167.4	70.7	-85.8	0	0	0	109.2	Y182 W201	Y182-Y190 PolarHBondContact N-O 3.29Å; Y182-Y190 WeakPolarHBondContact O-CD1 3.46Å; Y182-Y190 PolarHBondContact O-N 3.06Å; Y182-Y190 VanDerWaalsContact O-O 3.1Å; Y190-W201 HydrophobicContact CD1-CH2 4.47Å; Y190-W201 HydrophobicContact CD1-CZ3 4.41Å
191	Y	84.5	Confident	75.3	Confident	22 Å²	22	88.4 Å²	88.4	9%	0.086	44%	0.439	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	123.7	-173.8	-55.7	-87.6	0	0	0	109.2	K180 E181 S199 R200 K203 P204 L207	K180-Y191 WeakPolarHBondContact O-CA 3.12Å; E181-Y191 HydrophobicContact CB-CD1 3.93Å; E181-Y191 HydrophobicContact CB-CE1 3.79Å; E181-Y191 HydrophobicContact CG-CD1 4.12Å; E181-Y191 HydrophobicContact CG-CE1 3.72Å; E181-Y191 WeakPolarHBondContact OE2-CE1 3.39Å; E181-Y191 PolarHBondContact OE2-OH 3.05Å; Y191-S199 CarbonylContact O-C 3.56Å; Y191-S199 WeakPolarHBondContact O-CA 3.38Å; Y191-R200 PolarHBondContact N-O 2.82Å; Y191-R200 PolarHBondContact O-N 3.1Å; Y191-K203 HydrophobicContact CD2-CB 4.45Å; Y191-K203 HydrophobicContact CE1-CD 4.39Å; Y191-K203 HydrophobicContact CE1-CG 3.99Å; Y191-K203 HydrophobicContact CE2-CB 3.91Å; Y191-K203 HydrophobicContact CE2-CG 4.09Å; Y191-P204 VanDerWaalsContact CG-CD 3.49Å; Y191-P204 HydrophobicContact CG-CG 4.23Å; Y191-L207 HydrophobicContact CD1-CD1 3.74Å; Y191-L207 HydrophobicContact CE1-CD1 4.1Å
192	Y	74.9	Confident	74.9	Confident	70 Å²	70	89.8 Å²	89.8	28%	0.275	45%	0.453	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	130.1	-177.7	175.6	-102.7	0	0	0	110.4	W179 K180 Y182 K197 E198	W179-Y192 WeakPolarHBondContact CA-O 3.43Å; K180-Y192 PolarHBondContact N-O 3.25Å; K180-Y192 PolarHBondContact O-N 2.95Å; Y182-Y192 HydrophobicContact CE2-CD1 4.11Å; Y182-Y192 HydrophobicContact CE2-CG 4.43Å; Y192-K197 HydrophobicContact CE2-CB 4.39Å; Y192-K197 WeakPolarHBondContact CE2-O 3.41Å; Y192-E198 WeakPolarHBondContact CA-O 3.21Å; Y192-E198 WeakPolarHBondContact CD2-O 3.04Å
193	N	77.1	Confident	74.9	Confident	8 Å²	8	87.7 Å²	87.7	4%	0.043	45%	0.446	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.9	117.3	174.8	-171.6	-40.2	0	0	0	109.9	W179 Q195 T196 K197 E198	W179-N193 HydrophobicContact CD2-CB 3.81Å; W179-N193 VanDerWaalsContact CE2-ND2 3.28Å; W179-N193 HydrophobicContact CE3-CB 3.67Å; W179-N193 HydrophobicContact CH2-CB 3.54Å; W179-N193 HydrophobicContact CZ2-CB 3.72Å; W179-N193 VanDerWaalsContact CZ2-ND2 3.28Å; W179-N193 WeakPolarHBondContact CZ2-ND2 3.4Å; W179-N193 HydrophobicContact CZ3-CB 3.54Å; N193-Q195 PolarHBondContact O-N 3.01Å; N193-Q195 WeakPolarHBondContact OD1-CA 3.31Å; N193-Q195 WeakPolarHBondContact OD1-CB 3.43Å; N193-Q195 PolarHBondContact OD1-N 3.19Å; N193-T196 VanDerWaalsContact CB-OG1 3.23Å; N193-T196 WeakPolarHBondContact CB-OG1 3.34Å; N193-T196 PolarHBondContact ND2-OG1 3.49Å; N193-T196 PolarHBondContact OD1-N 3.39Å; N193-K197 VanDerWaalsContact O-CA 3.25Å; N193-K197 WeakPolarHBondContact O-CA 3.39Å; N193-K197 PolarHBondContact O-N 3.01Å; N193-E198 PolarHBondContact N-O 3.47Å
194	S	71.1	Confident	74.7	Confident	54 Å²	54	81 Å²	81	38%	0.378	42%	0.417	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.4	-20.9	-178.4	-48.4	0	0	0	0	113.3	P178	P178-S194 WeakPolarHBondContact O-CB 3.37Å; P178-S194 PolarHBondContact O-N 3.23Å; P178-S194 PolarHBondContact O-OG 3.11Å
195	Q	68.5	Low	74.4	Confident	151 Å²	151	86.4 Å²	86.4	71%	0.706	44%	0.438	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.2	-49	179.7	-65.1	175.1	-5.7	0	0	112.4	P178 N193	P178-Q195 HydrophobicContact CB-CB 4.28Å; P178-Q195 HydrophobicContact CB-CG 3.75Å; N193-Q195 PolarHBondContact O-N 3.01Å; N193-Q195 WeakPolarHBondContact OD1-CA 3.31Å; N193-Q195 WeakPolarHBondContact OD1-CB 3.43Å; N193-Q195 PolarHBondContact OD1-N 3.19Å
196	T	74.4	Confident	74.6	Confident	75 Å²	75	83.9 Å²	83.9	46%	0.46	42%	0.421	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.3	-12.3	-179.5	67.6	0	0	0	0	113.9	N193 E198	N193-T196 VanDerWaalsContact CB-OG1 3.23Å; N193-T196 WeakPolarHBondContact CB-OG1 3.34Å; N193-T196 PolarHBondContact ND2-OG1 3.49Å; N193-T196 PolarHBondContact OD1-N 3.39Å; T196-E198 PolarHBondContact O-N 2.81Å; T196-E198 WeakPolarHBondContact OG1-CB 3.43Å; T196-E198 WeakPolarHBondContact OG1-CG 3.48Å; T196-E198 PolarHBondContact OG1-OE2 3.32Å
197	K	75	Confident	75	Confident	162 Å²	162	80.9 Å²	80.9	70%	0.704	40%	0.402	S	S	*	.			trans	60.4	14.6	-172.7	-53.6	-173.7	179.7	-179.7	0	114.7	Y192 N193	Y192-K197 HydrophobicContact CE2-CB 4.39Å; Y192-K197 WeakPolarHBondContact CE2-O 3.41Å; N193-K197 VanDerWaalsContact O-CA 3.25Å; N193-K197 WeakPolarHBondContact O-CA 3.39Å; N193-K197 PolarHBondContact O-N 3.01Å
198	E	69.3	Low	75.1	Confident	105 Å²	105	82.9 Å²	82.9	49%	0.491	40%	0.397	S	S	.	.			trans	-77.8	143.8	175.5	-64.4	172.4	133.6	0	0	111.3	W179 Y192 N193 T196	W179-E198 HydrophobicContact CH2-CB 4.34Å; Y192-E198 WeakPolarHBondContact CA-O 3.21Å; Y192-E198 WeakPolarHBondContact CD2-O 3.04Å; N193-E198 PolarHBondContact N-O 3.47Å; T196-E198 PolarHBondContact O-N 2.81Å; T196-E198 WeakPolarHBondContact OG1-CB 3.43Å; T196-E198 WeakPolarHBondContact OG1-CG 3.48Å; T196-E198 PolarHBondContact OG1-OE2 3.32Å
199	S	81.6	Confident	74.7	Confident	80 Å²	80	80.3 Å²	80.3	56%	0.559	39%	0.39	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-117.1	137.4	167.4	55.2	0	0	0	0	110.4	Y191	Y191-S199 CarbonylContact O-C 3.56Å; Y191-S199 WeakPolarHBondContact O-CA 3.38Å
200	R	80.6	Confident	73.6	Confident	78 Å²	78	80.6 Å²	80.6	29%	0.294	39%	0.388	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136	143.5	177.4	62.6	171.8	81.2	169.6	4.2	111.9	W179 Y191 T202 P204	W179-R200 HydrophobicContact CH2-CG 4.36Å; W179-R200 VanDerWaalsContact CH2-CZ 3.42Å; W179-R200 HydrophobicContact CZ3-CG 3.85Å; Y191-R200 PolarHBondContact N-O 2.82Å; Y191-R200 PolarHBondContact O-N 3.1Å; R200-T202 WeakPolarHBondContact CD-O 3.39Å; R200-T202 VanDerWaalsContact CG-O 3.23Å; R200-T202 WeakPolarHBondContact CG-O 3.43Å; R200-P204 HydrophobicContact CG-CG 4.49Å
201	W	80	Confident	73	Confident	162 Å²	162	81.8 Å²	81.8	61%	0.614	40%	0.396	S	S	*	.	S	Bend	trans	-88.3	-15.4	179.4	-63.6	94.5	0	0	0	113.5	K188 Y190	K188-W201 HydrophobicContact CB-CZ3 3.99Å; Y190-W201 HydrophobicContact CD1-CH2 4.47Å; Y190-W201 HydrophobicContact CD1-CZ3 4.41Å
202	T	73.9	Confident	72	Confident	110 Å²	110	83.6 Å²	83.6	68%	0.675	42%	0.415	S	S	*	.	S	Bend	trans	-95.7	142.5	169.8	31.9	0	0	0	0	110.3	R200	R200-T202 WeakPolarHBondContact CD-O 3.39Å; R200-T202 VanDerWaalsContact CG-O 3.23Å; R200-T202 WeakPolarHBondContact CG-O 3.43Å
203	K	78	Confident	71.2	Confident	56 Å²	56	86.4 Å²	86.4	24%	0.243	43%	0.432	C	S	.	.	P	Polyproline II helix	trans	-60.6	135.5	-177.6	-161.1	163.8	-173.9	169	0	110.9	Y191 K205 E208 E211	Y191-K203 HydrophobicContact CD2-CB 4.45Å; Y191-K203 HydrophobicContact CE1-CD 4.39Å; Y191-K203 HydrophobicContact CE1-CG 3.99Å; Y191-K203 HydrophobicContact CE2-CB 3.91Å; Y191-K203 HydrophobicContact CE2-CG 4.09Å; K203-K205 PolarHBondContact O-N 3.13Å; K203-E208 HydrophobicContact CB-CG 4.22Å; K203-E208 HydrophobicContact CD-CG 3.8Å; K203-E208 HydrophobicContact CG-CG 3.83Å; K203-E211 WeakPolarHBondContact CE-OE1 3.49Å; K203-E211 IonicContact NZ-OE1 2.73Å; K203-E211 PolarHBondContact NZ-OE1 3.14Å; K203-E211 IonicContact NZ-OE2 2.79Å; K203-E211 PolarHBondContact NZ-OE2 3.28Å
204	P	77.1	Confident	70.6	Confident	0 Å²	0	89.2 Å²	89.2	0%	0	45%	0.447	C	S	.	.	P	Polyproline II helix	trans	-66.5	132.6	173.9	-13.5	25.1	0	0	0	110	W179 Y191 R200 E206 L207 E208	W179-P204 HydrophobicContact CB-CG 4.18Å; W179-P204 HydrophobicContact CD2-CB 3.9Å; W179-P204 HydrophobicContact CD2-CG 3.44Å; W179-P204 VanDerWaalsContact CD2-CG 3.44Å; W179-P204 HydrophobicContact CE3-CB 4.37Å; W179-P204 HydrophobicContact CE3-CG 3.52Å; W179-P204 HydrophobicContact CG-CB 4.08Å; W179-P204 HydrophobicContact CG-CG 3.73Å; W179-P204 HydrophobicContact CZ3-CG 4.2Å; Y191-P204 VanDerWaalsContact CG-CD 3.49Å; Y191-P204 HydrophobicContact CG-CG 4.23Å; R200-P204 HydrophobicContact CG-CG 4.49Å; P204-E206 PolarHBondContact O-N 3.41Å; P204-L207 HydrophobicContact CB-CB 4.17Å; P204-L207 HydrophobicContact CG-CB 4.28Å; P204-L207 HydrophobicContact CG-CD1 4.32Å; P204-L207 WeakPolarHBondContact O-CA 3.23Å; P204-L207 VanDerWaalsContact O-CB 3.25Å; P204-L207 WeakPolarHBondContact O-CB 3.32Å; P204-L207 PolarHBondContact O-N 3.15Å; P204-E208 PolarHBondContact O-N 3.32Å; P204-E208 VanDerWaalsContact O-N 3.11Å
205	K	68.8	Low	70.4	Confident	132 Å²	132	94.1 Å²	94.1	57%	0.574	46%	0.461	S	S	*	.	H	α-helix	trans	-60	-35.3	177	-159.8	-164.2	171.5	-149.5	0	112.1	K203 L207 E208 D209	K203-K205 PolarHBondContact O-N 3.13Å; K205-L207 PolarHBondContact O-N 2.78Å; K205-L207 VanDerWaalsContact O-N 3.15Å; K205-E208 PolarHBondContact O-N 3.46Å; K205-E208 VanDerWaalsContact O-N 3.11Å; K205-D209 WeakPolarHBondContact CE-OD1 3.2Å; K205-D209 WeakPolarHBondContact CE-OD2 3.23Å; K205-D209 IonicContact NZ-OD1 3.46Å; K205-D209 IonicContact NZ-OD2 3.28Å; K205-D209 PolarHBondContact NZ-OD2 2.76Å; K205-D209 WeakPolarHBondContact O-CB 3.46Å; K205-D209 PolarHBondContact O-N 3Å
206	E	66.9	Low	69.6	Low	109 Å²	109	89.8 Å²	89.8	51%	0.509	45%	0.451	S	S	.	.	H	α-helix	trans	-55.1	-27.7	170.6	-68.3	146.1	-139.9	0	0	113.5	W179 P204 L210	W179-E206 PolarHBondContact NE1-OE2 3.41Å; P204-E206 PolarHBondContact O-N 3.41Å; E206-L210 VanDerWaalsContact O-CD1 3.31Å; E206-L210 WeakPolarHBondContact O-CD1 3.49Å; E206-L210 VanDerWaalsContact O-CG 3.24Å; E206-L210 WeakPolarHBondContact O-CG 3.28Å
207	L	67.4	Low	68.6	Low	26 Å²	26	92.6 Å²	92.6	14%	0.136	46%	0.459	C	S	.	.	H	α-helix	trans	-87.3	-38.2	177.3	-145.8	175.8	0	0	0	110.7	W179 Y191 P204 K205 L210 E211	W179-L207 HydrophobicContact CB-CD1 4.09Å; Y191-L207 HydrophobicContact CD1-CD1 3.74Å; Y191-L207 HydrophobicContact CE1-CD1 4.1Å; P204-L207 HydrophobicContact CB-CB 4.17Å; P204-L207 HydrophobicContact CG-CB 4.28Å; P204-L207 HydrophobicContact CG-CD1 4.32Å; P204-L207 WeakPolarHBondContact O-CA 3.23Å; P204-L207 VanDerWaalsContact O-CB 3.25Å; P204-L207 WeakPolarHBondContact O-CB 3.32Å; P204-L207 PolarHBondContact O-N 3.15Å; K205-L207 PolarHBondContact O-N 2.78Å; K205-L207 VanDerWaalsContact O-N 3.15Å; L207-L210 PolarHBondContact O-N 3.16Å; L207-E211 HydrophobicContact CD2-CG 4.11Å; L207-E211 WeakPolarHBondContact CD2-OE1 3.4Å; L207-E211 PolarHBondContact O-N 2.82Å
208	E	70.9	Confident	67.4	Low	95 Å²	95	92.9 Å²	92.9	44%	0.444	46%	0.463	S	S	.	.	H	α-helix	trans	-64.8	-43.9	174.1	-64	179.6	145.5	0	0	112.4	K203 P204 K205 L210 E211 A212	K203-E208 HydrophobicContact CB-CG 4.22Å; K203-E208 HydrophobicContact CD-CG 3.8Å; K203-E208 HydrophobicContact CG-CG 3.83Å; P204-E208 PolarHBondContact O-N 3.32Å; P204-E208 VanDerWaalsContact O-N 3.11Å; K205-E208 PolarHBondContact O-N 3.46Å; K205-E208 VanDerWaalsContact O-N 3.11Å; E208-L210 VanDerWaalsContact C-N 3.3Å; E208-L210 PolarHBondContact O-N 2.98Å; E208-E211 PolarHBondContact O-N 3.11Å; E208-A212 WeakPolarHBondContact O-CB 3.45Å; E208-A212 PolarHBondContact O-N 3.28Å
209	D	65.5	Low	66.1	Low	76 Å²	76	92.7 Å²	92.7	41%	0.406	47%	0.473	S	S	.	.	H	α-helix	trans	-65.7	-33.6	178.3	-68.5	-28.6	0	0	0	110.6	K205 M213	K205-D209 WeakPolarHBondContact CE-OD1 3.2Å; K205-D209 WeakPolarHBondContact CE-OD2 3.23Å; K205-D209 IonicContact NZ-OD1 3.46Å; K205-D209 IonicContact NZ-OD2 3.28Å; K205-D209 PolarHBondContact NZ-OD2 2.76Å; K205-D209 WeakPolarHBondContact O-CB 3.46Å; K205-D209 PolarHBondContact O-N 3Å; D209-M213 WeakPolarHBondContact O-CG 3.5Å; D209-M213 PolarHBondContact O-N 2.76Å
210	L	60.5	Low	64.3	Low	55 Å²	55	91.5 Å²	91.5	29%	0.288	47%	0.474	S	S	.	.	H	α-helix	trans	-73	-43.7	173.9	-76.9	172.1	0	0	0	113.3	C177 E206 L207 E208 A212 M213 I214	C177-L210 HydrophobicContact CB-CD1 4.05Å; E206-L210 VanDerWaalsContact O-CD1 3.31Å; E206-L210 WeakPolarHBondContact O-CD1 3.49Å; E206-L210 VanDerWaalsContact O-CG 3.24Å; E206-L210 WeakPolarHBondContact O-CG 3.28Å; L207-L210 PolarHBondContact O-N 3.16Å; E208-L210 VanDerWaalsContact C-N 3.3Å; E208-L210 PolarHBondContact O-N 2.98Å; L210-A212 VanDerWaalsContact C-N 3.26Å; L210-A212 PolarHBondContact O-N 3.24Å; L210-M213 PolarHBondContact O-N 2.74Å; L210-I214 WeakPolarHBondContact O-CG1 3.33Å; L210-I214 PolarHBondContact O-N 2.78Å
211	E	66.4	Low	62.2	Low	92 Å²	92	93.6 Å²	93.6	43%	0.43	50%	0.495	S	S	.	.	H	α-helix	trans	-61	-37	173.2	-79.8	178.6	-173.4	0	0	111.9	K203 L207 E208 M213 K215	K203-E211 WeakPolarHBondContact CE-OE1 3.49Å; K203-E211 IonicContact NZ-OE1 2.73Å; K203-E211 PolarHBondContact NZ-OE1 3.14Å; K203-E211 IonicContact NZ-OE2 2.79Å; K203-E211 PolarHBondContact NZ-OE2 3.28Å; L207-E211 HydrophobicContact CD2-CG 4.11Å; L207-E211 WeakPolarHBondContact CD2-OE1 3.4Å; L207-E211 PolarHBondContact O-N 2.82Å; E208-E211 PolarHBondContact O-N 3.11Å; E211-M213 VanDerWaalsContact C-N 3.35Å; E211-K215 VanDerWaalsContact O-CB 3.26Å; E211-K215 WeakPolarHBondContact O-CB 3.42Å; E211-K215 PolarHBondContact O-N 3.1Å
212	A	63.6	Low	59.9	Low	59 Å²	59	92.8 Å²	92.8	49%	0.488	51%	0.508	S	S	.	.	H	α-helix	trans	-64.2	-37.8	175.3	0	0	0	0	0	112.4	E208 L210 A216	E208-A212 WeakPolarHBondContact O-CB 3.45Å; E208-A212 PolarHBondContact O-N 3.28Å; L210-A212 VanDerWaalsContact C-N 3.26Å; L210-A212 PolarHBondContact O-N 3.24Å; A212-A216 WeakPolarHBondContact O-CB 3.4Å; A212-A216 PolarHBondContact O-N 3.29Å
213	M	59	Low	57.7	Low	129 Å²	129	97.1 Å²	97.1	64%	0.635	52%	0.521	S	S	*	.	H	α-helix	trans	-68.9	-46.6	175.7	-74	174.1	61.8	0	0	112.2	D209 L210 E211 K215 A216 E217	D209-M213 WeakPolarHBondContact O-CG 3.5Å; D209-M213 PolarHBondContact O-N 2.76Å; L210-M213 PolarHBondContact O-N 2.74Å; E211-M213 VanDerWaalsContact C-N 3.35Å; M213-K215 VanDerWaalsContact C-N 3.3Å; M213-K215 PolarHBondContact O-N 3.13Å; M213-A216 WeakPolarHBondContact O-CB 3.34Å; M213-A216 PolarHBondContact O-N 3.45Å; M213-A216 VanDerWaalsContact O-N 3.13Å; M213-E217 PolarHBondContact O-N 3.21Å
214	I	63.5	Low	55.3	Low	68 Å²	68	99 Å²	99	35%	0.349	55%	0.547	S	S	.	.	H	α-helix	trans	-57.6	-45.6	176.6	-66.4	164.1	0	0	0	110.5	L174 L210 A216 E217 E218	L174-I214 HydrophobicContact CD1-CD1 3.57Å; L210-I214 WeakPolarHBondContact O-CG1 3.33Å; L210-I214 PolarHBondContact O-N 2.78Å; I214-A216 VanDerWaalsContact C-N 3.32Å; I214-A216 PolarHBondContact O-N 3.29Å; I214-E217 PolarHBondContact O-N 2.94Å; I214-E218 PolarHBondContact O-N 2.98Å
215	K	66.6	Low	53	Low	157 Å²	157	104.3 Å²	104.3	68%	0.683	59%	0.591	S	S	*	*	H	α-helix	trans	-68.9	-26.4	179.1	-173.7	169.4	-178.4	172.6	0	113.8	E211 M213	E211-K215 VanDerWaalsContact O-CB 3.26Å; E211-K215 WeakPolarHBondContact O-CB 3.42Å; E211-K215 PolarHBondContact O-N 3.1Å; M213-K215 VanDerWaalsContact C-N 3.3Å; M213-K215 PolarHBondContact O-N 3.13Å
216	A	53.4	Low	51.4	Low	59 Å²	59	102.7 Å²	102.7	49%	0.488	60%	0.602	S	S	.	*	H	α-helix	trans	-72.3	-43.8	172.8	0	0	0	0	0	111	A212 M213 I214 S219	A212-A216 WeakPolarHBondContact O-CB 3.4Å; A212-A216 PolarHBondContact O-N 3.29Å; M213-A216 WeakPolarHBondContact O-CB 3.34Å; M213-A216 PolarHBondContact O-N 3.45Å; M213-A216 VanDerWaalsContact O-N 3.13Å; I214-A216 VanDerWaalsContact C-N 3.32Å; I214-A216 PolarHBondContact O-N 3.29Å; A216-S219 PolarHBondContact O-N 3.09Å; A216-S219 PolarHBondContact O-OG 3.47Å
217	E	52.5	Low	50.4	Low	135 Å²	135	103.6 Å²	103.6	63%	0.631	62%	0.617	S	S	*	*	H	α-helix	trans	-64.8	-41.2	179.7	-158.2	169.1	161.9	0	0	111.8	M213 I214 S219 G220	M213-E217 PolarHBondContact O-N 3.21Å; I214-E217 PolarHBondContact O-N 2.94Å; E217-S219 PolarHBondContact O-N 2.82Å; E217-G220 PolarHBondContact O-N 2.77Å; E217-G220 VanDerWaalsContact O-N 3.13Å
218	E	49.6	Very low	48.5	Very low	168 Å²	168	105.7 Å²	105.7	79%	0.785	65%	0.645	S	S	*	*	T	Hydrogen-bonded Turn	trans	-64.8	-19.8	175.9	-164.1	172.9	-132.5	0	0	113.6	I214 G220	I214-E218 PolarHBondContact O-N 2.98Å; E218-G220 VanDerWaalsContact C-N 3.34Å
219	S	43	Very low	46.4	Very low	100 Å²	100	107.2 Å²	107.2	70%	0.699	66%	0.661	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.9	-1.3	176.3	73.5	0	0	0	0	114.6	A216 E217	A216-S219 PolarHBondContact O-N 3.09Å; A216-S219 PolarHBondContact O-OG 3.47Å; E217-S219 PolarHBondContact O-N 2.82Å
220	G	42	Very low	44.7	Very low	56 Å²	56	109.7 Å²	109.7	58%	0.577	68%	0.679	S	S	*	*	S	Bend	trans	-97.9	10.2	-163.6	0	0	0	0	0	117.9	E217 E218	E217-G220 PolarHBondContact O-N 2.77Å; E217-G220 VanDerWaalsContact O-N 3.13Å; E218-G220 VanDerWaalsContact C-N 3.34Å
221	T	37.2	Very low	43	Very low	121 Å²	121	111.4 Å²	111.4	74%	0.742	70%	0.702	S	S	*	*	S	Bend	trans	-153.1	94.8	-179.1	-66.3	0	0	0	0	113.5
222	T	31.1	Very low	41.2	Very low	145 Å²	145	111.4 Å²	111.4	89%	0.89	72%	0.717	S	S	*	*			trans	164.9	110.3	133.6	30.9	0	0	0	0	111.8
223	E	27.5	Very low	39.9	Very low	201 Å²	201	114.3 Å²	114.3	94%	0.939	73%	0.731	S	S	*	*			trans	-153.7	115.7	158.9	-172.9	173.3	-160.4	0	0	110.8
224	A	29.3	Very low	38.4	Very low	97 Å²	97	114.3 Å²	114.3	80%	0.802	74%	0.739	S	S	*	*			trans	-166.1	128.1	163.9	0	0	0	0	0	112.2
225	A	29	Very low	36.8	Very low	111 Å²	111	114.9 Å²	114.9	92%	0.917	75%	0.754	S	S	*	*			trans	68.5	136.4	164.9	0	0	0	0	0	120.2
226	A	35.2	Very low	34.9	Very low	98 Å²	98	116.8 Å²	116.8	81%	0.81	77%	0.765	S	S	*	*			trans	-134.4	-159.7	177.3	0	0	0	0	0	107.8
227	P	44.2	Very low	33.6	Very low	127 Å²	127	119.1 Å²	119.1	83%	0.825	78%	0.784	S	S	*	*			cis	-124.8	167.8	-3.5	42.2	-25.8	0	0	0	114.4
228	G	28.4	Very low	32.3	Very low	70 Å²	70	119.1 Å²	119.1	72%	0.722	79%	0.789	S	S	*	*				102.3	140.6	91	0	0	0	0	0	111.2
229	T	27.6	Very low	31.2	Very low	127 Å²	127	118.7 Å²	118.7	78%	0.779	79%	0.786	S	S	*	*			cis	-172.9	161.6	40.9	-64	0	0	0	0	111.7
230	T	28.3	Very low	30.4	Very low	129 Å²	129	121 Å²	121	79%	0.791	79%	0.791	S	S	*	*			trans	70.1	112.8	160.5	34.1	0	0	0	0	124.4
231	A	26.4	Very low	29.7	Very low	91 Å²	91	123.4 Å²	123.4	75%	0.752	80%	0.795	S	S	*	*				69	108.5	119	0	0	0	0	0	124.4
232	A	27.1	Very low	29.1	Very low	92 Å²	92	123.8 Å²	123.8	76%	0.76	80%	0.797	S	S	*	*				17.5	141.9	122.1	0	0	0	0	0	120.5
233	P	37.7	Very low	28.8	Very low	120 Å²	120	120.6 Å²	120.6	78%	0.779	79%	0.785	S	S	*	*				-146.7	142.3	66.9	38.6	-19.7	0	0	0	120.1
234	T	27.5	Very low	28.6	Very low	129 Å²	129	119.1 Å²	119.1	79%	0.791	78%	0.781	S	S	*	*				45.2	101.7	125.6	-42.7	0	0	0	0	122.9
235	A	28.6	Very low	28.3	Very low	80 Å²	80	120.7 Å²	120.7	66%	0.661	78%	0.78	S	S	*	*				64.1	124.7	128.1	0	0	0	0	0	124.4
236	Q	27.7	Very low	28	Very low	196 Å²	196	121 Å²	121	92%	0.916	77%	0.77	S	S	*	*			trans	56.2	107.5	134.4	-64	-176.6	-64.8	0	0	121.4
237	A	25.6	Very low	27.6	Very low	108 Å²	108	121.7 Å²	121.7	89%	0.893	76%	0.764	S	S	*	*				-144.5	161.2	125.7	0	0	0	0	0	109.2
238	D	24.2	Very low	26.7	Very low	136 Å²	136	124.1 Å²	124.1	73%	0.727	76%	0.762	S	S	*	*			trans	-106.8	161	-169.1	-143.6	-49.6	0	0	0	112.6
239	Q	28.5	Very low	26.6	Very low	159 Å²	159	128.7 Å²	128.7	74%	0.743	76%	0.764	S	S	*	*			trans	57.6	111.4	155.1	-92.4	155.2	83.4	0	0	123
240	N	25	Very low	26.6	Very low	147 Å²	147	127.2 Å²	127.2	79%	0.786	77%	0.765	S	S	*	*				103.1	152.9	113.6	-158.9	30.1	0	0	0	119.3
241	T	28.1	Very low	26.5	Very low	108 Å²	108	128.9 Å²	128.9	66%	0.663	76%	0.764	S	S	*	*			trans	-74	151.8	-173.5	59.7	0	0	0	0	114.4
242	T	24.9	Very low	26.5	Very low	128 Å²	128	130.3 Å²	130.3	79%	0.785	76%	0.763	S	S	*	*				167.4	124.9	115.6	-76.9	0	0	0	0	111.7
243	A	23.8	Very low	26.4	Very low	79 Å²	79	131 Å²	131	65%	0.653	77%	0.77	S	S	*	*			trans	-166.5	123.6	143.4	0	0	0	0	0	111
244	M	23.8	Very low	25.7	Very low	170 Å²	170	130.5 Å²	130.5	84%	0.837	78%	0.775	S	S	*	*				39.3	137	125.6	-43.4	169.9	-150.6	0	0	117.9
245	V	23.1	Very low	25.8	Very low	129 Å²	129	129 Å²	129	78%	0.782	78%	0.776	S	S	*	*				-161.5	170.4	60.1	164.1	0	0	0	0	110.5
246	T	22.5	Very low	25.9	Very low	118 Å²	118	131 Å²	131	72%	0.724	78%	0.78	S	S	*	*			trans	-51.2	177.7	173.1	45.3	0	0	0	0	115.4
247	V	26.1	Very low	26.6	Very low	112 Å²	112	126.8 Å²	126.8	68%	0.679	77%	0.769	S	S	*	*			cis	-164.8	139.7	45.7	-169.2	0	0	0	0	113.1
248	K	26.2	Very low	26.7	Very low	178 Å²	178	129.2 Å²	129.2	77%	0.774	76%	0.762	S	S	*	*			trans	54.7	162.9	154.1	-74.4	-177.6	173.8	-172.4	0	121.9
249	E	26.1	Very low	26.7	Very low	166 Å²	166	131.4 Å²	131.4	78%	0.776	77%	0.768	S	S	*	*			cis	145.1	113.1	-21.7	176	-179.4	-141.1	0	0	110.3
250	A	27.6	Very low	26.6	Very low	96 Å²	96	131.2 Å²	131.2	79%	0.793	77%	0.767	S	S	*	*			trans	-171.2	152.3	157.8	0	0	0	0	0	106.9
251	E	26	Very low	26.5	Very low	165 Å²	165	132.6 Å²	132.6	77%	0.771	77%	0.769	S	S	*	*			cis	-148.5	158.7	14.7	-144.6	-158.3	105.5	0	0	113.5
252	T	26	Very low	26.4	Very low	120 Å²	120	132 Å²	132	74%	0.736	77%	0.769	S	S	*	*			trans	39.9	122.2	152.2	42.5	0	0	0	0	124.5
253	A	24.7	Very low	26.5	Very low	108 Å²	108	134.8 Å²	134.8	89%	0.893	77%	0.773	S	S	*	*			trans	-146.2	161.1	145.6	0	0	0	0	0	109.6
254	A	24.8	Very low	26.5	Very low	108 Å²	108	137.2 Å²	137.2	89%	0.893	78%	0.779	S	S	*	*			trans	-123.3	162.4	-172.9	0	0	0	0	0	114.5
255	A	28.1	Very low	26.5	Very low	98 Å²	98	135.5 Å²	135.5	81%	0.81	78%	0.779	S	S	*	*			trans	-153.7	-177.9	-177.1	0	0	0	0	0	109.3
256	V	30.4	Very low	26.7	Very low	123 Å²	123	133.4 Å²	133.4	75%	0.745	77%	0.77	S	S	*	*			cis	-160.8	172.5	2.6	93.8	0	0	0	0	105.6
257	P	43.6	Very low	26.8	Very low	106 Å²	106	135.8 Å²	135.8	69%	0.688	77%	0.772	S	S	*	*			cis	-112.1	-160.4	26.9	14.4	13.6	0	0	0	112.3
258	E	27.9	Very low	26.9	Very low	159 Å²	159	138.6 Å²	138.6	74%	0.743	78%	0.778	S	S	*	*			cis	74.9	146.8	24.3	-92.1	168.4	157.2	0	0	115.4
259	E	23.7	Very low	26.7	Very low	183 Å²	183	136.4 Å²	136.4	86%	0.855	78%	0.78	S	S	*	*			cis	-143.3	-153	31.2	-146.9	-176.1	172.4	0	0	114.9
260	Q	26.4	Very low	26.7	Very low	155 Å²	155	132.6 Å²	132.6	72%	0.724	78%	0.777	S	S	*	*			trans	-119.8	146.2	-157.2	-59.5	-179.5	9.4	0	0	117.3
261	Q	23.9	Very low	26.6	Very low	176 Å²	176	135.9 Å²	135.9	82%	0.822	78%	0.776	S	S	*	*				30.3	127	127.5	-136.1	169.1	97.3	0	0	119.1
262	S	25.9	Very low	26.6	Very low	94 Å²	94	133.9 Å²	133.9	66%	0.657	77%	0.774	S	S	*	*				172.5	165.4	82	-66.6	0	0	0	0	114.8
263	Q	27	Very low	26.6	Very low	187 Å²	187	137.8 Å²	137.8	87%	0.874	78%	0.781	S	S	*	*			trans	67	139.7	165.4	-64.3	-179.4	-1	0	0	117.9
264	V	23.7	Very low	26.8	Very low	130 Å²	130	136.9 Å²	136.9	79%	0.788	77%	0.774	S	S	*	*			cis	111.6	106.2	12.1	170.6	0	0	0	0	113.8
265	T	22.9	Very low	27	Very low	135 Å²	135	137.5 Å²	137.5	83%	0.828	77%	0.766	S	S	*	*			trans	-169.3	111.3	145.4	25.3	0	0	0	0	114.7
266	S	27.3	Very low	26.9	Very low	85 Å²	85	141.9 Å²	141.9	59%	0.594	77%	0.77	S	S	*	*				30	123.6	129.1	55	0	0	0	0	125.8
267	H	24.5	Very low	27.2	Very low	167 Å²	167	140.3 Å²	140.3	77%	0.773	77%	0.77	S	S	*	*				80.4	132.4	122.8	-60.6	-33.6	0	0	0	125.1
268	Q	28.7	Very low	26.9	Very low	172 Å²	172	140.7 Å²	140.7	80%	0.804	77%	0.772	S	S	*	*			trans	70.4	151.9	149.9	-67.2	173.8	95.3	0	0	117.6
269	T	22.2	Very low	26.9	Very low	132 Å²	132	140.2 Å²	140.2	81%	0.81	78%	0.78	S	S	*	*			cis	-146.7	-163.8	4.1	-15.8	0	0	0	0	112.4
270	A	25.4	Very low	27	Very low	86 Å²	86	137.4 Å²	137.4	71%	0.711	78%	0.775	S	S	*	*			trans	-65.8	-175.7	-179.3	0	0	0	0	0	115
271	E	25.5	Very low	27.1	Very low	164 Å²	164	135 Å²	135	77%	0.766	78%	0.776	S	S	*	*			cis	-166.4	160	22.7	-155.8	-171.1	109.5	0	0	113
272	V	26	Very low	27.3	Very low	123 Å²	123	131.4 Å²	131.4	75%	0.745	77%	0.77	S	S	*	*			trans	53.2	161	166.2	-79.1	0	0	0	0	118.3
273	K	27	Very low	27.5	Very low	202 Å²	202	134.9 Å²	134.9	88%	0.878	78%	0.776	S	S	*	*			cis	-148.2	174.3	17.4	-148.3	169.3	-175.8	177.5	0	111
274	A	28	Very low	27.7	Very low	89 Å²	89	130.9 Å²	130.9	74%	0.736	77%	0.769	S	S	*	*			trans	-110.2	-177.3	-179.5	0	0	0	0	0	113.4
275	V	28.7	Very low	27.9	Very low	122 Å²	122	129.4 Å²	129.4	74%	0.739	77%	0.77	S	S	*	*			trans	115.7	99	160.6	-178.4	0	0	0	0	116.2
276	E	27	Very low	28.3	Very low	190 Å²	190	129.2 Å²	129.2	89%	0.888	77%	0.768	S	S	*	*			trans	61.9	158.3	136.7	-60.7	-177.8	128.5	0	0	123.3
277	A	35.9	Very low	28.5	Very low	89 Å²	89	132.2 Å²	132.2	74%	0.736	78%	0.783	S	S	*	*			trans	-93.8	-176.8	177.7	0	0	0	0	0	111.3
278	P	36.7	Very low	28.8	Very low	114 Å²	114	128.2 Å²	128.2	74%	0.74	78%	0.778	S	S	*	*				-147.1	168.9	91.7	39.4	-24.4	0	0	0	115.3
279	V	28.7	Very low	28.8	Very low	150 Å²	150	129.1 Å²	129.1	91%	0.909	78%	0.783	S	S	*	*			trans	-131.5	149.4	153.4	-80.7	0	0	0	0	109.3
280	T	24.8	Very low	29.1	Very low	124 Å²	124	128 Å²	128	76%	0.761	78%	0.781	S	S	*	*			trans	-123.8	172.6	-161.9	48.7	0	0	0	0	113.2
281	S	28.8	Very low	29.4	Very low	105 Å²	105	132.6 Å²	132.6	73%	0.734	79%	0.785	S	S	*	*			trans	73.2	125.8	174.3	-71.5	0	0	0	0	115.2
282	S	28	Very low	30	Very low	100 Å²	100	130.6 Å²	130.6	70%	0.699	79%	0.786	S	S	*	*				82.1	142.9	50.5	82.1	0	0	0	0	112.3
283	E	30.8	Very low	30.1	Very low	166 Å²	166	129.3 Å²	129.3	78%	0.776	78%	0.782	S	S	*	*			cis	-162	152.8	24.6	-157.9	-174.7	126.4	0	0	114.4
284	S	31.5	Very low	30.2	Very low	104 Å²	104	126 Å²	126	73%	0.727	78%	0.778	S	S	*	*			trans	63.7	160.7	157.4	-75.2	0	0	0	0	119.5
285	A	28.4	Very low	30.3	Very low	98 Å²	98	130.6 Å²	130.6	81%	0.81	79%	0.785	S	S	*	*			cis	-141.3	-178.2	18.3	0	0	0	0	0	116.1
286	V	31.3	Very low	30.3	Very low	132 Å²	132	130.4 Å²	130.4	80%	0.8	78%	0.784	S	S	*	*			trans	-91.1	160.5	-159.8	-146.4	0	0	0	0	115.7
287	V	30.1	Very low	30.3	Very low	147 Å²	147	131.1 Å²	131.1	89%	0.891	78%	0.784	S	S	*	*				178.8	163.5	124.9	150.8	0	0	0	0	110.1
288	A	31.2	Very low	30.2	Very low	83 Å²	83	135.5 Å²	135.5	69%	0.686	79%	0.789	S	S	*	*			trans	-135.7	167.2	-163.4	0	0	0	0	0	116.1
289	E	27.9	Very low	29.8	Very low	191 Å²	191	139 Å²	139	89%	0.893	80%	0.796	S	S	*	*			trans	63.8	154.3	161.5	-72.5	-168	140.7	0	0	119.3
290	S	29.2	Very low	29.8	Very low	110 Å²	110	140.3 Å²	140.3	77%	0.769	79%	0.792	S	S	*	*			cis	-155.3	-162.7	-15.7	58.3	0	0	0	0	111.3
291	K	32	Very low	30.7	Very low	182 Å²	182	145 Å²	145	79%	0.791	80%	0.795	S	S	*	*			trans	-88.3	160.4	-167.1	-54.6	176.6	-177.9	174.8	0	114.6
292	P	38.1	Very low	30.9	Very low	122 Å²	122	145.2 Å²	145.2	79%	0.792	79%	0.794	S	S	*	*				-128.6	162.1	89.3	4.7	18.6	0	0	0	113.2
293	S	28.3	Very low	31.2	Very low	95 Å²	95	148.5 Å²	148.5	66%	0.664	80%	0.799	S	S	*	*			cis	84	123.5	24.1	-56.7	0	0	0	0	114.1
294	V	29.5	Very low	31.5	Very low	132 Å²	132	149 Å²	149	80%	0.8	81%	0.806	S	S	*	*			cis	-159	155.9	-1.5	-163.6	0	0	0	0	108.4
295	E	28.4	Very low	31.7	Very low	186 Å²	186	152.4 Å²	152.4	87%	0.869	81%	0.81	S	S	*	*			trans	-165.7	119.6	136	-111.3	-171	164.4	0	0	116.9
296	V	29.3	Very low	32.5	Very low	119 Å²	119	156.7 Å²	156.7	72%	0.721	81%	0.81	S	S	*	*			trans	27.1	115.3	139	-169.8	0	0	0	0	121.5
297	K	28.1	Very low	32.9	Very low	204 Å²	204	157.8 Å²	157.8	89%	0.887	80%	0.804	S	S	*	*				-159.4	147.2	101.4	-103	-167.5	-179.7	-173.6	0	113.2
298	E	32.8	Very low	33.7	Very low	182 Å²	182	156.5 Å²	156.5	85%	0.85	80%	0.797	S	S	*	*			trans	-115.8	-177.3	176.9	-165.6	164.6	-157.3	0	0	109.2
299	E	27.9	Very low	35	Very low	188 Å²	188	157.6 Å²	157.6	88%	0.879	78%	0.784	S	S	*	*			trans	70.7	141	-171.3	-52.8	-177.8	149.9	0	0	114.1
300	E	29.4	Very low	36.5	Very low	177 Å²	177	157 Å²	157	83%	0.827	78%	0.779	S	S	*	*			cis	-143.6	165.7	-0.8	-150	-169.4	-176.9	0	0	110.2	P302	E300-P302 WeakPolarHBondContact O-CD 3.23Å
301	R	42.8	Very low	38.3	Very low	222 Å²	222	154.9 Å²	154.9	84%	0.838	75%	0.754	S	S	*	*			trans	-104.3	93	175.8	-177	-158.9	179.1	-150.7	1.9	111.3
302	P	34.9	Very low	39.6	Very low	109 Å²	109	153 Å²	153	71%	0.708	75%	0.752	S	S	*	*			trans	-70.7	145.3	165.4	30.6	-34.1	0	0	0	110.6	E300	E300-P302 WeakPolarHBondContact O-CD 3.23Å
303	E	33.3	Very low	41.5	Very low	170 Å²	170	150.9 Å²	150.9	79%	0.794	74%	0.738	S	S	*	*			trans	-68.7	149.2	179.6	-61.4	-178.2	108.6	0	0	112.4	Q305	E303-Q305 VanDerWaalsContact C-N 3.26Å; E303-Q305 PolarHBondContact O-N 2.57Å
304	L	38.1	Very low	43.7	Very low	176 Å²	176	151.9 Å²	151.9	92%	0.921	73%	0.73	S	S	*	*			trans	-70.8	81.4	173.8	-79.6	171.2	0	0	0	111	K306	L304-K306 PolarHBondContact O-N 3.48Å
305	Q	35.2	Very low	46.1	Very low	176 Å²	176	152.8 Å²	152.8	82%	0.822	73%	0.725	S	S	*	*			trans	-53.2	114.7	166.5	-66.9	-174.4	0.9	0	0	109.3	E303 K307	E303-Q305 VanDerWaalsContact C-N 3.26Å; E303-Q305 PolarHBondContact O-N 2.57Å; Q305-K307 VanDerWaalsContact C-N 3.33Å; Q305-K307 PolarHBondContact O-N 3.43Å
306	K	44	Very low	48.6	Very low	187 Å²	187	147.5 Å²	147.5	81%	0.813	70%	0.7	S	S	*	*			trans	-65	93.4	172.8	-75.5	180	178.1	173.5	0	108.9	L304 T308	L304-K306 PolarHBondContact O-N 3.48Å; K306-T308 PolarHBondContact O-N 2.67Å; K306-T308 PolarHBondContact O-OG1 3.21Å
307	K	41.3	Very low	51	Low	155 Å²	155	142.1 Å²	142.1	67%	0.674	67%	0.669	S	S	*	*			trans	-56.4	101.7	167.4	-76.8	-172.7	176.7	179.9	0	108.3	Q305 Y309	Q305-K307 VanDerWaalsContact C-N 3.33Å; Q305-K307 PolarHBondContact O-N 3.43Å; K307-Y309 VanDerWaalsContact C-N 3.32Å; K307-Y309 HydrophobicContact CB-CD2 4.43Å; K307-Y309 HydrophobicContact CB-CE2 3.97Å; K307-Y309 WeakPolarHBondContact O-CD2 3.43Å; K307-Y309 WeakPolarHBondContact O-CE2 3.31Å; K307-Y309 PolarHBondContact O-N 3.29Å
308	T	45.8	Very low	53.6	Low	121 Å²	121	135.5 Å²	135.5	74%	0.742	64%	0.64	S	S	*	*			trans	-76.9	87	177.4	-61.1	0	0	0	0	108.1	K306 K310	K306-T308 PolarHBondContact O-N 2.67Å; K306-T308 PolarHBondContact O-OG1 3.21Å; T308-K310 PolarHBondContact O-N 2.79Å
309	Y	58.9	Low	56	Low	106 Å²	106	132.2 Å²	132.2	42%	0.416	63%	0.625	S	S	.	*			trans	-61	102.3	178.3	-66.3	-88.5	0	0	0	110.5	K307 W311 P347 R348	K307-Y309 VanDerWaalsContact C-N 3.32Å; K307-Y309 HydrophobicContact CB-CD2 4.43Å; K307-Y309 HydrophobicContact CB-CE2 3.97Å; K307-Y309 WeakPolarHBondContact O-CD2 3.43Å; K307-Y309 WeakPolarHBondContact O-CE2 3.31Å; K307-Y309 PolarHBondContact O-N 3.29Å; Y309-W311 VanDerWaalsContact CB-CZ2 3.46Å; Y309-W311 AromaticContact CD1-CH2 3.66Å; Y309-W311 HydrophobicContact CD1-CH2 3.66Å; Y309-W311 AromaticContact CD1-CZ2 3.74Å; Y309-W311 HydrophobicContact CD1-CZ2 3.74Å; Y309-W311 HydrophobicContact CD1-CZ3 4.45Å; Y309-W311 HydrophobicContact CE1-CH2 4.4Å; Y309-W311 HydrophobicContact CG-CH2 4.14Å; Y309-W311 AromaticContact CG-CZ2 3.71Å; Y309-W311 HydrophobicContact CG-CZ2 3.71Å; Y309-W311 PolarHBondContact O-N 3Å; Y309-P347 HydrophobicContact CE2-CB 4.47Å; Y309-R348 HydrophobicContact CD2-CG 4.06Å; Y309-R348 HydrophobicContact CE2-CG 3.96Å
310	K	58.7	Low	58.6	Low	177 Å²	177	123.4 Å²	123.4	77%	0.77	58%	0.584	S	S	*	*			trans	-86.5	98.8	169.1	-73.5	-172.3	176.2	-177.4	0	109	T308	T308-K310 PolarHBondContact O-N 2.79Å
311	W	66.9	Low	61.4	Low	67 Å²	67	115 Å²	115	25%	0.254	55%	0.545	S	S	.	.			trans	-77.7	119.8	169	-46	106.9	0	0	0	108.3	Y309 T313 E316 A317 A320 R348	Y309-W311 VanDerWaalsContact CB-CZ2 3.46Å; Y309-W311 AromaticContact CD1-CH2 3.66Å; Y309-W311 HydrophobicContact CD1-CH2 3.66Å; Y309-W311 AromaticContact CD1-CZ2 3.74Å; Y309-W311 HydrophobicContact CD1-CZ2 3.74Å; Y309-W311 HydrophobicContact CD1-CZ3 4.45Å; Y309-W311 HydrophobicContact CE1-CH2 4.4Å; Y309-W311 HydrophobicContact CG-CH2 4.14Å; Y309-W311 AromaticContact CG-CZ2 3.71Å; Y309-W311 HydrophobicContact CG-CZ2 3.71Å; Y309-W311 PolarHBondContact O-N 3Å; W311-T313 VanDerWaalsContact C-N 3.33Å; W311-E316 HydrophobicContact CB-CG 4.44Å; W311-E316 HydrophobicContact CE3-CG 3.8Å; W311-A317 HydrophobicContact CB-CB 3.75Å; W311-A317 HydrophobicContact CG-CB 3.93Å; W311-A320 HydrophobicContact CD2-CB 4.17Å; W311-A320 HydrophobicContact CE3-CB 4.13Å; W311-A320 HydrophobicContact CH2-CB 3.35Å; W311-A320 HydrophobicContact CZ2-CB 3.42Å; W311-A320 VanDerWaalsContact CZ2-CB 3.42Å; W311-A320 HydrophobicContact CZ3-CB 3.74Å; W311-R348 HydrophobicContact CZ2-CG 4.25Å
312	N	60.7	Low	63.4	Low	142 Å²	142	107.5 Å²	107.5	76%	0.759	52%	0.518	S	S	*	.	S	Bend	trans	-80.9	-17.1	-175.3	-71.2	-37.4	0	0	0	112.1	E316	N312-E316 PolarHBondContact N-OE2 3.02Å
313	T	77.9	Confident	65.8	Low	78 Å²	78	107.8 Å²	107.8	48%	0.479	51%	0.51	S	S	.	.	S	Bend	trans	-126.7	153.9	171.4	74.1	0	0	0	0	113.3	W311 E315 E316 A317	W311-T313 VanDerWaalsContact C-N 3.33Å; T313-E315 PolarHBondContact O-N 3.11Å; T313-E316 PolarHBondContact N-OE2 3.21Å; T313-E316 VanDerWaalsContact N-OE2 3.08Å; T313-E316 WeakPolarHBondContact OG1-CB 3.15Å; T313-E316 PolarHBondContact OG1-N 2.92Å; T313-E316 VanDerWaalsContact OG1-N 3.11Å; T313-A317 PolarHBondContact O-N 3.29Å
314	K	74.7	Confident	68.4	Low	115 Å²	115	99.7 Å²	99.7	50%	0.5	47%	0.472	S	S	.	.	H	α-helix	trans	-67.6	-18.7	175.3	-171.3	167.3	-173.7	168.8	0	113.1	K318 E357	K314-K318 VanDerWaalsContact O-CG 3.28Å; K314-K318 WeakPolarHBondContact O-CG 3.27Å; K314-K318 PolarHBondContact O-N 3.26Å; K314-E357 WeakPolarHBondContact CE-OE2 3.16Å; K314-E357 IonicContact NZ-OE1 2.78Å; K314-E357 PolarHBondContact NZ-OE1 3Å; K314-E357 IonicContact NZ-OE2 2.73Å; K314-E357 PolarHBondContact NZ-OE2 3.11Å
315	E	78.6	Confident	70.7	Confident	151 Å²	151	91.3 Å²	91.3	71%	0.706	43%	0.428	S	S	*	.	H	α-helix	trans	-85.3	-43.2	178.7	-55.3	-154.6	127.2	0	0	111.2	T313 A317 K318 Q319	T313-E315 PolarHBondContact O-N 3.11Å; E315-A317 VanDerWaalsContact C-N 3.34Å; E315-A317 PolarHBondContact O-N 3.33Å; E315-K318 CarbonylContact O-C 3.58Å; E315-K318 WeakPolarHBondContact O-CB 3.38Å; E315-K318 PolarHBondContact O-N 2.97Å; E315-K318 VanDerWaalsContact O-N 3.11Å; E315-Q319 WeakPolarHBondContact O-CB 3.42Å; E315-Q319 PolarHBondContact O-N 2.79Å
316	E	80.7	Confident	73.2	Confident	75 Å²	75	89 Å²	89	35%	0.35	42%	0.415	S	S	.	.	H	α-helix	trans	-55	-46.6	167.9	-177.2	-169.5	-167.2	0	0	111.5	W311 N312 T313 K318 Q319 A320	W311-E316 HydrophobicContact CB-CG 4.44Å; W311-E316 HydrophobicContact CE3-CG 3.8Å; N312-E316 PolarHBondContact N-OE2 3.02Å; T313-E316 PolarHBondContact N-OE2 3.21Å; T313-E316 VanDerWaalsContact N-OE2 3.08Å; T313-E316 WeakPolarHBondContact OG1-CB 3.15Å; T313-E316 PolarHBondContact OG1-N 2.92Å; T313-E316 VanDerWaalsContact OG1-N 3.11Å; E316-K318 VanDerWaalsContact C-N 3.3Å; E316-K318 PolarHBondContact O-N 3.06Å; E316-Q319 PolarHBondContact O-N 2.84Å; E316-A320 PolarHBondContact O-N 2.67Å
317	A	80.8	Confident	75.2	Confident	7 Å²	7	85 Å²	85	6%	0.058	40%	0.4	C	S	.	.	H	α-helix	trans	-60.3	-35.7	174.8	0	0	0	0	0	113.6	W311 T313 E315 F321 L352	W311-A317 HydrophobicContact CB-CB 3.75Å; W311-A317 HydrophobicContact CG-CB 3.93Å; T313-A317 PolarHBondContact O-N 3.29Å; E315-A317 VanDerWaalsContact C-N 3.34Å; E315-A317 PolarHBondContact O-N 3.33Å; A317-F321 PolarHBondContact O-N 3.06Å; A317-L352 HydrophobicContact CB-CD2 4.07Å
318	K	82.4	Confident	77.3	Confident	65 Å²	65	81.1 Å²	81.1	28%	0.283	38%	0.383	S	S	.	.	H	α-helix	trans	-71.8	-36.9	172.9	-75.1	170.3	-179.5	177.9	0	111.5	K314 E315 E316 F321 K322 L352	K314-K318 VanDerWaalsContact O-CG 3.28Å; K314-K318 WeakPolarHBondContact O-CG 3.27Å; K314-K318 PolarHBondContact O-N 3.26Å; E315-K318 CarbonylContact O-C 3.58Å; E315-K318 WeakPolarHBondContact O-CB 3.38Å; E315-K318 PolarHBondContact O-N 2.97Å; E315-K318 VanDerWaalsContact O-N 3.11Å; E316-K318 VanDerWaalsContact C-N 3.3Å; E316-K318 PolarHBondContact O-N 3.06Å; K318-F321 PolarHBondContact O-N 3.28Å; K318-K322 WeakPolarHBondContact O-CG 3.28Å; K318-K322 PolarHBondContact O-N 2.85Å; K318-L352 HydrophobicContact CG-CD1 4.3Å; K318-L352 HydrophobicContact CG-CD2 3.79Å
319	Q	82.8	Confident	79.1	Confident	113 Å²	113	78.2 Å²	78.2	53%	0.528	38%	0.377	S	S	.	.	H	α-helix	trans	-69.3	-45.4	-179.2	-167.8	67.5	-0.3	0	0	110.9	E315 E316 F321 K322 E323	E315-Q319 WeakPolarHBondContact O-CB 3.42Å; E315-Q319 PolarHBondContact O-N 2.79Å; E316-Q319 PolarHBondContact O-N 2.84Å; Q319-F321 PolarHBondContact O-N 2.82Å; Q319-K322 WeakPolarHBondContact O-CB 3.36Å; Q319-K322 PolarHBondContact O-N 3.36Å; Q319-E323 WeakPolarHBondContact O-CB 3.47Å; Q319-E323 PolarHBondContact O-N 3.13Å
320	A	82.9	Confident	80.3	Confident	3 Å²	3	73.2 Å²	73.2	3%	0.025	36%	0.358	C	S	.	.	H	α-helix	trans	-59.7	-33	172.5	0	0	0	0	0	112.8	W311 E316 L324	W311-A320 HydrophobicContact CD2-CB 4.17Å; W311-A320 HydrophobicContact CE3-CB 4.13Å; W311-A320 HydrophobicContact CH2-CB 3.35Å; W311-A320 HydrophobicContact CZ2-CB 3.42Å; W311-A320 VanDerWaalsContact CZ2-CB 3.42Å; W311-A320 HydrophobicContact CZ3-CB 3.74Å; E316-A320 PolarHBondContact O-N 2.67Å; A320-L324 WeakPolarHBondContact O-CB 3.43Å; A320-L324 PolarHBondContact O-N 3.22Å
321	F	87.2	Confident	81.4	Confident	0 Å²	0	66.6 Å²	66.6	0%	0	33%	0.333	C	S	.	.	H	α-helix	trans	-71.3	-35.4	173.4	-172	-90.4	0	0	0	112.9	A317 K318 Q319 L325 W336 I343 Y349 L352 K358 A361 F362	A317-F321 PolarHBondContact O-N 3.06Å; K318-F321 PolarHBondContact O-N 3.28Å; Q319-F321 PolarHBondContact O-N 2.82Å; F321-L325 HydrophobicContact CD1-CD1 4.03Å; F321-L325 HydrophobicContact CE1-CD1 3.83Å; F321-L325 HydrophobicContact CE1-CG 4.45Å; F321-L325 WeakPolarHBondContact O-CG 3.45Å; F321-L325 PolarHBondContact O-N 3Å; F321-W336 HydrophobicContact CZ-CH2 4.34Å; F321-W336 HydrophobicContact CZ-CZ3 4.31Å; F321-I343 HydrophobicContact CE2-CD1 4.17Å; F321-I343 HydrophobicContact CZ-CD1 3.85Å; F321-Y349 AromaticContact CE2-CD2 3.76Å; F321-Y349 HydrophobicContact CE2-CD2 3.76Å; F321-Y349 HydrophobicContact CE2-CE2 4.15Å; F321-Y349 HydrophobicContact CZ-CD2 4.44Å; F321-Y349 HydrophobicContact CZ-CE2 4.49Å; F321-L352 HydrophobicContact CB-CD1 3.81Å; F321-L352 HydrophobicContact CB-CG 4.17Å; F321-L352 HydrophobicContact CD1-CD1 3.94Å; F321-L352 HydrophobicContact CD2-CD1 4.12Å; F321-L352 HydrophobicContact CD2-CG 4.42Å; F321-L352 HydrophobicContact CG-CD1 3.68Å; F321-L352 HydrophobicContact CG-CG 4.29Å; F321-K358 HydrophobicContact CE1-CB 4.28Å; F321-K358 WeakPolarHBondContact CE1-O 3.13Å; F321-K358 HydrophobicContact CE2-CB 4.11Å; F321-K358 HydrophobicContact CE2-CD 3.95Å; F321-K358 HydrophobicContact CE2-CG 3.8Å; F321-K358 HydrophobicContact CZ-CB 3.69Å; F321-K358 HydrophobicContact CZ-CD 4.26Å; F321-K358 HydrophobicContact CZ-CG 3.93Å; F321-A361 HydrophobicContact CD1-CB 3.62Å; F321-A361 HydrophobicContact CE1-CB 4.03Å; F321-F362 HydrophobicContact CE1-CB 4.44Å
322	K	84.9	Confident	82.1	Confident	64 Å²	64	64.1 Å²	64.1	28%	0.278	33%	0.327	S	S	.	.	H	α-helix	trans	-69.7	-40	171.4	-69.6	174.4	174.4	-179.3	0	112.2	K318 Q319 L325 K326 Y365	K318-K322 WeakPolarHBondContact O-CG 3.28Å; K318-K322 PolarHBondContact O-N 2.85Å; Q319-K322 WeakPolarHBondContact O-CB 3.36Å; Q319-K322 PolarHBondContact O-N 3.36Å; K322-L325 WeakPolarHBondContact O-CB 3.26Å; K322-L325 PolarHBondContact O-N 2.59Å; K322-K326 PolarHBondContact O-N 3.15Å; K322-Y365 HydrophobicContact CB-CD2 4.23Å
323	E	85.1	Confident	83.3	Confident	116 Å²	116	63.7 Å²	63.7	54%	0.542	32%	0.324	S	S	.	.	H	α-helix	trans	-63.7	-42.2	176.7	-175.2	174	-142.3	0	0	110.9	Q319 L325 K326 E327	Q319-E323 WeakPolarHBondContact O-CB 3.47Å; Q319-E323 PolarHBondContact O-N 3.13Å; E323-L325 VanDerWaalsContact C-N 3.32Å; E323-L325 PolarHBondContact O-N 3.3Å; E323-K326 PolarHBondContact O-N 2.96Å; E323-K326 VanDerWaalsContact O-N 3.1Å; E323-E327 WeakPolarHBondContact O-CB 3.35Å; E323-E327 PolarHBondContact O-N 2.62Å
324	L	88	Confident	83.8	Confident	0 Å²	0	61 Å²	61	0%	0	31%	0.308	C	S	.	.	H	α-helix	trans	-56.3	-42.8	170.1	174.6	63.1	0	0	0	112.6	A320 K326 K328 I343 D346 R348	A320-L324 WeakPolarHBondContact O-CB 3.43Å; A320-L324 PolarHBondContact O-N 3.22Å; L324-K326 VanDerWaalsContact C-N 3.33Å; L324-K328 HydrophobicContact CD1-CG 3.91Å; L324-K328 WeakPolarHBondContact O-CG 3.38Å; L324-K328 PolarHBondContact O-N 3.46Å; L324-I343 HydrophobicContact CD2-CB 3.96Å; L324-I343 HydrophobicContact CD2-CG2 4.26Å; L324-I343 HydrophobicContact CG-CB 4.2Å; L324-I343 HydrophobicContact CG-CG2 3.96Å; L324-D346 HydrophobicContact CD1-CB 3.59Å; L324-D346 WeakPolarHBondContact CD1-OD2 3.48Å; L324-D346 HydrophobicContact CD2-CB 4.19Å; L324-R348 HydrophobicContact CD2-CB 4.05Å
325	L	87.9	Confident	84.5	Confident	0 Å²	0	57.8 Å²	57.8	0%	0	30%	0.301	C	S	.	.	H	α-helix	trans	-64.4	-37.6	175.7	-70.4	165.3	0	0	0	111.8	F321 K322 E323 V330 A339 I343 F362 Y365	F321-L325 HydrophobicContact CD1-CD1 4.03Å; F321-L325 HydrophobicContact CE1-CD1 3.83Å; F321-L325 HydrophobicContact CE1-CG 4.45Å; F321-L325 WeakPolarHBondContact O-CG 3.45Å; F321-L325 PolarHBondContact O-N 3Å; K322-L325 WeakPolarHBondContact O-CB 3.26Å; K322-L325 PolarHBondContact O-N 2.59Å; E323-L325 VanDerWaalsContact C-N 3.32Å; E323-L325 PolarHBondContact O-N 3.3Å; L325-V330 HydrophobicContact CB-CB 4.41Å; L325-V330 HydrophobicContact CD2-CB 4.22Å; L325-V330 HydrophobicContact CD2-CG1 4.23Å; L325-V330 HydrophobicContact CD2-CG2 3.92Å; L325-V330 VanDerWaalsContact O-CB 3.31Å; L325-V330 WeakPolarHBondContact O-CB 3.37Å; L325-V330 WeakPolarHBondContact O-CG2 3.4Å; L325-V330 PolarHBondContact O-N 3.05Å; L325-A339 HydrophobicContact CD2-CB 4.31Å; L325-I343 HydrophobicContact CD2-CD1 3.86Å; L325-I343 HydrophobicContact CD2-CG2 4.04Å; L325-F362 HydrophobicContact CD1-CB 4.17Å; L325-F362 HydrophobicContact CD1-CD2 3.95Å; L325-F362 HydrophobicContact CD2-CD2 3.87Å; L325-F362 HydrophobicContact CD2-CE2 4.46Å; L325-Y365 HydrophobicContact CB-CD1 3.77Å; L325-Y365 HydrophobicContact CB-CD2 3.87Å; L325-Y365 HydrophobicContact CB-CE1 3.72Å; L325-Y365 HydrophobicContact CB-CE2 3.81Å; L325-Y365 HydrophobicContact CB-CG 3.85Å; L325-Y365 HydrophobicContact CD1-CD1 3.79Å; L325-Y365 HydrophobicContact CD1-CD2 4.32Å; L325-Y365 HydrophobicContact CD1-CG 3.66Å; L325-Y365 HydrophobicContact CG-CD1 4.3Å; L325-Y365 HydrophobicContact CG-CG 4.4Å; L325-Y365 PolarHBondContact O-OH 3.4Å
326	K	86.2	Confident	84.9	Confident	126 Å²	126	52.1 Å²	52.1	55%	0.548	27%	0.273	S	S	.	.	H	α-helix	trans	-69.2	-46.2	176.5	-159.3	160.5	-176	166.2	0	111.9	K322 E323 L324 K328 G329 Y365 E372	K322-K326 PolarHBondContact O-N 3.15Å; E323-K326 PolarHBondContact O-N 2.96Å; E323-K326 VanDerWaalsContact O-N 3.1Å; L324-K326 VanDerWaalsContact C-N 3.33Å; K326-K328 PolarHBondContact O-N 3.48Å; K326-G329 PolarHBondContact O-N 3.2Å; K326-G329 VanDerWaalsContact O-N 3.1Å; K326-Y365 WeakPolarHBondContact CA-OH 3.43Å; K326-Y365 HydrophobicContact CB-CE2 4Å; K326-E372 IonicContact NZ-OE2 2.85Å; K326-E372 PolarHBondContact NZ-OE2 3.43Å
327	E	86.4	Confident	85.2	Confident	105 Å²	105	55 Å²	55	49%	0.491	29%	0.286	S	S	.	.	H	α-helix	trans	-64.8	-36.4	179	-169.8	-159.7	105.9	0	0	112.6	E323 G329 R348	E323-E327 WeakPolarHBondContact O-CB 3.35Å; E323-E327 PolarHBondContact O-N 2.62Å; E327-G329 PolarHBondContact O-N 2.94Å; E327-R348 IonicContact OE1-CZ 3.22Å; E327-R348 IonicContact OE1-NH2 2.89Å; E327-R348 PolarHBondContact OE1-NH2 3.45Å; E327-R348 IonicContact OE2-CZ 3.75Å; E327-R348 IonicContact OE2-NH1 2.8Å; E327-R348 PolarHBondContact OE2-NH1 3.01Å; E327-R348 IonicContact OE2-NH2 3.67Å; E327-R348 PolarHBondContact OE2-NH2 3.07Å
328	K	86.9	Confident	85.5	Confident	73 Å²	73	60 Å²	60	32%	0.317	31%	0.308	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.7	14.1	174.1	-57.4	-46.4	-176.6	-149	0	113.8	L324 K326 V330 L342 I343 D346	L324-K328 HydrophobicContact CD1-CG 3.91Å; L324-K328 WeakPolarHBondContact O-CG 3.38Å; L324-K328 PolarHBondContact O-N 3.46Å; K326-K328 PolarHBondContact O-N 3.48Å; K328-V330 VanDerWaalsContact C-N 3.29Å; K328-V330 HydrophobicContact CB-CG2 4.38Å; K328-V330 PolarHBondContact O-N 3.5Å; K328-L342 HydrophobicContact CB-CB 4.39Å; K328-I343 HydrophobicContact CB-CG2 4.29Å; K328-I343 HydrophobicContact CG-CG2 4.15Å; K328-D346 WeakPolarHBondContact CE-OD2 3.49Å; K328-D346 IonicContact NZ-OD2 2.76Å; K328-D346 PolarHBondContact NZ-OD2 2.92Å
329	G	81.6	Confident	85.7	Confident	60 Å²	60	56.9 Å²	56.9	62%	0.619	30%	0.295	S	S	*	.	T	Hydrogen-bonded Turn	trans	63.6	29.1	172.5	0	0	0	0	0	114.5	K326 E327 S331	K326-G329 PolarHBondContact O-N 3.2Å; K326-G329 VanDerWaalsContact O-N 3.1Å; E327-G329 PolarHBondContact O-N 2.94Å; G329-S331 PolarHBondContact O-N 2.91Å; G329-S331 VanDerWaalsContact O-N 3.14Å
330	V	84.7	Confident	85.8	Confident	1 Å²	1	54 Å²	54	1%	0.006	28%	0.282	C	S	.	.			trans	-73.1	109.5	-177.1	-177	0	0	0	0	109.4	L325 K328 A339 L342 F362 Y365	L325-V330 HydrophobicContact CB-CB 4.41Å; L325-V330 HydrophobicContact CD2-CB 4.22Å; L325-V330 HydrophobicContact CD2-CG1 4.23Å; L325-V330 HydrophobicContact CD2-CG2 3.92Å; L325-V330 VanDerWaalsContact O-CB 3.31Å; L325-V330 WeakPolarHBondContact O-CB 3.37Å; L325-V330 WeakPolarHBondContact O-CG2 3.4Å; L325-V330 PolarHBondContact O-N 3.05Å; K328-V330 VanDerWaalsContact C-N 3.29Å; K328-V330 HydrophobicContact CB-CG2 4.38Å; K328-V330 PolarHBondContact O-N 3.5Å; V330-A339 HydrophobicContact CG1-CB 3.61Å; V330-A339 HydrophobicContact CG2-CB 4.38Å; V330-L342 HydrophobicContact CG2-CD1 4.08Å; V330-F362 HydrophobicContact CG1-CE2 3.91Å; V330-Y365 HydrophobicContact CB-CE1 4.12Å; V330-Y365 HydrophobicContact CG1-CE1 4.27Å; V330-Y365 VanDerWaalsContact O-CE1 3.23Å; V330-Y365 WeakPolarHBondContact O-CE1 3.34Å; V330-Y365 PolarHBondContact O-OH 3.45Å
331	S	82	Confident	86	Confident	37 Å²	37	61.8 Å²	61.8	26%	0.259	32%	0.315	S	S	.	.			trans	-71.5	154	-177.2	176.3	0	0	0	0	112.8	G329 N333 S334	G329-S331 PolarHBondContact O-N 2.91Å; G329-S331 VanDerWaalsContact O-N 3.14Å; S331-N333 WeakPolarHBondContact CB-OD1 3.24Å; S331-N333 PolarHBondContact O-N 2.79Å; S331-N333 VanDerWaalsContact O-N 3.11Å; S331-N333 PolarHBondContact OG-N 3.26Å; S331-N333 PolarHBondContact OG-OD1 3.14Å; S331-S334 PolarHBondContact N-OG 3.31Å; S331-S334 VanDerWaalsContact O-CB 3.28Å; S331-S334 WeakPolarHBondContact O-CB 3.39Å; S331-S334 PolarHBondContact O-N 3.08Å; S331-S334 PolarHBondContact O-OG 3.29Å
332	S	82.5	Confident	85.8	Confident	16 Å²	16	66.4 Å²	66.4	11%	0.112	34%	0.34	C	S	.	.	T	Hydrogen-bonded Turn	trans	-53.8	-22.5	171.8	57.9	0	0	0	0	114.8	K366 E373	S332-K366 VanDerWaalsContact O-CD 3.23Å; S332-K366 WeakPolarHBondContact O-CD 3.07Å; S332-K366 WeakPolarHBondContact O-CG 3.34Å; S332-K366 PolarHBondContact O-NZ 3.06Å; S332-E373 WeakPolarHBondContact CB-OE2 3.25Å; S332-E373 PolarHBondContact OG-OE1 3.33Å; S332-E373 PolarHBondContact OG-OE2 3.09Å
333	N	85.8	Confident	85.9	Confident	132 Å²	132	63.4 Å²	63.4	71%	0.706	33%	0.326	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89	-9.9	176	70.3	13.2	0	0	0	114.5	S331	S331-N333 WeakPolarHBondContact CB-OD1 3.24Å; S331-N333 PolarHBondContact O-N 2.79Å; S331-N333 VanDerWaalsContact O-N 3.11Å; S331-N333 PolarHBondContact OG-N 3.26Å; S331-N333 PolarHBondContact OG-OD1 3.14Å
334	S	87.6	Confident	86	Confident	21 Å²	21	61.9 Å²	61.9	15%	0.147	32%	0.321	C	S	.	.			trans	-68.8	144.6	-170.5	-67.7	0	0	0	0	112.8	S331 F362	S331-S334 PolarHBondContact N-OG 3.31Å; S331-S334 VanDerWaalsContact O-CB 3.28Å; S331-S334 WeakPolarHBondContact O-CB 3.39Å; S331-S334 PolarHBondContact O-N 3.08Å; S331-S334 PolarHBondContact O-OG 3.29Å; S334-F362 WeakPolarHBondContact O-CZ 3.22Å
335	S	89.3	Confident	85.8	Confident	49 Å²	49	69 Å²	69	34%	0.343	36%	0.359	S	S	.	.			trans	-75.8	158.2	169	68.7	0	0	0	0	111.8	E337 Q338 A339	S335-E337 PolarHBondContact O-N 2.66Å; S335-Q338 VanDerWaalsContact CB-OE1 3.29Å; S335-Q338 PolarHBondContact O-N 3.42Å; S335-Q338 VanDerWaalsContact OG-CD 3.29Å; S335-Q338 WeakPolarHBondContact OG-CG 3.18Å; S335-Q338 PolarHBondContact OG-N 3.25Å; S335-Q338 PolarHBondContact OG-OE1 2.91Å; S335-A339 WeakPolarHBondContact O-CB 3.31Å; S335-A339 PolarHBondContact O-N 3.24Å
336	W	86.8	Confident	85.6	Confident	32 Å²	32	70.1 Å²	70.1	12%	0.121	37%	0.365	C	S	.	.	H	α-helix	trans	-55	-34.7	173	166.4	-97.5	0	0	0	112.3	F321 M340 Y349 L355 K358 K359 F362	F321-W336 HydrophobicContact CZ-CH2 4.34Å; F321-W336 HydrophobicContact CZ-CZ3 4.31Å; W336-M340 HydrophobicContact CZ2-CB 4.23Å; W336-M340 HydrophobicContact CZ2-CG 4.12Å; W336-M340 HydrophobicContact CZ2-SD 3.63Å; W336-M340 WeakPolarHBondContact O-CB 3.35Å; W336-M340 PolarHBondContact O-N 3.29Å; W336-Y349 HydrophobicContact CH2-CE2 4.48Å; W336-L355 HydrophobicContact CH2-CD1 4.35Å; W336-L355 HydrophobicContact CZ2-CD1 3.56Å; W336-K358 HydrophobicContact CH2-CB 3.69Å; W336-K358 HydrophobicContact CZ3-CB 4.26Å; W336-K359 HydrophobicContact CD2-CD 4.5Å; W336-K359 HydrophobicContact CD2-CG 3.72Å; W336-K359 HydrophobicContact CE3-CG 3.94Å; W336-K359 HydrophobicContact CG-CG 4.27Å; W336-K359 HydrophobicContact CH2-CG 4.31Å; W336-K359 HydrophobicContact CZ2-CG 4.08Å; W336-K359 HydrophobicContact CZ3-CG 4.23Å; W336-K359 VanDerWaalsContact NE1-CE 3.35Å; W336-F362 HydrophobicContact CB-CD1 4.24Å; W336-F362 HydrophobicContact CB-CE1 3.98Å; W336-F362 HydrophobicContact CE3-CB 3.66Å; W336-F362 AromaticContact CE3-CD1 3.68Å; W336-F362 HydrophobicContact CE3-CD1 3.68Å; W336-F362 HydrophobicContact CE3-CD2 4.36Å; W336-F362 HydrophobicContact CE3-CE1 4.43Å; W336-F362 AromaticContact CE3-CG 3.63Å; W336-F362 HydrophobicContact CE3-CG 3.63Å; W336-F362 HydrophobicContact CZ3-CB 3.64Å; W336-F362 HydrophobicContact CZ3-CG 4.06Å
337	E	87.9	Confident	85.3	Confident	134 Å²	134	67.6 Å²	67.6	63%	0.626	36%	0.362	S	S	*	.	H	α-helix	trans	-77.3	-38.4	-176.3	-64.9	179.5	-171.6	0	0	112.7	S335 M340 K341	S335-E337 PolarHBondContact O-N 2.66Å; E337-M340 PolarHBondContact O-N 2.87Å; E337-K341 WeakPolarHBondContact O-CG 3.32Å; E337-K341 PolarHBondContact O-N 3.08Å; E337-K341 VanDerWaalsContact O-N 3.08Å
338	Q	85.9	Confident	85	Confident	112 Å²	112	64.2 Å²	64.2	52%	0.523	34%	0.344	S	S	.	.	H	α-helix	trans	-63.3	-48.4	170.4	-72.2	158.6	-47.1	0	0	110.5	S335 M340 K341 L342	S335-Q338 VanDerWaalsContact CB-OE1 3.29Å; S335-Q338 PolarHBondContact O-N 3.42Å; S335-Q338 VanDerWaalsContact OG-CD 3.29Å; S335-Q338 WeakPolarHBondContact OG-CG 3.18Å; S335-Q338 PolarHBondContact OG-N 3.25Å; S335-Q338 PolarHBondContact OG-OE1 2.91Å; Q338-M340 VanDerWaalsContact C-N 3.35Å; Q338-M340 PolarHBondContact O-N 3.2Å; Q338-K341 PolarHBondContact O-N 3.36Å; Q338-L342 PolarHBondContact O-N 2.98Å
339	A	87.2	Confident	84.7	Confident	0 Å²	0	62.2 Å²	62.2	0%	0	34%	0.335	C	S	.	.	H	α-helix	trans	-58.6	-45.2	175.7	0	0	0	0	0	111.9	L325 V330 S335 K341 L342 I343 F362	L325-A339 HydrophobicContact CD2-CB 4.31Å; V330-A339 HydrophobicContact CG1-CB 3.61Å; V330-A339 HydrophobicContact CG2-CB 4.38Å; S335-A339 WeakPolarHBondContact O-CB 3.31Å; S335-A339 PolarHBondContact O-N 3.24Å; A339-K341 VanDerWaalsContact C-N 3.35Å; A339-K341 PolarHBondContact O-N 2.9Å; A339-L342 PolarHBondContact O-N 3.3Å; A339-L342 VanDerWaalsContact O-N 3.12Å; A339-I343 WeakPolarHBondContact O-CG1 3.43Å; A339-I343 PolarHBondContact O-N 2.86Å; A339-F362 HydrophobicContact CB-CD2 3.91Å; A339-F362 HydrophobicContact CB-CE2 3.36Å; A339-F362 HydrophobicContact CB-CZ 3.96Å
340	M	85.6	Confident	84.5	Confident	54 Å²	54	63.7 Å²	63.7	27%	0.266	34%	0.336	S	S	.	.	H	α-helix	trans	-61.2	-40.6	179.7	-170.9	170.9	73.7	0	0	111.9	W336 E337 Q338 L342 I343 I344 Y349	W336-M340 HydrophobicContact CZ2-CB 4.23Å; W336-M340 HydrophobicContact CZ2-CG 4.12Å; W336-M340 HydrophobicContact CZ2-SD 3.63Å; W336-M340 WeakPolarHBondContact O-CB 3.35Å; W336-M340 PolarHBondContact O-N 3.29Å; E337-M340 PolarHBondContact O-N 2.87Å; Q338-M340 VanDerWaalsContact C-N 3.35Å; Q338-M340 PolarHBondContact O-N 3.2Å; M340-L342 VanDerWaalsContact C-N 3.28Å; M340-L342 PolarHBondContact O-N 2.99Å; M340-I343 PolarHBondContact O-N 2.99Å; M340-I344 WeakPolarHBondContact O-CB 3.26Å; M340-I344 WeakPolarHBondContact O-CG2 3.38Å; M340-I344 PolarHBondContact O-N 2.98Å; M340-Y349 HydrophobicContact CG-CE2 4.49Å
341	K	86.9	Confident	84.3	Confident	166 Å²	166	64.3 Å²	64.3	72%	0.722	34%	0.341	S	S	*	.	H	α-helix	trans	-60.2	-35.3	175	-74.9	173.8	-179.6	179.5	0	113	E337 Q338 A339	E337-K341 WeakPolarHBondContact O-CG 3.32Å; E337-K341 PolarHBondContact O-N 3.08Å; E337-K341 VanDerWaalsContact O-N 3.08Å; Q338-K341 PolarHBondContact O-N 3.36Å; A339-K341 VanDerWaalsContact C-N 3.35Å; A339-K341 PolarHBondContact O-N 2.9Å
342	L	83	Confident	84.2	Confident	97 Å²	97	62.6 Å²	62.6	51%	0.508	33%	0.329	S	S	.	.	H	α-helix	trans	-75.7	-30	179.6	-65.5	169.8	0	0	0	113.3	K328 V330 Q338 A339 M340	K328-L342 HydrophobicContact CB-CB 4.39Å; V330-L342 HydrophobicContact CG2-CD1 4.08Å; Q338-L342 PolarHBondContact O-N 2.98Å; A339-L342 PolarHBondContact O-N 3.3Å; A339-L342 VanDerWaalsContact O-N 3.12Å; M340-L342 VanDerWaalsContact C-N 3.28Å; M340-L342 PolarHBondContact O-N 2.99Å
343	I	87.2	Confident	84	Confident	0 Å²	0	67.3 Å²	67.3	0%	0	36%	0.36	C	S	.	.	H	α-helix	trans	-104.6	-21.3	-173.3	68.1	-174.3	0	0	0	114.9	F321 L324 L325 K328 A339 M340 N345 D346 Y349	F321-I343 HydrophobicContact CE2-CD1 4.17Å; F321-I343 HydrophobicContact CZ-CD1 3.85Å; L324-I343 HydrophobicContact CD2-CB 3.96Å; L324-I343 HydrophobicContact CD2-CG2 4.26Å; L324-I343 HydrophobicContact CG-CB 4.2Å; L324-I343 HydrophobicContact CG-CG2 3.96Å; L325-I343 HydrophobicContact CD2-CD1 3.86Å; L325-I343 HydrophobicContact CD2-CG2 4.04Å; K328-I343 HydrophobicContact CB-CG2 4.29Å; K328-I343 HydrophobicContact CG-CG2 4.15Å; A339-I343 WeakPolarHBondContact O-CG1 3.43Å; A339-I343 PolarHBondContact O-N 2.86Å; M340-I343 PolarHBondContact O-N 2.99Å; I343-N345 PolarHBondContact O-N 3Å; I343-D346 PolarHBondContact O-N 3.42Å; I343-Y349 HydrophobicContact CB-CD2 4.3Å; I343-Y349 HydrophobicContact CD1-CD2 3.68Å; I343-Y349 HydrophobicContact CD1-CE2 3.77Å; I343-Y349 HydrophobicContact CG1-CD2 3.54Å; I343-Y349 HydrophobicContact CG1-CE2 3.78Å; I343-Y349 HydrophobicContact CG1-CG 4.47Å; I343-Y349 WeakPolarHBondContact O-CB 3.49Å
344	I	85.9	Confident	84	Confident	84 Å²	84	66.8 Å²	66.8	43%	0.431	35%	0.351	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.8	-29	-168.9	-172.2	163.8	0	0	0	114.5	M340 Y349	M340-I344 WeakPolarHBondContact O-CB 3.26Å; M340-I344 WeakPolarHBondContact O-CG2 3.38Å; M340-I344 PolarHBondContact O-N 2.98Å; I344-Y349 HydrophobicContact CB-CE1 4.33Å; I344-Y349 HydrophobicContact CG1-CD1 4.26Å; I344-Y349 HydrophobicContact CG1-CE1 3.89Å
345	N	83.7	Confident	83.7	Confident	150 Å²	150	70.2 Å²	70.2	80%	0.802	37%	0.367	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.2	-9.9	-179.6	-66.1	-18.7	0	0	0	114.2	I343	I343-N345 PolarHBondContact O-N 3Å
346	D	84	Confident	83.5	Confident	24 Å²	24	71.8 Å²	71.8	13%	0.128	38%	0.378	C	S	.	.	S	Bend	trans	-80.7	133	179.2	-167.4	-66.4	0	0	0	110.5	L324 K328 I343 R348 Y349	L324-D346 HydrophobicContact CD1-CB 3.59Å; L324-D346 WeakPolarHBondContact CD1-OD2 3.48Å; L324-D346 HydrophobicContact CD2-CB 4.19Å; K328-D346 WeakPolarHBondContact CE-OD2 3.49Å; K328-D346 IonicContact NZ-OD2 2.76Å; K328-D346 PolarHBondContact NZ-OD2 2.92Å; I343-D346 PolarHBondContact O-N 3.42Å; D346-R348 PolarHBondContact O-N 3.21Å; D346-R348 VanDerWaalsContact OD1-CB 3.28Å; D346-R348 WeakPolarHBondContact OD1-CB 3.35Å; D346-R348 WeakPolarHBondContact OD1-CG 3.39Å; D346-R348 IonicContact OD1-CZ 3.04Å; D346-R348 PolarHBondContact OD1-N 3.28Å; D346-R348 IonicContact OD1-NE 2.67Å; D346-R348 PolarHBondContact OD1-NE 3.4Å; D346-R348 IonicContact OD1-NH2 3.62Å; D346-R348 IonicContact OD2-CZ 3.88Å; D346-R348 IonicContact OD2-NE 2.94Å; D346-R348 IonicContact OD2-NH2 2.83Å; D346-R348 PolarHBondContact OD2-NH2 3.32Å; D346-Y349 WeakPolarHBondContact O-CB 3.43Å; D346-Y349 PolarHBondContact O-N 2.98Å
347	P	79.9	Confident	83.5	Confident	72 Å²	72	71.5 Å²	71.5	47%	0.468	38%	0.378	S	S	.	.	G	3₁₀ helix	trans	-51.5	-32.8	177.2	-28.9	35.9	0	0	0	114.1	Y309 Y349 S350	Y309-P347 HydrophobicContact CE2-CB 4.47Å; P347-Y349 PolarHBondContact O-N 2.77Å; P347-S350 WeakPolarHBondContact O-CB 3.3Å; P347-S350 PolarHBondContact O-N 2.91Å; P347-S350 VanDerWaalsContact O-N 3.17Å; P347-S350 PolarHBondContact O-OG 2.88Å
348	R	79.8	Confident	83.5	Confident	34 Å²	34	66.1 Å²	66.1	13%	0.128	35%	0.353	C	S	.	.	G	3₁₀ helix	trans	-70.7	-15.9	179.6	-61.6	169.4	-71.8	179.9	-2.5	113	Y309 W311 L324 E327 D346 S350 A351	Y309-R348 HydrophobicContact CD2-CG 4.06Å; Y309-R348 HydrophobicContact CE2-CG 3.96Å; W311-R348 HydrophobicContact CZ2-CG 4.25Å; L324-R348 HydrophobicContact CD2-CB 4.05Å; E327-R348 IonicContact OE1-CZ 3.22Å; E327-R348 IonicContact OE1-NH2 2.89Å; E327-R348 PolarHBondContact OE1-NH2 3.45Å; E327-R348 IonicContact OE2-CZ 3.75Å; E327-R348 IonicContact OE2-NH1 2.8Å; E327-R348 PolarHBondContact OE2-NH1 3.01Å; E327-R348 IonicContact OE2-NH2 3.67Å; E327-R348 PolarHBondContact OE2-NH2 3.07Å; D346-R348 PolarHBondContact O-N 3.21Å; D346-R348 VanDerWaalsContact OD1-CB 3.28Å; D346-R348 WeakPolarHBondContact OD1-CB 3.35Å; D346-R348 WeakPolarHBondContact OD1-CG 3.39Å; D346-R348 IonicContact OD1-CZ 3.04Å; D346-R348 PolarHBondContact OD1-N 3.28Å; D346-R348 IonicContact OD1-NE 2.67Å; D346-R348 PolarHBondContact OD1-NE 3.4Å; D346-R348 IonicContact OD1-NH2 3.62Å; D346-R348 IonicContact OD2-CZ 3.88Å; D346-R348 IonicContact OD2-NE 2.94Å; D346-R348 IonicContact OD2-NH2 2.83Å; D346-R348 PolarHBondContact OD2-NH2 3.32Å; R348-S350 PolarHBondContact O-N 3.45Å; R348-S350 VanDerWaalsContact O-N 3.16Å; R348-A351 WeakPolarHBondContact O-CB 3.31Å; R348-A351 PolarHBondContact O-N 2.65Å
349	Y	81	Confident	83.6	Confident	31 Å²	31	65.1 Å²	65.1	12%	0.122	35%	0.347	C	S	.	.	G	3₁₀ helix	trans	-59.9	-23.4	169.6	-178.4	-113.5	0	0	0	112.5	F321 W336 M340 I343 I344 D346 P347 A351 K358	F321-Y349 AromaticContact CE2-CD2 3.76Å; F321-Y349 HydrophobicContact CE2-CD2 3.76Å; F321-Y349 HydrophobicContact CE2-CE2 4.15Å; F321-Y349 HydrophobicContact CZ-CD2 4.44Å; F321-Y349 HydrophobicContact CZ-CE2 4.49Å; W336-Y349 HydrophobicContact CH2-CE2 4.48Å; M340-Y349 HydrophobicContact CG-CE2 4.49Å; I343-Y349 HydrophobicContact CB-CD2 4.3Å; I343-Y349 HydrophobicContact CD1-CD2 3.68Å; I343-Y349 HydrophobicContact CD1-CE2 3.77Å; I343-Y349 HydrophobicContact CG1-CD2 3.54Å; I343-Y349 HydrophobicContact CG1-CE2 3.78Å; I343-Y349 HydrophobicContact CG1-CG 4.47Å; I343-Y349 WeakPolarHBondContact O-CB 3.49Å; I344-Y349 HydrophobicContact CB-CE1 4.33Å; I344-Y349 HydrophobicContact CG1-CD1 4.26Å; I344-Y349 HydrophobicContact CG1-CE1 3.89Å; D346-Y349 WeakPolarHBondContact O-CB 3.43Å; D346-Y349 PolarHBondContact O-N 2.98Å; P347-Y349 PolarHBondContact O-N 2.77Å; Y349-A351 VanDerWaalsContact C-N 3.33Å; Y349-K358 VanDerWaalsContact CD1-NZ 3.27Å; Y349-K358 HydrophobicContact CD2-CD 4.2Å; Y349-K358 HydrophobicContact CE1-CD 4.5Å; Y349-K358 HydrophobicContact CE2-CD 3.64Å; Y349-K358 WeakPolarHBondContact O-CE 3.35Å; Y349-K358 PolarHBondContact O-NZ 2.95Å
350	S	78.8	Confident	83.6	Confident	91 Å²	91	71.1 Å²	71.1	64%	0.636	37%	0.374	S	S	*	.	G	3₁₀ helix	trans	-76.8	-12.8	175.3	70.5	0	0	0	0	114.5	P347 R348 L352	P347-S350 WeakPolarHBondContact O-CB 3.3Å; P347-S350 PolarHBondContact O-N 2.91Å; P347-S350 VanDerWaalsContact O-N 3.17Å; P347-S350 PolarHBondContact O-OG 2.88Å; R348-S350 PolarHBondContact O-N 3.45Å; R348-S350 VanDerWaalsContact O-N 3.16Å; S350-L352 PolarHBondContact O-N 3.46Å; S350-L352 VanDerWaalsContact O-N 3.11Å
351	A	78.6	Confident	83.6	Confident	15 Å²	15	68.8 Å²	68.8	12%	0.124	36%	0.364	C	S	.	.	G	3₁₀ helix	trans	-54.9	-33.8	-174.6	0	0	0	0	0	114.1	R348 Y349	R348-A351 WeakPolarHBondContact O-CB 3.31Å; R348-A351 PolarHBondContact O-N 2.65Å; Y349-A351 VanDerWaalsContact C-N 3.33Å
352	L	80.9	Confident	83.7	Confident	1 Å²	1	61.1 Å²	61.1	1%	0.005	33%	0.331	C	S	.	.	S	Bend	trans	-108.2	112.5	174.3	-61.7	178.8	0	0	0	109	A317 K318 F321 S350 K354 K358 A361	A317-L352 HydrophobicContact CB-CD2 4.07Å; K318-L352 HydrophobicContact CG-CD1 4.3Å; K318-L352 HydrophobicContact CG-CD2 3.79Å; F321-L352 HydrophobicContact CB-CD1 3.81Å; F321-L352 HydrophobicContact CB-CG 4.17Å; F321-L352 HydrophobicContact CD1-CD1 3.94Å; F321-L352 HydrophobicContact CD2-CD1 4.12Å; F321-L352 HydrophobicContact CD2-CG 4.42Å; F321-L352 HydrophobicContact CG-CD1 3.68Å; F321-L352 HydrophobicContact CG-CG 4.29Å; S350-L352 PolarHBondContact O-N 3.46Å; S350-L352 VanDerWaalsContact O-N 3.11Å; L352-K354 PolarHBondContact O-N 2.92Å; L352-K358 HydrophobicContact CB-CG 3.82Å; L352-K358 HydrophobicContact CD1-CG 4.5Å; L352-K358 WeakPolarHBondContact O-CE 3.37Å; L352-A361 HydrophobicContact CD1-CB 3.64Å
353	P	79.3	Confident	84	Confident	115 Å²	115	60.9 Å²	60.9	75%	0.747	33%	0.33	S	S	*	.			trans	-72.9	-25.5	-172.4	26.3	-34.1	0	0	0	113.7
354	K	84.9	Confident	84	Confident	121 Å²	121	63.1 Å²	63.1	53%	0.526	35%	0.349	S	S	.	.	S	Bend	trans	-99.4	130.3	-175	-64.5	-177.8	-176.1	176.6	0	111.8	L352 S356 E357 K358	L352-K354 PolarHBondContact O-N 2.92Å; K354-S356 PolarHBondContact O-N 3.39Å; K354-E357 HydrophobicContact CB-CB 4.19Å; K354-E357 HydrophobicContact CB-CG 3.95Å; K354-E357 HydrophobicContact CD-CG 4.47Å; K354-E357 PolarHBondContact O-N 3.46Å; K354-K358 PolarHBondContact O-N 3.07Å
355	L	82.1	Confident	84.2	Confident	93 Å²	93	59.8 Å²	59.8	49%	0.487	33%	0.331	S	S	.	.	H	α-helix	trans	-58.3	-34.3	177.3	-178.9	61.4	0	0	0	113	W336 K358 K359	W336-L355 HydrophobicContact CH2-CD1 4.35Å; W336-L355 HydrophobicContact CZ2-CD1 3.56Å; L355-K358 PolarHBondContact O-N 3.37Å; L355-K359 WeakPolarHBondContact O-CB 3.25Å; L355-K359 WeakPolarHBondContact O-CG 3.26Å; L355-K359 PolarHBondContact O-N 3.32Å
356	S	84.8	Confident	84.4	Confident	81 Å²	81	55.4 Å²	55.4	57%	0.566	31%	0.305	S	S	*	.	H	α-helix	trans	-64.6	-40.5	173.7	48.7	0	0	0	0	112.5	K354 K359 Q360	K354-S356 PolarHBondContact O-N 3.39Å; S356-K359 PolarHBondContact O-N 3.25Å; S356-Q360 WeakPolarHBondContact O-CB 3.48Å; S356-Q360 PolarHBondContact O-N 3.1Å
357	E	87.1	Confident	84.6	Confident	27 Å²	27	58.8 Å²	58.8	13%	0.126	33%	0.326	C	S	.	.	H	α-helix	trans	-70.5	-36.1	176.9	-62.8	-175.5	-174	0	0	111.3	K314 K354 Q360 A361	K314-E357 WeakPolarHBondContact CE-OE2 3.16Å; K314-E357 IonicContact NZ-OE1 2.78Å; K314-E357 PolarHBondContact NZ-OE1 3Å; K314-E357 IonicContact NZ-OE2 2.73Å; K314-E357 PolarHBondContact NZ-OE2 3.11Å; K354-E357 HydrophobicContact CB-CB 4.19Å; K354-E357 HydrophobicContact CB-CG 3.95Å; K354-E357 HydrophobicContact CD-CG 4.47Å; K354-E357 PolarHBondContact O-N 3.46Å; E357-Q360 PolarHBondContact O-N 2.97Å; E357-A361 VanDerWaalsContact O-CB 3.31Å; E357-A361 WeakPolarHBondContact O-CB 3.45Å; E357-A361 PolarHBondContact O-N 3.33Å
358	K	87.1	Confident	84.9	Confident	20 Å²	20	58.9 Å²	58.9	9%	0.087	32%	0.32	C	S	.	.	H	α-helix	trans	-62.2	-48.7	169.9	-64.7	-173.3	-170.9	-168	0	112.4	F321 W336 Y349 L352 K354 L355 Q360 A361 F362	F321-K358 HydrophobicContact CE1-CB 4.28Å; F321-K358 WeakPolarHBondContact CE1-O 3.13Å; F321-K358 HydrophobicContact CE2-CB 4.11Å; F321-K358 HydrophobicContact CE2-CD 3.95Å; F321-K358 HydrophobicContact CE2-CG 3.8Å; F321-K358 HydrophobicContact CZ-CB 3.69Å; F321-K358 HydrophobicContact CZ-CD 4.26Å; F321-K358 HydrophobicContact CZ-CG 3.93Å; W336-K358 HydrophobicContact CH2-CB 3.69Å; W336-K358 HydrophobicContact CZ3-CB 4.26Å; Y349-K358 VanDerWaalsContact CD1-NZ 3.27Å; Y349-K358 HydrophobicContact CD2-CD 4.2Å; Y349-K358 HydrophobicContact CE1-CD 4.5Å; Y349-K358 HydrophobicContact CE2-CD 3.64Å; Y349-K358 WeakPolarHBondContact O-CE 3.35Å; Y349-K358 PolarHBondContact O-NZ 2.95Å; L352-K358 HydrophobicContact CB-CG 3.82Å; L352-K358 HydrophobicContact CD1-CG 4.5Å; L352-K358 WeakPolarHBondContact O-CE 3.37Å; K354-K358 PolarHBondContact O-N 3.07Å; L355-K358 PolarHBondContact O-N 3.37Å; K358-Q360 VanDerWaalsContact C-N 3.33Å; K358-Q360 PolarHBondContact O-N 2.85Å; K358-A361 PolarHBondContact O-N 3.15Å; K358-F362 WeakPolarHBondContact O-CB 3.17Å; K358-F362 PolarHBondContact O-N 3.48Å
359	K	87.3	Confident	85.3	Confident	92 Å²	92	57.9 Å²	57.9	40%	0.4	32%	0.318	S	S	.	.	H	α-helix	trans	-62.1	-38.9	176.8	-78	-174.8	172.8	-170.9	0	111.9	W336 L355 S356 F362 N363	W336-K359 HydrophobicContact CD2-CD 4.5Å; W336-K359 HydrophobicContact CD2-CG 3.72Å; W336-K359 HydrophobicContact CE3-CG 3.94Å; W336-K359 HydrophobicContact CG-CG 4.27Å; W336-K359 HydrophobicContact CH2-CG 4.31Å; W336-K359 HydrophobicContact CZ2-CG 4.08Å; W336-K359 HydrophobicContact CZ3-CG 4.23Å; W336-K359 VanDerWaalsContact NE1-CE 3.35Å; L355-K359 WeakPolarHBondContact O-CB 3.25Å; L355-K359 WeakPolarHBondContact O-CG 3.26Å; L355-K359 PolarHBondContact O-N 3.32Å; S356-K359 PolarHBondContact O-N 3.25Å; K359-F362 PolarHBondContact O-N 3.02Å; K359-N363 WeakPolarHBondContact O-CB 3.46Å; K359-N363 PolarHBondContact O-N 3.24Å
360	Q	87.3	Confident	85.6	Confident	125 Å²	125	61.1 Å²	61.1	58%	0.584	33%	0.334	S	S	*	.	H	α-helix	trans	-65	-45.1	174.1	-171.7	-177.5	49.6	0	0	111.7	S356 E357 K358 F362 N363 A364	S356-Q360 WeakPolarHBondContact O-CB 3.48Å; S356-Q360 PolarHBondContact O-N 3.1Å; E357-Q360 PolarHBondContact O-N 2.97Å; K358-Q360 VanDerWaalsContact C-N 3.33Å; K358-Q360 PolarHBondContact O-N 2.85Å; Q360-F362 VanDerWaalsContact C-N 3.35Å; Q360-N363 PolarHBondContact O-N 3.47Å; Q360-A364 VanDerWaalsContact O-CB 3.3Å; Q360-A364 WeakPolarHBondContact O-CB 3.43Å; Q360-A364 PolarHBondContact O-N 3.28Å
361	A	87.3	Confident	86.2	Confident	6 Å²	6	63.2 Å²	63.2	5%	0.05	33%	0.331	C	S	.	.	H	α-helix	trans	-64.6	-37.6	177	0	0	0	0	0	112.3	F321 L352 E357 K358 Y365	F321-A361 HydrophobicContact CD1-CB 3.62Å; F321-A361 HydrophobicContact CE1-CB 4.03Å; L352-A361 HydrophobicContact CD1-CB 3.64Å; E357-A361 VanDerWaalsContact O-CB 3.31Å; E357-A361 WeakPolarHBondContact O-CB 3.45Å; E357-A361 PolarHBondContact O-N 3.33Å; K358-A361 PolarHBondContact O-N 3.15Å; A361-Y365 VanDerWaalsContact O-CB 3.32Å; A361-Y365 WeakPolarHBondContact O-CB 3.26Å; A361-Y365 PolarHBondContact O-N 3.45Å
362	F	88.8	Confident	86.6	Confident	4 Å²	4	65.8 Å²	65.8	2%	0.018	34%	0.341	C	S	.	.	H	α-helix	trans	-67.4	-45.5	173.5	169.3	-99.5	0	0	0	112.9	F321 L325 V330 S334 W336 A339 K358 K359 Q360 A364 Y365 K366	F321-F362 HydrophobicContact CE1-CB 4.44Å; L325-F362 HydrophobicContact CD1-CB 4.17Å; L325-F362 HydrophobicContact CD1-CD2 3.95Å; L325-F362 HydrophobicContact CD2-CD2 3.87Å; L325-F362 HydrophobicContact CD2-CE2 4.46Å; V330-F362 HydrophobicContact CG1-CE2 3.91Å; S334-F362 WeakPolarHBondContact O-CZ 3.22Å; W336-F362 HydrophobicContact CB-CD1 4.24Å; W336-F362 HydrophobicContact CB-CE1 3.98Å; W336-F362 HydrophobicContact CE3-CB 3.66Å; W336-F362 AromaticContact CE3-CD1 3.68Å; W336-F362 HydrophobicContact CE3-CD1 3.68Å; W336-F362 HydrophobicContact CE3-CD2 4.36Å; W336-F362 HydrophobicContact CE3-CE1 4.43Å; W336-F362 AromaticContact CE3-CG 3.63Å; W336-F362 HydrophobicContact CE3-CG 3.63Å; W336-F362 HydrophobicContact CZ3-CB 3.64Å; W336-F362 HydrophobicContact CZ3-CG 4.06Å; A339-F362 HydrophobicContact CB-CD2 3.91Å; A339-F362 HydrophobicContact CB-CE2 3.36Å; A339-F362 HydrophobicContact CB-CZ 3.96Å; K358-F362 WeakPolarHBondContact O-CB 3.17Å; K358-F362 PolarHBondContact O-N 3.48Å; K359-F362 PolarHBondContact O-N 3.02Å; Q360-F362 VanDerWaalsContact C-N 3.35Å; F362-A364 VanDerWaalsContact C-N 3.29Å; F362-A364 PolarHBondContact O-N 2.86Å; F362-Y365 CarbonylContact O-C 3.58Å; F362-Y365 WeakPolarHBondContact O-CB 3.38Å; F362-Y365 PolarHBondContact O-N 3.23Å; F362-Y365 VanDerWaalsContact O-N 3.16Å; F362-K366 WeakPolarHBondContact O-CB 3.33Å; F362-K366 PolarHBondContact O-N 3.19Å
363	N	88	Confident	86.9	Confident	93 Å²	93	69.5 Å²	69.5	50%	0.497	36%	0.358	S	S	.	.	H	α-helix	trans	-63.5	-38.5	176.6	-73	-4.6	0	0	0	111.2	K359 Q360 K366 V367	K359-N363 WeakPolarHBondContact O-CB 3.46Å; K359-N363 PolarHBondContact O-N 3.24Å; Q360-N363 PolarHBondContact O-N 3.47Å; N363-K366 PolarHBondContact O-N 2.92Å; N363-V367 WeakPolarHBondContact O-CG2 3.44Å; N363-V367 PolarHBondContact O-N 3.36Å; N363-V367 VanDerWaalsContact O-N 3.15Å
364	A	87.6	Confident	87.4	Confident	47 Å²	47	71.7 Å²	71.7	39%	0.388	36%	0.356	S	S	.	.	H	α-helix	trans	-67.7	-35	173.3	0	0	0	0	0	112.8	Q360 F362 Q368	Q360-A364 VanDerWaalsContact O-CB 3.3Å; Q360-A364 WeakPolarHBondContact O-CB 3.43Å; Q360-A364 PolarHBondContact O-N 3.28Å; F362-A364 VanDerWaalsContact C-N 3.29Å; F362-A364 PolarHBondContact O-N 2.86Å; A364-Q368 WeakPolarHBondContact O-CB 3.42Å; A364-Q368 PolarHBondContact O-N 3.48Å; A364-Q368 VanDerWaalsContact O-N 3.13Å
365	Y	89.4	Confident	87.6	Confident	14 Å²	14	69.5 Å²	69.5	6%	0.055	35%	0.348	C	S	.	.	H	α-helix	trans	-63.4	-51.4	169.7	169.6	-95.4	0	0	0	110.6	K322 L325 K326 V330 A361 F362 V367 Q368 T369	K322-Y365 HydrophobicContact CB-CD2 4.23Å; L325-Y365 HydrophobicContact CB-CD1 3.77Å; L325-Y365 HydrophobicContact CB-CD2 3.87Å; L325-Y365 HydrophobicContact CB-CE1 3.72Å; L325-Y365 HydrophobicContact CB-CE2 3.81Å; L325-Y365 HydrophobicContact CB-CG 3.85Å; L325-Y365 HydrophobicContact CD1-CD1 3.79Å; L325-Y365 HydrophobicContact CD1-CD2 4.32Å; L325-Y365 HydrophobicContact CD1-CG 3.66Å; L325-Y365 HydrophobicContact CG-CD1 4.3Å; L325-Y365 HydrophobicContact CG-CG 4.4Å; L325-Y365 PolarHBondContact O-OH 3.4Å; K326-Y365 WeakPolarHBondContact CA-OH 3.43Å; K326-Y365 HydrophobicContact CB-CE2 4Å; V330-Y365 HydrophobicContact CB-CE1 4.12Å; V330-Y365 HydrophobicContact CG1-CE1 4.27Å; V330-Y365 VanDerWaalsContact O-CE1 3.23Å; V330-Y365 WeakPolarHBondContact O-CE1 3.34Å; V330-Y365 PolarHBondContact O-OH 3.45Å; A361-Y365 VanDerWaalsContact O-CB 3.32Å; A361-Y365 WeakPolarHBondContact O-CB 3.26Å; A361-Y365 PolarHBondContact O-N 3.45Å; F362-Y365 CarbonylContact O-C 3.58Å; F362-Y365 WeakPolarHBondContact O-CB 3.38Å; F362-Y365 PolarHBondContact O-N 3.23Å; F362-Y365 VanDerWaalsContact O-N 3.16Å; Y365-V367 VanDerWaalsContact C-N 3.34Å; Y365-V367 PolarHBondContact O-N 3.02Å; Y365-Q368 CarbonylContact O-C 3.59Å; Y365-Q368 WeakPolarHBondContact O-CA 3.36Å; Y365-Q368 WeakPolarHBondContact O-CB 3.2Å; Y365-Q368 PolarHBondContact O-N 2.82Å; Y365-T369 WeakPolarHBondContact CE1-OG1 3.09Å; Y365-T369 VanDerWaalsContact CE2-OG1 3.23Å; Y365-T369 WeakPolarHBondContact CE2-OG1 3.44Å; Y365-T369 PolarHBondContact O-N 3.07Å; Y365-T369 PolarHBondContact O-OG1 3.45Å; Y365-T369 VanDerWaalsContact O-OG1 3.13Å; Y365-T369 PolarHBondContact OH-OG1 2.84Å
366	K	89.1	Confident	87.9	Confident	58 Å²	58	71.6 Å²	71.6	25%	0.252	36%	0.355	S	S	.	.	H	α-helix	trans	-55.9	-46.5	-176.7	-157	-167.3	88.8	80.7	0	112.2	S332 F362 N363 Q368 T369 E370	S332-K366 VanDerWaalsContact O-CD 3.23Å; S332-K366 WeakPolarHBondContact O-CD 3.07Å; S332-K366 WeakPolarHBondContact O-CG 3.34Å; S332-K366 PolarHBondContact O-NZ 3.06Å; F362-K366 WeakPolarHBondContact O-CB 3.33Å; F362-K366 PolarHBondContact O-N 3.19Å; N363-K366 PolarHBondContact O-N 2.92Å; K366-Q368 VanDerWaalsContact C-N 3.34Å; K366-T369 PolarHBondContact O-N 2.83Å; K366-E370 IonicContact NZ-OE2 3.19Å; K366-E370 WeakPolarHBondContact O-CB 3.34Å; K366-E370 PolarHBondContact O-N 3.34Å
367	V	87.8	Confident	88.1	Confident	94 Å²	94	70.7 Å²	70.7	57%	0.57	35%	0.353	S	S	*	.	H	α-helix	trans	-67.9	-32.6	175.9	173.7	0	0	0	0	112.2	N363 Y365 K371	N363-V367 WeakPolarHBondContact O-CG2 3.44Å; N363-V367 PolarHBondContact O-N 3.36Å; N363-V367 VanDerWaalsContact O-N 3.15Å; Y365-V367 VanDerWaalsContact C-N 3.34Å; Y365-V367 PolarHBondContact O-N 3.02Å; V367-K371 WeakPolarHBondContact O-CB 3.34Å; V367-K371 PolarHBondContact O-N 3.16Å
368	Q	86.8	Confident	88.3	Confident	75 Å²	75	76.9 Å²	76.9	35%	0.35	38%	0.375	S	S	.	.	H	α-helix	trans	-72.4	-41.8	175.4	179.6	64.4	20.5	0	0	111.6	A364 Y365 K366 K371 E372	A364-Q368 WeakPolarHBondContact O-CB 3.42Å; A364-Q368 PolarHBondContact O-N 3.48Å; A364-Q368 VanDerWaalsContact O-N 3.13Å; Y365-Q368 CarbonylContact O-C 3.59Å; Y365-Q368 WeakPolarHBondContact O-CA 3.36Å; Y365-Q368 WeakPolarHBondContact O-CB 3.2Å; Y365-Q368 PolarHBondContact O-N 2.82Å; K366-Q368 VanDerWaalsContact C-N 3.34Å; Q368-K371 CarbonylContact O-C 3.56Å; Q368-K371 WeakPolarHBondContact O-CB 3.45Å; Q368-K371 PolarHBondContact O-N 3.26Å; Q368-E372 WeakPolarHBondContact CG-OE1 3.45Å; Q368-E372 PolarHBondContact NE2-OE1 2.81Å; Q368-E372 WeakPolarHBondContact O-CB 3.3Å; Q368-E372 WeakPolarHBondContact O-CG 3.33Å; Q368-E372 PolarHBondContact O-N 3.1Å
369	T	87.8	Confident	88.6	Confident	13 Å²	13	79.5 Å²	79.5	8%	0.08	39%	0.389	C	S	.	.	H	α-helix	trans	-67.4	-45.4	177.3	-54	0	0	0	0	111.5	Y365 K366 K371 E372 E373	Y365-T369 WeakPolarHBondContact CE1-OG1 3.09Å; Y365-T369 VanDerWaalsContact CE2-OG1 3.23Å; Y365-T369 WeakPolarHBondContact CE2-OG1 3.44Å; Y365-T369 PolarHBondContact O-N 3.07Å; Y365-T369 PolarHBondContact O-OG1 3.45Å; Y365-T369 VanDerWaalsContact O-OG1 3.13Å; Y365-T369 PolarHBondContact OH-OG1 2.84Å; K366-T369 PolarHBondContact O-N 2.83Å; T369-K371 PolarHBondContact O-N 3.34Å; T369-E372 PolarHBondContact O-N 3.25Å; T369-E372 VanDerWaalsContact O-N 3.09Å; T369-E373 HydrophobicContact CG2-CG 4.26Å; T369-E373 WeakPolarHBondContact O-CB 3.46Å; T369-E373 VanDerWaalsContact O-CG 3.31Å; T369-E373 WeakPolarHBondContact O-CG 3.34Å; T369-E373 PolarHBondContact O-N 3.13Å
370	E	88.1	Confident	88.8	Confident	98 Å²	98	82 Å²	82	46%	0.458	40%	0.4	S	S	.	.	H	α-helix	trans	-56.9	-35	173.6	-170.3	-178.6	156.6	0	0	111.8	K366 K374	K366-E370 IonicContact NZ-OE2 3.19Å; K366-E370 WeakPolarHBondContact O-CB 3.34Å; K366-E370 PolarHBondContact O-N 3.34Å; E370-K374 WeakPolarHBondContact O-CB 3.4Å; E370-K374 PolarHBondContact O-N 2.82Å
371	K	89.7	Confident	89	Confident	135 Å²	135	80.8 Å²	80.8	59%	0.587	39%	0.391	S	S	*	.	H	α-helix	trans	-78.2	-35.6	176.4	-178.3	-174	172.6	-164.6	0	113	V367 Q368 T369 E375	V367-K371 WeakPolarHBondContact O-CB 3.34Å; V367-K371 PolarHBondContact O-N 3.16Å; Q368-K371 CarbonylContact O-C 3.56Å; Q368-K371 WeakPolarHBondContact O-CB 3.45Å; Q368-K371 PolarHBondContact O-N 3.26Å; T369-K371 PolarHBondContact O-N 3.34Å; K371-E375 VanDerWaalsContact O-CB 3.27Å; K371-E375 WeakPolarHBondContact O-CB 3.31Å; K371-E375 PolarHBondContact O-N 3.08Å
372	E	87.8	Confident	89.3	Confident	69 Å²	69	86 Å²	86	32%	0.322	41%	0.412	S	S	.	.	H	α-helix	trans	-66.5	-52.2	173.7	-80.2	174	-156.7	0	0	110.4	K326 Q368 T369 K374 E375 E376	K326-E372 IonicContact NZ-OE2 2.85Å; K326-E372 PolarHBondContact NZ-OE2 3.43Å; Q368-E372 WeakPolarHBondContact CG-OE1 3.45Å; Q368-E372 PolarHBondContact NE2-OE1 2.81Å; Q368-E372 WeakPolarHBondContact O-CB 3.3Å; Q368-E372 WeakPolarHBondContact O-CG 3.33Å; Q368-E372 PolarHBondContact O-N 3.1Å; T369-E372 PolarHBondContact O-N 3.25Å; T369-E372 VanDerWaalsContact O-N 3.09Å; E372-K374 VanDerWaalsContact C-N 3.29Å; E372-K374 PolarHBondContact O-N 3.09Å; E372-E375 PolarHBondContact O-N 2.98Å; E372-E375 VanDerWaalsContact O-N 3.11Å; E372-E376 WeakPolarHBondContact O-CB 3.22Å; E372-E376 PolarHBondContact O-N 3.48Å
373	E	87.9	Confident	89.5	Confident	80 Å²	80	91.1 Å²	91.1	37%	0.374	44%	0.436	S	S	.	.	H	α-helix	trans	-54.4	-43.5	175.6	-69.9	166.9	168.3	0	0	111.7	S332 T369 A377	S332-E373 WeakPolarHBondContact CB-OE2 3.25Å; S332-E373 PolarHBondContact OG-OE1 3.33Å; S332-E373 PolarHBondContact OG-OE2 3.09Å; T369-E373 HydrophobicContact CG2-CG 4.26Å; T369-E373 WeakPolarHBondContact O-CB 3.46Å; T369-E373 VanDerWaalsContact O-CG 3.31Å; T369-E373 WeakPolarHBondContact O-CG 3.34Å; T369-E373 PolarHBondContact O-N 3.13Å; E373-A377 WeakPolarHBondContact O-CB 3.31Å; E373-A377 PolarHBondContact O-N 3Å
374	K	88.2	Confident	89.8	Confident	160 Å²	160	87.8 Å²	87.8	70%	0.696	42%	0.42	S	S	*	.	H	α-helix	trans	-72.3	-30.8	179.3	-172.9	168.9	-174.4	167.2	0	113.7	E370 E372 R378	E370-K374 WeakPolarHBondContact O-CB 3.4Å; E370-K374 PolarHBondContact O-N 2.82Å; E372-K374 VanDerWaalsContact C-N 3.29Å; E372-K374 PolarHBondContact O-N 3.09Å; K374-R378 WeakPolarHBondContact O-CB 3.48Å; K374-R378 PolarHBondContact O-N 3.01Å
375	E	89.3	Confident	90.2	Very high	75 Å²	75	87.8 Å²	87.8	35%	0.35	41%	0.411	S	S	.	.	H	α-helix	trans	-79.1	-37.6	174.6	-172.5	59.7	-146.5	0	0	111.1	K371 E372 R378 I379	K371-E375 VanDerWaalsContact O-CB 3.27Å; K371-E375 WeakPolarHBondContact O-CB 3.31Å; K371-E375 PolarHBondContact O-N 3.08Å; E372-E375 PolarHBondContact O-N 2.98Å; E372-E375 VanDerWaalsContact O-N 3.11Å; E375-R378 VanDerWaalsContact CD-NE 3.32Å; E375-R378 CarbonylContact O-C 3.5Å; E375-R378 WeakPolarHBondContact O-CA 3.34Å; E375-R378 WeakPolarHBondContact O-CB 3.44Å; E375-R378 PolarHBondContact O-N 2.82Å; E375-R378 VanDerWaalsContact O-N 3.11Å; E375-R378 IonicContact OE1-CZ 3.59Å; E375-R378 VanDerWaalsContact OE1-CZ 3.25Å; E375-R378 IonicContact OE1-NE 3.84Å; E375-R378 PolarHBondContact OE1-NE 2.88Å; E375-R378 IonicContact OE1-NH2 3.26Å; E375-R378 PolarHBondContact OE1-NH2 3.14Å; E375-R378 IonicContact OE2-CZ 2.78Å; E375-R378 IonicContact OE2-NE 3.77Å; E375-R378 PolarHBondContact OE2-NE 3.23Å; E375-R378 IonicContact OE2-NH2 2.74Å; E375-R378 PolarHBondContact OE2-NH2 2.94Å; E375-I379 HydrophobicContact CG-CD1 4.08Å; E375-I379 VanDerWaalsContact O-CG1 3.28Å; E375-I379 WeakPolarHBondContact O-CG1 3.32Å; E375-I379 PolarHBondContact O-N 3.28Å
376	E	89.4	Confident	90.5	Very high	137 Å²	137	90.7 Å²	90.7	64%	0.64	43%	0.426	S	S	*	.	H	α-helix	trans	-62.8	-44.8	173.5	-173.3	176.8	171.8	0	0	111.3	E372 R378 I379 K380	E372-E376 WeakPolarHBondContact O-CB 3.22Å; E372-E376 PolarHBondContact O-N 3.48Å; E376-R378 VanDerWaalsContact C-N 3.25Å; E376-R378 PolarHBondContact O-N 3.13Å; E376-I379 PolarHBondContact O-N 3.3Å; E376-K380 WeakPolarHBondContact O-CB 3.35Å; E376-K380 PolarHBondContact O-N 2.82Å
377	A	88.9	Confident	90.7	Very high	63 Å²	63	93 Å²	93	52%	0.521	44%	0.436	S	S	.	.	H	α-helix	trans	-58.9	-36.8	171.4	0	0	0	0	0	112.4	E373 Y381	E373-A377 WeakPolarHBondContact O-CB 3.31Å; E373-A377 PolarHBondContact O-N 3Å; A377-Y381 VanDerWaalsContact O-CB 3.26Å; A377-Y381 WeakPolarHBondContact O-CB 3.29Å; A377-Y381 PolarHBondContact O-N 2.93Å
378	R	91.3	Very high	91.1	Very high	156 Å²	156	88.6 Å²	88.6	59%	0.589	41%	0.409	S	S	*	.	H	α-helix	trans	-71.1	-37.7	176.6	-167.6	177.3	80.8	113.9	4.3	112.5	K374 E375 E376 K382	K374-R378 WeakPolarHBondContact O-CB 3.48Å; K374-R378 PolarHBondContact O-N 3.01Å; E375-R378 VanDerWaalsContact CD-NE 3.32Å; E375-R378 CarbonylContact O-C 3.5Å; E375-R378 WeakPolarHBondContact O-CA 3.34Å; E375-R378 WeakPolarHBondContact O-CB 3.44Å; E375-R378 PolarHBondContact O-N 2.82Å; E375-R378 VanDerWaalsContact O-N 3.11Å; E375-R378 IonicContact OE1-CZ 3.59Å; E375-R378 VanDerWaalsContact OE1-CZ 3.25Å; E375-R378 IonicContact OE1-NE 3.84Å; E375-R378 PolarHBondContact OE1-NE 2.88Å; E375-R378 IonicContact OE1-NH2 3.26Å; E375-R378 PolarHBondContact OE1-NH2 3.14Å; E375-R378 IonicContact OE2-CZ 2.78Å; E375-R378 IonicContact OE2-NE 3.77Å; E375-R378 PolarHBondContact OE2-NE 3.23Å; E375-R378 IonicContact OE2-NH2 2.74Å; E375-R378 PolarHBondContact OE2-NH2 2.94Å; E376-R378 VanDerWaalsContact C-N 3.25Å; E376-R378 PolarHBondContact O-N 3.13Å; R378-K382 WeakPolarHBondContact O-CB 3.38Å; R378-K382 PolarHBondContact O-N 3.44Å
379	I	93.3	Very high	91.5	Very high	75 Å²	75	88.2 Å²	88.2	39%	0.385	41%	0.407	S	S	.	.	H	α-helix	trans	-65.3	-54.5	174.4	-71.7	163.2	0	0	0	109.3	E375 E376 Y381 K382 E383	E375-I379 HydrophobicContact CG-CD1 4.08Å; E375-I379 VanDerWaalsContact O-CG1 3.28Å; E375-I379 WeakPolarHBondContact O-CG1 3.32Å; E375-I379 PolarHBondContact O-N 3.28Å; E376-I379 PolarHBondContact O-N 3.3Å; I379-Y381 VanDerWaalsContact C-N 3.31Å; I379-Y381 PolarHBondContact O-N 3.13Å; I379-K382 CarbonylContact O-C 3.54Å; I379-K382 WeakPolarHBondContact O-CA 3.27Å; I379-K382 WeakPolarHBondContact O-CB 3.48Å; I379-K382 PolarHBondContact O-N 2.92Å; I379-E383 HydrophobicContact CG2-CG 4.32Å; I379-E383 WeakPolarHBondContact CG2-OE1 3.36Å; I379-E383 WeakPolarHBondContact O-CG 3.38Å; I379-E383 PolarHBondContact O-N 2.68Å
380	K	91.6	Very high	91.8	Very high	146 Å²	146	95.7 Å²	95.7	64%	0.635	43%	0.434	S	S	*	.	H	α-helix	trans	-57	-41.3	179.3	-173.9	173.3	-178.9	175.5	0	112.5	E376 E383 S384	E376-K380 WeakPolarHBondContact O-CB 3.35Å; E376-K380 PolarHBondContact O-N 2.82Å; K380-E383 PolarHBondContact O-N 3.16Å; K380-S384 PolarHBondContact O-N 2.54Å; K380-S384 PolarHBondContact O-OG 2.95Å; K380-S384 VanDerWaalsContact O-OG 3.13Å
381	Y	90.3	Very high	92.1	Very high	99 Å²	99	93.4 Å²	93.4	39%	0.388	42%	0.422	S	S	.	.	H	α-helix	trans	-65.7	-38.7	174.6	169.4	-107.2	0	0	0	113	A377 I379 S384 K385 P421 D424	A377-Y381 VanDerWaalsContact O-CB 3.26Å; A377-Y381 WeakPolarHBondContact O-CB 3.29Å; A377-Y381 PolarHBondContact O-N 2.93Å; I379-Y381 VanDerWaalsContact C-N 3.31Å; I379-Y381 PolarHBondContact O-N 3.13Å; Y381-S384 PolarHBondContact O-N 3.34Å; Y381-K385 VanDerWaalsContact CZ-CE 3.45Å; Y381-K385 PolarHBondContact O-N 2.92Å; Y381-K385 WeakPolarHBondContact OH-CE 3.17Å; Y381-P421 HydrophobicContact CE2-CG 4.14Å; Y381-D424 PolarHBondContact OH-OD1 3.25Å; Y381-D424 PolarHBondContact OH-OD2 3.27Å
382	K	94.1	Very high	92.3	Very high	115 Å²	115	87 Å²	87	50%	0.5	39%	0.394	S	S	.	.	H	α-helix	trans	-65.4	-40.8	172.7	178	-178.8	171.7	-64.4	0	111.6	R378 I379 K385 E386	R378-K382 WeakPolarHBondContact O-CB 3.38Å; R378-K382 PolarHBondContact O-N 3.44Å; I379-K382 CarbonylContact O-C 3.54Å; I379-K382 WeakPolarHBondContact O-CA 3.27Å; I379-K382 WeakPolarHBondContact O-CB 3.48Å; I379-K382 PolarHBondContact O-N 2.92Å; K382-K385 PolarHBondContact O-N 2.86Å; K382-E386 VanDerWaalsContact CE-OE1 3.24Å; K382-E386 WeakPolarHBondContact CE-OE1 3.37Å; K382-E386 IonicContact NZ-OE1 3.77Å; K382-E386 PolarHBondContact NZ-OE1 2.87Å; K382-E386 IonicContact NZ-OE2 2.75Å; K382-E386 PolarHBondContact NZ-OE2 3.09Å; K382-E386 PolarHBondContact O-N 3.4Å
383	E	94.1	Very high	92.6	Very high	111 Å²	111	85.1 Å²	85.1	52%	0.519	39%	0.385	S	S	.	.	H	α-helix	trans	-64.6	-39.8	174.2	-69.9	170.4	168.7	0	0	111.7	I379 K380 E386 K387	I379-E383 HydrophobicContact CG2-CG 4.32Å; I379-E383 WeakPolarHBondContact CG2-OE1 3.36Å; I379-E383 WeakPolarHBondContact O-CG 3.38Å; I379-E383 PolarHBondContact O-N 2.68Å; K380-E383 PolarHBondContact O-N 3.16Å; E383-E386 PolarHBondContact O-N 3.44Å; E383-K387 VanDerWaalsContact O-CB 3.26Å; E383-K387 WeakPolarHBondContact O-CB 3.38Å; E383-K387 PolarHBondContact O-N 2.74Å
384	S	94	Very high	92.8	Very high	23 Å²	23	86.5 Å²	86.5	16%	0.161	40%	0.396	C	S	.	.	H	α-helix	trans	-60.7	-42.7	172.1	-66.1	0	0	0	0	112.1	K380 Y381 K387 F388	K380-S384 PolarHBondContact O-N 2.54Å; K380-S384 PolarHBondContact O-OG 2.95Å; K380-S384 VanDerWaalsContact O-OG 3.13Å; Y381-S384 PolarHBondContact O-N 3.34Å; S384-K387 PolarHBondContact O-N 3.48Å; S384-F388 WeakPolarHBondContact O-CB 3.48Å; S384-F388 PolarHBondContact O-N 3.37Å
385	K	94.9	Very high	92.9	Very high	47 Å²	47	81.5 Å²	81.5	20%	0.204	37%	0.374	C	S	.	.	H	α-helix	trans	-60.8	-47	172.8	-73.9	-164.5	176.5	-150.5	0	112.1	Y381 K382 F388 Q389 V420 D424 I428	Y381-K385 VanDerWaalsContact CZ-CE 3.45Å; Y381-K385 PolarHBondContact O-N 2.92Å; Y381-K385 WeakPolarHBondContact OH-CE 3.17Å; K382-K385 PolarHBondContact O-N 2.86Å; K385-F388 PolarHBondContact O-N 2.65Å; K385-Q389 WeakPolarHBondContact O-CB 3.32Å; K385-Q389 PolarHBondContact O-N 2.84Å; K385-V420 HydrophobicContact CG-CG1 4.47Å; K385-D424 WeakPolarHBondContact CE-OD1 3.36Å; K385-D424 IonicContact NZ-OD1 2.91Å; K385-D424 PolarHBondContact NZ-OD1 3.17Å; K385-D424 IonicContact NZ-OD2 3.48Å; K385-I428 HydrophobicContact CB-CD1 3.8Å; K385-I428 HydrophobicContact CD-CD1 4.1Å; K385-I428 HydrophobicContact CG-CD1 3.85Å
386	E	95.2	Very high	92.9	Very high	76 Å²	76	86.3 Å²	86.3	36%	0.355	40%	0.397	S	S	.	.	H	α-helix	trans	-68.5	-33.9	-179.8	-75	171.5	-160.4	0	0	112.7	K382 E383 R390	K382-E386 VanDerWaalsContact CE-OE1 3.24Å; K382-E386 WeakPolarHBondContact CE-OE1 3.37Å; K382-E386 IonicContact NZ-OE1 3.77Å; K382-E386 PolarHBondContact NZ-OE1 2.87Å; K382-E386 IonicContact NZ-OE2 2.75Å; K382-E386 PolarHBondContact NZ-OE2 3.09Å; K382-E386 PolarHBondContact O-N 3.4Å; E383-E386 PolarHBondContact O-N 3.44Å; E386-R390 WeakPolarHBondContact O-CB 3.45Å; E386-R390 VanDerWaalsContact O-CG 3.31Å; E386-R390 WeakPolarHBondContact O-CG 3.46Å; E386-R390 PolarHBondContact O-N 3.22Å
387	K	95.1	Very high	92.8	Very high	107 Å²	107	86.3 Å²	86.3	47%	0.465	40%	0.395	S	S	.	.	H	α-helix	trans	-65.2	-43.2	171.4	-170.4	-174.7	-177.7	-164.9	0	110.9	E383 S384 F391 E415 V416	E383-K387 VanDerWaalsContact O-CB 3.26Å; E383-K387 WeakPolarHBondContact O-CB 3.38Å; E383-K387 PolarHBondContact O-N 2.74Å; S384-K387 PolarHBondContact O-N 3.48Å; K387-F391 VanDerWaalsContact O-CB 3.25Å; K387-F391 WeakPolarHBondContact O-CB 3.5Å; K387-F391 PolarHBondContact O-N 3.42Å; K387-E415 IonicContact NZ-OE2 3.24Å; K387-E415 PolarHBondContact NZ-OE2 2.82Å; K387-E415 VanDerWaalsContact NZ-OE2 3.15Å; K387-V416 HydrophobicContact CD-CG2 3.96Å; K387-V416 HydrophobicContact CG-CG1 4.38Å; K387-V416 HydrophobicContact CG-CG2 4.19Å
388	F	95	Very high	92.8	Very high	0 Å²	0	83.8 Å²	83.8	0%	0	37%	0.373	C	S	.	.	H	α-helix	trans	-65.3	-46	176.2	-179.1	-105.5	0	0	0	112.5	S384 K385 F391 L392 V416 W417 V420 R425 I428	S384-F388 WeakPolarHBondContact O-CB 3.48Å; S384-F388 PolarHBondContact O-N 3.37Å; K385-F388 PolarHBondContact O-N 2.65Å; F388-F391 WeakPolarHBondContact O-CB 3.46Å; F388-F391 PolarHBondContact O-N 2.86Å; F388-L392 HydrophobicContact CD1-CD1 4.28Å; F388-L392 HydrophobicContact CE1-CD1 3.59Å; F388-L392 HydrophobicContact CE1-CG 4.43Å; F388-L392 HydrophobicContact CE2-CD1 4.26Å; F388-L392 HydrophobicContact CE2-CG 4.45Å; F388-L392 HydrophobicContact CZ-CD1 3.59Å; F388-L392 HydrophobicContact CZ-CG 4.25Å; F388-L392 PolarHBondContact O-N 3.09Å; F388-L392 VanDerWaalsContact O-N 3.08Å; F388-V416 HydrophobicContact CB-CG1 4.19Å; F388-V416 HydrophobicContact CD2-CG1 4.15Å; F388-V416 VanDerWaalsContact CD2-O 3.26Å; F388-V416 WeakPolarHBondContact CD2-O 3.17Å; F388-W417 HydrophobicContact CE2-CB 4.26Å; F388-W417 AromaticContact CE2-CD2 3.97Å; F388-W417 HydrophobicContact CE2-CD2 3.97Å; F388-W417 AromaticContact CE2-CE3 3.45Å; F388-W417 HydrophobicContact CE2-CE3 3.45Å; F388-W417 VanDerWaalsContact CE2-CE3 3.45Å; F388-W417 HydrophobicContact CE2-CG 4.33Å; F388-W417 HydrophobicContact CE2-CZ3 4.05Å; F388-W417 HydrophobicContact CZ-CD2 4.39Å; F388-W417 AromaticContact CZ-CE3 3.77Å; F388-W417 HydrophobicContact CZ-CE3 3.77Å; F388-W417 AromaticContact CZ-CZ3 3.88Å; F388-W417 HydrophobicContact CZ-CZ3 3.88Å; F388-V420 HydrophobicContact CB-CG2 3.77Å; F388-V420 HydrophobicContact CG-CG2 4.13Å; F388-R425 HydrophobicContact CD1-CG 4.47Å; F388-R425 HydrophobicContact CE1-CB 3.98Å; F388-R425 HydrophobicContact CE1-CG 3.83Å; F388-R425 HydrophobicContact CE2-CG 4.09Å; F388-R425 HydrophobicContact CZ-CB 3.92Å; F388-R425 HydrophobicContact CZ-CG 3.6Å; F388-I428 HydrophobicContact CD1-CB 4.02Å; F388-I428 HydrophobicContact CD1-CD1 3.92Å; F388-I428 HydrophobicContact CD1-CG2 3.71Å; F388-I428 HydrophobicContact CE1-CB 4.12Å; F388-I428 HydrophobicContact CE1-CG2 4.04Å
389	Q	94.9	Very high	92.8	Very high	67 Å²	67	78.7 Å²	78.7	31%	0.313	36%	0.359	S	S	.	.	H	α-helix	trans	-57.2	-56.5	174.8	-177.7	178.5	-13.5	0	0	111	K385 F391 L392 E393 I428 V432	K385-Q389 WeakPolarHBondContact O-CB 3.32Å; K385-Q389 PolarHBondContact O-N 2.84Å; Q389-F391 PolarHBondContact O-N 3.3Å; Q389-L392 PolarHBondContact O-N 2.92Å; Q389-L392 VanDerWaalsContact O-N 3.1Å; Q389-E393 HydrophobicContact CG-CG 4.26Å; Q389-E393 WeakPolarHBondContact CG-OE1 3.5Å; Q389-E393 PolarHBondContact NE2-OE1 3.4Å; Q389-E393 WeakPolarHBondContact O-CG 3.16Å; Q389-E393 PolarHBondContact O-N 3.03Å; Q389-I428 HydrophobicContact CB-CG2 3.66Å; Q389-I428 HydrophobicContact CG-CG2 4.05Å; Q389-V432 HydrophobicContact CG-CG2 3.73Å
390	R	94.6	Very high	92.8	Very high	171 Å²	171	76.5 Å²	76.5	65%	0.645	35%	0.35	S	S	*	.	H	α-helix	trans	-61.8	-30.9	-179.4	-73.3	-179.6	-178.9	-159.9	3.5	113.5	E386 N394	E386-R390 WeakPolarHBondContact O-CB 3.45Å; E386-R390 VanDerWaalsContact O-CG 3.31Å; E386-R390 WeakPolarHBondContact O-CG 3.46Å; E386-R390 PolarHBondContact O-N 3.22Å; R390-N394 PolarHBondContact O-N 3.26Å; R390-N394 PolarHBondContact O-ND2 3.43Å
391	F	94.9	Very high	92.8	Very high	49 Å²	49	75 Å²	75	22%	0.215	35%	0.353	C	S	.	.	H	α-helix	trans	-62.3	-54.6	172	171.1	-98.4	0	0	0	110.3	K387 F388 Q389 E393 N394 H395 F411 L414 V416	K387-F391 VanDerWaalsContact O-CB 3.25Å; K387-F391 WeakPolarHBondContact O-CB 3.5Å; K387-F391 PolarHBondContact O-N 3.42Å; F388-F391 WeakPolarHBondContact O-CB 3.46Å; F388-F391 PolarHBondContact O-N 2.86Å; Q389-F391 PolarHBondContact O-N 3.3Å; F391-E393 PolarHBondContact O-N 2.98Å; F391-N394 PolarHBondContact O-N 2.88Å; F391-H395 AromaticContact CE2-CD2 3.6Å; F391-H395 HydrophobicContact CZ-CB 4.5Å; F391-H395 AromaticContact CZ-CD2 3.58Å; F391-H395 WeakPolarHBondContact O-CB 3.41Å; F391-H395 PolarHBondContact O-N 3.48Å; F391-F411 HydrophobicContact CE1-CB 4.37Å; F391-F411 AromaticContact CE1-CD1 3.76Å; F391-F411 HydrophobicContact CE1-CD1 3.76Å; F391-F411 HydrophobicContact CE1-CD2 4.12Å; F391-F411 HydrophobicContact CE1-CE1 4.02Å; F391-F411 HydrophobicContact CE1-CE2 4.35Å; F391-F411 AromaticContact CE1-CG 3.83Å; F391-F411 HydrophobicContact CE1-CG 3.83Å; F391-F411 HydrophobicContact CE1-CZ 4.31Å; F391-F411 AromaticContact CZ-CD1 3.66Å; F391-F411 HydrophobicContact CZ-CD1 3.66Å; F391-F411 AromaticContact CZ-CE1 3.83Å; F391-F411 HydrophobicContact CZ-CE1 3.83Å; F391-F411 HydrophobicContact CZ-CG 4.21Å; F391-F411 HydrophobicContact CZ-CZ 4.48Å; F391-L414 HydrophobicContact CE1-CD1 4.13Å; F391-L414 HydrophobicContact CE2-CD1 3.99Å; F391-L414 HydrophobicContact CZ-CD1 3.41Å; F391-L414 VanDerWaalsContact CZ-CD1 3.41Å; F391-V416 HydrophobicContact CB-CG1 3.85Å; F391-V416 HydrophobicContact CD1-CG1 4.27Å; F391-V416 HydrophobicContact CG-CG1 4.02Å
392	L	93.6	Very high	93	Very high	0 Å²	0	70.6 Å²	70.6	0%	0	34%	0.337	C	S	.	.	H	α-helix	trans	-63.7	-35.9	179.2	-64.3	-177.4	0	0	0	113.3	F388 Q389 N394 M398 F411 V432	F388-L392 HydrophobicContact CD1-CD1 4.28Å; F388-L392 HydrophobicContact CE1-CD1 3.59Å; F388-L392 HydrophobicContact CE1-CG 4.43Å; F388-L392 HydrophobicContact CE2-CD1 4.26Å; F388-L392 HydrophobicContact CE2-CG 4.45Å; F388-L392 HydrophobicContact CZ-CD1 3.59Å; F388-L392 HydrophobicContact CZ-CG 4.25Å; F388-L392 PolarHBondContact O-N 3.09Å; F388-L392 VanDerWaalsContact O-N 3.08Å; Q389-L392 PolarHBondContact O-N 2.92Å; Q389-L392 VanDerWaalsContact O-N 3.1Å; L392-N394 PolarHBondContact O-N 3.08Å; L392-M398 HydrophobicContact CB-CG 4.46Å; L392-M398 HydrophobicContact CD1-CE 4.42Å; L392-M398 HydrophobicContact CD2-CE 4.21Å; L392-M398 HydrophobicContact CD2-SD 4.28Å; L392-M398 VanDerWaalsContact O-CG 3.31Å; L392-M398 WeakPolarHBondContact O-CG 3.45Å; L392-F411 HydrophobicContact CD2-CD2 3.87Å; L392-F411 HydrophobicContact CD2-CE2 3.76Å; L392-V432 HydrophobicContact CB-CB 4.37Å; L392-V432 HydrophobicContact CB-CG1 3.75Å; L392-V432 HydrophobicContact CB-CG2 4.36Å
393	E	94.2	Very high	92.9	Very high	30 Å²	30	74.7 Å²	74.7	14%	0.14	35%	0.349	C	S	.	.	H	α-helix	trans	-66.3	-20.4	180	-73.3	175.6	169	0	0	114.9	Q389 F391 V432 Y435 K439	Q389-E393 HydrophobicContact CG-CG 4.26Å; Q389-E393 WeakPolarHBondContact CG-OE1 3.5Å; Q389-E393 PolarHBondContact NE2-OE1 3.4Å; Q389-E393 WeakPolarHBondContact O-CG 3.16Å; Q389-E393 PolarHBondContact O-N 3.03Å; F391-E393 PolarHBondContact O-N 2.98Å; E393-V432 HydrophobicContact CG-CB 4.42Å; E393-V432 HydrophobicContact CG-CG1 3.87Å; E393-V432 HydrophobicContact CG-CG2 3.77Å; E393-Y435 HydrophobicContact CB-CD1 4.35Å; E393-Y435 HydrophobicContact CB-CE1 4.22Å; E393-Y435 HydrophobicContact CG-CD1 3.83Å; E393-Y435 HydrophobicContact CG-CE1 4.06Å; E393-K439 PolarHBondContact O-NZ 3.24Å
394	N	91.9	Very high	92.9	Very high	110 Å²	110	70.5 Å²	70.5	59%	0.588	33%	0.329	S	S	*	.	H	α-helix	trans	-130.1	-0.8	-170.5	-58.6	-75.4	0	0	0	113.8	R390 F391 L392 E396	R390-N394 PolarHBondContact O-N 3.26Å; R390-N394 PolarHBondContact O-ND2 3.43Å; F391-N394 PolarHBondContact O-N 2.88Å; L392-N394 PolarHBondContact O-N 3.08Å; N394-E396 PolarHBondContact O-N 2.85Å
395	H	91.3	Very high	92.8	Very high	54 Å²	54	75.3 Å²	75.3	25%	0.25	35%	0.347	C	S	.	.			trans	-77.3	121.1	178.1	-175.3	-78.1	0	0	0	111.1	F391 K397 M398 F411	F391-H395 AromaticContact CE2-CD2 3.6Å; F391-H395 HydrophobicContact CZ-CB 4.5Å; F391-H395 AromaticContact CZ-CD2 3.58Å; F391-H395 WeakPolarHBondContact O-CB 3.41Å; F391-H395 PolarHBondContact O-N 3.48Å; H395-K397 VanDerWaalsContact C-N 3.28Å; H395-K397 PolarHBondContact ND1-N 2.79Å; H395-K397 VanDerWaalsContact ND1-N 3.15Å; H395-K397 PolarHBondContact O-N 3.37Å; H395-K397 VanDerWaalsContact O-N 3.08Å; H395-M398 HydrophobicContact CB-CB 4.26Å; H395-M398 WeakPolarHBondContact O-CA 3.32Å; H395-M398 VanDerWaalsContact O-CB 3.25Å; H395-M398 WeakPolarHBondContact O-CB 3.4Å; H395-M398 PolarHBondContact O-N 3.16Å; H395-F411 AromaticContact CD2-CE1 3.98Å; H395-F411 AromaticContact CE1-CE1 3.51Å; H395-F411 AromaticContact CE1-CZ 3.84Å; H395-F411 AromaticContact CG-CE1 3.97Å; H395-F411 AromaticContact CG-CZ 3.95Å; H395-F411 AromaticContact ND1-CE1 3.67Å; H395-F411 AromaticContact ND1-CZ 3.55Å; H395-F411 AromaticContact NE2-CE1 3.69Å
396	E	88.6	Confident	92.7	Very high	176 Å²	176	78.4 Å²	78.4	82%	0.822	36%	0.36	S	S	*	.	T	Hydrogen-bonded Turn	trans	-45.9	-42.4	-176.1	-177.4	-173.1	-147.1	0	0	115.1	N394 M398	N394-E396 PolarHBondContact O-N 2.85Å; E396-M398 VanDerWaalsContact C-N 3.25Å; E396-M398 PolarHBondContact O-N 2.95Å
397	K	86	Confident	92.6	Very high	138 Å²	138	74.8 Å²	74.8	60%	0.6	34%	0.343	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.3	5.8	-179.7	-50.8	178.9	-177.1	172	0	114.4	H395 M410	H395-K397 VanDerWaalsContact C-N 3.28Å; H395-K397 PolarHBondContact ND1-N 2.79Å; H395-K397 VanDerWaalsContact ND1-N 3.15Å; H395-K397 PolarHBondContact O-N 3.37Å; H395-K397 VanDerWaalsContact O-N 3.08Å; K397-M410 HydrophobicContact CB-SD 4.4Å
398	M	90.4	Very high	92.5	Very high	10 Å²	10	71.5 Å²	71.5	5%	0.049	33%	0.329	C	S	.	.			trans	-105.3	128	178.7	-166.1	65.9	176.2	0	0	109.7	L392 H395 E396 T402 A407 F411 Y429 L436	L392-M398 HydrophobicContact CB-CG 4.46Å; L392-M398 HydrophobicContact CD1-CE 4.42Å; L392-M398 HydrophobicContact CD2-CE 4.21Å; L392-M398 HydrophobicContact CD2-SD 4.28Å; L392-M398 VanDerWaalsContact O-CG 3.31Å; L392-M398 WeakPolarHBondContact O-CG 3.45Å; H395-M398 HydrophobicContact CB-CB 4.26Å; H395-M398 WeakPolarHBondContact O-CA 3.32Å; H395-M398 VanDerWaalsContact O-CB 3.25Å; H395-M398 WeakPolarHBondContact O-CB 3.4Å; H395-M398 PolarHBondContact O-N 3.16Å; E396-M398 VanDerWaalsContact C-N 3.25Å; E396-M398 PolarHBondContact O-N 2.95Å; M398-T402 HydrophobicContact SD-CG2 3.77Å; M398-A407 HydrophobicContact CE-CB 4.39Å; M398-A407 HydrophobicContact SD-CB 4.24Å; M398-F411 HydrophobicContact SD-CE2 4.08Å; M398-Y429 HydrophobicContact CE-CD2 3.71Å; M398-Y429 HydrophobicContact CE-CE2 3.8Å; M398-L436 HydrophobicContact CB-CD1 4.45Å; M398-L436 HydrophobicContact CG-CD1 3.78Å
399	T	90.9	Very high	92.3	Very high	48 Å²	48	78.6 Å²	78.6	29%	0.294	36%	0.363	S	S	.	.			trans	-143.5	164.4	-175.7	62.6	0	0	0	0	110.4	T401 T402 L433 E440	T399-T401 PolarHBondContact O-N 2.85Å; T399-T401 PolarHBondContact OG1-OG1 3.11Å; T399-T402 WeakPolarHBondContact O-CB 3.06Å; T399-T402 PolarHBondContact O-N 3.21Å; T399-T402 PolarHBondContact OG1-OG1 3.46Å; T399-L433 WeakPolarHBondContact O-CD1 3.22Å; T399-E440 WeakPolarHBondContact CA-OE1 3.1Å
400	S	92.3	Very high	92.2	Very high	29 Å²	29	78.4 Å²	78.4	20%	0.203	36%	0.363	C	S	.	.	T	Hydrogen-bonded Turn	trans	-52.7	-16.5	175.6	66.3	0	0	0	0	116.1	L433 A437 E440	S400-L433 WeakPolarHBondContact O-CD1 3.45Å; S400-L433 WeakPolarHBondContact O-CG 3.34Å; S400-A437 VanDerWaalsContact CB-CA 3.49Å; S400-E440 WeakPolarHBondContact CB-OE1 3.46Å; S400-E440 WeakPolarHBondContact CB-OE2 3.5Å; S400-E440 PolarHBondContact N-OE1 3.03Å; S400-E440 PolarHBondContact OG-OE2 2.72Å
401	T	92.8	Very high	92.1	Very high	114 Å²	114	70.5 Å²	70.5	70%	0.699	33%	0.333	S	S	*	.	T	Hydrogen-bonded Turn	trans	-107.8	-3.9	-178.9	55.8	0	0	0	0	113.8	T399 R403	T399-T401 PolarHBondContact O-N 2.85Å; T399-T401 PolarHBondContact OG1-OG1 3.11Å; T401-R403 PolarHBondContact O-N 3Å; T401-R403 VanDerWaalsContact O-N 3.13Å
402	T	93.4	Very high	91.8	Very high	8 Å²	8	72 Å²	72	5%	0.049	34%	0.343	C	S	.	.			trans	-78.8	98.9	-174.2	-70.3	0	0	0	0	111.4	M398 T399 K406 A407 M410 Y429	M398-T402 HydrophobicContact SD-CG2 3.77Å; T399-T402 WeakPolarHBondContact O-CB 3.06Å; T399-T402 PolarHBondContact O-N 3.21Å; T399-T402 PolarHBondContact OG1-OG1 3.46Å; T402-K406 HydrophobicContact CG2-CD 4.47Å; T402-A407 HydrophobicContact CG2-CB 4.42Å; T402-M410 HydrophobicContact CG2-CE 3.8Å; T402-Y429 WeakPolarHBondContact O-CE2 3.47Å; T402-Y429 PolarHBondContact O-OH 3.32Å; T402-Y429 VanDerWaalsContact O-OH 3.09Å
403	R	93.4	Very high	91.6	Very high	201 Å²	201	80.7 Å²	80.7	76%	0.758	38%	0.384	S	S	*	.			trans	-56.7	142.8	-179	-61.7	-176.7	-179.5	-175.3	-0.1	113	T401 K405 K406 A407 Y429	T401-R403 PolarHBondContact O-N 3Å; T401-R403 VanDerWaalsContact O-N 3.13Å; R403-K405 VanDerWaalsContact C-N 3.34Å; R403-K405 PolarHBondContact O-N 3.38Å; R403-K405 VanDerWaalsContact O-N 3.16Å; R403-K406 WeakPolarHBondContact O-CA 3.4Å; R403-K406 WeakPolarHBondContact O-CB 3.35Å; R403-K406 PolarHBondContact O-N 3.37Å; R403-A407 PolarHBondContact O-N 2.67Å; R403-Y429 WeakPolarHBondContact CA-OH 3.42Å
404	Y	93.4	Very high	91.4	Very high	22 Å²	22	82.7 Å²	82.7	9%	0.086	40%	0.395	C	S	.	.	H	α-helix	trans	-48	-46.1	-179.1	-177	-100.2	0	0	0	114.5	K406 A407 E408 W417 R425 L426 Y429	Y404-K406 PolarHBondContact O-N 3.46Å; Y404-A407 WeakPolarHBondContact O-CB 3.47Å; Y404-A407 PolarHBondContact O-N 2.81Å; Y404-A407 VanDerWaalsContact O-N 3.1Å; Y404-E408 WeakPolarHBondContact O-CB 3.45Å; Y404-E408 PolarHBondContact O-N 3.44Å; Y404-W417 HydrophobicContact CD2-CH2 4.14Å; Y404-W417 AromaticContact CE2-CH2 3.57Å; Y404-W417 HydrophobicContact CE2-CH2 3.57Å; Y404-W417 AromaticContact CE2-CZ2 3.94Å; Y404-W417 HydrophobicContact CE2-CZ2 3.94Å; Y404-W417 AromaticContact CZ-CH2 3.9Å; Y404-W417 AromaticContact CZ-CZ2 3.78Å; Y404-R425 HydrophobicContact CE2-CB 4.3Å; Y404-R425 PolarHBondContact OH-NH1 3.1Å; Y404-L426 HydrophobicContact CD1-CD2 3.7Å; Y404-L426 HydrophobicContact CD2-CD2 3.79Å; Y404-L426 HydrophobicContact CE1-CD2 3.66Å; Y404-L426 HydrophobicContact CE1-CG 4.29Å; Y404-L426 HydrophobicContact CE2-CD2 3.76Å; Y404-L426 HydrophobicContact CE2-CG 4.15Å; Y404-L426 HydrophobicContact CG-CD2 3.76Å; Y404-Y429 AromaticContact CD2-CD1 3.99Å; Y404-Y429 HydrophobicContact CD2-CD1 3.99Å; Y404-Y429 AromaticContact CD2-CD2 3.85Å; Y404-Y429 HydrophobicContact CD2-CD2 3.85Å; Y404-Y429 HydrophobicContact CD2-CE2 4.39Å; Y404-Y429 AromaticContact CD2-CG 3.64Å; Y404-Y429 HydrophobicContact CD2-CG 3.64Å; Y404-Y429 HydrophobicContact CE2-CG 4.49Å; Y404-Y429 HydrophobicContact CG-CD1 4.5Å; Y404-Y429 HydrophobicContact CG-CG 4.48Å; Y404-Y429 VanDerWaalsContact N-CZ 3.31Å; Y404-Y429 PolarHBondContact N-OH 3.08Å
405	K	92.7	Very high	91.3	Very high	124 Å²	124	83.3 Å²	83.3	54%	0.539	39%	0.394	S	S	.	.	H	α-helix	trans	-63.7	-26.2	177.9	-76.4	-73.8	161.4	-161.7	0	113.9	R403 E408 Q409	R403-K405 VanDerWaalsContact C-N 3.34Å; R403-K405 PolarHBondContact O-N 3.38Å; R403-K405 VanDerWaalsContact O-N 3.16Å; K405-E408 WeakPolarHBondContact CD-OE2 3.4Å; K405-E408 WeakPolarHBondContact CE-OE2 3.32Å; K405-E408 IonicContact NZ-OE1 3.65Å; K405-E408 IonicContact NZ-OE2 2.97Å; K405-E408 PolarHBondContact NZ-OE2 3.49Å; K405-Q409 VanDerWaalsContact O-CG 3.22Å; K405-Q409 WeakPolarHBondContact O-CG 3.29Å; K405-Q409 PolarHBondContact O-N 2.87Å
406	K	92.8	Very high	91.3	Very high	113 Å²	113	81.8 Å²	81.8	49%	0.491	39%	0.389	S	S	.	.	H	α-helix	trans	-78.4	-40.2	171.3	-171	-174.8	175.9	-168.9	0	111.1	T402 R403 Y404 E408 Q409 M410	T402-K406 HydrophobicContact CG2-CD 4.47Å; R403-K406 WeakPolarHBondContact O-CA 3.4Å; R403-K406 WeakPolarHBondContact O-CB 3.35Å; R403-K406 PolarHBondContact O-N 3.37Å; Y404-K406 PolarHBondContact O-N 3.46Å; K406-E408 VanDerWaalsContact C-N 3.33Å; K406-Q409 PolarHBondContact O-N 3.45Å; K406-M410 HydrophobicContact CG-CE 4.26Å; K406-M410 HydrophobicContact CG-SD 4.41Å; K406-M410 VanDerWaalsContact O-CG 3.31Å; K406-M410 WeakPolarHBondContact O-CG 3.25Å; K406-M410 PolarHBondContact O-N 2.91Å; K406-M410 VanDerWaalsContact O-N 3.13Å
407	A	92.6	Very high	91.5	Very high	0 Å²	0	73.8 Å²	73.8	0%	0	35%	0.351	C	S	.	.	H	α-helix	trans	-60	-44.3	173	0	0	0	0	0	111.2	M398 T402 R403 Y404 Q409 M410 F411 W417	M398-A407 HydrophobicContact CE-CB 4.39Å; M398-A407 HydrophobicContact SD-CB 4.24Å; T402-A407 HydrophobicContact CG2-CB 4.42Å; R403-A407 PolarHBondContact O-N 2.67Å; Y404-A407 WeakPolarHBondContact O-CB 3.47Å; Y404-A407 PolarHBondContact O-N 2.81Å; Y404-A407 VanDerWaalsContact O-N 3.1Å; A407-Q409 PolarHBondContact O-N 3.2Å; A407-M410 PolarHBondContact O-N 2.71Å; A407-F411 HydrophobicContact CB-CD2 4Å; A407-F411 HydrophobicContact CB-CE2 4.06Å; A407-F411 WeakPolarHBondContact O-CB 3.43Å; A407-F411 WeakPolarHBondContact O-CD2 3.45Å; A407-F411 WeakPolarHBondContact O-CG 3.4Å; A407-F411 PolarHBondContact O-N 2.65Å; A407-W417 HydrophobicContact CB-CH2 4.27Å; A407-W417 HydrophobicContact CB-CZ3 4.14Å
408	E	91.9	Very high	91.6	Very high	37 Å²	37	71.1 Å²	71.1	17%	0.173	35%	0.35	C	S	.	.	H	α-helix	trans	-58.1	-46.8	174.9	-175.5	170	-113.8	0	0	112.3	Y404 K405 K406 M410 F411 N412 W417 R425	Y404-E408 WeakPolarHBondContact O-CB 3.45Å; Y404-E408 PolarHBondContact O-N 3.44Å; K405-E408 WeakPolarHBondContact CD-OE2 3.4Å; K405-E408 WeakPolarHBondContact CE-OE2 3.32Å; K405-E408 IonicContact NZ-OE1 3.65Å; K405-E408 IonicContact NZ-OE2 2.97Å; K405-E408 PolarHBondContact NZ-OE2 3.49Å; K406-E408 VanDerWaalsContact C-N 3.33Å; E408-M410 PolarHBondContact O-N 3.36Å; E408-F411 PolarHBondContact O-N 2.94Å; E408-N412 WeakPolarHBondContact O-CB 3.32Å; E408-N412 VanDerWaalsContact O-CG 3.28Å; E408-N412 PolarHBondContact O-N 3.2Å; E408-N412 PolarHBondContact O-OD1 2.76Å; E408-W417 VanDerWaalsContact CA-CZ2 3.46Å; E408-W417 HydrophobicContact CB-CH2 3.89Å; E408-W417 HydrophobicContact CB-CZ2 3.52Å; E408-W417 HydrophobicContact CG-CZ2 3.75Å; E408-R425 IonicContact OE1-NH1 2.67Å
409	Q	92.6	Very high	91.7	Very high	150 Å²	150	73.5 Å²	73.5	70%	0.701	37%	0.367	S	S	*	.	H	α-helix	trans	-63.6	-20.5	175.1	-74.7	168.7	-15.7	0	0	114.5	K405 K406 A407	K405-Q409 VanDerWaalsContact O-CG 3.22Å; K405-Q409 WeakPolarHBondContact O-CG 3.29Å; K405-Q409 PolarHBondContact O-N 2.87Å; K406-Q409 PolarHBondContact O-N 3.45Å; A407-Q409 PolarHBondContact O-N 3.2Å
410	M	90.9	Very high	91.8	Very high	63 Å²	63	71.2 Å²	71.2	31%	0.31	35%	0.353	S	S	.	.	H	α-helix	trans	-96.6	-19.3	179.1	-68.4	-174.6	-52.6	0	0	113.4	K397 T402 K406 A407 E408	K397-M410 HydrophobicContact CB-SD 4.4Å; T402-M410 HydrophobicContact CG2-CE 3.8Å; K406-M410 HydrophobicContact CG-CE 4.26Å; K406-M410 HydrophobicContact CG-SD 4.41Å; K406-M410 VanDerWaalsContact O-CG 3.31Å; K406-M410 WeakPolarHBondContact O-CG 3.25Å; K406-M410 PolarHBondContact O-N 2.91Å; K406-M410 VanDerWaalsContact O-N 3.13Å; A407-M410 PolarHBondContact O-N 2.71Å; E408-M410 PolarHBondContact O-N 3.36Å
411	F	92.9	Very high	91.8	Very high	4 Å²	4	72.9 Å²	72.9	2%	0.018	36%	0.363	C	S	.	.	H	α-helix	trans	-132.1	-7.9	-165.4	-54.5	-43.1	0	0	0	115.1	F391 L392 H395 M398 A407 E408 E413 L414 W417	F391-F411 HydrophobicContact CE1-CB 4.37Å; F391-F411 AromaticContact CE1-CD1 3.76Å; F391-F411 HydrophobicContact CE1-CD1 3.76Å; F391-F411 HydrophobicContact CE1-CD2 4.12Å; F391-F411 HydrophobicContact CE1-CE1 4.02Å; F391-F411 HydrophobicContact CE1-CE2 4.35Å; F391-F411 AromaticContact CE1-CG 3.83Å; F391-F411 HydrophobicContact CE1-CG 3.83Å; F391-F411 HydrophobicContact CE1-CZ 4.31Å; F391-F411 AromaticContact CZ-CD1 3.66Å; F391-F411 HydrophobicContact CZ-CD1 3.66Å; F391-F411 AromaticContact CZ-CE1 3.83Å; F391-F411 HydrophobicContact CZ-CE1 3.83Å; F391-F411 HydrophobicContact CZ-CG 4.21Å; F391-F411 HydrophobicContact CZ-CZ 4.48Å; L392-F411 HydrophobicContact CD2-CD2 3.87Å; L392-F411 HydrophobicContact CD2-CE2 3.76Å; H395-F411 AromaticContact CD2-CE1 3.98Å; H395-F411 AromaticContact CE1-CE1 3.51Å; H395-F411 AromaticContact CE1-CZ 3.84Å; H395-F411 AromaticContact CG-CE1 3.97Å; H395-F411 AromaticContact CG-CZ 3.95Å; H395-F411 AromaticContact ND1-CE1 3.67Å; H395-F411 AromaticContact ND1-CZ 3.55Å; H395-F411 AromaticContact NE2-CE1 3.69Å; M398-F411 HydrophobicContact SD-CE2 4.08Å; A407-F411 HydrophobicContact CB-CD2 4Å; A407-F411 HydrophobicContact CB-CE2 4.06Å; A407-F411 WeakPolarHBondContact O-CB 3.43Å; A407-F411 WeakPolarHBondContact O-CD2 3.45Å; A407-F411 WeakPolarHBondContact O-CG 3.4Å; A407-F411 PolarHBondContact O-N 2.65Å; E408-F411 PolarHBondContact O-N 2.94Å; F411-E413 VanDerWaalsContact C-N 3.26Å; F411-E413 PolarHBondContact O-N 3.1Å; F411-L414 HydrophobicContact CB-CD1 4.22Å; F411-L414 HydrophobicContact CD1-CD1 3.94Å; F411-L414 HydrophobicContact CG-CD1 4.5Å; F411-L414 WeakPolarHBondContact O-CB 3.33Å; F411-L414 PolarHBondContact O-N 3.36Å; F411-W417 HydrophobicContact CB-CB 4.48Å; F411-W417 HydrophobicContact CB-CD2 4.07Å; F411-W417 HydrophobicContact CB-CE3 3.51Å; F411-W417 HydrophobicContact CB-CG 4.48Å; F411-W417 HydrophobicContact CB-CZ3 4.18Å; F411-W417 HydrophobicContact CD2-CE3 4.14Å; F411-W417 HydrophobicContact CD2-CZ3 4.07Å; F411-W417 HydrophobicContact CG-CE3 4.33Å; F411-W417 WeakPolarHBondContact O-CB 3.24Å
412	N	88.8	Confident	91.8	Very high	82 Å²	82	71.9 Å²	71.9	44%	0.439	35%	0.35	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.3	-35	-178.2	59.3	-18.9	0	0	0	115	E408 L414	E408-N412 WeakPolarHBondContact O-CB 3.32Å; E408-N412 VanDerWaalsContact O-CG 3.28Å; E408-N412 PolarHBondContact O-N 3.2Å; E408-N412 PolarHBondContact O-OD1 2.76Å; N412-L414 VanDerWaalsContact C-N 3.26Å; N412-L414 PolarHBondContact O-N 2.93Å
413	E	89.9	Confident	91.8	Very high	182 Å²	182	80.5 Å²	80.5	85%	0.85	38%	0.382	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.7	-12.6	178.4	-67.5	178.2	-178.3	0	0	113.6	F411	F411-E413 VanDerWaalsContact C-N 3.26Å; F411-E413 PolarHBondContact O-N 3.1Å
414	L	90.7	Very high	91.9	Very high	72 Å²	72	71.7 Å²	71.7	38%	0.377	35%	0.35	S	S	.	.	S	Bend	trans	-83.7	133.7	-177.1	-57.1	176.9	0	0	0	111.6	F391 F411 N412 V416 W417 S418	F391-L414 HydrophobicContact CE1-CD1 4.13Å; F391-L414 HydrophobicContact CE2-CD1 3.99Å; F391-L414 HydrophobicContact CZ-CD1 3.41Å; F391-L414 VanDerWaalsContact CZ-CD1 3.41Å; F411-L414 HydrophobicContact CB-CD1 4.22Å; F411-L414 HydrophobicContact CD1-CD1 3.94Å; F411-L414 HydrophobicContact CG-CD1 4.5Å; F411-L414 WeakPolarHBondContact O-CB 3.33Å; F411-L414 PolarHBondContact O-N 3.36Å; N412-L414 VanDerWaalsContact C-N 3.26Å; N412-L414 PolarHBondContact O-N 2.93Å; L414-V416 PolarHBondContact O-N 3.24Å; L414-V416 VanDerWaalsContact O-N 3.08Å; L414-W417 WeakPolarHBondContact O-CB 3.34Å; L414-W417 PolarHBondContact O-N 2.94Å; L414-S418 PolarHBondContact O-N 3.35Å; L414-S418 VanDerWaalsContact O-N 3.14Å
415	E	89.6	Confident	91.9	Very high	122 Å²	122	72.1 Å²	72.1	57%	0.57	35%	0.351	S	S	*	.	H	α-helix	trans	-48.7	-38.9	173.3	-173.8	-157.3	-139.5	0	0	112.2	K387 W417 S418 C419	K387-E415 IonicContact NZ-OE2 3.24Å; K387-E415 PolarHBondContact NZ-OE2 2.82Å; K387-E415 VanDerWaalsContact NZ-OE2 3.15Å; E415-W417 VanDerWaalsContact C-N 3.26Å; E415-W417 PolarHBondContact O-N 3.29Å; E415-S418 WeakPolarHBondContact CA-OG 3.49Å; E415-S418 PolarHBondContact O-N 3.33Å; E415-S418 PolarHBondContact O-OG 3.16Å; E415-C419 WeakPolarHBondContact O-CB 3.23Å; E415-C419 PolarHBondContact O-N 2.7Å; E415-C419 PolarHBondContact O-SG 3.02Å; E415-C419 VanDerWaalsContact O-SG 3.33Å
416	V	90.8	Very high	92	Very high	22 Å²	22	69.4 Å²	69.4	13%	0.133	34%	0.342	C	S	.	.	H	α-helix	trans	-62.3	-32	179.8	176.1	0	0	0	0	112.5	K387 F388 F391 L414	K387-V416 HydrophobicContact CD-CG2 3.96Å; K387-V416 HydrophobicContact CG-CG1 4.38Å; K387-V416 HydrophobicContact CG-CG2 4.19Å; F388-V416 HydrophobicContact CB-CG1 4.19Å; F388-V416 HydrophobicContact CD2-CG1 4.15Å; F388-V416 VanDerWaalsContact CD2-O 3.26Å; F388-V416 WeakPolarHBondContact CD2-O 3.17Å; F391-V416 HydrophobicContact CB-CG1 3.85Å; F391-V416 HydrophobicContact CD1-CG1 4.27Å; F391-V416 HydrophobicContact CG-CG1 4.02Å; L414-V416 PolarHBondContact O-N 3.24Å; L414-V416 VanDerWaalsContact O-N 3.08Å
417	W	92.3	Very high	92.1	Very high	9 Å²	9	69 Å²	69	3%	0.034	34%	0.342	C	S	.	.	H	α-helix	trans	-80.8	-40.8	175	-175.8	-81.1	0	0	0	111.8	F388 Y404 A407 E408 F411 L414 E415 V420 R425	F388-W417 HydrophobicContact CE2-CB 4.26Å; F388-W417 AromaticContact CE2-CD2 3.97Å; F388-W417 HydrophobicContact CE2-CD2 3.97Å; F388-W417 AromaticContact CE2-CE3 3.45Å; F388-W417 HydrophobicContact CE2-CE3 3.45Å; F388-W417 VanDerWaalsContact CE2-CE3 3.45Å; F388-W417 HydrophobicContact CE2-CG 4.33Å; F388-W417 HydrophobicContact CE2-CZ3 4.05Å; F388-W417 HydrophobicContact CZ-CD2 4.39Å; F388-W417 AromaticContact CZ-CE3 3.77Å; F388-W417 HydrophobicContact CZ-CE3 3.77Å; F388-W417 AromaticContact CZ-CZ3 3.88Å; F388-W417 HydrophobicContact CZ-CZ3 3.88Å; Y404-W417 HydrophobicContact CD2-CH2 4.14Å; Y404-W417 AromaticContact CE2-CH2 3.57Å; Y404-W417 HydrophobicContact CE2-CH2 3.57Å; Y404-W417 AromaticContact CE2-CZ2 3.94Å; Y404-W417 HydrophobicContact CE2-CZ2 3.94Å; Y404-W417 AromaticContact CZ-CH2 3.9Å; Y404-W417 AromaticContact CZ-CZ2 3.78Å; A407-W417 HydrophobicContact CB-CH2 4.27Å; A407-W417 HydrophobicContact CB-CZ3 4.14Å; E408-W417 VanDerWaalsContact CA-CZ2 3.46Å; E408-W417 HydrophobicContact CB-CH2 3.89Å; E408-W417 HydrophobicContact CB-CZ2 3.52Å; E408-W417 HydrophobicContact CG-CZ2 3.75Å; F411-W417 HydrophobicContact CB-CB 4.48Å; F411-W417 HydrophobicContact CB-CD2 4.07Å; F411-W417 HydrophobicContact CB-CE3 3.51Å; F411-W417 HydrophobicContact CB-CG 4.48Å; F411-W417 HydrophobicContact CB-CZ3 4.18Å; F411-W417 HydrophobicContact CD2-CE3 4.14Å; F411-W417 HydrophobicContact CD2-CZ3 4.07Å; F411-W417 HydrophobicContact CG-CE3 4.33Å; F411-W417 WeakPolarHBondContact O-CB 3.24Å; L414-W417 WeakPolarHBondContact O-CB 3.34Å; L414-W417 PolarHBondContact O-N 2.94Å; E415-W417 VanDerWaalsContact C-N 3.26Å; E415-W417 PolarHBondContact O-N 3.29Å; W417-V420 PolarHBondContact O-N 2.93Å; W417-R425 VanDerWaalsContact NE1-NH1 3.18Å; W417-R425 VanDerWaalsContact O-CD 3.3Å; W417-R425 WeakPolarHBondContact O-CD 3.33Å; W417-R425 PolarHBondContact O-NE 3.08Å
418	S	89.4	Confident	92.3	Very high	81 Å²	81	69.6 Å²	69.6	57%	0.566	35%	0.345	S	S	*	.	H	α-helix	trans	-76.6	-26.5	-176.6	63.4	0	0	0	0	114.3	L414 E415 V420	L414-S418 PolarHBondContact O-N 3.35Å; L414-S418 VanDerWaalsContact O-N 3.14Å; E415-S418 WeakPolarHBondContact CA-OG 3.49Å; E415-S418 PolarHBondContact O-N 3.33Å; E415-S418 PolarHBondContact O-OG 3.16Å; S418-V420 PolarHBondContact O-N 3.26Å
419	C	91.3	Very high	92.4	Very high	60 Å²	60	68.9 Å²	68.9	41%	0.405	34%	0.341	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.7	-12.9	173.5	-77.4	0	0	0	0	114.8	E415	E415-C419 WeakPolarHBondContact O-CB 3.23Å; E415-C419 PolarHBondContact O-N 2.7Å; E415-C419 PolarHBondContact O-SG 3.02Å; E415-C419 VanDerWaalsContact O-SG 3.33Å
420	V	93.5	Very high	92.5	Very high	1 Å²	1	68.2 Å²	68.2	1%	0.006	34%	0.338	C	S	.	.	S	Bend	trans	-114	125.7	-176.6	-177.4	0	0	0	0	110.2	K385 F388 W417 S418 D424 R425 I428	K385-V420 HydrophobicContact CG-CG1 4.47Å; F388-V420 HydrophobicContact CB-CG2 3.77Å; F388-V420 HydrophobicContact CG-CG2 4.13Å; W417-V420 PolarHBondContact O-N 2.93Å; S418-V420 PolarHBondContact O-N 3.26Å; V420-D424 HydrophobicContact CG1-CB 3.57Å; V420-R425 HydrophobicContact CB-CG 3.86Å; V420-R425 HydrophobicContact CG1-CG 3.75Å; V420-R425 PolarHBondContact O-NE 2.82Å; V420-I428 HydrophobicContact CG1-CD1 4.36Å
421	P	92.7	Very high	92.7	Very high	63 Å²	63	70.6 Å²	70.6	41%	0.409	35%	0.352	S	S	.	.			trans	-58.5	149.4	175.6	-24.5	33.7	0	0	0	112.9	Y381 R423 D424 R425	Y381-P421 HydrophobicContact CE2-CG 4.14Å; P421-R423 VanDerWaalsContact C-N 3.34Å; P421-R423 PolarHBondContact O-N 2.86Å; P421-D424 WeakPolarHBondContact CB-OD2 3.16Å; P421-D424 WeakPolarHBondContact CD-OD2 3.4Å; P421-D424 VanDerWaalsContact CG-OD2 3.31Å; P421-D424 WeakPolarHBondContact CG-OD2 3.28Å; P421-D424 WeakPolarHBondContact O-CA 3.42Å; P421-D424 WeakPolarHBondContact O-CB 3.33Å; P421-D424 PolarHBondContact O-N 3.26Å; P421-R425 PolarHBondContact O-N 3.34Å
422	E	92	Very high	92.8	Very high	94 Å²	94	70.4 Å²	70.4	44%	0.439	35%	0.351	S	S	.	.	H	α-helix	trans	-60.1	-37.5	-170.9	-172.7	171.6	-175.1	0	0	114.4	D424 R425 L426	E422-D424 VanDerWaalsContact C-N 3.31Å; E422-D424 PolarHBondContact O-N 2.87Å; E422-R425 PolarHBondContact O-N 2.73Å; E422-L426 HydrophobicContact CG-CD1 4.36Å; E422-L426 WeakPolarHBondContact O-CG 3.4Å; E422-L426 PolarHBondContact O-N 2.94Å
423	R	93.5	Very high	93.1	Very high	189 Å²	189	68.4 Å²	68.4	71%	0.713	34%	0.34	S	S	*	.	H	α-helix	trans	-56.6	-47.7	172.8	-177.7	-169.6	-61.9	142.9	2.1	111.2	P421 R425 L426 E427	P421-R423 VanDerWaalsContact C-N 3.34Å; P421-R423 PolarHBondContact O-N 2.86Å; R423-R425 VanDerWaalsContact C-N 3.34Å; R423-L426 PolarHBondContact O-N 3.06Å; R423-E427 WeakPolarHBondContact CG-OE1 3.35Å; R423-E427 WeakPolarHBondContact O-CG 3.47Å; R423-E427 PolarHBondContact O-N 3.49Å; R423-E427 VanDerWaalsContact O-N 3.07Å
424	D	95	Very high	93.3	Very high	15 Å²	15	66.6 Å²	66.6	8%	0.08	33%	0.33	C	S	.	.	H	α-helix	trans	-69.5	-34.4	-178.7	-57.8	-52.1	0	0	0	111.3	Y381 K385 V420 P421 E422 I428	Y381-D424 PolarHBondContact OH-OD1 3.25Å; Y381-D424 PolarHBondContact OH-OD2 3.27Å; K385-D424 WeakPolarHBondContact CE-OD1 3.36Å; K385-D424 IonicContact NZ-OD1 2.91Å; K385-D424 PolarHBondContact NZ-OD1 3.17Å; K385-D424 IonicContact NZ-OD2 3.48Å; V420-D424 HydrophobicContact CG1-CB 3.57Å; P421-D424 WeakPolarHBondContact CB-OD2 3.16Å; P421-D424 WeakPolarHBondContact CD-OD2 3.4Å; P421-D424 VanDerWaalsContact CG-OD2 3.31Å; P421-D424 WeakPolarHBondContact CG-OD2 3.28Å; P421-D424 WeakPolarHBondContact O-CA 3.42Å; P421-D424 WeakPolarHBondContact O-CB 3.33Å; P421-D424 PolarHBondContact O-N 3.26Å; E422-D424 VanDerWaalsContact C-N 3.31Å; E422-D424 PolarHBondContact O-N 2.87Å; D424-I428 WeakPolarHBondContact O-CB 3.47Å; D424-I428 WeakPolarHBondContact O-CD1 3.48Å; D424-I428 WeakPolarHBondContact O-CG1 3.4Å; D424-I428 PolarHBondContact O-N 2.75Å
425	R	94.7	Very high	93.5	Very high	32 Å²	32	68.2 Å²	68.2	12%	0.121	33%	0.331	C	S	.	.	H	α-helix	trans	-62.8	-41.3	172.8	-75.3	-169.9	-98.9	121.4	-6.7	112.2	F388 Y404 E408 W417 V420 P421 E422 R423 Y429	F388-R425 HydrophobicContact CD1-CG 4.47Å; F388-R425 HydrophobicContact CE1-CB 3.98Å; F388-R425 HydrophobicContact CE1-CG 3.83Å; F388-R425 HydrophobicContact CE2-CG 4.09Å; F388-R425 HydrophobicContact CZ-CB 3.92Å; F388-R425 HydrophobicContact CZ-CG 3.6Å; Y404-R425 HydrophobicContact CE2-CB 4.3Å; Y404-R425 PolarHBondContact OH-NH1 3.1Å; E408-R425 IonicContact OE1-NH1 2.67Å; W417-R425 VanDerWaalsContact NE1-NH1 3.18Å; W417-R425 VanDerWaalsContact O-CD 3.3Å; W417-R425 WeakPolarHBondContact O-CD 3.33Å; W417-R425 PolarHBondContact O-NE 3.08Å; V420-R425 HydrophobicContact CB-CG 3.86Å; V420-R425 HydrophobicContact CG1-CG 3.75Å; V420-R425 PolarHBondContact O-NE 2.82Å; P421-R425 PolarHBondContact O-N 3.34Å; E422-R425 PolarHBondContact O-N 2.73Å; R423-R425 VanDerWaalsContact C-N 3.34Å; R425-Y429 WeakPolarHBondContact O-CB 3.46Å; R425-Y429 PolarHBondContact O-N 2.87Å
426	L	94.2	Very high	93.8	Very high	67 Å²	67	62.8 Å²	62.8	35%	0.351	31%	0.306	S	S	.	.	H	α-helix	trans	-65.7	-49.1	176.7	-73.9	164	0	0	0	111.5	Y404 E422 R423 I428 Y429 E430	Y404-L426 HydrophobicContact CD1-CD2 3.7Å; Y404-L426 HydrophobicContact CD2-CD2 3.79Å; Y404-L426 HydrophobicContact CE1-CD2 3.66Å; Y404-L426 HydrophobicContact CE1-CG 4.29Å; Y404-L426 HydrophobicContact CE2-CD2 3.76Å; Y404-L426 HydrophobicContact CE2-CG 4.15Å; Y404-L426 HydrophobicContact CG-CD2 3.76Å; E422-L426 HydrophobicContact CG-CD1 4.36Å; E422-L426 WeakPolarHBondContact O-CG 3.4Å; E422-L426 PolarHBondContact O-N 2.94Å; R423-L426 PolarHBondContact O-N 3.06Å; L426-I428 PolarHBondContact O-N 3.1Å; L426-Y429 PolarHBondContact O-N 3.45Å; L426-E430 PolarHBondContact O-N 2.95Å
427	E	95.3	Very high	94	Very high	103 Å²	103	63.7 Å²	63.7	48%	0.481	32%	0.316	S	S	.	.	H	α-helix	trans	-55.8	-49.9	176.4	-71.7	171.8	-163.5	0	0	111.5	R423 E430 D431	R423-E427 WeakPolarHBondContact CG-OE1 3.35Å; R423-E427 WeakPolarHBondContact O-CG 3.47Å; R423-E427 PolarHBondContact O-N 3.49Å; R423-E427 VanDerWaalsContact O-N 3.07Å; E427-E430 PolarHBondContact O-N 3.31Å; E427-D431 PolarHBondContact O-N 2.72Å
428	I	95.4	Very high	94.1	Very high	14 Å²	14	69.8 Å²	69.8	7%	0.072	34%	0.343	C	S	.	.	H	α-helix	trans	-67	-38.3	178.8	-64.7	163.6	0	0	0	111.5	K385 F388 Q389 V420 D424 L426 E430 D431 V432	K385-I428 HydrophobicContact CB-CD1 3.8Å; K385-I428 HydrophobicContact CD-CD1 4.1Å; K385-I428 HydrophobicContact CG-CD1 3.85Å; F388-I428 HydrophobicContact CD1-CB 4.02Å; F388-I428 HydrophobicContact CD1-CD1 3.92Å; F388-I428 HydrophobicContact CD1-CG2 3.71Å; F388-I428 HydrophobicContact CE1-CB 4.12Å; F388-I428 HydrophobicContact CE1-CG2 4.04Å; Q389-I428 HydrophobicContact CB-CG2 3.66Å; Q389-I428 HydrophobicContact CG-CG2 4.05Å; V420-I428 HydrophobicContact CG1-CD1 4.36Å; D424-I428 WeakPolarHBondContact O-CB 3.47Å; D424-I428 WeakPolarHBondContact O-CD1 3.48Å; D424-I428 WeakPolarHBondContact O-CG1 3.4Å; D424-I428 PolarHBondContact O-N 2.75Å; L426-I428 PolarHBondContact O-N 3.1Å; I428-E430 VanDerWaalsContact C-N 3.34Å; I428-E430 PolarHBondContact O-N 2.88Å; I428-D431 PolarHBondContact O-N 3.26Å; I428-V432 HydrophobicContact CG2-CG2 4.07Å; I428-V432 WeakPolarHBondContact O-CB 3.49Å; I428-V432 VanDerWaalsContact O-CG2 3.26Å; I428-V432 WeakPolarHBondContact O-CG2 3.47Å; I428-V432 PolarHBondContact O-N 3.46Å
429	Y	94.9	Very high	94.3	Very high	22 Å²	22	69.2 Å²	69.2	9%	0.086	33%	0.33	C	S	.	.	H	α-helix	trans	-60.8	-41.7	177.3	160.3	-86.3	0	0	0	111.9	M398 T402 R403 Y404 R425 L426 V432 L433	M398-Y429 HydrophobicContact CE-CD2 3.71Å; M398-Y429 HydrophobicContact CE-CE2 3.8Å; T402-Y429 WeakPolarHBondContact O-CE2 3.47Å; T402-Y429 PolarHBondContact O-OH 3.32Å; T402-Y429 VanDerWaalsContact O-OH 3.09Å; R403-Y429 WeakPolarHBondContact CA-OH 3.42Å; Y404-Y429 AromaticContact CD2-CD1 3.99Å; Y404-Y429 HydrophobicContact CD2-CD1 3.99Å; Y404-Y429 AromaticContact CD2-CD2 3.85Å; Y404-Y429 HydrophobicContact CD2-CD2 3.85Å; Y404-Y429 HydrophobicContact CD2-CE2 4.39Å; Y404-Y429 AromaticContact CD2-CG 3.64Å; Y404-Y429 HydrophobicContact CD2-CG 3.64Å; Y404-Y429 HydrophobicContact CE2-CG 4.49Å; Y404-Y429 HydrophobicContact CG-CD1 4.5Å; Y404-Y429 HydrophobicContact CG-CG 4.48Å; Y404-Y429 VanDerWaalsContact N-CZ 3.31Å; Y404-Y429 PolarHBondContact N-OH 3.08Å; R425-Y429 WeakPolarHBondContact O-CB 3.46Å; R425-Y429 PolarHBondContact O-N 2.87Å; L426-Y429 PolarHBondContact O-N 3.45Å; Y429-V432 PolarHBondContact O-N 3.38Å; Y429-L433 HydrophobicContact CE1-CD2 4.31Å; Y429-L433 HydrophobicContact CE2-CD1 4.27Å; Y429-L433 VanDerWaalsContact O-CB 3.3Å; Y429-L433 WeakPolarHBondContact O-CB 3.47Å; Y429-L433 PolarHBondContact O-N 3.31Å
430	E	94.9	Very high	94.4	Very high	135 Å²	135	69.5 Å²	69.5	63%	0.631	33%	0.326	S	S	*	.	H	α-helix	trans	-66.5	-44.8	179	-71.1	-174.8	177.7	0	0	111.8	L426 E427 I428 V432 L433 F434	L426-E430 PolarHBondContact O-N 2.95Å; E427-E430 PolarHBondContact O-N 3.31Å; I428-E430 VanDerWaalsContact C-N 3.34Å; I428-E430 PolarHBondContact O-N 2.88Å; E430-V432 PolarHBondContact O-N 2.97Å; E430-L433 PolarHBondContact O-N 2.93Å; E430-F434 PolarHBondContact O-N 3.43Å
431	D	95.2	Very high	94.5	Very high	113 Å²	113	76.3 Å²	76.3	60%	0.604	36%	0.355	S	S	*	.	H	α-helix	trans	-60.3	-43.5	174.5	-88.1	-20.1	0	0	0	111.8	E427 I428 F434 Y435	E427-D431 PolarHBondContact O-N 2.72Å; I428-D431 PolarHBondContact O-N 3.26Å; D431-F434 PolarHBondContact O-N 3.07Å; D431-Y435 WeakPolarHBondContact O-CB 3.4Å; D431-Y435 PolarHBondContact O-N 3.11Å
432	V	95.6	Very high	94.6	Very high	0 Å²	0	77 Å²	77	0%	0	35%	0.353	C	S	.	.	H	α-helix	trans	-69.2	-39.1	178.1	173.7	0	0	0	0	111.9	Q389 L392 E393 I428 Y429 E430 F434 Y435 L436	Q389-V432 HydrophobicContact CG-CG2 3.73Å; L392-V432 HydrophobicContact CB-CB 4.37Å; L392-V432 HydrophobicContact CB-CG1 3.75Å; L392-V432 HydrophobicContact CB-CG2 4.36Å; E393-V432 HydrophobicContact CG-CB 4.42Å; E393-V432 HydrophobicContact CG-CG1 3.87Å; E393-V432 HydrophobicContact CG-CG2 3.77Å; I428-V432 HydrophobicContact CG2-CG2 4.07Å; I428-V432 WeakPolarHBondContact O-CB 3.49Å; I428-V432 VanDerWaalsContact O-CG2 3.26Å; I428-V432 WeakPolarHBondContact O-CG2 3.47Å; I428-V432 PolarHBondContact O-N 3.46Å; Y429-V432 PolarHBondContact O-N 3.38Å; E430-V432 PolarHBondContact O-N 2.97Å; V432-F434 VanDerWaalsContact C-N 3.3Å; V432-F434 PolarHBondContact O-N 3.36Å; V432-Y435 PolarHBondContact O-N 3.03Å; V432-L436 HydrophobicContact CG1-CD1 3.9Å; V432-L436 HydrophobicContact CG1-CG 4.09Å; V432-L436 WeakPolarHBondContact O-CB 3.49Å; V432-L436 WeakPolarHBondContact O-CG 3.34Å; V432-L436 PolarHBondContact O-N 3.01Å
433	L	94.4	Very high	94.6	Very high	41 Å²	41	77.5 Å²	77.5	22%	0.215	36%	0.355	C	S	.	.	H	α-helix	trans	-62.6	-40.3	177.1	-160.2	78.9	0	0	0	111	T399 S400 Y429 E430 A437	T399-L433 WeakPolarHBondContact O-CD1 3.22Å; S400-L433 WeakPolarHBondContact O-CD1 3.45Å; S400-L433 WeakPolarHBondContact O-CG 3.34Å; Y429-L433 HydrophobicContact CE1-CD2 4.31Å; Y429-L433 HydrophobicContact CE2-CD1 4.27Å; Y429-L433 VanDerWaalsContact O-CB 3.3Å; Y429-L433 WeakPolarHBondContact O-CB 3.47Å; Y429-L433 PolarHBondContact O-N 3.31Å; E430-L433 PolarHBondContact O-N 2.93Å; L433-A437 WeakPolarHBondContact O-CB 3.42Å; L433-A437 PolarHBondContact O-N 3.37Å
434	F	94.8	Very high	94.6	Very high	144 Å²	144	71.5 Å²	71.5	63%	0.632	35%	0.346	S	S	*	.	H	α-helix	trans	-65.9	-41.9	172.7	177.1	-100	0	0	0	112.4	E430 D431 V432 A437 K438	E430-F434 PolarHBondContact O-N 3.43Å; D431-F434 PolarHBondContact O-N 3.07Å; V432-F434 VanDerWaalsContact C-N 3.3Å; V432-F434 PolarHBondContact O-N 3.36Å; F434-A437 PolarHBondContact O-N 3.41Å; F434-K438 WeakPolarHBondContact O-CB 3.2Å; F434-K438 PolarHBondContact O-N 2.76Å
435	Y	94.6	Very high	94.7	Very high	105 Å²	105	75.9 Å²	75.9	41%	0.412	36%	0.364	S	S	.	.	H	α-helix	trans	-62.3	-45.4	175.5	174.3	-102.5	0	0	0	112.1	E393 D431 V432 K438 K439	E393-Y435 HydrophobicContact CB-CD1 4.35Å; E393-Y435 HydrophobicContact CB-CE1 4.22Å; E393-Y435 HydrophobicContact CG-CD1 3.83Å; E393-Y435 HydrophobicContact CG-CE1 4.06Å; D431-Y435 WeakPolarHBondContact O-CB 3.4Å; D431-Y435 PolarHBondContact O-N 3.11Å; V432-Y435 PolarHBondContact O-N 3.03Å; Y435-K438 PolarHBondContact O-N 3.14Å; Y435-K439 HydrophobicContact CE1-CD 4.01Å; Y435-K439 VanDerWaalsContact O-CB 3.27Å; Y435-K439 WeakPolarHBondContact O-CB 3.37Å; Y435-K439 PolarHBondContact O-N 3Å
436	L	94.6	Very high	94.7	Very high	8 Å²	8	80 Å²	80	4%	0.042	39%	0.385	C	S	.	.	H	α-helix	trans	-62.5	-48.1	175.7	-70.9	175.2	0	0	0	111.2	M398 V432 K438 K439 E440	M398-L436 HydrophobicContact CB-CD1 4.45Å; M398-L436 HydrophobicContact CG-CD1 3.78Å; V432-L436 HydrophobicContact CG1-CD1 3.9Å; V432-L436 HydrophobicContact CG1-CG 4.09Å; V432-L436 WeakPolarHBondContact O-CB 3.49Å; V432-L436 WeakPolarHBondContact O-CG 3.34Å; V432-L436 PolarHBondContact O-N 3.01Å; L436-K438 PolarHBondContact O-N 3.31Å; L436-K439 HydrophobicContact CD2-CD 4.44Å; L436-K439 PolarHBondContact O-N 3.24Å; L436-K439 VanDerWaalsContact O-N 3.09Å; L436-E440 WeakPolarHBondContact O-CB 3.31Å; L436-E440 VanDerWaalsContact O-CG 3.29Å; L436-E440 WeakPolarHBondContact O-CG 3.25Å; L436-E440 PolarHBondContact O-N 3.06Å
437	A	94.8	Very high	94.7	Very high	41 Å²	41	79.9 Å²	79.9	34%	0.339	38%	0.384	S	S	.	.	H	α-helix	trans	-56.4	-38	175.3	0	0	0	0	0	112.7	S400 L433 F434 K441	S400-A437 VanDerWaalsContact CB-CA 3.49Å; L433-A437 WeakPolarHBondContact O-CB 3.42Å; L433-A437 PolarHBondContact O-N 3.37Å; F434-A437 PolarHBondContact O-N 3.41Å; A437-K441 WeakPolarHBondContact O-CB 3.37Å; A437-K441 PolarHBondContact O-N 3.04Å; A437-K441 VanDerWaalsContact O-N 3.16Å
438	K	95.6	Very high	94.7	Very high	137 Å²	137	82 Å²	82	60%	0.596	39%	0.388	S	S	*	.	H	α-helix	trans	-71.8	-41.9	175.8	-174.3	-176.8	176.3	-172.1	0	112.3	F434 Y435 L436 E442	F434-K438 WeakPolarHBondContact O-CB 3.2Å; F434-K438 PolarHBondContact O-N 2.76Å; Y435-K438 PolarHBondContact O-N 3.14Å; L436-K438 PolarHBondContact O-N 3.31Å; K438-E442 WeakPolarHBondContact O-CB 3.47Å; K438-E442 PolarHBondContact O-N 2.88Å
439	K	93.2	Very high	94.8	Very high	70 Å²	70	87 Å²	87	30%	0.304	41%	0.409	S	S	.	.	H	α-helix	trans	-64.7	-52.9	179.1	-179.9	-176	172.3	-173.5	0	110.9	E393 Y435 L436 K441 E442 Q443	E393-K439 PolarHBondContact O-NZ 3.24Å; Y435-K439 HydrophobicContact CE1-CD 4.01Å; Y435-K439 VanDerWaalsContact O-CB 3.27Å; Y435-K439 WeakPolarHBondContact O-CB 3.37Å; Y435-K439 PolarHBondContact O-N 3Å; L436-K439 HydrophobicContact CD2-CD 4.44Å; L436-K439 PolarHBondContact O-N 3.24Å; L436-K439 VanDerWaalsContact O-N 3.09Å; K439-K441 PolarHBondContact O-N 2.84Å; K439-E442 PolarHBondContact O-N 3.27Å; K439-E442 VanDerWaalsContact O-N 3.14Å; K439-Q443 WeakPolarHBondContact O-CG 3.38Å; K439-Q443 PolarHBondContact O-N 3.46Å
440	E	93.9	Very high	94.8	Very high	65 Å²	65	90 Å²	90	30%	0.304	42%	0.42	S	S	.	.	H	α-helix	trans	-56.9	-47.2	175.8	-68.5	167.2	-154.1	0	0	111.3	T399 S400 L436 E442 Q443 A444	T399-E440 WeakPolarHBondContact CA-OE1 3.1Å; S400-E440 WeakPolarHBondContact CB-OE1 3.46Å; S400-E440 WeakPolarHBondContact CB-OE2 3.5Å; S400-E440 PolarHBondContact N-OE1 3.03Å; S400-E440 PolarHBondContact OG-OE2 2.72Å; L436-E440 WeakPolarHBondContact O-CB 3.31Å; L436-E440 VanDerWaalsContact O-CG 3.29Å; L436-E440 WeakPolarHBondContact O-CG 3.25Å; L436-E440 PolarHBondContact O-N 3.06Å; E440-E442 VanDerWaalsContact C-N 3.31Å; E440-E442 PolarHBondContact O-N 3.1Å; E440-Q443 PolarHBondContact O-N 3.42Å; E440-A444 WeakPolarHBondContact O-CB 3.33Å; E440-A444 PolarHBondContact O-N 3.08Å
441	K	94.5	Very high	94.9	Very high	145 Å²	145	83.8 Å²	83.8	63%	0.63	39%	0.391	S	S	*	.	H	α-helix	trans	-63.3	-34.2	177.1	-177.4	167.5	-176.6	168.4	0	113	A437 K439 K445	A437-K441 WeakPolarHBondContact O-CB 3.37Å; A437-K441 PolarHBondContact O-N 3.04Å; A437-K441 VanDerWaalsContact O-N 3.16Å; K439-K441 PolarHBondContact O-N 2.84Å; K441-K445 WeakPolarHBondContact O-CG 3.44Å; K441-K445 PolarHBondContact O-N 3.49Å
442	E	95.4	Very high	94.9	Very high	78 Å²	78	81.1 Å²	81.1	36%	0.364	37%	0.373	S	S	.	.	H	α-helix	trans	-76.2	-38.9	177.5	-161.9	61.6	-148.7	0	0	111.7	K438 K439 E440 A444 K445 Q446	K438-E442 WeakPolarHBondContact O-CB 3.47Å; K438-E442 PolarHBondContact O-N 2.88Å; K439-E442 PolarHBondContact O-N 3.27Å; K439-E442 VanDerWaalsContact O-N 3.14Å; E440-E442 VanDerWaalsContact C-N 3.31Å; E440-E442 PolarHBondContact O-N 3.1Å; E442-A444 VanDerWaalsContact C-N 3.34Å; E442-A444 PolarHBondContact O-N 3.04Å; E442-K445 WeakPolarHBondContact O-CB 3.49Å; E442-K445 PolarHBondContact O-N 2.56Å; E442-K445 IonicContact OE1-NZ 3.29Å; E442-K445 WeakPolarHBondContact OE2-CE 3.29Å; E442-K445 IonicContact OE2-NZ 3.44Å; E442-K445 PolarHBondContact OE2-NZ 3.33Å; E442-Q446 VanDerWaalsContact O-CG 3.32Å; E442-Q446 WeakPolarHBondContact O-CG 3.31Å; E442-Q446 PolarHBondContact O-N 3.19Å
443	Q	93.2	Very high	94.9	Very high	104 Å²	104	86.1 Å²	86.1	49%	0.486	40%	0.396	S	S	.	.	H	α-helix	trans	-60.4	-43	171.8	-71.1	176.3	-78	0	0	111.3	K439 E440 K445 Q446 L447	K439-Q443 WeakPolarHBondContact O-CG 3.38Å; K439-Q443 PolarHBondContact O-N 3.46Å; E440-Q443 PolarHBondContact O-N 3.42Å; Q443-K445 VanDerWaalsContact C-N 3.34Å; Q443-K445 PolarHBondContact O-N 2.99Å; Q443-Q446 PolarHBondContact O-N 2.86Å; Q443-Q446 VanDerWaalsContact O-N 3.13Å; Q443-L447 PolarHBondContact O-N 3Å
444	A	93.2	Very high	95	Very high	62 Å²	62	85.4 Å²	85.4	51%	0.512	40%	0.396	S	S	.	.	H	α-helix	trans	-60.9	-38.6	175.6	0	0	0	0	0	113	E440 E442 R448	E440-A444 WeakPolarHBondContact O-CB 3.33Å; E440-A444 PolarHBondContact O-N 3.08Å; E442-A444 VanDerWaalsContact C-N 3.34Å; E442-A444 PolarHBondContact O-N 3.04Å; A444-R448 WeakPolarHBondContact O-CB 3.36Å; A444-R448 PolarHBondContact O-N 2.83Å
445	K	95.5	Very high	95.1	Very high	107 Å²	107	78.6 Å²	78.6	47%	0.465	37%	0.366	S	S	.	.	H	α-helix	trans	-65.8	-42.4	171.5	-67.9	179.2	-157.2	162.2	0	112.3	K441 E442 Q443 L447 R448 K449	K441-K445 WeakPolarHBondContact O-CG 3.44Å; K441-K445 PolarHBondContact O-N 3.49Å; E442-K445 WeakPolarHBondContact O-CB 3.49Å; E442-K445 PolarHBondContact O-N 2.56Å; E442-K445 IonicContact OE1-NZ 3.29Å; E442-K445 WeakPolarHBondContact OE2-CE 3.29Å; E442-K445 IonicContact OE2-NZ 3.44Å; E442-K445 PolarHBondContact OE2-NZ 3.33Å; Q443-K445 VanDerWaalsContact C-N 3.34Å; Q443-K445 PolarHBondContact O-N 2.99Å; K445-L447 VanDerWaalsContact C-N 3.33Å; K445-R448 PolarHBondContact O-N 3.5Å; K445-K449 WeakPolarHBondContact O-CB 3.36Å; K445-K449 PolarHBondContact O-N 3.24Å
446	Q	96	Very high	95.1	Very high	120 Å²	120	76.5 Å²	76.5	56%	0.561	36%	0.36	S	S	*	.	H	α-helix	trans	-64.8	-39.9	-178.8	-73	171.8	10.2	0	0	110.9	E442 Q443 K449 R450	E442-Q446 VanDerWaalsContact O-CG 3.32Å; E442-Q446 WeakPolarHBondContact O-CG 3.31Å; E442-Q446 PolarHBondContact O-N 3.19Å; Q443-Q446 PolarHBondContact O-N 2.86Å; Q443-Q446 VanDerWaalsContact O-N 3.13Å; Q446-K449 PolarHBondContact O-N 3.45Å; Q446-R450 WeakPolarHBondContact O-CB 3.45Å; Q446-R450 PolarHBondContact O-N 3.08Å
447	L	94.6	Very high	95.2	Very high	64 Å²	64	80.8 Å²	80.8	34%	0.335	38%	0.382	S	S	.	.	H	α-helix	trans	-65.6	-50	172.8	-178.6	57.8	0	0	0	111.8	Q443 K445 K449 R450 N451 E489	Q443-L447 PolarHBondContact O-N 3Å; K445-L447 VanDerWaalsContact C-N 3.33Å; L447-K449 PolarHBondContact O-N 3.41Å; L447-R450 WeakPolarHBondContact O-CB 3.47Å; L447-R450 PolarHBondContact O-N 3.25Å; L447-R450 VanDerWaalsContact O-N 3.09Å; L447-N451 WeakPolarHBondContact CD1-OD1 3.44Å; L447-N451 WeakPolarHBondContact O-CB 3.5Å; L447-N451 VanDerWaalsContact O-CG 3.3Å; L447-N451 PolarHBondContact O-N 3.16Å; L447-N451 PolarHBondContact O-OD1 2.8Å; L447-E489 HydrophobicContact CD1-CB 4.15Å; L447-E489 HydrophobicContact CD1-CG 4.07Å; L447-E489 WeakPolarHBondContact CD1-OE2 3.45Å
448	R	94.9	Very high	95.2	Very high	148 Å²	148	79.4 Å²	79.4	56%	0.558	37%	0.369	S	S	*	.	H	α-helix	trans	-53.1	-42.4	174.2	-172.8	-178.9	-177.4	-167.5	1	111.7	A444 K445 W452 D497	A444-R448 WeakPolarHBondContact O-CB 3.36Å; A444-R448 PolarHBondContact O-N 2.83Å; K445-R448 PolarHBondContact O-N 3.5Å; R448-W452 WeakPolarHBondContact O-CB 3.38Å; R448-W452 PolarHBondContact O-N 2.63Å; R448-D497 WeakPolarHBondContact CD-OD2 3.25Å; R448-D497 VanDerWaalsContact CG-OD2 3.32Å; R448-D497 WeakPolarHBondContact CG-OD2 3.24Å; R448-D497 IonicContact CZ-OD1 3.15Å; R448-D497 IonicContact CZ-OD2 3.46Å; R448-D497 VanDerWaalsContact NE-CG 3.34Å; R448-D497 IonicContact NE-OD1 2.66Å; R448-D497 PolarHBondContact NE-OD1 3.24Å; R448-D497 IonicContact NE-OD2 3.92Å; R448-D497 PolarHBondContact NE-OD2 2.93Å; R448-D497 IonicContact NH2-OD1 2.59Å; R448-D497 PolarHBondContact NH2-OD1 3.45Å; R448-D497 IonicContact NH2-OD2 3.93Å
449	K	96.4	Very high	95.2	Very high	117 Å²	117	72.9 Å²	72.9	51%	0.509	34%	0.341	S	S	.	.	H	α-helix	trans	-66.9	-46.6	175.9	-170	-176.8	-176	-113	0	112.4	K445 Q446 L447 N451 W452 E453	K445-K449 WeakPolarHBondContact O-CB 3.36Å; K445-K449 PolarHBondContact O-N 3.24Å; Q446-K449 PolarHBondContact O-N 3.45Å; L447-K449 PolarHBondContact O-N 3.41Å; K449-N451 VanDerWaalsContact C-N 3.28Å; K449-N451 PolarHBondContact O-N 2.97Å; K449-W452 PolarHBondContact O-N 2.87Å; K449-E453 VanDerWaalsContact CE-CD 3.45Å; K449-E453 WeakPolarHBondContact CE-OE1 3.16Å; K449-E453 WeakPolarHBondContact CE-OE2 3.34Å; K449-E453 HydrophobicContact CG-CG 4.38Å; K449-E453 IonicContact NZ-OE1 3.25Å; K449-E453 PolarHBondContact NZ-OE1 2.67Å; K449-E453 IonicContact NZ-OE2 2.92Å; K449-E453 PolarHBondContact NZ-OE2 2.94Å; K449-E453 WeakPolarHBondContact O-CB 3.21Å; K449-E453 WeakPolarHBondContact O-CG 3.42Å; K449-E453 PolarHBondContact O-N 3.41Å
450	R	96	Very high	95.3	Very high	85 Å²	85	73.9 Å²	73.9	32%	0.321	35%	0.35	S	S	.	.	H	α-helix	trans	-54.1	-48.9	175.9	-173.8	-169.9	80.8	72.2	-16.5	110.2	Q446 L447 E453 A454 D487 E489	Q446-R450 WeakPolarHBondContact O-CB 3.45Å; Q446-R450 PolarHBondContact O-N 3.08Å; L447-R450 WeakPolarHBondContact O-CB 3.47Å; L447-R450 PolarHBondContact O-N 3.25Å; L447-R450 VanDerWaalsContact O-N 3.09Å; R450-E453 PolarHBondContact O-N 3.12Å; R450-A454 VanDerWaalsContact O-CB 3.25Å; R450-A454 WeakPolarHBondContact O-CB 3.28Å; R450-A454 PolarHBondContact O-N 3.49Å; R450-D487 IonicContact CZ-OD1 3.02Å; R450-D487 IonicContact CZ-OD2 2.67Å; R450-D487 IonicContact NH1-OD1 2.68Å; R450-D487 IonicContact NH1-OD2 3.12Å; R450-D487 PolarHBondContact NH1-OD2 3.27Å; R450-D487 IonicContact NH2-OD1 2.91Å; R450-D487 PolarHBondContact NH2-OD1 2.87Å; R450-D487 IonicContact NH2-OD2 2.76Å; R450-D487 PolarHBondContact NH2-OD2 3.44Å; R450-E489 IonicContact CZ-OE2 3.45Å; R450-E489 IonicContact NE-OE2 3.34Å; R450-E489 PolarHBondContact NE-OE2 3.28Å; R450-E489 VanDerWaalsContact NE-OE2 3.09Å; R450-E489 IonicContact NH2-OE2 3.89Å; R450-E489 PolarHBondContact NH2-OE2 2.89Å
451	N	96.1	Very high	95.3	Very high	6 Å²	6	76.5 Å²	76.5	3%	0.032	37%	0.365	C	S	.	.	H	α-helix	trans	-66.8	-39.8	-176.5	-67.8	10.3	0	0	0	111.6	L447 K449 A454 L455 E489 L490 M493	L447-N451 WeakPolarHBondContact CD1-OD1 3.44Å; L447-N451 WeakPolarHBondContact O-CB 3.5Å; L447-N451 VanDerWaalsContact O-CG 3.3Å; L447-N451 PolarHBondContact O-N 3.16Å; L447-N451 PolarHBondContact O-OD1 2.8Å; K449-N451 VanDerWaalsContact C-N 3.28Å; K449-N451 PolarHBondContact O-N 2.97Å; N451-A454 PolarHBondContact O-N 2.87Å; N451-L455 WeakPolarHBondContact O-CB 3.4Å; N451-L455 PolarHBondContact O-N 3.29Å; N451-E489 PolarHBondContact ND2-O 2.98Å; N451-L490 HydrophobicContact CB-CD1 3.74Å; N451-L490 VanDerWaalsContact O-CD1 3.23Å; N451-L490 WeakPolarHBondContact O-CD1 3.37Å; N451-M493 HydrophobicContact CB-CB 4.14Å; N451-M493 HydrophobicContact CB-CE 4.16Å
452	W	95.7	Very high	95.2	Very high	57 Å²	57	70.4 Å²	70.4	22%	0.216	34%	0.339	C	S	.	.	H	α-helix	trans	-61.6	-50	172.8	-170.6	-74.8	0	0	0	112.5	R448 K449 A454 L455 K456 D497 I500 C501	R448-W452 WeakPolarHBondContact O-CB 3.38Å; R448-W452 PolarHBondContact O-N 2.63Å; K449-W452 PolarHBondContact O-N 2.87Å; W452-A454 VanDerWaalsContact C-N 3.3Å; W452-A454 PolarHBondContact O-N 3.23Å; W452-L455 PolarHBondContact O-N 3.11Å; W452-K456 VanDerWaalsContact O-CB 3.24Å; W452-K456 WeakPolarHBondContact O-CB 3.22Å; W452-K456 PolarHBondContact O-N 3.44Å; W452-D497 HydrophobicContact CE3-CB 4.06Å; W452-D497 HydrophobicContact CZ3-CB 4.04Å; W452-D497 WeakPolarHBondContact CZ3-O 3.4Å; W452-I500 HydrophobicContact CH2-CB 3.82Å; W452-I500 HydrophobicContact CH2-CG2 3.74Å; W452-I500 HydrophobicContact CZ3-CB 4.27Å; W452-C501 HydrophobicContact CD2-CB 4.04Å; W452-C501 HydrophobicContact CE3-CB 4.12Å; W452-C501 HydrophobicContact CH2-CB 4.06Å; W452-C501 HydrophobicContact CZ2-CB 3.96Å; W452-C501 HydrophobicContact CZ3-CB 4.13Å
453	E	96.1	Very high	94.9	Very high	105 Å²	105	71.7 Å²	71.7	49%	0.491	36%	0.363	S	S	.	.	H	α-helix	trans	-65.1	-34.6	179.7	-70.8	179.9	146	0	0	111.6	K449 R450 N457	K449-E453 VanDerWaalsContact CE-CD 3.45Å; K449-E453 WeakPolarHBondContact CE-OE1 3.16Å; K449-E453 WeakPolarHBondContact CE-OE2 3.34Å; K449-E453 HydrophobicContact CG-CG 4.38Å; K449-E453 IonicContact NZ-OE1 3.25Å; K449-E453 PolarHBondContact NZ-OE1 2.67Å; K449-E453 IonicContact NZ-OE2 2.92Å; K449-E453 PolarHBondContact NZ-OE2 2.94Å; K449-E453 WeakPolarHBondContact O-CB 3.21Å; K449-E453 WeakPolarHBondContact O-CG 3.42Å; K449-E453 PolarHBondContact O-N 3.41Å; R450-E453 PolarHBondContact O-N 3.12Å; E453-N457 VanDerWaalsContact O-CB 3.29Å; E453-N457 WeakPolarHBondContact O-CB 3.41Å; E453-N457 PolarHBondContact O-N 3.25Å; E453-N457 VanDerWaalsContact O-N 3.08Å
454	A	96.2	Very high	94.7	Very high	26 Å²	26	70.2 Å²	70.2	22%	0.215	36%	0.359	C	S	.	.	H	α-helix	trans	-68.3	-54.1	173.7	0	0	0	0	0	112.4	R450 N451 W452 K456 N457 I458 L490	R450-A454 VanDerWaalsContact O-CB 3.25Å; R450-A454 WeakPolarHBondContact O-CB 3.28Å; R450-A454 PolarHBondContact O-N 3.49Å; N451-A454 PolarHBondContact O-N 2.87Å; W452-A454 VanDerWaalsContact C-N 3.3Å; W452-A454 PolarHBondContact O-N 3.23Å; A454-K456 VanDerWaalsContact C-N 3.3Å; A454-K456 PolarHBondContact O-N 3.47Å; A454-N457 PolarHBondContact O-N 2.97Å; A454-N457 VanDerWaalsContact O-N 3.16Å; A454-I458 WeakPolarHBondContact O-CG1 3.47Å; A454-I458 PolarHBondContact O-N 3.33Å; A454-L490 HydrophobicContact CB-CD1 4.23Å; A454-L490 HydrophobicContact CB-CD2 4.19Å
455	L	96.1	Very high	94.7	Very high	0 Å²	0	67.8 Å²	67.8	0%	0	34%	0.338	C	S	.	.	H	α-helix	trans	-57.5	-44.4	178.5	177.6	60.7	0	0	0	111.4	N451 W452 I458 L459 L478 F484 L490 M493 A498 C501	N451-L455 WeakPolarHBondContact O-CB 3.4Å; N451-L455 PolarHBondContact O-N 3.29Å; W452-L455 PolarHBondContact O-N 3.11Å; L455-I458 PolarHBondContact O-N 3.39Å; L455-L459 HydrophobicContact CD1-CD1 4.34Å; L455-L459 HydrophobicContact CD1-CG 4.37Å; L455-L459 HydrophobicContact CG-CD1 4.09Å; L455-L459 WeakPolarHBondContact O-CG 3.5Å; L455-L459 PolarHBondContact O-N 2.78Å; L455-L478 HydrophobicContact CD1-CD1 3.72Å; L455-L478 HydrophobicContact CD1-CD2 3.57Å; L455-L478 HydrophobicContact CD1-CG 4.32Å; L455-F484 HydrophobicContact CD1-CD2 4.39Å; L455-F484 HydrophobicContact CD1-CE2 4.3Å; L455-L490 HydrophobicContact CB-CD1 4.23Å; L455-M493 HydrophobicContact CB-CE 4.38Å; L455-M493 HydrophobicContact CB-SD 4.37Å; L455-M493 HydrophobicContact CD2-CE 3.86Å; L455-M493 HydrophobicContact CD2-SD 3.82Å; L455-A498 HydrophobicContact CD2-CB 3.87Å; L455-C501 HydrophobicContact CD2-CB 3.96Å
456	K	95.7	Very high	94.7	Very high	62 Å²	62	65.7 Å²	65.7	27%	0.27	33%	0.334	S	S	.	.	H	α-helix	trans	-59.6	-47.5	176.3	-177.1	165.3	-176.4	170.5	0	111.7	W452 A454 I458 L459 D460 E504	W452-K456 VanDerWaalsContact O-CB 3.24Å; W452-K456 WeakPolarHBondContact O-CB 3.22Å; W452-K456 PolarHBondContact O-N 3.44Å; A454-K456 VanDerWaalsContact C-N 3.3Å; A454-K456 PolarHBondContact O-N 3.47Å; K456-I458 VanDerWaalsContact C-N 3.28Å; K456-I458 PolarHBondContact O-N 2.82Å; K456-L459 PolarHBondContact O-N 3.4Å; K456-D460 WeakPolarHBondContact CG-OD2 3.34Å; K456-D460 WeakPolarHBondContact O-CB 3.5Å; K456-D460 PolarHBondContact O-N 2.9Å; K456-E504 IonicContact NZ-OE1 3.77Å; K456-E504 PolarHBondContact NZ-OE1 3.23Å
457	N	95.8	Very high	94.6	Very high	97 Å²	97	62.8 Å²	62.8	52%	0.519	32%	0.318	S	S	.	.	H	α-helix	trans	-63.4	-32.6	177.1	-177.7	60.2	0	0	0	112.6	E453 A454 N461	E453-N457 VanDerWaalsContact O-CB 3.29Å; E453-N457 WeakPolarHBondContact O-CB 3.41Å; E453-N457 PolarHBondContact O-N 3.25Å; E453-N457 VanDerWaalsContact O-N 3.08Å; A454-N457 PolarHBondContact O-N 2.97Å; A454-N457 VanDerWaalsContact O-N 3.16Å; N457-N461 PolarHBondContact O-N 3.49Å; N457-N461 PolarHBondContact O-ND2 3.2Å; N457-N461 PolarHBondContact OD1-ND2 2.87Å; N457-N461 VanDerWaalsContact OD1-ND2 3.16Å
458	I	95.6	Very high	94.6	Very high	12 Å²	12	68.3 Å²	68.3	6%	0.062	34%	0.335	C	S	.	.	H	α-helix	trans	-68.2	-46.6	174.4	-65.3	169.5	0	0	0	110.3	A454 L455 K456 N461 M462 L478 T483 F484 L490	A454-I458 WeakPolarHBondContact O-CG1 3.47Å; A454-I458 PolarHBondContact O-N 3.33Å; L455-I458 PolarHBondContact O-N 3.39Å; K456-I458 VanDerWaalsContact C-N 3.28Å; K456-I458 PolarHBondContact O-N 2.82Å; I458-N461 PolarHBondContact O-N 3.39Å; I458-M462 HydrophobicContact CG2-CE 4.05Å; I458-M462 HydrophobicContact CG2-SD 4.27Å; I458-M462 WeakPolarHBondContact O-CG 3.36Å; I458-M462 PolarHBondContact O-N 3Å; I458-L478 HydrophobicContact CG2-CD2 3.73Å; I458-T483 WeakPolarHBondContact CD1-OG1 3.46Å; I458-T483 WeakPolarHBondContact CG1-OG1 3.22Å; I458-F484 HydrophobicContact CD1-CB 4.14Å; I458-L490 HydrophobicContact CD1-CD2 3.8Å
459	L	95.6	Very high	94.7	Very high	1 Å²	1	61.9 Å²	61.9	1%	0.005	31%	0.312	C	S	.	.	H	α-helix	trans	-59.2	-48.5	174.4	-69.2	166.8	0	0	0	112	L455 K456 N461 M462 V465 F502 H505	L455-L459 HydrophobicContact CD1-CD1 4.34Å; L455-L459 HydrophobicContact CD1-CG 4.37Å; L455-L459 HydrophobicContact CG-CD1 4.09Å; L455-L459 WeakPolarHBondContact O-CG 3.5Å; L455-L459 PolarHBondContact O-N 2.78Å; K456-L459 PolarHBondContact O-N 3.4Å; L459-N461 PolarHBondContact O-N 3.13Å; L459-N461 VanDerWaalsContact O-N 3.14Å; L459-M462 HydrophobicContact CD2-CE 3.83Å; L459-M462 HydrophobicContact CG-CE 4.5Å; L459-M462 PolarHBondContact O-N 3.2Å; L459-V465 HydrophobicContact CD2-CG2 4.35Å; L459-F502 HydrophobicContact CD1-CB 4.45Å; L459-F502 HydrophobicContact CD1-CD2 4.43Å; L459-F502 HydrophobicContact CD2-CD2 4.01Å; L459-H505 VanDerWaalsContact C-CE1 3.43Å; L459-H505 HydrophobicContact CD1-CB 4.19Å; L459-H505 PolarHBondContact O-CE1 3.49Å
460	D	94.1	Very high	94.7	Very high	91 Å²	91	59.3 Å²	59.3	49%	0.487	31%	0.306	S	S	.	.	H	α-helix	trans	-62.1	-20.5	-179	-69.2	-11.5	0	0	0	113.3	K456 H505	K456-D460 WeakPolarHBondContact CG-OD2 3.34Å; K456-D460 WeakPolarHBondContact O-CB 3.5Å; K456-D460 PolarHBondContact O-N 2.9Å; D460-H505 IonicContact OD1-CE1 3.74Å; D460-H505 PolarHBondContact OD1-CE1 3.17Å; D460-H505 IonicContact OD1-CG 2.71Å; D460-H505 IonicContact OD1-ND1 2.62Å; D460-H505 PolarHBondContact OD1-ND1 2.93Å
461	N	94	Very high	94.7	Very high	119 Å²	119	58.6 Å²	58.6	64%	0.636	30%	0.304	S	S	*	.	H	α-helix	trans	-100.4	-6.2	175.3	-74.4	-81.4	0	0	0	114.2	N457 I458 L459 A463	N457-N461 PolarHBondContact O-N 3.49Å; N457-N461 PolarHBondContact O-ND2 3.2Å; N457-N461 PolarHBondContact OD1-ND2 2.87Å; N457-N461 VanDerWaalsContact OD1-ND2 3.16Å; I458-N461 PolarHBondContact O-N 3.39Å; L459-N461 PolarHBondContact O-N 3.13Å; L459-N461 VanDerWaalsContact O-N 3.14Å; N461-A463 PolarHBondContact O-N 3.33Å
462	M	92.2	Very high	94.6	Very high	17 Å²	17	62.4 Å²	62.4	8%	0.084	33%	0.331	C	S	.	.			trans	-87.7	94.8	-178.1	-83.8	-167.5	-54.2	0	0	112.1	I458 L459 N464 V465 L478 N481	I458-M462 HydrophobicContact CG2-CE 4.05Å; I458-M462 HydrophobicContact CG2-SD 4.27Å; I458-M462 WeakPolarHBondContact O-CG 3.36Å; I458-M462 PolarHBondContact O-N 3Å; L459-M462 HydrophobicContact CD2-CE 3.83Å; L459-M462 HydrophobicContact CG-CE 4.5Å; L459-M462 PolarHBondContact O-N 3.2Å; M462-N464 WeakPolarHBondContact CB-OD1 3.39Å; M462-N464 PolarHBondContact O-N 3.2Å; M462-V465 HydrophobicContact CB-CB 4.46Å; M462-V465 HydrophobicContact CB-CG2 3.91Å; M462-V465 HydrophobicContact CE-CG2 3.92Å; M462-V465 PolarHBondContact O-N 2.95Å; M462-L478 HydrophobicContact CE-CD2 3.72Å; M462-L478 HydrophobicContact CE-CG 4.1Å; M462-N481 HydrophobicContact SD-CB 4.46Å
463	A	89.3	Confident	94.6	Very high	105 Å²	105	63.8 Å²	63.8	87%	0.868	34%	0.339	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.9	-7.7	-179.2	0	0	0	0	0	115.8	N461	N461-A463 PolarHBondContact O-N 3.33Å
464	N	90.3	Very high	94.6	Very high	73 Å²	73	58.8 Å²	58.8	39%	0.39	32%	0.316	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.8	-14.8	171.1	53.8	-33.7	0	0	0	113.4	M462 Y477	M462-N464 WeakPolarHBondContact CB-OD1 3.39Å; M462-N464 PolarHBondContact O-N 3.2Å; N464-Y477 HydrophobicContact CB-CD2 4.37Å; N464-Y477 HydrophobicContact CB-CE2 4.1Å; N464-Y477 VanDerWaalsContact ND2-CD1 3.34Å; N464-Y477 WeakPolarHBondContact ND2-CD1 3.49Å; N464-Y477 WeakPolarHBondContact ND2-CD2 3.49Å
465	V	93.6	Very high	94.5	Very high	12 Å²	12	61.9 Å²	61.9	7%	0.073	33%	0.326	C	S	.	.			trans	-79.7	132.5	167.2	-178.6	0	0	0	0	108.7	L459 M462 T469 Y477 F502 H505 I506 L509	L459-V465 HydrophobicContact CD2-CG2 4.35Å; M462-V465 HydrophobicContact CB-CB 4.46Å; M462-V465 HydrophobicContact CB-CG2 3.91Å; M462-V465 HydrophobicContact CE-CG2 3.92Å; M462-V465 PolarHBondContact O-N 2.95Å; V465-T469 HydrophobicContact CG1-CG2 4.47Å; V465-Y477 HydrophobicContact CG2-CD2 4.1Å; V465-F502 HydrophobicContact CG1-CE2 4.49Å; V465-H505 VanDerWaalsContact CG1-NE2 3.34Å; V465-H505 WeakPolarHBondContact CG1-NE2 3.26Å; V465-I506 HydrophobicContact CG1-CD1 4.01Å; V465-L509 HydrophobicContact CG1-CD1 4.25Å
466	T	94.2	Very high	94.4	Very high	62 Å²	62	66.5 Å²	66.5	38%	0.38	35%	0.348	S	S	.	.			trans	-134.6	166.1	-180	70.4	0	0	0	0	109	R468 T469 I506	T466-R468 PolarHBondContact O-N 3.16Å; T466-R468 PolarHBondContact OG1-N 3.49Å; T466-T469 PolarHBondContact N-OG1 3.42Å; T466-T469 WeakPolarHBondContact O-CB 3.4Å; T466-T469 PolarHBondContact O-N 2.77Å; T466-T469 PolarHBondContact O-OG1 3.14Å; T466-T469 PolarHBondContact OG1-OG1 3.22Å; T466-T469 VanDerWaalsContact OG1-OG1 3.07Å; T466-I506 WeakPolarHBondContact O-CD1 3.39Å
467	Y	93.4	Very high	94.4	Very high	59 Å²	59	66.9 Å²	66.9	23%	0.231	35%	0.348	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59	-6	174	74.8	-90.8	0	0	0	115	E510 E513	Y467-E510 HydrophobicContact CD2-CG 4.4Å; Y467-E513 HydrophobicContact CD1-CB 4.2Å; Y467-E513 HydrophobicContact CD1-CG 4.34Å; Y467-E513 HydrophobicContact CE1-CB 4.25Å; Y467-E513 HydrophobicContact CE1-CG 3.88Å; Y467-E513 WeakPolarHBondContact CE1-OE1 3.23Å; Y467-E513 VanDerWaalsContact OH-CD 3.25Å; Y467-E513 PolarHBondContact OH-OE1 3.09Å
468	R	94.9	Very high	94.3	Very high	180 Å²	180	62.3 Å²	62.3	68%	0.679	32%	0.323	S	S	*	.	T	Hydrogen-bonded Turn	trans	-106.5	-9.6	175.8	-59.7	-171.4	175.6	-77.7	-10.8	114	T466	T466-R468 PolarHBondContact O-N 3.16Å; T466-R468 PolarHBondContact OG1-N 3.49Å
469	T	96.6	Very high	94.2	Very high	14 Å²	14	66.2 Å²	66.2	9%	0.086	34%	0.344	C	S	.	.			trans	-66.9	134.4	-174.5	-60	0	0	0	0	110	V465 T466 E473 A474 Y477 F502	V465-T469 HydrophobicContact CG1-CG2 4.47Å; T466-T469 PolarHBondContact N-OG1 3.42Å; T466-T469 WeakPolarHBondContact O-CB 3.4Å; T466-T469 PolarHBondContact O-N 2.77Å; T466-T469 PolarHBondContact O-OG1 3.14Å; T466-T469 PolarHBondContact OG1-OG1 3.22Å; T466-T469 VanDerWaalsContact OG1-OG1 3.07Å; T469-E473 HydrophobicContact CG2-CB 3.84Å; T469-A474 HydrophobicContact CG2-CB 4.18Å; T469-Y477 HydrophobicContact CG2-CD2 4.48Å; T469-Y477 HydrophobicContact CG2-CE2 4.08Å; T469-F502 WeakPolarHBondContact O-CZ 3.36Å
470	T	96.6	Very high	94	Very high	63 Å²	63	71.1 Å²	71.1	39%	0.387	37%	0.37	S	S	.	.			trans	-84.1	159.6	176.7	63.7	0	0	0	0	111.4	S472 E473 A474	T470-S472 PolarHBondContact O-N 3.18Å; T470-S472 PolarHBondContact OG1-OG 2.81Å; T470-E473 VanDerWaalsContact CB-OE2 3.31Å; T470-E473 WeakPolarHBondContact CB-OE2 3.44Å; T470-E473 WeakPolarHBondContact CG2-OE2 3.17Å; T470-E473 PolarHBondContact N-OE2 2.87Å; T470-E473 PolarHBondContact O-N 3.45Å; T470-E473 VanDerWaalsContact O-N 3.16Å; T470-E473 VanDerWaalsContact OG1-CD 3.28Å; T470-E473 WeakPolarHBondContact OG1-CG 3.48Å; T470-E473 PolarHBondContact OG1-N 2.79Å; T470-E473 PolarHBondContact OG1-OE2 3.28Å; T470-A474 WeakPolarHBondContact O-CB 3.3Å; T470-A474 PolarHBondContact O-N 3.44Å
471	W	96.4	Very high	94	Very high	70 Å²	70	68.3 Å²	68.3	27%	0.265	36%	0.355	S	S	.	.	H	α-helix	trans	-57.3	-37.2	173.8	172.5	-105.1	0	0	0	112.2	E473 A474 Q475 L478 A498 L499 F502	W471-E473 PolarHBondContact O-N 3.41Å; W471-A474 PolarHBondContact O-N 2.87Å; W471-Q475 HydrophobicContact CZ2-CB 4.27Å; W471-Q475 HydrophobicContact CZ2-CG 4.39Å; W471-Q475 WeakPolarHBondContact O-CB 3.22Å; W471-Q475 PolarHBondContact O-N 2.85Å; W471-L478 HydrophobicContact CH2-CD1 4.28Å; W471-L478 HydrophobicContact CZ3-CD1 4.31Å; W471-A498 HydrophobicContact CH2-CB 3.83Å; W471-A498 HydrophobicContact CZ2-CB 4.44Å; W471-L499 HydrophobicContact CB-CD2 4.19Å; W471-L499 HydrophobicContact CD2-CD2 3.56Å; W471-L499 HydrophobicContact CD2-CG 4.47Å; W471-L499 HydrophobicContact CE3-CD2 4.16Å; W471-L499 HydrophobicContact CG-CD2 3.53Å; W471-F502 HydrophobicContact CB-CD1 4.14Å; W471-F502 HydrophobicContact CB-CE1 3.9Å; W471-F502 HydrophobicContact CE3-CB 3.7Å; W471-F502 AromaticContact CE3-CD1 3.69Å; W471-F502 HydrophobicContact CE3-CD1 3.69Å; W471-F502 HydrophobicContact CE3-CD2 4.17Å; W471-F502 HydrophobicContact CE3-CE1 4.33Å; W471-F502 AromaticContact CE3-CG 3.58Å; W471-F502 HydrophobicContact CE3-CG 3.58Å; W471-F502 HydrophobicContact CZ3-CB 3.73Å; W471-F502 HydrophobicContact CZ3-CD2 4.49Å; W471-F502 HydrophobicContact CZ3-CG 4.03Å
472	S	95.3	Very high	93.9	Very high	86 Å²	86	66.1 Å²	66.1	60%	0.601	35%	0.348	S	S	*	.	H	α-helix	trans	-61.3	-40.4	176.4	29	0	0	0	0	113.6	T470 Q476	T470-S472 PolarHBondContact O-N 3.18Å; T470-S472 PolarHBondContact OG1-OG 2.81Å; S472-Q476 PolarHBondContact O-N 2.88Å
473	E	95.6	Very high	93.9	Very high	85 Å²	85	69.1 Å²	69.1	40%	0.397	37%	0.367	S	S	.	.	H	α-helix	trans	-73	-44.1	176.7	-68.4	159.1	132.5	0	0	110.7	T469 T470 W471 Q475 Q476 Y477	T469-E473 HydrophobicContact CG2-CB 3.84Å; T470-E473 VanDerWaalsContact CB-OE2 3.31Å; T470-E473 WeakPolarHBondContact CB-OE2 3.44Å; T470-E473 WeakPolarHBondContact CG2-OE2 3.17Å; T470-E473 PolarHBondContact N-OE2 2.87Å; T470-E473 PolarHBondContact O-N 3.45Å; T470-E473 VanDerWaalsContact O-N 3.16Å; T470-E473 VanDerWaalsContact OG1-CD 3.28Å; T470-E473 WeakPolarHBondContact OG1-CG 3.48Å; T470-E473 PolarHBondContact OG1-N 2.79Å; T470-E473 PolarHBondContact OG1-OE2 3.28Å; W471-E473 PolarHBondContact O-N 3.41Å; E473-Q475 VanDerWaalsContact C-N 3.34Å; E473-Q475 PolarHBondContact O-N 3.21Å; E473-Q476 PolarHBondContact O-N 3.29Å; E473-Y477 HydrophobicContact CB-CE2 4.32Å; E473-Y477 WeakPolarHBondContact O-CD1 3.43Å; E473-Y477 WeakPolarHBondContact O-CD2 3.17Å; E473-Y477 PolarHBondContact O-N 3.33Å
474	A	95.6	Very high	94.2	Very high	0 Å²	0	65.5 Å²	65.5	0%	0	33%	0.332	C	S	.	.	H	α-helix	trans	-63	-37.8	177	0	0	0	0	0	112.6	T469 T470 W471 Q476 Y477 L478 F502	T469-A474 HydrophobicContact CG2-CB 4.18Å; T470-A474 WeakPolarHBondContact O-CB 3.3Å; T470-A474 PolarHBondContact O-N 3.44Å; W471-A474 PolarHBondContact O-N 2.87Å; A474-Q476 VanDerWaalsContact C-N 3.34Å; A474-Q476 PolarHBondContact O-N 2.88Å; A474-Y477 PolarHBondContact O-N 2.9Å; A474-L478 WeakPolarHBondContact O-CB 3.46Å; A474-L478 VanDerWaalsContact O-CG 3.25Å; A474-L478 WeakPolarHBondContact O-CG 3.47Å; A474-L478 PolarHBondContact O-N 3.12Å; A474-F502 HydrophobicContact CB-CD2 3.82Å; A474-F502 HydrophobicContact CB-CE2 3.23Å; A474-F502 HydrophobicContact CB-CZ 3.74Å
475	Q	94.1	Very high	94.3	Very high	92 Å²	92	64.5 Å²	64.5	43%	0.43	33%	0.334	S	S	.	.	H	α-helix	trans	-64.1	-38.4	175.4	-175.1	178.8	-19.7	0	0	111.5	W471 E473 L478 L479	W471-Q475 HydrophobicContact CZ2-CB 4.27Å; W471-Q475 HydrophobicContact CZ2-CG 4.39Å; W471-Q475 WeakPolarHBondContact O-CB 3.22Å; W471-Q475 PolarHBondContact O-N 2.85Å; E473-Q475 VanDerWaalsContact C-N 3.34Å; E473-Q475 PolarHBondContact O-N 3.21Å; Q475-L478 PolarHBondContact O-N 3.45Å; Q475-L479 HydrophobicContact CG-CD1 4.47Å; Q475-L479 WeakPolarHBondContact O-CG 3.4Å; Q475-L479 PolarHBondContact O-N 2.9Å
476	Q	94.4	Very high	94.3	Very high	97 Å²	97	71.8 Å²	71.8	45%	0.453	37%	0.367	S	S	.	.	H	α-helix	trans	-64.5	-46.7	171.7	-174.5	60.4	54.4	0	0	110.8	S472 E473 A474 L478 L479 D480	S472-Q476 PolarHBondContact O-N 2.88Å; E473-Q476 PolarHBondContact O-N 3.29Å; A474-Q476 VanDerWaalsContact C-N 3.34Å; A474-Q476 PolarHBondContact O-N 2.88Å; Q476-L478 VanDerWaalsContact C-N 3.25Å; Q476-L478 PolarHBondContact O-N 2.95Å; Q476-L479 PolarHBondContact O-N 3.3Å; Q476-L479 VanDerWaalsContact O-N 3.1Å; Q476-D480 PolarHBondContact NE2-OD1 2.88Å; Q476-D480 PolarHBondContact NE2-OD2 2.96Å; Q476-D480 WeakPolarHBondContact O-CB 3.46Å; Q476-D480 PolarHBondContact O-N 3.47Å
477	Y	94.8	Very high	94.3	Very high	69 Å²	69	70.6 Å²	70.6	27%	0.271	36%	0.358	S	S	.	.	H	α-helix	trans	-61.9	-31	178.1	-57.6	-22.4	0	0	0	113.5	N464 V465 T469 E473 A474 N481	N464-Y477 HydrophobicContact CB-CD2 4.37Å; N464-Y477 HydrophobicContact CB-CE2 4.1Å; N464-Y477 VanDerWaalsContact ND2-CD1 3.34Å; N464-Y477 WeakPolarHBondContact ND2-CD1 3.49Å; N464-Y477 WeakPolarHBondContact ND2-CD2 3.49Å; V465-Y477 HydrophobicContact CG2-CD2 4.1Å; T469-Y477 HydrophobicContact CG2-CD2 4.48Å; T469-Y477 HydrophobicContact CG2-CE2 4.08Å; E473-Y477 HydrophobicContact CB-CE2 4.32Å; E473-Y477 WeakPolarHBondContact O-CD1 3.43Å; E473-Y477 WeakPolarHBondContact O-CD2 3.17Å; E473-Y477 PolarHBondContact O-N 3.33Å; A474-Y477 PolarHBondContact O-N 2.9Å; Y477-N481 WeakPolarHBondContact O-CB 3.48Å; Y477-N481 PolarHBondContact O-N 3.5Å
478	L	94.1	Very high	94.3	Very high	1 Å²	1	74.8 Å²	74.8	1%	0.005	38%	0.38	C	S	.	.	H	α-helix	trans	-71.2	-43.4	172.3	-72.2	166.3	0	0	0	111.6	L455 I458 M462 W471 A474 Q475 Q476 D480 N481 F484	L455-L478 HydrophobicContact CD1-CD1 3.72Å; L455-L478 HydrophobicContact CD1-CD2 3.57Å; L455-L478 HydrophobicContact CD1-CG 4.32Å; I458-L478 HydrophobicContact CG2-CD2 3.73Å; M462-L478 HydrophobicContact CE-CD2 3.72Å; M462-L478 HydrophobicContact CE-CG 4.1Å; W471-L478 HydrophobicContact CH2-CD1 4.28Å; W471-L478 HydrophobicContact CZ3-CD1 4.31Å; A474-L478 WeakPolarHBondContact O-CB 3.46Å; A474-L478 VanDerWaalsContact O-CG 3.25Å; A474-L478 WeakPolarHBondContact O-CG 3.47Å; A474-L478 PolarHBondContact O-N 3.12Å; Q475-L478 PolarHBondContact O-N 3.45Å; Q476-L478 VanDerWaalsContact C-N 3.25Å; Q476-L478 PolarHBondContact O-N 2.95Å; L478-D480 VanDerWaalsContact C-N 3.28Å; L478-D480 PolarHBondContact O-N 3.44Å; L478-N481 WeakPolarHBondContact O-CB 3.47Å; L478-N481 PolarHBondContact O-N 2.87Å; L478-N481 VanDerWaalsContact O-N 3.08Å; L478-F484 HydrophobicContact CB-CD1 3.97Å; L478-F484 HydrophobicContact CB-CD2 4.41Å; L478-F484 HydrophobicContact CB-CE1 4.2Å; L478-F484 HydrophobicContact CB-CG 4.09Å; L478-F484 HydrophobicContact CD2-CD2 4.13Å; L478-F484 HydrophobicContact CD2-CG 4.33Å; L478-F484 WeakPolarHBondContact O-CB 3.35Å; L478-F484 WeakPolarHBondContact O-CD1 3.36Å
479	L	92.4	Very high	94.2	Very high	94 Å²	94	71 Å²	71	49%	0.492	37%	0.37	S	S	.	.	H	α-helix	trans	-64.8	-32.3	174.9	-70	169.7	0	0	0	112.6	Q475 Q476 N481 F484	Q475-L479 HydrophobicContact CG-CD1 4.47Å; Q475-L479 WeakPolarHBondContact O-CG 3.4Å; Q475-L479 PolarHBondContact O-N 2.9Å; Q476-L479 PolarHBondContact O-N 3.3Å; Q476-L479 VanDerWaalsContact O-N 3.1Å; L479-N481 VanDerWaalsContact C-N 3.27Å; L479-N481 PolarHBondContact O-N 3.28Å; L479-F484 HydrophobicContact CD2-CE1 4.45Å
480	D	92.7	Very high	94.1	Very high	105 Å²	105	70.4 Å²	70.4	56%	0.561	37%	0.366	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.2	-9.5	174.2	-61.8	-26.4	0	0	0	112.9	Q476 L478	Q476-D480 PolarHBondContact NE2-OD1 2.88Å; Q476-D480 PolarHBondContact NE2-OD2 2.96Å; Q476-D480 WeakPolarHBondContact O-CB 3.46Å; Q476-D480 PolarHBondContact O-N 3.47Å; L478-D480 VanDerWaalsContact C-N 3.28Å; L478-D480 PolarHBondContact O-N 3.44Å
481	N	93.3	Very high	93.9	Very high	31 Å²	31	71.8 Å²	71.8	17%	0.166	37%	0.368	C	S	.	.			trans	-94.7	119.4	-177.2	-168.8	-47.4	0	0	0	111.4	M462 Y477 L478 L479 T483 F484 A485	M462-N481 HydrophobicContact SD-CB 4.46Å; Y477-N481 WeakPolarHBondContact O-CB 3.48Å; Y477-N481 PolarHBondContact O-N 3.5Å; L478-N481 WeakPolarHBondContact O-CB 3.47Å; L478-N481 PolarHBondContact O-N 2.87Å; L478-N481 VanDerWaalsContact O-N 3.08Å; L479-N481 VanDerWaalsContact C-N 3.27Å; L479-N481 PolarHBondContact O-N 3.28Å; N481-T483 PolarHBondContact O-N 3.32Å; N481-T483 PolarHBondContact OD1-N 2.63Å; N481-T483 PolarHBondContact OD1-OG1 2.91Å; N481-F484 PolarHBondContact O-N 3.16Å; N481-A485 WeakPolarHBondContact O-CB 3.31Å; N481-A485 PolarHBondContact O-N 2.78Å
482	P	93.1	Very high	93.8	Very high	74 Å²	74	74.2 Å²	74.2	48%	0.481	39%	0.386	S	S	.	.	H	α-helix	trans	-60	-33.3	-176.3	23.9	-33.9	0	0	0	113.1	F484 A485 E486	P482-F484 PolarHBondContact O-N 2.96Å; P482-A485 PolarHBondContact O-N 3.07Å; P482-E486 WeakPolarHBondContact O-CB 3.33Å; P482-E486 WeakPolarHBondContact O-CG 3.37Å; P482-E486 PolarHBondContact O-N 3.2Å
483	T	92	Very high	93.7	Very high	80 Å²	80	71.2 Å²	71.2	49%	0.491	36%	0.363	S	S	.	.	H	α-helix	trans	-70.6	-17.3	-179.3	64	0	0	0	0	114	I458 N481	I458-T483 WeakPolarHBondContact CD1-OG1 3.46Å; I458-T483 WeakPolarHBondContact CG1-OG1 3.22Å; N481-T483 PolarHBondContact O-N 3.32Å; N481-T483 PolarHBondContact OD1-N 2.63Å; N481-T483 PolarHBondContact OD1-OG1 2.91Å
484	F	94	Very high	93.7	Very high	29 Å²	29	70.6 Å²	70.6	13%	0.127	36%	0.362	C	S	.	.	H	α-helix	trans	-96.8	-37.2	169.9	-177.3	-90.1	0	0	0	111.1	L455 I458 L478 L479 N481 P482 E486 L490 Q491	L455-F484 HydrophobicContact CD1-CD2 4.39Å; L455-F484 HydrophobicContact CD1-CE2 4.3Å; I458-F484 HydrophobicContact CD1-CB 4.14Å; L478-F484 HydrophobicContact CB-CD1 3.97Å; L478-F484 HydrophobicContact CB-CD2 4.41Å; L478-F484 HydrophobicContact CB-CE1 4.2Å; L478-F484 HydrophobicContact CB-CG 4.09Å; L478-F484 HydrophobicContact CD2-CD2 4.13Å; L478-F484 HydrophobicContact CD2-CG 4.33Å; L478-F484 WeakPolarHBondContact O-CB 3.35Å; L478-F484 WeakPolarHBondContact O-CD1 3.36Å; L479-F484 HydrophobicContact CD2-CE1 4.45Å; N481-F484 PolarHBondContact O-N 3.16Å; P482-F484 PolarHBondContact O-N 2.96Å; F484-E486 VanDerWaalsContact C-N 3.3Å; F484-E486 PolarHBondContact O-N 3.04Å; F484-L490 HydrophobicContact CD2-CD2 3.67Å; F484-L490 HydrophobicContact CD2-CG 3.84Å; F484-L490 HydrophobicContact CE2-CD2 4.3Å; F484-L490 HydrophobicContact CE2-CG 3.96Å; F484-Q491 HydrophobicContact CD1-CG 4.39Å; F484-Q491 HydrophobicContact CE1-CG 4.04Å; F484-Q491 HydrophobicContact CZ-CG 4.34Å; F484-Q491 WeakPolarHBondContact O-CG 3.21Å; F484-Q491 PolarHBondContact O-NE2 3.28Å
485	A	92.8	Very high	93.6	Very high	52 Å²	52	78.8 Å²	78.8	43%	0.43	40%	0.398	S	S	.	.	H	α-helix	trans	-67.6	-22.8	178.3	0	0	0	0	0	114.4	N481 P482 Q491	N481-A485 WeakPolarHBondContact O-CB 3.31Å; N481-A485 PolarHBondContact O-N 2.78Å; P482-A485 PolarHBondContact O-N 3.07Å; A485-Q491 PolarHBondContact O-NE2 3.19Å
486	E	93.6	Very high	93.6	Very high	165 Å²	165	78.1 Å²	78.1	77%	0.771	40%	0.395	S	S	*	.	S	Bend	trans	-95.8	-18.2	178.9	-68.2	174.4	-169.9	0	0	114.3	P482 F484 E488	P482-E486 WeakPolarHBondContact O-CB 3.33Å; P482-E486 WeakPolarHBondContact O-CG 3.37Å; P482-E486 PolarHBondContact O-N 3.2Å; F484-E486 VanDerWaalsContact C-N 3.3Å; F484-E486 PolarHBondContact O-N 3.04Å; E486-E488 PolarHBondContact O-N 2.82Å
487	D	94.6	Very high	93.6	Very high	37 Å²	37	73.9 Å²	73.9	20%	0.198	38%	0.375	C	S	.	.			trans	-94.8	91.6	-178.2	-171	-20.5	0	0	0	111.3	R450 E489 L490 Q491	R450-D487 IonicContact CZ-OD1 3.02Å; R450-D487 IonicContact CZ-OD2 2.67Å; R450-D487 IonicContact NH1-OD1 2.68Å; R450-D487 IonicContact NH1-OD2 3.12Å; R450-D487 PolarHBondContact NH1-OD2 3.27Å; R450-D487 IonicContact NH2-OD1 2.91Å; R450-D487 PolarHBondContact NH2-OD1 2.87Å; R450-D487 IonicContact NH2-OD2 2.76Å; R450-D487 PolarHBondContact NH2-OD2 3.44Å; D487-E489 VanDerWaalsContact C-N 3.29Å; D487-E489 PolarHBondContact O-N 3.21Å; D487-E489 WeakPolarHBondContact OD1-CB 2.96Å; D487-E489 PolarHBondContact OD1-N 3.12Å; D487-L490 HydrophobicContact CB-CB 3.71Å; D487-L490 HydrophobicContact CB-CD2 4.34Å; D487-L490 WeakPolarHBondContact O-CB 3.45Å; D487-L490 PolarHBondContact O-N 3.12Å; D487-L490 VanDerWaalsContact O-N 3.11Å; D487-L490 PolarHBondContact OD1-N 3.32Å; D487-Q491 PolarHBondContact O-N 3.18Å
488	E	93.6	Very high	93.7	Very high	147 Å²	147	71 Å²	71	69%	0.687	37%	0.366	S	S	*	.	H	α-helix	trans	-59.5	-36.5	178.4	179.1	177.6	-172.4	0	0	112.6	E486 L490 Q491 N492	E486-E488 PolarHBondContact O-N 2.82Å; E488-L490 VanDerWaalsContact C-N 3.3Å; E488-L490 PolarHBondContact O-N 3.3Å; E488-Q491 PolarHBondContact O-N 3.2Å; E488-N492 WeakPolarHBondContact CG-ND2 3.25Å; E488-N492 WeakPolarHBondContact O-CB 3.35Å; E488-N492 PolarHBondContact O-N 3Å; E488-N492 VanDerWaalsContact O-N 3.08Å; E488-N492 PolarHBondContact O-ND2 3.09Å
489	E	93.1	Very high	93.8	Very high	101 Å²	101	74.7 Å²	74.7	47%	0.472	39%	0.385	S	S	.	.	H	α-helix	trans	-64.5	-37	176	-91.9	-176	-177.6	0	0	111.2	L447 R450 N451 D487	L447-E489 HydrophobicContact CD1-CB 4.15Å; L447-E489 HydrophobicContact CD1-CG 4.07Å; L447-E489 WeakPolarHBondContact CD1-OE2 3.45Å; R450-E489 IonicContact CZ-OE2 3.45Å; R450-E489 IonicContact NE-OE2 3.34Å; R450-E489 PolarHBondContact NE-OE2 3.28Å; R450-E489 VanDerWaalsContact NE-OE2 3.09Å; R450-E489 IonicContact NH2-OE2 3.89Å; R450-E489 PolarHBondContact NH2-OE2 2.89Å; N451-E489 PolarHBondContact ND2-O 2.98Å; D487-E489 VanDerWaalsContact C-N 3.29Å; D487-E489 PolarHBondContact O-N 3.21Å; D487-E489 WeakPolarHBondContact OD1-CB 2.96Å; D487-E489 PolarHBondContact OD1-N 3.12Å
490	L	94	Very high	94	Very high	0 Å²	0	73.7 Å²	73.7	0%	0	38%	0.38	C	S	.	.	H	α-helix	trans	-71.9	-41.5	177.2	-174.7	60.4	0	0	0	112.2	N451 A454 L455 I458 F484 D487 E488 N492 M493	N451-L490 HydrophobicContact CB-CD1 3.74Å; N451-L490 VanDerWaalsContact O-CD1 3.23Å; N451-L490 WeakPolarHBondContact O-CD1 3.37Å; A454-L490 HydrophobicContact CB-CD1 4.23Å; A454-L490 HydrophobicContact CB-CD2 4.19Å; L455-L490 HydrophobicContact CB-CD1 4.23Å; I458-L490 HydrophobicContact CD1-CD2 3.8Å; F484-L490 HydrophobicContact CD2-CD2 3.67Å; F484-L490 HydrophobicContact CD2-CG 3.84Å; F484-L490 HydrophobicContact CE2-CD2 4.3Å; F484-L490 HydrophobicContact CE2-CG 3.96Å; D487-L490 HydrophobicContact CB-CB 3.71Å; D487-L490 HydrophobicContact CB-CD2 4.34Å; D487-L490 WeakPolarHBondContact O-CB 3.45Å; D487-L490 PolarHBondContact O-N 3.12Å; D487-L490 VanDerWaalsContact O-N 3.11Å; D487-L490 PolarHBondContact OD1-N 3.32Å; E488-L490 VanDerWaalsContact C-N 3.3Å; E488-L490 PolarHBondContact O-N 3.3Å; L490-N492 PolarHBondContact O-N 3.19Å; L490-M493 HydrophobicContact CD1-SD 3.74Å; L490-M493 VanDerWaalsContact O-CB 3.28Å; L490-M493 WeakPolarHBondContact O-CB 3.49Å; L490-M493 WeakPolarHBondContact O-CG 3.37Å; L490-M493 PolarHBondContact O-N 3.32Å; L490-M493 VanDerWaalsContact O-N 3.1Å
491	Q	93.4	Very high	94.2	Very high	93 Å²	93	68.7 Å²	68.7	44%	0.435	35%	0.353	S	S	.	.	H	α-helix	trans	-62.6	-31.7	174.2	-70.5	173.2	37.7	0	0	112.7	F484 A485 D487 E488 M493	F484-Q491 HydrophobicContact CD1-CG 4.39Å; F484-Q491 HydrophobicContact CE1-CG 4.04Å; F484-Q491 HydrophobicContact CZ-CG 4.34Å; F484-Q491 WeakPolarHBondContact O-CG 3.21Å; F484-Q491 PolarHBondContact O-NE2 3.28Å; A485-Q491 PolarHBondContact O-NE2 3.19Å; D487-Q491 PolarHBondContact O-N 3.18Å; E488-Q491 PolarHBondContact O-N 3.2Å; Q491-M493 VanDerWaalsContact C-N 3.28Å; Q491-M493 PolarHBondContact O-N 3.03Å
492	N	92.8	Very high	94.3	Very high	120 Å²	120	68 Å²	68	64%	0.642	35%	0.349	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.4	11.3	175.7	-74.4	-61.5	0	0	0	114	E488 L490	E488-N492 WeakPolarHBondContact CG-ND2 3.25Å; E488-N492 WeakPolarHBondContact O-CB 3.35Å; E488-N492 PolarHBondContact O-N 3Å; E488-N492 VanDerWaalsContact O-N 3.08Å; E488-N492 PolarHBondContact O-ND2 3.09Å; L490-N492 PolarHBondContact O-N 3.19Å
493	M	94.1	Very high	94.5	Very high	23 Å²	23	68.7 Å²	68.7	11%	0.113	35%	0.345	C	S	.	.	S	Bend	trans	-66.6	160.5	173.2	79.6	-171.1	-64.8	0	0	112.5	N451 L455 L490 Q491 K495 D497 A498	N451-M493 HydrophobicContact CB-CB 4.14Å; N451-M493 HydrophobicContact CB-CE 4.16Å; L455-M493 HydrophobicContact CB-CE 4.38Å; L455-M493 HydrophobicContact CB-SD 4.37Å; L455-M493 HydrophobicContact CD2-CE 3.86Å; L455-M493 HydrophobicContact CD2-SD 3.82Å; L490-M493 HydrophobicContact CD1-SD 3.74Å; L490-M493 VanDerWaalsContact O-CB 3.28Å; L490-M493 WeakPolarHBondContact O-CB 3.49Å; L490-M493 WeakPolarHBondContact O-CG 3.37Å; L490-M493 PolarHBondContact O-N 3.32Å; L490-M493 VanDerWaalsContact O-N 3.1Å; Q491-M493 VanDerWaalsContact C-N 3.28Å; Q491-M493 PolarHBondContact O-N 3.03Å; M493-K495 PolarHBondContact O-N 3Å; M493-D497 HydrophobicContact CE-CB 4.16Å; M493-A498 HydrophobicContact CE-CB 4.34Å; M493-A498 HydrophobicContact CG-CB 4.27Å; M493-A498 HydrophobicContact SD-CB 4.03Å
494	D	94.6	Very high	94.7	Very high	72 Å²	72	68.4 Å²	68.4	39%	0.385	34%	0.338	S	S	.	.			trans	-62.5	130.9	174.6	-165.1	-28.2	0	0	0	110	E496 D497 A498 R879	D494-E496 PolarHBondContact O-N 2.95Å; D494-E496 PolarHBondContact OD1-N 2.94Å; D494-D497 HydrophobicContact CB-CB 4.18Å; D494-D497 WeakPolarHBondContact O-CB 3.2Å; D494-D497 PolarHBondContact O-N 3.3Å; D494-D497 VanDerWaalsContact O-N 3.07Å; D494-A498 PolarHBondContact O-N 3.3Å; D494-R879 IonicContact OD2-NH2 2.68Å
495	K	93.3	Very high	94.9	Very high	172 Å²	172	67.4 Å²	67.4	75%	0.748	33%	0.334	S	S	*	.	H	α-helix	trans	-63.4	-29.7	178.2	-63.1	-177.9	-178.7	-179	0	111.4	M493 L499	M493-K495 PolarHBondContact O-N 3Å; K495-L499 WeakPolarHBondContact O-CB 3.48Å; K495-L499 WeakPolarHBondContact O-CD1 3.38Å; K495-L499 VanDerWaalsContact O-CG 3.31Å; K495-L499 WeakPolarHBondContact O-CG 3.23Å; K495-L499 PolarHBondContact O-N 3.33Å
496	E	94.3	Very high	95.1	Very high	78 Å²	78	65.9 Å²	65.9	36%	0.364	32%	0.318	S	S	.	.	H	α-helix	trans	-68.1	-40.3	173.1	-64.9	-173.9	-122.4	0	0	111.3	D494 L499 I500 R879	D494-E496 PolarHBondContact O-N 2.95Å; D494-E496 PolarHBondContact OD1-N 2.94Å; E496-L499 PolarHBondContact O-N 2.67Å; E496-I500 WeakPolarHBondContact O-CD1 3.48Å; E496-I500 WeakPolarHBondContact O-CG1 3.38Å; E496-I500 PolarHBondContact O-N 2.8Å; E496-R879 VanDerWaalsContact CD-NE 3.32Å; E496-R879 IonicContact OE1-CZ 3.72Å; E496-R879 IonicContact OE1-NE 2.86Å; E496-R879 PolarHBondContact OE1-NE 3.32Å; E496-R879 VanDerWaalsContact OE1-NE 3.1Å; E496-R879 IonicContact OE1-NH2 3.86Å; E496-R879 PolarHBondContact OE1-NH2 3.01Å; E496-R879 IonicContact OE2-CZ 2.92Å; E496-R879 IonicContact OE2-NE 3.81Å; E496-R879 PolarHBondContact OE2-NE 3.18Å; E496-R879 IonicContact OE2-NH2 2.65Å; E496-R879 PolarHBondContact OE2-NH2 3.35Å
497	D	95.8	Very high	95.2	Very high	8 Å²	8	63.7 Å²	63.7	4%	0.043	30%	0.303	C	S	.	.	H	α-helix	trans	-64.6	-42.9	174.9	-78.1	-29.5	0	0	0	111.8	R448 W452 M493 D494 L499 I500 C501	R448-D497 WeakPolarHBondContact CD-OD2 3.25Å; R448-D497 VanDerWaalsContact CG-OD2 3.32Å; R448-D497 WeakPolarHBondContact CG-OD2 3.24Å; R448-D497 IonicContact CZ-OD1 3.15Å; R448-D497 IonicContact CZ-OD2 3.46Å; R448-D497 VanDerWaalsContact NE-CG 3.34Å; R448-D497 IonicContact NE-OD1 2.66Å; R448-D497 PolarHBondContact NE-OD1 3.24Å; R448-D497 IonicContact NE-OD2 3.92Å; R448-D497 PolarHBondContact NE-OD2 2.93Å; R448-D497 IonicContact NH2-OD1 2.59Å; R448-D497 PolarHBondContact NH2-OD1 3.45Å; R448-D497 IonicContact NH2-OD2 3.93Å; W452-D497 HydrophobicContact CE3-CB 4.06Å; W452-D497 HydrophobicContact CZ3-CB 4.04Å; W452-D497 WeakPolarHBondContact CZ3-O 3.4Å; M493-D497 HydrophobicContact CE-CB 4.16Å; D494-D497 HydrophobicContact CB-CB 4.18Å; D494-D497 WeakPolarHBondContact O-CB 3.2Å; D494-D497 PolarHBondContact O-N 3.3Å; D494-D497 VanDerWaalsContact O-N 3.07Å; D497-L499 VanDerWaalsContact C-N 3.32Å; D497-L499 PolarHBondContact O-N 3.04Å; D497-I500 PolarHBondContact O-N 2.84Å; D497-C501 WeakPolarHBondContact O-CB 3.34Å; D497-C501 PolarHBondContact O-N 2.73Å
498	A	95.6	Very high	95.3	Very high	9 Å²	9	64.5 Å²	64.5	7%	0.074	32%	0.315	C	S	.	.	H	α-helix	trans	-60.7	-42.2	177.3	0	0	0	0	0	111.8	L455 W471 M493 D494 F502	L455-A498 HydrophobicContact CD2-CB 3.87Å; W471-A498 HydrophobicContact CH2-CB 3.83Å; W471-A498 HydrophobicContact CZ2-CB 4.44Å; M493-A498 HydrophobicContact CE-CB 4.34Å; M493-A498 HydrophobicContact CG-CB 4.27Å; M493-A498 HydrophobicContact SD-CB 4.03Å; D494-A498 PolarHBondContact O-N 3.3Å; A498-F502 WeakPolarHBondContact O-CB 3.44Å; A498-F502 PolarHBondContact O-N 2.85Å
499	L	96.4	Very high	95.4	Very high	78 Å²	78	59.5 Å²	59.5	41%	0.408	29%	0.293	S	S	.	.	H	α-helix	trans	-64.5	-44.2	175.1	-78.3	166.8	0	0	0	113	W471 K495 E496 D497 F502 E503	W471-L499 HydrophobicContact CB-CD2 4.19Å; W471-L499 HydrophobicContact CD2-CD2 3.56Å; W471-L499 HydrophobicContact CD2-CG 4.47Å; W471-L499 HydrophobicContact CE3-CD2 4.16Å; W471-L499 HydrophobicContact CG-CD2 3.53Å; K495-L499 WeakPolarHBondContact O-CB 3.48Å; K495-L499 WeakPolarHBondContact O-CD1 3.38Å; K495-L499 VanDerWaalsContact O-CG 3.31Å; K495-L499 WeakPolarHBondContact O-CG 3.23Å; K495-L499 PolarHBondContact O-N 3.33Å; E496-L499 PolarHBondContact O-N 2.67Å; D497-L499 VanDerWaalsContact C-N 3.32Å; D497-L499 PolarHBondContact O-N 3.04Å; L499-F502 PolarHBondContact O-N 2.91Å; L499-E503 WeakPolarHBondContact O-CB 3.45Å; L499-E503 PolarHBondContact O-N 3.47Å
500	I	96.3	Very high	95.4	Very high	73 Å²	73	59.3 Å²	59.3	37%	0.374	29%	0.292	S	S	.	.	H	α-helix	trans	-71.9	-37.8	-179.4	-56.5	157.2	0	0	0	110.7	W452 E496 D497 F502 E503 E504	W452-I500 HydrophobicContact CH2-CB 3.82Å; W452-I500 HydrophobicContact CH2-CG2 3.74Å; W452-I500 HydrophobicContact CZ3-CB 4.27Å; E496-I500 WeakPolarHBondContact O-CD1 3.48Å; E496-I500 WeakPolarHBondContact O-CG1 3.38Å; E496-I500 PolarHBondContact O-N 2.8Å; D497-I500 PolarHBondContact O-N 2.84Å; I500-F502 VanDerWaalsContact C-N 3.31Å; I500-F502 PolarHBondContact O-N 2.89Å; I500-E503 PolarHBondContact O-N 3Å; I500-E504 WeakPolarHBondContact O-CB 3.44Å; I500-E504 PolarHBondContact O-N 2.93Å
501	C	97	Very high	95.6	Very high	1 Å²	1	65.5 Å²	65.5	1%	0.007	32%	0.319	C	S	.	.	H	α-helix	trans	-60.1	-41.9	173.3	-177.8	0	0	0	0	111.5	W452 L455 D497 H505	W452-C501 HydrophobicContact CD2-CB 4.04Å; W452-C501 HydrophobicContact CE3-CB 4.12Å; W452-C501 HydrophobicContact CH2-CB 4.06Å; W452-C501 HydrophobicContact CZ2-CB 3.96Å; W452-C501 HydrophobicContact CZ3-CB 4.13Å; L455-C501 HydrophobicContact CD2-CB 3.96Å; D497-C501 WeakPolarHBondContact O-CB 3.34Å; D497-C501 PolarHBondContact O-N 2.73Å; C501-H505 PolarHBondContact O-N 2.91Å; C501-H505 VanDerWaalsContact O-N 3.11Å
502	F	96.9	Very high	95.6	Very high	17 Å²	17	66.7 Å²	66.7	8%	0.075	32%	0.324	C	S	.	.	H	α-helix	trans	-66.5	-43.8	173.2	176.7	-106.1	0	0	0	112.6	L459 V465 T469 W471 A474 A498 L499 I500 E504 H505 I506	L459-F502 HydrophobicContact CD1-CB 4.45Å; L459-F502 HydrophobicContact CD1-CD2 4.43Å; L459-F502 HydrophobicContact CD2-CD2 4.01Å; V465-F502 HydrophobicContact CG1-CE2 4.49Å; T469-F502 WeakPolarHBondContact O-CZ 3.36Å; W471-F502 HydrophobicContact CB-CD1 4.14Å; W471-F502 HydrophobicContact CB-CE1 3.9Å; W471-F502 HydrophobicContact CE3-CB 3.7Å; W471-F502 AromaticContact CE3-CD1 3.69Å; W471-F502 HydrophobicContact CE3-CD1 3.69Å; W471-F502 HydrophobicContact CE3-CD2 4.17Å; W471-F502 HydrophobicContact CE3-CE1 4.33Å; W471-F502 AromaticContact CE3-CG 3.58Å; W471-F502 HydrophobicContact CE3-CG 3.58Å; W471-F502 HydrophobicContact CZ3-CB 3.73Å; W471-F502 HydrophobicContact CZ3-CD2 4.49Å; W471-F502 HydrophobicContact CZ3-CG 4.03Å; A474-F502 HydrophobicContact CB-CD2 3.82Å; A474-F502 HydrophobicContact CB-CE2 3.23Å; A474-F502 HydrophobicContact CB-CZ 3.74Å; A498-F502 WeakPolarHBondContact O-CB 3.44Å; A498-F502 PolarHBondContact O-N 2.85Å; L499-F502 PolarHBondContact O-N 2.91Å; I500-F502 VanDerWaalsContact C-N 3.31Å; I500-F502 PolarHBondContact O-N 2.89Å; F502-E504 VanDerWaalsContact C-N 3.31Å; F502-E504 PolarHBondContact O-N 2.78Å; F502-H505 PolarHBondContact O-N 3.34Å; F502-I506 HydrophobicContact CD1-CG1 4.2Å; F502-I506 HydrophobicContact CD2-CG1 4.05Å; F502-I506 HydrophobicContact CE1-CD1 4.47Å; F502-I506 HydrophobicContact CE1-CG1 3.75Å; F502-I506 HydrophobicContact CE2-CD1 3.7Å; F502-I506 HydrophobicContact CE2-CG1 3.56Å; F502-I506 HydrophobicContact CG-CG1 4.35Å; F502-I506 HydrophobicContact CZ-CD1 3.68Å; F502-I506 HydrophobicContact CZ-CG1 3.42Å; F502-I506 VanDerWaalsContact CZ-CG1 3.42Å; F502-I506 WeakPolarHBondContact O-CG1 3.32Å; F502-I506 PolarHBondContact O-N 3.02Å
503	E	96.3	Very high	95.7	Very high	87 Å²	87	64.4 Å²	64.4	41%	0.407	31%	0.31	S	S	.	.	H	α-helix	trans	-62.3	-37.8	177.3	-154.6	-149.5	155.8	0	0	111.7	L499 I500 R507	L499-E503 WeakPolarHBondContact O-CB 3.45Å; L499-E503 PolarHBondContact O-N 3.47Å; I500-E503 PolarHBondContact O-N 3Å; E503-R507 VanDerWaalsContact O-CB 3.29Å; E503-R507 WeakPolarHBondContact O-CB 3.33Å; E503-R507 VanDerWaalsContact O-CG 3.31Å; E503-R507 WeakPolarHBondContact O-CG 3.42Å; E503-R507 PolarHBondContact O-N 2.54Å; E503-R507 IonicContact OE1-CZ 3.09Å; E503-R507 IonicContact OE1-NE 3.87Å; E503-R507 PolarHBondContact OE1-NE 2.75Å; E503-R507 IonicContact OE1-NH2 2.65Å; E503-R507 PolarHBondContact OE1-NH2 2.85Å; E503-R507 IonicContact OE2-CZ 2.74Å; E503-R507 IonicContact OE2-NH2 3.34Å; E503-R507 PolarHBondContact OE2-NH2 3.32Å
504	E	96.9	Very high	95.6	Very high	74 Å²	74	66.6 Å²	66.6	35%	0.346	32%	0.32	S	S	.	.	H	α-helix	trans	-62.9	-47.2	173.5	-168.2	-164.5	125.8	0	0	111.5	K456 I500 F502 R507 A508	K456-E504 IonicContact NZ-OE1 3.77Å; K456-E504 PolarHBondContact NZ-OE1 3.23Å; I500-E504 WeakPolarHBondContact O-CB 3.44Å; I500-E504 PolarHBondContact O-N 2.93Å; F502-E504 VanDerWaalsContact C-N 3.31Å; F502-E504 PolarHBondContact O-N 2.78Å; E504-R507 PolarHBondContact O-N 2.76Å; E504-A508 WeakPolarHBondContact O-CB 3.39Å; E504-A508 PolarHBondContact O-N 2.85Å
505	H	96.8	Very high	95.7	Very high	8 Å²	8	66.8 Å²	66.8	4%	0.037	32%	0.318	C	S	.	.	H	α-helix	trans	-63.9	-46.4	178.9	171.6	91.4	0	0	0	111.9	L459 D460 V465 C501 F502 R507 A508 L509	L459-H505 VanDerWaalsContact C-CE1 3.43Å; L459-H505 HydrophobicContact CD1-CB 4.19Å; L459-H505 PolarHBondContact O-CE1 3.49Å; D460-H505 IonicContact OD1-CE1 3.74Å; D460-H505 PolarHBondContact OD1-CE1 3.17Å; D460-H505 IonicContact OD1-CG 2.71Å; D460-H505 IonicContact OD1-ND1 2.62Å; D460-H505 PolarHBondContact OD1-ND1 2.93Å; V465-H505 VanDerWaalsContact CG1-NE2 3.34Å; V465-H505 WeakPolarHBondContact CG1-NE2 3.26Å; C501-H505 PolarHBondContact O-N 2.91Å; C501-H505 VanDerWaalsContact O-N 3.11Å; F502-H505 PolarHBondContact O-N 3.34Å; H505-R507 PolarHBondContact O-N 2.78Å; H505-A508 WeakPolarHBondContact O-CB 3.27Å; H505-A508 PolarHBondContact O-N 3.28Å; H505-A508 VanDerWaalsContact O-N 3.12Å; H505-L509 WeakPolarHBondContact NE2-CD1 3.33Å; H505-L509 PolarHBondContact O-N 3.41Å
506	I	96.9	Very high	95.7	Very high	20 Å²	20	61.9 Å²	61.9	10%	0.103	30%	0.3	C	S	.	.	H	α-helix	trans	-61.8	-45.9	175.6	-65.8	-65.8	0	0	0	111.1	V465 T466 F502 A508 L509 E510	V465-I506 HydrophobicContact CG1-CD1 4.01Å; T466-I506 WeakPolarHBondContact O-CD1 3.39Å; F502-I506 HydrophobicContact CD1-CG1 4.2Å; F502-I506 HydrophobicContact CD2-CG1 4.05Å; F502-I506 HydrophobicContact CE1-CD1 4.47Å; F502-I506 HydrophobicContact CE1-CG1 3.75Å; F502-I506 HydrophobicContact CE2-CD1 3.7Å; F502-I506 HydrophobicContact CE2-CG1 3.56Å; F502-I506 HydrophobicContact CG-CG1 4.35Å; F502-I506 HydrophobicContact CZ-CD1 3.68Å; F502-I506 HydrophobicContact CZ-CG1 3.42Å; F502-I506 VanDerWaalsContact CZ-CG1 3.42Å; F502-I506 WeakPolarHBondContact O-CG1 3.32Å; F502-I506 PolarHBondContact O-N 3.02Å; I506-A508 PolarHBondContact O-N 3.44Å; I506-L509 PolarHBondContact O-N 2.72Å; I506-L509 VanDerWaalsContact O-N 3.11Å; I506-E510 HydrophobicContact CG2-CG 4.38Å; I506-E510 WeakPolarHBondContact O-CG 3.31Å; I506-E510 PolarHBondContact O-N 2.82Å
507	R	96.6	Very high	95.7	Very high	120 Å²	120	62.9 Å²	62.9	45%	0.453	30%	0.303	S	S	.	.	H	α-helix	trans	-62.5	-26.9	175.5	-74.7	-161.1	-105.7	108.3	-10.9	112.8	E503 E504 H505 K511	E503-R507 VanDerWaalsContact O-CB 3.29Å; E503-R507 WeakPolarHBondContact O-CB 3.33Å; E503-R507 VanDerWaalsContact O-CG 3.31Å; E503-R507 WeakPolarHBondContact O-CG 3.42Å; E503-R507 PolarHBondContact O-N 2.54Å; E503-R507 IonicContact OE1-CZ 3.09Å; E503-R507 IonicContact OE1-NE 3.87Å; E503-R507 PolarHBondContact OE1-NE 2.75Å; E503-R507 IonicContact OE1-NH2 2.65Å; E503-R507 PolarHBondContact OE1-NH2 2.85Å; E503-R507 IonicContact OE2-CZ 2.74Å; E503-R507 IonicContact OE2-NH2 3.34Å; E503-R507 PolarHBondContact OE2-NH2 3.32Å; E504-R507 PolarHBondContact O-N 2.76Å; H505-R507 PolarHBondContact O-N 2.78Å; R507-K511 WeakPolarHBondContact O-CB 3.36Å; R507-K511 PolarHBondContact O-N 2.74Å
508	A	95.9	Very high	95.6	Very high	53 Å²	53	67.2 Å²	67.2	44%	0.438	32%	0.323	S	S	.	.	H	α-helix	trans	-71.4	-44.8	171.7	0	0	0	0	0	111.8	E504 H505 I506 K511 E512	E504-A508 WeakPolarHBondContact O-CB 3.39Å; E504-A508 PolarHBondContact O-N 2.85Å; H505-A508 WeakPolarHBondContact O-CB 3.27Å; H505-A508 PolarHBondContact O-N 3.28Å; H505-A508 VanDerWaalsContact O-N 3.12Å; I506-A508 PolarHBondContact O-N 3.44Å; A508-K511 PolarHBondContact O-N 2.91Å; A508-E512 PolarHBondContact O-N 2.98Å
509	L	95.9	Very high	95.6	Very high	42 Å²	42	70.1 Å²	70.1	22%	0.22	33%	0.334	C	S	.	.	H	α-helix	trans	-65.1	-40.2	175.9	-64.8	-177.1	0	0	0	112.7	V465 H505 I506 K511 E512 E513	V465-L509 HydrophobicContact CG1-CD1 4.25Å; H505-L509 WeakPolarHBondContact NE2-CD1 3.33Å; H505-L509 PolarHBondContact O-N 3.41Å; I506-L509 PolarHBondContact O-N 2.72Å; I506-L509 VanDerWaalsContact O-N 3.11Å; L509-K511 VanDerWaalsContact C-N 3.3Å; L509-K511 PolarHBondContact O-N 3.11Å; L509-E512 PolarHBondContact O-N 2.84Å; L509-E513 PolarHBondContact O-N 3.33Å
510	E	94.8	Very high	95.6	Very high	97 Å²	97	69.6 Å²	69.6	45%	0.453	34%	0.335	S	S	.	.	H	α-helix	trans	-58	-44.1	173.1	-74	-174.6	127.3	0	0	111.4	Y467 I506 E513 E514	Y467-E510 HydrophobicContact CD2-CG 4.4Å; I506-E510 HydrophobicContact CG2-CG 4.38Å; I506-E510 WeakPolarHBondContact O-CG 3.31Å; I506-E510 PolarHBondContact O-N 2.82Å; E510-E513 PolarHBondContact O-N 3.08Å; E510-E514 PolarHBondContact O-N 3.3Å; E510-E514 VanDerWaalsContact O-N 3.12Å
511	K	96.6	Very high	95.5	Very high	131 Å²	131	71 Å²	71	57%	0.57	34%	0.342	S	S	*	.	H	α-helix	trans	-65.9	-38.7	177.5	179.5	176.5	173.8	-72.9	0	111.6	R507 A508 L509 E515	R507-K511 WeakPolarHBondContact O-CB 3.36Å; R507-K511 PolarHBondContact O-N 2.74Å; A508-K511 PolarHBondContact O-N 2.91Å; L509-K511 VanDerWaalsContact C-N 3.3Å; L509-K511 PolarHBondContact O-N 3.11Å; K511-E515 WeakPolarHBondContact CE-OE1 3.11Å; K511-E515 IonicContact NZ-OE1 3.9Å; K511-E515 PolarHBondContact NZ-OE1 3.4Å; K511-E515 VanDerWaalsContact O-CB 3.28Å; K511-E515 WeakPolarHBondContact O-CB 3.49Å; K511-E515 WeakPolarHBondContact O-CG 3.42Å; K511-E515 PolarHBondContact O-N 2.67Å
512	E	94.7	Very high	95.4	Very high	117 Å²	117	74.5 Å²	74.5	55%	0.547	36%	0.361	S	S	.	.	H	α-helix	trans	-67.3	-41.4	176.2	-174	160.3	-147.5	0	0	112.1	A508 L509 E514 E515 D516	A508-E512 PolarHBondContact O-N 2.98Å; L509-E512 PolarHBondContact O-N 2.84Å; E512-E514 PolarHBondContact O-N 3.08Å; E512-E515 PolarHBondContact O-N 2.72Å; E512-D516 PolarHBondContact O-N 2.73Å
513	E	93.6	Very high	95.3	Very high	72 Å²	72	81.2 Å²	81.2	34%	0.336	39%	0.385	S	S	.	.	H	α-helix	trans	-58.8	-50.2	174.5	-164.4	-144.5	-152.7	0	0	111.2	Y467 L509 E510 E515 D516 K517	Y467-E513 HydrophobicContact CD1-CB 4.2Å; Y467-E513 HydrophobicContact CD1-CG 4.34Å; Y467-E513 HydrophobicContact CE1-CB 4.25Å; Y467-E513 HydrophobicContact CE1-CG 3.88Å; Y467-E513 WeakPolarHBondContact CE1-OE1 3.23Å; Y467-E513 VanDerWaalsContact OH-CD 3.25Å; Y467-E513 PolarHBondContact OH-OE1 3.09Å; L509-E513 PolarHBondContact O-N 3.33Å; E510-E513 PolarHBondContact O-N 3.08Å; E513-E515 VanDerWaalsContact C-N 3.34Å; E513-E515 PolarHBondContact O-N 3.24Å; E513-D516 PolarHBondContact O-N 3.27Å; E513-K517 WeakPolarHBondContact O-CB 3.33Å; E513-K517 PolarHBondContact O-N 3.5Å
514	E	93.3	Very high	95.2	Very high	69 Å²	69	79.6 Å²	79.6	32%	0.322	38%	0.378	S	S	.	.	H	α-helix	trans	-67.6	-34.4	-179.5	-178.8	55.4	-142.1	0	0	111.7	E510 E512 K517 Q518	E510-E514 PolarHBondContact O-N 3.3Å; E510-E514 VanDerWaalsContact O-N 3.12Å; E512-E514 PolarHBondContact O-N 3.08Å; E514-K517 WeakPolarHBondContact OE2-CD 3.38Å; E514-K517 WeakPolarHBondContact OE2-CE 3.41Å; E514-K517 IonicContact OE2-NZ 2.61Å; E514-K517 PolarHBondContact OE2-NZ 3.13Å; E514-Q518 WeakPolarHBondContact O-CB 3.41Å; E514-Q518 VanDerWaalsContact O-CG 3.25Å; E514-Q518 WeakPolarHBondContact O-CG 3.49Å; E514-Q518 PolarHBondContact O-N 3.32Å; E514-Q518 WeakPolarHBondContact OE1-CG 3.27Å; E514-Q518 PolarHBondContact OE1-NE2 3.47Å
515	E	95.2	Very high	95	Very high	76 Å²	76	83.3 Å²	83.3	36%	0.355	39%	0.388	S	S	.	.	H	α-helix	trans	-63.1	-42.8	170.1	-85.9	-167.4	-147.6	0	0	112.5	K511 E512 E513 Q518 K519	K511-E515 WeakPolarHBondContact CE-OE1 3.11Å; K511-E515 IonicContact NZ-OE1 3.9Å; K511-E515 PolarHBondContact NZ-OE1 3.4Å; K511-E515 VanDerWaalsContact O-CB 3.28Å; K511-E515 WeakPolarHBondContact O-CB 3.49Å; K511-E515 WeakPolarHBondContact O-CG 3.42Å; K511-E515 PolarHBondContact O-N 2.67Å; E512-E515 PolarHBondContact O-N 2.72Å; E513-E515 VanDerWaalsContact C-N 3.34Å; E513-E515 PolarHBondContact O-N 3.24Å; E515-Q518 PolarHBondContact O-N 3.06Å; E515-K519 WeakPolarHBondContact O-CB 3.5Å; E515-K519 WeakPolarHBondContact O-CE 3.37Å; E515-K519 WeakPolarHBondContact O-CG 3.49Å; E515-K519 PolarHBondContact O-N 3.47Å; E515-K519 IonicContact OE2-NZ 2.89Å
516	D	93.8	Very high	95	Very high	70 Å²	70	90.5 Å²	90.5	37%	0.374	42%	0.415	S	S	.	.	H	α-helix	trans	-72.7	-34.2	179.4	-109.3	50.3	0	0	0	112.9	E512 E513 Q518 K519 T520	E512-D516 PolarHBondContact O-N 2.73Å; E513-D516 PolarHBondContact O-N 3.27Å; D516-Q518 VanDerWaalsContact C-N 3.34Å; D516-K519 PolarHBondContact O-N 2.8Å; D516-K519 VanDerWaalsContact OD1-CD 3.25Å; D516-K519 WeakPolarHBondContact OD1-CD 3.44Å; D516-K519 WeakPolarHBondContact OD1-CE 3.44Å; D516-K519 IonicContact OD1-NZ 3.34Å; D516-K519 PolarHBondContact OD1-NZ 3.33Å; D516-T520 WeakPolarHBondContact O-CB 3.48Å; D516-T520 WeakPolarHBondContact O-CG2 3.2Å; D516-T520 PolarHBondContact O-N 3.05Å; D516-T520 PolarHBondContact O-OG1 3.05Å
517	K	94.4	Very high	94.9	Very high	99 Å²	99	96.3 Å²	96.3	43%	0.43	44%	0.436	S	S	.	.	H	α-helix	trans	-61.8	-39	167.5	-178.3	170.5	156.9	-152.5	0	111.6	E513 E514 T520 L521	E513-K517 WeakPolarHBondContact O-CB 3.33Å; E513-K517 PolarHBondContact O-N 3.5Å; E514-K517 WeakPolarHBondContact OE2-CD 3.38Å; E514-K517 WeakPolarHBondContact OE2-CE 3.41Å; E514-K517 IonicContact OE2-NZ 2.61Å; E514-K517 PolarHBondContact OE2-NZ 3.13Å; K517-T520 WeakPolarHBondContact CA-OG1 3.41Å; K517-T520 PolarHBondContact O-OG1 3.4Å; K517-L521 WeakPolarHBondContact O-CB 3.13Å; K517-L521 VanDerWaalsContact O-CG 3.23Å; K517-L521 WeakPolarHBondContact O-CG 3.23Å; K517-L521 PolarHBondContact O-N 2.85Å
518	Q	94.8	Very high	94.8	Very high	98 Å²	98	92 Å²	92	46%	0.458	42%	0.421	S	S	.	.	H	α-helix	trans	-71.2	-40.7	170.9	-72.7	176.7	33.5	0	0	112.6	E514 E515 D516 T520 L521 L522	E514-Q518 WeakPolarHBondContact O-CB 3.41Å; E514-Q518 VanDerWaalsContact O-CG 3.25Å; E514-Q518 WeakPolarHBondContact O-CG 3.49Å; E514-Q518 PolarHBondContact O-N 3.32Å; E514-Q518 WeakPolarHBondContact OE1-CG 3.27Å; E514-Q518 PolarHBondContact OE1-NE2 3.47Å; E515-Q518 PolarHBondContact O-N 3.06Å; D516-Q518 VanDerWaalsContact C-N 3.34Å; Q518-T520 VanDerWaalsContact C-N 3.33Å; Q518-T520 PolarHBondContact O-N 2.88Å; Q518-L521 PolarHBondContact O-N 2.89Å; Q518-L522 VanDerWaalsContact O-CB 3.3Å; Q518-L522 WeakPolarHBondContact O-CB 3.26Å; Q518-L522 VanDerWaalsContact O-CG 3.23Å; Q518-L522 WeakPolarHBondContact O-CG 3.47Å; Q518-L522 PolarHBondContact O-N 3.35Å
519	K	94.9	Very high	94.8	Very high	70 Å²	70	95.7 Å²	95.7	30%	0.304	42%	0.423	S	S	.	.	H	α-helix	trans	-59.6	-42.6	174.3	-71.1	163.1	-137.7	158.4	0	110.9	E515 D516 L522 R523	E515-K519 WeakPolarHBondContact O-CB 3.5Å; E515-K519 WeakPolarHBondContact O-CE 3.37Å; E515-K519 WeakPolarHBondContact O-CG 3.49Å; E515-K519 PolarHBondContact O-N 3.47Å; E515-K519 IonicContact OE2-NZ 2.89Å; D516-K519 PolarHBondContact O-N 2.8Å; D516-K519 VanDerWaalsContact OD1-CD 3.25Å; D516-K519 WeakPolarHBondContact OD1-CD 3.44Å; D516-K519 WeakPolarHBondContact OD1-CE 3.44Å; D516-K519 IonicContact OD1-NZ 3.34Å; D516-K519 PolarHBondContact OD1-NZ 3.33Å; K519-L522 PolarHBondContact O-N 3.22Å; K519-R523 WeakPolarHBondContact O-CB 3.34Å; K519-R523 WeakPolarHBondContact O-CG 3.43Å; K519-R523 PolarHBondContact O-N 2.99Å
520	T	95.3	Very high	94.8	Very high	68 Å²	68	100.5 Å²	100.5	42%	0.417	44%	0.443	S	S	.	.	H	α-helix	trans	-68.8	-46	176.6	49.3	0	0	0	0	112.3	D516 K517 Q518 L522 R523 E524	D516-T520 WeakPolarHBondContact O-CB 3.48Å; D516-T520 WeakPolarHBondContact O-CG2 3.2Å; D516-T520 PolarHBondContact O-N 3.05Å; D516-T520 PolarHBondContact O-OG1 3.05Å; K517-T520 WeakPolarHBondContact CA-OG1 3.41Å; K517-T520 PolarHBondContact O-OG1 3.4Å; Q518-T520 VanDerWaalsContact C-N 3.33Å; Q518-T520 PolarHBondContact O-N 2.88Å; T520-L522 VanDerWaalsContact C-N 3.26Å; T520-L522 PolarHBondContact O-N 3.13Å; T520-R523 WeakPolarHBondContact O-CB 3.29Å; T520-R523 PolarHBondContact O-N 3.1Å; T520-E524 WeakPolarHBondContact O-CB 3.44Å; T520-E524 PolarHBondContact O-N 3.38Å
521	L	94.4	Very high	94.9	Very high	103 Å²	103	97.4 Å²	97.4	54%	0.539	43%	0.429	S	S	.	.	H	α-helix	trans	-59.8	-34.2	172.9	-72.9	170.1	0	0	0	113	K517 Q518 R525	K517-L521 WeakPolarHBondContact O-CB 3.13Å; K517-L521 VanDerWaalsContact O-CG 3.23Å; K517-L521 WeakPolarHBondContact O-CG 3.23Å; K517-L521 PolarHBondContact O-N 2.85Å; Q518-L521 PolarHBondContact O-N 2.89Å; L521-R525 WeakPolarHBondContact O-CB 3.47Å; L521-R525 PolarHBondContact O-N 3.11Å
522	L	95.1	Very high	94.9	Very high	74 Å²	74	93.7 Å²	93.7	39%	0.387	41%	0.412	S	S	.	.	H	α-helix	trans	-74.6	-38.9	174.4	-73.6	170.8	0	0	0	112.7	Q518 K519 T520 E524 R526	Q518-L522 VanDerWaalsContact O-CB 3.3Å; Q518-L522 WeakPolarHBondContact O-CB 3.26Å; Q518-L522 VanDerWaalsContact O-CG 3.23Å; Q518-L522 WeakPolarHBondContact O-CG 3.47Å; Q518-L522 PolarHBondContact O-N 3.35Å; K519-L522 PolarHBondContact O-N 3.22Å; T520-L522 VanDerWaalsContact C-N 3.26Å; T520-L522 PolarHBondContact O-N 3.13Å; L522-E524 VanDerWaalsContact C-N 3.29Å; L522-R526 WeakPolarHBondContact O-CB 3.48Å; L522-R526 WeakPolarHBondContact O-CD 3.26Å; L522-R526 WeakPolarHBondContact O-CG 3.46Å; L522-R526 PolarHBondContact O-N 3.15Å
523	R	95.1	Very high	95	Very high	158 Å²	158	92.7 Å²	92.7	60%	0.596	41%	0.407	S	S	*	.	H	α-helix	trans	-58.3	-44.1	169.9	-74.3	166.4	-175.6	169.8	4.2	110.1	K519 T520 R526 R527	K519-R523 WeakPolarHBondContact O-CB 3.34Å; K519-R523 WeakPolarHBondContact O-CG 3.43Å; K519-R523 PolarHBondContact O-N 2.99Å; T520-R523 WeakPolarHBondContact O-CB 3.29Å; T520-R523 PolarHBondContact O-N 3.1Å; R523-R526 WeakPolarHBondContact O-CB 3.41Å; R523-R526 PolarHBondContact O-N 3.08Å; R523-R527 PolarHBondContact O-N 3.15Å
524	E	93.6	Very high	95.2	Very high	52 Å²	52	91 Å²	91	24%	0.243	40%	0.403	C	S	.	.	H	α-helix	trans	-64.1	-50.8	178.2	-175.4	54.8	-151.6	0	0	112.2	T520 L522 R526 R527 Q528	T520-E524 WeakPolarHBondContact O-CB 3.44Å; T520-E524 PolarHBondContact O-N 3.38Å; L522-E524 VanDerWaalsContact C-N 3.29Å; E524-R526 PolarHBondContact O-N 3.1Å; E524-R527 WeakPolarHBondContact O-CA 3.16Å; E524-R527 WeakPolarHBondContact O-CB 3.45Å; E524-R527 PolarHBondContact O-N 2.69Å; E524-R527 IonicContact OE1-CZ 3.49Å; E524-R527 IonicContact OE1-NE 3.26Å; E524-R527 PolarHBondContact OE1-NE 3.39Å; E524-R527 IonicContact OE1-NH2 2.82Å; E524-R527 PolarHBondContact OE1-NH2 2.99Å; E524-R527 IonicContact OE2-CZ 3.83Å; E524-R527 IonicContact OE2-NE 2.67Å; E524-R527 PolarHBondContact OE2-NE 3.46Å; E524-R527 IonicContact OE2-NH2 2.63Å; E524-R527 PolarHBondContact OE2-NH2 2.85Å; E524-Q528 HydrophobicContact CG-CG 4.45Å; E524-Q528 WeakPolarHBondContact O-CG 3.19Å; E524-Q528 PolarHBondContact O-N 2.91Å; E524-Q528 WeakPolarHBondContact OE1-CG 3.44Å; E524-Q528 PolarHBondContact OE1-NE2 3.45Å
525	R	94.3	Very high	95.4	Very high	152 Å²	152	87.7 Å²	87.7	57%	0.574	39%	0.388	S	S	*	.	H	α-helix	trans	-58.1	-33.5	176.6	-166	-173.9	-58.7	177.8	2.9	112.5	L521 R529	L521-R525 WeakPolarHBondContact O-CB 3.47Å; L521-R525 PolarHBondContact O-N 3.11Å; R525-R529 PolarHBondContact O-N 2.76Å
526	R	95.4	Very high	95.5	Very high	160 Å²	160	86.7 Å²	86.7	60%	0.604	38%	0.383	S	S	*	.	H	α-helix	trans	-70	-43	173	-70.9	167.3	-171.8	-163	4.2	111.7	L522 R523 E524 R529 K530	L522-R526 WeakPolarHBondContact O-CB 3.48Å; L522-R526 WeakPolarHBondContact O-CD 3.26Å; L522-R526 WeakPolarHBondContact O-CG 3.46Å; L522-R526 PolarHBondContact O-N 3.15Å; R523-R526 WeakPolarHBondContact O-CB 3.41Å; R523-R526 PolarHBondContact O-N 3.08Å; E524-R526 PolarHBondContact O-N 3.1Å; R526-R529 PolarHBondContact O-N 3.12Å; R526-K530 PolarHBondContact O-N 3.13Å
527	R	95	Very high	95.7	Very high	142 Å²	142	89.8 Å²	89.8	54%	0.536	39%	0.393	S	S	.	.	H	α-helix	trans	-58.9	-50.6	175.2	-175.2	173.1	72.4	162.3	8.1	111.2	R523 E524 R529 K530 N531	R523-R527 PolarHBondContact O-N 3.15Å; E524-R527 WeakPolarHBondContact O-CA 3.16Å; E524-R527 WeakPolarHBondContact O-CB 3.45Å; E524-R527 PolarHBondContact O-N 2.69Å; E524-R527 IonicContact OE1-CZ 3.49Å; E524-R527 IonicContact OE1-NE 3.26Å; E524-R527 PolarHBondContact OE1-NE 3.39Å; E524-R527 IonicContact OE1-NH2 2.82Å; E524-R527 PolarHBondContact OE1-NH2 2.99Å; E524-R527 IonicContact OE2-CZ 3.83Å; E524-R527 IonicContact OE2-NE 2.67Å; E524-R527 PolarHBondContact OE2-NE 3.46Å; E524-R527 IonicContact OE2-NH2 2.63Å; E524-R527 PolarHBondContact OE2-NH2 2.85Å; R527-R529 VanDerWaalsContact C-N 3.28Å; R527-R529 PolarHBondContact O-N 2.91Å; R527-K530 WeakPolarHBondContact O-CB 3.15Å; R527-K530 PolarHBondContact O-N 3.49Å; R527-K530 VanDerWaalsContact O-N 3.09Å; R527-N531 PolarHBondContact O-N 2.68Å; R527-N531 PolarHBondContact O-ND2 3.05Å; R527-N531 PolarHBondContact O-OD1 3.32Å
528	Q	95.4	Very high	95.8	Very high	29 Å²	29	85.7 Å²	85.7	14%	0.136	38%	0.375	C	S	.	.	H	α-helix	trans	-61.2	-34.1	178	-63.4	175.1	-2	0	0	112.9	E524 R532 Q573	E524-Q528 HydrophobicContact CG-CG 4.45Å; E524-Q528 WeakPolarHBondContact O-CG 3.19Å; E524-Q528 PolarHBondContact O-N 2.91Å; E524-Q528 WeakPolarHBondContact OE1-CG 3.44Å; E524-Q528 PolarHBondContact OE1-NE2 3.45Å; Q528-R532 PolarHBondContact O-N 2.97Å; Q528-Q573 HydrophobicContact CG-CB 4.37Å; Q528-Q573 HydrophobicContact CG-CG 3.9Å
529	R	95.5	Very high	95.9	Very high	130 Å²	130	81 Å²	81	49%	0.491	35%	0.353	S	S	.	.	H	α-helix	trans	-67.6	-47.1	171.8	-160.6	-162.9	-63.5	123.2	-2.1	111.6	R525 R526 R527 N531 R532 E533	R525-R529 PolarHBondContact O-N 2.76Å; R526-R529 PolarHBondContact O-N 3.12Å; R527-R529 VanDerWaalsContact C-N 3.28Å; R527-R529 PolarHBondContact O-N 2.91Å; R529-N531 PolarHBondContact O-N 2.74Å; R529-R532 WeakPolarHBondContact O-CB 3.29Å; R529-R532 PolarHBondContact O-N 3.29Å; R529-R532 VanDerWaalsContact O-N 3.12Å; R529-E533 WeakPolarHBondContact CD-OE1 3.36Å; R529-E533 HydrophobicContact CG-CG 4.49Å; R529-E533 WeakPolarHBondContact CG-OE1 3.35Å; R529-E533 WeakPolarHBondContact O-CG 3.33Å; R529-E533 PolarHBondContact O-N 3.44Å
530	K	96.3	Very high	96	Very high	144 Å²	144	80.4 Å²	80.4	63%	0.626	35%	0.353	S	S	*	.	H	α-helix	trans	-58.2	-34.8	175.7	-75.6	-170.5	172.9	-167.7	0	112.8	R526 R527 E533 S534	R526-K530 PolarHBondContact O-N 3.13Å; R527-K530 WeakPolarHBondContact O-CB 3.15Å; R527-K530 PolarHBondContact O-N 3.49Å; R527-K530 VanDerWaalsContact O-N 3.09Å; K530-E533 PolarHBondContact O-N 3.43Å; K530-S534 WeakPolarHBondContact O-CB 3.1Å; K530-S534 PolarHBondContact O-N 3Å; K530-S534 PolarHBondContact O-OG 3.25Å
531	N	96.7	Very high	96.1	Very high	32 Å²	32	80.8 Å²	80.8	17%	0.171	35%	0.351	C	S	.	.	H	α-helix	trans	-69.4	-37.3	177.5	-64.1	-12.4	0	0	0	112	R527 R529 S534 F535 S569 M570 Q573	R527-N531 PolarHBondContact O-N 2.68Å; R527-N531 PolarHBondContact O-ND2 3.05Å; R527-N531 PolarHBondContact O-OD1 3.32Å; R529-N531 PolarHBondContact O-N 2.74Å; N531-S534 PolarHBondContact O-OG 2.98Å; N531-S534 VanDerWaalsContact O-OG 3.04Å; N531-F535 PolarHBondContact O-N 3.22Å; N531-F535 VanDerWaalsContact O-N 3.1Å; N531-S569 WeakPolarHBondContact CB-O 3.08Å; N531-S569 PolarHBondContact ND2-O 2.85Å; N531-M570 HydrophobicContact CB-CG 4.29Å; N531-M570 WeakPolarHBondContact O-CG 3.46Å; N531-Q573 PolarHBondContact ND2-NE2 3.22Å; N531-Q573 VanDerWaalsContact ND2-NE2 3.15Å
532	R	96.2	Very high	96.2	Very high	52 Å²	52	76.3 Å²	76.3	20%	0.196	33%	0.327	C	S	.	.	H	α-helix	trans	-66.3	-42.6	168.6	-75.8	-177.1	-75.2	-98.6	0.3	112.6	Q528 R529 S534 F535 Q536 M570 P574 L581	Q528-R532 PolarHBondContact O-N 2.97Å; R529-R532 WeakPolarHBondContact O-CB 3.29Å; R529-R532 PolarHBondContact O-N 3.29Å; R529-R532 VanDerWaalsContact O-N 3.12Å; R532-S534 VanDerWaalsContact C-N 3.32Å; R532-S534 PolarHBondContact O-N 3.36Å; R532-F535 PolarHBondContact O-N 2.68Å; R532-Q536 WeakPolarHBondContact O-CB 3.26Å; R532-Q536 PolarHBondContact O-N 3.49Å; R532-M570 HydrophobicContact CB-SD 4.44Å; R532-M570 HydrophobicContact CG-CE 3.62Å; R532-M570 HydrophobicContact CG-CG 4.48Å; R532-M570 HydrophobicContact CG-SD 3.93Å; R532-P574 PolarHBondContact NH1-O 2.97Å; R532-L581 HydrophobicContact CB-CD1 4.14Å; R532-L581 HydrophobicContact CG-CD1 4.11Å
533	E	96.6	Very high	96.2	Very high	97 Å²	97	74.6 Å²	74.6	45%	0.453	32%	0.317	S	S	.	.	H	α-helix	trans	-64.2	-34.4	177	-69.5	161.8	-169.5	0	0	112.2	R529 K530 K537	R529-E533 WeakPolarHBondContact CD-OE1 3.36Å; R529-E533 HydrophobicContact CG-CG 4.49Å; R529-E533 WeakPolarHBondContact CG-OE1 3.35Å; R529-E533 WeakPolarHBondContact O-CG 3.33Å; R529-E533 PolarHBondContact O-N 3.44Å; K530-E533 PolarHBondContact O-N 3.43Å; E533-K537 WeakPolarHBondContact O-CG 3.48Å; E533-K537 PolarHBondContact O-N 3.19Å
534	S	97.4	Very high	96.2	Very high	36 Å²	36	73.1 Å²	73.1	25%	0.252	32%	0.321	S	S	.	.	H	α-helix	trans	-76.7	-37.9	177.1	66.8	0	0	0	0	112.8	K530 N531 R532 Q536 K537 F538 R566	K530-S534 WeakPolarHBondContact O-CB 3.1Å; K530-S534 PolarHBondContact O-N 3Å; K530-S534 PolarHBondContact O-OG 3.25Å; N531-S534 PolarHBondContact O-OG 2.98Å; N531-S534 VanDerWaalsContact O-OG 3.04Å; R532-S534 VanDerWaalsContact C-N 3.32Å; R532-S534 PolarHBondContact O-N 3.36Å; S534-Q536 VanDerWaalsContact C-N 3.34Å; S534-K537 PolarHBondContact O-N 3.12Å; S534-F538 PolarHBondContact O-N 2.86Å; S534-F538 VanDerWaalsContact O-N 3.08Å; S534-R566 WeakPolarHBondContact O-CD 3.34Å
535	F	97.8	Very high	96.1	Very high	0 Å²	0	77.5 Å²	77.5	0%	0	34%	0.341	C	S	.	.	H	α-helix	trans	-67.7	-34	171.1	-173.7	-99.2	0	0	0	112	N531 R532 K537 F538 L539 L561 F567 M570 P578 L581	N531-F535 PolarHBondContact O-N 3.22Å; N531-F535 VanDerWaalsContact O-N 3.1Å; R532-F535 PolarHBondContact O-N 2.68Å; F535-K537 PolarHBondContact O-N 3.25Å; F535-F538 AromaticContact CD2-CD1 3.97Å; F535-F538 HydrophobicContact CD2-CD1 3.97Å; F535-F538 AromaticContact CE2-CD1 3.91Å; F535-F538 HydrophobicContact CE2-CD1 3.91Å; F535-F538 HydrophobicContact CE2-CE1 4.39Å; F535-F538 WeakPolarHBondContact O-CB 3.47Å; F535-F538 PolarHBondContact O-N 3.06Å; F535-F538 VanDerWaalsContact O-N 3.15Å; F535-L539 HydrophobicContact CD1-CD1 4.3Å; F535-L539 HydrophobicContact CD1-CG 4.4Å; F535-L539 HydrophobicContact CE1-CD1 3.95Å; F535-L539 HydrophobicContact CE1-CD2 4.09Å; F535-L539 HydrophobicContact CE1-CG 4.07Å; F535-L539 HydrophobicContact CZ-CD2 4.13Å; F535-L539 PolarHBondContact O-N 3.08Å; F535-L539 VanDerWaalsContact O-N 3.11Å; F535-L561 HydrophobicContact CE2-CD2 4.15Å; F535-L561 HydrophobicContact CZ-CD2 4.03Å; F535-F567 HydrophobicContact CD2-CB 4.2Å; F535-F567 HydrophobicContact CE2-CB 3.91Å; F535-F567 AromaticContact CE2-CD2 3.94Å; F535-F567 HydrophobicContact CE2-CD2 3.94Å; F535-F567 HydrophobicContact CE2-CG 4.44Å; F535-F567 HydrophobicContact CZ-CD2 4.31Å; F535-M570 HydrophobicContact CB-CG 4.18Å; F535-M570 HydrophobicContact CB-SD 3.44Å; F535-M570 WeakPolarHBondContact CB-SD 3.34Å; F535-M570 HydrophobicContact CD1-SD 3.85Å; F535-M570 HydrophobicContact CG-SD 3.72Å; F535-P578 HydrophobicContact CD1-CB 4.45Å; F535-P578 HydrophobicContact CE1-CB 3.87Å; F535-P578 WeakPolarHBondContact CE1-O 3.29Å; F535-P578 HydrophobicContact CE2-CB 4.3Å; F535-P578 HydrophobicContact CZ-CB 3.79Å; F535-L581 HydrophobicContact CD1-CB 4.22Å; F535-L581 HydrophobicContact CD1-CD1 4Å; F535-L581 HydrophobicContact CE1-CB 4.29Å
536	Q	97.1	Very high	95.9	Very high	55 Å²	55	72.4 Å²	72.4	26%	0.257	34%	0.336	S	S	.	.	H	α-helix	trans	-61.1	-45.5	172.8	-175	53.8	69.9	0	0	111.3	R532 S534 F538 L539 D540	R532-Q536 WeakPolarHBondContact O-CB 3.26Å; R532-Q536 PolarHBondContact O-N 3.49Å; S534-Q536 VanDerWaalsContact C-N 3.34Å; Q536-F538 VanDerWaalsContact C-N 3.25Å; Q536-F538 PolarHBondContact O-N 3.05Å; Q536-L539 WeakPolarHBondContact O-CB 3.26Å; Q536-L539 PolarHBondContact O-N 3.47Å; Q536-D540 PolarHBondContact O-N 3.43Å; Q536-D540 VanDerWaalsContact O-OD2 3.14Å
537	K	97.6	Very high	95.8	Very high	134 Å²	134	69.7 Å²	69.7	58%	0.583	33%	0.33	S	S	*	.	H	α-helix	trans	-61.1	-31.4	173.1	-72.5	-179.2	176.3	-166.6	0	113.7	E533 S534 F535 D540 E541	E533-K537 WeakPolarHBondContact O-CG 3.48Å; E533-K537 PolarHBondContact O-N 3.19Å; S534-K537 PolarHBondContact O-N 3.12Å; F535-K537 PolarHBondContact O-N 3.25Å; K537-D540 WeakPolarHBondContact O-CB 3.45Å; K537-D540 PolarHBondContact O-N 2.96Å; K537-E541 WeakPolarHBondContact O-CB 3.24Å; K537-E541 VanDerWaalsContact O-CG 3.24Å; K537-E541 WeakPolarHBondContact O-CG 3.48Å; K537-E541 PolarHBondContact O-N 3.36Å
538	F	97.7	Very high	95.9	Very high	13 Å²	13	63 Å²	63	6%	0.057	31%	0.305	C	S	.	.	H	α-helix	trans	-66.2	-37.7	173.4	-178.8	-147.7	0	0	0	112	S534 F535 Q536 D540 E541 L542 L561 D564	S534-F538 PolarHBondContact O-N 2.86Å; S534-F538 VanDerWaalsContact O-N 3.08Å; F535-F538 AromaticContact CD2-CD1 3.97Å; F535-F538 HydrophobicContact CD2-CD1 3.97Å; F535-F538 AromaticContact CE2-CD1 3.91Å; F535-F538 HydrophobicContact CE2-CD1 3.91Å; F535-F538 HydrophobicContact CE2-CE1 4.39Å; F535-F538 WeakPolarHBondContact O-CB 3.47Å; F535-F538 PolarHBondContact O-N 3.06Å; F535-F538 VanDerWaalsContact O-N 3.15Å; Q536-F538 VanDerWaalsContact C-N 3.25Å; Q536-F538 PolarHBondContact O-N 3.05Å; F538-D540 VanDerWaalsContact C-N 3.34Å; F538-E541 PolarHBondContact O-N 2.89Å; F538-L542 HydrophobicContact CD2-CD1 4.04Å; F538-L542 HydrophobicContact CD2-CG 4Å; F538-L542 HydrophobicContact CE1-CD1 4.28Å; F538-L542 HydrophobicContact CE2-CD1 3.71Å; F538-L542 HydrophobicContact CE2-CD2 3.98Å; F538-L542 HydrophobicContact CE2-CG 3.75Å; F538-L542 HydrophobicContact CG-CD1 4.45Å; F538-L542 HydrophobicContact CZ-CD1 3.84Å; F538-L542 HydrophobicContact CZ-CG 4.36Å; F538-L542 WeakPolarHBondContact O-CB 3.06Å; F538-L542 VanDerWaalsContact O-CG 3.27Å; F538-L542 WeakPolarHBondContact O-CG 3.49Å; F538-L542 PolarHBondContact O-N 3.02Å; F538-L561 HydrophobicContact CD1-CD2 4.11Å; F538-L561 HydrophobicContact CE1-CD2 3.71Å; F538-L561 HydrophobicContact CZ-CD2 4.29Å; F538-D564 HydrophobicContact CD1-CB 3.98Å; F538-D564 HydrophobicContact CE1-CB 3.28Å; F538-D564 HydrophobicContact CE2-CB 4.21Å; F538-D564 HydrophobicContact CZ-CB 3.42Å; F538-D564 VanDerWaalsContact CZ-CB 3.42Å
539	L	97.5	Very high	95.9	Very high	0 Å²	0	63.8 Å²	63.8	0%	0	31%	0.308	C	S	.	.	H	α-helix	trans	-65.2	-38.9	171.8	-59.3	176.7	0	0	0	111.3	F535 Q536 L542 H543 L548 L561 L581 F582 Y585	F535-L539 HydrophobicContact CD1-CD1 4.3Å; F535-L539 HydrophobicContact CD1-CG 4.4Å; F535-L539 HydrophobicContact CE1-CD1 3.95Å; F535-L539 HydrophobicContact CE1-CD2 4.09Å; F535-L539 HydrophobicContact CE1-CG 4.07Å; F535-L539 HydrophobicContact CZ-CD2 4.13Å; F535-L539 PolarHBondContact O-N 3.08Å; F535-L539 VanDerWaalsContact O-N 3.11Å; Q536-L539 WeakPolarHBondContact O-CB 3.26Å; Q536-L539 PolarHBondContact O-N 3.47Å; L539-L542 PolarHBondContact O-N 3.33Å; L539-H543 WeakPolarHBondContact O-CB 3.23Å; L539-H543 PolarHBondContact O-N 3.3Å; L539-L548 HydrophobicContact CB-CD2 3.82Å; L539-L548 HydrophobicContact CD2-CD2 3.76Å; L539-L548 HydrophobicContact CG-CD2 4.35Å; L539-L561 HydrophobicContact CD2-CD2 3.8Å; L539-L581 HydrophobicContact CD1-CB 4.39Å; L539-F582 HydrophobicContact CD2-CD2 4.2Å; L539-Y585 HydrophobicContact CB-CD1 4.11Å; L539-Y585 HydrophobicContact CB-CD2 4.43Å; L539-Y585 HydrophobicContact CB-CE1 4.23Å; L539-Y585 HydrophobicContact CB-CG 4.19Å; L539-Y585 HydrophobicContact CD1-CG 4.22Å
540	D	96.9	Very high	95.9	Very high	57 Å²	57	57.7 Å²	57.7	31%	0.305	29%	0.286	S	S	.	.	H	α-helix	trans	-62.3	-47.7	173.6	-59	-46.9	0	0	0	111.9	Q536 K537 F538 L542 H543 D544 Y585	Q536-D540 PolarHBondContact O-N 3.43Å; Q536-D540 VanDerWaalsContact O-OD2 3.14Å; K537-D540 WeakPolarHBondContact O-CB 3.45Å; K537-D540 PolarHBondContact O-N 2.96Å; F538-D540 VanDerWaalsContact C-N 3.34Å; D540-L542 VanDerWaalsContact C-N 3.33Å; D540-L542 PolarHBondContact O-N 3Å; D540-H543 PolarHBondContact O-N 3.43Å; D540-H543 VanDerWaalsContact O-N 3.13Å; D540-D544 PolarHBondContact O-N 3.29Å; D540-Y585 WeakPolarHBondContact CA-OH 3.3Å; D540-Y585 WeakPolarHBondContact OD1-CE2 3.4Å; D540-Y585 VanDerWaalsContact OD1-CZ 3.28Å; D540-Y585 PolarHBondContact OD1-OH 3.47Å
541	E	96.5	Very high	95.7	Very high	77 Å²	77	55 Å²	55	36%	0.36	28%	0.277	S	S	.	.	H	α-helix	trans	-57	-42.8	174.6	-71.8	156.7	-148.1	0	0	112.3	K537 F538 H545 R566	K537-E541 WeakPolarHBondContact O-CB 3.24Å; K537-E541 VanDerWaalsContact O-CG 3.24Å; K537-E541 WeakPolarHBondContact O-CG 3.48Å; K537-E541 PolarHBondContact O-N 3.36Å; F538-E541 PolarHBondContact O-N 2.89Å; E541-H545 WeakPolarHBondContact O-CB 3.25Å; E541-H545 PolarHBondContact O-CD2 3.47Å; E541-H545 PolarHBondContact O-N 3.21Å; E541-R566 IonicContact OE1-CZ 2.78Å; E541-R566 IonicContact OE1-NH1 2.82Å; E541-R566 PolarHBondContact OE1-NH1 2.83Å; E541-R566 IonicContact OE2-CZ 2.65Å; E541-R566 IonicContact OE2-NH1 3.05Å; E541-R566 PolarHBondContact OE2-NH1 3.13Å; E541-R566 IonicContact OE2-NH2 2.65Å; E541-R566 PolarHBondContact OE2-NH2 2.81Å
542	L	96.5	Very high	95.7	Very high	8 Å²	8	53.8 Å²	53.8	4%	0.042	27%	0.271	C	S	.	.	H	α-helix	trans	-68.2	-32.9	177.1	-70.6	170	0	0	0	112.7	F538 L539 D540 G546 Q547 L548 M557 T560 L561	F538-L542 HydrophobicContact CD2-CD1 4.04Å; F538-L542 HydrophobicContact CD2-CG 4Å; F538-L542 HydrophobicContact CE1-CD1 4.28Å; F538-L542 HydrophobicContact CE2-CD1 3.71Å; F538-L542 HydrophobicContact CE2-CD2 3.98Å; F538-L542 HydrophobicContact CE2-CG 3.75Å; F538-L542 HydrophobicContact CG-CD1 4.45Å; F538-L542 HydrophobicContact CZ-CD1 3.84Å; F538-L542 HydrophobicContact CZ-CG 4.36Å; F538-L542 WeakPolarHBondContact O-CB 3.06Å; F538-L542 VanDerWaalsContact O-CG 3.27Å; F538-L542 WeakPolarHBondContact O-CG 3.49Å; F538-L542 PolarHBondContact O-N 3.02Å; L539-L542 PolarHBondContact O-N 3.33Å; D540-L542 VanDerWaalsContact C-N 3.33Å; D540-L542 PolarHBondContact O-N 3Å; L542-G546 PolarHBondContact O-N 2.89Å; L542-Q547 HydrophobicContact CD2-CB 4.22Å; L542-Q547 VanDerWaalsContact CD2-OE1 3.27Å; L542-Q547 WeakPolarHBondContact O-CA 3.06Å; L542-Q547 PolarHBondContact O-N 3.06Å; L542-L548 HydrophobicContact CB-CB 3.74Å; L542-L548 HydrophobicContact CB-CD2 4.41Å; L542-L548 PolarHBondContact O-N 2.92Å; L542-M557 HydrophobicContact CD1-CE 4.31Å; L542-T560 HydrophobicContact CD2-CG2 4.04Å; L542-L561 HydrophobicContact CD1-CD2 3.5Å; L542-L561 HydrophobicContact CD1-CG 4.47Å
543	H	95.8	Very high	95.7	Very high	38 Å²	38	53.8 Å²	53.8	18%	0.176	28%	0.279	C	S	.	.	H	α-helix	trans	-72.1	-43.8	175.3	163.5	-81.5	0	0	0	111.7	L539 D540 H545 G546 L548 Y585 R592	L539-H543 WeakPolarHBondContact O-CB 3.23Å; L539-H543 PolarHBondContact O-N 3.3Å; D540-H543 PolarHBondContact O-N 3.43Å; D540-H543 VanDerWaalsContact O-N 3.13Å; H543-H545 PolarHBondContact O-N 2.81Å; H543-G546 WeakPolarHBondContact O-CA 3.02Å; H543-G546 PolarHBondContact O-N 3.31Å; H543-L548 WeakPolarHBondContact CA-O 3.31Å; H543-L548 HydrophobicContact CB-CB 4.43Å; H543-Y585 HydrophobicContact CB-CE1 4Å; H543-R592 PolarHBondContact NE2-NH2 3.23Å; H543-R592 VanDerWaalsContact NE2-NH2 3.13Å
544	D	93.6	Very high	95.7	Very high	127 Å²	127	52 Å²	52	68%	0.679	27%	0.268	S	S	*	.	H	α-helix	trans	-68.4	-24.4	178.5	-69.5	-0	0	0	0	112	D540 G546	D540-D544 PolarHBondContact O-N 3.29Å; D544-G546 VanDerWaalsContact C-N 3.34Å
545	H	92.6	Very high	95.6	Very high	144 Å²	144	58.3 Å²	58.3	67%	0.667	30%	0.295	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.3	1.3	166.8	-69.9	-41.6	0	0	0	114.6	E541 H543 Q547	E541-H545 WeakPolarHBondContact O-CB 3.25Å; E541-H545 PolarHBondContact O-CD2 3.47Å; E541-H545 PolarHBondContact O-N 3.21Å; H543-H545 PolarHBondContact O-N 2.81Å; H545-Q547 HydrophobicContact CB-CG 4.32Å; H545-Q547 PolarHBondContact O-N 3.29Å
546	G	90.7	Very high	95.4	Very high	45 Å²	45	64 Å²	64	46%	0.464	32%	0.322	S	S	.	.	T	Hydrogen-bonded Turn	trans	69.1	8.3	179.8	0	0	0	0	0	115.3	L542 H543 D544	L542-G546 PolarHBondContact O-N 2.89Å; H543-G546 WeakPolarHBondContact O-CA 3.02Å; H543-G546 PolarHBondContact O-N 3.31Å; D544-G546 VanDerWaalsContact C-N 3.34Å
547	Q	93.6	Very high	95.4	Very high	103 Å²	103	61.9 Å²	61.9	48%	0.481	31%	0.312	S	S	.	.	S	Bend	trans	-80.4	-28.2	177.8	-61.2	-173.3	-0.8	0	0	112	L542 H545 M557	L542-Q547 HydrophobicContact CD2-CB 4.22Å; L542-Q547 VanDerWaalsContact CD2-OE1 3.27Å; L542-Q547 WeakPolarHBondContact O-CA 3.06Å; L542-Q547 PolarHBondContact O-N 3.06Å; H545-Q547 HydrophobicContact CB-CG 4.32Å; H545-Q547 PolarHBondContact O-N 3.29Å; Q547-M557 HydrophobicContact CB-CE 4.32Å; Q547-M557 VanDerWaalsContact O-CE 3.29Å; Q547-M557 WeakPolarHBondContact O-CE 3.39Å; Q547-M557 VanDerWaalsContact O-SD 3.35Å
548	L	96.3	Very high	95.3	Very high	2 Å²	2	60.6 Å²	60.6	1%	0.01	30%	0.304	C	S	.	.	S	Bend	trans	-113.1	128.1	175.4	-178.1	59.4	0	0	0	110.5	L539 L542 H543 M557 F582 Y585 V586	L539-L548 HydrophobicContact CB-CD2 3.82Å; L539-L548 HydrophobicContact CD2-CD2 3.76Å; L539-L548 HydrophobicContact CG-CD2 4.35Å; L542-L548 HydrophobicContact CB-CB 3.74Å; L542-L548 HydrophobicContact CB-CD2 4.41Å; L542-L548 PolarHBondContact O-N 2.92Å; H543-L548 WeakPolarHBondContact CA-O 3.31Å; H543-L548 HydrophobicContact CB-CB 4.43Å; L548-M557 HydrophobicContact CB-CE 4.25Å; L548-M557 HydrophobicContact CD1-CE 4.49Å; L548-M557 HydrophobicContact CD1-CG 4.36Å; L548-F582 HydrophobicContact CD1-CD2 4.18Å; L548-F582 HydrophobicContact CD1-CE2 3.5Å; L548-F582 HydrophobicContact CD1-CZ 4.22Å; L548-Y585 HydrophobicContact CD2-CD1 3.62Å; L548-Y585 HydrophobicContact CD2-CE1 3.75Å; L548-Y585 HydrophobicContact CG-CD1 4.29Å; L548-Y585 HydrophobicContact CG-CE1 4.34Å; L548-V586 HydrophobicContact CD1-CG2 3.9Å
549	H	95.6	Very high	95.2	Very high	45 Å²	45	64 Å²	64	21%	0.208	33%	0.327	C	S	.	.			trans	-149.2	173.4	-179.3	57.9	90.6	0	0	0	111.9	M551 S552 D634 A635	H549-M551 PolarHBondContact ND1-N 2.87Å; H549-M551 PolarHBondContact O-N 3.29Å; H549-S552 PolarHBondContact CD2-OG 3.09Å; H549-S552 PolarHBondContact N-OG 2.98Å; H549-S552 PolarHBondContact NE2-OG 3.25Å; H549-S552 WeakPolarHBondContact O-CB 3.46Å; H549-S552 PolarHBondContact O-N 3.35Å; H549-S552 PolarHBondContact O-OG 2.92Å; H549-D634 WeakPolarHBondContact CA-OD1 3.24Å; H549-D634 WeakPolarHBondContact CB-OD1 3.5Å; H549-A635 HydrophobicContact CB-CB 4.37Å
550	S	95.8	Very high	95.1	Very high	2 Å²	2	66.5 Å²	66.5	1%	0.014	34%	0.343	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59.3	-12.5	-173.6	75.2	0	0	0	0	116.2	K590 D634 N637	S550-K590 WeakPolarHBondContact O-CE 3.48Å; S550-K590 WeakPolarHBondContact O-CG 3.49Å; S550-D634 WeakPolarHBondContact CB-OD2 3.11Å; S550-D634 PolarHBondContact N-OD1 2.88Å; S550-D634 PolarHBondContact N-OD2 2.87Å; S550-D634 VanDerWaalsContact N-OD2 3.14Å; S550-D634 PolarHBondContact OG-OD2 3.28Å; S550-N637 WeakPolarHBondContact CB-OD1 3.41Å; S550-N637 PolarHBondContact OG-N 3.42Å; S550-N637 PolarHBondContact OG-OD1 3.11Å
551	M	92.5	Very high	95.1	Very high	89 Å²	89	63.8 Å²	63.8	44%	0.438	33%	0.328	S	S	.	.	T	Hydrogen-bonded Turn	trans	-109	-6.9	177.3	-61.3	-172.8	74.4	0	0	114.1	H549 K639 L640	H549-M551 PolarHBondContact ND1-N 2.87Å; H549-M551 PolarHBondContact O-N 3.29Å; M551-K639 HydrophobicContact SD-CB 4.42Å; M551-L640 HydrophobicContact CE-CD2 3.95Å; M551-L640 HydrophobicContact CG-CD1 4Å; M551-L640 HydrophobicContact CG-CD2 4.27Å; M551-L640 HydrophobicContact CG-CG 3.99Å; M551-L640 HydrophobicContact SD-CD1 4.38Å; M551-L640 HydrophobicContact SD-CD2 3.74Å; M551-L640 HydrophobicContact SD-CG 3.69Å
552	S	96.2	Very high	95	Very high	6 Å²	6	61.8 Å²	61.8	4%	0.042	32%	0.323	C	S	.	.			trans	-63.3	137.5	-177.1	-53.2	0	0	0	0	111.5	H549	H549-S552 PolarHBondContact CD2-OG 3.09Å; H549-S552 PolarHBondContact N-OG 2.98Å; H549-S552 PolarHBondContact NE2-OG 3.25Å; H549-S552 WeakPolarHBondContact O-CB 3.46Å; H549-S552 PolarHBondContact O-N 3.35Å; H549-S552 PolarHBondContact O-OG 2.92Å
553	S	95.6	Very high	95	Very high	52 Å²	52	66.2 Å²	66.2	36%	0.364	35%	0.354	S	S	.	.			trans	-94.3	149.9	178.3	73.9	0	0	0	0	112.2	M555 E556 M557	S553-M555 VanDerWaalsContact C-N 3.26Å; S553-M555 PolarHBondContact O-N 3.27Å; S553-E556 PolarHBondContact N-OE2 2.91Å; S553-E556 VanDerWaalsContact N-OE2 3.09Å; S553-E556 PolarHBondContact O-N 2.92Å; S553-E556 WeakPolarHBondContact OG-CB 3.14Å; S553-E556 PolarHBondContact OG-N 3.21Å; S553-E556 PolarHBondContact OG-OE2 3.08Å; S553-E556 VanDerWaalsContact OG-OE2 3.08Å; S553-M557 WeakPolarHBondContact O-CG 3.29Å; S553-M557 PolarHBondContact O-N 3.01Å
554	W	96.1	Very high	95	Very high	60 Å²	60	66 Å²	66	23%	0.227	36%	0.355	C	S	.	.	H	α-helix	trans	-59.1	-39.5	176.3	174.2	-101.7	0	0	0	112.1	E556 M557 Y558 L561 F567 P578 L579 F582	W554-E556 VanDerWaalsContact C-N 3.32Å; W554-E556 PolarHBondContact O-N 3.4Å; W554-M557 PolarHBondContact O-N 2.94Å; W554-Y558 AromaticContact CE2-CD2 3.86Å; W554-Y558 AromaticContact CZ2-CD2 3.77Å; W554-Y558 HydrophobicContact CZ2-CD2 3.77Å; W554-Y558 HydrophobicContact CZ2-CE2 4.33Å; W554-Y558 AromaticContact NE1-CD2 3.77Å; W554-Y558 WeakPolarHBondContact O-CA 3.2Å; W554-Y558 WeakPolarHBondContact O-CB 3.41Å; W554-Y558 PolarHBondContact O-N 3.44Å; W554-L561 HydrophobicContact CE3-CD1 3.89Å; W554-L561 HydrophobicContact CH2-CD1 4.28Å; W554-L561 HydrophobicContact CZ3-CD1 3.56Å; W554-F567 AromaticContact CH2-CE2 3.88Å; W554-F567 HydrophobicContact CH2-CE2 3.88Å; W554-F567 HydrophobicContact CZ2-CE2 4.11Å; W554-P578 HydrophobicContact CH2-CB 4.09Å; W554-L579 HydrophobicContact CB-CD1 4.02Å; W554-L579 HydrophobicContact CD2-CD1 3.39Å; W554-L579 HydrophobicContact CE3-CD1 3.85Å; W554-L579 HydrophobicContact CG-CD1 3.46Å; W554-L579 VanDerWaalsContact CG-CD1 3.46Å; W554-L579 HydrophobicContact CH2-CB 4.06Å; W554-L579 HydrophobicContact CZ2-CB 3.98Å; W554-L579 HydrophobicContact CZ2-CD1 4.3Å; W554-L579 HydrophobicContact CZ3-CB 4.4Å; W554-L579 HydrophobicContact CZ3-CD1 4.44Å; W554-F582 HydrophobicContact CB-CD1 4.22Å; W554-F582 HydrophobicContact CB-CE1 3.86Å; W554-F582 HydrophobicContact CB-CZ 4.42Å; W554-F582 HydrophobicContact CD2-CD1 4.49Å; W554-F582 HydrophobicContact CE3-CB 3.69Å; W554-F582 AromaticContact CE3-CD1 3.61Å; W554-F582 HydrophobicContact CE3-CD1 3.61Å; W554-F582 AromaticContact CE3-CD2 3.89Å; W554-F582 HydrophobicContact CE3-CD2 3.89Å; W554-F582 HydrophobicContact CE3-CE1 4.19Å; W554-F582 HydrophobicContact CE3-CE2 4.41Å; W554-F582 AromaticContact CE3-CG 3.45Å; W554-F582 HydrophobicContact CE3-CG 3.45Å; W554-F582 VanDerWaalsContact CE3-CG 3.45Å; W554-F582 HydrophobicContact CZ3-CB 3.54Å; W554-F582 HydrophobicContact CZ3-CD1 4.37Å; W554-F582 HydrophobicContact CZ3-CD2 4.2Å; W554-F582 AromaticContact CZ3-CG 3.8Å; W554-F582 HydrophobicContact CZ3-CG 3.8Å
555	M	95.9	Very high	95.1	Very high	168 Å²	168	66.9 Å²	66.9	83%	0.828	36%	0.357	S	S	*	.	H	α-helix	trans	-69.5	-31.4	-174.8	-169.4	166.5	-178.8	0	0	112.8	S553	S553-M555 VanDerWaalsContact C-N 3.26Å; S553-M555 PolarHBondContact O-N 3.27Å
556	E	94.4	Very high	95.2	Very high	119 Å²	119	62.7 Å²	62.7	56%	0.556	34%	0.335	S	S	*	.	H	α-helix	trans	-74.8	-41.2	173.7	175	179.4	-149.2	0	0	112.2	S553 W554 P559	S553-E556 PolarHBondContact N-OE2 2.91Å; S553-E556 VanDerWaalsContact N-OE2 3.09Å; S553-E556 PolarHBondContact O-N 2.92Å; S553-E556 WeakPolarHBondContact OG-CB 3.14Å; S553-E556 PolarHBondContact OG-N 3.21Å; S553-E556 PolarHBondContact OG-OE2 3.08Å; S553-E556 VanDerWaalsContact OG-OE2 3.08Å; W554-E556 VanDerWaalsContact C-N 3.32Å; W554-E556 PolarHBondContact O-N 3.4Å; E556-P559 WeakPolarHBondContact O-CD 3.48Å
557	M	95.9	Very high	95.5	Very high	11 Å²	11	61.3 Å²	61.3	5%	0.054	32%	0.316	C	S	.	.	H	α-helix	trans	-81.8	-19.9	179.8	-62.8	-55.6	-67.4	0	0	113.5	L542 Q547 L548 S553 W554 P559 T560 L561 F582	L542-M557 HydrophobicContact CD1-CE 4.31Å; Q547-M557 HydrophobicContact CB-CE 4.32Å; Q547-M557 VanDerWaalsContact O-CE 3.29Å; Q547-M557 WeakPolarHBondContact O-CE 3.39Å; Q547-M557 VanDerWaalsContact O-SD 3.35Å; L548-M557 HydrophobicContact CB-CE 4.25Å; L548-M557 HydrophobicContact CD1-CE 4.49Å; L548-M557 HydrophobicContact CD1-CG 4.36Å; S553-M557 WeakPolarHBondContact O-CG 3.29Å; S553-M557 PolarHBondContact O-N 3.01Å; W554-M557 PolarHBondContact O-N 2.94Å; M557-P559 VanDerWaalsContact C-CD 3.49Å; M557-T560 PolarHBondContact O-N 2.81Å; M557-L561 HydrophobicContact CB-CD1 3.75Å; M557-L561 HydrophobicContact CB-CG 4.2Å; M557-L561 WeakPolarHBondContact O-CB 3.4Å; M557-L561 VanDerWaalsContact O-CG 3.29Å; M557-L561 WeakPolarHBondContact O-CG 3.14Å; M557-L561 PolarHBondContact O-N 2.86Å; M557-F582 HydrophobicContact CB-CE2 3.88Å; M557-F582 HydrophobicContact CB-CZ 4.4Å; M557-F582 HydrophobicContact CG-CE2 3.9Å; M557-F582 HydrophobicContact CG-CZ 4.25Å
558	Y	96.1	Very high	95.7	Very high	107 Å²	107	59.3 Å²	59.3	42%	0.42	31%	0.313	S	S	.	.	H	α-helix	trans	-54.8	-41.8	-176.3	179.6	-93.8	0	0	0	114.8	W554 T560 L561 S562 F567	W554-Y558 AromaticContact CE2-CD2 3.86Å; W554-Y558 AromaticContact CZ2-CD2 3.77Å; W554-Y558 HydrophobicContact CZ2-CD2 3.77Å; W554-Y558 HydrophobicContact CZ2-CE2 4.33Å; W554-Y558 AromaticContact NE1-CD2 3.77Å; W554-Y558 WeakPolarHBondContact O-CA 3.2Å; W554-Y558 WeakPolarHBondContact O-CB 3.41Å; W554-Y558 PolarHBondContact O-N 3.44Å; Y558-T560 PolarHBondContact O-N 3.02Å; Y558-L561 PolarHBondContact O-N 3.44Å; Y558-S562 VanDerWaalsContact O-CB 3.26Å; Y558-S562 WeakPolarHBondContact O-CB 3.49Å; Y558-S562 PolarHBondContact O-N 2.97Å; Y558-S562 PolarHBondContact O-OG 3.47Å; Y558-F567 HydrophobicContact CE2-CE2 4.41Å; Y558-F567 AromaticContact CE2-CZ 3.84Å; Y558-F567 HydrophobicContact CE2-CZ 3.84Å
559	P	95.9	Very high	95.6	Very high	83 Å²	83	61.5 Å²	61.5	54%	0.539	33%	0.329	S	S	.	.	H	α-helix	trans	-59.9	-45.2	176.6	-23.7	35.5	0	0	0	112.5	E556 M557 S563	E556-P559 WeakPolarHBondContact O-CD 3.48Å; M557-P559 VanDerWaalsContact C-CD 3.49Å; P559-S563 PolarHBondContact O-N 2.86Å
560	T	95.1	Very high	95.6	Very high	53 Å²	53	59.7 Å²	59.7	33%	0.325	32%	0.321	S	S	.	.	H	α-helix	trans	-64.5	-50.8	175.4	-49.1	0	0	0	0	110.6	L542 M557 Y558 S562 S563	L542-T560 HydrophobicContact CD2-CG2 4.04Å; M557-T560 PolarHBondContact O-N 2.81Å; Y558-T560 PolarHBondContact O-N 3.02Å; T560-S562 PolarHBondContact O-N 3.05Å; T560-S563 PolarHBondContact O-N 3.02Å; T560-S563 PolarHBondContact O-OG 3.25Å
561	L	95.6	Very high	95.5	Very high	0 Å²	0	64.1 Å²	64.1	0%	0	34%	0.344	C	S	.	.	H	α-helix	trans	-62.1	-43.9	-176	-70.1	171.1	0	0	0	112.7	F535 F538 L539 L542 W554 M557 Y558 S563 D564 F567 F582	F535-L561 HydrophobicContact CE2-CD2 4.15Å; F535-L561 HydrophobicContact CZ-CD2 4.03Å; F538-L561 HydrophobicContact CD1-CD2 4.11Å; F538-L561 HydrophobicContact CE1-CD2 3.71Å; F538-L561 HydrophobicContact CZ-CD2 4.29Å; L539-L561 HydrophobicContact CD2-CD2 3.8Å; L542-L561 HydrophobicContact CD1-CD2 3.5Å; L542-L561 HydrophobicContact CD1-CG 4.47Å; W554-L561 HydrophobicContact CE3-CD1 3.89Å; W554-L561 HydrophobicContact CH2-CD1 4.28Å; W554-L561 HydrophobicContact CZ3-CD1 3.56Å; M557-L561 HydrophobicContact CB-CD1 3.75Å; M557-L561 HydrophobicContact CB-CG 4.2Å; M557-L561 WeakPolarHBondContact O-CB 3.4Å; M557-L561 VanDerWaalsContact O-CG 3.29Å; M557-L561 WeakPolarHBondContact O-CG 3.14Å; M557-L561 PolarHBondContact O-N 2.86Å; Y558-L561 PolarHBondContact O-N 3.44Å; L561-S563 VanDerWaalsContact C-N 3.27Å; L561-S563 PolarHBondContact O-N 2.72Å; L561-D564 PolarHBondContact O-N 3.32Å; L561-F567 WeakPolarHBondContact O-CB 3.48Å; L561-F582 HydrophobicContact CD1-CD2 3.84Å; L561-F582 HydrophobicContact CD1-CE2 4.21Å
562	S	96.1	Very high	95.4	Very high	36 Å²	36	64 Å²	64	25%	0.252	37%	0.366	S	S	.	.	H	α-helix	trans	-74.5	-14.5	-177.5	60.7	0	0	0	0	114.4	Y558 T560	Y558-S562 VanDerWaalsContact O-CB 3.26Å; Y558-S562 WeakPolarHBondContact O-CB 3.49Å; Y558-S562 PolarHBondContact O-N 2.97Å; Y558-S562 PolarHBondContact O-OG 3.47Å; T560-S562 PolarHBondContact O-N 3.05Å
563	S	95.4	Very high	95.3	Very high	100 Å²	100	65.5 Å²	65.5	70%	0.699	37%	0.372	S	S	*	.	H	α-helix	trans	-76.3	-21.7	173.5	76.2	0	0	0	0	113.8	P559 T560 L561	P559-S563 PolarHBondContact O-N 2.86Å; T560-S563 PolarHBondContact O-N 3.02Å; T560-S563 PolarHBondContact O-OG 3.25Å; L561-S563 VanDerWaalsContact C-N 3.27Å; L561-S563 PolarHBondContact O-N 2.72Å
564	D	96	Very high	95.1	Very high	34 Å²	34	67.3 Å²	67.3	18%	0.182	38%	0.382	C	S	.	.	S	Bend	trans	-84.2	137.9	-177.3	-169.4	-64.3	0	0	0	112.2	F538 L561 R566 F567 S568	F538-D564 HydrophobicContact CD1-CB 3.98Å; F538-D564 HydrophobicContact CE1-CB 3.28Å; F538-D564 HydrophobicContact CE2-CB 4.21Å; F538-D564 HydrophobicContact CZ-CB 3.42Å; F538-D564 VanDerWaalsContact CZ-CB 3.42Å; L561-D564 PolarHBondContact O-N 3.32Å; D564-R566 VanDerWaalsContact CG-NE 3.35Å; D564-R566 PolarHBondContact O-N 3.43Å; D564-R566 VanDerWaalsContact O-N 3.13Å; D564-R566 WeakPolarHBondContact OD1-CB 3.44Å; D564-R566 WeakPolarHBondContact OD1-CG 3.5Å; D564-R566 IonicContact OD1-CZ 3.39Å; D564-R566 PolarHBondContact OD1-N 3.21Å; D564-R566 IonicContact OD1-NE 2.72Å; D564-R566 PolarHBondContact OD1-NE 3.5Å; D564-R566 IonicContact OD2-CZ 3.84Å; D564-R566 IonicContact OD2-NE 3.31Å; D564-R566 PolarHBondContact OD2-NE 2.97Å; D564-R566 VanDerWaalsContact OD2-NE 3.12Å; D564-R566 IonicContact OD2-NH2 3.34Å; D564-R566 PolarHBondContact OD2-NH2 3.14Å; D564-F567 WeakPolarHBondContact O-CB 3.22Å; D564-F567 PolarHBondContact O-N 3.17Å; D564-F567 VanDerWaalsContact O-N 3.14Å; D564-S568 PolarHBondContact O-N 3.42Å
565	M	95.3	Very high	94.9	Very high	146 Å²	146	67.3 Å²	67.3	72%	0.719	40%	0.402	S	S	*	.	H	α-helix	trans	-58	-28.2	179.7	-159.9	63.8	64.5	0	0	113.1	S568 S569	M565-S568 PolarHBondContact O-N 3.21Å; M565-S569 VanDerWaalsContact O-CB 3.23Å; M565-S569 WeakPolarHBondContact O-CB 3.4Å; M565-S569 PolarHBondContact O-N 3.37Å; M565-S569 PolarHBondContact O-OG 3.39Å
566	R	96.1	Very high	94.8	Very high	56 Å²	56	61.5 Å²	61.5	21%	0.211	38%	0.377	C	S	.	.	H	α-helix	trans	-69.6	-35.1	179.2	-63.3	171.3	-82.4	-171.1	-3.8	112.5	S534 E541 D564 S569 M570	S534-R566 WeakPolarHBondContact O-CD 3.34Å; E541-R566 IonicContact OE1-CZ 2.78Å; E541-R566 IonicContact OE1-NH1 2.82Å; E541-R566 PolarHBondContact OE1-NH1 2.83Å; E541-R566 IonicContact OE2-CZ 2.65Å; E541-R566 IonicContact OE2-NH1 3.05Å; E541-R566 PolarHBondContact OE2-NH1 3.13Å; E541-R566 IonicContact OE2-NH2 2.65Å; E541-R566 PolarHBondContact OE2-NH2 2.81Å; D564-R566 VanDerWaalsContact CG-NE 3.35Å; D564-R566 PolarHBondContact O-N 3.43Å; D564-R566 VanDerWaalsContact O-N 3.13Å; D564-R566 WeakPolarHBondContact OD1-CB 3.44Å; D564-R566 WeakPolarHBondContact OD1-CG 3.5Å; D564-R566 IonicContact OD1-CZ 3.39Å; D564-R566 PolarHBondContact OD1-N 3.21Å; D564-R566 IonicContact OD1-NE 2.72Å; D564-R566 PolarHBondContact OD1-NE 3.5Å; D564-R566 IonicContact OD2-CZ 3.84Å; D564-R566 IonicContact OD2-NE 3.31Å; D564-R566 PolarHBondContact OD2-NE 2.97Å; D564-R566 VanDerWaalsContact OD2-NE 3.12Å; D564-R566 IonicContact OD2-NH2 3.34Å; D564-R566 PolarHBondContact OD2-NH2 3.14Å; R566-S569 PolarHBondContact O-N 2.7Å; R566-M570 PolarHBondContact O-N 3.3Å
567	F	96.7	Very high	94.9	Very high	15 Å²	15	58.7 Å²	58.7	7%	0.066	37%	0.368	C	S	.	.	H	α-helix	trans	-64	-52.1	172.3	172.8	-88.6	0	0	0	110.4	F535 W554 Y558 L561 D564 S569 M570 L571 P578	F535-F567 HydrophobicContact CD2-CB 4.2Å; F535-F567 HydrophobicContact CE2-CB 3.91Å; F535-F567 AromaticContact CE2-CD2 3.94Å; F535-F567 HydrophobicContact CE2-CD2 3.94Å; F535-F567 HydrophobicContact CE2-CG 4.44Å; F535-F567 HydrophobicContact CZ-CD2 4.31Å; W554-F567 AromaticContact CH2-CE2 3.88Å; W554-F567 HydrophobicContact CH2-CE2 3.88Å; W554-F567 HydrophobicContact CZ2-CE2 4.11Å; Y558-F567 HydrophobicContact CE2-CE2 4.41Å; Y558-F567 AromaticContact CE2-CZ 3.84Å; Y558-F567 HydrophobicContact CE2-CZ 3.84Å; L561-F567 WeakPolarHBondContact O-CB 3.48Å; D564-F567 WeakPolarHBondContact O-CB 3.22Å; D564-F567 PolarHBondContact O-N 3.17Å; D564-F567 VanDerWaalsContact O-N 3.14Å; F567-S569 PolarHBondContact O-N 3.02Å; F567-M570 WeakPolarHBondContact O-CB 3.47Å; F567-M570 PolarHBondContact O-N 3.13Å; F567-L571 HydrophobicContact CD1-CD1 4.43Å; F567-L571 HydrophobicContact CD1-CD2 4.49Å; F567-L571 HydrophobicContact CE1-CD1 4.04Å; F567-L571 HydrophobicContact CE1-CD2 3.96Å; F567-L571 HydrophobicContact CE1-CG 4.35Å; F567-L571 HydrophobicContact CZ-CD2 4.06Å; F567-P578 HydrophobicContact CD2-CB 3.67Å; F567-P578 HydrophobicContact CD2-CG 4.04Å; F567-P578 HydrophobicContact CE2-CB 3.69Å; F567-P578 HydrophobicContact CE2-CG 4.06Å
568	S	96.3	Very high	94.9	Very high	61 Å²	61	58.6 Å²	58.6	43%	0.427	37%	0.368	S	S	.	.	H	α-helix	trans	-58.6	-39.4	176.4	-67.6	0	0	0	0	111.6	D564 M565 M570 L571	D564-S568 PolarHBondContact O-N 3.42Å; M565-S568 PolarHBondContact O-N 3.21Å; S568-M570 PolarHBondContact O-N 3.01Å; S568-M570 VanDerWaalsContact O-N 3.13Å; S568-L571 PolarHBondContact O-N 2.84Å; S568-L571 VanDerWaalsContact O-N 3.17Å
569	S	95.3	Very high	94.9	Very high	49 Å²	49	56 Å²	56	34%	0.343	36%	0.362	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.3	-4.7	175.3	-60.2	0	0	0	0	114.7	N531 M565 R566 F567 Q573	N531-S569 WeakPolarHBondContact CB-O 3.08Å; N531-S569 PolarHBondContact ND2-O 2.85Å; M565-S569 VanDerWaalsContact O-CB 3.23Å; M565-S569 WeakPolarHBondContact O-CB 3.4Å; M565-S569 PolarHBondContact O-N 3.37Å; M565-S569 PolarHBondContact O-OG 3.39Å; R566-S569 PolarHBondContact O-N 2.7Å; F567-S569 PolarHBondContact O-N 3.02Å; S569-Q573 PolarHBondContact O-NE2 3.2Å
570	M	95.4	Very high	95	Very high	6 Å²	6	54.2 Å²	54.2	3%	0.03	35%	0.347	C	S	.	.	T	Hydrogen-bonded Turn	trans	-102.6	-14.4	172.2	-93.1	-162.6	61.7	0	0	114.1	N531 R532 F535 R566 F567 S568 S576 P578 L581	N531-M570 HydrophobicContact CB-CG 4.29Å; N531-M570 WeakPolarHBondContact O-CG 3.46Å; R532-M570 HydrophobicContact CB-SD 4.44Å; R532-M570 HydrophobicContact CG-CE 3.62Å; R532-M570 HydrophobicContact CG-CG 4.48Å; R532-M570 HydrophobicContact CG-SD 3.93Å; F535-M570 HydrophobicContact CB-CG 4.18Å; F535-M570 HydrophobicContact CB-SD 3.44Å; F535-M570 WeakPolarHBondContact CB-SD 3.34Å; F535-M570 HydrophobicContact CD1-SD 3.85Å; F535-M570 HydrophobicContact CG-SD 3.72Å; R566-M570 PolarHBondContact O-N 3.3Å; F567-M570 WeakPolarHBondContact O-CB 3.47Å; F567-M570 PolarHBondContact O-N 3.13Å; S568-M570 PolarHBondContact O-N 3.01Å; S568-M570 VanDerWaalsContact O-N 3.13Å; M570-S576 VanDerWaalsContact CE-O 3.26Å; M570-S576 WeakPolarHBondContact CE-O 3.35Å; M570-P578 HydrophobicContact CB-CG 3.79Å; M570-P578 HydrophobicContact CE-CG 3.96Å; M570-P578 HydrophobicContact SD-CG 4.26Å; M570-L581 HydrophobicContact CE-CD1 3.73Å; M570-L581 HydrophobicContact CE-CG 4.39Å; M570-L581 HydrophobicContact SD-CD1 3.71Å
571	L	93.8	Very high	95	Very high	95 Å²	95	52.6 Å²	52.6	50%	0.497	34%	0.337	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.7	148	-173.3	-59.4	-179.5	0	0	0	112	F567 S568 Q573 P578	F567-L571 HydrophobicContact CD1-CD1 4.43Å; F567-L571 HydrophobicContact CD1-CD2 4.49Å; F567-L571 HydrophobicContact CE1-CD1 4.04Å; F567-L571 HydrophobicContact CE1-CD2 3.96Å; F567-L571 HydrophobicContact CE1-CG 4.35Å; F567-L571 HydrophobicContact CZ-CD2 4.06Å; S568-L571 PolarHBondContact O-N 2.84Å; S568-L571 VanDerWaalsContact O-N 3.17Å; L571-Q573 PolarHBondContact O-N 3.5Å; L571-P578 HydrophobicContact CD2-CG 4.3Å
572	G	90.7	Very high	95.2	Very high	88 Å²	88	52.9 Å²	52.9	91%	0.907	34%	0.338	S	S	*	.	T	Hydrogen-bonded Turn	trans	71.8	0.8	179.6	0	0	0	0	0	116.1
573	Q	93.9	Very high	95.2	Very high	37 Å²	37	56.1 Å²	56.1	17%	0.173	35%	0.348	C	S	.	.			trans	-88.7	144.6	-176	-66.8	171.1	21.8	0	0	113	Q528 N531 S569 L571	Q528-Q573 HydrophobicContact CG-CB 4.37Å; Q528-Q573 HydrophobicContact CG-CG 3.9Å; N531-Q573 PolarHBondContact ND2-NE2 3.22Å; N531-Q573 VanDerWaalsContact ND2-NE2 3.15Å; S569-Q573 PolarHBondContact O-NE2 3.2Å; L571-Q573 PolarHBondContact O-N 3.5Å
574	P	91.6	Very high	95.3	Very high	89 Å²	89	56.8 Å²	56.8	58%	0.578	34%	0.338	S	S	*	.	S	Bend	trans	-72.3	138.4	175.6	29.9	-34.9	0	0	0	111.9	R532	R532-P574 PolarHBondContact NH1-O 2.97Å
575	G	91.7	Very high	95.4	Very high	61 Å²	61	56.4 Å²	56.4	63%	0.629	33%	0.334	S	S	*	.	S	Bend	trans	117.5	-153.8	-179.6	0	0	0	0	0	112.1	T577	G575-T577 PolarHBondContact O-N 2.84Å
576	S	93.9	Very high	95.5	Very high	45 Å²	45	49.9 Å²	49.9	32%	0.315	30%	0.302	S	S	.	.	S	Bend	trans	-60.8	128.8	175.9	-49	0	0	0	0	111.4	M570	M570-S576 VanDerWaalsContact CE-O 3.26Å; M570-S576 WeakPolarHBondContact CE-O 3.35Å
577	T	95.8	Very high	95.5	Very high	60 Å²	60	52.4 Å²	52.4	37%	0.368	32%	0.317	S	S	.	.			trans	-77.5	167.6	174.2	70.1	0	0	0	0	111.1	G575 L579 D580 L581	G575-T577 PolarHBondContact O-N 2.84Å; T577-L579 PolarHBondContact O-N 3.44Å; T577-L579 PolarHBondContact OG1-N 3.11Å; T577-D580 WeakPolarHBondContact CB-OD2 3.29Å; T577-D580 WeakPolarHBondContact CG2-OD2 3.43Å; T577-D580 PolarHBondContact N-OD2 3.27Å; T577-D580 PolarHBondContact O-N 3.15Å; T577-D580 PolarHBondContact OG1-N 3.47Å; T577-D580 PolarHBondContact OG1-OD2 2.89Å; T577-L581 PolarHBondContact O-N 2.78Å
578	P	97.1	Very high	95.5	Very high	9 Å²	9	56.9 Å²	56.9	6%	0.058	34%	0.342	C	S	.	.	H	α-helix	trans	-56.1	-35	172.8	-26.7	36.7	0	0	0	113.1	F535 W554 F567 M570 L571 F582	F535-P578 HydrophobicContact CD1-CB 4.45Å; F535-P578 HydrophobicContact CE1-CB 3.87Å; F535-P578 WeakPolarHBondContact CE1-O 3.29Å; F535-P578 HydrophobicContact CE2-CB 4.3Å; F535-P578 HydrophobicContact CZ-CB 3.79Å; W554-P578 HydrophobicContact CH2-CB 4.09Å; F567-P578 HydrophobicContact CD2-CB 3.67Å; F567-P578 HydrophobicContact CD2-CG 4.04Å; F567-P578 HydrophobicContact CE2-CB 3.69Å; F567-P578 HydrophobicContact CE2-CG 4.06Å; M570-P578 HydrophobicContact CB-CG 3.79Å; M570-P578 HydrophobicContact CE-CG 3.96Å; M570-P578 HydrophobicContact SD-CG 4.26Å; L571-P578 HydrophobicContact CD2-CG 4.3Å; P578-F582 WeakPolarHBondContact O-CB 3.26Å; P578-F582 PolarHBondContact O-N 2.83Å
579	L	95.9	Very high	95.6	Very high	54 Å²	54	54.2 Å²	54.2	28%	0.283	32%	0.322	S	S	.	.	H	α-helix	trans	-65.4	-36.7	175.1	173.1	64.6	0	0	0	112.2	W554 T577 K583	W554-L579 HydrophobicContact CB-CD1 4.02Å; W554-L579 HydrophobicContact CD2-CD1 3.39Å; W554-L579 HydrophobicContact CE3-CD1 3.85Å; W554-L579 HydrophobicContact CG-CD1 3.46Å; W554-L579 VanDerWaalsContact CG-CD1 3.46Å; W554-L579 HydrophobicContact CH2-CB 4.06Å; W554-L579 HydrophobicContact CZ2-CB 3.98Å; W554-L579 HydrophobicContact CZ2-CD1 4.3Å; W554-L579 HydrophobicContact CZ3-CB 4.4Å; W554-L579 HydrophobicContact CZ3-CD1 4.44Å; T577-L579 PolarHBondContact O-N 3.44Å; T577-L579 PolarHBondContact OG1-N 3.11Å; L579-K583 HydrophobicContact CD1-CD 4.44Å; L579-K583 HydrophobicContact CD1-CG 4.45Å; L579-K583 HydrophobicContact CG-CD 4.31Å; L579-K583 WeakPolarHBondContact O-CB 3.43Å; L579-K583 VanDerWaalsContact O-CG 3.22Å; L579-K583 WeakPolarHBondContact O-CG 3.42Å; L579-K583 PolarHBondContact O-N 3.14Å
580	D	96.6	Very high	95.6	Very high	44 Å²	44	55.8 Å²	55.8	24%	0.235	32%	0.323	C	S	.	.	H	α-helix	trans	-74.2	-42.5	179.4	-54.4	-47.9	0	0	0	111	T577 F582 K583 F584	T577-D580 WeakPolarHBondContact CB-OD2 3.29Å; T577-D580 WeakPolarHBondContact CG2-OD2 3.43Å; T577-D580 PolarHBondContact N-OD2 3.27Å; T577-D580 PolarHBondContact O-N 3.15Å; T577-D580 PolarHBondContact OG1-N 3.47Å; T577-D580 PolarHBondContact OG1-OD2 2.89Å; D580-F582 VanDerWaalsContact C-N 3.35Å; D580-F582 PolarHBondContact O-N 2.91Å; D580-K583 PolarHBondContact O-N 2.73Å; D580-K583 IonicContact OD1-NZ 3.58Å; D580-F584 HydrophobicContact CB-CE2 3.89Å; D580-F584 HydrophobicContact CB-CZ 4.11Å; D580-F584 WeakPolarHBondContact O-CD2 3.42Å; D580-F584 WeakPolarHBondContact O-CG 3.24Å; D580-F584 PolarHBondContact O-N 3.15Å
581	L	97.1	Very high	95.6	Very high	19 Å²	19	58.6 Å²	58.6	10%	0.099	35%	0.347	C	S	.	.	H	α-helix	trans	-59.9	-44.7	173.9	-65	-173.6	0	0	0	111.6	R532 F535 L539 M570 T577 K583 F584 Y585	R532-L581 HydrophobicContact CB-CD1 4.14Å; R532-L581 HydrophobicContact CG-CD1 4.11Å; F535-L581 HydrophobicContact CD1-CB 4.22Å; F535-L581 HydrophobicContact CD1-CD1 4Å; F535-L581 HydrophobicContact CE1-CB 4.29Å; L539-L581 HydrophobicContact CD1-CB 4.39Å; M570-L581 HydrophobicContact CE-CD1 3.73Å; M570-L581 HydrophobicContact CE-CG 4.39Å; M570-L581 HydrophobicContact SD-CD1 3.71Å; T577-L581 PolarHBondContact O-N 2.78Å; L581-K583 PolarHBondContact O-N 2.94Å; L581-F584 HydrophobicContact CD2-CD2 4.44Å; L581-F584 PolarHBondContact O-N 2.96Å; L581-Y585 WeakPolarHBondContact O-CB 3.49Å; L581-Y585 PolarHBondContact O-N 2.9Å
582	F	97.9	Very high	95.7	Very high	7 Å²	7	58.2 Å²	58.2	3%	0.031	34%	0.339	C	S	.	.	H	α-helix	trans	-58.4	-45.6	173	173.1	-85.3	0	0	0	112.7	L539 L548 W554 M557 L561 P578 D580 Y585 V586	L539-F582 HydrophobicContact CD2-CD2 4.2Å; L548-F582 HydrophobicContact CD1-CD2 4.18Å; L548-F582 HydrophobicContact CD1-CE2 3.5Å; L548-F582 HydrophobicContact CD1-CZ 4.22Å; W554-F582 HydrophobicContact CB-CD1 4.22Å; W554-F582 HydrophobicContact CB-CE1 3.86Å; W554-F582 HydrophobicContact CB-CZ 4.42Å; W554-F582 HydrophobicContact CD2-CD1 4.49Å; W554-F582 HydrophobicContact CE3-CB 3.69Å; W554-F582 AromaticContact CE3-CD1 3.61Å; W554-F582 HydrophobicContact CE3-CD1 3.61Å; W554-F582 AromaticContact CE3-CD2 3.89Å; W554-F582 HydrophobicContact CE3-CD2 3.89Å; W554-F582 HydrophobicContact CE3-CE1 4.19Å; W554-F582 HydrophobicContact CE3-CE2 4.41Å; W554-F582 AromaticContact CE3-CG 3.45Å; W554-F582 HydrophobicContact CE3-CG 3.45Å; W554-F582 VanDerWaalsContact CE3-CG 3.45Å; W554-F582 HydrophobicContact CZ3-CB 3.54Å; W554-F582 HydrophobicContact CZ3-CD1 4.37Å; W554-F582 HydrophobicContact CZ3-CD2 4.2Å; W554-F582 AromaticContact CZ3-CG 3.8Å; W554-F582 HydrophobicContact CZ3-CG 3.8Å; M557-F582 HydrophobicContact CB-CE2 3.88Å; M557-F582 HydrophobicContact CB-CZ 4.4Å; M557-F582 HydrophobicContact CG-CE2 3.9Å; M557-F582 HydrophobicContact CG-CZ 4.25Å; L561-F582 HydrophobicContact CD1-CD2 3.84Å; L561-F582 HydrophobicContact CD1-CE2 4.21Å; P578-F582 WeakPolarHBondContact O-CB 3.26Å; P578-F582 PolarHBondContact O-N 2.83Å; D580-F582 VanDerWaalsContact C-N 3.35Å; D580-F582 PolarHBondContact O-N 2.91Å; F582-Y585 PolarHBondContact O-N 3.38Å; F582-V586 HydrophobicContact CD1-CG2 4.31Å; F582-V586 HydrophobicContact CD2-CG2 4.42Å; F582-V586 HydrophobicContact CE1-CG2 3.91Å; F582-V586 HydrophobicContact CE2-CG2 4.06Å; F582-V586 HydrophobicContact CZ-CG2 3.78Å; F582-V586 WeakPolarHBondContact O-CB 3.11Å; F582-V586 WeakPolarHBondContact O-CG2 3.35Å; F582-V586 PolarHBondContact O-N 3.33Å
583	K	97.3	Very high	95.9	Very high	104 Å²	104	55.7 Å²	55.7	45%	0.452	30%	0.303	S	S	.	.	H	α-helix	trans	-62.1	-46.2	178.2	-76.9	166.4	-175.1	162.2	0	111.8	L579 D580 L581 Y585 E587	L579-K583 HydrophobicContact CD1-CD 4.44Å; L579-K583 HydrophobicContact CD1-CG 4.45Å; L579-K583 HydrophobicContact CG-CD 4.31Å; L579-K583 WeakPolarHBondContact O-CB 3.43Å; L579-K583 VanDerWaalsContact O-CG 3.22Å; L579-K583 WeakPolarHBondContact O-CG 3.42Å; L579-K583 PolarHBondContact O-N 3.14Å; D580-K583 PolarHBondContact O-N 2.73Å; D580-K583 IonicContact OD1-NZ 3.58Å; L581-K583 PolarHBondContact O-N 2.94Å; K583-Y585 VanDerWaalsContact C-N 3.32Å; K583-E587 VanDerWaalsContact O-CB 3.29Å; K583-E587 WeakPolarHBondContact O-CB 3.4Å; K583-E587 PolarHBondContact O-N 3.47Å
584	F	97.6	Very high	96	Very high	114 Å²	114	60.9 Å²	60.9	50%	0.5	33%	0.326	S	S	.	.	H	α-helix	trans	-61.3	-44.4	177.9	-58.2	-36.3	0	0	0	110.4	D580 L581 E587 D588	D580-F584 HydrophobicContact CB-CE2 3.89Å; D580-F584 HydrophobicContact CB-CZ 4.11Å; D580-F584 WeakPolarHBondContact O-CD2 3.42Å; D580-F584 WeakPolarHBondContact O-CG 3.24Å; D580-F584 PolarHBondContact O-N 3.15Å; L581-F584 HydrophobicContact CD2-CD2 4.44Å; L581-F584 PolarHBondContact O-N 2.96Å; F584-E587 PolarHBondContact O-N 2.92Å; F584-D588 PolarHBondContact O-N 2.78Å
585	Y	97.8	Very high	96.2	Very high	26 Å²	26	60.7 Å²	60.7	10%	0.102	32%	0.321	C	S	.	.	H	α-helix	trans	-59	-55.1	177.2	-162.3	-103.1	0	0	0	112.5	L539 D540 H543 L548 L581 F582 K583 E587 D588 L589	L539-Y585 HydrophobicContact CB-CD1 4.11Å; L539-Y585 HydrophobicContact CB-CD2 4.43Å; L539-Y585 HydrophobicContact CB-CE1 4.23Å; L539-Y585 HydrophobicContact CB-CG 4.19Å; L539-Y585 HydrophobicContact CD1-CG 4.22Å; D540-Y585 WeakPolarHBondContact CA-OH 3.3Å; D540-Y585 WeakPolarHBondContact OD1-CE2 3.4Å; D540-Y585 VanDerWaalsContact OD1-CZ 3.28Å; D540-Y585 PolarHBondContact OD1-OH 3.47Å; H543-Y585 HydrophobicContact CB-CE1 4Å; L548-Y585 HydrophobicContact CD2-CD1 3.62Å; L548-Y585 HydrophobicContact CD2-CE1 3.75Å; L548-Y585 HydrophobicContact CG-CD1 4.29Å; L548-Y585 HydrophobicContact CG-CE1 4.34Å; L581-Y585 WeakPolarHBondContact O-CB 3.49Å; L581-Y585 PolarHBondContact O-N 2.9Å; F582-Y585 PolarHBondContact O-N 3.38Å; K583-Y585 VanDerWaalsContact C-N 3.32Å; Y585-E587 PolarHBondContact O-N 3.2Å; Y585-D588 PolarHBondContact O-N 3.45Å; Y585-D588 VanDerWaalsContact O-N 3.09Å; Y585-L589 HydrophobicContact CD1-CD1 4Å; Y585-L589 HydrophobicContact CD1-CG 4.2Å; Y585-L589 HydrophobicContact CE1-CD1 3.96Å; Y585-L589 HydrophobicContact CE1-CD2 4.12Å; Y585-L589 HydrophobicContact CE1-CG 4.2Å; Y585-L589 WeakPolarHBondContact O-CG 3.27Å; Y585-L589 PolarHBondContact O-N 2.91Å
586	V	97.1	Very high	96.4	Very high	8 Å²	8	58.2 Å²	58.2	5%	0.048	29%	0.293	C	S	.	.	H	α-helix	trans	-62.3	-30.3	179.5	170.7	0	0	0	0	112.1	L548 F582 K590	L548-V586 HydrophobicContact CD1-CG2 3.9Å; F582-V586 HydrophobicContact CD1-CG2 4.31Å; F582-V586 HydrophobicContact CD2-CG2 4.42Å; F582-V586 HydrophobicContact CE1-CG2 3.91Å; F582-V586 HydrophobicContact CE2-CG2 4.06Å; F582-V586 HydrophobicContact CZ-CG2 3.78Å; F582-V586 WeakPolarHBondContact O-CB 3.11Å; F582-V586 WeakPolarHBondContact O-CG2 3.35Å; F582-V586 PolarHBondContact O-N 3.33Å; V586-K590 WeakPolarHBondContact O-CG 3.31Å; V586-K590 PolarHBondContact O-N 3.19Å; V586-K590 VanDerWaalsContact O-N 3.15Å
587	E	97.1	Very high	96.5	Very high	110 Å²	110	57.7 Å²	57.7	51%	0.514	29%	0.285	S	S	.	.	H	α-helix	trans	-74.1	-37.6	173.7	-159.1	64.8	-166.8	0	0	112.6	K583 F584 Y585 L589 K590 A591	K583-E587 VanDerWaalsContact O-CB 3.29Å; K583-E587 WeakPolarHBondContact O-CB 3.4Å; K583-E587 PolarHBondContact O-N 3.47Å; F584-E587 PolarHBondContact O-N 2.92Å; Y585-E587 PolarHBondContact O-N 3.2Å; E587-L589 VanDerWaalsContact C-N 3.33Å; E587-L589 PolarHBondContact O-N 3.46Å; E587-K590 PolarHBondContact O-N 3.05Å; E587-K590 IonicContact OE2-NZ 3.1Å; E587-K590 PolarHBondContact OE2-NZ 2.89Å; E587-A591 PolarHBondContact O-N 3.02Å
588	D	96.8	Very high	96.6	Very high	109 Å²	109	61.1 Å²	61.1	58%	0.583	29%	0.291	S	S	*	.	H	α-helix	trans	-64.3	-36.7	171.4	-76.8	-24.3	0	0	0	111.4	F584 Y585 A591 R592	F584-D588 PolarHBondContact O-N 2.78Å; Y585-D588 PolarHBondContact O-N 3.45Å; Y585-D588 VanDerWaalsContact O-N 3.09Å; D588-A591 PolarHBondContact O-N 2.95Å; D588-R592 PolarHBondContact O-N 3.46Å
589	L	96.4	Very high	96.5	Very high	4 Å²	4	63 Å²	63	2%	0.021	30%	0.3	C	S	.	.	H	α-helix	trans	-60.4	-44.4	170.9	-60.5	-178	0	0	0	111.6	Y585 E587 R592 N637	Y585-L589 HydrophobicContact CD1-CD1 4Å; Y585-L589 HydrophobicContact CD1-CG 4.2Å; Y585-L589 HydrophobicContact CE1-CD1 3.96Å; Y585-L589 HydrophobicContact CE1-CD2 4.12Å; Y585-L589 HydrophobicContact CE1-CG 4.2Å; Y585-L589 WeakPolarHBondContact O-CG 3.27Å; Y585-L589 PolarHBondContact O-N 2.91Å; E587-L589 VanDerWaalsContact C-N 3.33Å; E587-L589 PolarHBondContact O-N 3.46Å; L589-R592 PolarHBondContact O-N 2.62Å; L589-N637 PolarHBondContact O-ND2 2.89Å
590	K	95.2	Very high	96.5	Very high	82 Å²	82	60.4 Å²	60.4	36%	0.357	29%	0.287	S	S	.	.	H	α-helix	trans	-67.5	-34.5	174.8	-68.2	174.2	-146.2	151.9	0	112.8	S550 V586 E587 R592 Y593	S550-K590 WeakPolarHBondContact O-CE 3.48Å; S550-K590 WeakPolarHBondContact O-CG 3.49Å; V586-K590 WeakPolarHBondContact O-CG 3.31Å; V586-K590 PolarHBondContact O-N 3.19Å; V586-K590 VanDerWaalsContact O-N 3.15Å; E587-K590 PolarHBondContact O-N 3.05Å; E587-K590 IonicContact OE2-NZ 3.1Å; E587-K590 PolarHBondContact OE2-NZ 2.89Å; K590-R592 PolarHBondContact O-N 2.95Å; K590-Y593 WeakPolarHBondContact O-CB 3.22Å; K590-Y593 PolarHBondContact O-N 3.08Å
591	A	96.2	Very high	96.5	Very high	66 Å²	66	63 Å²	63	55%	0.545	30%	0.296	S	S	.	.	H	α-helix	trans	-59.6	-36.3	178.5	0	0	0	0	0	111.3	E587 D588 Y593	E587-A591 PolarHBondContact O-N 3.02Å; D588-A591 PolarHBondContact O-N 2.95Å; A591-Y593 VanDerWaalsContact C-N 3.25Å; A591-Y593 PolarHBondContact O-N 3.27Å
592	R	95.8	Very high	96.5	Very high	86 Å²	86	65.2 Å²	65.2	33%	0.325	31%	0.308	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.8	-19	174.7	-62.5	-166.5	-83	143.7	-18.6	114.7	H543 D588 L589 K590 H594 D595 E596 T632	H543-R592 PolarHBondContact NE2-NH2 3.23Å; H543-R592 VanDerWaalsContact NE2-NH2 3.13Å; D588-R592 PolarHBondContact O-N 3.46Å; L589-R592 PolarHBondContact O-N 2.62Å; K590-R592 PolarHBondContact O-N 2.95Å; R592-H594 PolarHBondContact O-N 2.86Å; R592-D595 PolarHBondContact O-N 2.84Å; R592-D595 VanDerWaalsContact O-N 3.12Å; R592-E596 HydrophobicContact CB-CG 4.25Å; R592-E596 WeakPolarHBondContact CB-OE1 3.4Å; R592-E596 WeakPolarHBondContact CD-OE1 3.07Å; R592-E596 IonicContact CZ-OE1 2.71Å; R592-E596 IonicContact NE-OE1 3.12Å; R592-E596 IonicContact NH1-OE1 2.65Å; R592-E596 PolarHBondContact NH1-OE1 3.29Å; R592-E596 PolarHBondContact O-N 3.48Å; R592-T632 PolarHBondContact NH1-O 2.83Å
593	Y	96.2	Very high	96.4	Very high	35 Å²	35	64.9 Å²	64.9	14%	0.137	31%	0.306	C	S	.	.	H	α-helix	trans	-49.4	-37.8	-173.9	175.8	-114.2	0	0	0	114.3	K590 A591 K597 N637 L640 A641	K590-Y593 WeakPolarHBondContact O-CB 3.22Å; K590-Y593 PolarHBondContact O-N 3.08Å; A591-Y593 VanDerWaalsContact C-N 3.25Å; A591-Y593 PolarHBondContact O-N 3.27Å; Y593-K597 HydrophobicContact CE1-CD 3.79Å; Y593-K597 HydrophobicContact CE2-CB 4.37Å; Y593-K597 HydrophobicContact CE2-CD 4.18Å; Y593-K597 WeakPolarHBondContact O-CB 3.33Å; Y593-K597 PolarHBondContact O-N 3.32Å; Y593-K597 VanDerWaalsContact OH-CE 3.3Å; Y593-K597 WeakPolarHBondContact OH-CE 3.4Å; Y593-K597 PolarHBondContact OH-NZ 3.18Å; Y593-N637 HydrophobicContact CD2-CB 4.03Å; Y593-L640 HydrophobicContact CD2-CB 3.99Å; Y593-L640 HydrophobicContact CD2-CD1 4.38Å; Y593-L640 HydrophobicContact CE2-CB 3.33Å; Y593-L640 HydrophobicContact CE2-CD1 4.46Å; Y593-L640 PolarHBondContact OH-O 3.18Å; Y593-A641 HydrophobicContact CE2-CB 4.47Å
594	H	95.3	Very high	96.3	Very high	146 Å²	146	60.3 Å²	60.3	68%	0.676	29%	0.287	S	S	*	.	H	α-helix	trans	-70.6	-37.5	-175.3	-72.1	84.2	0	0	0	113.3	R592 R598	R592-H594 PolarHBondContact O-N 2.86Å; H594-R598 PolarHBondContact O-N 3.39Å
595	D	95.9	Very high	96.3	Very high	85 Å²	85	62.7 Å²	62.7	46%	0.455	30%	0.297	S	S	.	.	H	α-helix	trans	-78.3	-40.5	174.5	-81.9	-66.4	0	0	0	111.2	R592 K597 R598 I599	R592-D595 PolarHBondContact O-N 2.84Å; R592-D595 VanDerWaalsContact O-N 3.12Å; D595-K597 PolarHBondContact O-N 3.39Å; D595-R598 WeakPolarHBondContact O-CA 3.38Å; D595-R598 VanDerWaalsContact O-CB 3.29Å; D595-R598 WeakPolarHBondContact O-CB 3.45Å; D595-R598 PolarHBondContact O-N 2.85Å; D595-R598 IonicContact OD1-CZ 3.03Å; D595-R598 IonicContact OD1-NH1 4Å; D595-R598 PolarHBondContact OD1-NH1 3.43Å; D595-R598 IonicContact OD1-NH2 2.72Å; D595-R598 PolarHBondContact OD1-NH2 2.93Å; D595-I599 PolarHBondContact O-N 2.69Å
596	E	96.3	Very high	96.2	Very high	9 Å²	9	66.2 Å²	66.2	4%	0.042	32%	0.318	C	S	.	.	H	α-helix	trans	-63.9	-40.3	176.4	-70.2	-179.2	-161	0	0	111.8	R592 R598 I599 I600 L633 D634 N637	R592-E596 HydrophobicContact CB-CG 4.25Å; R592-E596 WeakPolarHBondContact CB-OE1 3.4Å; R592-E596 WeakPolarHBondContact CD-OE1 3.07Å; R592-E596 IonicContact CZ-OE1 2.71Å; R592-E596 IonicContact NE-OE1 3.12Å; R592-E596 IonicContact NH1-OE1 2.65Å; R592-E596 PolarHBondContact NH1-OE1 3.29Å; R592-E596 PolarHBondContact O-N 3.48Å; E596-R598 PolarHBondContact O-N 3.34Å; E596-I599 PolarHBondContact O-N 3.49Å; E596-I599 VanDerWaalsContact O-N 3.13Å; E596-I600 WeakPolarHBondContact O-CB 3.3Å; E596-I600 VanDerWaalsContact O-CG1 3.26Å; E596-I600 WeakPolarHBondContact O-CG1 3.29Å; E596-I600 PolarHBondContact O-N 2.81Å; E596-L633 HydrophobicContact CB-CD2 3.89Å; E596-L633 HydrophobicContact CG-CD2 3.74Å; E596-D634 PolarHBondContact OE2-N 2.8Å; E596-N637 HydrophobicContact CB-CB 4.48Å; E596-N637 VanDerWaalsContact OE2-CB 3.29Å; E596-N637 WeakPolarHBondContact OE2-CB 3.49Å; E596-N637 PolarHBondContact OE2-ND2 2.87Å
597	K	95.8	Very high	96	Very high	35 Å²	35	69.7 Å²	69.7	15%	0.152	33%	0.332	C	S	.	.	H	α-helix	trans	-64.8	-17.8	171.4	-170.3	-179.7	-162.5	167.8	0	113.2	Y593 D595 K601 A641 S644	Y593-K597 HydrophobicContact CE1-CD 3.79Å; Y593-K597 HydrophobicContact CE2-CB 4.37Å; Y593-K597 HydrophobicContact CE2-CD 4.18Å; Y593-K597 WeakPolarHBondContact O-CB 3.33Å; Y593-K597 PolarHBondContact O-N 3.32Å; Y593-K597 VanDerWaalsContact OH-CE 3.3Å; Y593-K597 WeakPolarHBondContact OH-CE 3.4Å; Y593-K597 PolarHBondContact OH-NZ 3.18Å; D595-K597 PolarHBondContact O-N 3.39Å; K597-K601 VanDerWaalsContact O-CD 3.24Å; K597-K601 WeakPolarHBondContact O-CD 3.42Å; K597-K601 WeakPolarHBondContact O-CE 3.44Å; K597-K601 VanDerWaalsContact O-CG 3.25Å; K597-K601 WeakPolarHBondContact O-CG 3.29Å; K597-A641 HydrophobicContact CG-CB 4.37Å; K597-S644 VanDerWaalsContact NZ-CB 3.33Å; K597-S644 PolarHBondContact NZ-OG 2.85Å
598	R	96.4	Very high	95.9	Very high	131 Å²	131	67.7 Å²	67.7	49%	0.494	34%	0.341	S	S	.	.	H	α-helix	trans	-77.4	-53.3	167.4	-173.5	-179.6	64.2	-111.1	-8.5	109.6	H594 D595 E596 I600 K601 D602	H594-R598 PolarHBondContact O-N 3.39Å; D595-R598 WeakPolarHBondContact O-CA 3.38Å; D595-R598 VanDerWaalsContact O-CB 3.29Å; D595-R598 WeakPolarHBondContact O-CB 3.45Å; D595-R598 PolarHBondContact O-N 2.85Å; D595-R598 IonicContact OD1-CZ 3.03Å; D595-R598 IonicContact OD1-NH1 4Å; D595-R598 PolarHBondContact OD1-NH1 3.43Å; D595-R598 IonicContact OD1-NH2 2.72Å; D595-R598 PolarHBondContact OD1-NH2 2.93Å; E596-R598 PolarHBondContact O-N 3.34Å; R598-I600 VanDerWaalsContact C-N 3.27Å; R598-I600 PolarHBondContact O-N 2.91Å; R598-K601 WeakPolarHBondContact O-CB 3.48Å; R598-K601 PolarHBondContact O-N 3.02Å; R598-D602 PolarHBondContact O-N 3.2Å
599	I	96.3	Very high	95.8	Very high	48 Å²	48	65.3 Å²	65.3	25%	0.246	33%	0.326	C	S	.	.	H	α-helix	trans	-53.6	-44.4	178.5	-61.7	167.6	0	0	0	111.2	D595 E596 K601 D602 I603 R629 L633	D595-I599 PolarHBondContact O-N 2.69Å; E596-I599 PolarHBondContact O-N 3.49Å; E596-I599 VanDerWaalsContact O-N 3.13Å; I599-K601 PolarHBondContact O-N 3.46Å; I599-D602 PolarHBondContact O-N 2.8Å; I599-I603 HydrophobicContact CG2-CD1 3.99Å; I599-I603 HydrophobicContact CG2-CG1 4.43Å; I599-I603 VanDerWaalsContact O-CG1 3.32Å; I599-I603 WeakPolarHBondContact O-CG1 3.39Å; I599-I603 PolarHBondContact O-N 3.43Å; I599-R629 HydrophobicContact CG2-CB 3.94Å; I599-L633 HydrophobicContact CB-CD2 4.15Å; I599-L633 HydrophobicContact CD1-CD2 4.22Å; I599-L633 HydrophobicContact CG2-CD2 4.01Å
600	I	96.6	Very high	95.5	Very high	1 Å²	1	69.9 Å²	69.9	1%	0.005	35%	0.349	C	S	.	.	H	α-helix	trans	-59.1	-45.9	176.5	-70.4	164.3	0	0	0	111.7	E596 R598 D602 I603 L604 F620 I624 L633 I638 A641	E596-I600 WeakPolarHBondContact O-CB 3.3Å; E596-I600 VanDerWaalsContact O-CG1 3.26Å; E596-I600 WeakPolarHBondContact O-CG1 3.29Å; E596-I600 PolarHBondContact O-N 2.81Å; R598-I600 VanDerWaalsContact C-N 3.27Å; R598-I600 PolarHBondContact O-N 2.91Å; I600-D602 VanDerWaalsContact C-N 3.3Å; I600-D602 PolarHBondContact O-N 2.76Å; I600-I603 PolarHBondContact O-N 2.94Å; I600-L604 HydrophobicContact CG2-CD1 3.77Å; I600-L604 HydrophobicContact CG2-CG 4.45Å; I600-L604 WeakPolarHBondContact O-CD1 3.39Å; I600-L604 WeakPolarHBondContact O-CG 3.29Å; I600-L604 PolarHBondContact O-N 3.21Å; I600-F620 HydrophobicContact CG2-CZ 4Å; I600-I624 HydrophobicContact CG1-CD1 4.39Å; I600-I624 HydrophobicContact CG2-CD1 3.7Å; I600-L633 HydrophobicContact CD1-CD1 4.25Å; I600-L633 HydrophobicContact CG1-CD1 3.63Å; I600-I638 HydrophobicContact CD1-CG1 4.03Å; I600-A641 HydrophobicContact CD1-CB 3.61Å; I600-A641 HydrophobicContact CG2-CB 4.07Å
601	K	95.8	Very high	95.5	Very high	99 Å²	99	66.5 Å²	66.5	43%	0.43	34%	0.336	S	S	.	.	H	α-helix	trans	-64.6	-36.4	176.8	-71.2	165.9	-171.4	159.2	0	112.1	K597 R598 I599 K605	K597-K601 VanDerWaalsContact O-CD 3.24Å; K597-K601 WeakPolarHBondContact O-CD 3.42Å; K597-K601 WeakPolarHBondContact O-CE 3.44Å; K597-K601 VanDerWaalsContact O-CG 3.25Å; K597-K601 WeakPolarHBondContact O-CG 3.29Å; R598-K601 WeakPolarHBondContact O-CB 3.48Å; R598-K601 PolarHBondContact O-N 3.02Å; I599-K601 PolarHBondContact O-N 3.46Å; K601-K605 VanDerWaalsContact O-CB 3.26Å; K601-K605 WeakPolarHBondContact O-CB 3.47Å; K601-K605 PolarHBondContact O-N 2.94Å
602	D	96.4	Very high	95.3	Very high	64 Å²	64	67.6 Å²	67.6	34%	0.342	33%	0.33	S	S	.	.	H	α-helix	trans	-67	-44.9	177.4	-61.4	-30.2	0	0	0	110.1	R598 I599 I600 L604 K605 D606	R598-D602 PolarHBondContact O-N 3.2Å; I599-D602 PolarHBondContact O-N 2.8Å; I600-D602 VanDerWaalsContact C-N 3.3Å; I600-D602 PolarHBondContact O-N 2.76Å; D602-L604 PolarHBondContact O-N 2.62Å; D602-K605 PolarHBondContact O-N 2.86Å; D602-D606 WeakPolarHBondContact O-CB 3.48Å; D602-D606 PolarHBondContact O-N 3.33Å; D602-D606 VanDerWaalsContact O-OD2 3.14Å
603	I	96.4	Very high	95.1	Very high	0 Å²	0	66.8 Å²	66.8	0%	0	33%	0.334	C	S	.	.	H	α-helix	trans	-55.7	-50.3	172.5	-64.6	163.4	0	0	0	111.7	I599 I600 K605 D606 K607 I624 D627 R629 L633	I599-I603 HydrophobicContact CG2-CD1 3.99Å; I599-I603 HydrophobicContact CG2-CG1 4.43Å; I599-I603 VanDerWaalsContact O-CG1 3.32Å; I599-I603 WeakPolarHBondContact O-CG1 3.39Å; I599-I603 PolarHBondContact O-N 3.43Å; I600-I603 PolarHBondContact O-N 2.94Å; I603-K605 VanDerWaalsContact C-N 3.32Å; I603-K605 PolarHBondContact O-N 3.08Å; I603-D606 PolarHBondContact O-N 3.01Å; I603-K607 HydrophobicContact CG2-CD 4.16Å; I603-K607 WeakPolarHBondContact O-CB 3.41Å; I603-K607 WeakPolarHBondContact O-CG 3.32Å; I603-K607 PolarHBondContact O-N 2.71Å; I603-I624 HydrophobicContact CD1-CG2 4.4Å; I603-D627 HydrophobicContact CD1-CB 4.17Å; I603-D627 HydrophobicContact CG1-CB 4.09Å; I603-D627 HydrophobicContact CG2-CB 3.7Å; I603-R629 HydrophobicContact CD1-CB 3.93Å; I603-R629 HydrophobicContact CG1-CB 4.25Å; I603-L633 HydrophobicContact CD1-CD1 4.12Å
604	L	95.9	Very high	94.9	Very high	9 Å²	9	71.4 Å²	71.4	5%	0.047	36%	0.361	C	S	.	.	H	α-helix	trans	-63.1	-39.9	-178.4	-64.4	162.8	0	0	0	111.3	I600 D602 K607 G608 F609 F620 V623 I624 L645	I600-L604 HydrophobicContact CG2-CD1 3.77Å; I600-L604 HydrophobicContact CG2-CG 4.45Å; I600-L604 WeakPolarHBondContact O-CD1 3.39Å; I600-L604 WeakPolarHBondContact O-CG 3.29Å; I600-L604 PolarHBondContact O-N 3.21Å; D602-L604 PolarHBondContact O-N 2.62Å; L604-K607 PolarHBondContact O-N 2.55Å; L604-G608 PolarHBondContact O-N 3.33Å; L604-G608 VanDerWaalsContact O-N 3.08Å; L604-F609 HydrophobicContact CD2-CB 4.28Å; L604-F609 HydrophobicContact CD2-CD1 3.73Å; L604-F609 HydrophobicContact CD2-CE1 4.48Å; L604-F609 HydrophobicContact CD2-CG 4.33Å; L604-F609 PolarHBondContact O-N 3.07Å; L604-F620 HydrophobicContact CD1-CD2 4.41Å; L604-F620 HydrophobicContact CD1-CE2 3.54Å; L604-F620 HydrophobicContact CD1-CZ 4.11Å; L604-F620 HydrophobicContact CD2-CD2 3.99Å; L604-F620 HydrophobicContact CD2-CE2 3.91Å; L604-F620 HydrophobicContact CG-CE2 4.36Å; L604-V623 HydrophobicContact CD2-CG1 4.01Å; L604-I624 HydrophobicContact CD2-CG1 4.32Å; L604-L645 HydrophobicContact CD1-CD1 3.7Å
605	K	95.9	Very high	94.8	Very high	164 Å²	164	65.4 Å²	65.4	71%	0.713	34%	0.335	S	S	*	.	H	α-helix	trans	-65.3	-46.6	175.3	-177.6	-164.5	170.5	-155.1	0	111.9	K601 D602 I603 K607 G608	K601-K605 VanDerWaalsContact O-CB 3.26Å; K601-K605 WeakPolarHBondContact O-CB 3.47Å; K601-K605 PolarHBondContact O-N 2.94Å; D602-K605 PolarHBondContact O-N 2.86Å; I603-K605 VanDerWaalsContact C-N 3.32Å; I603-K605 PolarHBondContact O-N 3.08Å; K605-K607 PolarHBondContact O-N 3.5Å; K605-G608 PolarHBondContact O-N 3.37Å
606	D	96	Very high	94.8	Very high	100 Å²	100	63.3 Å²	63.3	54%	0.535	33%	0.327	S	S	.	.	H	α-helix	trans	-64.4	-29.6	-179.3	-64.1	-24.5	0	0	0	111.8	D602 I603 R629	D602-D606 WeakPolarHBondContact O-CB 3.48Å; D602-D606 PolarHBondContact O-N 3.33Å; D602-D606 VanDerWaalsContact O-OD2 3.14Å; I603-D606 PolarHBondContact O-N 3.01Å; D606-R629 IonicContact OD2-CZ 2.72Å; D606-R629 VanDerWaalsContact OD2-CZ 3.24Å; D606-R629 IonicContact OD2-NH1 3.18Å; D606-R629 PolarHBondContact OD2-NH1 3.35Å; D606-R629 IonicContact OD2-NH2 2.85Å; D606-R629 PolarHBondContact OD2-NH2 3.21Å
607	K	94.4	Very high	94.7	Very high	80 Å²	80	66.2 Å²	66.2	35%	0.348	34%	0.339	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.3	1.6	174.4	-65.8	-176.4	178.2	-176.2	0	114.4	I603 L604 K605 F609 V623 S626 D627	I603-K607 HydrophobicContact CG2-CD 4.16Å; I603-K607 WeakPolarHBondContact O-CB 3.41Å; I603-K607 WeakPolarHBondContact O-CG 3.32Å; I603-K607 PolarHBondContact O-N 2.71Å; L604-K607 PolarHBondContact O-N 2.55Å; K605-K607 PolarHBondContact O-N 3.5Å; K607-F609 PolarHBondContact O-N 3.38Å; K607-V623 HydrophobicContact CB-CG1 4.3Å; K607-V623 HydrophobicContact CD-CG1 3.9Å; K607-V623 WeakPolarHBondContact CD-O 3.14Å; K607-V623 PolarHBondContact NZ-O 3.46Å; K607-S626 PolarHBondContact NZ-O 3.08Å; K607-S626 VanDerWaalsContact NZ-O 3.11Å; K607-S626 PolarHBondContact NZ-OG 3.09Å; K607-D627 VanDerWaalsContact NZ-N 3.11Å
608	G	93.3	Very high	94.6	Very high	69 Å²	69	70 Å²	70	71%	0.711	36%	0.361	S	S	*	.	T	Hydrogen-bonded Turn	trans	65.7	16	-179.6	0	0	0	0	0	115.3	L604 K605	L604-G608 PolarHBondContact O-N 3.33Å; L604-G608 VanDerWaalsContact O-N 3.08Å; K605-G608 PolarHBondContact O-N 3.37Å
609	F	94.7	Very high	94.5	Very high	59 Å²	59	68.1 Å²	68.1	26%	0.259	36%	0.361	S	S	.	.	P	Polyproline II helix	trans	-85.4	124.7	-173.9	-170.4	-89.3	0	0	0	111.8	L604 K607 V611 T615 D619 F620 V623	L604-F609 HydrophobicContact CD2-CB 4.28Å; L604-F609 HydrophobicContact CD2-CD1 3.73Å; L604-F609 HydrophobicContact CD2-CE1 4.48Å; L604-F609 HydrophobicContact CD2-CG 4.33Å; L604-F609 PolarHBondContact O-N 3.07Å; K607-F609 PolarHBondContact O-N 3.38Å; F609-V611 HydrophobicContact CD1-CG2 4.47Å; F609-V611 HydrophobicContact CE1-CG2 4.26Å; F609-T615 HydrophobicContact CE1-CG2 3.85Å; F609-T615 HydrophobicContact CZ-CG2 3.7Å; F609-D619 HydrophobicContact CZ-CB 4.39Å; F609-F620 HydrophobicContact CE1-CD2 4.31Å; F609-V623 HydrophobicContact CB-CG1 3.9Å; F609-V623 HydrophobicContact CD2-CB 4.41Å; F609-V623 HydrophobicContact CD2-CG1 4.22Å; F609-V623 HydrophobicContact CD2-CG2 3.68Å; F609-V623 HydrophobicContact CE2-CG2 3.82Å; F609-V623 HydrophobicContact CG-CG1 3.98Å; F609-V623 HydrophobicContact CG-CG2 4.25Å; F609-V623 HydrophobicContact CZ-CG2 4.49Å
610	L	91.1	Very high	94.5	Very high	99 Å²	99	65.8 Å²	65.8	52%	0.518	35%	0.349	S	S	.	.	P	Polyproline II helix	trans	-103.3	130.4	175.2	-177.7	63.1	0	0	0	109.8	E612	L610-E612 HydrophobicContact CD2-CG 4.13Å; L610-E612 HydrophobicContact CG-CG 4.08Å
611	V	93.9	Very high	94.4	Very high	11 Å²	11	66.4 Å²	66.4	7%	0.067	36%	0.356	C	S	.	.	P	Polyproline II helix	trans	-81.1	121.4	169.6	-175.1	0	0	0	0	109	F609 T615 F620 L645 L646 A649	F609-V611 HydrophobicContact CD1-CG2 4.47Å; F609-V611 HydrophobicContact CE1-CG2 4.26Å; V611-T615 HydrophobicContact CG1-CG2 4.45Å; V611-F620 HydrophobicContact CG2-CD2 3.79Å; V611-F620 HydrophobicContact CG2-CE2 3.76Å; V611-L645 HydrophobicContact CB-CB 4.24Å; V611-L645 HydrophobicContact CG1-CB 4.24Å; V611-L645 HydrophobicContact CG2-CB 4.06Å; V611-L645 HydrophobicContact CG2-CD1 4.3Å; V611-L646 HydrophobicContact CG1-CB 4.45Å; V611-L646 HydrophobicContact CG1-CD1 4.4Å; V611-A649 WeakPolarHBondContact O-CB 3.45Å
612	E	92	Very high	94.4	Very high	90 Å²	90	65.5 Å²	65.5	42%	0.421	36%	0.362	S	S	.	.			trans	-119	168.5	177	-60.1	-163.3	146.2	0	0	110.4	L610 N614 T615 L646	L610-E612 HydrophobicContact CD2-CG 4.13Å; L610-E612 HydrophobicContact CG-CG 4.08Å; E612-N614 WeakPolarHBondContact CB-OD1 3.33Å; E612-N614 PolarHBondContact O-N 3.45Å; E612-N614 VanDerWaalsContact O-N 3.16Å; E612-T615 PolarHBondContact N-OG1 2.82Å; E612-T615 VanDerWaalsContact O-CB 3.27Å; E612-T615 WeakPolarHBondContact O-CB 3.36Å; E612-T615 PolarHBondContact O-N 3.37Å; E612-T615 PolarHBondContact O-OG1 3.2Å; E612-T615 VanDerWaalsContact O-OG1 3.08Å; E612-L646 VanDerWaalsContact O-CD1 3.29Å; E612-L646 WeakPolarHBondContact O-CD1 3.28Å
613	V	91.9	Very high	94.3	Very high	69 Å²	69	63.9 Å²	63.9	42%	0.418	35%	0.354	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.1	-23.3	-171.8	-178.3	0	0	0	0	113.3	A649 E650 E653	V613-A649 HydrophobicContact CG2-CB 4.26Å; V613-E650 HydrophobicContact CG1-CG 4.05Å; V613-E650 HydrophobicContact CG2-CB 4.49Å; V613-E650 HydrophobicContact CG2-CG 4.11Å; V613-E653 HydrophobicContact CG2-CB 3.96Å; V613-E653 HydrophobicContact CG2-CG 4.07Å
614	N	91.8	Very high	94.3	Very high	132 Å²	132	63.9 Å²	63.9	71%	0.706	35%	0.354	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.6	-0.7	177.3	62.2	-10	0	0	0	114.1	E612 S616	E612-N614 WeakPolarHBondContact CB-OD1 3.33Å; E612-N614 PolarHBondContact O-N 3.45Å; E612-N614 VanDerWaalsContact O-N 3.16Å; N614-S616 PolarHBondContact O-N 3.2Å
615	T	94.4	Very high	94.2	Very high	19 Å²	19	67.6 Å²	67.6	12%	0.117	38%	0.381	C	S	.	.			trans	-70.4	126.8	-175.9	-60.6	0	0	0	0	110.9	F609 V611 E612 F642	F609-T615 HydrophobicContact CE1-CG2 3.85Å; F609-T615 HydrophobicContact CZ-CG2 3.7Å; V611-T615 HydrophobicContact CG1-CG2 4.45Å; E612-T615 PolarHBondContact N-OG1 2.82Å; E612-T615 VanDerWaalsContact O-CB 3.27Å; E612-T615 WeakPolarHBondContact O-CB 3.36Å; E612-T615 PolarHBondContact O-N 3.37Å; E612-T615 PolarHBondContact O-OG1 3.2Å; E612-T615 VanDerWaalsContact O-OG1 3.08Å; T615-F642 HydrophobicContact CG2-CE2 4.34Å; T615-F642 WeakPolarHBondContact O-CZ 3.43Å
616	S	95.3	Very high	94.1	Very high	42 Å²	42	63.9 Å²	63.9	29%	0.294	38%	0.376	S	S	.	.			trans	-78.3	160.1	176.2	84.8	0	0	0	0	112.2	N614 D618 D619 F620	N614-S616 PolarHBondContact O-N 3.2Å; S616-D618 VanDerWaalsContact C-N 3.27Å; S616-D618 PolarHBondContact O-N 3.23Å; S616-D618 PolarHBondContact OG-N 2.83Å; S616-D619 VanDerWaalsContact CB-OD2 3.31Å; S616-D619 WeakPolarHBondContact CB-OD2 3.4Å; S616-D619 PolarHBondContact OG-N 3.23Å; S616-D619 PolarHBondContact OG-OD2 2.88Å; S616-F620 WeakPolarHBondContact O-CB 3.45Å; S616-F620 PolarHBondContact O-N 2.89Å
617	F	94.6	Very high	94.1	Very high	69 Å²	69	60.4 Å²	60.4	30%	0.303	36%	0.357	S	S	.	.	H	α-helix	trans	-66.7	-31.2	171.7	179.2	-106.8	0	0	0	111.9	F620 G621 I638 K639 F642	F617-F620 HydrophobicContact CD2-CD1 4.48Å; F617-F620 PolarHBondContact O-N 2.89Å; F617-G621 PolarHBondContact O-N 3.47Å; F617-I638 HydrophobicContact CE2-CG2 4.3Å; F617-I638 HydrophobicContact CZ-CG2 4.49Å; F617-K639 HydrophobicContact CE2-CB 4.1Å; F617-K639 HydrophobicContact CE2-CG 4.07Å; F617-K639 HydrophobicContact CZ-CB 4.31Å; F617-K639 HydrophobicContact CZ-CG 4.34Å; F617-F642 HydrophobicContact CB-CD1 4.2Å; F617-F642 HydrophobicContact CB-CE1 3.91Å; F617-F642 HydrophobicContact CB-CZ 4.15Å; F617-F642 HydrophobicContact CD2-CB 3.93Å; F617-F642 AromaticContact CD2-CD1 3.7Å; F617-F642 HydrophobicContact CD2-CD1 3.7Å; F617-F642 HydrophobicContact CD2-CD2 4.34Å; F617-F642 HydrophobicContact CD2-CE1 4.29Å; F617-F642 AromaticContact CD2-CG 3.72Å; F617-F642 HydrophobicContact CD2-CG 3.72Å; F617-F642 HydrophobicContact CE2-CB 4.19Å; F617-F642 HydrophobicContact CE2-CG 4.48Å; F617-F642 HydrophobicContact CG-CD1 4.41Å
618	D	94.1	Very high	94.1	Very high	115 Å²	115	65.8 Å²	65.8	62%	0.615	38%	0.38	S	S	*	.	H	α-helix	trans	-75.7	-35.6	-175.1	-56.6	-46	0	0	0	111.8	S616 S622	S616-D618 VanDerWaalsContact C-N 3.27Å; S616-D618 PolarHBondContact O-N 3.23Å; S616-D618 PolarHBondContact OG-N 2.83Å; D618-S622 VanDerWaalsContact O-CB 3.26Å; D618-S622 WeakPolarHBondContact O-CB 3.25Å; D618-S622 PolarHBondContact O-N 3.38Å; D618-S622 PolarHBondContact O-OG 2.91Å
619	D	94.1	Very high	94.2	Very high	91 Å²	91	66.6 Å²	66.6	49%	0.487	36%	0.362	S	S	.	.	H	α-helix	trans	-62.6	-50.9	169.8	-61.8	-56.8	0	0	0	110.5	F609 S616 G621 S622 V623	F609-D619 HydrophobicContact CZ-CB 4.39Å; S616-D619 VanDerWaalsContact CB-OD2 3.31Å; S616-D619 WeakPolarHBondContact CB-OD2 3.4Å; S616-D619 PolarHBondContact OG-N 3.23Å; S616-D619 PolarHBondContact OG-OD2 2.88Å; D619-G621 PolarHBondContact O-N 2.77Å; D619-S622 PolarHBondContact O-N 2.91Å; D619-V623 WeakPolarHBondContact O-CG2 3.16Å; D619-V623 PolarHBondContact O-N 3.23Å
620	F	96.4	Very high	94	Very high	0 Å²	0	64.3 Å²	64.3	0%	0	35%	0.354	C	S	.	.	H	α-helix	trans	-60	-44.2	178.8	178.5	-93.8	0	0	0	112.1	I600 L604 F609 V611 S616 F617 V623 I624 I638 F642 L645	I600-F620 HydrophobicContact CG2-CZ 4Å; L604-F620 HydrophobicContact CD1-CD2 4.41Å; L604-F620 HydrophobicContact CD1-CE2 3.54Å; L604-F620 HydrophobicContact CD1-CZ 4.11Å; L604-F620 HydrophobicContact CD2-CD2 3.99Å; L604-F620 HydrophobicContact CD2-CE2 3.91Å; L604-F620 HydrophobicContact CG-CE2 4.36Å; F609-F620 HydrophobicContact CE1-CD2 4.31Å; V611-F620 HydrophobicContact CG2-CD2 3.79Å; V611-F620 HydrophobicContact CG2-CE2 3.76Å; S616-F620 WeakPolarHBondContact O-CB 3.45Å; S616-F620 PolarHBondContact O-N 2.89Å; F617-F620 HydrophobicContact CD2-CD1 4.48Å; F617-F620 PolarHBondContact O-N 2.89Å; F620-V623 PolarHBondContact O-N 2.88Å; F620-I624 HydrophobicContact CD1-CD1 3.69Å; F620-I624 HydrophobicContact CE1-CD1 3.23Å; F620-I624 HydrophobicContact CE2-CD1 4.2Å; F620-I624 HydrophobicContact CG-CD1 4.34Å; F620-I624 HydrophobicContact CZ-CD1 3.54Å; F620-I624 WeakPolarHBondContact O-CG1 3.31Å; F620-I624 PolarHBondContact O-N 2.86Å; F620-I638 HydrophobicContact CD1-CG2 4.47Å; F620-I638 HydrophobicContact CE1-CG2 4.06Å; F620-F642 HydrophobicContact CB-CD2 3.76Å; F620-F642 HydrophobicContact CB-CE2 3.98Å; F620-F642 HydrophobicContact CD1-CB 3.76Å; F620-F642 AromaticContact CD1-CD2 3.66Å; F620-F642 HydrophobicContact CD1-CD2 3.66Å; F620-F642 HydrophobicContact CD1-CG 4.07Å; F620-F642 AromaticContact CD2-CD2 3.81Å; F620-F642 HydrophobicContact CD2-CD2 3.81Å; F620-F642 HydrophobicContact CE1-CB 3.49Å; F620-F642 VanDerWaalsContact CE1-CB 3.49Å; F620-F642 HydrophobicContact CE1-CD2 4.1Å; F620-F642 HydrophobicContact CE1-CG 4.26Å; F620-F642 HydrophobicContact CE2-CD2 4.22Å; F620-F642 HydrophobicContact CG-CB 4.44Å; F620-F642 AromaticContact CG-CD2 3.49Å; F620-F642 HydrophobicContact CG-CD2 3.49Å; F620-F642 VanDerWaalsContact CG-CD2 3.49Å; F620-F642 HydrophobicContact CG-CE2 4.19Å; F620-F642 HydrophobicContact CG-CG 4.35Å; F620-F642 HydrophobicContact CZ-CB 3.95Å; F620-F642 HydrophobicContact CZ-CD2 4.35Å; F620-L645 HydrophobicContact CE2-CD1 3.84Å; F620-L645 HydrophobicContact CZ-CD1 4.02Å
621	G	94.2	Very high	93.9	Very high	14 Å²	14	65.6 Å²	65.6	14%	0.144	37%	0.367	C	S	.	.	H	α-helix	trans	-62.9	-44.6	175.5	0	0	0	0	0	112	F617 D619 V623 I624 S625	F617-G621 PolarHBondContact O-N 3.47Å; D619-G621 PolarHBondContact O-N 2.77Å; G621-V623 VanDerWaalsContact C-N 3.34Å; G621-V623 PolarHBondContact O-N 2.91Å; G621-I624 PolarHBondContact O-N 2.89Å; G621-S625 WeakPolarHBondContact O-CB 3.36Å; G621-S625 PolarHBondContact O-N 3.03Å; G621-S625 PolarHBondContact O-OG 3.18Å; G621-S625 VanDerWaalsContact O-OG 3.08Å
622	S	94.6	Very high	93.7	Very high	79 Å²	79	69.5 Å²	69.5	55%	0.552	39%	0.39	S	S	*	.	H	α-helix	trans	-62.9	-38.8	176.7	-61.1	0	0	0	0	112.4	D618 D619 S626	D618-S622 VanDerWaalsContact O-CB 3.26Å; D618-S622 WeakPolarHBondContact O-CB 3.25Å; D618-S622 PolarHBondContact O-N 3.38Å; D618-S622 PolarHBondContact O-OG 2.91Å; D619-S622 PolarHBondContact O-N 2.91Å; S622-S626 WeakPolarHBondContact O-CB 3.35Å; S622-S626 PolarHBondContact O-N 2.93Å; S622-S626 PolarHBondContact O-OG 2.96Å
623	V	95.8	Very high	93.8	Very high	30 Å²	30	66 Å²	66	18%	0.182	37%	0.374	C	S	.	.	H	α-helix	trans	-68.1	-35	175.3	169.9	0	0	0	0	112	L604 K607 F609 D619 F620 G621 S626	L604-V623 HydrophobicContact CD2-CG1 4.01Å; K607-V623 HydrophobicContact CB-CG1 4.3Å; K607-V623 HydrophobicContact CD-CG1 3.9Å; K607-V623 WeakPolarHBondContact CD-O 3.14Å; K607-V623 PolarHBondContact NZ-O 3.46Å; F609-V623 HydrophobicContact CB-CG1 3.9Å; F609-V623 HydrophobicContact CD2-CB 4.41Å; F609-V623 HydrophobicContact CD2-CG1 4.22Å; F609-V623 HydrophobicContact CD2-CG2 3.68Å; F609-V623 HydrophobicContact CE2-CG2 3.82Å; F609-V623 HydrophobicContact CG-CG1 3.98Å; F609-V623 HydrophobicContact CG-CG2 4.25Å; F609-V623 HydrophobicContact CZ-CG2 4.49Å; D619-V623 WeakPolarHBondContact O-CG2 3.16Å; D619-V623 PolarHBondContact O-N 3.23Å; F620-V623 PolarHBondContact O-N 2.88Å; G621-V623 VanDerWaalsContact C-N 3.34Å; G621-V623 PolarHBondContact O-N 2.91Å; V623-S626 PolarHBondContact O-OG 3.45Å
624	I	95.9	Very high	94	Very high	0 Å²	0	62.8 Å²	62.8	0%	0	36%	0.355	C	S	.	.	H	α-helix	trans	-74.7	-55.6	175	-70.1	169	0	0	0	111	I600 I603 L604 F620 G621 S626 D627 A630 L633 I638	I600-I624 HydrophobicContact CG1-CD1 4.39Å; I600-I624 HydrophobicContact CG2-CD1 3.7Å; I603-I624 HydrophobicContact CD1-CG2 4.4Å; L604-I624 HydrophobicContact CD2-CG1 4.32Å; F620-I624 HydrophobicContact CD1-CD1 3.69Å; F620-I624 HydrophobicContact CE1-CD1 3.23Å; F620-I624 HydrophobicContact CE2-CD1 4.2Å; F620-I624 HydrophobicContact CG-CD1 4.34Å; F620-I624 HydrophobicContact CZ-CD1 3.54Å; F620-I624 WeakPolarHBondContact O-CG1 3.31Å; F620-I624 PolarHBondContact O-N 2.86Å; G621-I624 PolarHBondContact O-N 2.89Å; I624-S626 PolarHBondContact O-N 3.34Å; I624-S626 VanDerWaalsContact O-N 3.08Å; I624-D627 VanDerWaalsContact O-CB 3.31Å; I624-D627 WeakPolarHBondContact O-CB 3.31Å; I624-D627 PolarHBondContact O-N 3.16Å; I624-A630 HydrophobicContact CG2-CB 3.82Å; I624-A630 WeakPolarHBondContact O-CB 3.39Å; I624-L633 HydrophobicContact CG2-CD1 4.07Å; I624-I638 HydrophobicContact CD1-CG2 3.98Å; I624-I638 HydrophobicContact CG2-CD1 4.07Å; I624-I638 HydrophobicContact CG2-CG1 4.46Å
625	S	93.6	Very high	94.1	Very high	88 Å²	88	59 Å²	59	62%	0.615	34%	0.342	S	S	*	.	H	α-helix	trans	-61.5	-20.9	-174.2	-62.1	0	0	0	0	114.5	G621 D627	G621-S625 WeakPolarHBondContact O-CB 3.36Å; G621-S625 PolarHBondContact O-N 3.03Å; G621-S625 PolarHBondContact O-OG 3.18Å; G621-S625 VanDerWaalsContact O-OG 3.08Å; S625-D627 PolarHBondContact O-N 3.26Å
626	S	93.8	Very high	94	Very high	86 Å²	86	58.1 Å²	58.1	60%	0.601	34%	0.336	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.2	5.6	170.8	54.3	0	0	0	0	114	K607 S622 V623 I624	K607-S626 PolarHBondContact NZ-O 3.08Å; K607-S626 VanDerWaalsContact NZ-O 3.11Å; K607-S626 PolarHBondContact NZ-OG 3.09Å; S622-S626 WeakPolarHBondContact O-CB 3.35Å; S622-S626 PolarHBondContact O-N 2.93Å; S622-S626 PolarHBondContact O-OG 2.96Å; V623-S626 PolarHBondContact O-OG 3.45Å; I624-S626 PolarHBondContact O-N 3.34Å; I624-S626 VanDerWaalsContact O-N 3.08Å
627	D	96.2	Very high	94	Very high	27 Å²	27	56.1 Å²	56.1	14%	0.144	32%	0.322	C	S	.	.	S	Bend	trans	-105.9	137.5	172	-162.9	-67.5	0	0	0	110.6	I603 K607 I624 S625 R629 A630	I603-D627 HydrophobicContact CD1-CB 4.17Å; I603-D627 HydrophobicContact CG1-CB 4.09Å; I603-D627 HydrophobicContact CG2-CB 3.7Å; K607-D627 VanDerWaalsContact NZ-N 3.11Å; I624-D627 VanDerWaalsContact O-CB 3.31Å; I624-D627 WeakPolarHBondContact O-CB 3.31Å; I624-D627 PolarHBondContact O-N 3.16Å; S625-D627 PolarHBondContact O-N 3.26Å; D627-R629 PolarHBondContact O-N 3.36Å; D627-R629 VanDerWaalsContact O-N 3.12Å; D627-R629 VanDerWaalsContact OD1-CB 3.26Å; D627-R629 WeakPolarHBondContact OD1-CB 3.36Å; D627-R629 WeakPolarHBondContact OD1-CG 3.08Å; D627-R629 IonicContact OD1-CZ 3.53Å; D627-R629 PolarHBondContact OD1-N 3.12Å; D627-R629 IonicContact OD1-NE 3.58Å; D627-R629 PolarHBondContact OD1-NE 2.81Å; D627-R629 IonicContact OD1-NH2 3.34Å; D627-R629 IonicContact OD2-CZ 2.67Å; D627-R629 IonicContact OD2-NE 3.2Å; D627-R629 PolarHBondContact OD2-NE 2.61Å; D627-R629 IonicContact OD2-NH2 3.97Å; D627-R629 PolarHBondContact OD2-NH2 2.78Å; D627-A630 VanDerWaalsContact O-CB 3.27Å; D627-A630 WeakPolarHBondContact O-CB 3.39Å; D627-A630 PolarHBondContact O-N 3.17Å
628	K	95	Very high	94	Very high	192 Å²	192	53.7 Å²	53.7	84%	0.835	31%	0.312	S	S	*	.	G	3₁₀ helix	trans	-62	-21.9	179	-64.6	-175.9	-179.8	-178.8	0	113.2	A630 T631	K628-A630 PolarHBondContact O-N 3.07Å; K628-T631 PolarHBondContact O-OG1 2.85Å
629	R	94.1	Very high	94	Very high	86 Å²	86	53 Å²	53	33%	0.325	30%	0.304	S	S	.	.	G	3₁₀ helix	trans	-71.4	-15.9	174.8	-66.8	171.2	-74.3	-171.4	-5.4	113.2	I599 I603 D606 D627 T631 T632	I599-R629 HydrophobicContact CG2-CB 3.94Å; I603-R629 HydrophobicContact CD1-CB 3.93Å; I603-R629 HydrophobicContact CG1-CB 4.25Å; D606-R629 IonicContact OD2-CZ 2.72Å; D606-R629 VanDerWaalsContact OD2-CZ 3.24Å; D606-R629 IonicContact OD2-NH1 3.18Å; D606-R629 PolarHBondContact OD2-NH1 3.35Å; D606-R629 IonicContact OD2-NH2 2.85Å; D606-R629 PolarHBondContact OD2-NH2 3.21Å; D627-R629 PolarHBondContact O-N 3.36Å; D627-R629 VanDerWaalsContact O-N 3.12Å; D627-R629 VanDerWaalsContact OD1-CB 3.26Å; D627-R629 WeakPolarHBondContact OD1-CB 3.36Å; D627-R629 WeakPolarHBondContact OD1-CG 3.08Å; D627-R629 IonicContact OD1-CZ 3.53Å; D627-R629 PolarHBondContact OD1-N 3.12Å; D627-R629 IonicContact OD1-NE 3.58Å; D627-R629 PolarHBondContact OD1-NE 2.81Å; D627-R629 IonicContact OD1-NH2 3.34Å; D627-R629 IonicContact OD2-CZ 2.67Å; D627-R629 IonicContact OD2-NE 3.2Å; D627-R629 PolarHBondContact OD2-NE 2.61Å; D627-R629 IonicContact OD2-NH2 3.97Å; D627-R629 PolarHBondContact OD2-NH2 2.78Å; R629-T631 VanDerWaalsContact C-N 3.35Å; R629-T632 PolarHBondContact O-OG1 2.87Å
630	A	90.8	Very high	94	Very high	12 Å²	12	51.1 Å²	51.1	10%	0.099	29%	0.294	C	S	.	.	G	3₁₀ helix	trans	-73.1	-24	-176.8	0	0	0	0	0	113.9	I624 D627 K628 T632 L633	I624-A630 HydrophobicContact CG2-CB 3.82Å; I624-A630 WeakPolarHBondContact O-CB 3.39Å; D627-A630 VanDerWaalsContact O-CB 3.27Å; D627-A630 WeakPolarHBondContact O-CB 3.39Å; D627-A630 PolarHBondContact O-N 3.17Å; K628-A630 PolarHBondContact O-N 3.07Å; A630-T632 PolarHBondContact O-N 2.9Å; A630-T632 VanDerWaalsContact O-N 3.08Å; A630-L633 HydrophobicContact CB-CD1 4.46Å; A630-L633 PolarHBondContact O-N 2.74Å; A630-L633 VanDerWaalsContact O-N 3.09Å
631	T	89.8	Confident	94	Very high	126 Å²	126	51.1 Å²	51.1	77%	0.773	29%	0.294	S	S	*	.	G	3₁₀ helix	trans	-65.9	-12.6	-176.6	60.1	0	0	0	0	114.4	K628 R629	K628-T631 PolarHBondContact O-OG1 2.85Å; R629-T631 VanDerWaalsContact C-N 3.35Å
632	T	90.3	Very high	94.1	Very high	92 Å²	92	51.1 Å²	51.1	56%	0.564	29%	0.29	S	S	*	.	G	3₁₀ helix	trans	-108.6	2.1	177.1	56.4	0	0	0	0	113.6	R592 R629 A630	R592-T632 PolarHBondContact NH1-O 2.83Å; R629-T632 PolarHBondContact O-OG1 2.87Å; A630-T632 PolarHBondContact O-N 2.9Å; A630-T632 VanDerWaalsContact O-N 3.08Å
633	L	94.1	Very high	94	Very high	16 Å²	16	51 Å²	51	8%	0.084	28%	0.283	C	S	.	.	S	Bend	trans	-91.6	138	-178.6	-57.1	-179.8	0	0	0	110.6	E596 I599 I600 I603 I624 A630 I638	E596-L633 HydrophobicContact CB-CD2 3.89Å; E596-L633 HydrophobicContact CG-CD2 3.74Å; I599-L633 HydrophobicContact CB-CD2 4.15Å; I599-L633 HydrophobicContact CD1-CD2 4.22Å; I599-L633 HydrophobicContact CG2-CD2 4.01Å; I600-L633 HydrophobicContact CD1-CD1 4.25Å; I600-L633 HydrophobicContact CG1-CD1 3.63Å; I603-L633 HydrophobicContact CD1-CD1 4.12Å; I624-L633 HydrophobicContact CG2-CD1 4.07Å; A630-L633 HydrophobicContact CB-CD1 4.46Å; A630-L633 PolarHBondContact O-N 2.74Å; A630-L633 VanDerWaalsContact O-N 3.09Å; L633-I638 HydrophobicContact CB-CD1 3.96Å; L633-I638 HydrophobicContact CB-CG1 4.06Å; L633-I638 HydrophobicContact CD1-CD1 4.39Å; L633-I638 HydrophobicContact CD1-CG1 4.31Å
634	D	95.3	Very high	94	Very high	2 Å²	2	51.2 Å²	51.2	1%	0.011	29%	0.286	C	S	.	.			trans	-72.4	134.1	173.8	168.1	94.8	0	0	0	110.9	H549 S550 E596 G636 N637 I638	H549-D634 WeakPolarHBondContact CA-OD1 3.24Å; H549-D634 WeakPolarHBondContact CB-OD1 3.5Å; S550-D634 WeakPolarHBondContact CB-OD2 3.11Å; S550-D634 PolarHBondContact N-OD1 2.88Å; S550-D634 PolarHBondContact N-OD2 2.87Å; S550-D634 VanDerWaalsContact N-OD2 3.14Å; S550-D634 PolarHBondContact OG-OD2 3.28Å; E596-D634 PolarHBondContact OE2-N 2.8Å; D634-G636 VanDerWaalsContact C-N 3.27Å; D634-G636 PolarHBondContact O-N 2.82Å; D634-G636 WeakPolarHBondContact OD2-CA 3.43Å; D634-G636 PolarHBondContact OD2-N 3.25Å; D634-N637 HydrophobicContact CB-CB 4.01Å; D634-N637 WeakPolarHBondContact O-CB 3.41Å; D634-N637 PolarHBondContact O-N 2.9Å; D634-N637 PolarHBondContact OD2-N 3.12Å; D634-I638 PolarHBondContact O-N 2.81Å
635	A	93	Very high	93.9	Very high	53 Å²	53	52.7 Å²	52.7	44%	0.438	29%	0.293	S	S	.	.	H	α-helix	trans	-63.2	-31.6	-176.7	0	0	0	0	0	113.2	H549 K639	H549-A635 HydrophobicContact CB-CB 4.37Å; A635-K639 PolarHBondContact O-N 2.63Å; A635-K639 VanDerWaalsContact O-N 3.15Å
636	G	93.6	Very high	94	Very high	0 Å²	0	50.1 Å²	50.1	0%	0	27%	0.272	C	S	.	.	H	α-helix	trans	-67.8	-42.5	171.5	0	0	0	0	0	111.8	D634 I638 K639 L640	D634-G636 VanDerWaalsContact C-N 3.27Å; D634-G636 PolarHBondContact O-N 2.82Å; D634-G636 WeakPolarHBondContact OD2-CA 3.43Å; D634-G636 PolarHBondContact OD2-N 3.25Å; G636-I638 VanDerWaalsContact C-N 3.34Å; G636-I638 PolarHBondContact O-N 3.33Å; G636-K639 CarbonylContact O-C 3.57Å; G636-K639 WeakPolarHBondContact O-CB 3.48Å; G636-K639 PolarHBondContact O-N 2.73Å; G636-K639 VanDerWaalsContact O-N 3.11Å; G636-L640 WeakPolarHBondContact O-CB 3.17Å; G636-L640 VanDerWaalsContact O-CG 3.31Å; G636-L640 WeakPolarHBondContact O-CG 3.26Å; G636-L640 PolarHBondContact O-N 3.22Å
637	N	95.4	Very high	94	Very high	0 Å²	0	52.1 Å²	52.1	0%	0	27%	0.272	C	S	.	.	H	α-helix	trans	-65.2	-35.7	175.9	-72.3	-15.8	0	0	0	112.1	S550 L589 Y593 E596 D634 A641	S550-N637 WeakPolarHBondContact CB-OD1 3.41Å; S550-N637 PolarHBondContact OG-N 3.42Å; S550-N637 PolarHBondContact OG-OD1 3.11Å; L589-N637 PolarHBondContact O-ND2 2.89Å; Y593-N637 HydrophobicContact CD2-CB 4.03Å; E596-N637 HydrophobicContact CB-CB 4.48Å; E596-N637 VanDerWaalsContact OE2-CB 3.29Å; E596-N637 WeakPolarHBondContact OE2-CB 3.49Å; E596-N637 PolarHBondContact OE2-ND2 2.87Å; D634-N637 HydrophobicContact CB-CB 4.01Å; D634-N637 WeakPolarHBondContact O-CB 3.41Å; D634-N637 PolarHBondContact O-N 2.9Å; D634-N637 PolarHBondContact OD2-N 3.12Å; N637-A641 VanDerWaalsContact O-CB 3.23Å; N637-A641 WeakPolarHBondContact O-CB 3.15Å; N637-A641 PolarHBondContact O-N 2.83Å
638	I	94.8	Very high	93.9	Very high	18 Å²	18	57.1 Å²	57.1	9%	0.092	29%	0.293	C	S	.	.	H	α-helix	trans	-59.5	-47	169.1	-67	171.1	0	0	0	110.4	I600 F617 F620 I624 L633 D634 G636 A641 F642	I600-I638 HydrophobicContact CD1-CG1 4.03Å; F617-I638 HydrophobicContact CE2-CG2 4.3Å; F617-I638 HydrophobicContact CZ-CG2 4.49Å; F620-I638 HydrophobicContact CD1-CG2 4.47Å; F620-I638 HydrophobicContact CE1-CG2 4.06Å; I624-I638 HydrophobicContact CD1-CG2 3.98Å; I624-I638 HydrophobicContact CG2-CD1 4.07Å; I624-I638 HydrophobicContact CG2-CG1 4.46Å; L633-I638 HydrophobicContact CB-CD1 3.96Å; L633-I638 HydrophobicContact CB-CG1 4.06Å; L633-I638 HydrophobicContact CD1-CD1 4.39Å; L633-I638 HydrophobicContact CD1-CG1 4.31Å; D634-I638 PolarHBondContact O-N 2.81Å; G636-I638 VanDerWaalsContact C-N 3.34Å; G636-I638 PolarHBondContact O-N 3.33Å; I638-A641 WeakPolarHBondContact O-CB 3.14Å; I638-A641 PolarHBondContact O-N 3.46Å; I638-F642 PolarHBondContact O-N 3.4Å
639	K	93.7	Very high	93.7	Very high	102 Å²	102	48 Å²	48	44%	0.443	25%	0.254	S	S	.	.	H	α-helix	trans	-67	-40.4	178.7	-161.1	169.5	-172	170.5	0	113.2	M551 F617 A635 G636 A641 F642 N643	M551-K639 HydrophobicContact SD-CB 4.42Å; F617-K639 HydrophobicContact CE2-CB 4.1Å; F617-K639 HydrophobicContact CE2-CG 4.07Å; F617-K639 HydrophobicContact CZ-CB 4.31Å; F617-K639 HydrophobicContact CZ-CG 4.34Å; A635-K639 PolarHBondContact O-N 2.63Å; A635-K639 VanDerWaalsContact O-N 3.15Å; G636-K639 CarbonylContact O-C 3.57Å; G636-K639 WeakPolarHBondContact O-CB 3.48Å; G636-K639 PolarHBondContact O-N 2.73Å; G636-K639 VanDerWaalsContact O-N 3.11Å; K639-A641 VanDerWaalsContact C-N 3.28Å; K639-A641 PolarHBondContact O-N 2.79Å; K639-F642 WeakPolarHBondContact O-CB 3.23Å; K639-F642 PolarHBondContact O-N 2.85Å; K639-N643 VanDerWaalsContact O-CG 3.27Å; K639-N643 PolarHBondContact O-N 3.01Å; K639-N643 PolarHBondContact O-OD1 3.05Å
640	L	93.9	Very high	93.6	Very high	50 Å²	50	47.3 Å²	47.3	26%	0.262	25%	0.254	S	S	.	.	H	α-helix	trans	-67.1	-27.6	172.2	-69	172.2	0	0	0	112.4	M551 Y593 G636 S644	M551-L640 HydrophobicContact CE-CD2 3.95Å; M551-L640 HydrophobicContact CG-CD1 4Å; M551-L640 HydrophobicContact CG-CD2 4.27Å; M551-L640 HydrophobicContact CG-CG 3.99Å; M551-L640 HydrophobicContact SD-CD1 4.38Å; M551-L640 HydrophobicContact SD-CD2 3.74Å; M551-L640 HydrophobicContact SD-CG 3.69Å; Y593-L640 HydrophobicContact CD2-CB 3.99Å; Y593-L640 HydrophobicContact CD2-CD1 4.38Å; Y593-L640 HydrophobicContact CE2-CB 3.33Å; Y593-L640 HydrophobicContact CE2-CD1 4.46Å; Y593-L640 PolarHBondContact OH-O 3.18Å; G636-L640 WeakPolarHBondContact O-CB 3.17Å; G636-L640 VanDerWaalsContact O-CG 3.31Å; G636-L640 WeakPolarHBondContact O-CG 3.26Å; G636-L640 PolarHBondContact O-N 3.22Å; L640-S644 WeakPolarHBondContact O-CB 3.45Å; L640-S644 PolarHBondContact O-N 3.27Å
641	A	95.5	Very high	93.7	Very high	0 Å²	0	49.2 Å²	49.2	0%	0	27%	0.269	C	S	.	.	H	α-helix	trans	-76	-42.5	173.3	0	0	0	0	0	111	Y593 K597 I600 N637 I638 K639 S644 L645	Y593-A641 HydrophobicContact CE2-CB 4.47Å; K597-A641 HydrophobicContact CG-CB 4.37Å; I600-A641 HydrophobicContact CD1-CB 3.61Å; I600-A641 HydrophobicContact CG2-CB 4.07Å; N637-A641 VanDerWaalsContact O-CB 3.23Å; N637-A641 WeakPolarHBondContact O-CB 3.15Å; N637-A641 PolarHBondContact O-N 2.83Å; I638-A641 WeakPolarHBondContact O-CB 3.14Å; I638-A641 PolarHBondContact O-N 3.46Å; K639-A641 VanDerWaalsContact C-N 3.28Å; K639-A641 PolarHBondContact O-N 2.79Å; A641-S644 PolarHBondContact O-N 3.17Å; A641-L645 WeakPolarHBondContact O-CB 3.29Å; A641-L645 VanDerWaalsContact O-CG 3.24Å; A641-L645 WeakPolarHBondContact O-CG 3.49Å; A641-L645 PolarHBondContact O-N 3.21Å
642	F	96.1	Very high	93.7	Very high	15 Å²	15	47.5 Å²	47.5	7%	0.066	25%	0.249	C	C	.	.	H	α-helix	trans	-54.8	-59	172.8	177.7	-111.4	0	0	0	111.4	T615 F617 F620 I638 K639 S644 L645 L646	T615-F642 HydrophobicContact CG2-CE2 4.34Å; T615-F642 WeakPolarHBondContact O-CZ 3.43Å; F617-F642 HydrophobicContact CB-CD1 4.2Å; F617-F642 HydrophobicContact CB-CE1 3.91Å; F617-F642 HydrophobicContact CB-CZ 4.15Å; F617-F642 HydrophobicContact CD2-CB 3.93Å; F617-F642 AromaticContact CD2-CD1 3.7Å; F617-F642 HydrophobicContact CD2-CD1 3.7Å; F617-F642 HydrophobicContact CD2-CD2 4.34Å; F617-F642 HydrophobicContact CD2-CE1 4.29Å; F617-F642 AromaticContact CD2-CG 3.72Å; F617-F642 HydrophobicContact CD2-CG 3.72Å; F617-F642 HydrophobicContact CE2-CB 4.19Å; F617-F642 HydrophobicContact CE2-CG 4.48Å; F617-F642 HydrophobicContact CG-CD1 4.41Å; F620-F642 HydrophobicContact CB-CD2 3.76Å; F620-F642 HydrophobicContact CB-CE2 3.98Å; F620-F642 HydrophobicContact CD1-CB 3.76Å; F620-F642 AromaticContact CD1-CD2 3.66Å; F620-F642 HydrophobicContact CD1-CD2 3.66Å; F620-F642 HydrophobicContact CD1-CG 4.07Å; F620-F642 AromaticContact CD2-CD2 3.81Å; F620-F642 HydrophobicContact CD2-CD2 3.81Å; F620-F642 HydrophobicContact CE1-CB 3.49Å; F620-F642 VanDerWaalsContact CE1-CB 3.49Å; F620-F642 HydrophobicContact CE1-CD2 4.1Å; F620-F642 HydrophobicContact CE1-CG 4.26Å; F620-F642 HydrophobicContact CE2-CD2 4.22Å; F620-F642 HydrophobicContact CG-CB 4.44Å; F620-F642 AromaticContact CG-CD2 3.49Å; F620-F642 HydrophobicContact CG-CD2 3.49Å; F620-F642 VanDerWaalsContact CG-CD2 3.49Å; F620-F642 HydrophobicContact CG-CE2 4.19Å; F620-F642 HydrophobicContact CG-CG 4.35Å; F620-F642 HydrophobicContact CZ-CB 3.95Å; F620-F642 HydrophobicContact CZ-CD2 4.35Å; I638-F642 PolarHBondContact O-N 3.4Å; K639-F642 WeakPolarHBondContact O-CB 3.23Å; K639-F642 PolarHBondContact O-N 2.85Å; F642-S644 VanDerWaalsContact C-N 3.27Å; F642-S644 PolarHBondContact O-N 3.16Å; F642-L645 WeakPolarHBondContact O-CA 3.4Å; F642-L645 PolarHBondContact O-N 2.87Å; F642-L646 HydrophobicContact CE1-CD2 3.97Å; F642-L646 HydrophobicContact CZ-CD2 3.97Å; F642-L646 PolarHBondContact O-N 2.89Å
643	N	94.3	Very high	93.7	Very high	76 Å²	76	47.4 Å²	47.4	41%	0.406	24%	0.242	S	C	.	.	H	α-helix	trans	-53.6	-45.2	-177.3	-67.3	-1.5	0	0	0	111.7	K639 L645 L646 E647	K639-N643 VanDerWaalsContact O-CG 3.27Å; K639-N643 PolarHBondContact O-N 3.01Å; K639-N643 PolarHBondContact O-OD1 3.05Å; N643-L645 VanDerWaalsContact C-N 3.32Å; N643-L645 PolarHBondContact O-N 2.85Å; N643-L646 PolarHBondContact O-N 2.85Å; N643-E647 VanDerWaalsContact O-CB 3.29Å; N643-E647 WeakPolarHBondContact O-CB 3.23Å; N643-E647 PolarHBondContact O-N 2.87Å
644	S	94.8	Very high	93.5	Very high	34 Å²	34	51.9 Å²	51.9	24%	0.238	26%	0.258	C	S	.	.	H	α-helix	trans	-75.5	-15.5	-179.7	-174.9	0	0	0	0	114.3	K597 L640 A641 F642 K648	K597-S644 VanDerWaalsContact NZ-CB 3.33Å; K597-S644 PolarHBondContact NZ-OG 2.85Å; L640-S644 WeakPolarHBondContact O-CB 3.45Å; L640-S644 PolarHBondContact O-N 3.27Å; A641-S644 PolarHBondContact O-N 3.17Å; F642-S644 VanDerWaalsContact C-N 3.27Å; F642-S644 PolarHBondContact O-N 3.16Å; S644-K648 WeakPolarHBondContact O-CB 3.4Å
645	L	94.8	Very high	93.3	Very high	31 Å²	31	57.8 Å²	57.8	16%	0.162	29%	0.285	C	S	.	.	H	α-helix	trans	-88.1	-35.8	170.2	-72.6	170.6	0	0	0	111.6	L604 V611 F620 A641 F642 N643 K648 A649	L604-L645 HydrophobicContact CD1-CD1 3.7Å; V611-L645 HydrophobicContact CB-CB 4.24Å; V611-L645 HydrophobicContact CG1-CB 4.24Å; V611-L645 HydrophobicContact CG2-CB 4.06Å; V611-L645 HydrophobicContact CG2-CD1 4.3Å; F620-L645 HydrophobicContact CE2-CD1 3.84Å; F620-L645 HydrophobicContact CZ-CD1 4.02Å; A641-L645 WeakPolarHBondContact O-CB 3.29Å; A641-L645 VanDerWaalsContact O-CG 3.24Å; A641-L645 WeakPolarHBondContact O-CG 3.49Å; A641-L645 PolarHBondContact O-N 3.21Å; F642-L645 WeakPolarHBondContact O-CA 3.4Å; F642-L645 PolarHBondContact O-N 2.87Å; N643-L645 VanDerWaalsContact C-N 3.32Å; N643-L645 PolarHBondContact O-N 2.85Å; L645-K648 PolarHBondContact O-N 2.83Å; L645-A649 PolarHBondContact O-N 3.42Å
646	L	94	Very high	93	Very high	34 Å²	34	60.9 Å²	60.9	18%	0.178	29%	0.285	C	S	.	.	H	α-helix	trans	-67.4	-48	175	-173.3	66.8	0	0	0	111.4	V611 E612 F642 N643 K648 A649 E650	V611-L646 HydrophobicContact CG1-CB 4.45Å; V611-L646 HydrophobicContact CG1-CD1 4.4Å; E612-L646 VanDerWaalsContact O-CD1 3.29Å; E612-L646 WeakPolarHBondContact O-CD1 3.28Å; F642-L646 HydrophobicContact CE1-CD2 3.97Å; F642-L646 HydrophobicContact CZ-CD2 3.97Å; F642-L646 PolarHBondContact O-N 2.89Å; N643-L646 PolarHBondContact O-N 2.85Å; L646-K648 PolarHBondContact O-N 2.95Å; L646-A649 CarbonylContact O-C 3.57Å; L646-A649 WeakPolarHBondContact O-CA 3.4Å; L646-A649 VanDerWaalsContact O-CB 3.3Å; L646-A649 WeakPolarHBondContact O-CB 3Å; L646-A649 PolarHBondContact O-N 2.8Å; L646-E650 PolarHBondContact O-N 2.96Å
647	E	94.5	Very high	92.8	Very high	128 Å²	128	67 Å²	67	60%	0.598	31%	0.314	S	S	*	.	H	α-helix	trans	-53.2	-40.5	170.7	-179	-166.3	-168	0	0	111.5	N643 E650 A651	N643-E647 VanDerWaalsContact O-CB 3.29Å; N643-E647 WeakPolarHBondContact O-CB 3.23Å; N643-E647 PolarHBondContact O-N 2.87Å; E647-E650 PolarHBondContact O-N 2.87Å; E647-A651 WeakPolarHBondContact O-CB 3.39Å; E647-A651 PolarHBondContact O-N 2.93Å
648	K	93.6	Very high	92.6	Very high	133 Å²	133	72.3 Å²	72.3	58%	0.578	34%	0.337	S	S	*	.	H	α-helix	trans	-71.5	-29.6	176	-174.5	173.5	-178.8	179.5	0	112.8	S644 L645 L646 R652	S644-K648 WeakPolarHBondContact O-CB 3.4Å; L645-K648 PolarHBondContact O-N 2.83Å; L646-K648 PolarHBondContact O-N 2.95Å; K648-R652 PolarHBondContact O-N 2.99Å
649	A	92.3	Very high	92.3	Very high	1 Å²	1	77.3 Å²	77.3	1%	0.008	36%	0.36	C	S	.	.	H	α-helix	trans	-67.9	-49.6	171.6	0	0	0	0	0	110.4	V611 V613 L645 L646 A651 R652 E653	V611-A649 WeakPolarHBondContact O-CB 3.45Å; V613-A649 HydrophobicContact CG2-CB 4.26Å; L645-A649 PolarHBondContact O-N 3.42Å; L646-A649 CarbonylContact O-C 3.57Å; L646-A649 WeakPolarHBondContact O-CA 3.4Å; L646-A649 VanDerWaalsContact O-CB 3.3Å; L646-A649 WeakPolarHBondContact O-CB 3Å; L646-A649 PolarHBondContact O-N 2.8Å; A649-A651 VanDerWaalsContact C-N 3.33Å; A649-A651 PolarHBondContact O-N 3.27Å; A649-R652 WeakPolarHBondContact O-CB 3.39Å; A649-R652 PolarHBondContact O-N 3.45Å; A649-R652 VanDerWaalsContact O-N 3.12Å; A649-E653 PolarHBondContact O-N 2.67Å
650	E	92.1	Very high	92.1	Very high	71 Å²	71	78.4 Å²	78.4	33%	0.332	37%	0.367	S	S	.	.	H	α-helix	trans	-57.6	-43	174.1	-70.4	-176.6	-156.5	0	0	112.9	V613 L646 E647 R652 E653 R654	V613-E650 HydrophobicContact CG1-CG 4.05Å; V613-E650 HydrophobicContact CG2-CB 4.49Å; V613-E650 HydrophobicContact CG2-CG 4.11Å; L646-E650 PolarHBondContact O-N 2.96Å; E647-E650 PolarHBondContact O-N 2.87Å; E650-R652 VanDerWaalsContact C-N 3.25Å; E650-R652 PolarHBondContact O-N 3.5Å; E650-E653 WeakPolarHBondContact O-CB 3.3Å; E650-E653 PolarHBondContact O-N 3.41Å; E650-R654 WeakPolarHBondContact O-CB 3.34Å; E650-R654 PolarHBondContact O-N 2.83Å; E650-R654 IonicContact OE2-CZ 3.66Å; E650-R654 IonicContact OE2-NH2 2.8Å; E650-R654 PolarHBondContact OE2-NH2 3.04Å
651	A	92.6	Very high	91.8	Very high	51 Å²	51	78.2 Å²	78.2	42%	0.421	37%	0.373	S	S	.	.	H	α-helix	trans	-61.1	-36.5	178.4	0	0	0	0	0	111.9	E647 A649 E655	E647-A651 WeakPolarHBondContact O-CB 3.39Å; E647-A651 PolarHBondContact O-N 2.93Å; A649-A651 VanDerWaalsContact C-N 3.33Å; A649-A651 PolarHBondContact O-N 3.27Å; A651-E655 WeakPolarHBondContact O-CB 3.01Å; A651-E655 PolarHBondContact O-N 2.75Å; A651-E655 VanDerWaalsContact O-N 3.07Å
652	R	90.2	Very high	91.6	Very high	90 Å²	90	85.1 Å²	85.1	34%	0.34	40%	0.399	S	S	.	.	H	α-helix	trans	-70.8	-41.9	174.1	-169	-162.8	-60.3	115.7	-8.5	111.7	K648 A649 E650 E655 R656	K648-R652 PolarHBondContact O-N 2.99Å; A649-R652 WeakPolarHBondContact O-CB 3.39Å; A649-R652 PolarHBondContact O-N 3.45Å; A649-R652 VanDerWaalsContact O-N 3.12Å; E650-R652 VanDerWaalsContact C-N 3.25Å; E650-R652 PolarHBondContact O-N 3.5Å; R652-E655 PolarHBondContact O-N 2.88Å; R652-R656 WeakPolarHBondContact O-CG 3.3Å; R652-R656 PolarHBondContact O-N 3.41Å
653	E	89.3	Confident	91.3	Very high	91 Å²	91	90.3 Å²	90.3	43%	0.425	42%	0.422	S	S	.	.	H	α-helix	trans	-60.2	-49.3	177	-148.6	59.6	-152.4	0	0	110.9	V613 A649 E650 E655 R656 E657	V613-E653 HydrophobicContact CG2-CB 3.96Å; V613-E653 HydrophobicContact CG2-CG 4.07Å; A649-E653 PolarHBondContact O-N 2.67Å; E650-E653 WeakPolarHBondContact O-CB 3.3Å; E650-E653 PolarHBondContact O-N 3.41Å; E653-E655 PolarHBondContact O-N 2.77Å; E653-R656 WeakPolarHBondContact O-CB 3.45Å; E653-R656 PolarHBondContact O-N 2.95Å; E653-R656 IonicContact OE1-NH1 3.97Å; E653-R656 IonicContact OE2-CZ 3.41Å; E653-R656 IonicContact OE2-NH1 2.76Å; E653-R656 PolarHBondContact OE2-NH1 3.15Å; E653-E657 PolarHBondContact O-N 2.94Å
654	R	89.9	Confident	90.9	Very high	110 Å²	110	91.1 Å²	91.1	42%	0.415	42%	0.424	S	S	.	.	H	α-helix	trans	-67.9	-16.1	176.1	-162.6	-175.9	-63.8	120	-1.8	113.3	E650 K658	E650-R654 WeakPolarHBondContact O-CB 3.34Å; E650-R654 PolarHBondContact O-N 2.83Å; E650-R654 IonicContact OE2-CZ 3.66Å; E650-R654 IonicContact OE2-NH2 2.8Å; E650-R654 PolarHBondContact OE2-NH2 3.04Å; R654-K658 WeakPolarHBondContact O-CD 3.48Å; R654-K658 WeakPolarHBondContact O-CE 3.36Å; R654-K658 WeakPolarHBondContact O-CG 3.26Å
655	E	90.4	Very high	90.6	Very high	125 Å²	125	96.8 Å²	96.8	58%	0.584	44%	0.444	S	S	*	.	H	α-helix	trans	-84.8	-43.9	169.3	-178.1	165.4	-138.2	0	0	111.6	A651 R652 E653 K658 E659	A651-E655 WeakPolarHBondContact O-CB 3.01Å; A651-E655 PolarHBondContact O-N 2.75Å; A651-E655 VanDerWaalsContact O-N 3.07Å; R652-E655 PolarHBondContact O-N 2.88Å; E653-E655 PolarHBondContact O-N 2.77Å; E655-K658 CarbonylContact O-C 3.58Å; E655-K658 PolarHBondContact O-N 2.92Å; E655-K658 VanDerWaalsContact O-N 3.16Å; E655-E659 PolarHBondContact O-N 3.23Å
656	R	88.4	Confident	90.5	Very high	118 Å²	118	103.9 Å²	103.9	45%	0.445	47%	0.469	S	S	.	.	H	α-helix	trans	-55.3	-51.7	172.8	-70.7	165.6	168.4	172.2	-11.6	111	R652 E653 K658 E659 E660	R652-R656 WeakPolarHBondContact O-CG 3.3Å; R652-R656 PolarHBondContact O-N 3.41Å; E653-R656 WeakPolarHBondContact O-CB 3.45Å; E653-R656 PolarHBondContact O-N 2.95Å; E653-R656 IonicContact OE1-NH1 3.97Å; E653-R656 IonicContact OE2-CZ 3.41Å; E653-R656 IonicContact OE2-NH1 2.76Å; E653-R656 PolarHBondContact OE2-NH1 3.15Å; R656-K658 VanDerWaalsContact C-N 3.27Å; R656-K658 PolarHBondContact O-N 3.44Å; R656-E659 CarbonylContact O-C 3.6Å; R656-E659 WeakPolarHBondContact O-CA 3.47Å; R656-E659 PolarHBondContact O-N 3.19Å; R656-E660 WeakPolarHBondContact O-CG 3.31Å; R656-E660 PolarHBondContact O-N 2.81Å
657	E	88.3	Confident	90.3	Very high	130 Å²	130	104.5 Å²	104.5	61%	0.607	47%	0.47	S	S	*	.	H	α-helix	trans	-53.9	-43.3	176	-176	-165.4	-152.6	0	0	111.6	E653 E660 A661	E653-E657 PolarHBondContact O-N 2.94Å; E657-E660 PolarHBondContact O-N 3.4Å; E657-A661 VanDerWaalsContact O-CB 3.26Å; E657-A661 WeakPolarHBondContact O-CB 3.23Å; E657-A661 PolarHBondContact O-N 3.03Å
658	K	90.9	Very high	90.2	Very high	110 Å²	110	100.6 Å²	100.6	48%	0.478	45%	0.452	S	S	.	.	H	α-helix	trans	-70	-33.5	177.1	-73.5	170.9	-167.9	167.7	0	112.8	R654 E655 R656 R662	R654-K658 WeakPolarHBondContact O-CD 3.48Å; R654-K658 WeakPolarHBondContact O-CE 3.36Å; R654-K658 WeakPolarHBondContact O-CG 3.26Å; E655-K658 CarbonylContact O-C 3.58Å; E655-K658 PolarHBondContact O-N 2.92Å; E655-K658 VanDerWaalsContact O-N 3.16Å; R656-K658 VanDerWaalsContact C-N 3.27Å; R656-K658 PolarHBondContact O-N 3.44Å; K658-R662 WeakPolarHBondContact O-CB 3.49Å; K658-R662 VanDerWaalsContact O-CD 3.24Å; K658-R662 WeakPolarHBondContact O-CD 3.41Å; K658-R662 WeakPolarHBondContact O-CG 3.43Å; K658-R662 PolarHBondContact O-N 3.32Å
659	E	89.4	Confident	90.1	Very high	123 Å²	123	96.7 Å²	96.7	58%	0.575	44%	0.444	S	S	*	.	H	α-helix	trans	-69.7	-43	173.1	-179.1	160.3	-145.4	0	0	111.6	E655 R656 R662 K663	E655-E659 PolarHBondContact O-N 3.23Å; R656-E659 CarbonylContact O-C 3.6Å; R656-E659 WeakPolarHBondContact O-CA 3.47Å; R656-E659 PolarHBondContact O-N 3.19Å; E659-R662 CarbonylContact O-C 3.57Å; E659-R662 WeakPolarHBondContact O-CB 3.36Å; E659-R662 PolarHBondContact O-N 3.29Å; E659-K663 WeakPolarHBondContact O-CB 3.48Å; E659-K663 PolarHBondContact O-N 2.87Å
660	E	88.7	Confident	90.1	Very high	125 Å²	125	98.5 Å²	98.5	58%	0.584	46%	0.459	S	S	*	.	H	α-helix	trans	-64.6	-43.6	175.4	-69.4	-175.1	167.6	0	0	111.5	R656 E657 R662 K663 M664	R656-E660 WeakPolarHBondContact O-CG 3.31Å; R656-E660 PolarHBondContact O-N 2.81Å; E657-E660 PolarHBondContact O-N 3.4Å; E660-R662 VanDerWaalsContact C-N 3.28Å; E660-R662 PolarHBondContact O-N 3.03Å; E660-K663 CarbonylContact O-C 3.39Å; E660-K663 WeakPolarHBondContact O-CB 3.25Å; E660-K663 PolarHBondContact O-N 3.08Å; E660-K663 VanDerWaalsContact O-N 3.08Å; E660-M664 WeakPolarHBondContact O-CG 3.36Å; E660-M664 PolarHBondContact O-N 3.33Å
661	A	88.4	Confident	90.1	Very high	47 Å²	47	95.1 Å²	95.1	39%	0.388	44%	0.444	S	S	.	.	H	α-helix	trans	-60.9	-34.9	172.1	0	0	0	0	0	112.7	E657 K665	E657-A661 VanDerWaalsContact O-CB 3.26Å; E657-A661 WeakPolarHBondContact O-CB 3.23Å; E657-A661 PolarHBondContact O-N 3.03Å; A661-K665 WeakPolarHBondContact O-CB 3.39Å; A661-K665 VanDerWaalsContact O-CG 3.31Å; A661-K665 WeakPolarHBondContact O-CG 3.39Å; A661-K665 PolarHBondContact O-N 3.49Å
662	R	91.3	Very high	90	Very high	144 Å²	144	95.1 Å²	95.1	54%	0.543	43%	0.434	S	S	.	.	H	α-helix	trans	-69.8	-39.3	171.6	-72.9	160.8	-177.8	163.6	-0.6	111.8	K658 E659 E660 K665 R666	K658-R662 WeakPolarHBondContact O-CB 3.49Å; K658-R662 VanDerWaalsContact O-CD 3.24Å; K658-R662 WeakPolarHBondContact O-CD 3.41Å; K658-R662 WeakPolarHBondContact O-CG 3.43Å; K658-R662 PolarHBondContact O-N 3.32Å; E659-R662 CarbonylContact O-C 3.57Å; E659-R662 WeakPolarHBondContact O-CB 3.36Å; E659-R662 PolarHBondContact O-N 3.29Å; E660-R662 VanDerWaalsContact C-N 3.28Å; E660-R662 PolarHBondContact O-N 3.03Å; R662-K665 PolarHBondContact O-N 2.65Å; R662-R666 WeakPolarHBondContact O-CG 3.24Å; R662-R666 PolarHBondContact O-N 2.65Å
663	K	89.8	Confident	90	Very high	125 Å²	125	94.2 Å²	94.2	54%	0.543	44%	0.438	S	S	.	.	H	α-helix	trans	-64	-45.9	177	-173	-179.7	179.5	-177.2	0	110.7	E659 E660 R666 K667	E659-K663 WeakPolarHBondContact O-CB 3.48Å; E659-K663 PolarHBondContact O-N 2.87Å; E660-K663 CarbonylContact O-C 3.39Å; E660-K663 WeakPolarHBondContact O-CB 3.25Å; E660-K663 PolarHBondContact O-N 3.08Å; E660-K663 VanDerWaalsContact O-N 3.08Å; K663-R666 WeakPolarHBondContact O-CB 3.42Å; K663-R666 PolarHBondContact O-N 3.11Å; K663-K667 PolarHBondContact O-N 3.44Å
664	M	85.4	Confident	90.1	Very high	93 Å²	93	90.5 Å²	90.5	46%	0.458	42%	0.421	S	S	.	.	H	α-helix	trans	-60.9	-46.1	172.8	-69	-59.2	-72.4	0	0	111.7	E660 R666 K667 E668	E660-M664 WeakPolarHBondContact O-CG 3.36Å; E660-M664 PolarHBondContact O-N 3.33Å; M664-R666 VanDerWaalsContact C-N 3.29Å; M664-R666 PolarHBondContact O-N 3.11Å; M664-K667 PolarHBondContact O-N 2.98Å; M664-K667 VanDerWaalsContact O-N 3.15Å; M664-E668 PolarHBondContact O-N 3.38Å
665	K	89	Confident	90	Very high	152 Å²	152	85.4 Å²	85.4	66%	0.661	40%	0.402	S	S	*	.	H	α-helix	trans	-63.6	-29.3	175.3	-75.7	178.2	179.3	-177.4	0	113.8	A661 R662 A669	A661-K665 WeakPolarHBondContact O-CB 3.39Å; A661-K665 VanDerWaalsContact O-CG 3.31Å; A661-K665 WeakPolarHBondContact O-CG 3.39Å; A661-K665 PolarHBondContact O-N 3.49Å; R662-K665 PolarHBondContact O-N 2.65Å; K665-A669 VanDerWaalsContact O-CB 3.3Å; K665-A669 WeakPolarHBondContact O-CB 3.44Å; K665-A669 PolarHBondContact O-N 3.05Å
666	R	91.9	Very high	89.8	Confident	181 Å²	181	85.9 Å²	85.9	68%	0.683	40%	0.402	S	S	*	.	H	α-helix	trans	-69.1	-44.5	171	-74.9	172.8	-176.6	163.6	2	111.8	R662 K663 M664 A669 A670	R662-R666 WeakPolarHBondContact O-CG 3.24Å; R662-R666 PolarHBondContact O-N 2.65Å; K663-R666 WeakPolarHBondContact O-CB 3.42Å; K663-R666 PolarHBondContact O-N 3.11Å; M664-R666 VanDerWaalsContact C-N 3.29Å; M664-R666 PolarHBondContact O-N 3.11Å; R666-A669 PolarHBondContact O-N 3.33Å; R666-A670 PolarHBondContact O-N 2.74Å
667	K	90.4	Very high	89.7	Confident	47 Å²	47	87 Å²	87	20%	0.204	41%	0.412	C	S	.	.	H	α-helix	trans	-60.5	-45.6	174.7	-69	-171.3	167.9	-147.3	0	111.4	K663 M664 A669 A670 F671 D703 V704	K663-K667 PolarHBondContact O-N 3.44Å; M664-K667 PolarHBondContact O-N 2.98Å; M664-K667 VanDerWaalsContact O-N 3.15Å; K667-A669 PolarHBondContact O-N 3.28Å; K667-A670 PolarHBondContact O-N 2.87Å; K667-F671 WeakPolarHBondContact O-CB 3.49Å; K667-F671 PolarHBondContact O-N 3.11Å; K667-D703 HydrophobicContact CD-CB 4.18Å; K667-D703 WeakPolarHBondContact CD-O 3.27Å; K667-D703 VanDerWaalsContact CE-CG 3.44Å; K667-D703 WeakPolarHBondContact CE-OD1 3.43Å; K667-D703 HydrophobicContact CG-CB 4.35Å; K667-D703 PolarHBondContact NZ-O 3.15Å; K667-D703 IonicContact NZ-OD1 2.81Å; K667-D703 PolarHBondContact NZ-OD1 3.04Å; K667-V704 HydrophobicContact CB-CG2 4.04Å
668	E	91.4	Very high	89.5	Confident	46 Å²	46	81.3 Å²	81.3	22%	0.215	39%	0.388	C	S	.	.	H	α-helix	trans	-58.9	-43.8	173.4	173	171.7	148.6	0	0	112.7	M664 F671 K672 R712 I713	M664-E668 PolarHBondContact O-N 3.38Å; E668-F671 PolarHBondContact O-N 3.03Å; E668-K672 HydrophobicContact CG-CD 4.07Å; E668-K672 PolarHBondContact O-N 3.27Å; E668-K672 IonicContact OE1-NZ 3.93Å; E668-K672 PolarHBondContact OE1-NZ 3.32Å; E668-R712 IonicContact OE2-NH2 2.72Å; E668-R712 PolarHBondContact OE2-NH2 2.99Å; E668-I713 HydrophobicContact CB-CD1 3.91Å; E668-I713 HydrophobicContact CB-CG1 4.37Å; E668-I713 HydrophobicContact CG-CD1 3.95Å; E668-I713 HydrophobicContact CG-CG1 3.84Å; E668-I713 HydrophobicContact CG-CG2 4.16Å
669	A	91.7	Very high	88.8	Confident	51 Å²	51	82.6 Å²	82.6	42%	0.421	41%	0.405	S	S	.	.	H	α-helix	trans	-67.3	-37.1	178.1	0	0	0	0	0	112.7	K665 R666 K667 T673	K665-A669 VanDerWaalsContact O-CB 3.3Å; K665-A669 WeakPolarHBondContact O-CB 3.44Å; K665-A669 PolarHBondContact O-N 3.05Å; R666-A669 PolarHBondContact O-N 3.33Å; K667-A669 PolarHBondContact O-N 3.28Å; A669-T673 WeakPolarHBondContact O-CB 3.31Å; A669-T673 PolarHBondContact O-N 2.72Å; A669-T673 PolarHBondContact O-OG1 3.38Å
670	A	92.9	Very high	88.4	Confident	39 Å²	39	81 Å²	81	32%	0.322	41%	0.406	S	S	.	.	H	α-helix	trans	-63.2	-45.9	172.2	0	0	0	0	0	110.8	R666 K667 T673 M674 A700	R666-A670 PolarHBondContact O-N 2.74Å; K667-A670 PolarHBondContact O-N 2.87Å; A670-T673 WeakPolarHBondContact O-CB 3.17Å; A670-T673 PolarHBondContact O-N 3.16Å; A670-T673 VanDerWaalsContact O-N 3.12Å; A670-M674 PolarHBondContact O-N 2.75Å; A670-A700 HydrophobicContact CB-CB 4.15Å
671	F	92.8	Very high	88	Confident	0 Å²	0	79.6 Å²	79.6	0%	0	41%	0.407	C	S	.	.	H	α-helix	trans	-60.3	-46.7	176.4	-160.2	-70	0	0	0	112.2	K667 E668 T673 M674 L675 W688 A700 F701 V704 R710 I713	K667-F671 WeakPolarHBondContact O-CB 3.49Å; K667-F671 PolarHBondContact O-N 3.11Å; E668-F671 PolarHBondContact O-N 3.03Å; F671-T673 VanDerWaalsContact C-N 3.26Å; F671-T673 PolarHBondContact O-N 3.07Å; F671-M674 HydrophobicContact CD1-CE 4Å; F671-M674 HydrophobicContact CD2-CE 4.2Å; F671-M674 HydrophobicContact CE1-CE 3.82Å; F671-M674 HydrophobicContact CE2-CE 4.04Å; F671-M674 HydrophobicContact CG-CE 4.16Å; F671-M674 HydrophobicContact CZ-CE 3.81Å; F671-M674 WeakPolarHBondContact O-CB 3.35Å; F671-M674 PolarHBondContact O-N 2.92Å; F671-L675 HydrophobicContact CD1-CD1 3.88Å; F671-L675 HydrophobicContact CD1-CG 4.03Å; F671-L675 HydrophobicContact CE1-CD1 3.85Å; F671-L675 HydrophobicContact CE1-CD2 4.15Å; F671-L675 HydrophobicContact CE1-CG 3.97Å; F671-L675 WeakPolarHBondContact O-CG 3.45Å; F671-L675 PolarHBondContact O-N 2.97Å; F671-W688 HydrophobicContact CE1-CH2 4.4Å; F671-W688 AromaticContact CZ-CH2 3.93Å; F671-W688 HydrophobicContact CZ-CH2 3.93Å; F671-W688 HydrophobicContact CZ-CZ3 4.46Å; F671-A700 VanDerWaalsContact CD2-O 3.32Å; F671-A700 WeakPolarHBondContact CD2-O 3.44Å; F671-F701 HydrophobicContact CE2-CB 4.18Å; F671-F701 AromaticContact CE2-CD2 3.63Å; F671-F701 HydrophobicContact CE2-CD2 3.63Å; F671-F701 HydrophobicContact CE2-CE2 4.35Å; F671-F701 HydrophobicContact CE2-CG 4.12Å; F671-F701 AromaticContact CZ-CD2 3.6Å; F671-F701 HydrophobicContact CZ-CD2 3.6Å; F671-F701 HydrophobicContact CZ-CE2 4.1Å; F671-V704 HydrophobicContact CB-CG2 4.26Å; F671-V704 HydrophobicContact CD2-CB 3.95Å; F671-V704 HydrophobicContact CD2-CG2 3.69Å; F671-V704 HydrophobicContact CE2-CB 4.32Å; F671-V704 HydrophobicContact CG-CG2 4.34Å; F671-R710 HydrophobicContact CE2-CB 4.2Å; F671-R710 HydrophobicContact CE2-CG 3.76Å; F671-R710 HydrophobicContact CZ-CB 4.05Å; F671-R710 HydrophobicContact CZ-CG 4.1Å; F671-I713 HydrophobicContact CB-CG2 3.96Å; F671-I713 HydrophobicContact CD1-CB 4.39Å; F671-I713 HydrophobicContact CD1-CG2 3.49Å; F671-I713 VanDerWaalsContact CD1-CG2 3.49Å; F671-I713 HydrophobicContact CE1-CG2 4.3Å; F671-I713 HydrophobicContact CG-CG2 3.9Å
672	K	89.5	Confident	87.7	Confident	51 Å²	51	78 Å²	78	22%	0.222	39%	0.392	C	S	.	.	H	α-helix	trans	-65.4	-27.9	175.1	-75	174.8	172.3	165.9	0	112.5	E668 K676 I713 D716 F717	E668-K672 HydrophobicContact CG-CD 4.07Å; E668-K672 PolarHBondContact O-N 3.27Å; E668-K672 IonicContact OE1-NZ 3.93Å; E668-K672 PolarHBondContact OE1-NZ 3.32Å; K672-K676 WeakPolarHBondContact O-CB 3.32Å; K672-K676 PolarHBondContact O-N 3.15Å; K672-I713 HydrophobicContact CD-CG2 4.24Å; K672-I713 VanDerWaalsContact CE-O 3.23Å; K672-I713 WeakPolarHBondContact CE-O 3.36Å; K672-I713 HydrophobicContact CG-CG2 3.69Å; K672-D716 IonicContact NZ-OD2 2.8Å; K672-D716 PolarHBondContact NZ-OD2 2.75Å; K672-F717 HydrophobicContact CG-CB 4.45Å
673	T	90.2	Very high	87	Confident	70 Å²	70	77.4 Å²	77.4	43%	0.429	40%	0.395	S	S	.	.	H	α-helix	trans	-73.7	-43.3	174.1	-57	0	0	0	0	111.7	A669 A670 F671 K676 Q677	A669-T673 WeakPolarHBondContact O-CB 3.31Å; A669-T673 PolarHBondContact O-N 2.72Å; A669-T673 PolarHBondContact O-OG1 3.38Å; A670-T673 WeakPolarHBondContact O-CB 3.17Å; A670-T673 PolarHBondContact O-N 3.16Å; A670-T673 VanDerWaalsContact O-N 3.12Å; F671-T673 VanDerWaalsContact C-N 3.26Å; F671-T673 PolarHBondContact O-N 3.07Å; T673-K676 CarbonylContact O-C 3.59Å; T673-K676 PolarHBondContact O-N 3.48Å; T673-K676 VanDerWaalsContact O-N 3.13Å; T673-Q677 WeakPolarHBondContact O-CG 3.41Å; T673-Q677 PolarHBondContact O-N 3.04Å
674	M	90.5	Very high	86.4	Confident	14 Å²	14	74.8 Å²	74.8	7%	0.069	39%	0.391	C	S	.	.	H	α-helix	trans	-57.5	-48.5	173.5	174.8	-162.8	77	0	0	111.2	A670 F671 K676 Q677 A678 F695 E698 A700 F701	A670-M674 PolarHBondContact O-N 2.75Å; F671-M674 HydrophobicContact CD1-CE 4Å; F671-M674 HydrophobicContact CD2-CE 4.2Å; F671-M674 HydrophobicContact CE1-CE 3.82Å; F671-M674 HydrophobicContact CE2-CE 4.04Å; F671-M674 HydrophobicContact CG-CE 4.16Å; F671-M674 HydrophobicContact CZ-CE 3.81Å; F671-M674 WeakPolarHBondContact O-CB 3.35Å; F671-M674 PolarHBondContact O-N 2.92Å; M674-K676 VanDerWaalsContact C-N 3.27Å; M674-K676 PolarHBondContact O-N 3.39Å; M674-Q677 PolarHBondContact O-N 3.48Å; M674-A678 PolarHBondContact O-N 3.47Å; M674-F695 HydrophobicContact CE-CB 3.89Å; M674-F695 HydrophobicContact CE-CD1 4.12Å; M674-F695 HydrophobicContact CE-CD2 4.26Å; M674-F695 HydrophobicContact CE-CG 3.83Å; M674-F695 HydrophobicContact CG-CD1 3.67Å; M674-F695 HydrophobicContact CG-CE1 3.86Å; M674-F695 HydrophobicContact CG-CG 4.35Å; M674-F695 HydrophobicContact SD-CB 4.04Å; M674-F695 HydrophobicContact SD-CD1 3.83Å; M674-F695 HydrophobicContact SD-CG 4.05Å; M674-E698 HydrophobicContact CG-CB 4.33Å; M674-E698 HydrophobicContact CG-CG 4.3Å; M674-E698 HydrophobicContact SD-CB 3.56Å; M674-E698 VanDerWaalsContact SD-CB 3.56Å; M674-E698 HydrophobicContact SD-CG 4.1Å; M674-A700 HydrophobicContact CB-CB 4.17Å; M674-A700 HydrophobicContact SD-CB 4Å; M674-F701 HydrophobicContact CE-CB 4.08Å; M674-F701 HydrophobicContact CE-CD2 4.26Å; M674-F701 HydrophobicContact SD-CB 3.85Å
675	L	88.6	Confident	85.9	Confident	2 Å²	2	79.5 Å²	79.5	1%	0.01	41%	0.412	C	S	.	.	H	α-helix	trans	-58.5	-37.1	174.2	-67.3	177	0	0	0	112.6	F671 Q677 A678 L682 V691 F695 F714 F717	F671-L675 HydrophobicContact CD1-CD1 3.88Å; F671-L675 HydrophobicContact CD1-CG 4.03Å; F671-L675 HydrophobicContact CE1-CD1 3.85Å; F671-L675 HydrophobicContact CE1-CD2 4.15Å; F671-L675 HydrophobicContact CE1-CG 3.97Å; F671-L675 WeakPolarHBondContact O-CG 3.45Å; F671-L675 PolarHBondContact O-N 2.97Å; L675-Q677 VanDerWaalsContact C-N 3.28Å; L675-Q677 PolarHBondContact O-N 3.01Å; L675-A678 WeakPolarHBondContact O-CB 3.3Å; L675-A678 PolarHBondContact O-N 2.95Å; L675-L682 HydrophobicContact CB-CD1 4.23Å; L675-L682 HydrophobicContact CD2-CD1 3.92Å; L675-V691 HydrophobicContact CD2-CG1 3.94Å; L675-F695 HydrophobicContact CD2-CD2 4.19Å; L675-F695 HydrophobicContact CD2-CE2 4.01Å; L675-F714 HydrophobicContact CD1-CB 4.27Å; L675-F714 HydrophobicContact CD1-CD2 4.01Å; L675-F714 HydrophobicContact CD2-CD2 4.11Å; L675-F717 HydrophobicContact CB-CD1 3.77Å; L675-F717 HydrophobicContact CB-CD2 4.44Å; L675-F717 HydrophobicContact CB-CE1 3.76Å; L675-F717 HydrophobicContact CB-CE2 4.43Å; L675-F717 HydrophobicContact CB-CG 4.13Å; L675-F717 HydrophobicContact CB-CZ 4.1Å; L675-F717 HydrophobicContact CD1-CB 3.88Å; L675-F717 HydrophobicContact CD1-CD1 3.85Å; L675-F717 HydrophobicContact CD1-CG 3.89Å; L675-F717 HydrophobicContact CG-CD1 4.44Å
676	K	86.6	Confident	85.5	Confident	135 Å²	135	73.4 Å²	73.4	59%	0.587	39%	0.39	S	S	*	.	H	α-helix	trans	-75	-13.4	177.5	-165.7	154.6	-173	148	0	114	K672 T673 M674 F717 E724	K672-K676 WeakPolarHBondContact O-CB 3.32Å; K672-K676 PolarHBondContact O-N 3.15Å; T673-K676 CarbonylContact O-C 3.59Å; T673-K676 PolarHBondContact O-N 3.48Å; T673-K676 VanDerWaalsContact O-N 3.13Å; M674-K676 VanDerWaalsContact C-N 3.27Å; M674-K676 PolarHBondContact O-N 3.39Å; K676-F717 HydrophobicContact CB-CE2 3.85Å; K676-F717 HydrophobicContact CB-CZ 3.91Å; K676-F717 HydrophobicContact CD-CE2 4.35Å; K676-F717 HydrophobicContact CG-CE2 4.38Å; K676-F717 HydrophobicContact CG-CZ 4.4Å; K676-E724 IonicContact NZ-OE2 3.22Å; K676-E724 PolarHBondContact NZ-OE2 3.13Å
677	Q	85.9	Confident	85	Confident	141 Å²	141	66.9 Å²	66.9	66%	0.659	37%	0.373	S	S	*	.	T	Hydrogen-bonded Turn	trans	-102.3	7.3	176.7	-69.5	177.6	-7.2	0	0	112.8	T673 M674 L675 T679	T673-Q677 WeakPolarHBondContact O-CG 3.41Å; T673-Q677 PolarHBondContact O-N 3.04Å; M674-Q677 PolarHBondContact O-N 3.48Å; L675-Q677 VanDerWaalsContact C-N 3.28Å; L675-Q677 PolarHBondContact O-N 3.01Å; Q677-T679 PolarHBondContact O-N 3.38Å; Q677-T679 PolarHBondContact O-OG1 2.86Å
678	A	84.6	Confident	84.7	Confident	12 Å²	12	66 Å²	66	10%	0.099	37%	0.368	C	S	.	.			trans	-50	131.6	174.6	0	0	0	0	0	112.4	M674 L675 P680 P681 L682 F695	M674-A678 PolarHBondContact O-N 3.47Å; L675-A678 WeakPolarHBondContact O-CB 3.3Å; L675-A678 PolarHBondContact O-N 2.95Å; A678-P680 CarbonylContact C-O 3.21Å; A678-P680 CarbonylContact O-C 3.51Å; A678-P681 WeakPolarHBondContact O-CA 3.44Å; A678-L682 HydrophobicContact CB-CD1 4.31Å; A678-L682 HydrophobicContact CB-CD2 3.72Å; A678-L682 HydrophobicContact CB-CG 3.61Å; A678-F695 HydrophobicContact CB-CE2 4.5Å; A678-F695 HydrophobicContact CB-CZ 3.81Å
679	T	76.9	Confident	84.4	Confident	136 Å²	136	70.3 Å²	70.3	83%	0.834	39%	0.388	S	S	*	.	S	Bend	trans	-132.6	113.9	173.9	-59.6	0	0	0	0	109	Q677	Q677-T679 PolarHBondContact O-N 3.38Å; Q677-T679 PolarHBondContact O-OG1 2.86Å
680	P	79	Confident	83.7	Confident	91 Å²	91	73 Å²	73	59%	0.591	39%	0.392	S	S	*	.	S	Bend	cis	-58.4	158.1	-5.8	-22.3	34.3	0	0	0	113.5	A678	A678-P680 CarbonylContact C-O 3.21Å; A678-P680 CarbonylContact O-C 3.51Å
681	P	81.1	Confident	83.2	Confident	94 Å²	94	71.2 Å²	71.2	61%	0.61	38%	0.377	S	S	*	.	P	Polyproline II helix	trans	-54.1	159.3	174.1	-26.5	36.1	0	0	0	113.2	A678	A678-P681 WeakPolarHBondContact O-CA 3.44Å
682	L	81.4	Confident	82.8	Confident	13 Å²	13	75.5 Å²	75.5	7%	0.068	39%	0.393	C	S	.	.	P	Polyproline II helix	trans	-86.8	117	175.6	-55.7	-174.4	0	0	0	109.9	L675 A678 V691 F714 F717 M718	L675-L682 HydrophobicContact CB-CD1 4.23Å; L675-L682 HydrophobicContact CD2-CD1 3.92Å; A678-L682 HydrophobicContact CB-CD1 4.31Å; A678-L682 HydrophobicContact CB-CD2 3.72Å; A678-L682 HydrophobicContact CB-CG 3.61Å; L682-V691 HydrophobicContact CD1-CG1 3.94Å; L682-V691 HydrophobicContact CD1-CG2 4.48Å; L682-V691 HydrophobicContact CD2-CG1 4.22Å; L682-V691 HydrophobicContact CD2-CG2 3.94Å; L682-F714 HydrophobicContact CD1-CE2 4.31Å; L682-F717 HydrophobicContact CD1-CE1 4.21Å; L682-M718 HydrophobicContact CB-CE 3.77Å; L682-M718 HydrophobicContact CD1-CE 4.03Å
683	E	77.7	Confident	82.4	Confident	132 Å²	132	80 Å²	80	62%	0.617	42%	0.415	S	S	*	.	P	Polyproline II helix	trans	-69.2	151.2	172.2	-63.9	-58.9	154.2	0	0	111.2	E685 A686	E683-E685 PolarHBondContact O-N 3.14Å; E683-E685 VanDerWaalsContact O-N 3.11Å; E683-A686 VanDerWaalsContact O-CB 3.26Å; E683-A686 WeakPolarHBondContact O-CB 3.39Å; E683-A686 PolarHBondContact O-N 3.07Å; E683-A686 VanDerWaalsContact O-N 3.07Å
684	P	76.8	Confident	82	Confident	70 Å²	70	83.2 Å²	83.2	46%	0.455	42%	0.419	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.2	-24.4	-177.5	-24.1	33.3	0	0	0	115.3	L721	P684-L721 HydrophobicContact CB-CD2 4.28Å; P684-L721 HydrophobicContact CG-CD2 3.82Å
685	E	75.8	Confident	81.8	Confident	192 Å²	192	83.6 Å²	83.6	90%	0.897	42%	0.42	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.5	4.1	-179.4	-60.2	-172.9	165	0	0	113.5	E683 S687	E683-E685 PolarHBondContact O-N 3.14Å; E683-E685 VanDerWaalsContact O-N 3.11Å; E685-S687 PolarHBondContact O-N 2.92Å
686	A	79.6	Confident	81.5	Confident	24 Å²	24	87.2 Å²	87.2	20%	0.198	44%	0.439	C	S	.	.			trans	-62	127.9	-174.1	0	0	0	0	0	112.9	E683 V691	E683-A686 VanDerWaalsContact O-CB 3.26Å; E683-A686 WeakPolarHBondContact O-CB 3.39Å; E683-A686 PolarHBondContact O-N 3.07Å; E683-A686 VanDerWaalsContact O-N 3.07Å; A686-V691 HydrophobicContact CB-CG2 3.91Å
687	S	82.3	Confident	81.2	Confident	45 Å²	45	90.2 Å²	90.2	32%	0.315	45%	0.452	S	S	.	.			trans	-70.4	147.1	178.8	82.7	0	0	0	0	111.6	E685 E689 E690 V691	E685-S687 PolarHBondContact O-N 2.92Å; S687-E689 PolarHBondContact O-N 3.33Å; S687-E690 VanDerWaalsContact CB-OE1 3.27Å; S687-E690 WeakPolarHBondContact CB-OE1 3.5Å; S687-E690 VanDerWaalsContact OG-CD 3.29Å; S687-E690 WeakPolarHBondContact OG-CG 3.26Å; S687-E690 PolarHBondContact OG-N 3.12Å; S687-E690 PolarHBondContact OG-OE1 3.3Å; S687-V691 WeakPolarHBondContact O-CG2 3.39Å; S687-V691 PolarHBondContact O-N 3.45Å
688	W	84.4	Confident	81.2	Confident	29 Å²	29	88.4 Å²	88.4	11%	0.11	44%	0.444	C	S	.	.	H	α-helix	trans	-56.6	-36.7	176.8	169.9	-110.2	0	0	0	112	F671 V691 R692 F701 E707 R710 K711 F714	F671-W688 HydrophobicContact CE1-CH2 4.4Å; F671-W688 AromaticContact CZ-CH2 3.93Å; F671-W688 HydrophobicContact CZ-CH2 3.93Å; F671-W688 HydrophobicContact CZ-CZ3 4.46Å; W688-V691 PolarHBondContact O-N 2.91Å; W688-R692 HydrophobicContact CD2-CB 4.38Å; W688-R692 HydrophobicContact CZ2-CB 4.18Å; W688-R692 HydrophobicContact CZ2-CG 4.08Å; W688-R692 WeakPolarHBondContact O-CB 3.35Å; W688-R692 PolarHBondContact O-N 3.26Å; W688-F701 AromaticContact CH2-CE2 3.97Å; W688-F701 HydrophobicContact CH2-CE2 3.97Å; W688-F701 HydrophobicContact CZ2-CE2 4.27Å; W688-E707 WeakPolarHBondContact CZ2-OE1 3.48Å; W688-E707 PolarHBondContact NE1-OE1 3.06Å; W688-R710 HydrophobicContact CH2-CB 3.72Å; W688-R710 HydrophobicContact CZ2-CB 3.67Å; W688-K711 HydrophobicContact CD2-CG 4.12Å; W688-K711 HydrophobicContact CG-CG 4.11Å; W688-K711 HydrophobicContact CZ2-CG 4.26Å; W688-F714 HydrophobicContact CB-CD1 4.19Å; W688-F714 HydrophobicContact CB-CE1 4.03Å; W688-F714 HydrophobicContact CD2-CD1 4.23Å; W688-F714 HydrophobicContact CD2-CG 4.43Å; W688-F714 HydrophobicContact CE3-CB 3.55Å; W688-F714 AromaticContact CE3-CD1 3.47Å; W688-F714 HydrophobicContact CE3-CD1 3.47Å; W688-F714 VanDerWaalsContact CE3-CD1 3.47Å; W688-F714 AromaticContact CE3-CD2 3.84Å; W688-F714 HydrophobicContact CE3-CD2 3.84Å; W688-F714 HydrophobicContact CE3-CE1 4.08Å; W688-F714 HydrophobicContact CE3-CE2 4.41Å; W688-F714 AromaticContact CE3-CG 3.32Å; W688-F714 HydrophobicContact CE3-CG 3.32Å; W688-F714 HydrophobicContact CH2-CB 4.42Å; W688-F714 HydrophobicContact CZ3-CB 3.45Å; W688-F714 VanDerWaalsContact CZ3-CB 3.45Å; W688-F714 HydrophobicContact CZ3-CD1 4.25Å; W688-F714 AromaticContact CZ3-CD2 3.98Å; W688-F714 HydrophobicContact CZ3-CD2 3.98Å; W688-F714 AromaticContact CZ3-CG 3.64Å; W688-F714 HydrophobicContact CZ3-CG 3.64Å
689	E	83.9	Confident	81.3	Confident	136 Å²	136	91.1 Å²	91.1	64%	0.636	47%	0.467	S	S	*	.	H	α-helix	trans	-74.3	-39.8	-169.4	-57.5	-172.9	162	0	0	111	S687 V691 R692 E693	S687-E689 PolarHBondContact O-N 3.33Å; E689-V691 PolarHBondContact O-N 2.96Å; E689-R692 PolarHBondContact O-N 2.97Å; E689-E693 PolarHBondContact O-N 2.89Å
690	E	77.7	Confident	81.7	Confident	108 Å²	108	85.6 Å²	85.6	51%	0.505	44%	0.435	S	S	.	.	H	α-helix	trans	-66.9	-32.4	170.9	-68.7	163.1	-107.5	0	0	113.9	S687 R694	S687-E690 VanDerWaalsContact CB-OE1 3.27Å; S687-E690 WeakPolarHBondContact CB-OE1 3.5Å; S687-E690 VanDerWaalsContact OG-CD 3.29Å; S687-E690 WeakPolarHBondContact OG-CG 3.26Å; S687-E690 PolarHBondContact OG-N 3.12Å; S687-E690 PolarHBondContact OG-OE1 3.3Å; E690-R694 WeakPolarHBondContact O-CG 3.42Å; E690-R694 PolarHBondContact O-NE 2.82Å; E690-R694 VanDerWaalsContact O-NE 3.12Å
691	V	81.3	Confident	82.2	Confident	0 Å²	0	81.6 Å²	81.6	0%	0	41%	0.408	C	S	.	.	H	α-helix	trans	-75.9	-40.4	177.5	174.8	0	0	0	0	110.3	L675 L682 A686 S687 W688 E689 E693 R694 F695 F714	L675-V691 HydrophobicContact CD2-CG1 3.94Å; L682-V691 HydrophobicContact CD1-CG1 3.94Å; L682-V691 HydrophobicContact CD1-CG2 4.48Å; L682-V691 HydrophobicContact CD2-CG1 4.22Å; L682-V691 HydrophobicContact CD2-CG2 3.94Å; A686-V691 HydrophobicContact CB-CG2 3.91Å; S687-V691 WeakPolarHBondContact O-CG2 3.39Å; S687-V691 PolarHBondContact O-N 3.45Å; W688-V691 PolarHBondContact O-N 2.91Å; E689-V691 PolarHBondContact O-N 2.96Å; V691-E693 PolarHBondContact O-N 3.17Å; V691-R694 PolarHBondContact O-N 2.85Å; V691-F695 HydrophobicContact CG1-CD2 3.96Å; V691-F695 HydrophobicContact CG1-CE2 3.89Å; V691-F695 VanDerWaalsContact O-CD2 3.27Å; V691-F695 WeakPolarHBondContact O-CD2 3.24Å; V691-F714 HydrophobicContact CB-CE2 4.06Å; V691-F714 HydrophobicContact CB-CZ 4.38Å; V691-F714 HydrophobicContact CG1-CD2 4.15Å; V691-F714 HydrophobicContact CG1-CE2 3.79Å; V691-F714 HydrophobicContact CG2-CE2 3.94Å; V691-F714 HydrophobicContact CG2-CZ 4.08Å
692	R	84.7	Confident	82.5	Confident	91 Å²	91	82.8 Å²	82.8	34%	0.343	41%	0.405	S	S	.	.	H	α-helix	trans	-56.6	-47.4	-179.8	-177.5	-172.2	-165.4	-109.4	-3.9	112.3	W688 E689 R694 F695 L696 F701 E707	W688-R692 HydrophobicContact CD2-CB 4.38Å; W688-R692 HydrophobicContact CZ2-CB 4.18Å; W688-R692 HydrophobicContact CZ2-CG 4.08Å; W688-R692 WeakPolarHBondContact O-CB 3.35Å; W688-R692 PolarHBondContact O-N 3.26Å; E689-R692 PolarHBondContact O-N 2.97Å; R692-R694 VanDerWaalsContact C-N 3.26Å; R692-R694 PolarHBondContact O-N 3.18Å; R692-F695 PolarHBondContact O-N 3.26Å; R692-L696 HydrophobicContact CG-CD2 4.3Å; R692-L696 WeakPolarHBondContact O-CG 3.42Å; R692-L696 PolarHBondContact O-N 3.12Å; R692-F701 HydrophobicContact CG-CE2 4.16Å; R692-F701 HydrophobicContact CG-CZ 3.85Å; R692-E707 IonicContact CZ-OE1 2.73Å; R692-E707 IonicContact CZ-OE2 3.58Å; R692-E707 VanDerWaalsContact NE-CD 3.32Å; R692-E707 IonicContact NE-OE1 3Å; R692-E707 PolarHBondContact NE-OE1 2.86Å; R692-E707 IonicContact NE-OE2 2.78Å; R692-E707 PolarHBondContact NE-OE2 3.31Å; R692-E707 VanDerWaalsContact NH2-CD 3.31Å; R692-E707 IonicContact NH2-OE1 3.77Å; R692-E707 IonicContact NH2-OE2 2.83Å; R692-E707 PolarHBondContact NH2-OE2 3.42Å
693	E	82.3	Confident	82.8	Confident	146 Å²	146	85.8 Å²	85.8	68%	0.682	42%	0.422	S	S	*	.	H	α-helix	trans	-60.5	-34.4	-178.4	-69	-159.1	147.6	0	0	113.3	E689 V691 F695	E689-E693 PolarHBondContact O-N 2.89Å; V691-E693 PolarHBondContact O-N 3.17Å; E693-F695 VanDerWaalsContact C-N 3.27Å; E693-F695 PolarHBondContact O-N 3.04Å
694	R	80.6	Confident	83.4	Confident	136 Å²	136	79.9 Å²	79.9	51%	0.513	39%	0.394	S	S	.	.	H	α-helix	trans	-66.6	-28.1	-179.6	-58.1	175	-161	-158.8	2.2	113	E690 V691 R692	E690-R694 WeakPolarHBondContact O-CG 3.42Å; E690-R694 PolarHBondContact O-NE 2.82Å; E690-R694 VanDerWaalsContact O-NE 3.12Å; V691-R694 PolarHBondContact O-N 2.85Å; R692-R694 VanDerWaalsContact C-N 3.26Å; R692-R694 PolarHBondContact O-N 3.18Å
695	F	85.7	Confident	83.8	Confident	22 Å²	22	82 Å²	82	10%	0.096	41%	0.406	C	S	.	.	H	α-helix	trans	-108.2	4	-172.5	-65.5	-63.1	0	0	0	114.6	M674 L675 A678 V691 R692 E693 K697 E698 F701	M674-F695 HydrophobicContact CE-CB 3.89Å; M674-F695 HydrophobicContact CE-CD1 4.12Å; M674-F695 HydrophobicContact CE-CD2 4.26Å; M674-F695 HydrophobicContact CE-CG 3.83Å; M674-F695 HydrophobicContact CG-CD1 3.67Å; M674-F695 HydrophobicContact CG-CE1 3.86Å; M674-F695 HydrophobicContact CG-CG 4.35Å; M674-F695 HydrophobicContact SD-CB 4.04Å; M674-F695 HydrophobicContact SD-CD1 3.83Å; M674-F695 HydrophobicContact SD-CG 4.05Å; L675-F695 HydrophobicContact CD2-CD2 4.19Å; L675-F695 HydrophobicContact CD2-CE2 4.01Å; A678-F695 HydrophobicContact CB-CE2 4.5Å; A678-F695 HydrophobicContact CB-CZ 3.81Å; V691-F695 HydrophobicContact CG1-CD2 3.96Å; V691-F695 HydrophobicContact CG1-CE2 3.89Å; V691-F695 VanDerWaalsContact O-CD2 3.27Å; V691-F695 WeakPolarHBondContact O-CD2 3.24Å; R692-F695 PolarHBondContact O-N 3.26Å; E693-F695 VanDerWaalsContact C-N 3.27Å; E693-F695 PolarHBondContact O-N 3.04Å; F695-K697 PolarHBondContact O-N 3.02Å; F695-E698 HydrophobicContact CD1-CG 3.96Å; F695-E698 PolarHBondContact O-N 2.99Å; F695-F701 HydrophobicContact CB-CB 4.27Å; F695-F701 HydrophobicContact CB-CD2 3.84Å; F695-F701 HydrophobicContact CB-CG 4.22Å; F695-F701 WeakPolarHBondContact O-CB 3.42Å; F695-F701 VanDerWaalsContact O-CG 3.31Å; F695-F701 WeakPolarHBondContact O-CG 3.31Å
696	L	83	Confident	84.5	Confident	79 Å²	79	77.5 Å²	77.5	41%	0.414	39%	0.388	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.2	-21.4	-177	-68.5	177.5	0	0	0	115.5	R692 F701	R692-L696 HydrophobicContact CG-CD2 4.3Å; R692-L696 WeakPolarHBondContact O-CG 3.42Å; R692-L696 PolarHBondContact O-N 3.12Å; L696-F701 HydrophobicContact CD2-CE1 3.74Å; L696-F701 HydrophobicContact CD2-CZ 3.91Å
697	K	80.3	Confident	84.8	Confident	197 Å²	197	78.6 Å²	78.6	86%	0.857	39%	0.389	S	S	*	.	T	Hydrogen-bonded Turn	trans	-107.6	2.1	-178.3	-62.1	-179.6	-179	175.8	0	113.9	F695	F695-K697 PolarHBondContact O-N 3.02Å
698	E	85.4	Confident	85.1	Confident	104 Å²	104	79.9 Å²	79.9	49%	0.486	40%	0.398	S	S	.	.			trans	-84.1	131.5	178.9	-76.3	-57.6	152	0	0	111.1	M674 F695 A700 F701 E702	M674-E698 HydrophobicContact CG-CB 4.33Å; M674-E698 HydrophobicContact CG-CG 4.3Å; M674-E698 HydrophobicContact SD-CB 3.56Å; M674-E698 VanDerWaalsContact SD-CB 3.56Å; M674-E698 HydrophobicContact SD-CG 4.1Å; F695-E698 HydrophobicContact CD1-CG 3.96Å; F695-E698 PolarHBondContact O-N 2.99Å; E698-A700 PolarHBondContact O-N 2.81Å; E698-A700 VanDerWaalsContact O-N 3.14Å; E698-F701 HydrophobicContact CB-CB 4.28Å; E698-F701 WeakPolarHBondContact O-CA 3.37Å; E698-F701 WeakPolarHBondContact O-CB 3.43Å; E698-F701 PolarHBondContact O-N 3.45Å; E698-E702 PolarHBondContact O-N 3.21Å; E698-E702 VanDerWaalsContact O-N 3.07Å
699	A	86.6	Confident	85.4	Confident	69 Å²	69	80.6 Å²	80.6	57%	0.57	40%	0.403	S	S	*	.	H	α-helix	trans	-57.3	-35.2	-178.5	0	0	0	0	0	112.3	F701 E702 D703	A699-F701 VanDerWaalsContact C-N 3.29Å; A699-F701 PolarHBondContact O-N 2.81Å; A699-E702 PolarHBondContact O-N 2.79Å; A699-D703 WeakPolarHBondContact O-CB 3.42Å; A699-D703 PolarHBondContact O-N 2.73Å
700	A	87.3	Confident	85.7	Confident	20 Å²	20	75.6 Å²	75.6	17%	0.165	38%	0.378	C	S	.	.	H	α-helix	trans	-67.6	-25.3	176.1	0	0	0	0	0	113.6	A670 F671 M674 E698	A670-A700 HydrophobicContact CB-CB 4.15Å; F671-A700 VanDerWaalsContact CD2-O 3.32Å; F671-A700 WeakPolarHBondContact CD2-O 3.44Å; M674-A700 HydrophobicContact CB-CB 4.17Å; M674-A700 HydrophobicContact SD-CB 4Å; E698-A700 PolarHBondContact O-N 2.81Å; E698-A700 VanDerWaalsContact O-N 3.14Å
701	F	87.9	Confident	86.2	Confident	6 Å²	6	75 Å²	75	3%	0.026	37%	0.374	C	S	.	.	H	α-helix	trans	-80.5	-42.8	174.6	-179	-85.2	0	0	0	111.6	F671 M674 W688 R692 F695 L696 E698 A699 D703 R710	F671-F701 HydrophobicContact CE2-CB 4.18Å; F671-F701 AromaticContact CE2-CD2 3.63Å; F671-F701 HydrophobicContact CE2-CD2 3.63Å; F671-F701 HydrophobicContact CE2-CE2 4.35Å; F671-F701 HydrophobicContact CE2-CG 4.12Å; F671-F701 AromaticContact CZ-CD2 3.6Å; F671-F701 HydrophobicContact CZ-CD2 3.6Å; F671-F701 HydrophobicContact CZ-CE2 4.1Å; M674-F701 HydrophobicContact CE-CB 4.08Å; M674-F701 HydrophobicContact CE-CD2 4.26Å; M674-F701 HydrophobicContact SD-CB 3.85Å; W688-F701 AromaticContact CH2-CE2 3.97Å; W688-F701 HydrophobicContact CH2-CE2 3.97Å; W688-F701 HydrophobicContact CZ2-CE2 4.27Å; R692-F701 HydrophobicContact CG-CE2 4.16Å; R692-F701 HydrophobicContact CG-CZ 3.85Å; F695-F701 HydrophobicContact CB-CB 4.27Å; F695-F701 HydrophobicContact CB-CD2 3.84Å; F695-F701 HydrophobicContact CB-CG 4.22Å; F695-F701 WeakPolarHBondContact O-CB 3.42Å; F695-F701 VanDerWaalsContact O-CG 3.31Å; F695-F701 WeakPolarHBondContact O-CG 3.31Å; L696-F701 HydrophobicContact CD2-CE1 3.74Å; L696-F701 HydrophobicContact CD2-CZ 3.91Å; E698-F701 HydrophobicContact CB-CB 4.28Å; E698-F701 WeakPolarHBondContact O-CA 3.37Å; E698-F701 WeakPolarHBondContact O-CB 3.43Å; E698-F701 PolarHBondContact O-N 3.45Å; A699-F701 VanDerWaalsContact C-N 3.29Å; A699-F701 PolarHBondContact O-N 2.81Å; F701-D703 VanDerWaalsContact C-N 3.34Å; F701-R710 PolarHBondContact O-NE 3.36Å; F701-R710 PolarHBondContact O-NH2 3.31Å
702	E	88.3	Confident	86.8	Confident	119 Å²	119	79.7 Å²	79.7	56%	0.556	39%	0.391	S	S	*	.	H	α-helix	trans	-62	-40.6	174.6	-66.2	-169.6	149.7	0	0	111.8	E698 A699 V704	E698-E702 PolarHBondContact O-N 3.21Å; E698-E702 VanDerWaalsContact O-N 3.07Å; A699-E702 PolarHBondContact O-N 2.79Å; E702-V704 PolarHBondContact O-N 2.95Å
703	D	87.9	Confident	87.1	Confident	77 Å²	77	75.5 Å²	75.5	41%	0.412	38%	0.376	S	S	.	.	H	α-helix	trans	-58.3	-33.7	-177.4	-125.8	-11	0	0	0	112.9	K667 A699 F701 T705	K667-D703 HydrophobicContact CD-CB 4.18Å; K667-D703 WeakPolarHBondContact CD-O 3.27Å; K667-D703 VanDerWaalsContact CE-CG 3.44Å; K667-D703 WeakPolarHBondContact CE-OD1 3.43Å; K667-D703 HydrophobicContact CG-CB 4.35Å; K667-D703 PolarHBondContact NZ-O 3.15Å; K667-D703 IonicContact NZ-OD1 2.81Å; K667-D703 PolarHBondContact NZ-OD1 3.04Å; A699-D703 WeakPolarHBondContact O-CB 3.42Å; A699-D703 PolarHBondContact O-N 2.73Å; F701-D703 VanDerWaalsContact C-N 3.34Å; D703-T705 PolarHBondContact O-N 3.42Å
704	V	89.6	Confident	87.5	Confident	8 Å²	8	69.3 Å²	69.3	5%	0.048	35%	0.347	C	S	.	.			trans	-88.2	86.2	173.2	-177.1	0	0	0	0	108.6	K667 F671 E702 L706 E709 R710 I713	K667-V704 HydrophobicContact CB-CG2 4.04Å; F671-V704 HydrophobicContact CB-CG2 4.26Å; F671-V704 HydrophobicContact CD2-CB 3.95Å; F671-V704 HydrophobicContact CD2-CG2 3.69Å; F671-V704 HydrophobicContact CE2-CB 4.32Å; F671-V704 HydrophobicContact CG-CG2 4.34Å; E702-V704 PolarHBondContact O-N 2.95Å; V704-L706 VanDerWaalsContact C-N 3.34Å; V704-L706 PolarHBondContact O-N 3.41Å; V704-E709 HydrophobicContact CG1-CB 3.65Å; V704-R710 HydrophobicContact CB-CG 4.12Å; V704-R710 HydrophobicContact CG1-CG 3.77Å; V704-R710 WeakPolarHBondContact O-CG 3.31Å; V704-R710 PolarHBondContact O-NE 3.06Å; V704-R710 PolarHBondContact O-NH2 3.32Å; V704-I713 HydrophobicContact CG1-CD1 4.13Å; V704-I713 HydrophobicContact CG2-CD1 4.41Å
705	T	86	Confident	87.9	Confident	115 Å²	115	70.4 Å²	70.4	71%	0.706	36%	0.355	S	S	*	.			trans	-68.3	-27.3	-172.3	54	0	0	0	0	114.6	D703	D703-T705 PolarHBondContact O-N 3.42Å
706	L	89.8	Confident	88	Confident	96 Å²	96	72.1 Å²	72.1	50%	0.503	37%	0.365	S	S	.	.			trans	-83	113.6	179.7	-80	159.8	0	0	0	111.2	V704 S708 E709 R710	V704-L706 VanDerWaalsContact C-N 3.34Å; V704-L706 PolarHBondContact O-N 3.41Å; L706-S708 PolarHBondContact O-N 3Å; L706-E709 HydrophobicContact CB-CB 3.99Å; L706-E709 HydrophobicContact CB-CG 3.63Å; L706-E709 HydrophobicContact CD1-CG 4.04Å; L706-E709 HydrophobicContact CG-CG 4.49Å; L706-E709 WeakPolarHBondContact O-CB 3.1Å; L706-E709 PolarHBondContact O-N 3.11Å; L706-R710 PolarHBondContact O-N 3.04Å
707	E	85.4	Confident	88.3	Confident	47 Å²	47	69.4 Å²	69.4	22%	0.22	35%	0.35	C	S	.	.	H	α-helix	trans	-59.2	-29.7	177.3	-173.7	68.3	-152.4	0	0	112.8	W688 R692 R710 K711	W688-E707 WeakPolarHBondContact CZ2-OE1 3.48Å; W688-E707 PolarHBondContact NE1-OE1 3.06Å; R692-E707 IonicContact CZ-OE1 2.73Å; R692-E707 IonicContact CZ-OE2 3.58Å; R692-E707 VanDerWaalsContact NE-CD 3.32Å; R692-E707 IonicContact NE-OE1 3Å; R692-E707 PolarHBondContact NE-OE1 2.86Å; R692-E707 IonicContact NE-OE2 2.78Å; R692-E707 PolarHBondContact NE-OE2 3.31Å; R692-E707 VanDerWaalsContact NH2-CD 3.31Å; R692-E707 IonicContact NH2-OE1 3.77Å; R692-E707 IonicContact NH2-OE2 2.83Å; R692-E707 PolarHBondContact NH2-OE2 3.42Å; E707-R710 IonicContact OE2-NH1 3.7Å; E707-R710 PolarHBondContact OE2-NH1 3.38Å; E707-R710 VanDerWaalsContact OE2-NH1 3.12Å; E707-K711 WeakPolarHBondContact O-CB 3.11Å; E707-K711 WeakPolarHBondContact O-CG 3.23Å; E707-K711 PolarHBondContact O-N 3.37Å
708	S	89.3	Confident	88.6	Confident	73 Å²	73	60.9 Å²	60.9	51%	0.51	31%	0.314	S	S	.	.	H	α-helix	trans	-65	-42.2	171.5	48.7	0	0	0	0	112.7	L706 K711 R712	L706-S708 PolarHBondContact O-N 3Å; S708-K711 PolarHBondContact O-N 2.88Å; S708-R712 PolarHBondContact O-N 3.13Å
709	E	89.6	Confident	88.6	Confident	44 Å²	44	60.8 Å²	60.8	21%	0.206	31%	0.313	C	S	.	.	H	α-helix	trans	-64.6	-46.5	174.8	-65.1	-63.2	98.5	0	0	110.1	V704 L706 K711 R712 I713	V704-E709 HydrophobicContact CG1-CB 3.65Å; L706-E709 HydrophobicContact CB-CB 3.99Å; L706-E709 HydrophobicContact CB-CG 3.63Å; L706-E709 HydrophobicContact CD1-CG 4.04Å; L706-E709 HydrophobicContact CG-CG 4.49Å; L706-E709 WeakPolarHBondContact O-CB 3.1Å; L706-E709 PolarHBondContact O-N 3.11Å; E709-K711 VanDerWaalsContact C-N 3.33Å; E709-K711 PolarHBondContact O-N 3.07Å; E709-R712 PolarHBondContact O-N 2.7Å; E709-R712 IonicContact OE1-CZ 2.91Å; E709-R712 IonicContact OE1-NH1 2.67Å; E709-R712 PolarHBondContact OE1-NH1 3.35Å; E709-R712 IonicContact OE2-CZ 3.82Å; E709-R712 IonicContact OE2-NH1 2.77Å; E709-R712 PolarHBondContact OE2-NH1 3.2Å; E709-R712 IonicContact OE2-NH2 2.67Å; E709-R712 PolarHBondContact OE2-NH2 3.28Å; E709-I713 HydrophobicContact CB-CD1 4.32Å; E709-I713 VanDerWaalsContact O-CB 3.31Å; E709-I713 WeakPolarHBondContact O-CB 3.35Å; E709-I713 WeakPolarHBondContact O-CD1 3.47Å; E709-I713 WeakPolarHBondContact O-CG1 3.47Å; E709-I713 PolarHBondContact O-N 3.3Å
710	R	90.9	Very high	88.5	Confident	30 Å²	30	61.1 Å²	61.1	11%	0.113	31%	0.308	C	S	.	.	H	α-helix	trans	-52.8	-50	174.6	-63.3	-175.1	176.3	139.1	0.2	111.7	F671 W688 F701 V704 L706 E707 I713 F714	F671-R710 HydrophobicContact CE2-CB 4.2Å; F671-R710 HydrophobicContact CE2-CG 3.76Å; F671-R710 HydrophobicContact CZ-CB 4.05Å; F671-R710 HydrophobicContact CZ-CG 4.1Å; W688-R710 HydrophobicContact CH2-CB 3.72Å; W688-R710 HydrophobicContact CZ2-CB 3.67Å; F701-R710 PolarHBondContact O-NE 3.36Å; F701-R710 PolarHBondContact O-NH2 3.31Å; V704-R710 HydrophobicContact CB-CG 4.12Å; V704-R710 HydrophobicContact CG1-CG 3.77Å; V704-R710 WeakPolarHBondContact O-CG 3.31Å; V704-R710 PolarHBondContact O-NE 3.06Å; V704-R710 PolarHBondContact O-NH2 3.32Å; L706-R710 PolarHBondContact O-N 3.04Å; E707-R710 IonicContact OE2-NH1 3.7Å; E707-R710 PolarHBondContact OE2-NH1 3.38Å; E707-R710 VanDerWaalsContact OE2-NH1 3.12Å; R710-I713 PolarHBondContact O-N 3.02Å; R710-F714 WeakPolarHBondContact O-CB 3.41Å; R710-F714 PolarHBondContact O-N 3.44Å
711	K	88.6	Confident	88.2	Confident	96 Å²	96	62 Å²	62	42%	0.417	31%	0.309	S	S	.	.	H	α-helix	trans	-61.7	-41.5	177.8	-75.4	-178.4	179.4	-164.1	0	112.8	W688 E707 S708 E709 K715	W688-K711 HydrophobicContact CD2-CG 4.12Å; W688-K711 HydrophobicContact CG-CG 4.11Å; W688-K711 HydrophobicContact CZ2-CG 4.26Å; E707-K711 WeakPolarHBondContact O-CB 3.11Å; E707-K711 WeakPolarHBondContact O-CG 3.23Å; E707-K711 PolarHBondContact O-N 3.37Å; S708-K711 PolarHBondContact O-N 2.88Å; E709-K711 VanDerWaalsContact C-N 3.33Å; E709-K711 PolarHBondContact O-N 3.07Å; K711-K715 WeakPolarHBondContact O-CB 3.49Å; K711-K715 PolarHBondContact O-N 2.83Å
712	R	93.4	Very high	87.9	Confident	99 Å²	99	66.3 Å²	66.3	37%	0.374	33%	0.33	S	S	.	.	H	α-helix	trans	-61.5	-52.6	173.8	-174.5	-170.3	72.5	-124.6	-5.9	110.8	E668 S708 E709 F714 K715 D716	E668-R712 IonicContact OE2-NH2 2.72Å; E668-R712 PolarHBondContact OE2-NH2 2.99Å; S708-R712 PolarHBondContact O-N 3.13Å; E709-R712 PolarHBondContact O-N 2.7Å; E709-R712 IonicContact OE1-CZ 2.91Å; E709-R712 IonicContact OE1-NH1 2.67Å; E709-R712 PolarHBondContact OE1-NH1 3.35Å; E709-R712 IonicContact OE2-CZ 3.82Å; E709-R712 IonicContact OE2-NH1 2.77Å; E709-R712 PolarHBondContact OE2-NH1 3.2Å; E709-R712 IonicContact OE2-NH2 2.67Å; E709-R712 PolarHBondContact OE2-NH2 3.28Å; R712-F714 VanDerWaalsContact C-N 3.27Å; R712-F714 PolarHBondContact O-N 3.36Å; R712-K715 PolarHBondContact O-N 2.7Å; R712-D716 VanDerWaalsContact O-CG 3.31Å; R712-D716 PolarHBondContact O-N 3.2Å
713	I	91.5	Very high	87.1	Confident	3 Å²	3	65.3 Å²	65.3	2%	0.015	33%	0.325	C	S	.	.	H	α-helix	trans	-60.4	-38.1	-174.9	-69.2	168.6	0	0	0	111.2	E668 F671 K672 V704 E709 R710 F717	E668-I713 HydrophobicContact CB-CD1 3.91Å; E668-I713 HydrophobicContact CB-CG1 4.37Å; E668-I713 HydrophobicContact CG-CD1 3.95Å; E668-I713 HydrophobicContact CG-CG1 3.84Å; E668-I713 HydrophobicContact CG-CG2 4.16Å; F671-I713 HydrophobicContact CB-CG2 3.96Å; F671-I713 HydrophobicContact CD1-CB 4.39Å; F671-I713 HydrophobicContact CD1-CG2 3.49Å; F671-I713 VanDerWaalsContact CD1-CG2 3.49Å; F671-I713 HydrophobicContact CE1-CG2 4.3Å; F671-I713 HydrophobicContact CG-CG2 3.9Å; K672-I713 HydrophobicContact CD-CG2 4.24Å; K672-I713 VanDerWaalsContact CE-O 3.23Å; K672-I713 WeakPolarHBondContact CE-O 3.36Å; K672-I713 HydrophobicContact CG-CG2 3.69Å; V704-I713 HydrophobicContact CG1-CD1 4.13Å; V704-I713 HydrophobicContact CG2-CD1 4.41Å; E709-I713 HydrophobicContact CB-CD1 4.32Å; E709-I713 VanDerWaalsContact O-CB 3.31Å; E709-I713 WeakPolarHBondContact O-CB 3.35Å; E709-I713 WeakPolarHBondContact O-CD1 3.47Å; E709-I713 WeakPolarHBondContact O-CG1 3.47Å; E709-I713 PolarHBondContact O-N 3.3Å; R710-I713 PolarHBondContact O-N 3.02Å; I713-F717 WeakPolarHBondContact O-CB 3.35Å; I713-F717 PolarHBondContact O-N 3.37Å; I713-F717 VanDerWaalsContact O-N 3.17Å
714	F	89.6	Confident	86.1	Confident	16 Å²	16	67.5 Å²	67.5	7%	0.07	33%	0.333	C	S	.	.	H	α-helix	trans	-67.3	-46.4	171.1	172.9	-103.5	0	0	0	113	L675 L682 W688 V691 R710 R712 D716 F717 M718	L675-F714 HydrophobicContact CD1-CB 4.27Å; L675-F714 HydrophobicContact CD1-CD2 4.01Å; L675-F714 HydrophobicContact CD2-CD2 4.11Å; L682-F714 HydrophobicContact CD1-CE2 4.31Å; W688-F714 HydrophobicContact CB-CD1 4.19Å; W688-F714 HydrophobicContact CB-CE1 4.03Å; W688-F714 HydrophobicContact CD2-CD1 4.23Å; W688-F714 HydrophobicContact CD2-CG 4.43Å; W688-F714 HydrophobicContact CE3-CB 3.55Å; W688-F714 AromaticContact CE3-CD1 3.47Å; W688-F714 HydrophobicContact CE3-CD1 3.47Å; W688-F714 VanDerWaalsContact CE3-CD1 3.47Å; W688-F714 AromaticContact CE3-CD2 3.84Å; W688-F714 HydrophobicContact CE3-CD2 3.84Å; W688-F714 HydrophobicContact CE3-CE1 4.08Å; W688-F714 HydrophobicContact CE3-CE2 4.41Å; W688-F714 AromaticContact CE3-CG 3.32Å; W688-F714 HydrophobicContact CE3-CG 3.32Å; W688-F714 HydrophobicContact CH2-CB 4.42Å; W688-F714 HydrophobicContact CZ3-CB 3.45Å; W688-F714 VanDerWaalsContact CZ3-CB 3.45Å; W688-F714 HydrophobicContact CZ3-CD1 4.25Å; W688-F714 AromaticContact CZ3-CD2 3.98Å; W688-F714 HydrophobicContact CZ3-CD2 3.98Å; W688-F714 AromaticContact CZ3-CG 3.64Å; W688-F714 HydrophobicContact CZ3-CG 3.64Å; V691-F714 HydrophobicContact CB-CE2 4.06Å; V691-F714 HydrophobicContact CB-CZ 4.38Å; V691-F714 HydrophobicContact CG1-CD2 4.15Å; V691-F714 HydrophobicContact CG1-CE2 3.79Å; V691-F714 HydrophobicContact CG2-CE2 3.94Å; V691-F714 HydrophobicContact CG2-CZ 4.08Å; R710-F714 WeakPolarHBondContact O-CB 3.41Å; R710-F714 PolarHBondContact O-N 3.44Å; R712-F714 VanDerWaalsContact C-N 3.27Å; R712-F714 PolarHBondContact O-N 3.36Å; F714-D716 VanDerWaalsContact C-N 3.34Å; F714-D716 PolarHBondContact O-N 2.95Å; F714-F717 WeakPolarHBondContact O-CA 3.34Å; F714-F717 WeakPolarHBondContact O-CB 3.47Å; F714-F717 PolarHBondContact O-N 3.31Å; F714-M718 HydrophobicContact CD1-CG 4.22Å; F714-M718 HydrophobicContact CD2-CG 4.14Å; F714-M718 HydrophobicContact CE1-CG 3.75Å; F714-M718 HydrophobicContact CE2-CE 3.97Å; F714-M718 HydrophobicContact CE2-CG 3.63Å; F714-M718 HydrophobicContact CE2-SD 3.84Å; F714-M718 HydrophobicContact CG-CG 4.41Å; F714-M718 HydrophobicContact CZ-CE 4.46Å; F714-M718 HydrophobicContact CZ-CG 3.43Å; F714-M718 VanDerWaalsContact CZ-CG 3.43Å; F714-M718 HydrophobicContact CZ-SD 3.72Å; F714-M718 WeakPolarHBondContact O-CG 3.4Å; F714-M718 PolarHBondContact O-N 2.72Å
715	K	89.2	Confident	84.4	Confident	159 Å²	159	71.9 Å²	71.9	69%	0.691	36%	0.362	S	S	*	.	H	α-helix	trans	-61.9	-41.6	178.7	-170.7	176.9	-178.8	178.1	0	112.1	K711 R712 F717 M718 H719	K711-K715 WeakPolarHBondContact O-CB 3.49Å; K711-K715 PolarHBondContact O-N 2.83Å; R712-K715 PolarHBondContact O-N 2.7Å; K715-F717 VanDerWaalsContact C-N 3.29Å; K715-F717 PolarHBondContact O-N 3.21Å; K715-M718 PolarHBondContact O-N 2.78Å; K715-H719 WeakPolarHBondContact O-CB 3.32Å; K715-H719 PolarHBondContact O-N 2.94Å
716	D	88.6	Confident	83	Confident	57 Å²	57	71.7 Å²	71.7	31%	0.305	35%	0.353	S	S	.	.	H	α-helix	trans	-57.4	-43.5	171.4	-66.2	-10.1	0	0	0	111.3	K672 R712 F714 V720	K672-D716 IonicContact NZ-OD2 2.8Å; K672-D716 PolarHBondContact NZ-OD2 2.75Å; R712-D716 VanDerWaalsContact O-CG 3.31Å; R712-D716 PolarHBondContact O-N 3.2Å; F714-D716 VanDerWaalsContact C-N 3.34Å; F714-D716 PolarHBondContact O-N 2.95Å; D716-V720 WeakPolarHBondContact O-CG2 3.49Å; D716-V720 PolarHBondContact O-N 3.13Å
717	F	88.6	Confident	81.2	Confident	22 Å²	22	75.1 Å²	75.1	10%	0.096	37%	0.366	C	S	.	.	H	α-helix	trans	-68.1	-44.2	-178.2	178.1	-99.5	0	0	0	112	K672 L675 K676 L682 I713 F714 K715 V720 L721	K672-F717 HydrophobicContact CG-CB 4.45Å; L675-F717 HydrophobicContact CB-CD1 3.77Å; L675-F717 HydrophobicContact CB-CD2 4.44Å; L675-F717 HydrophobicContact CB-CE1 3.76Å; L675-F717 HydrophobicContact CB-CE2 4.43Å; L675-F717 HydrophobicContact CB-CG 4.13Å; L675-F717 HydrophobicContact CB-CZ 4.1Å; L675-F717 HydrophobicContact CD1-CB 3.88Å; L675-F717 HydrophobicContact CD1-CD1 3.85Å; L675-F717 HydrophobicContact CD1-CG 3.89Å; L675-F717 HydrophobicContact CG-CD1 4.44Å; K676-F717 HydrophobicContact CB-CE2 3.85Å; K676-F717 HydrophobicContact CB-CZ 3.91Å; K676-F717 HydrophobicContact CD-CE2 4.35Å; K676-F717 HydrophobicContact CG-CE2 4.38Å; K676-F717 HydrophobicContact CG-CZ 4.4Å; L682-F717 HydrophobicContact CD1-CE1 4.21Å; I713-F717 WeakPolarHBondContact O-CB 3.35Å; I713-F717 PolarHBondContact O-N 3.37Å; I713-F717 VanDerWaalsContact O-N 3.17Å; F714-F717 WeakPolarHBondContact O-CA 3.34Å; F714-F717 WeakPolarHBondContact O-CB 3.47Å; F714-F717 PolarHBondContact O-N 3.31Å; K715-F717 VanDerWaalsContact C-N 3.29Å; K715-F717 PolarHBondContact O-N 3.21Å; F717-V720 PolarHBondContact O-N 3.35Å; F717-L721 HydrophobicContact CE1-CD1 3.91Å; F717-L721 HydrophobicContact CZ-CD1 4.1Å; F717-L721 WeakPolarHBondContact O-CB 3.46Å; F717-L721 PolarHBondContact O-N 3.37Å
718	M	87.3	Confident	78.9	Confident	19 Å²	19	80.7 Å²	80.7	9%	0.094	39%	0.392	C	S	.	.	H	α-helix	trans	-60.7	-43.8	174.1	-69.4	-71.8	97.6	0	0	111.7	L682 F714 K715 V720 L721 E722	L682-M718 HydrophobicContact CB-CE 3.77Å; L682-M718 HydrophobicContact CD1-CE 4.03Å; F714-M718 HydrophobicContact CD1-CG 4.22Å; F714-M718 HydrophobicContact CD2-CG 4.14Å; F714-M718 HydrophobicContact CE1-CG 3.75Å; F714-M718 HydrophobicContact CE2-CE 3.97Å; F714-M718 HydrophobicContact CE2-CG 3.63Å; F714-M718 HydrophobicContact CE2-SD 3.84Å; F714-M718 HydrophobicContact CG-CG 4.41Å; F714-M718 HydrophobicContact CZ-CE 4.46Å; F714-M718 HydrophobicContact CZ-CG 3.43Å; F714-M718 VanDerWaalsContact CZ-CG 3.43Å; F714-M718 HydrophobicContact CZ-SD 3.72Å; F714-M718 WeakPolarHBondContact O-CG 3.4Å; F714-M718 PolarHBondContact O-N 2.72Å; K715-M718 PolarHBondContact O-N 2.78Å; M718-V720 PolarHBondContact O-N 2.87Å; M718-L721 HydrophobicContact CE-CD1 4.11Å; M718-L721 PolarHBondContact O-N 3.43Å; M718-E722 WeakPolarHBondContact O-CB 3.43Å; M718-E722 PolarHBondContact O-N 3.04Å
719	H	85.2	Confident	76.8	Confident	101 Å²	101	85.1 Å²	85.1	47%	0.468	40%	0.404	S	S	.	.	H	α-helix	trans	-66.6	-34.2	177.8	-175.2	50.7	0	0	0	113.1	K715 E722 H723	K715-H719 WeakPolarHBondContact O-CB 3.32Å; K715-H719 PolarHBondContact O-N 2.94Å; H719-E722 IonicContact ND1-OE2 3.33Å; H719-E722 PolarHBondContact ND1-OE2 3.13Å; H719-H723 AromaticContact CE1-CD2 3.28Å; H719-H723 PolarHBondContact CE1-CD2 3.44Å; H719-H723 AromaticContact CE1-NE2 3.33Å; H719-H723 PolarHBondContact CE1-NE2 3.49Å; H719-H723 VanDerWaalsContact CE1-NE2 3.33Å; H719-H723 AromaticContact ND1-CD2 3.76Å; H719-H723 AromaticContact NE2-CD2 3.73Å; H719-H723 AromaticContact NE2-NE2 3.9Å; H719-H723 PolarHBondContact O-N 2.99Å
720	V	84.6	Confident	74.6	Confident	77 Å²	77	88.1 Å²	88.1	47%	0.467	43%	0.43	S	S	.	.	H	α-helix	trans	-67.3	-42.5	170.5	169.1	0	0	0	0	111	D716 F717 M718 H723 E724	D716-V720 WeakPolarHBondContact O-CG2 3.49Å; D716-V720 PolarHBondContact O-N 3.13Å; F717-V720 PolarHBondContact O-N 3.35Å; M718-V720 PolarHBondContact O-N 2.87Å; V720-H723 PolarHBondContact O-N 3.18Å; V720-E724 HydrophobicContact CG1-CG 4.12Å; V720-E724 WeakPolarHBondContact O-CB 3.43Å; V720-E724 WeakPolarHBondContact O-CG 3.4Å; V720-E724 PolarHBondContact O-N 2.97Å
721	L	81.7	Confident	72.4	Confident	37 Å²	37	96 Å²	96	19%	0.194	47%	0.465	C	S	.	.	H	α-helix	trans	-64.4	-43.1	179.5	-173.3	149	0	0	0	111.5	P684 F717 M718 H723 E724 C725	P684-L721 HydrophobicContact CB-CD2 4.28Å; P684-L721 HydrophobicContact CG-CD2 3.82Å; F717-L721 HydrophobicContact CE1-CD1 3.91Å; F717-L721 HydrophobicContact CZ-CD1 4.1Å; F717-L721 WeakPolarHBondContact O-CB 3.46Å; F717-L721 PolarHBondContact O-N 3.37Å; M718-L721 HydrophobicContact CE-CD1 4.11Å; M718-L721 PolarHBondContact O-N 3.43Å; L721-H723 VanDerWaalsContact C-N 3.35Å; L721-H723 PolarHBondContact O-N 3.21Å; L721-E724 PolarHBondContact O-N 3.21Å; L721-C725 PolarHBondContact O-N 3.44Å; L721-C725 PolarHBondContact O-SG 3.2Å
722	E	80.3	Confident	70.3	Confident	98 Å²	98	97.6 Å²	97.6	46%	0.458	48%	0.483	S	S	.	.	H	α-helix	trans	-56.2	-44.3	171.8	-177.8	-171.9	-159.9	0	0	112.1	M718 H719 Q726	M718-E722 WeakPolarHBondContact O-CB 3.43Å; M718-E722 PolarHBondContact O-N 3.04Å; H719-E722 IonicContact ND1-OE2 3.33Å; H719-E722 PolarHBondContact ND1-OE2 3.13Å; E722-Q726 WeakPolarHBondContact O-CG 3.5Å; E722-Q726 PolarHBondContact O-NE2 3.05Å
723	H	72.3	Confident	68	Low	97 Å²	97	102.4 Å²	102.4	45%	0.449	51%	0.507	S	S	.	.	H	α-helix	trans	-78.8	-35.2	179.4	-90.6	-58.4	0	0	0	114.5	H719 V720 L721 C725 Q726	H719-H723 AromaticContact CE1-CD2 3.28Å; H719-H723 PolarHBondContact CE1-CD2 3.44Å; H719-H723 AromaticContact CE1-NE2 3.33Å; H719-H723 PolarHBondContact CE1-NE2 3.49Å; H719-H723 VanDerWaalsContact CE1-NE2 3.33Å; H719-H723 AromaticContact ND1-CD2 3.76Å; H719-H723 AromaticContact NE2-CD2 3.73Å; H719-H723 AromaticContact NE2-NE2 3.9Å; H719-H723 PolarHBondContact O-N 2.99Å; V720-H723 PolarHBondContact O-N 3.18Å; L721-H723 VanDerWaalsContact C-N 3.35Å; L721-H723 PolarHBondContact O-N 3.21Å; H723-C725 PolarHBondContact O-N 3.44Å; H723-Q726 PolarHBondContact O-N 3.46Å; H723-Q726 VanDerWaalsContact O-N 3.07Å
724	E	67	Low	65.9	Low	124 Å²	124	110.4 Å²	110.4	58%	0.579	54%	0.541	S	S	*	.	H	α-helix	trans	-60.6	-34.3	175.5	-76.3	-165.3	134.4	0	0	110.7	K676 V720 L721 Q726	K676-E724 IonicContact NZ-OE2 3.22Å; K676-E724 PolarHBondContact NZ-OE2 3.13Å; V720-E724 HydrophobicContact CG1-CG 4.12Å; V720-E724 WeakPolarHBondContact O-CB 3.43Å; V720-E724 WeakPolarHBondContact O-CG 3.4Å; V720-E724 PolarHBondContact O-N 2.97Å; L721-E724 PolarHBondContact O-N 3.21Å; E724-Q726 VanDerWaalsContact C-N 3.29Å; E724-Q726 PolarHBondContact O-N 3.39Å
725	C	54.4	Low	63.8	Low	99 Å²	99	117.5 Å²	117.5	67%	0.669	58%	0.575	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.5	-19	174.7	-74.6	0	0	0	0	115	L721 H723	L721-C725 PolarHBondContact O-N 3.44Å; L721-C725 PolarHBondContact O-SG 3.2Å; H723-C725 PolarHBondContact O-N 3.44Å
726	Q	55.7	Low	61.4	Low	112 Å²	112	115.9 Å²	115.9	52%	0.523	58%	0.583	S	S	.	*	T	Hydrogen-bonded Turn	trans	-88.6	3.2	-174.5	-67.7	175	29.7	0	0	114.5	E722 H723 E724	E722-Q726 WeakPolarHBondContact O-CG 3.5Å; E722-Q726 PolarHBondContact O-NE2 3.05Å; H723-Q726 PolarHBondContact O-N 3.46Å; H723-Q726 VanDerWaalsContact O-N 3.07Å; E724-Q726 VanDerWaalsContact C-N 3.29Å; E724-Q726 PolarHBondContact O-N 3.39Å
727	H	52.5	Low	59.5	Low	168 Å²	168	122.8 Å²	122.8	78%	0.778	61%	0.611	S	S	*	*			trans	-125.7	57.5	-170.4	-93.2	21.9	0	0	0	115.6
728	H	36.2	Very low	57.4	Low	163 Å²	163	131.9 Å²	131.9	76%	0.755	65%	0.65	S	S	*	*			trans	-145	106	160.7	-122.2	61.8	0	0	0	114.1
729	H	46	Very low	55.1	Low	167 Å²	167	135.7 Å²	135.7	77%	0.773	68%	0.679	S	S	*	*				164.2	112.8	126.6	-89.8	-64.3	0	0	0	115.1
730	S	42.6	Very low	53.2	Low	107 Å²	107	140.5 Å²	140.5	75%	0.748	70%	0.698	S	S	*	*			trans	67.3	159.4	151.9	81.2	0	0	0	0	118.1
731	K	45.5	Very low	51	Low	196 Å²	196	146 Å²	146	85%	0.852	72%	0.716	S	S	*	*			cis	-137.5	164.1	17	-66.3	175.8	178.3	167.4	0	113.4
732	T	44.1	Very low	48.9	Very low	129 Å²	129	153.6 Å²	153.6	79%	0.791	75%	0.75	S	S	*	*			trans	-96.7	136.4	173.5	53.7	0	0	0	0	113.7
733	K	45.5	Very low	47	Very low	199 Å²	199	155.8 Å²	155.8	87%	0.865	76%	0.76	S	S	*	*				177.2	119.9	124	-105	177.8	177.4	174.6	0	115.8
734	K	46.2	Very low	45.4	Very low	171 Å²	171	161.8 Å²	161.8	74%	0.743	78%	0.779	S	S	*	*			trans	32.6	130.2	131.8	-87.5	-178.6	164.7	-168.5	0	123.5
735	H	46.1	Very low	44	Very low	166 Å²	166	165.8 Å²	165.8	77%	0.769	79%	0.794	S	S	*	*			trans	77.9	118.4	139.9	-60.9	-46.4	0	0	0	122
736	S	38.5	Very low	43	Very low	124 Å²	124	171.6 Å²	171.6	87%	0.867	80%	0.802	S	S	*	*				-151.8	159.6	129	-170.2	0	0	0	0	110.8
737	K	50	Low	42	Very low	203 Å²	203	170.3 Å²	170.3	88%	0.883	81%	0.805	S	S	*	*			trans	-109.1	137.8	176.7	-67.9	174.3	178.9	172.6	0	109.9
738	K	43.4	Very low	41	Very low	212 Å²	212	173 Å²	173	92%	0.922	81%	0.808	S	S	*	*			trans	-149.9	162.4	148.5	-147.9	152.5	-173.6	172.8	0	112.1
739	S	38.4	Very low	40.9	Very low	100 Å²	100	170.9 Å²	170.9	70%	0.699	81%	0.812	S	S	*	*			trans	-127.5	135.8	-151.8	56.8	0	0	0	0	115.3
740	K	46.4	Very low	40.1	Very low	201 Å²	201	174.1 Å²	174.1	87%	0.874	82%	0.818	S	S	*	*				39.6	93.1	129.1	-169.3	-177	-177	177.4	0	117.6
741	K	38.7	Very low	39.6	Very low	194 Å²	194	174.7 Å²	174.7	84%	0.843	82%	0.821	S	S	*	*			trans	-162.7	117.6	133.1	-123.5	175.1	-178.9	177.3	0	111.8
742	H	37.5	Very low	38.8	Very low	196 Å²	196	170.7 Å²	170.7	91%	0.907	82%	0.818	S	S	*	*			trans	-87.6	145	157.8	-76.7	-88.7	0	0	0	108.8
743	H	39.6	Very low	38.3	Very low	144 Å²	144	169.5 Å²	169.5	67%	0.667	82%	0.815	S	S	*	*			trans	-147.9	131.5	167.3	-143.7	-30.5	0	0	0	113
744	R	38.6	Very low	37.6	Very low	223 Å²	223	169.8 Å²	169.8	84%	0.842	82%	0.816	S	S	*	*			trans	66.3	125.9	159.8	-91.3	163.6	179.4	167.7	-0.5	119.2
745	K	38.9	Very low	36.8	Very low	207 Å²	207	166 Å²	166	90%	0.9	82%	0.817	S	S	*	*			trans	-70.5	166.2	160.1	-44.1	175.9	-178.4	-177	0	110
746	R	31.8	Very low	36	Very low	222 Å²	222	163 Å²	163	84%	0.838	82%	0.815	S	S	*	*				172.9	91.8	118.7	-174	164	-168.3	-179.4	4.9	116.5
747	S	35.3	Very low	35.7	Very low	84 Å²	84	166.2 Å²	166.2	59%	0.587	82%	0.816	S	S	*	*			trans	60.2	155.7	133.7	73.4	0	0	0	0	124.8
748	R	31.2	Very low	34.7	Very low	224 Å²	224	161 Å²	161	85%	0.845	81%	0.805	S	S	*	*			trans	86.7	146	166.6	-58.3	176.2	168.6	141.1	-7.3	114.3
749	S	33.9	Very low	34.3	Very low	120 Å²	120	158.7 Å²	158.7	84%	0.839	80%	0.798	S	S	*	*			cis	-134	179.6	17.1	-76.8	0	0	0	0	115.1
750	R	29.9	Very low	33.9	Very low	235 Å²	235	163.1 Å²	163.1	89%	0.887	81%	0.807	S	S	*	*			trans	-77.2	155.1	-179.2	-57.5	161.9	168	138.7	-9.5	113.4
751	S	31.7	Very low	33	Very low	118 Å²	118	163.2 Å²	163.2	83%	0.825	81%	0.811	S	S	*	*				166.6	143	107.6	-83.3	0	0	0	0	116.4
752	S	30.1	Very low	32.8	Very low	113 Å²	113	162 Å²	162	79%	0.79	81%	0.808	S	S	*	*			trans	-13.2	134	165.3	-169.5	0	0	0	0	121.2
753	S	31.7	Very low	32.4	Very low	103 Å²	103	161 Å²	161	72%	0.72	80%	0.797	S	S	*	*				169.4	146.3	95.9	53.3	0	0	0	0	116
754	K	31.6	Very low	32.2	Very low	206 Å²	206	162 Å²	162	90%	0.896	80%	0.802	S	S	*	*			trans	47.3	163.2	151.7	-70.9	-173.1	175.8	-176.2	0	122.6
755	A	29.9	Very low	32	Very low	92 Å²	92	159.3 Å²	159.3	76%	0.76	80%	0.796	S	S	*	*			trans	66.7	125.2	176.6	0	0	0	0	0	114.7
756	S	29.9	Very low	31.7	Very low	102 Å²	102	159.9 Å²	159.9	71%	0.713	80%	0.799	S	S	*	*			cis	95.8	140.4	36.2	73.2	0	0	0	0	112.9
757	E	31.4	Very low	31.8	Very low	191 Å²	191	159 Å²	159	89%	0.893	80%	0.801	S	S	*	*			trans	63.9	167.6	178	-62.1	176.6	165.9	0	0	114.8
758	S	29.5	Very low	31.7	Very low	94 Å²	94	164.6 Å²	164.6	66%	0.657	82%	0.815	S	S	*	*			cis	-149.6	175.4	-48.2	-163.9	0	0	0	0	108.5
759	E	33.6	Very low	31.7	Very low	164 Å²	164	164.2 Å²	164.2	77%	0.766	81%	0.814	S	S	*	*			trans	13.1	123	157.7	-72.2	161.1	169.2	0	0	121.2
760	E	30	Very low	31.6	Very low	192 Å²	192	163.1 Å²	163.1	90%	0.897	81%	0.806	S	S	*	*				30.4	105.1	118.5	-57.2	-164.6	146.8	0	0	119.5
761	E	29.2	Very low	31.7	Very low	203 Å²	203	160 Å²	160	95%	0.949	80%	0.801	S	S	*	*			trans	-107.9	116.3	148.6	-80.3	-153.7	138.7	0	0	111.1
762	E	33.3	Very low	31.6	Very low	170 Å²	170	158.6 Å²	158.6	79%	0.794	79%	0.792	S	S	*	*			trans	-108.1	108.4	157.5	-171.3	-148.8	165.8	0	0	109.9
763	Y	30.1	Very low	31.8	Very low	173 Å²	173	162.6 Å²	162.6	68%	0.678	80%	0.795	S	S	*	*			trans	-171.7	155.5	151.9	-93.7	-46.3	0	0	0	109.4
764	H	35.6	Very low	31.8	Very low	166 Å²	166	163.1 Å²	163.1	77%	0.769	80%	0.799	S	S	*	*			cis	-136.1	156.2	11.4	-89.8	-51.8	0	0	0	114.4
765	K	33.8	Very low	32.2	Very low	166 Å²	166	159.2 Å²	159.2	72%	0.722	79%	0.794	S	S	*	*			trans	-50.6	147.7	165.4	-63	147.6	-179.5	157	0	113.5
766	K	31.9	Very low	32.2	Very low	220 Å²	220	159.4 Å²	159.4	96%	0.957	79%	0.79	S	S	*	*			trans	-125.3	136	141.5	-88	-179.4	178.2	168.6	0	110.3
767	K	34.4	Very low	32.1	Very low	202 Å²	202	161.6 Å²	161.6	88%	0.878	79%	0.789	S	S	*	*			trans	-130.1	121.5	-168.6	-174.6	-177.7	-176.4	-179	0	110.9
768	K	33.7	Very low	31.8	Very low	203 Å²	203	162.5 Å²	162.5	88%	0.883	79%	0.785	S	S	*	*			trans	-148.1	150.7	169.1	-69.4	-83.7	-170.7	165.8	0	108
769	R	29.7	Very low	31.6	Very low	215 Å²	215	163.1 Å²	163.1	81%	0.811	79%	0.789	S	S	*	*			cis	-170.8	125.5	-45.3	155.4	169.4	166.8	167.2	-4.7	106.4
770	S	32.8	Very low	31.3	Very low	98 Å²	98	160.7 Å²	160.7	69%	0.685	79%	0.79	S	S	*	*			trans	59.1	162	173.6	49.8	0	0	0	0	115.6
771	Q	31.3	Very low	31.2	Very low	168 Å²	168	157.3 Å²	157.3	79%	0.785	79%	0.787	S	S	*	*			cis	-149.3	157	2.8	-146.4	162.1	-38.3	0	0	111
772	S	30.4	Very low	31.2	Very low	89 Å²	89	150.8 Å²	150.8	62%	0.622	77%	0.774	S	S	*	*			trans	17.3	133.8	154.2	63.2	0	0	0	0	120
773	K	33.2	Very low	31.2	Very low	197 Å²	197	151 Å²	151	86%	0.857	78%	0.776	S	S	*	*				-158	166.9	54.7	-76.4	178.3	177.7	176.7	0	113.4
774	S	31.9	Very low	31.3	Very low	114 Å²	114	147.9 Å²	147.9	80%	0.797	78%	0.779	S	S	*	*			trans	-73.9	-177.9	169.1	-26.4	0	0	0	0	112.7
775	P	39.9	Very low	30.9	Very low	124 Å²	124	146.7 Å²	146.7	81%	0.805	77%	0.774	S	S	*	*			cis	-133.1	-149.1	0.4	41.9	-21.8	0	0	0	114.2
776	S	30	Very low	30.9	Very low	97 Å²	97	148.9 Å²	148.9	68%	0.678	78%	0.778	S	S	*	*			trans	-89.4	-177	-170.2	52.1	0	0	0	0	116.3
777	E	27.8	Very low	30.9	Very low	148 Å²	148	142.5 Å²	142.5	69%	0.692	76%	0.761	S	S	*	*			trans	74.1	157.1	175	-55	-65.4	93	0	0	117.1
778	R	26.3	Very low	30.7	Very low	210 Å²	210	142.6 Å²	142.6	79%	0.792	76%	0.757	S	S	*	*			cis	-174	134	-37.5	-177.2	164.9	167.1	-167.6	-3.8	111.6
779	S	25.4	Very low	30.5	Very low	106 Å²	106	141.9 Å²	141.9	74%	0.741	75%	0.754	S	S	*	*			trans	72.5	149.1	162.4	-153.8	0	0	0	0	120.9
780	S	26.2	Very low	30.5	Very low	113 Å²	113	141.1 Å²	141.1	79%	0.79	76%	0.756	S	S	*	*			trans	62.2	151.2	157.2	-68.2	0	0	0	0	120.4
781	S	28.8	Very low	30.3	Very low	121 Å²	121	141.1 Å²	141.1	85%	0.846	76%	0.756	S	S	*	*			cis	-168	146.6	-21.3	-175.2	0	0	0	0	110.8
782	G	28.9	Very low	30.3	Very low	66 Å²	66	142.8 Å²	142.8	68%	0.68	76%	0.761	S	S	*	*			trans	82.5	161.5	163.8	0	0	0	0	0	117.6
783	E	33.2	Very low	30.2	Very low	176 Å²	176	146.6 Å²	146.6	82%	0.822	77%	0.766	S	S	*	*			cis	-167.6	162.3	-13.8	-117.4	-78.2	69.4	0	0	109.2
784	S	31.5	Very low	30	Very low	106 Å²	106	144.8 Å²	144.8	74%	0.741	76%	0.76	S	S	*	*			trans	67.5	147	177.8	82.7	0	0	0	0	117
785	E	28.8	Very low	29.8	Very low	142 Å²	142	148.2 Å²	148.2	66%	0.664	76%	0.761	S	S	*	*			cis	-138.9	168.1	-2.1	-93.7	-139.3	86.3	0	0	112
786	R	32.1	Very low	29.2	Very low	212 Å²	212	151.2 Å²	151.2	80%	0.8	76%	0.761	S	S	*	*			trans	6.7	140.7	149.9	-67.6	174.8	172.4	127.8	-11.8	119.2
787	S	32.5	Very low	29.2	Very low	86 Å²	86	156.6 Å²	156.6	60%	0.601	77%	0.773	S	S	*	*			cis	-176.5	171.2	11.6	46.6	0	0	0	0	115.8
788	Y	30.4	Very low	29.2	Very low	204 Å²	204	153.3 Å²	153.3	80%	0.8	78%	0.778	S	S	*	*			trans	74.2	140.9	154.1	67.8	-117.6	0	0	0	125
789	K	30.2	Very low	29.4	Very low	188 Å²	188	153.5 Å²	153.5	82%	0.817	79%	0.785	S	S	*	*			trans	77.2	78.3	159	-68.1	171.6	-177	174.3	0	121.7
790	K	28.2	Very low	29.7	Very low	199 Å²	199	158 Å²	158	87%	0.865	79%	0.791	S	S	*	*				38.4	89.8	119.1	-165.2	175.2	-174.8	177.7	0	116
791	S	28.9	Very low	29.8	Very low	97 Å²	97	162.4 Å²	162.4	68%	0.678	79%	0.79	S	S	*	*				61.5	140.3	69	103.5	0	0	0	0	114.5
792	K	30.7	Very low	29.8	Very low	203 Å²	203	168.4 Å²	168.4	88%	0.883	80%	0.795	S	S	*	*			cis	-156.2	152.5	30.5	-139.2	165.1	-171.4	172.8	0	112.5
793	K	28.3	Very low	29.9	Very low	170 Å²	170	172.3 Å²	172.3	74%	0.739	80%	0.795	S	S	*	*			trans	-133.7	142.6	178.1	-161.7	-169.7	-171.2	-172.8	0	110.7
794	H	30.3	Very low	29.5	Very low	159 Å²	159	171.7 Å²	171.7	74%	0.736	80%	0.797	S	S	*	*			trans	54.6	133.5	167.6	-60.6	-47.1	0	0	0	120.1
795	K	26.6	Very low	29.6	Very low	186 Å²	186	174 Å²	174	81%	0.809	80%	0.796	S	S	*	*				153.1	144.5	90.4	-154.1	161	-176.2	172.8	0	113.6
796	K	28.4	Very low	29.6	Very low	187 Å²	187	174.2 Å²	174.2	81%	0.813	80%	0.802	S	S	*	*			trans	2.9	132.3	162.4	-63.2	-176.2	175.6	-173.6	0	119.7
797	K	29.8	Very low	29.5	Very low	210 Å²	210	172.8 Å²	172.8	91%	0.913	80%	0.801	S	S	*	*				-161.7	142.1	91.3	-101.9	177.7	178.8	179.4	0	110.2
798	G	27.5	Very low	29.4	Very low	79 Å²	79	177.8 Å²	177.8	81%	0.814	82%	0.815	S	S	*	*			trans	-103.7	-167.2	-165.6	0	0	0	0	0	115.4
799	K	31.6	Very low	29.3	Very low	213 Å²	213	173 Å²	173	93%	0.926	82%	0.818	S	S	*	*			trans	-141.1	160.2	165.7	-105.5	172.2	-178	174.6	0	111.5
800	K	30.9	Very low	29.2	Very low	202 Å²	202	169.5 Å²	169.5	88%	0.878	82%	0.817	S	S	*	*			trans	-41.9	143.2	-164.2	-62.4	174.3	176	-178.1	0	117.4
801	R	28.6	Very low	30.2	Very low	204 Å²	204	165.3 Å²	165.3	77%	0.77	81%	0.81	S	S	*	*			trans	-59.5	141.5	160.3	-60.2	158	74.6	172.6	6.9	110.2	H803	R801-H803 PolarHBondContact NH2-NE2 3.28Å; R801-H803 VanDerWaalsContact NH2-NE2 3.13Å
802	R	28.8	Very low	30.2	Very low	248 Å²	248	167.4 Å²	167.4	94%	0.936	81%	0.813	S	S	*	*			trans	-130	134.1	136.6	-87.2	-169.8	165.2	-178.6	-5.6	107
803	H	29.9	Very low	30.1	Very low	147 Å²	147	162 Å²	162	68%	0.681	80%	0.801	S	S	*	*			trans	-80.5	146.2	174.9	-76.8	-73.7	0	0	0	109.3	R801	R801-H803 PolarHBondContact NH2-NE2 3.28Å; R801-H803 VanDerWaalsContact NH2-NE2 3.13Å
804	N	26.1	Very low	30.2	Very low	164 Å²	164	161.7 Å²	161.7	88%	0.877	81%	0.808	S	S	*	*			trans	-132.3	114.3	145.5	-160.2	39	0	0	0	106
805	H	32.5	Very low	30.1	Very low	155 Å²	155	157.6 Å²	157.6	72%	0.718	81%	0.809	S	S	*	*			trans	-134.6	99.2	-179.4	-175.8	-59.1	0	0	0	107.3
806	D	28.7	Very low	30.3	Very low	146 Å²	146	156.1 Å²	156.1	78%	0.781	81%	0.805	S	S	*	*			trans	-98.7	116.3	176.1	-160.7	-25.3	0	0	0	108.9
807	K	30.6	Very low	30.4	Very low	181 Å²	181	153.8 Å²	153.8	79%	0.787	80%	0.795	S	S	*	*			trans	-162.7	138.4	164	-119.6	-179.5	-176.8	-173.2	0	110.1
808	Q	31.2	Very low	30.4	Very low	192 Å²	192	153.2 Å²	153.2	90%	0.897	79%	0.792	S	S	*	*			trans	-74.4	144.4	-171.9	-60.9	150.9	-30.1	0	0	112.4
809	A	27.5	Very low	30.5	Very low	104 Å²	104	152.8 Å²	152.8	86%	0.86	79%	0.787	S	S	*	*			trans	-157.7	147.4	155.8	0	0	0	0	0	110.3
810	S	28.7	Very low	30.5	Very low	114 Å²	114	153.3 Å²	153.3	80%	0.797	78%	0.783	S	S	*	*			trans	-167.8	157.2	179.1	-176.6	0	0	0	0	108
811	P	49.6	Very low	30.5	Very low	110 Å²	110	149.3 Å²	149.3	71%	0.714	77%	0.768	S	S	*	*			cis	-106.5	-168.5	-12.5	40.6	-27.6	0	0	0	111
812	D	27.6	Very low	30.7	Very low	141 Å²	141	149.2 Å²	149.2	75%	0.754	77%	0.768	S	S	*	*				-175.8	163.2	78.1	-144.1	-44	0	0	0	113.7
813	S	29.6	Very low	30.8	Very low	89 Å²	89	144 Å²	144	62%	0.622	76%	0.758	S	S	*	*			trans	53	114.6	156.1	-68.2	0	0	0	0	123.9
814	D	29.1	Very low	30.8	Very low	164 Å²	164	139.6 Å²	139.6	88%	0.877	75%	0.753	S	S	*	*			trans	70	139	131.9	-73.4	-57.2	0	0	0	124.1
815	G	28.3	Very low	31.2	Very low	74 Å²	74	140.9 Å²	140.9	76%	0.763	75%	0.751	S	S	*	*			trans	156.9	82.8	171.8	0	0	0	0	0	116.5
816	E	30.6	Very low	31.1	Very low	155 Å²	155	143.4 Å²	143.4	72%	0.724	75%	0.754	S	S	*	*			trans	-46.7	165.3	169.1	-56.7	-153.1	130.8	0	0	116.3
817	K	31.4	Very low	31.3	Very low	137 Å²	137	143 Å²	143	60%	0.596	75%	0.747	S	S	*	*			cis	-170.9	154	-1.5	-120.1	169.7	-168.6	144.8	0	109.3
818	K	30.6	Very low	31.4	Very low	199 Å²	199	143.7 Å²	143.7	87%	0.865	75%	0.745	S	S	*	*			trans	60.1	144.3	155.5	-60.1	167.3	179.2	176.8	0	117.9
819	G	29.3	Very low	31.4	Very low	69 Å²	69	141.8 Å²	141.8	71%	0.711	74%	0.741	S	S	*	*			cis	144.5	162	-6.7	0	0	0	0	0	112.9
820	R	30.6	Very low	31.4	Very low	224 Å²	224	142.6 Å²	142.6	85%	0.845	74%	0.74	S	S	*	*			trans	74	145.8	168.5	-75.2	-165	160.1	143.3	1.8	118.6
821	E	31.1	Very low	31.5	Very low	118 Å²	118	145 Å²	145	55%	0.551	74%	0.739	S	S	*	*			cis	-170.1	163.3	-19.6	-134.5	170	-122.4	0	0	110.5
822	R	32.1	Very low	30.6	Very low	203 Å²	203	147.3 Å²	147.3	77%	0.766	74%	0.738	S	S	*	*			trans	66.2	158.3	159.2	-67.3	-174.3	145.9	121.2	-5.2	119
823	D	32.4	Very low	30.7	Very low	138 Å²	138	146.7 Å²	146.7	74%	0.738	73%	0.734	S	S	*	*			cis	-161	164.8	-19	-112.7	-49.2	0	0	0	105.6
824	G	30.4	Very low	30.8	Very low	55 Å²	55	152.6 Å²	152.6	57%	0.567	75%	0.749	S	S	*	*			cis	152.8	135.7	-4.7	0	0	0	0	0	112.2
825	K	32.7	Very low	30.9	Very low	191 Å²	191	152.5 Å²	152.5	83%	0.83	74%	0.743	S	S	*	*			trans	75	156.9	176.2	-60.3	166.6	-175.1	164.6	0	116
826	R	30.5	Very low	30.9	Very low	208 Å²	208	154.2 Å²	154.2	79%	0.785	74%	0.735	S	S	*	*			cis	-154.4	130.8	-6.9	-117.3	164.5	175.7	173.2	-4.7	105.7
827	E	34.2	Very low	30.9	Very low	136 Å²	136	153.3 Å²	153.3	64%	0.636	74%	0.735	S	S	*	*				83.9	127	65.5	-153	-142	-145.3	0	0	115.6
828	R	31.1	Very low	31	Very low	196 Å²	196	154 Å²	154	74%	0.74	74%	0.738	S	S	*	*			trans	109.6	133.4	141.4	-159.4	166.3	-69.5	-107	-7.8	120
829	D	32.3	Very low	31.1	Very low	153 Å²	153	152 Å²	152	82%	0.818	74%	0.735	S	S	*	*			trans	-84.1	165.2	179.3	-39.7	-102	0	0	0	114
830	S	27.7	Very low	31.1	Very low	121 Å²	121	160.8 Å²	160.8	85%	0.846	75%	0.747	S	S	*	*			trans	-158	145.6	145.5	60.1	0	0	0	0	111.5
831	E	30.4	Very low	31	Very low	164 Å²	164	153.9 Å²	153.9	77%	0.766	75%	0.745	S	S	*	*			trans	-86.7	-179.7	-174.6	-46.7	175.6	120.2	0	0	114.7
832	K	30.8	Very low	31.2	Very low	158 Å²	158	157.9 Å²	157.9	69%	0.687	76%	0.761	S	S	*	*			trans	100	132	138	-84.9	178.1	177.9	-179.2	0	123
833	D	29.8	Very low	30.9	Very low	128 Å²	128	154.1 Å²	154.1	68%	0.684	77%	0.765	S	S	*	*			trans	52.6	110.5	137.6	-49.5	-20.7	0	0	0	120.5
834	K	31.1	Very low	30.8	Very low	213 Å²	213	157.3 Å²	157.3	93%	0.926	77%	0.767	S	S	*	*				-165.7	159.1	102.9	-105.7	161.2	-175.4	171.3	0	115.6
835	E	31.1	Very low	30.8	Very low	162 Å²	162	160.6 Å²	160.6	76%	0.757	78%	0.781	S	S	*	*			trans	-107.4	161.3	-176.7	-161.3	-160.8	144.1	0	0	110.9
836	N	29.7	Very low	30.6	Very low	110 Å²	110	158.5 Å²	158.5	59%	0.588	77%	0.774	S	S	*	*			trans	53.4	129.9	158.4	-102	-47.4	0	0	0	119.9
837	D	28.8	Very low	30.5	Very low	136 Å²	136	154.1 Å²	154.1	73%	0.727	78%	0.776	S	S	*	*				-171	-167.7	76.5	-145.7	-32	0	0	0	111.6
838	K	33.6	Very low	30.5	Very low	153 Å²	153	157 Å²	157	67%	0.665	79%	0.786	S	S	*	*			trans	-107.1	145	-152.1	-68.9	155.8	-168.8	140.3	0	117.3
839	I	33	Very low	30.4	Very low	156 Å²	156	157 Å²	157	80%	0.8	79%	0.794	S	S	*	*				40.3	111.7	128.7	-48.3	164.9	0	0	0	118.5
840	R	30.5	Very low	30.5	Very low	254 Å²	254	159 Å²	159	96%	0.958	80%	0.796	S	S	*	*				-166.4	154.2	127.4	-136.1	170.9	175.8	143.2	-2.6	113.5
841	G	28.8	Very low	30.6	Very low	79 Å²	79	158.9 Å²	158.9	81%	0.814	80%	0.795	S	S	*	*			trans	126.9	110.8	163.7	0	0	0	0	0	114
842	K	33.4	Very low	30.9	Very low	202 Å²	202	157.1 Å²	157.1	88%	0.878	80%	0.798	S	S	*	*			trans	-131.7	129.9	-177.2	180	173.8	-178.1	171.4	0	110.4
843	S	27.6	Very low	31.1	Very low	123 Å²	123	159.3 Å²	159.3	86%	0.86	81%	0.807	S	S	*	*			trans	-135.1	139.4	165.2	53.4	0	0	0	0	109.4
844	R	29	Very low	31.1	Very low	206 Å²	206	164.7 Å²	164.7	78%	0.777	82%	0.818	S	S	*	*			trans	-124.7	124.9	-175.7	175.8	-175.6	176.5	175.9	-0.2	108.7	E846	R844-E846 IonicContact CZ-OE2 3.41Å; R844-E846 IonicContact NE-OE2 2.67Å; R844-E846 IonicContact NH2-OE2 3.39Å; R844-E846 PolarHBondContact NH2-OE2 3.12Å
845	S	30	Very low	31.2	Very low	123 Å²	123	164.6 Å²	164.6	86%	0.86	82%	0.818	S	S	*	*			trans	-139.9	136.1	167.9	53.5	0	0	0	0	108.5
846	E	29.4	Very low	31.2	Very low	147 Å²	147	162 Å²	162	69%	0.687	82%	0.824	S	S	*	*			trans	-118.2	124	-163.2	-166.8	173.4	123.8	0	0	110.6	R844	R844-E846 IonicContact CZ-OE2 3.41Å; R844-E846 IonicContact NE-OE2 2.67Å; R844-E846 IonicContact NH2-OE2 3.39Å; R844-E846 PolarHBondContact NH2-OE2 3.12Å
847	S	29.1	Very low	31.2	Very low	116 Å²	116	161.8 Å²	161.8	81%	0.811	84%	0.838	S	S	*	*			trans	-152.1	113.1	173.6	59.1	0	0	0	0	111.5
848	K	32.9	Very low	31.3	Very low	198 Å²	198	163.2 Å²	163.2	86%	0.861	84%	0.837	S	S	*	*			trans	-68	142.2	168.2	-65.7	167.5	179.4	166.8	0	109.8
849	Q	30.3	Very low	31.1	Very low	194 Å²	194	165 Å²	165	91%	0.907	85%	0.848	S	S	*	*			trans	-165.5	158.8	132.2	-89.5	-108.6	-15.7	0	0	109.4
850	K	34.5	Very low	31	Very low	195 Å²	195	164.9 Å²	164.9	85%	0.848	84%	0.844	S	S	*	*			trans	-83.7	160.8	-174.4	-71.9	174.9	175.9	173.1	0	111.9
851	S	29.6	Very low	31	Very low	120 Å²	120	156.5 Å²	156.5	84%	0.839	84%	0.837	S	S	*	*			trans	-146.7	155.9	160	-83.4	0	0	0	0	111.7
852	P	35.7	Very low	31	Very low	127 Å²	127	156.2 Å²	156.2	83%	0.825	83%	0.834	S	S	*	*			trans	-102.5	168.4	-158	38.8	-36.4	0	0	0	116.2
853	K	35.2	Very low	30.9	Very low	203 Å²	203	159.2 Å²	159.2	88%	0.883	84%	0.84	S	S	*	*			trans	-75.4	138.2	175.2	-71.6	177.3	173	176	0	113.6
854	R	30.4	Very low	31.1	Very low	241 Å²	241	159.7 Å²	159.7	91%	0.909	83%	0.833	S	S	*	*			trans	-168.5	124.4	138.2	-98.2	156.1	-169.1	-137.6	2.9	107.3
855	K	32.9	Very low	31.4	Very low	211 Å²	211	156.9 Å²	156.9	92%	0.917	84%	0.839	S	S	*	*				75.4	99.4	62.7	-92.6	-156.1	173.1	-170.8	0	115.3
856	A	29.7	Very low	31.6	Very low	107 Å²	107	155.8 Å²	155.8	88%	0.884	83%	0.831	S	S	*	*			trans	-166	150.9	153.1	0	0	0	0	0	107
857	A	29.8	Very low	31.7	Very low	106 Å²	106	152.1 Å²	152.1	88%	0.876	83%	0.833	S	S	*	*			cis	-148.9	173.5	-22.3	0	0	0	0	0	107.8
858	K	32.5	Very low	32.1	Very low	167 Å²	167	151.2 Å²	151.2	73%	0.726	83%	0.826	S	S	*	*			trans	-130.7	130.4	-169.4	-176.3	-142.2	-171.2	-158.3	0	111.6	E860	K858-E860 WeakPolarHBondContact CE-OE1 3.42Å; K858-E860 IonicContact NZ-OE1 3.99Å; K858-E860 PolarHBondContact NZ-OE1 3.46Å
859	E	28.3	Very low	32.7	Very low	191 Å²	191	151 Å²	151	89%	0.893	83%	0.828	S	S	*	*			trans	-173.1	170.1	145.9	-116.2	176.5	-155.4	0	0	111.5
860	E	30.9	Very low	33.9	Very low	152 Å²	152	145.5 Å²	145.5	71%	0.71	81%	0.805	S	S	*	*				-153	159.7	-88.9	-168.7	167.7	-88.6	0	0	110.6	K858	K858-E860 WeakPolarHBondContact CE-OE1 3.42Å; K858-E860 IonicContact NZ-OE1 3.99Å; K858-E860 PolarHBondContact NZ-OE1 3.46Å
861	G	30.1	Very low	35.6	Very low	79 Å²	79	139.1 Å²	139.1	81%	0.814	79%	0.785	S	S	*	*			trans	96.2	115.9	166.3	0	0	0	0	0	115.7
862	G	29.2	Very low	37	Very low	72 Å²	72	141.5 Å²	141.5	74%	0.742	78%	0.783	S	S	*	*			cis	131	102	-8.1	0	0	0	0	0	113.7
863	W	32.4	Very low	38.8	Very low	265 Å²	265	137.7 Å²	137.7	100%	1.004	77%	0.766	S	S	*	*			trans	-135.8	125.1	151.3	-84.8	83.1	0	0	0	106
864	D	31.8	Very low	40.5	Very low	134 Å²	134	132.2 Å²	132.2	72%	0.717	74%	0.744	S	S	*	*			trans	-122	127.9	-169.7	178.6	11.5	0	0	0	110.1	S866	D864-S866 PolarHBondContact OD1-N 2.81Å
865	T	34.8	Very low	42.4	Very low	146 Å²	146	125.2 Å²	125.2	90%	0.896	72%	0.724	S	S	*	*			trans	-145.2	53.8	167.9	59.2	0	0	0	0	110.2
866	S	32.9	Very low	44.2	Very low	100 Å²	100	120.2 Å²	120.2	70%	0.699	70%	0.704	S	S	*	*			trans	-102.9	101	167.6	-162	0	0	0	0	110.7	D864 S868	D864-S866 PolarHBondContact OD1-N 2.81Å; S866-S868 PolarHBondContact O-N 3.5Å
867	G	32.4	Very low	46.4	Very low	70 Å²	70	122.1 Å²	122.1	72%	0.722	69%	0.692	S	S	*	*			trans	-62	134	164.6	0	0	0	0	0	109.5	E869	G867-E869 PolarHBondContact O-N 3.35Å
868	S	37.9	Very low	48.8	Very low	97 Å²	97	124.5 Å²	124.5	68%	0.678	68%	0.678	S	S	*	*			trans	-67.8	121.8	-171.4	53.6	0	0	0	0	112.8	S866 L870	S866-S868 PolarHBondContact O-N 3.5Å; S868-L870 PolarHBondContact O-N 3.22Å
869	E	45.4	Very low	50.7	Low	194 Å²	194	120.8 Å²	120.8	91%	0.907	66%	0.66	S	S	*	*			trans	-59.6	114.3	151.8	-64.4	-179.9	120	0	0	107.5	G867	G867-E869 PolarHBondContact O-N 3.35Å
870	L	55	Low	53	Low	79 Å²	79	119.6 Å²	119.6	41%	0.414	65%	0.647	S	S	.	*			trans	-66.4	134.6	177	-69.2	174.1	0	0	0	109	S868 E874	S868-L870 PolarHBondContact O-N 3.22Å; L870-E874 HydrophobicContact CB-CB 4.41Å
871	S	70.1	Confident	55.1	Low	61 Å²	61	115.7 Å²	115.7	43%	0.427	63%	0.634	S	S	.	*			trans	-68.4	156.2	-177.4	64.1	0	0	0	0	111.8	G873 E874 L875	S871-G873 PolarHBondContact O-N 2.86Å; S871-G873 VanDerWaalsContact O-N 3.1Å; S871-E874 WeakPolarHBondContact CB-OE2 3.34Å; S871-E874 PolarHBondContact N-OE2 3.35Å; S871-E874 WeakPolarHBondContact O-CA 3.42Å; S871-E874 WeakPolarHBondContact O-CB 3.26Å; S871-E874 PolarHBondContact O-N 3.44Å; S871-E874 WeakPolarHBondContact OG-CG 3.34Å; S871-E874 PolarHBondContact OG-OE2 3.17Å; S871-L875 PolarHBondContact O-N 3.05Å; S871-L875 VanDerWaalsContact O-N 3.08Å
872	E	58.9	Low	57	Low	170 Å²	170	116.9 Å²	116.9	79%	0.794	62%	0.621	S	S	*	*	H	α-helix	trans	-51.1	-36.5	176.6	-165.4	172.3	-160.6	0	0	111.7	E874 L875 E876	E872-E874 PolarHBondContact O-N 3.44Å; E872-L875 PolarHBondContact O-N 3.02Å; E872-E876 WeakPolarHBondContact O-CB 3.44Å; E872-E876 PolarHBondContact O-N 3.02Å
873	G	73.6	Confident	58.8	Low	46 Å²	46	118.5 Å²	118.5	47%	0.474	61%	0.612	S	S	.	*	H	α-helix	trans	-76.7	-9.5	175.6	0	0	0	0	0	116.3	S871 K877	S871-G873 PolarHBondContact O-N 2.86Å; S871-G873 VanDerWaalsContact O-N 3.1Å; G873-K877 WeakPolarHBondContact O-CG 3.5Å
874	E	70.6	Confident	60.6	Low	89 Å²	89	112 Å²	112	42%	0.416	59%	0.593	S	S	.	*	H	α-helix	trans	-93.6	-35.1	170	-72.2	167.1	118.9	0	0	111.4	L870 S871 E872 K877 R878	L870-E874 HydrophobicContact CB-CB 4.41Å; S871-E874 WeakPolarHBondContact CB-OE2 3.34Å; S871-E874 PolarHBondContact N-OE2 3.35Å; S871-E874 WeakPolarHBondContact O-CA 3.42Å; S871-E874 WeakPolarHBondContact O-CB 3.26Å; S871-E874 PolarHBondContact O-N 3.44Å; S871-E874 WeakPolarHBondContact OG-CG 3.34Å; S871-E874 PolarHBondContact OG-OE2 3.17Å; E872-E874 PolarHBondContact O-N 3.44Å; E874-K877 PolarHBondContact O-N 3.11Å; E874-R878 PolarHBondContact O-N 3.05Å
875	L	71.5	Confident	62.1	Low	94 Å²	94	112.1 Å²	112.1	49%	0.492	59%	0.589	S	S	.	*	H	α-helix	trans	-59.3	-49.3	165.9	-74.4	163.1	0	0	0	110.5	S871 E872 K877 R878 R879	S871-L875 PolarHBondContact O-N 3.05Å; S871-L875 VanDerWaalsContact O-N 3.08Å; E872-L875 PolarHBondContact O-N 3.02Å; L875-K877 PolarHBondContact O-N 3.18Å; L875-R878 PolarHBondContact O-N 2.86Å; L875-R878 VanDerWaalsContact O-N 3.08Å; L875-R879 WeakPolarHBondContact O-CB 3.34Å; L875-R879 PolarHBondContact O-N 3.37Å
876	E	70.8	Confident	63.2	Low	106 Å²	106	111.9 Å²	111.9	50%	0.495	58%	0.581	S	S	.	*	H	α-helix	trans	-61.5	-30.6	177.7	-156.5	63.5	-137.7	0	0	112.8	E872 R879 R880	E872-E876 WeakPolarHBondContact O-CB 3.44Å; E872-E876 PolarHBondContact O-N 3.02Å; E876-R879 IonicContact OE2-NH1 3.56Å; E876-R880 PolarHBondContact O-N 3.07Å; E876-R880 VanDerWaalsContact O-N 3.16Å
877	K	76.4	Confident	64.4	Low	147 Å²	147	114.1 Å²	114.1	64%	0.639	59%	0.586	S	S	*	*	H	α-helix	trans	-69.1	-47.5	171.1	-82.4	175.1	178.6	175.6	0	112.2	G873 E874 L875 R879 R880 T881	G873-K877 WeakPolarHBondContact O-CG 3.5Å; E874-K877 PolarHBondContact O-N 3.11Å; L875-K877 PolarHBondContact O-N 3.18Å; K877-R879 VanDerWaalsContact C-N 3.31Å; K877-R879 PolarHBondContact O-N 3.47Å; K877-R880 WeakPolarHBondContact O-CB 3.27Å; K877-R880 PolarHBondContact O-N 2.9Å; K877-T881 PolarHBondContact O-N 3.27Å; K877-T881 PolarHBondContact O-OG1 2.84Å
878	R	80.3	Confident	64.9	Low	156 Å²	156	114.1 Å²	114.1	59%	0.589	58%	0.579	S	S	*	*	H	α-helix	trans	-58.3	-43.5	175.1	-93.1	-173.9	165.6	-161.3	-4.3	111.5	E874 L875 R880 T881 L882	E874-R878 PolarHBondContact O-N 3.05Å; L875-R878 PolarHBondContact O-N 2.86Å; L875-R878 VanDerWaalsContact O-N 3.08Å; R878-R880 VanDerWaalsContact C-N 3.3Å; R878-R880 PolarHBondContact O-N 2.81Å; R878-T881 PolarHBondContact O-N 2.58Å; R878-L882 PolarHBondContact O-N 3.21Å
879	R	70.7	Confident	65.3	Low	88 Å²	88	119.1 Å²	119.1	33%	0.332	61%	0.609	S	S	.	*	H	α-helix	trans	-53.8	-46.6	175	-158.3	178.8	-164.2	176.8	4.6	111.1	D494 E496 L875 E876 K877 L883	D494-R879 IonicContact OD2-NH2 2.68Å; E496-R879 VanDerWaalsContact CD-NE 3.32Å; E496-R879 IonicContact OE1-CZ 3.72Å; E496-R879 IonicContact OE1-NE 2.86Å; E496-R879 PolarHBondContact OE1-NE 3.32Å; E496-R879 VanDerWaalsContact OE1-NE 3.1Å; E496-R879 IonicContact OE1-NH2 3.86Å; E496-R879 PolarHBondContact OE1-NH2 3.01Å; E496-R879 IonicContact OE2-CZ 2.92Å; E496-R879 IonicContact OE2-NE 3.81Å; E496-R879 PolarHBondContact OE2-NE 3.18Å; E496-R879 IonicContact OE2-NH2 2.65Å; E496-R879 PolarHBondContact OE2-NH2 3.35Å; L875-R879 WeakPolarHBondContact O-CB 3.34Å; L875-R879 PolarHBondContact O-N 3.37Å; E876-R879 IonicContact OE2-NH1 3.56Å; K877-R879 VanDerWaalsContact C-N 3.31Å; K877-R879 PolarHBondContact O-N 3.47Å; R879-L883 WeakPolarHBondContact O-CG 3.42Å; R879-L883 PolarHBondContact O-N 3.45Å; R879-L883 VanDerWaalsContact O-N 3.14Å
880	R	77.5	Confident	66.2	Low	166 Å²	166	115.4 Å²	115.4	63%	0.626	59%	0.594	S	S	*	*	H	α-helix	trans	-61.5	-48.7	173.9	-121.1	-176.2	-166.6	-174.8	5.1	113.5	E876 K877 R878 L882 L883 E884	E876-R880 PolarHBondContact O-N 3.07Å; E876-R880 VanDerWaalsContact O-N 3.16Å; K877-R880 WeakPolarHBondContact O-CB 3.27Å; K877-R880 PolarHBondContact O-N 2.9Å; R878-R880 VanDerWaalsContact C-N 3.3Å; R878-R880 PolarHBondContact O-N 2.81Å; R880-L882 VanDerWaalsContact C-N 3.31Å; R880-L882 PolarHBondContact O-N 3.47Å; R880-L883 PolarHBondContact O-N 3.28Å; R880-E884 WeakPolarHBondContact O-CB 3.36Å; R880-E884 PolarHBondContact O-N 3.33Å
881	T	74.9	Confident	66.8	Low	71 Å²	71	117.3 Å²	117.3	44%	0.436	60%	0.604	S	S	.	*	H	α-helix	trans	-67.3	-30.7	-177.5	-53.6	0	0	0	0	112.7	K877 R878 Q885	K877-T881 PolarHBondContact O-N 3.27Å; K877-T881 PolarHBondContact O-OG1 2.84Å; R878-T881 PolarHBondContact O-N 2.58Å; T881-Q885 PolarHBondContact O-N 3.32Å; T881-Q885 WeakPolarHBondContact O-CG 3.45Å
882	L	69.9	Low	66.7	Low	103 Å²	103	120.4 Å²	120.4	54%	0.539	61%	0.614	S	S	.	*	H	α-helix	trans	-72.5	-40.9	173.9	-78	164.4	0	0	0	112.3	R878 R880 E884 Q885 L886	R878-L882 PolarHBondContact O-N 3.21Å; R880-L882 VanDerWaalsContact C-N 3.31Å; R880-L882 PolarHBondContact O-N 3.47Å; L882-E884 VanDerWaalsContact C-N 3.33Å; L882-E884 PolarHBondContact O-N 3.45Å; L882-Q885 PolarHBondContact O-N 3.48Å; L882-Q885 VanDerWaalsContact O-N 3.16Å; L882-L886 PolarHBondContact O-N 3.07Å
883	L	67.3	Low	67.1	Low	107 Å²	107	117.5 Å²	117.5	56%	0.56	60%	0.603	S	S	*	*	H	α-helix	trans	-60.5	-42.9	171.3	-77.2	162.9	0	0	0	111.5	R879 R880 Q885 L886 D887	R879-L883 WeakPolarHBondContact O-CG 3.42Å; R879-L883 PolarHBondContact O-N 3.45Å; R879-L883 VanDerWaalsContact O-N 3.14Å; R880-L883 PolarHBondContact O-N 3.28Å; L883-Q885 PolarHBondContact O-N 3.33Å; L883-L886 PolarHBondContact O-N 3.33Å; L883-D887 PolarHBondContact O-N 3.28Å
884	E	69.6	Low	66.7	Low	128 Å²	128	122 Å²	122	60%	0.598	61%	0.611	S	S	*	*	H	α-helix	trans	-67.4	-13.5	177	-164.8	164.4	-145.9	0	0	113.5	R880 L882	R880-E884 WeakPolarHBondContact O-CB 3.36Å; R880-E884 PolarHBondContact O-N 3.33Å; L882-E884 VanDerWaalsContact C-N 3.33Å; L882-E884 PolarHBondContact O-N 3.45Å
885	Q	64.2	Low	66.4	Low	136 Å²	136	124.2 Å²	124.2	64%	0.636	62%	0.624	S	S	*	*	H	α-helix	trans	-95	-13.5	171.1	-76	176.4	-11.8	0	0	113.9	T881 L882 L883	T881-Q885 PolarHBondContact O-N 3.32Å; T881-Q885 WeakPolarHBondContact O-CG 3.45Å; L882-Q885 PolarHBondContact O-N 3.48Å; L882-Q885 VanDerWaalsContact O-N 3.16Å; L883-Q885 PolarHBondContact O-N 3.33Å
886	L	58.2	Low	66.1	Low	141 Å²	141	126.4 Å²	126.4	74%	0.738	63%	0.634	S	S	*	*	H	α-helix	trans	-99.4	-20.9	-179.9	-76.3	164.2	0	0	0	113.5	L882 L883 A888	L882-L886 PolarHBondContact O-N 3.07Å; L883-L886 PolarHBondContact O-N 3.33Å; L886-A888 VanDerWaalsContact C-N 3.32Å
887	D	56.4	Low	65.7	Low	147 Å²	147	127.9 Å²	127.9	79%	0.786	64%	0.644	S	S	*	*	S	Bend	trans	-89.2	12.1	177.1	-106.4	-4.7	0	0	0	113.5	L883	L883-D887 PolarHBondContact O-N 3.28Å
888	A	43.7	Very low	64.8	Low	70 Å²	70	126.3 Å²	126.3	58%	0.579	65%	0.645	S	S	*	*			trans	-90.3	134.4	176.1	0	0	0	0	0	111.5	L886	L886-A888 VanDerWaalsContact C-N 3.32Å
889	P	45.3	Very low	63.4	Low	203 Å²	203	123.6 Å²	123.6	100%	1.318	65%	0.65	S	S	*	*			trans	-81.2	0	-176.1	34.4	-37.2	0	0	0	114.8

Retrieved 889 of 889 residues in 1970.5 ms (Link to these results)

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