A0A3B3TIQ2_9TELE Loading...

Solute carrier organic anion transporter family member

AlphaFold DB , UniProt , Accession A0A3B3TIQ2, Species 9TELE (Poecilia latipinna, sailfin molly), Gene n/a, Length 881 aa.

						>A0A3B3TIQ2_9TELE|A0A3B3TIQ2
MDPLPRTQGLSSSCAMTSSDHDETGSDLSESMEIRELQDQYVSAENCFKSKSLPILNGPCEHGVGPSAHPQQVGTTCSCVAAEDRRALQLKTPESSQAESPSSWTDFSPSISSMVGLSSSMPVEAHRPAGFRGRKLGFSLSRFIQIPARKCVRVILTDSRCFLFCMCYLTFIQSLMVSGYLSSVITTIEKRYSLRSSESGLLVSCFDIGSLLVVVFISYFGGRGQRPRWLAVGGVVIAVGAALFSLPHFISPPYQIQEMNSSAGHEGLCQSENGSRRELEVASCPRDQEGNEHNLYVALFICAQILIGMGSTPIYTLGPTYLDDNVKKDNASLYLAIMYVMGALGPAAGYLLGGVLIGFYVDPKTVVNIDQNDPRFVGNWWSGFLLCSIAMLLVIFPMFAFPKKLPPRHKRKKKKKMSSLGDVSSDDDVKKEKSSSKDQNVSSSMGFGKDIKDLPKAALRILSNMTFLFVSLSYTAECAIVTAFITFIPKFIESQFGIPASKASIYTGLIIVPSAGVGIVLGGYIIKKLKLGARESAKLAMICSGVSLLCFSTLFIVGCESINLGGINIPYTTGPTLTMTHRNLTGSCNVNCGCRIHEYAPVCGSDGITYFNPCLAGCSTVGNDSTGTRNYTDCGCVQSRQVITPSSGGQVNQLQLVIVKTYLNENGYALSGKCDRTCNTLIPFLIFLFIVTLITACAQPSAIIVTLRSVDEQERPFALGMQFVLLRTLAYIPTPIYFGAVIDTTCMLWQQDCGVHGSCWEYDVTSFRFVYFGLAASLKFVGFVFIFLTWYSIKHKEAQAERWRQHLPPLGTVSELVCHAGGRKSHARTRSCPVFIPPRPDVPVAMLLDRGHSSLSCPGNGLKAIPPPVSLPHHHRGSAHV
					

Structure Viewer

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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	Very low	34.4	Very low	244 Å²	244	149.1 Å²	149.1	100%	1.202	82%	0.818	S	S	*	*				0	105.1	0	-81.6	174.9	164.5	0	0	107
2	D	30.2	Very low	34.1	Very low	152 Å²	152	145.9 Å²	145.9	81%	0.813	82%	0.815	S	S	*	*			trans	-77.1	175.5	159.9	-59.6	-77.1	0	0	0	109.6
3	P	61.5	Low	33.7	Very low	117 Å²	117	143.1 Å²	143.1	76%	0.76	81%	0.811	S	S	*	*			cis	-133	164.7	0.4	24.8	-0.8	0	0	0	117.2
4	L	35.1	Very low	33.2	Very low	153 Å²	153	141.9 Å²	141.9	80%	0.801	81%	0.814	S	S	*	*				-8.9	169.6	127.2	-77.2	161.3	0	0	0	119.5
5	P	59.6	Low	33	Very low	102 Å²	102	138.6 Å²	138.6	66%	0.662	81%	0.811	S	S	*	*			cis	-142.9	-173.4	-8.1	32.6	-9.2	0	0	0	117.2
6	R	28.1	Very low	32.6	Very low	221 Å²	221	141.7 Å²	141.7	83%	0.834	82%	0.818	S	S	*	*				114.4	138.6	122.4	-114.2	-177.7	-166.5	179.7	4.2	122.6
7	T	26.5	Very low	32.5	Very low	129 Å²	129	142.1 Å²	142.1	79%	0.791	82%	0.823	S	S	*	*			trans	84.2	158.3	148.1	28.5	0	0	0	0	122.8
8	Q	28.6	Very low	32.2	Very low	198 Å²	198	140.1 Å²	140.1	93%	0.925	82%	0.819	S	S	*	*			trans	-109.2	161.8	-164	-56.2	153.5	-54.5	0	0	112.1
9	G	24.5	Very low	32.1	Very low	70 Å²	70	137.6 Å²	137.6	72%	0.722	81%	0.81	S	S	*	*			trans	-178.8	111.8	169.2	0	0	0	0	0	119
10	L	24	Very low	32.1	Very low	162 Å²	162	137.4 Å²	137.4	85%	0.848	81%	0.805	S	S	*	*			trans	38.4	110.3	143.7	-80.1	74.1	0	0	0	124
11	S	27.1	Very low	32	Very low	92 Å²	92	138.8 Å²	138.8	64%	0.643	80%	0.803	S	S	*	*				41.2	131.7	118.9	62.9	0	0	0	0	125.4
12	S	30.8	Very low	31.8	Very low	111 Å²	111	133.4 Å²	133.4	78%	0.776	78%	0.779	S	S	*	*			trans	68.4	134.2	141.9	67.7	0	0	0	0	118.8
13	S	29.4	Very low	31.9	Very low	109 Å²	109	134.4 Å²	134.4	76%	0.762	78%	0.779	S	S	*	*			cis	-160.9	-178.5	32.2	-89	0	0	0	0	113.8
14	C	26.5	Very low	30.3	Very low	127 Å²	127	135.7 Å²	135.7	86%	0.858	79%	0.785	S	S	*	*			trans	92.6	110.5	154.2	-68.3	0	0	0	0	122.7
15	A	30.2	Very low	30	Very low	92 Å²	92	132 Å²	132	76%	0.76	78%	0.784	S	S	*	*				94.1	156.6	112.9	0	0	0	0	0	124
16	M	26.7	Very low	28.5	Very low	188 Å²	188	131.9 Å²	131.9	93%	0.926	79%	0.786	S	S	*	*			trans	77.7	131.5	158.7	-67.7	-179.4	175.3	0	0	122.7
17	T	31.6	Very low	28.6	Very low	149 Å²	149	128.4 Å²	128.4	91%	0.914	78%	0.784	S	S	*	*			trans	-154.8	140.7	150.8	49	0	0	0	0	110.2
18	S	27	Very low	28.6	Very low	105 Å²	105	129.7 Å²	129.7	73%	0.734	79%	0.785	S	S	*	*			trans	-126.2	152.5	174.3	59.4	0	0	0	0	110.5
19	S	30.3	Very low	28.5	Very low	93 Å²	93	126.2 Å²	126.2	65%	0.65	78%	0.782	S	S	*	*			cis	76.8	138.1	49.2	123.1	0	0	0	0	112.6
20	D	32.3	Very low	28.6	Very low	133 Å²	133	131.9 Å²	131.9	71%	0.711	79%	0.79	S	S	*	*			cis	-157.2	167.1	0.2	-82.5	-44.9	0	0	0	112.6
21	H	28.3	Very low	28.7	Very low	167 Å²	167	130.2 Å²	130.2	77%	0.773	79%	0.792	S	S	*	*				170	116.9	126.8	-94.3	-58	0	0	0	114.9
22	D	29.9	Very low	28.6	Very low	131 Å²	131	134 Å²	134	70%	0.701	80%	0.802	S	S	*	*				32.9	151.9	121.3	-47.5	-25.7	0	0	0	123.1
23	E	32.5	Very low	28.4	Very low	173 Å²	173	136 Å²	136	81%	0.808	80%	0.799	S	S	*	*			cis	-171	144.3	-31.3	-156.8	-162.3	175.9	0	0	108.7
24	T	26.7	Very low	28.3	Very low	144 Å²	144	138 Å²	138	88%	0.883	80%	0.799	S	S	*	*			trans	177.7	145.2	142.4	19.2	0	0	0	0	111.9
25	G	28.9	Very low	28.2	Very low	75 Å²	75	141.9 Å²	141.9	77%	0.773	80%	0.796	S	S	*	*			trans	-86.1	-169.3	-178.1	0	0	0	0	0	115.8
26	S	28.8	Very low	27.9	Very low	101 Å²	101	144 Å²	144	71%	0.706	79%	0.79	S	S	*	*			cis	-159.2	156.6	14.9	57.5	0	0	0	0	114.2
27	D	29.5	Very low	27.9	Very low	148 Å²	148	141.3 Å²	141.3	79%	0.791	78%	0.779	S	S	*	*			trans	49.9	146	148.3	-50.6	-25.1	0	0	0	121.1
28	L	26.7	Very low	27.4	Very low	155 Å²	155	142.5 Å²	142.5	81%	0.812	77%	0.774	S	S	*	*			cis	-160.5	136.2	24	-169.5	84.4	0	0	0	110.7
29	S	26.8	Very low	27.2	Very low	125 Å²	125	145.1 Å²	145.1	87%	0.874	78%	0.78	S	S	*	*			trans	-176.5	122.4	155.1	-83.6	0	0	0	0	112.9
30	E	27.8	Very low	26.8	Very low	190 Å²	190	148.3 Å²	148.3	89%	0.888	78%	0.784	S	S	*	*			trans	-103.7	136	172.7	-75.1	-175.1	92.8	0	0	112.9
31	S	25.2	Very low	26.3	Very low	126 Å²	126	151.4 Å²	151.4	88%	0.881	79%	0.787	S	S	*	*				161.2	151.5	112.8	49.4	0	0	0	0	111.1
32	M	24.3	Very low	26	Very low	173 Å²	173	149 Å²	149	85%	0.852	78%	0.784	S	S	*	*			trans	-130.5	169.1	-149.9	-143.3	179.3	-68.4	0	0	115.2
33	E	26.5	Very low	25.7	Very low	153 Å²	153	148 Å²	148	72%	0.715	79%	0.787	S	S	*	*			trans	-13.2	141	163.6	-70	-170.3	124.5	0	0	119.5
34	I	27.1	Very low	25.3	Very low	150 Å²	150	144 Å²	144	77%	0.769	78%	0.784	S	S	*	*				82.7	152.9	57.5	-70.2	172.3	0	0	0	113
35	R	24.4	Very low	25.1	Very low	209 Å²	209	145.1 Å²	145.1	79%	0.789	78%	0.779	S	S	*	*			trans	82.8	149.2	179	-81.6	-174.3	145.7	145.3	-0.9	118.4
36	E	25.8	Very low	24.9	Very low	135 Å²	135	149 Å²	149	63%	0.631	78%	0.782	S	S	*	*			cis	-158.4	166.3	-21.7	-138.3	167.2	-133.5	0	0	111.5
37	L	24.8	Very low	24.6	Very low	133 Å²	133	149.6 Å²	149.6	70%	0.696	79%	0.785	S	S	*	*			trans	30.7	111.1	156.4	-76.5	159.7	0	0	0	123.8
38	Q	22.9	Very low	24.3	Very low	174 Å²	174	151 Å²	151	81%	0.813	78%	0.784	S	S	*	*				57.3	120.1	116	-176.3	169.9	-29.6	0	0	123.2
39	D	22.6	Very low	24.2	Very low	160 Å²	160	151.2 Å²	151.2	86%	0.856	78%	0.779	S	S	*	*			trans	-157.1	-174.4	134.7	-143	-21.9	0	0	0	113.7
40	Q	21.7	Very low	24.1	Very low	160 Å²	160	151.1 Å²	151.1	75%	0.748	78%	0.778	S	S	*	*			trans	-113.6	161	-159.3	-99.7	-173.1	-25.8	0	0	118.8
41	Y	22.3	Very low	24.2	Very low	198 Å²	198	151 Å²	151	78%	0.776	77%	0.774	S	S	*	*			trans	88.9	132.5	147	-100.2	-128.7	0	0	0	124
42	V	22	Very low	24.3	Very low	117 Å²	117	150.4 Å²	150.4	71%	0.709	77%	0.771	S	S	*	*			trans	60.9	112	147.6	169.2	0	0	0	0	118.5
43	S	21.8	Very low	24.3	Very low	108 Å²	108	148.9 Å²	148.9	76%	0.755	77%	0.765	S	S	*	*				71.2	135.1	63.1	-169.1	0	0	0	0	113.7
44	A	24.5	Very low	25.1	Very low	89 Å²	89	147.1 Å²	147.1	74%	0.736	77%	0.767	S	S	*	*			cis	-125.1	-157.1	13.6	0	0	0	0	0	111
45	E	23.5	Very low	25.1	Very low	169 Å²	169	145.3 Å²	145.3	79%	0.79	76%	0.758	S	S	*	*			cis	-164.6	143.7	18.8	-176.2	176.4	-130	0	0	111.6
46	N	24.9	Very low	25.2	Very low	156 Å²	156	142.4 Å²	142.4	83%	0.834	76%	0.757	S	S	*	*			trans	167.6	146.4	136.8	-100.2	-77.8	0	0	0	112.6
47	C	22.1	Very low	25.3	Very low	114 Å²	114	142.6 Å²	142.6	77%	0.77	76%	0.762	S	S	*	*			trans	-154.7	134.2	-178.7	-176.1	0	0	0	0	115.2
48	F	23.6	Very low	25.4	Very low	177 Å²	177	139.5 Å²	139.5	78%	0.776	76%	0.762	S	S	*	*			trans	-163.3	146	163	-93.7	-39.2	0	0	0	108.8
49	K	24.2	Very low	25.9	Very low	160 Å²	160	136.8 Å²	136.8	70%	0.696	76%	0.76	S	S	*	*			cis	-168.8	131	-5.8	-163.3	172.5	-148.2	147	0	110.4
50	S	24.1	Very low	26	Very low	122 Å²	122	134.9 Å²	134.9	85%	0.853	76%	0.758	S	S	*	*			trans	-161.1	157.8	150.6	56.1	0	0	0	0	111.4
51	K	29.4	Very low	26.1	Very low	187 Å²	187	135.9 Å²	135.9	81%	0.813	76%	0.763	S	S	*	*			trans	-115.6	163.6	-177.8	-55.8	-177.9	176.7	-176.9	0	108.7
52	S	27.1	Very low	26.3	Very low	115 Å²	115	135.5 Å²	135.5	80%	0.804	77%	0.768	S	S	*	*			cis	-151.4	151.2	23.4	-49.2	0	0	0	0	114.1
53	L	26.1	Very low	26.4	Very low	140 Å²	140	133.4 Å²	133.4	73%	0.733	77%	0.769	S	S	*	*			trans	-76.5	179.1	162.6	-89.9	169.2	0	0	0	111.1	I55	L53-I55 HydrophobicContact CB-CD1 4.33Å; L53-I55 HydrophobicContact CB-CG1 4.38Å; L53-I55 HydrophobicContact CD1-CD1 4.36Å; L53-I55 HydrophobicContact CD1-CG1 4.4Å; L53-I55 HydrophobicContact CD2-CG1 4.29Å
54	P	41.3	Very low	26.7	Very low	117 Å²	117	135.4 Å²	135.4	76%	0.76	78%	0.777	S	S	*	*			cis	-134.3	143	45.7	15.8	12.4	0	0	0	118.5
55	I	28.7	Very low	26.6	Very low	112 Å²	112	134.1 Å²	134.1	57%	0.574	77%	0.772	S	S	*	*				81	147.4	74.5	-63.9	165.3	0	0	0	111.5	L53	L53-I55 HydrophobicContact CB-CD1 4.33Å; L53-I55 HydrophobicContact CB-CG1 4.38Å; L53-I55 HydrophobicContact CD1-CD1 4.36Å; L53-I55 HydrophobicContact CD1-CG1 4.4Å; L53-I55 HydrophobicContact CD2-CG1 4.29Å
56	L	26.5	Very low	27.4	Very low	147 Å²	147	131.8 Å²	131.8	77%	0.77	77%	0.772	S	S	*	*			cis	-110.4	146.3	13.3	-88.6	93.8	0	0	0	112.9
57	N	27.1	Very low	27.4	Very low	139 Å²	139	129.8 Å²	129.8	74%	0.743	77%	0.77	S	S	*	*				66	144.6	78	-46.8	-1.6	0	0	0	113.9
58	G	26.5	Very low	27.6	Very low	68 Å²	68	129 Å²	129	70%	0.701	77%	0.772	S	S	*	*			cis	-157.4	-173.6	12	0	0	0	0	0	113.9
59	P	33.2	Very low	27.7	Very low	117 Å²	117	129.7 Å²	129.7	76%	0.76	78%	0.777	S	S	*	*			trans	-135.3	-179.1	-133	44.8	-30.6	0	0	0	118.3
60	C	24.7	Very low	28.4	Very low	120 Å²	120	126.9 Å²	126.9	81%	0.811	78%	0.775	S	S	*	*			trans	74.7	161	160.9	-58.8	0	0	0	0	116.7
61	E	24.1	Very low	28.4	Very low	182 Å²	182	129.4 Å²	129.4	85%	0.85	77%	0.773	S	S	*	*			cis	-131.1	-173	15.6	-97.4	-158.1	109.4	0	0	115.7
62	H	26.2	Very low	28.1	Very low	190 Å²	190	129 Å²	129	88%	0.88	77%	0.774	S	S	*	*			trans	-76.5	163.2	-173.2	-71.8	-99.7	0	0	0	116.1
63	G	25.1	Very low	27.9	Very low	72 Å²	72	130.2 Å²	130.2	74%	0.742	78%	0.776	S	S	*	*			trans	174.2	93.1	158.9	0	0	0	0	0	117.6
64	V	27.4	Very low	27.8	Very low	151 Å²	151	126.6 Å²	126.6	92%	0.915	77%	0.773	S	S	*	*			trans	42.7	127.6	141.1	-176.3	0	0	0	0	120.9
65	G	22.6	Very low	27	Very low	62 Å²	62	127.1 Å²	127.1	64%	0.639	77%	0.774	S	S	*	*			trans	-103	-173.4	158.2	0	0	0	0	0	112.3
66	P	41.3	Very low	26.8	Very low	120 Å²	120	127.7 Å²	127.7	78%	0.779	78%	0.783	S	S	*	*			cis	-144.8	-178.4	26.8	43.3	-24.6	0	0	0	117.6
67	S	24.1	Very low	26.6	Very low	114 Å²	114	126.6 Å²	126.6	80%	0.797	79%	0.787	S	S	*	*			trans	74.7	162.2	148.4	74.4	0	0	0	0	121.7
68	A	25.6	Very low	26.4	Very low	98 Å²	98	125 Å²	125	81%	0.81	79%	0.787	S	S	*	*			trans	73.9	108.2	170.8	0	0	0	0	0	120.4
69	H	26	Very low	26.3	Very low	190 Å²	190	127.4 Å²	127.4	88%	0.88	79%	0.791	S	S	*	*			trans	-74.4	171.2	143.1	-85.8	-46.9	0	0	0	109.9
70	P	38.8	Very low	25.8	Very low	101 Å²	101	128.6 Å²	128.6	66%	0.656	80%	0.796	S	S	*	*			cis	-137.5	178.4	14	44.2	-27.9	0	0	0	116.6
71	Q	24.6	Very low	25.9	Very low	175 Å²	175	127.2 Å²	127.2	82%	0.818	79%	0.793	S	S	*	*			trans	63.9	160.9	163	-67.3	167.3	1.4	0	0	115.4
72	Q	22.5	Very low	25.9	Very low	180 Å²	180	123.5 Å²	123.5	84%	0.841	79%	0.793	S	S	*	*			cis	-144.1	-154.5	6.8	-147.3	176.5	5.3	0	0	111.5
73	V	23.2	Very low	25.9	Very low	139 Å²	139	123.1 Å²	123.1	84%	0.842	79%	0.792	S	S	*	*			trans	-90.3	116.3	-169.8	175.7	0	0	0	0	113.4
74	G	24.4	Very low	25.8	Very low	65 Å²	65	124.6 Å²	124.6	67%	0.67	78%	0.783	S	S	*	*				75.3	150.3	127.5	0	0	0	0	0	123.1
75	T	24.4	Very low	25.8	Very low	127 Å²	127	126.8 Å²	126.8	78%	0.779	78%	0.775	S	S	*	*			trans	112.2	128.6	137.3	-26	0	0	0	0	119.4
76	T	25.2	Very low	26	Very low	125 Å²	125	133.2 Å²	133.2	77%	0.767	78%	0.779	S	S	*	*			trans	65.1	115.8	153.4	32.2	0	0	0	0	123.2
77	C	22.2	Very low	25.3	Very low	124 Å²	124	131.7 Å²	131.7	84%	0.838	78%	0.777	S	S	*	*				-169.1	150.3	113.9	-102.6	0	0	0	0	109.3
78	S	23.1	Very low	25.2	Very low	106 Å²	106	133.8 Å²	133.8	74%	0.741	78%	0.779	S	S	*	*			cis	-163.3	170.4	-18.9	40.8	0	0	0	0	110.7
79	C	23.2	Very low	25.1	Very low	118 Å²	118	137.2 Å²	137.2	80%	0.797	78%	0.778	S	S	*	*			trans	-32.3	154.6	-177.6	-51.4	0	0	0	0	118.3
80	V	23.8	Very low	24.9	Very low	141 Å²	141	134.6 Å²	134.6	86%	0.855	77%	0.77	S	S	*	*				-172.3	159.5	71.3	147.6	0	0	0	0	110.3
81	A	25.6	Very low	24	Very low	91 Å²	91	137.9 Å²	137.9	75%	0.752	77%	0.774	S	S	*	*			cis	-174.5	144.2	-41.8	0	0	0	0	0	108.5
82	A	23.9	Very low	23.9	Very low	104 Å²	104	135.3 Å²	135.3	86%	0.86	77%	0.77	S	S	*	*			trans	-164.5	148.1	165.4	0	0	0	0	0	111.3
83	E	27.1	Very low	24.5	Very low	183 Å²	183	131.4 Å²	131.4	86%	0.855	76%	0.761	S	S	*	*			trans	-96.4	175.7	-175.3	-61.7	147.7	113.2	0	0	112.1
84	D	23.7	Very low	24.4	Very low	102 Å²	102	133.5 Å²	133.5	55%	0.545	76%	0.761	S	S	.	*			cis	-144.7	140.8	-4.6	-140.4	27.7	0	0	0	105.5
85	R	27.5	Very low	24.2	Very low	197 Å²	197	135 Å²	135	74%	0.743	76%	0.762	S	S	*	*				66.5	142.5	70.2	-127.9	-179.4	171.1	-178.9	3.2	111.5
86	R	26.2	Very low	24.1	Very low	197 Å²	197	133.8 Å²	133.8	74%	0.743	76%	0.758	S	S	*	*			cis	-151.6	-179.5	23.7	-72.9	169.7	-166.6	-166.1	1.7	108.3
87	A	25.8	Very low	23.9	Very low	89 Å²	89	137.1 Å²	137.1	74%	0.736	77%	0.765	S	S	*	*			cis	-171.5	140.6	-27.6	0	0	0	0	0	104.7
88	L	23.1	Very low	24	Very low	157 Å²	157	136.1 Å²	136.1	82%	0.822	77%	0.766	S	S	*	*			cis	83.2	101.8	48.7	-169.2	143.4	0	0	0	114.5
89	Q	22.9	Very low	24	Very low	170 Å²	170	140.1 Å²	140.1	79%	0.794	77%	0.773	S	S	*	*			trans	178.7	114.1	132.5	-94.1	-150.5	11	0	0	115.7
90	L	20.7	Very low	23.9	Very low	135 Å²	135	139.7 Å²	139.7	71%	0.707	77%	0.771	S	S	*	*				51.1	115.4	102.1	-153.4	67.8	0	0	0	124.2
91	K	21.5	Very low	24.6	Very low	170 Å²	170	138.2 Å²	138.2	74%	0.739	76%	0.764	S	S	*	*			trans	84.4	141.4	137.4	-89.8	-176.8	175	-175.3	0	125.8
92	T	22.4	Very low	24.5	Very low	121 Å²	121	139.1 Å²	139.1	74%	0.742	77%	0.765	S	S	*	*			trans	69.3	158.7	145.3	44.7	0	0	0	0	120.8
93	P	33.8	Very low	24.4	Very low	99 Å²	99	138.1 Å²	138.1	64%	0.643	75%	0.752	S	S	*	*			cis	-137.3	-171	-38.3	41.2	-24.7	0	0	0	113.5
94	E	21.3	Very low	24.3	Very low	183 Å²	183	140.3 Å²	140.3	86%	0.855	75%	0.752	S	S	*	*			trans	63.6	166.2	159.6	-70.5	177.4	149.4	0	0	118.3
95	S	20.4	Very low	24.3	Very low	97 Å²	97	140.4 Å²	140.4	68%	0.678	76%	0.757	S	S	*	*			cis	-161.2	-175.9	-37.5	66.5	0	0	0	0	109.1
96	S	21.8	Very low	24.2	Very low	100 Å²	100	137.5 Å²	137.5	70%	0.699	76%	0.756	S	S	*	*			trans	67.4	114.8	172.4	73.6	0	0	0	0	116.2
97	Q	22.1	Very low	24.1	Very low	195 Å²	195	138 Å²	138	91%	0.911	76%	0.764	S	S	*	*				76.6	111	83.5	-76.6	-176.4	-33.2	0	0	116.1
98	A	24.6	Very low	24	Very low	104 Å²	104	138.9 Å²	138.9	86%	0.86	77%	0.765	S	S	*	*			trans	-163.5	149.5	141.1	0	0	0	0	0	108.8
99	E	21.9	Very low	24.6	Very low	190 Å²	190	136.8 Å²	136.8	89%	0.888	76%	0.761	S	S	*	*			trans	-112.6	172.3	-173	-67.6	178.1	107	0	0	113.8
100	S	22.4	Very low	24.6	Very low	108 Å²	108	133.6 Å²	133.6	76%	0.755	76%	0.757	S	S	*	*			trans	-44.2	-176.1	169	-13	0	0	0	0	117.2
101	P	38.8	Very low	25	Very low	111 Å²	111	134.1 Å²	134.1	72%	0.721	76%	0.759	S	S	*	*			cis	-140.1	-169.3	-11.9	35.9	-14.9	0	0	0	115.4
102	S	22.8	Very low	25.2	Very low	109 Å²	109	131.2 Å²	131.2	76%	0.762	76%	0.76	S	S	*	*			trans	80.2	157.4	150.7	90.7	0	0	0	0	118.3
103	S	22.4	Very low	25.4	Very low	84 Å²	84	130.1 Å²	130.1	59%	0.587	76%	0.757	S	S	*	*			cis	-169.8	167.9	-21.4	44.6	0	0	0	0	111.9
104	W	23.4	Very low	25.1	Very low	228 Å²	228	133.1 Å²	133.1	86%	0.864	77%	0.765	S	S	*	*			trans	67.4	151.8	176.1	-48.2	84.9	0	0	0	115.7
105	T	25.5	Very low	25.3	Very low	105 Å²	105	130.4 Å²	130.4	64%	0.644	76%	0.76	S	S	*	*			cis	-152.8	156.4	3.3	-11.2	0	0	0	0	111.5
106	D	23.4	Very low	25.5	Very low	136 Å²	136	128.9 Å²	128.9	73%	0.727	76%	0.76	S	S	*	*			trans	26.8	139.8	149.4	-55.5	-17.1	0	0	0	123.8
107	F	25.1	Very low	25.7	Very low	206 Å²	206	131.8 Å²	131.8	90%	0.904	77%	0.767	S	S	*	*				-168.6	149.2	117.6	-103.7	-63.7	0	0	0	114.4
108	S	23.3	Very low	25.7	Very low	108 Å²	108	127.2 Å²	127.2	76%	0.755	76%	0.756	S	S	*	*			trans	-164.7	154.1	169.8	-83.7	0	0	0	0	106.9
109	P	35.3	Very low	25.7	Very low	114 Å²	114	127.9 Å²	127.9	74%	0.74	76%	0.755	S	S	*	*				-155.8	-174.9	54.9	44.2	-22.4	0	0	0	117.9
110	S	24.7	Very low	25.8	Very low	102 Å²	102	124.6 Å²	124.6	71%	0.713	75%	0.753	S	S	*	*			trans	38.6	157.9	134.8	-65.8	0	0	0	0	124.1
111	I	28.6	Very low	26.1	Very low	146 Å²	146	128 Å²	128	75%	0.749	76%	0.759	S	S	*	*			cis	-178.7	150.3	-31.4	-110.8	163.9	0	0	0	107.8
112	S	25.8	Very low	26.6	Very low	109 Å²	109	127.9 Å²	127.9	76%	0.762	76%	0.758	S	S	*	*			trans	64.9	170.8	164	-82.7	0	0	0	0	119.9
113	S	25.8	Very low	26.7	Very low	98 Å²	98	128.8 Å²	128.8	69%	0.685	76%	0.759	S	S	*	*			cis	-172.2	-176.5	-39.9	65.5	0	0	0	0	112.3
114	M	27.7	Very low	26.9	Very low	163 Å²	163	132 Å²	132	80%	0.803	77%	0.765	S	S	*	*			trans	86.4	123.3	157.8	-72	-175.9	70.2	0	0	125.2
115	V	25.8	Very low	27	Very low	125 Å²	125	124.9 Å²	124.9	76%	0.758	75%	0.754	S	S	*	*				57.7	110.5	124.9	-174.7	0	0	0	0	122.9
116	G	23.9	Very low	27	Very low	65 Å²	65	129.3 Å²	129.3	67%	0.67	77%	0.767	S	S	*	*				95.6	133.9	91.1	0	0	0	0	0	123.9
117	L	25.4	Very low	27.2	Very low	161 Å²	161	133.8 Å²	133.8	84%	0.843	77%	0.774	S	S	*	*			trans	76.6	110.6	148.2	-91.3	81.5	0	0	0	124.8
118	S	23.8	Very low	27.6	Very low	99 Å²	99	130.3 Å²	130.3	69%	0.692	77%	0.772	S	S	*	*				91.2	162.9	117.6	80.2	0	0	0	0	123.1
119	S	23.9	Very low	27.8	Very low	118 Å²	118	130.3 Å²	130.3	83%	0.825	78%	0.778	S	S	*	*			trans	70.8	148.9	-178.9	75.8	0	0	0	0	116.5
120	S	24.7	Very low	27.4	Very low	121 Å²	121	128.5 Å²	128.5	85%	0.846	78%	0.781	S	S	*	*			cis	-152.3	-168.1	-10.8	41.8	0	0	0	0	112
121	M	27.7	Very low	27.4	Very low	180 Å²	180	133.8 Å²	133.8	89%	0.887	79%	0.791	S	S	*	*			trans	-82.8	170	-166.3	-75.9	-144.4	83.1	0	0	116.6
122	P	49.8	Very low	27.4	Very low	108 Å²	108	138.9 Å²	138.9	70%	0.701	80%	0.801	S	S	*	*			trans	-106.2	-179	-170	42.5	-34.6	0	0	0	114.2
123	V	25.5	Very low	27.5	Very low	129 Å²	129	137.5 Å²	137.5	78%	0.782	80%	0.803	S	S	*	*			trans	-163.7	164.7	157.7	126.6	0	0	0	0	111.5
124	E	25.5	Very low	27.8	Very low	152 Å²	152	144.8 Å²	144.8	71%	0.71	82%	0.816	S	S	*	*			trans	2.5	130.3	174.6	-82.1	37.1	-97	0	0	120.2
125	A	26.2	Very low	27.7	Very low	77 Å²	77	147.3 Å²	147.3	64%	0.636	82%	0.822	S	S	*	*			cis	80.4	113.9	36.8	0	0	0	0	0	116.2
126	H	25.4	Very low	28	Very low	198 Å²	198	148.4 Å²	148.4	92%	0.917	82%	0.823	S	S	*	*			trans	-162.7	159.8	145.2	-106.8	-73.2	0	0	0	111.9
127	R	26.6	Very low	28.2	Very low	231 Å²	231	148.9 Å²	148.9	87%	0.872	83%	0.828	S	S	*	*			trans	-145.5	150.5	176.9	-107.1	-177.2	179.7	-177.7	1	107.3
128	P	34	Very low	28.5	Very low	133 Å²	133	149.7 Å²	149.7	86%	0.864	83%	0.825	S	S	*	*				-148.8	-169.3	90.5	39.6	-20.4	0	0	0	116.1
129	A	27.4	Very low	28.6	Very low	107 Å²	107	149 Å²	149	88%	0.884	82%	0.821	S	S	*	*			trans	-66.6	157.1	-161.8	0	0	0	0	0	119.1
130	G	26.3	Very low	29	Very low	77 Å²	77	151.6 Å²	151.6	79%	0.794	82%	0.824	S	S	*	*			trans	-169.9	134.2	160.9	0	0	0	0	0	109.8
131	F	26.4	Very low	29.4	Very low	213 Å²	213	149.8 Å²	149.8	93%	0.934	81%	0.812	S	S	*	*			trans	-138.6	104	-164.4	-164.5	-80.1	0	0	0	113.7
132	R	27.6	Very low	29.7	Very low	253 Å²	253	150.6 Å²	150.6	96%	0.955	81%	0.805	S	S	*	*			trans	-167.3	150.4	161.8	-121.2	177.1	-177	-173.5	1.1	113.3
133	G	27.6	Very low	28.9	Very low	79 Å²	79	155 Å²	155	81%	0.814	81%	0.813	S	S	*	*			trans	86	111.9	152.8	0	0	0	0	0	117.9
134	R	31.6	Very low	29.5	Very low	251 Å²	251	156.4 Å²	156.4	95%	0.947	82%	0.815	S	S	*	*			trans	-77	143.6	163.1	-75	170.7	163.7	164.4	-7.8	110.8
135	K	27.1	Very low	30.2	Very low	216 Å²	216	155.3 Å²	155.3	94%	0.939	81%	0.81	S	S	*	*				-151	169	125.7	-112.9	171.9	-174.9	-178.8	0	110.5
136	L	32.7	Very low	31.2	Very low	149 Å²	149	156.8 Å²	156.8	78%	0.78	81%	0.806	S	S	*	*			trans	-110	121.7	-149.8	-173.4	70.5	0	0	0	112.6	F138	L136-F138 HydrophobicContact CD2-CD2 4.04Å; L136-F138 HydrophobicContact CD2-CE2 4.15Å; L136-F138 HydrophobicContact CG-CD2 4.28Å
137	G	27.3	Very low	32.3	Very low	75 Å²	75	151.7 Å²	151.7	77%	0.773	79%	0.79	S	S	*	*			trans	-111.8	110.2	168.6	0	0	0	0	0	110.9
138	F	31.2	Very low	33.5	Very low	177 Å²	177	143.3 Å²	143.3	78%	0.776	77%	0.77	S	S	*	*			trans	-77.2	129.3	178	-118.2	-104.2	0	0	0	110.5	L136	L136-F138 HydrophobicContact CD2-CD2 4.04Å; L136-F138 HydrophobicContact CD2-CE2 4.15Å; L136-F138 HydrophobicContact CG-CD2 4.28Å
139	S	26	Very low	34.6	Very low	86 Å²	86	145 Å²	145	60%	0.601	76%	0.76	S	S	*	*			trans	-131.3	109	166.8	-174.5	0	0	0	0	109.5	S141	S139-S141 PolarHBondContact O-N 3.28Å; S139-S141 PolarHBondContact OG-OG 2.69Å
140	L	31.5	Very low	36	Very low	172 Å²	172	147.3 Å²	147.3	90%	0.901	75%	0.75	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.6	36.7	-171.9	-158.5	74.3	0	0	0	113.2
141	S	33.3	Very low	37.5	Very low	83 Å²	83	147.2 Å²	147.2	58%	0.58	74%	0.736	S	S	*	*	T	Hydrogen-bonded Turn	trans	-120.8	-9.4	-165	60.5	0	0	0	0	115	S139	S139-S141 PolarHBondContact O-N 3.28Å; S139-S141 PolarHBondContact OG-OG 2.69Å
142	R	33.8	Very low	39.1	Very low	196 Å²	196	140.6 Å²	140.6	74%	0.74	71%	0.713	S	S	*	*	S	Bend	trans	-120.1	-0.7	-162.8	-139.2	177.7	-71.5	-162	-0.1	117.8
143	F	33.2	Very low	40.8	Very low	200 Å²	200	138 Å²	138	88%	0.877	70%	0.703	S	S	*	*	S	Bend	trans	-100.7	-16.8	-173.8	-92.9	-80.4	0	0	0	117.2
144	I	38.1	Very low	42.3	Very low	160 Å²	160	138.6 Å²	138.6	82%	0.821	69%	0.691	S	S	*	*	S	Bend	trans	-89	-30.4	-175.7	-64.3	176.2	0	0	0	113.1	I146	I144-I146 PolarHBondContact O-N 3.45Å
145	Q	41.4	Very low	43.9	Very low	129 Å²	129	130.9 Å²	130.9	60%	0.603	67%	0.667	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86	-2.8	-159.6	-118.8	-168.7	36.9	0	0	117.7	R149	Q145-R149 VanDerWaalsContact OE1-NH2 3.11Å
146	I	47.1	Very low	45.8	Very low	108 Å²	108	121.2 Å²	121.2	55%	0.554	63%	0.626	S	S	*	*	T	Hydrogen-bonded Turn	trans	-106.2	-36.2	-167.5	-60.7	-179.5	0	0	0	115.1	I144	I144-I146 PolarHBondContact O-N 3.45Å
147	P	47.7	Very low	47.4	Very low	90 Å²	90	116.5 Å²	116.5	58%	0.584	60%	0.603	S	S	*	*	H	α-helix	trans	-64.6	-45	175.5	-21.1	33.2	0	0	0	112.3	R149 K150 C151	P147-R149 PolarHBondContact O-N 3.48Å; P147-K150 PolarHBondContact O-N 3.37Å; P147-K150 VanDerWaalsContact O-N 3.11Å; P147-C151 PolarHBondContact O-N 3.18Å; P147-C151 VanDerWaalsContact O-N 3.1Å
148	A	51.9	Low	49.9	Very low	55 Å²	55	115 Å²	115	46%	0.455	58%	0.577	S	S	.	*	H	α-helix	trans	-55.7	-47.8	-175.9	0	0	0	0	0	112.5	K150 C151 V152	A148-K150 PolarHBondContact O-N 3.48Å; A148-C151 PolarHBondContact O-N 3.04Å; A148-C151 VanDerWaalsContact O-N 3.12Å; A148-V152 VanDerWaalsContact O-CB 3.32Å; A148-V152 WeakPolarHBondContact O-CB 3.37Å; A148-V152 VanDerWaalsContact O-CG2 3.31Å; A148-V152 WeakPolarHBondContact O-CG2 3.41Å; A148-V152 PolarHBondContact O-N 3.17Å
149	R	58.4	Low	52.3	Low	170 Å²	170	107.6 Å²	107.6	64%	0.642	55%	0.548	S	S	*	.	H	α-helix	trans	-60.8	-29.3	-179.1	-65	-174.9	-175.7	-168	4	113.3	Q145 P147 R153	Q145-R149 VanDerWaalsContact OE1-NH2 3.11Å; P147-R149 PolarHBondContact O-N 3.48Å; R149-R153 VanDerWaalsContact O-CB 3.28Å; R149-R153 WeakPolarHBondContact O-CB 3.5Å; R149-R153 PolarHBondContact O-N 3.27Å
150	K	56.8	Low	55.2	Low	155 Å²	155	110.9 Å²	110.9	67%	0.674	55%	0.547	S	S	*	.	H	α-helix	trans	-78.4	-43.1	174.2	-73	178.4	179.6	172.7	0	111.7	P147 A148 V154	P147-K150 PolarHBondContact O-N 3.37Å; P147-K150 VanDerWaalsContact O-N 3.11Å; A148-K150 PolarHBondContact O-N 3.48Å; K150-V154 WeakPolarHBondContact O-CG2 3.49Å; K150-V154 PolarHBondContact O-N 3.32Å
151	C	55.8	Low	57.8	Low	75 Å²	75	104.1 Å²	104.1	51%	0.507	51%	0.514	S	S	.	.	H	α-helix	trans	-65.8	-49.2	178.8	-161.5	0	0	0	0	111.7	P147 A148 R153 V154 I155	P147-C151 PolarHBondContact O-N 3.18Å; P147-C151 VanDerWaalsContact O-N 3.1Å; A148-C151 PolarHBondContact O-N 3.04Å; A148-C151 VanDerWaalsContact O-N 3.12Å; C151-R153 PolarHBondContact O-N 2.97Å; C151-V154 WeakPolarHBondContact O-CA 3.29Å; C151-V154 WeakPolarHBondContact O-CB 3.44Å; C151-V154 PolarHBondContact O-N 3.33Å; C151-I155 WeakPolarHBondContact O-CG1 3.38Å; C151-I155 PolarHBondContact O-N 2.8Å
152	V	61.8	Low	60.4	Low	73 Å²	73	100.2 Å²	100.2	44%	0.442	49%	0.486	S	S	.	.	H	α-helix	trans	-56.6	-45.4	175.3	170.3	0	0	0	0	111.3	A148 V154 I155 L156	A148-V152 VanDerWaalsContact O-CB 3.32Å; A148-V152 WeakPolarHBondContact O-CB 3.37Å; A148-V152 VanDerWaalsContact O-CG2 3.31Å; A148-V152 WeakPolarHBondContact O-CG2 3.41Å; A148-V152 PolarHBondContact O-N 3.17Å; V152-V154 PolarHBondContact O-N 3.44Å; V152-I155 PolarHBondContact O-N 3.46Å; V152-L156 HydrophobicContact CG1-CD1 3.5Å; V152-L156 HydrophobicContact CG1-CG 4.1Å; V152-L156 WeakPolarHBondContact O-CB 3.47Å; V152-L156 WeakPolarHBondContact O-CG 3.32Å; V152-L156 PolarHBondContact O-N 3.09Å
153	R	61.6	Low	63.1	Low	198 Å²	198	91.8 Å²	91.8	75%	0.747	46%	0.456	S	S	*	.	H	α-helix	trans	-63.8	-24.4	175.3	-179.9	175.6	-83.2	-170.4	-3.9	113.5	R149 C151 T157	R149-R153 VanDerWaalsContact O-CB 3.28Å; R149-R153 WeakPolarHBondContact O-CB 3.5Å; R149-R153 PolarHBondContact O-N 3.27Å; C151-R153 PolarHBondContact O-N 2.97Å; R153-T157 WeakPolarHBondContact O-CG2 3.44Å; R153-T157 PolarHBondContact O-OG1 3.33Å
154	V	60.4	Low	65.9	Low	93 Å²	93	88.8 Å²	88.8	56%	0.564	44%	0.443	S	S	*	.	H	α-helix	trans	-78.2	-45.5	172.7	169.4	0	0	0	0	110.7	K150 C151 V152 L156 T157	K150-V154 WeakPolarHBondContact O-CG2 3.49Å; K150-V154 PolarHBondContact O-N 3.32Å; C151-V154 WeakPolarHBondContact O-CA 3.29Å; C151-V154 WeakPolarHBondContact O-CB 3.44Å; C151-V154 PolarHBondContact O-N 3.33Å; V152-V154 PolarHBondContact O-N 3.44Å; V154-L156 PolarHBondContact O-N 2.94Å; V154-T157 PolarHBondContact O-N 3.37Å; V154-T157 PolarHBondContact O-OG1 2.95Å
155	I	64.3	Low	68.4	Low	88 Å²	88	81.5 Å²	81.5	45%	0.451	41%	0.406	S	S	.	.	H	α-helix	trans	-60.5	-46.6	178.4	-65.3	162.8	0	0	0	111	C151 V152 T157 D158 C161	C151-I155 WeakPolarHBondContact O-CG1 3.38Å; C151-I155 PolarHBondContact O-N 2.8Å; V152-I155 PolarHBondContact O-N 3.46Å; I155-T157 PolarHBondContact O-N 2.93Å; I155-D158 PolarHBondContact O-N 3.5Å; I155-D158 VanDerWaalsContact O-N 3.09Å; I155-C161 HydrophobicContact CG2-CB 4.13Å; I155-C161 VanDerWaalsContact CG2-SG 3.6Å; I155-C161 WeakPolarHBondContact O-CB 3.24Å
156	L	67.1	Low	70.8	Confident	13 Å²	13	75.4 Å²	75.4	7%	0.068	38%	0.377	C	S	.	.	T	Hydrogen-bonded Turn	trans	-67.5	4.6	174.2	-61.4	170.4	0	0	0	114.4	V152 V154 P397 A400 F401	V152-L156 HydrophobicContact CG1-CD1 3.5Å; V152-L156 HydrophobicContact CG1-CG 4.1Å; V152-L156 WeakPolarHBondContact O-CB 3.47Å; V152-L156 WeakPolarHBondContact O-CG 3.32Å; V152-L156 PolarHBondContact O-N 3.09Å; V154-L156 PolarHBondContact O-N 2.94Å; L156-P397 HydrophobicContact CD2-CB 4.41Å; L156-A400 HydrophobicContact CD1-CB 3.44Å; L156-A400 VanDerWaalsContact CD1-CB 3.44Å; L156-F401 HydrophobicContact CB-CD1 4.42Å; L156-F401 HydrophobicContact CB-CE1 4.33Å; L156-F401 HydrophobicContact CD2-CD2 3.71Å; L156-F401 HydrophobicContact CD2-CE1 4.21Å; L156-F401 HydrophobicContact CD2-CE2 3.31Å; L156-F401 HydrophobicContact CD2-CG 4.33Å; L156-F401 HydrophobicContact CD2-CZ 3.61Å; L156-F401 VanDerWaalsContact O-CD1 3.28Å; L156-F401 WeakPolarHBondContact O-CD1 3.39Å; L156-F401 WeakPolarHBondContact O-CE1 3.37Å
157	T	66.3	Low	73	Confident	51 Å²	51	70.9 Å²	70.9	31%	0.313	36%	0.355	S	S	.	.	T	Hydrogen-bonded Turn	trans	-110	1	170.4	55.4	0	0	0	0	114.6	R153 V154 I155 P406	R153-T157 WeakPolarHBondContact O-CG2 3.44Å; R153-T157 PolarHBondContact O-OG1 3.33Å; V154-T157 PolarHBondContact O-N 3.37Å; V154-T157 PolarHBondContact O-OG1 2.95Å; I155-T157 PolarHBondContact O-N 2.93Å; T157-P406 HydrophobicContact CG2-CG 3.94Å
158	D	79.8	Confident	75.3	Confident	42 Å²	42	70 Å²	70	23%	0.225	34%	0.34	C	S	.	.	S	Bend	trans	-94.2	131.8	167.8	-156.1	-5.5	0	0	0	111.2	I155 R160 C161 F162 R408	I155-D158 PolarHBondContact O-N 3.5Å; I155-D158 VanDerWaalsContact O-N 3.09Å; D158-R160 PolarHBondContact O-N 2.92Å; D158-C161 WeakPolarHBondContact O-CB 3.48Å; D158-C161 PolarHBondContact O-N 3.13Å; D158-F162 PolarHBondContact O-N 3.04Å; D158-R408 IonicContact OD1-NH1 2.7Å; D158-R408 PolarHBondContact OD1-NH1 3.25Å; D158-R408 IonicContact OD2-NH1 2.78Å; D158-R408 PolarHBondContact OD2-NH1 3.4Å
159	S	81.3	Confident	77.3	Confident	22 Å²	22	67.4 Å²	67.4	15%	0.154	32%	0.319	C	S	.	.	H	α-helix	trans	-65.4	-20.2	178.3	55.6	0	0	0	0	112.5	F162 L163	S159-F162 PolarHBondContact O-N 3.08Å; S159-L163 WeakPolarHBondContact O-CB 3.33Å; S159-L163 PolarHBondContact O-N 3.42Å
160	R	86.9	Confident	78.9	Confident	156 Å²	156	59.4 Å²	59.4	59%	0.589	29%	0.289	S	S	*	.	H	α-helix	trans	-63.6	-38.1	170.4	-64.9	177.4	173.2	-166.8	-5.1	113.1	D158 L163 F164	D158-R160 PolarHBondContact O-N 2.92Å; R160-L163 PolarHBondContact O-N 3.38Å; R160-F164 PolarHBondContact O-N 3.17Å
161	C	86.9	Confident	80.8	Confident	29 Å²	29	54.2 Å²	54.2	20%	0.196	27%	0.267	C	S	.	.	H	α-helix	trans	-70.3	-40.2	176.5	179.8	0	0	0	0	110.6	I155 D158 F164 C165 F401	I155-C161 HydrophobicContact CG2-CB 4.13Å; I155-C161 VanDerWaalsContact CG2-SG 3.6Å; I155-C161 WeakPolarHBondContact O-CB 3.24Å; D158-C161 WeakPolarHBondContact O-CB 3.48Å; D158-C161 PolarHBondContact O-N 3.13Å; C161-F164 PolarHBondContact O-N 3.28Å; C161-C165 PolarHBondContact O-N 3.32Å; C161-C165 PolarHBondContact O-SG 3Å; C161-F401 HydrophobicContact CB-CZ 4.4Å
162	F	87.7	Confident	82.7	Confident	1 Å²	1	51.3 Å²	51.3	0%	0.004	25%	0.246	C	C	.	.	H	α-helix	trans	-62.7	-43.9	172.8	-174.9	-95.1	0	0	0	112.1	D158 S159 F164 C165 M166 L230 Y321 L322 M398 F401	D158-F162 PolarHBondContact O-N 3.04Å; S159-F162 PolarHBondContact O-N 3.08Å; F162-F164 PolarHBondContact O-N 3.38Å; F162-C165 PolarHBondContact O-N 3.45Å; F162-M166 HydrophobicContact CD1-CG 3.93Å; F162-M166 HydrophobicContact CE1-CG 3.29Å; F162-M166 HydrophobicContact CE1-SD 4.1Å; F162-M166 HydrophobicContact CE2-CG 4.25Å; F162-M166 HydrophobicContact CE2-SD 4.46Å; F162-M166 HydrophobicContact CZ-CG 3.47Å; F162-M166 VanDerWaalsContact CZ-CG 3.47Å; F162-M166 HydrophobicContact CZ-SD 3.71Å; F162-M166 PolarHBondContact O-N 2.89Å; F162-L230 HydrophobicContact CE2-CD1 4.24Å; F162-L230 HydrophobicContact CZ-CD1 3.84Å; F162-Y321 AromaticContact CD1-CD1 3.9Å; F162-Y321 HydrophobicContact CD1-CD1 3.9Å; F162-Y321 HydrophobicContact CD1-CE1 4.14Å; F162-Y321 HydrophobicContact CD2-CD1 4.16Å; F162-Y321 AromaticContact CD2-CE1 3.88Å; F162-Y321 HydrophobicContact CD2-CE1 3.88Å; F162-Y321 AromaticContact CE1-CD1 3.45Å; F162-Y321 HydrophobicContact CE1-CD1 3.45Å; F162-Y321 VanDerWaalsContact CE1-CD1 3.45Å; F162-Y321 HydrophobicContact CE1-CE1 4.09Å; F162-Y321 HydrophobicContact CE1-CG 4.45Å; F162-Y321 AromaticContact CE2-CD1 3.72Å; F162-Y321 HydrophobicContact CE2-CD1 3.72Å; F162-Y321 AromaticContact CE2-CE1 3.82Å; F162-Y321 HydrophobicContact CE2-CE1 3.82Å; F162-Y321 HydrophobicContact CG-CD1 4.25Å; F162-Y321 HydrophobicContact CG-CE1 4.05Å; F162-Y321 AromaticContact CZ-CD1 3.35Å; F162-Y321 HydrophobicContact CZ-CD1 3.35Å; F162-Y321 AromaticContact CZ-CE1 3.94Å; F162-Y321 HydrophobicContact CZ-CE1 3.94Å; F162-Y321 HydrophobicContact CZ-CG 4.2Å; F162-L322 HydrophobicContact CD1-CD1 3.91Å; F162-L322 HydrophobicContact CE1-CB 4.41Å; F162-L322 HydrophobicContact CE1-CD1 4.3Å; F162-M398 HydrophobicContact CD2-CE 3.61Å; F162-M398 HydrophobicContact CE2-CE 3.69Å; F162-M398 HydrophobicContact CE2-SD 4.26Å; F162-F401 HydrophobicContact CB-CD1 4.36Å; F162-F401 HydrophobicContact CB-CE1 3.7Å; F162-F401 HydrophobicContact CB-CZ 4Å; F162-F401 HydrophobicContact CD2-CD1 4.07Å; F162-F401 HydrophobicContact CD2-CD2 4.43Å; F162-F401 HydrophobicContact CD2-CE1 4.08Å; F162-F401 HydrophobicContact CD2-CE2 4.42Å; F162-F401 HydrophobicContact CD2-CG 4.25Å; F162-F401 HydrophobicContact CD2-CZ 4.25Å; F162-F401 HydrophobicContact CG-CE1 4.39Å
163	L	90.2	Very high	84.3	Confident	19 Å²	19	48 Å²	48	10%	0.099	23%	0.226	C	C	.	.	H	α-helix	trans	-56.2	-49.3	173.7	176.3	66	0	0	0	111.3	S159 R160 C165 M166 C167 L322 Y334 M338	S159-L163 WeakPolarHBondContact O-CB 3.33Å; S159-L163 PolarHBondContact O-N 3.42Å; R160-L163 PolarHBondContact O-N 3.38Å; L163-C165 VanDerWaalsContact C-N 3.35Å; L163-C165 PolarHBondContact O-N 2.97Å; L163-M166 PolarHBondContact O-N 3.36Å; L163-C167 WeakPolarHBondContact O-CB 3.45Å; L163-C167 PolarHBondContact O-N 3.4Å; L163-C167 PolarHBondContact O-SG 3.19Å; L163-L322 HydrophobicContact CB-CD1 4.25Å; L163-L322 HydrophobicContact CD1-CD1 4.24Å; L163-L322 HydrophobicContact CD1-CD2 4.01Å; L163-Y334 HydrophobicContact CB-CD2 4.29Å; L163-Y334 WeakPolarHBondContact CD1-O 3.09Å; L163-Y334 HydrophobicContact CD2-CD1 4.22Å; L163-Y334 HydrophobicContact CD2-CD2 3.78Å; L163-Y334 HydrophobicContact CD2-CE1 4.42Å; L163-Y334 HydrophobicContact CD2-CE2 4.02Å; L163-Y334 HydrophobicContact CD2-CG 3.89Å; L163-Y334 HydrophobicContact CG-CD2 4.42Å; L163-M338 HydrophobicContact CD1-CB 4.45Å
164	F	91.8	Very high	85.9	Confident	138 Å²	138	39 Å²	39	61%	0.605	19%	0.193	S	C	*	.	H	α-helix	trans	-57.6	-45.9	178.2	177.8	-94.6	0	0	0	112.2	R160 C161 F162 C167 Y168	R160-F164 PolarHBondContact O-N 3.17Å; C161-F164 PolarHBondContact O-N 3.28Å; F162-F164 PolarHBondContact O-N 3.38Å; F164-C167 PolarHBondContact O-N 2.89Å; F164-Y168 WeakPolarHBondContact O-CB 3.4Å; F164-Y168 PolarHBondContact O-N 3.1Å
165	C	91.6	Very high	87.6	Confident	7 Å²	7	35.1 Å²	35.1	5%	0.047	17%	0.169	C	C	.	.	H	α-helix	trans	-62.2	-44.2	176.6	-61.4	0	0	0	0	111.8	C161 F162 L163 Y168 L169 V394 M398	C161-C165 PolarHBondContact O-N 3.32Å; C161-C165 PolarHBondContact O-SG 3Å; F162-C165 PolarHBondContact O-N 3.45Å; L163-C165 VanDerWaalsContact C-N 3.35Å; L163-C165 PolarHBondContact O-N 2.97Å; C165-Y168 PolarHBondContact O-N 3.43Å; C165-L169 VanDerWaalsContact O-CG 3.29Å; C165-L169 WeakPolarHBondContact O-CG 3.44Å; C165-L169 PolarHBondContact O-N 3.5Å; C165-V394 HydrophobicContact CB-CG1 3.82Å; C165-M398 HydrophobicContact CB-CE 3.4Å; C165-M398 VanDerWaalsContact CB-CE 3.4Å; C165-M398 HydrophobicContact CB-SD 4Å
166	M	91.3	Very high	89.1	Confident	0 Å²	0	31 Å²	31	0%	0	15%	0.148	C	C	.	.	H	α-helix	trans	-62.4	-46.3	176.8	-78.5	-57.6	-46.7	0	0	112.4	F162 L163 Y168 L169 T170 L230 I314 M338	F162-M166 HydrophobicContact CD1-CG 3.93Å; F162-M166 HydrophobicContact CE1-CG 3.29Å; F162-M166 HydrophobicContact CE1-SD 4.1Å; F162-M166 HydrophobicContact CE2-CG 4.25Å; F162-M166 HydrophobicContact CE2-SD 4.46Å; F162-M166 HydrophobicContact CZ-CG 3.47Å; F162-M166 VanDerWaalsContact CZ-CG 3.47Å; F162-M166 HydrophobicContact CZ-SD 3.71Å; F162-M166 PolarHBondContact O-N 2.89Å; L163-M166 PolarHBondContact O-N 3.36Å; M166-Y168 VanDerWaalsContact C-N 3.28Å; M166-Y168 PolarHBondContact O-N 3.23Å; M166-L169 PolarHBondContact O-N 3.44Å; M166-T170 HydrophobicContact CE-CG2 4.49Å; M166-T170 PolarHBondContact O-N 2.78Å; M166-T170 PolarHBondContact O-OG1 3.35Å; M166-L230 HydrophobicContact CE-CD2 4.26Å; M166-L230 HydrophobicContact SD-CD1 3.91Å; M166-L230 HydrophobicContact SD-CD2 3.98Å; M166-I314 HydrophobicContact CE-CG2 3.7Å; M166-M338 HydrophobicContact CB-SD 4.25Å; M166-M338 HydrophobicContact CE-SD 4Å
167	C	94.1	Very high	90.4	Very high	13 Å²	13	30.9 Å²	30.9	9%	0.088	15%	0.148	C	C	.	.	H	α-helix	trans	-59.7	-37.8	176.4	-73	0	0	0	0	112.6	L163 F164 T170 F171 M341	L163-C167 WeakPolarHBondContact O-CB 3.45Å; L163-C167 PolarHBondContact O-N 3.4Å; L163-C167 PolarHBondContact O-SG 3.19Å; F164-C167 PolarHBondContact O-N 2.89Å; C167-T170 PolarHBondContact O-OG1 3.2Å; C167-F171 WeakPolarHBondContact O-CB 3.5Å; C167-F171 PolarHBondContact O-N 3.12Å; C167-M341 HydrophobicContact CB-CB 4.2Å; C167-M341 HydrophobicContact CB-CG 3.94Å
168	Y	94.5	Very high	91.5	Very high	71 Å²	71	30.2 Å²	30.2	28%	0.278	15%	0.145	S	C	.	.	H	α-helix	trans	-69.8	-44.1	176.3	-169.5	-83.8	0	0	0	111.4	F164 C165 M166 F171 I172 A390 V394	F164-Y168 WeakPolarHBondContact O-CB 3.4Å; F164-Y168 PolarHBondContact O-N 3.1Å; C165-Y168 PolarHBondContact O-N 3.43Å; M166-Y168 VanDerWaalsContact C-N 3.28Å; M166-Y168 PolarHBondContact O-N 3.23Å; Y168-F171 PolarHBondContact O-N 3.01Å; Y168-I172 HydrophobicContact CD1-CG1 3.83Å; Y168-I172 HydrophobicContact CE1-CD1 4.28Å; Y168-I172 HydrophobicContact CE1-CG1 3.53Å; Y168-I172 HydrophobicContact CG-CG1 4.49Å; Y168-I172 WeakPolarHBondContact O-CG1 3.41Å; Y168-I172 PolarHBondContact O-N 3.14Å; Y168-A390 HydrophobicContact CE1-CB 4.32Å; Y168-A390 WeakPolarHBondContact CE1-O 3.47Å; Y168-A390 WeakPolarHBondContact OH-CB 3.46Å; Y168-V394 HydrophobicContact CD1-CB 4.12Å; Y168-V394 HydrophobicContact CD1-CG2 3.39Å; Y168-V394 HydrophobicContact CE1-CB 4.5Å; Y168-V394 HydrophobicContact CE1-CG2 3.62Å; Y168-V394 HydrophobicContact CG-CG2 3.96Å
169	L	93.4	Very high	92.2	Very high	1 Å²	1	28.2 Å²	28.2	1%	0.005	14%	0.135	C	C	.	.	H	α-helix	trans	-63.3	-42.7	176.9	-69	171.4	0	0	0	112.3	C165 M166 Q173 I314 M391 V394 M398	C165-L169 VanDerWaalsContact O-CG 3.29Å; C165-L169 WeakPolarHBondContact O-CG 3.44Å; C165-L169 PolarHBondContact O-N 3.5Å; M166-L169 PolarHBondContact O-N 3.44Å; L169-Q173 WeakPolarHBondContact O-CB 3.35Å; L169-Q173 PolarHBondContact O-N 3.45Å; L169-Q173 VanDerWaalsContact O-N 3.12Å; L169-I314 HydrophobicContact CB-CD1 4.35Å; L169-M391 HydrophobicContact CD2-CE 3.65Å; L169-M391 HydrophobicContact CD2-SD 3.7Å; L169-V394 HydrophobicContact CD1-CG1 4.35Å; L169-V394 HydrophobicContact CD2-CB 4.33Å; L169-V394 HydrophobicContact CD2-CG1 4.11Å; L169-V394 HydrophobicContact CG-CG1 3.96Å; L169-M398 HydrophobicContact CD1-CG 4.01Å; L169-M398 HydrophobicContact CD1-SD 3.74Å
170	T	94.1	Very high	92.9	Very high	2 Å²	2	27.2 Å²	27.2	1%	0.012	13%	0.127	C	C	.	.	H	α-helix	trans	-68.4	-36.2	175.1	54.5	0	0	0	0	112.3	M166 C167 S174 I314 Y315 M338	M166-T170 HydrophobicContact CE-CG2 4.49Å; M166-T170 PolarHBondContact O-N 2.78Å; M166-T170 PolarHBondContact O-OG1 3.35Å; C167-T170 PolarHBondContact O-OG1 3.2Å; T170-S174 WeakPolarHBondContact O-CB 3.49Å; T170-S174 PolarHBondContact O-N 2.88Å; T170-S174 VanDerWaalsContact O-N 3.12Å; T170-I314 HydrophobicContact CG2-CG2 3.51Å; T170-Y315 HydrophobicContact CG2-CE1 4.46Å; T170-M338 HydrophobicContact CG2-CG 4.01Å; T170-M338 PolarHBondContact OG1-O 3.01Å
171	F	96.1	Very high	93.3	Very high	46 Å²	46	20 Å²	20	20%	0.202	10%	0.1	C	C	.	.	H	α-helix	trans	-64.8	-54.8	176	177.5	-103.5	0	0	0	111.8	C167 Y168 S174 L175 M341 L344 A348	C167-F171 WeakPolarHBondContact O-CB 3.5Å; C167-F171 PolarHBondContact O-N 3.12Å; Y168-F171 PolarHBondContact O-N 3.01Å; F171-S174 PolarHBondContact O-N 3.05Å; F171-L175 HydrophobicContact CD1-CD1 4.38Å; F171-L175 HydrophobicContact CE1-CD1 3.7Å; F171-L175 HydrophobicContact CZ-CD1 3.87Å; F171-L175 WeakPolarHBondContact O-CB 3.5Å; F171-L175 PolarHBondContact O-N 3.48Å; F171-M341 HydrophobicContact CB-CE 4Å; F171-M341 HydrophobicContact CD2-CE 3.76Å; F171-M341 HydrophobicContact CE2-CE 4.45Å; F171-M341 HydrophobicContact CG-CE 3.94Å; F171-L344 HydrophobicContact CD2-CB 4.46Å; F171-L344 HydrophobicContact CE2-CB 4.39Å; F171-A348 HydrophobicContact CE2-CB 3.86Å; F171-A348 HydrophobicContact CZ-CB 3.56Å
172	I	95.8	Very high	93.6	Very high	14 Å²	14	18.8 Å²	18.8	7%	0.072	9%	0.092	C	C	.	.	H	α-helix	trans	-65.7	-41.5	-176.8	-62.3	-63.4	0	0	0	111.9	Y168 L175 M176 C387 A390 M391	Y168-I172 HydrophobicContact CD1-CG1 3.83Å; Y168-I172 HydrophobicContact CE1-CD1 4.28Å; Y168-I172 HydrophobicContact CE1-CG1 3.53Å; Y168-I172 HydrophobicContact CG-CG1 4.49Å; Y168-I172 WeakPolarHBondContact O-CG1 3.41Å; Y168-I172 PolarHBondContact O-N 3.14Å; I172-L175 HydrophobicContact CD1-CD1 4.46Å; I172-M176 WeakPolarHBondContact O-CB 3.46Å; I172-M176 PolarHBondContact O-N 3.46Å; I172-C387 HydrophobicContact CG2-CB 4.01Å; I172-A390 HydrophobicContact CD1-CB 4.21Å; I172-A390 HydrophobicContact CG1-CB 4.34Å; I172-A390 HydrophobicContact CG2-CB 4.3Å; I172-M391 HydrophobicContact CB-CG 4.48Å; I172-M391 HydrophobicContact CB-SD 3.85Å; I172-M391 HydrophobicContact CG2-CG 3.73Å; I172-M391 HydrophobicContact CG2-SD 3.75Å
173	Q	95.1	Very high	94	Very high	4 Å²	4	18.8 Å²	18.8	2%	0.019	9%	0.092	C	C	.	.	H	α-helix	trans	-66.8	-41.1	178	173.5	-81.6	-37.8	0	0	111.9	L169 M176 V177 I237 I314 Y315	L169-Q173 WeakPolarHBondContact O-CB 3.35Å; L169-Q173 PolarHBondContact O-N 3.45Å; L169-Q173 VanDerWaalsContact O-N 3.12Å; Q173-M176 PolarHBondContact O-N 2.75Å; Q173-V177 HydrophobicContact CG-CG2 4.41Å; Q173-V177 WeakPolarHBondContact O-CB 3.44Å; Q173-V177 WeakPolarHBondContact O-CG2 3.46Å; Q173-V177 PolarHBondContact O-N 2.98Å; Q173-I237 HydrophobicContact CB-CD1 4.42Å; Q173-I237 HydrophobicContact CG-CD1 4.17Å; Q173-I314 HydrophobicContact CB-CD1 4.42Å; Q173-Y315 VanDerWaalsContact OE1-CE2 3.22Å; Q173-Y315 PolarHBondContact OE1-OH 3.14Å
174	S	94.8	Very high	94.2	Very high	9 Å²	9	17.9 Å²	17.9	6%	0.063	9%	0.088	C	C	.	.	H	α-helix	trans	-69.1	-39.4	177.6	-173.3	0	0	0	0	112.3	T170 F171 M176 S178 G342 P346	T170-S174 WeakPolarHBondContact O-CB 3.49Å; T170-S174 PolarHBondContact O-N 2.88Å; T170-S174 VanDerWaalsContact O-N 3.12Å; F171-S174 PolarHBondContact O-N 3.05Å; S174-M176 PolarHBondContact O-N 2.87Å; S174-S178 PolarHBondContact O-N 2.91Å; S174-G342 VanDerWaalsContact CB-O 3.27Å; S174-G342 WeakPolarHBondContact CB-O 3.13Å; S174-G342 PolarHBondContact OG-O 2.78Å; S174-P346 WeakPolarHBondContact OG-CD 3.25Å
175	L	96	Very high	94.3	Very high	12 Å²	12	11.6 Å²	11.6	6%	0.063	6%	0.061	C	C	.	.	H	α-helix	trans	-55.3	-49.7	170.9	179.2	167.1	0	0	0	111.3	F171 I172 G179 Y180 G345 A348 L352	F171-L175 HydrophobicContact CD1-CD1 4.38Å; F171-L175 HydrophobicContact CE1-CD1 3.7Å; F171-L175 HydrophobicContact CZ-CD1 3.87Å; F171-L175 WeakPolarHBondContact O-CB 3.5Å; F171-L175 PolarHBondContact O-N 3.48Å; I172-L175 HydrophobicContact CD1-CD1 4.46Å; L175-G179 PolarHBondContact O-N 2.81Å; L175-Y180 PolarHBondContact O-N 3.06Å; L175-G345 VanDerWaalsContact CA-O 3.25Å; L175-G345 WeakPolarHBondContact CA-O 3.25Å; L175-G345 WeakPolarHBondContact CB-O 3.42Å; L175-A348 HydrophobicContact CD1-CB 3.89Å; L175-A348 HydrophobicContact CG-CB 4.32Å; L175-L352 HydrophobicContact CD2-CD2 3.91Å
176	M	95.8	Very high	94.3	Very high	2 Å²	2	11.8 Å²	11.8	1%	0.01	6%	0.061	C	C	.	.	I	π-helix	trans	-68.4	-47.7	-177.9	-169.5	-176.6	72.9	0	0	112.6	I172 Q173 S174 L181 I237 A241 I307 F384 C387	I172-M176 WeakPolarHBondContact O-CB 3.46Å; I172-M176 PolarHBondContact O-N 3.46Å; Q173-M176 PolarHBondContact O-N 2.75Å; S174-M176 PolarHBondContact O-N 2.87Å; M176-L181 PolarHBondContact O-N 2.9Å; M176-L181 VanDerWaalsContact O-N 3.07Å; M176-I237 HydrophobicContact CE-CG2 3.76Å; M176-A241 HydrophobicContact CE-CB 4.17Å; M176-A241 HydrophobicContact SD-CB 3.57Å; M176-A241 VanDerWaalsContact SD-CB 3.57Å; M176-I307 HydrophobicContact CE-CB 4.5Å; M176-I307 HydrophobicContact CE-CD1 3.82Å; M176-I307 HydrophobicContact CE-CG1 4Å; M176-I307 HydrophobicContact CE-CG2 3.62Å; M176-F384 HydrophobicContact CG-CD1 3.75Å; M176-F384 HydrophobicContact CG-CE1 3.98Å; M176-F384 HydrophobicContact SD-CD1 4.04Å; M176-C387 HydrophobicContact CB-CB 4.2Å; M176-C387 HydrophobicContact CG-CB 4.04Å; M176-C387 HydrophobicContact SD-CB 3.72Å
177	V	93.7	Very high	94.3	Very high	9 Å²	9	12 Å²	12	6%	0.055	6%	0.062	C	C	.	.	I	π-helix	trans	-81.5	-36.4	-170.5	175.4	0	0	0	0	113.3	Q173 F206 I307	Q173-V177 HydrophobicContact CG-CG2 4.41Å; Q173-V177 WeakPolarHBondContact O-CB 3.44Å; Q173-V177 WeakPolarHBondContact O-CG2 3.46Å; Q173-V177 PolarHBondContact O-N 2.98Å; V177-F206 HydrophobicContact CB-CE2 4.49Å; V177-F206 HydrophobicContact CG1-CB 4.4Å; V177-F206 HydrophobicContact CG1-CD1 3.81Å; V177-F206 HydrophobicContact CG1-CD2 3.75Å; V177-F206 HydrophobicContact CG1-CE1 3.97Å; V177-F206 HydrophobicContact CG1-CE2 3.91Å; V177-F206 HydrophobicContact CG1-CG 3.7Å; V177-F206 HydrophobicContact CG1-CZ 4.03Å; V177-F206 HydrophobicContact CG2-CD2 4.04Å; V177-F206 HydrophobicContact CG2-CE2 3.91Å; V177-I307 HydrophobicContact CG2-CG2 3.55Å
178	S	90.2	Very high	94.2	Very high	38 Å²	38	11.6 Å²	11.6	27%	0.266	6%	0.06	S	C	.	.	I	π-helix	trans	-116.9	-3.1	-169.6	-57.1	0	0	0	0	114.9	S174 Y350 I485	S174-S178 PolarHBondContact O-N 2.91Å; S178-Y350 PolarHBondContact O-OH 3.05Å; S178-I485 WeakPolarHBondContact O-CG2 3.38Å
179	G	93.8	Very high	94	Very high	0 Å²	0	8.7 Å²	8.7	0%	0	5%	0.048	C	C	.	.	I	π-helix	trans	-120.9	-59.5	172.4	0	0	0	0	0	112	L175 S182 S183 P346	L175-G179 PolarHBondContact O-N 2.81Å; G179-S182 PolarHBondContact O-N 2.78Å; G179-S183 PolarHBondContact O-N 3.48Å; G179-S183 PolarHBondContact O-OG 2.7Å; G179-P346 WeakPolarHBondContact CA-O 3.38Å
180	Y	96.7	Very high	93.6	Very high	0 Å²	0	11.6 Å²	11.6	0%	0	6%	0.061	C	C	.	.	I	π-helix	trans	-64.8	-51.9	-175.8	-169.5	-109.2	0	0	0	111.6	L175 S182 S183 V184 L352 L356 N379 W380 G383 F384	L175-Y180 PolarHBondContact O-N 3.06Å; Y180-S182 VanDerWaalsContact C-N 3.33Å; Y180-S182 PolarHBondContact O-N 3.42Å; Y180-S183 PolarHBondContact O-N 2.93Å; Y180-S183 PolarHBondContact O-OG 2.85Å; Y180-V184 HydrophobicContact CD1-CG1 4.47Å; Y180-V184 HydrophobicContact CD2-CG1 4.46Å; Y180-V184 HydrophobicContact CE1-CG1 4.04Å; Y180-V184 HydrophobicContact CE2-CG1 4.02Å; Y180-V184 PolarHBondContact O-N 3.05Å; Y180-L352 HydrophobicContact CD2-CD2 4.45Å; Y180-L352 HydrophobicContact CD2-CG 4.39Å; Y180-L356 HydrophobicContact CE2-CB 4.33Å; Y180-L356 HydrophobicContact CE2-CD1 3.8Å; Y180-N379 PolarHBondContact OH-O 3.3Å; Y180-W380 WeakPolarHBondContact CE1-O 3.45Å; Y180-W380 VanDerWaalsContact OH-C 3.25Å; Y180-W380 PolarHBondContact OH-O 3.44Å; Y180-G383 VanDerWaalsContact CZ-CA 3.43Å; Y180-G383 WeakPolarHBondContact OH-CA 3.24Å; Y180-G383 PolarHBondContact OH-N 3.02Å; Y180-G383 VanDerWaalsContact OH-N 3.07Å; Y180-F384 HydrophobicContact CD1-CD1 4.26Å; Y180-F384 HydrophobicContact CD1-CD2 4.06Å; Y180-F384 AromaticContact CD1-CE1 3.99Å; Y180-F384 HydrophobicContact CD1-CE1 3.99Å; Y180-F384 AromaticContact CD1-CE2 3.78Å; Y180-F384 HydrophobicContact CD1-CE2 3.78Å; Y180-F384 HydrophobicContact CD1-CG 4.28Å; Y180-F384 AromaticContact CD1-CZ 3.74Å; Y180-F384 HydrophobicContact CD1-CZ 3.74Å; Y180-F384 AromaticContact CE1-CD2 3.61Å; Y180-F384 HydrophobicContact CE1-CD2 3.61Å; Y180-F384 AromaticContact CE1-CE2 3.54Å; Y180-F384 HydrophobicContact CE1-CE2 3.54Å; Y180-F384 HydrophobicContact CE1-CG 4.12Å; Y180-F384 HydrophobicContact CE1-CZ 4.02Å
181	L	95.8	Very high	93.2	Very high	4 Å²	4	13.5 Å²	13.5	2%	0.021	7%	0.068	C	C	.	.	H	α-helix	trans	-50.6	-51.8	175.6	-178.4	62.8	0	0	0	112	M176 S183 V184 I185 V203 F244 F384	M176-L181 PolarHBondContact O-N 2.9Å; M176-L181 VanDerWaalsContact O-N 3.07Å; L181-S183 VanDerWaalsContact C-N 3.28Å; L181-S183 PolarHBondContact O-N 2.85Å; L181-V184 VanDerWaalsContact O-CG2 3.25Å; L181-V184 WeakPolarHBondContact O-CG2 3.5Å; L181-V184 PolarHBondContact O-N 2.98Å; L181-V184 VanDerWaalsContact O-N 3.1Å; L181-I185 PolarHBondContact O-N 3.35Å; L181-V203 HydrophobicContact CD2-CG2 3.9Å; L181-V203 HydrophobicContact CG-CG2 4.33Å; L181-F244 HydrophobicContact CD1-CE1 4.11Å; L181-F244 HydrophobicContact CD1-CE2 4.28Å; L181-F244 HydrophobicContact CD1-CZ 3.62Å; L181-F384 HydrophobicContact CB-CZ 4.47Å; L181-F384 HydrophobicContact CD1-CZ 4.05Å
182	S	93.9	Very high	92.8	Very high	4 Å²	4	11.8 Å²	11.8	3%	0.028	6%	0.06	C	C	.	.	H	α-helix	trans	-60.9	-32.4	179.7	-56.5	0	0	0	0	113.9	G179 Y180 Y350 I485	G179-S182 PolarHBondContact O-N 2.78Å; Y180-S182 VanDerWaalsContact C-N 3.33Å; Y180-S182 PolarHBondContact O-N 3.42Å; S182-Y350 WeakPolarHBondContact CB-OH 3.4Å; S182-I485 VanDerWaalsContact CB-O 3.24Å; S182-I485 WeakPolarHBondContact CB-O 3.35Å; S182-I485 PolarHBondContact OG-O 3Å
183	S	95	Very high	92.3	Very high	1 Å²	1	12 Å²	12	1%	0.007	6%	0.063	C	C	.	.	H	α-helix	trans	-75.6	-21.4	176	70.5	0	0	0	0	114.5	G179 Y180 L181 G353 I357 S504	G179-S183 PolarHBondContact O-N 3.48Å; G179-S183 PolarHBondContact O-OG 2.7Å; Y180-S183 PolarHBondContact O-N 2.93Å; Y180-S183 PolarHBondContact O-OG 2.85Å; L181-S183 VanDerWaalsContact C-N 3.28Å; L181-S183 PolarHBondContact O-N 2.85Å; S183-G353 WeakPolarHBondContact OG-CA 3.31Å; S183-I357 VanDerWaalsContact O-CD1 3.32Å; S183-I357 WeakPolarHBondContact O-CD1 3.3Å; S183-S504 WeakPolarHBondContact CB-OG 3.47Å
184	V	95.1	Very high	92	Very high	0 Å²	0	11.9 Å²	11.9	0%	0	6%	0.063	C	C	.	.	H	α-helix	trans	-103.6	-0.1	-177.1	-56.8	0	0	0	0	114	Y180 L181 T186 T187 I188 I357 W380 F384	Y180-V184 HydrophobicContact CD1-CG1 4.47Å; Y180-V184 HydrophobicContact CD2-CG1 4.46Å; Y180-V184 HydrophobicContact CE1-CG1 4.04Å; Y180-V184 HydrophobicContact CE2-CG1 4.02Å; Y180-V184 PolarHBondContact O-N 3.05Å; L181-V184 VanDerWaalsContact O-CG2 3.25Å; L181-V184 WeakPolarHBondContact O-CG2 3.5Å; L181-V184 PolarHBondContact O-N 2.98Å; L181-V184 VanDerWaalsContact O-N 3.1Å; V184-T186 VanDerWaalsContact C-N 3.33Å; V184-T186 PolarHBondContact O-N 3.19Å; V184-T187 PolarHBondContact O-N 3.33Å; V184-T187 PolarHBondContact O-OG1 3.26Å; V184-I188 HydrophobicContact CB-CD1 4.37Å; V184-I188 HydrophobicContact CG2-CD1 3.65Å; V184-I188 HydrophobicContact CG2-CG1 4.38Å; V184-I188 WeakPolarHBondContact O-CG1 3.49Å; V184-I188 PolarHBondContact O-N 2.84Å; V184-I357 HydrophobicContact CG1-CG2 3.76Å; V184-W380 HydrophobicContact CB-CB 3.78Å; V184-W380 HydrophobicContact CG1-CB 3.92Å; V184-W380 HydrophobicContact CG2-CB 4.44Å; V184-F384 HydrophobicContact CG2-CE2 4.08Å; V184-F384 HydrophobicContact CG2-CZ 4.18Å
185	I	93.3	Very high	91.7	Very high	7 Å²	7	15.5 Å²	15.5	4%	0.036	8%	0.075	C	C	.	.	H	α-helix	trans	-53.8	-48.3	-178.8	-81.8	168.8	0	0	0	111.5	L181 T187 I188 E189 V203 T486	L181-I185 PolarHBondContact O-N 3.35Å; I185-T187 VanDerWaalsContact C-N 3.34Å; I185-T187 PolarHBondContact O-N 3.42Å; I185-I188 PolarHBondContact O-N 2.96Å; I185-E189 HydrophobicContact CG2-CG 4.22Å; I185-E189 VanDerWaalsContact CG2-OE1 3.29Å; I185-E189 WeakPolarHBondContact CG2-OE1 3.49Å; I185-E189 WeakPolarHBondContact O-CB 3.42Å; I185-E189 VanDerWaalsContact O-CG 3.24Å; I185-E189 WeakPolarHBondContact O-CG 3.47Å; I185-E189 PolarHBondContact O-N 3.42Å; I185-V203 HydrophobicContact CD1-CG2 3.94Å; I185-T486 HydrophobicContact CD1-CG2 3.74Å
186	T	90.9	Very high	91.6	Very high	10 Å²	10	15 Å²	15	6%	0.061	7%	0.072	C	C	.	.	H	α-helix	trans	-70.6	-25.8	-176.2	55.2	0	0	0	0	113.8	V184 K190 K490 E493	V184-T186 VanDerWaalsContact C-N 3.33Å; V184-T186 PolarHBondContact O-N 3.19Å; T186-K190 WeakPolarHBondContact O-CB 3.35Å; T186-K190 WeakPolarHBondContact O-CD 3.4Å; T186-K190 WeakPolarHBondContact O-CG 3.43Å; T186-K190 PolarHBondContact O-N 2.98Å; T186-K490 HydrophobicContact CG2-CB 3.54Å; T186-K490 HydrophobicContact CG2-CD 3.81Å; T186-K490 HydrophobicContact CG2-CG 3.54Å; T186-E493 VanDerWaalsContact CB-OE2 3.24Å; T186-E493 WeakPolarHBondContact CB-OE2 3.1Å; T186-E493 WeakPolarHBondContact CG2-OE2 3.23Å; T186-E493 PolarHBondContact OG1-OE2 2.91Å
187	T	91.8	Very high	91.4	Very high	4 Å²	4	16.3 Å²	16.3	3%	0.025	8%	0.082	C	C	.	.	H	α-helix	trans	-80.7	-32.1	174.2	51.2	0	0	0	0	112.4	V184 I185 R191	V184-T187 PolarHBondContact O-N 3.33Å; V184-T187 PolarHBondContact O-OG1 3.26Å; I185-T187 VanDerWaalsContact C-N 3.34Å; I185-T187 PolarHBondContact O-N 3.42Å; T187-R191 WeakPolarHBondContact O-CB 3.49Å; T187-R191 PolarHBondContact O-N 3.43Å
188	I	91.7	Very high	91.3	Very high	6 Å²	6	18.6 Å²	18.6	3%	0.031	9%	0.092	C	C	.	.	H	α-helix	trans	-70.4	-44.5	171.9	-64.3	173.9	0	0	0	110.6	V184 I185 K190 R191 Y192 L194 F244 F300 W380	V184-I188 HydrophobicContact CB-CD1 4.37Å; V184-I188 HydrophobicContact CG2-CD1 3.65Å; V184-I188 HydrophobicContact CG2-CG1 4.38Å; V184-I188 WeakPolarHBondContact O-CG1 3.49Å; V184-I188 PolarHBondContact O-N 2.84Å; I185-I188 PolarHBondContact O-N 2.96Å; I188-K190 PolarHBondContact O-N 2.86Å; I188-R191 PolarHBondContact O-N 3.26Å; I188-Y192 HydrophobicContact CG2-CD2 3.98Å; I188-Y192 PolarHBondContact O-N 3.12Å; I188-L194 HydrophobicContact CG2-CD1 3.91Å; I188-F244 HydrophobicContact CD1-CE1 3.72Å; I188-F244 HydrophobicContact CD1-CZ 4.05Å; I188-F300 HydrophobicContact CG2-CE2 4.09Å; I188-F300 HydrophobicContact CG2-CZ 4.02Å; I188-W380 HydrophobicContact CD1-CD2 4.33Å; I188-W380 HydrophobicContact CD1-CE3 3.81Å; I188-W380 HydrophobicContact CD1-CZ3 4.4Å; I188-W380 HydrophobicContact CG1-CB 4.21Å; I188-W380 HydrophobicContact CG1-CD2 3.81Å; I188-W380 HydrophobicContact CG1-CE3 3.8Å; I188-W380 HydrophobicContact CG1-CG 3.98Å
189	E	90.3	Very high	91.4	Very high	9 Å²	9	17 Å²	17	4%	0.042	8%	0.08	C	C	.	.	H	α-helix	trans	-54	-51.4	174.3	-75.1	170.7	167.6	0	0	111.3	I185 R191 S193 L194 S199 K490 S758	I185-E189 HydrophobicContact CG2-CG 4.22Å; I185-E189 VanDerWaalsContact CG2-OE1 3.29Å; I185-E189 WeakPolarHBondContact CG2-OE1 3.49Å; I185-E189 WeakPolarHBondContact O-CB 3.42Å; I185-E189 VanDerWaalsContact O-CG 3.24Å; I185-E189 WeakPolarHBondContact O-CG 3.47Å; I185-E189 PolarHBondContact O-N 3.42Å; E189-R191 PolarHBondContact O-N 2.91Å; E189-S193 WeakPolarHBondContact O-CA 3.36Å; E189-S193 PolarHBondContact O-N 3.26Å; E189-L194 HydrophobicContact CG-CB 4.33Å; E189-L194 PolarHBondContact O-N 3.27Å; E189-S199 WeakPolarHBondContact OE1-CB 3.35Å; E189-S199 PolarHBondContact OE1-OG 3.08Å; E189-K490 IonicContact OE1-NZ 3.94Å; E189-K490 PolarHBondContact OE1-NZ 3.17Å; E189-K490 WeakPolarHBondContact OE2-CE 3.42Å; E189-K490 IonicContact OE2-NZ 3.87Å; E189-K490 PolarHBondContact OE2-NZ 2.86Å; E189-S758 WeakPolarHBondContact O-CB 3.45Å
190	K	86.5	Confident	91.4	Very high	63 Å²	63	17 Å²	17	27%	0.274	8%	0.08	S	C	.	.	H	α-helix	trans	-62.9	-38.5	177.1	-70.6	170.3	-164.9	175.4	0	113.3	T186 I188 E493	T186-K190 WeakPolarHBondContact O-CB 3.35Å; T186-K190 WeakPolarHBondContact O-CD 3.4Å; T186-K190 WeakPolarHBondContact O-CG 3.43Å; T186-K190 PolarHBondContact O-N 2.98Å; I188-K190 PolarHBondContact O-N 2.86Å; K190-E493 IonicContact NZ-OE1 2.69Å; K190-E493 PolarHBondContact NZ-OE1 3.32Å
191	R	86.1	Confident	91.3	Very high	41 Å²	41	19.9 Å²	19.9	16%	0.155	10%	0.096	C	C	.	.	H	α-helix	trans	-74.7	-34.2	-176.5	178.6	59.1	-164.1	104.9	-11.2	113.3	T187 I188 E189 P252 V377	T187-R191 WeakPolarHBondContact O-CB 3.49Å; T187-R191 PolarHBondContact O-N 3.43Å; I188-R191 PolarHBondContact O-N 3.26Å; E189-R191 PolarHBondContact O-N 2.91Å; R191-P252 PolarHBondContact NH2-O 3.34Å; R191-V377 HydrophobicContact CB-CG1 4.1Å
192	Y	87.1	Confident	91.2	Very high	11 Å²	11	20.1 Å²	20.1	4%	0.043	10%	0.097	C	C	.	.	H	α-helix	trans	-113.8	10.6	-173.1	-64.6	-78.9	0	0	0	114.2	I188 L194 P247 H248 H293 Y296 F300 W380	I188-Y192 HydrophobicContact CG2-CD2 3.98Å; I188-Y192 PolarHBondContact O-N 3.12Å; Y192-L194 VanDerWaalsContact C-N 3.32Å; Y192-L194 PolarHBondContact O-N 2.98Å; Y192-P247 HydrophobicContact CE1-CB 4.03Å; Y192-P247 VanDerWaalsContact OH-CB 3.23Å; Y192-P247 WeakPolarHBondContact OH-CB 3.33Å; Y192-P247 PolarHBondContact OH-O 3.4Å; Y192-H248 PolarHBondContact OH-N 3.45Å; Y192-H248 VanDerWaalsContact OH-N 3.16Å; Y192-H293 PolarHBondContact O-CE1 2.97Å; Y192-H293 VanDerWaalsContact O-CE1 3.25Å; Y192-H293 PolarHBondContact O-ND1 2.75Å; Y192-Y296 AromaticContact CD1-CD2 3.62Å; Y192-Y296 HydrophobicContact CD1-CD2 3.62Å; Y192-Y296 HydrophobicContact CD1-CE2 4.43Å; Y192-Y296 HydrophobicContact CD1-CG 4.05Å; Y192-Y296 AromaticContact CE1-CD2 3.82Å; Y192-Y296 HydrophobicContact CE1-CD2 3.82Å; Y192-Y296 HydrophobicContact CE1-CE2 4.42Å; Y192-Y296 HydrophobicContact CE1-CG 4.01Å; Y192-F300 AromaticContact CD2-CE2 3.86Å; Y192-F300 HydrophobicContact CD2-CE2 3.86Å; Y192-F300 AromaticContact CD2-CZ 3.92Å; Y192-F300 HydrophobicContact CD2-CZ 3.92Å; Y192-F300 AromaticContact CE2-CE2 3.98Å; Y192-F300 HydrophobicContact CE2-CE2 3.98Å; Y192-F300 AromaticContact CE2-CZ 3.6Å; Y192-F300 HydrophobicContact CE2-CZ 3.6Å; Y192-F300 HydrophobicContact CG-CE2 4.18Å; Y192-W380 HydrophobicContact CE2-CH2 4.13Å; Y192-W380 AromaticContact CE2-CZ2 3.64Å; Y192-W380 HydrophobicContact CE2-CZ2 3.64Å; Y192-W380 AromaticContact CZ-CZ2 3.94Å; Y192-W380 VanDerWaalsContact OH-CZ2 3.28Å; Y192-W380 WeakPolarHBondContact OH-CZ2 3.25Å
193	S	85	Confident	91.2	Very high	17 Å²	17	21 Å²	21	12%	0.119	10%	0.102	C	C	.	.	T	Hydrogen-bonded Turn	trans	58.3	38.1	-177.9	-54.6	0	0	0	0	113.1	E189 Q750 D752 G757 S758	E189-S193 WeakPolarHBondContact O-CA 3.36Å; E189-S193 PolarHBondContact O-N 3.26Å; S193-Q750 VanDerWaalsContact OG-CD 3.3Å; S193-Q750 PolarHBondContact OG-NE2 2.85Å; S193-D752 WeakPolarHBondContact CB-OD2 3.26Å; S193-D752 PolarHBondContact OG-OD2 3.09Å; S193-G757 CarbonylContact O-C 3.18Å; S193-G757 WeakPolarHBondContact O-CA 3.31Å; S193-S758 PolarHBondContact O-N 3.35Å
194	L	87.8	Confident	91.2	Very high	3 Å²	3	21 Å²	21	2%	0.016	10%	0.102	C	C	.	.			trans	-86.5	147.9	-178	-47.4	-175.8	0	0	0	112.9	I188 E189 Y192 L202 V297 S758	I188-L194 HydrophobicContact CG2-CD1 3.91Å; E189-L194 HydrophobicContact CG-CB 4.33Å; E189-L194 PolarHBondContact O-N 3.27Å; Y192-L194 VanDerWaalsContact C-N 3.32Å; Y192-L194 PolarHBondContact O-N 2.98Å; L194-L202 HydrophobicContact CD1-CD1 4.06Å; L194-V297 HydrophobicContact CD2-CG2 3.54Å; L194-S758 WeakPolarHBondContact O-CA 3.41Å; L194-S758 WeakPolarHBondContact O-CB 3.4Å
195	R	90	Very high	91.2	Very high	84 Å²	84	21.3 Å²	21.3	32%	0.317	10%	0.104	S	C	.	.			trans	-81	161.8	170.1	-56.5	-172.7	-171.8	151.2	14.5	112.3	S197 E198 S199 W749 H756 G757	R195-S197 VanDerWaalsContact C-N 3.31Å; R195-S197 PolarHBondContact O-N 2.85Å; R195-E198 HydrophobicContact CB-CG 4.19Å; R195-E198 WeakPolarHBondContact CB-OE2 3.35Å; R195-E198 PolarHBondContact N-OE2 3.06Å; R195-E198 PolarHBondContact O-N 3.42Å; R195-E198 VanDerWaalsContact O-N 3.13Å; R195-S199 PolarHBondContact O-N 3.49Å; R195-W749 HydrophobicContact CG-CH2 4.47Å; R195-W749 HydrophobicContact CG-CZ3 4.01Å; R195-H756 VanDerWaalsContact CZ-O 3.27Å; R195-H756 PolarHBondContact NE-O 2.91Å; R195-H756 PolarHBondContact NH2-O 3.42Å; R195-G757 WeakPolarHBondContact CG-O 3.39Å
196	S	93.1	Very high	91.3	Very high	1 Å²	1	21.7 Å²	21.7	1%	0.007	11%	0.106	C	C	.	.	H	α-helix	trans	-67.5	-32.9	178.6	-36.3	0	0	0	0	112.1	E198 S199 G200 K490 G739 I742 D743 Y762	S196-E198 VanDerWaalsContact C-N 3.32Å; S196-S199 PolarHBondContact O-OG 3.48Å; S196-S199 VanDerWaalsContact O-OG 3.11Å; S196-G200 PolarHBondContact O-N 3.46Å; S196-K490 PolarHBondContact OG-NZ 3.29Å; S196-G739 VanDerWaalsContact C-CA 3.45Å; S196-G739 WeakPolarHBondContact CB-O 3.41Å; S196-G739 VanDerWaalsContact O-CA 3.31Å; S196-G739 WeakPolarHBondContact O-CA 3.25Å; S196-I742 WeakPolarHBondContact OG-CG2 3.32Å; S196-D743 WeakPolarHBondContact CA-OD1 3.39Å; S196-D743 WeakPolarHBondContact CB-OD1 3.44Å; S196-D743 PolarHBondContact N-OD1 3.14Å; S196-D743 PolarHBondContact N-OD2 3.08Å; S196-D743 PolarHBondContact OG-OD1 3.25Å; S196-Y762 PolarHBondContact OG-OH 2.85Å
197	S	92.3	Very high	91.4	Very high	31 Å²	31	22.1 Å²	22.1	22%	0.217	11%	0.107	C	C	.	.	H	α-helix	trans	-63.7	-34.9	171.1	41.4	0	0	0	0	112.9	R195 L201 D743	R195-S197 VanDerWaalsContact C-N 3.31Å; R195-S197 PolarHBondContact O-N 2.85Å; S197-L201 PolarHBondContact O-N 3.02Å; S197-D743 VanDerWaalsContact CB-OD2 3.26Å; S197-D743 WeakPolarHBondContact CB-OD2 3.5Å; S197-D743 PolarHBondContact N-OD2 3.18Å; S197-D743 PolarHBondContact OG-OD2 3.28Å
198	E	91.4	Very high	91.5	Very high	56 Å²	56	24.4 Å²	24.4	26%	0.262	12%	0.119	S	C	.	.	H	α-helix	trans	-78.2	-43.8	178.3	-64.8	169	149.6	0	0	111.4	R195 S196 G200 L201 L202	R195-E198 HydrophobicContact CB-CG 4.19Å; R195-E198 WeakPolarHBondContact CB-OE2 3.35Å; R195-E198 PolarHBondContact N-OE2 3.06Å; R195-E198 PolarHBondContact O-N 3.42Å; R195-E198 VanDerWaalsContact O-N 3.13Å; S196-E198 VanDerWaalsContact C-N 3.32Å; E198-G200 PolarHBondContact O-N 3.16Å; E198-L201 WeakPolarHBondContact O-CA 3.26Å; E198-L201 WeakPolarHBondContact O-CB 3.38Å; E198-L201 PolarHBondContact O-N 2.7Å; E198-L202 WeakPolarHBondContact O-CG 3.48Å; E198-L202 PolarHBondContact O-N 3.09Å
199	S	92.8	Very high	91.6	Very high	4 Å²	4	24.1 Å²	24.1	3%	0.028	12%	0.118	C	C	.	.	H	α-helix	trans	-62.5	-34.8	172.1	71.8	0	0	0	0	111.7	E189 R195 S196 L202 V203	E189-S199 WeakPolarHBondContact OE1-CB 3.35Å; E189-S199 PolarHBondContact OE1-OG 3.08Å; R195-S199 PolarHBondContact O-N 3.49Å; S196-S199 PolarHBondContact O-OG 3.48Å; S196-S199 VanDerWaalsContact O-OG 3.11Å; S199-L202 WeakPolarHBondContact O-CB 3.36Å; S199-L202 PolarHBondContact O-N 3.35Å; S199-V203 PolarHBondContact O-N 3.22Å
200	G	93.9	Very high	91.7	Very high	0 Å²	0	23.7 Å²	23.7	0%	0	12%	0.116	C	C	.	.	H	α-helix	trans	-57.8	-50.2	166.5	0	0	0	0	0	112.7	S196 E198 L202 V203 S204 P735	S196-G200 PolarHBondContact O-N 3.46Å; E198-G200 PolarHBondContact O-N 3.16Å; G200-L202 VanDerWaalsContact C-N 3.29Å; G200-L202 PolarHBondContact O-N 3.11Å; G200-V203 PolarHBondContact O-N 3.02Å; G200-V203 VanDerWaalsContact O-N 3.12Å; G200-S204 PolarHBondContact O-N 3.22Å; G200-S204 PolarHBondContact O-OG 3.4Å; G200-P735 VanDerWaalsContact O-CB 3.23Å; G200-P735 WeakPolarHBondContact O-CB 3.24Å
201	L	93.9	Very high	91.8	Very high	62 Å²	62	22.7 Å²	22.7	33%	0.325	11%	0.113	S	C	.	.	H	α-helix	trans	-57.3	-39.2	175.9	179.1	63	0	0	0	112.4	S197 E198 V203 S204 C205 I301 I736	S197-L201 PolarHBondContact O-N 3.02Å; E198-L201 WeakPolarHBondContact O-CA 3.26Å; E198-L201 WeakPolarHBondContact O-CB 3.38Å; E198-L201 PolarHBondContact O-N 2.7Å; L201-V203 VanDerWaalsContact C-N 3.32Å; L201-V203 PolarHBondContact O-N 3.43Å; L201-S204 PolarHBondContact O-N 3.24Å; L201-C205 PolarHBondContact O-N 3.01Å; L201-C205 PolarHBondContact O-SG 3.47Å; L201-I301 HydrophobicContact CD2-CD1 4.36Å; L201-I736 HydrophobicContact CB-CG1 4.32Å; L201-I736 HydrophobicContact CD1-CD1 3.86Å; L201-I736 HydrophobicContact CD1-CG1 4.37Å
202	L	93.6	Very high	92	Very high	9 Å²	9	26.8 Å²	26.8	5%	0.047	14%	0.137	C	C	.	.	H	α-helix	trans	-58	-42.7	175.5	-62.9	-173.8	0	0	0	112.2	L194 E198 S199 G200 C205 F300 I301 Q304	L194-L202 HydrophobicContact CD1-CD1 4.06Å; E198-L202 WeakPolarHBondContact O-CG 3.48Å; E198-L202 PolarHBondContact O-N 3.09Å; S199-L202 WeakPolarHBondContact O-CB 3.36Å; S199-L202 PolarHBondContact O-N 3.35Å; G200-L202 VanDerWaalsContact C-N 3.29Å; G200-L202 PolarHBondContact O-N 3.11Å; L202-C205 PolarHBondContact O-N 2.88Å; L202-F300 HydrophobicContact CD1-CB 3.87Å; L202-F300 HydrophobicContact CD1-CD2 4.29Å; L202-F300 HydrophobicContact CD1-CG 4.18Å; L202-F300 HydrophobicContact CD2-CB 3.59Å; L202-F300 HydrophobicContact CG-CB 4.36Å; L202-I301 HydrophobicContact CD2-CG1 3.62Å; L202-Q304 WeakPolarHBondContact O-CG 3.23Å
203	V	94.3	Very high	92.1	Very high	22 Å²	22	27.3 Å²	27.3	13%	0.133	14%	0.142	C	C	.	.	H	α-helix	trans	-65.8	-45	175.8	178.6	0	0	0	0	110.8	L181 I185 S199 G200 L201 C205 F206 T486 P735	L181-V203 HydrophobicContact CD2-CG2 3.9Å; L181-V203 HydrophobicContact CG-CG2 4.33Å; I185-V203 HydrophobicContact CD1-CG2 3.94Å; S199-V203 PolarHBondContact O-N 3.22Å; G200-V203 PolarHBondContact O-N 3.02Å; G200-V203 VanDerWaalsContact O-N 3.12Å; L201-V203 VanDerWaalsContact C-N 3.32Å; L201-V203 PolarHBondContact O-N 3.43Å; V203-C205 VanDerWaalsContact C-N 3.26Å; V203-C205 PolarHBondContact O-N 3.35Å; V203-F206 WeakPolarHBondContact O-CB 3.44Å; V203-F206 PolarHBondContact O-N 3.32Å; V203-T486 HydrophobicContact CB-CG2 4.48Å; V203-T486 HydrophobicContact CG2-CG2 3.97Å; V203-P735 HydrophobicContact CB-CB 4.29Å; V203-P735 HydrophobicContact CB-CG 4.34Å; V203-P735 HydrophobicContact CG1-CG 4.12Å
204	S	95.1	Very high	92.1	Very high	1 Å²	1	27.7 Å²	27.7	1%	0.007	14%	0.143	C	C	.	.	H	α-helix	trans	-63.2	-28.5	179	-61.5	0	0	0	0	113.9	G200 L201 F206 D207 I208 I732	G200-S204 PolarHBondContact O-N 3.22Å; G200-S204 PolarHBondContact O-OG 3.4Å; L201-S204 PolarHBondContact O-N 3.24Å; S204-F206 PolarHBondContact O-N 2.99Å; S204-D207 PolarHBondContact O-N 3.22Å; S204-D207 VanDerWaalsContact O-N 3.15Å; S204-I208 WeakPolarHBondContact O-CG1 3.49Å; S204-I208 PolarHBondContact O-N 3.22Å; S204-I732 VanDerWaalsContact CB-O 3.29Å; S204-I732 WeakPolarHBondContact CB-O 3.19Å; S204-I732 PolarHBondContact OG-O 2.91Å
205	C	95.4	Very high	91.8	Very high	6 Å²	6	32.9 Å²	32.9	4%	0.041	17%	0.174	C	C	.	.	H	α-helix	trans	-60.8	-26.6	177.3	-78.2	0	0	0	0	113.8	L201 L202 V203 G209 Q304 I305	L201-C205 PolarHBondContact O-N 3.01Å; L201-C205 PolarHBondContact O-SG 3.47Å; L202-C205 PolarHBondContact O-N 2.88Å; V203-C205 VanDerWaalsContact C-N 3.26Å; V203-C205 PolarHBondContact O-N 3.35Å; C205-G209 PolarHBondContact O-N 3.37Å; C205-Q304 HydrophobicContact CB-CB 3.87Å; C205-I305 HydrophobicContact CB-CG1 4.22Å
206	F	94.8	Very high	91.5	Very high	16 Å²	16	34.1 Å²	34.1	7%	0.07	18%	0.182	C	C	.	.	H	α-helix	trans	-61.7	-51.3	171.2	168.6	-98	0	0	0	111.8	V177 V203 S204 G209 S210 I307 G308 S311	V177-F206 HydrophobicContact CB-CE2 4.49Å; V177-F206 HydrophobicContact CG1-CB 4.4Å; V177-F206 HydrophobicContact CG1-CD1 3.81Å; V177-F206 HydrophobicContact CG1-CD2 3.75Å; V177-F206 HydrophobicContact CG1-CE1 3.97Å; V177-F206 HydrophobicContact CG1-CE2 3.91Å; V177-F206 HydrophobicContact CG1-CG 3.7Å; V177-F206 HydrophobicContact CG1-CZ 4.03Å; V177-F206 HydrophobicContact CG2-CD2 4.04Å; V177-F206 HydrophobicContact CG2-CE2 3.91Å; V203-F206 WeakPolarHBondContact O-CB 3.44Å; V203-F206 PolarHBondContact O-N 3.32Å; S204-F206 PolarHBondContact O-N 2.99Å; F206-G209 PolarHBondContact O-N 3.42Å; F206-S210 WeakPolarHBondContact O-CB 2.85Å; F206-S210 PolarHBondContact O-N 3.09Å; F206-I307 HydrophobicContact CD2-CB 4.46Å; F206-I307 HydrophobicContact CD2-CG2 3.92Å; F206-I307 HydrophobicContact CE2-CG2 4.03Å; F206-G308 VanDerWaalsContact O-CA 3.25Å; F206-G308 WeakPolarHBondContact O-CA 3.29Å; F206-S311 VanDerWaalsContact CE2-OG 3.31Å; F206-S311 WeakPolarHBondContact CE2-OG 3.45Å; F206-S311 WeakPolarHBondContact CZ-OG 3.26Å
207	D	93.7	Very high	91.2	Very high	18 Å²	18	34.7 Å²	34.7	10%	0.096	19%	0.185	C	C	.	.	H	α-helix	trans	-69.4	-36.6	-179.3	-84.4	-65.4	0	0	0	111.6	S204 S210 L211 R727 Y731 I732	S204-D207 PolarHBondContact O-N 3.22Å; S204-D207 VanDerWaalsContact O-N 3.15Å; D207-S210 WeakPolarHBondContact CA-OG 3.49Å; D207-S210 PolarHBondContact O-N 2.77Å; D207-S210 PolarHBondContact O-OG 2.85Å; D207-L211 WeakPolarHBondContact O-CG 3.28Å; D207-L211 PolarHBondContact O-N 3.48Å; D207-R727 IonicContact OD1-CZ 3.17Å; D207-R727 IonicContact OD1-NE 2.7Å; D207-R727 PolarHBondContact OD1-NE 2.94Å; D207-R727 IonicContact OD1-NH2 2.75Å; D207-R727 PolarHBondContact OD1-NH2 3.17Å; D207-Y731 WeakPolarHBondContact OD2-CB 3.41Å; D207-I732 HydrophobicContact CB-CD1 4.31Å; D207-I732 HydrophobicContact CB-CG1 3.77Å
208	I	93.8	Very high	90.6	Very high	53 Å²	53	35.5 Å²	35.5	27%	0.272	19%	0.191	S	C	.	.	H	α-helix	trans	-55.8	-56	170.7	-66.1	167.9	0	0	0	110.7	S204 S210 L211 L212 I732	S204-I208 WeakPolarHBondContact O-CG1 3.49Å; S204-I208 PolarHBondContact O-N 3.22Å; I208-S210 PolarHBondContact O-N 2.7Å; I208-L211 PolarHBondContact O-N 3.02Å; I208-L211 VanDerWaalsContact O-N 3.14Å; I208-L212 HydrophobicContact CG2-CD1 4.31Å; I208-L212 WeakPolarHBondContact O-CG 3.21Å; I208-L212 PolarHBondContact O-N 3.25Å; I208-L212 VanDerWaalsContact O-N 3.14Å; I208-I732 HydrophobicContact CD1-CG2 4.16Å; I208-I732 HydrophobicContact CG1-CD1 3.77Å; I208-I732 HydrophobicContact CG1-CG1 4.01Å; I208-I732 HydrophobicContact CG1-CG2 4.02Å
209	G	93.4	Very high	89.9	Confident	0 Å²	0	36.9 Å²	36.9	0%	0	19%	0.194	C	C	.	.	H	α-helix	trans	-58	-35.8	-179.7	0	0	0	0	0	113.1	C205 F206 M309	C205-G209 PolarHBondContact O-N 3.37Å; F206-G209 PolarHBondContact O-N 3.42Å; G209-M309 WeakPolarHBondContact O-CG 3.43Å
210	S	91.3	Very high	89.3	Confident	0 Å²	0	41.5 Å²	41.5	0%	0	21%	0.214	C	C	.	.	H	α-helix	trans	-73.1	-37.6	176.9	79.4	0	0	0	0	113.9	F206 D207 I208 V213 V214 G308 T312 R727	F206-S210 WeakPolarHBondContact O-CB 2.85Å; F206-S210 PolarHBondContact O-N 3.09Å; D207-S210 WeakPolarHBondContact CA-OG 3.49Å; D207-S210 PolarHBondContact O-N 2.77Å; D207-S210 PolarHBondContact O-OG 2.85Å; I208-S210 PolarHBondContact O-N 2.7Å; S210-V213 PolarHBondContact O-N 2.81Å; S210-V214 WeakPolarHBondContact O-CB 3.34Å; S210-V214 PolarHBondContact O-N 3.49Å; S210-V214 VanDerWaalsContact O-N 3.08Å; S210-G308 WeakPolarHBondContact CA-O 3.48Å; S210-G308 VanDerWaalsContact CB-O 3.26Å; S210-G308 WeakPolarHBondContact CB-O 3.46Å; S210-T312 WeakPolarHBondContact CA-OG1 3.43Å; S210-T312 VanDerWaalsContact CB-OG1 3.29Å; S210-T312 WeakPolarHBondContact CB-OG1 3.17Å; S210-T312 PolarHBondContact O-OG1 3.14Å; S210-R727 PolarHBondContact OG-NH1 2.92Å; S210-R727 PolarHBondContact OG-NH2 3.08Å
211	L	89.6	Confident	88.4	Confident	42 Å²	42	41.5 Å²	41.5	22%	0.22	21%	0.214	C	C	.	.	H	α-helix	trans	-64.9	-39.4	176.3	-80	-174.4	0	0	0	111.8	D207 I208 V213 V214 R727 T728 I732	D207-L211 WeakPolarHBondContact O-CG 3.28Å; D207-L211 PolarHBondContact O-N 3.48Å; I208-L211 PolarHBondContact O-N 3.02Å; I208-L211 VanDerWaalsContact O-N 3.14Å; L211-V213 PolarHBondContact O-N 2.73Å; L211-V213 VanDerWaalsContact O-N 3.16Å; L211-V214 HydrophobicContact CD2-CG1 4.47Å; L211-V214 PolarHBondContact O-N 3.27Å; L211-R727 HydrophobicContact CD1-CB 4.06Å; L211-R727 HydrophobicContact CD2-CB 3.97Å; L211-R727 HydrophobicContact CD2-CG 4.45Å; L211-R727 HydrophobicContact CG-CB 4.19Å; L211-T728 HydrophobicContact CD1-CG2 3.96Å; L211-I732 HydrophobicContact CD1-CD1 3.59Å
212	L	89.3	Confident	87.3	Confident	127 Å²	127	40 Å²	40	67%	0.665	21%	0.213	S	C	*	.	H	α-helix	trans	-56.6	-32	179.8	-71	171.4	0	0	0	112.9	I208	I208-L212 HydrophobicContact CG2-CD1 4.31Å; I208-L212 WeakPolarHBondContact O-CG 3.21Å; I208-L212 PolarHBondContact O-N 3.25Å; I208-L212 VanDerWaalsContact O-N 3.14Å
213	V	90	Very high	86.4	Confident	22 Å²	22	46.6 Å²	46.6	13%	0.133	24%	0.238	C	C	.	.	H	α-helix	trans	-110.3	-10.6	-176.2	-61.6	0	0	0	0	115.3	S210 L211 V215 F216 I217 M309 T312	S210-V213 PolarHBondContact O-N 2.81Å; L211-V213 PolarHBondContact O-N 2.73Å; L211-V213 VanDerWaalsContact O-N 3.16Å; V213-V215 VanDerWaalsContact C-N 3.34Å; V213-V215 PolarHBondContact O-N 2.69Å; V213-F216 PolarHBondContact O-N 2.89Å; V213-I217 HydrophobicContact CB-CD1 3.7Å; V213-I217 HydrophobicContact CB-CG1 4.1Å; V213-I217 HydrophobicContact CG2-CD1 3.55Å; V213-I217 HydrophobicContact CG2-CG1 4.43Å; V213-I217 WeakPolarHBondContact O-CB 3.41Å; V213-I217 WeakPolarHBondContact O-CG1 3.29Å; V213-I217 PolarHBondContact O-N 3.25Å; V213-M309 HydrophobicContact CG1-CB 4.41Å; V213-M309 HydrophobicContact CG1-CE 3.85Å; V213-M309 HydrophobicContact CG1-CG 3.9Å; V213-M309 HydrophobicContact CG2-CB 4.01Å; V213-M309 HydrophobicContact CG2-CG 4.05Å; V213-T312 HydrophobicContact CG2-CG2 4.12Å
214	V	85.3	Confident	85.5	Confident	25 Å²	25	47.2 Å²	47.2	15%	0.152	25%	0.248	C	C	.	.	H	α-helix	trans	-58.9	-40.6	-173.5	72.6	0	0	0	0	113.8	S210 L211 S218 T312 T316	S210-V214 WeakPolarHBondContact O-CB 3.34Å; S210-V214 PolarHBondContact O-N 3.49Å; S210-V214 VanDerWaalsContact O-N 3.08Å; L211-V214 HydrophobicContact CD2-CG1 4.47Å; L211-V214 PolarHBondContact O-N 3.27Å; V214-S218 VanDerWaalsContact O-CB 3.23Å; V214-S218 WeakPolarHBondContact O-CB 3.48Å; V214-S218 PolarHBondContact O-N 3.24Å; V214-S218 PolarHBondContact O-OG 3.27Å; V214-T312 HydrophobicContact CB-CG2 3.86Å; V214-T312 HydrophobicContact CG2-CG2 3.96Å; V214-T316 HydrophobicContact CG2-CG2 4.03Å
215	V	81.4	Confident	84.9	Confident	111 Å²	111	49.6 Å²	49.6	67%	0.673	26%	0.259	S	S	*	.	H	α-helix	trans	-68.2	-45.5	178.2	-176.8	0	0	0	0	110.8	V213 Y219	V213-V215 VanDerWaalsContact C-N 3.34Å; V213-V215 PolarHBondContact O-N 2.69Å; V215-Y219 WeakPolarHBondContact O-CB 3.41Å; V215-Y219 PolarHBondContact O-N 3.14Å; V215-Y219 VanDerWaalsContact O-N 3.08Å
216	F	83.8	Confident	84.4	Confident	110 Å²	110	51.6 Å²	51.6	48%	0.482	27%	0.266	S	S	.	.	H	α-helix	trans	-63.4	-51.4	-179.9	-179.1	-91.2	0	0	0	111.8	V213 S218 Y219 F220 W229	V213-F216 PolarHBondContact O-N 2.89Å; F216-S218 VanDerWaalsContact C-N 3.34Å; F216-S218 PolarHBondContact O-N 3.02Å; F216-Y219 PolarHBondContact O-N 2.94Å; F216-F220 HydrophobicContact CD1-CD2 4.3Å; F216-F220 AromaticContact CD2-CD2 3.47Å; F216-F220 HydrophobicContact CD2-CD2 3.47Å; F216-F220 VanDerWaalsContact CD2-CD2 3.47Å; F216-F220 AromaticContact CD2-CE2 3.54Å; F216-F220 HydrophobicContact CD2-CE2 3.54Å; F216-F220 HydrophobicContact CE1-CD2 4.27Å; F216-F220 AromaticContact CE2-CD2 3.42Å; F216-F220 HydrophobicContact CE2-CD2 3.42Å; F216-F220 VanDerWaalsContact CE2-CD2 3.42Å; F216-F220 AromaticContact CE2-CE2 3.45Å; F216-F220 HydrophobicContact CE2-CE2 3.45Å; F216-F220 VanDerWaalsContact CE2-CE2 3.45Å; F216-F220 HydrophobicContact CE2-CG 4.35Å; F216-F220 HydrophobicContact CE2-CZ 4.38Å; F216-F220 AromaticContact CG-CD2 3.92Å; F216-F220 HydrophobicContact CG-CD2 3.92Å; F216-F220 HydrophobicContact CG-CE2 4.4Å; F216-F220 AromaticContact CZ-CD2 3.84Å; F216-F220 HydrophobicContact CZ-CD2 3.84Å; F216-F220 HydrophobicContact CZ-CE2 4.26Å; F216-F220 HydrophobicContact CZ-CG 4.4Å; F216-F220 WeakPolarHBondContact O-CD2 3.42Å; F216-F220 PolarHBondContact O-N 2.99Å; F216-W229 HydrophobicContact CE1-CH2 4.02Å; F216-W229 HydrophobicContact CE1-CZ3 4.37Å
217	I	85.4	Confident	84	Confident	14 Å²	14	50.9 Å²	50.9	7%	0.072	26%	0.263	C	S	.	.	I	π-helix	trans	-65	-37.8	-178.7	-69	177.9	0	0	0	110.9	V213 G221 T312 P313 L317	V213-I217 HydrophobicContact CB-CD1 3.7Å; V213-I217 HydrophobicContact CB-CG1 4.1Å; V213-I217 HydrophobicContact CG2-CD1 3.55Å; V213-I217 HydrophobicContact CG2-CG1 4.43Å; V213-I217 WeakPolarHBondContact O-CB 3.41Å; V213-I217 WeakPolarHBondContact O-CG1 3.29Å; V213-I217 PolarHBondContact O-N 3.25Å; I217-G221 WeakPolarHBondContact O-CA 3.47Å; I217-G221 PolarHBondContact O-N 3.35Å; I217-T312 HydrophobicContact CB-CG2 4.42Å; I217-T312 HydrophobicContact CD1-CG2 4.16Å; I217-P313 HydrophobicContact CD1-CG 3.97Å; I217-P313 HydrophobicContact CG2-CB 4.35Å; I217-P313 HydrophobicContact CG2-CG 3.89Å; I217-L317 HydrophobicContact CG2-CD1 3.9Å; I217-L317 HydrophobicContact CG2-CG 4.23Å
218	S	80.1	Confident	83.8	Confident	48 Å²	48	56 Å²	56	34%	0.336	28%	0.281	S	S	.	.	I	π-helix	trans	-63.7	-45.4	174.7	-60.4	0	0	0	0	112	V214 F216 G222	V214-S218 VanDerWaalsContact O-CB 3.23Å; V214-S218 WeakPolarHBondContact O-CB 3.48Å; V214-S218 PolarHBondContact O-N 3.24Å; V214-S218 PolarHBondContact O-OG 3.27Å; F216-S218 VanDerWaalsContact C-N 3.34Å; F216-S218 PolarHBondContact O-N 3.02Å; S218-G222 PolarHBondContact O-N 2.92Å
219	Y	76.7	Confident	83.6	Confident	84 Å²	84	57.2 Å²	57.2	33%	0.329	28%	0.282	S	S	.	.	I	π-helix	trans	-73.8	-46.1	-176.3	-176.3	-91	0	0	0	113.8	V215 F216 R223 I451	V215-Y219 WeakPolarHBondContact O-CB 3.41Å; V215-Y219 PolarHBondContact O-N 3.14Å; V215-Y219 VanDerWaalsContact O-N 3.08Å; F216-Y219 PolarHBondContact O-N 2.94Å; Y219-R223 VanDerWaalsContact CE1-NH1 3.33Å; Y219-R223 PolarHBondContact O-NH1 2.87Å; Y219-R223 PolarHBondContact OH-NH2 3.48Å; Y219-I451 HydrophobicContact CE2-CD1 4.2Å
220	F	79.6	Confident	83.5	Confident	101 Å²	101	57.2 Å²	57.2	44%	0.443	28%	0.282	S	S	.	.	I	π-helix	trans	-87.5	-42.7	-178.1	-69.5	-75.4	0	0	0	112.3	F216 G222 R223 G224 W229	F216-F220 HydrophobicContact CD1-CD2 4.3Å; F216-F220 AromaticContact CD2-CD2 3.47Å; F216-F220 HydrophobicContact CD2-CD2 3.47Å; F216-F220 VanDerWaalsContact CD2-CD2 3.47Å; F216-F220 AromaticContact CD2-CE2 3.54Å; F216-F220 HydrophobicContact CD2-CE2 3.54Å; F216-F220 HydrophobicContact CE1-CD2 4.27Å; F216-F220 AromaticContact CE2-CD2 3.42Å; F216-F220 HydrophobicContact CE2-CD2 3.42Å; F216-F220 VanDerWaalsContact CE2-CD2 3.42Å; F216-F220 AromaticContact CE2-CE2 3.45Å; F216-F220 HydrophobicContact CE2-CE2 3.45Å; F216-F220 VanDerWaalsContact CE2-CE2 3.45Å; F216-F220 HydrophobicContact CE2-CG 4.35Å; F216-F220 HydrophobicContact CE2-CZ 4.38Å; F216-F220 AromaticContact CG-CD2 3.92Å; F216-F220 HydrophobicContact CG-CD2 3.92Å; F216-F220 HydrophobicContact CG-CE2 4.4Å; F216-F220 AromaticContact CZ-CD2 3.84Å; F216-F220 HydrophobicContact CZ-CD2 3.84Å; F216-F220 HydrophobicContact CZ-CE2 4.26Å; F216-F220 HydrophobicContact CZ-CG 4.4Å; F216-F220 WeakPolarHBondContact O-CD2 3.42Å; F216-F220 PolarHBondContact O-N 2.99Å; F220-G222 VanDerWaalsContact C-N 3.34Å; F220-G222 PolarHBondContact O-N 2.9Å; F220-R223 PolarHBondContact O-N 3.04Å; F220-G224 PolarHBondContact O-N 3.33Å; F220-W229 HydrophobicContact CB-CZ2 4.37Å
221	G	76.2	Confident	83.5	Confident	0 Å²	0	57.2 Å²	57.2	0%	0	28%	0.282	C	S	.	.	I	π-helix	trans	-64.4	-36.7	177.7	0	0	0	0	0	113	I217 R223 G224 R226	I217-G221 WeakPolarHBondContact O-CA 3.47Å; I217-G221 PolarHBondContact O-N 3.35Å; G221-R223 VanDerWaalsContact C-N 3.29Å; G221-R223 PolarHBondContact O-N 3.36Å; G221-G224 PolarHBondContact O-N 2.92Å; G221-G224 VanDerWaalsContact O-N 3.12Å; G221-R226 WeakPolarHBondContact O-CG 3.48Å
222	G	71.2	Confident	83.7	Confident	30 Å²	30	58.7 Å²	58.7	31%	0.309	29%	0.293	S	S	.	.	H	α-helix	trans	-60.7	-33.6	175.3	0	0	0	0	0	114.2	S218 F220 R226	S218-G222 PolarHBondContact O-N 2.92Å; F220-G222 VanDerWaalsContact C-N 3.34Å; F220-G222 PolarHBondContact O-N 2.9Å; G222-R226 PolarHBondContact O-NE 3.49Å
223	R	74.6	Confident	83.9	Confident	149 Å²	149	52.9 Å²	52.9	56%	0.562	26%	0.264	S	S	*	.	H	α-helix	trans	-85.8	-22.3	173.7	-67	-178.4	176.8	87.6	-10.4	113.4	Y219 F220 G221 G448	Y219-R223 VanDerWaalsContact CE1-NH1 3.33Å; Y219-R223 PolarHBondContact O-NH1 2.87Å; Y219-R223 PolarHBondContact OH-NH2 3.48Å; F220-R223 PolarHBondContact O-N 3.04Å; G221-R223 VanDerWaalsContact C-N 3.29Å; G221-R223 PolarHBondContact O-N 3.36Å; R223-G448 PolarHBondContact NH2-O 3.14Å
224	G	75.3	Confident	84.1	Confident	34 Å²	34	51.8 Å²	51.8	35%	0.351	26%	0.257	S	S	.	.	S	Bend	trans	-79.6	-162.4	-177.4	0	0	0	0	0	114.4	F220 G221 R226	F220-G224 PolarHBondContact O-N 3.33Å; G221-G224 PolarHBondContact O-N 2.92Å; G221-G224 VanDerWaalsContact O-N 3.12Å; G224-R226 PolarHBondContact O-N 3.41Å
225	Q	81.8	Confident	84.6	Confident	52 Å²	52	53 Å²	53	24%	0.243	27%	0.265	C	S	.	.			trans	-86.7	91.5	170.9	-49.4	-164.6	42.5	0	0	108.4	P227 R228 W229 K403	Q225-P227 VanDerWaalsContact C-N 3.32Å; Q225-P227 VanDerWaalsContact O-N 3.17Å; Q225-R228 HydrophobicContact CB-CB 4.13Å; Q225-R228 HydrophobicContact CB-CG 4Å; Q225-R228 WeakPolarHBondContact O-CA 3.39Å; Q225-R228 WeakPolarHBondContact O-CB 3.34Å; Q225-R228 PolarHBondContact O-N 3.29Å; Q225-W229 PolarHBondContact O-N 2.7Å; Q225-K403 HydrophobicContact CB-CG 4.43Å; Q225-K403 VanDerWaalsContact CD-CE 3.49Å; Q225-K403 HydrophobicContact CG-CD 4.06Å; Q225-K403 HydrophobicContact CG-CG 3.86Å
226	R	85.4	Confident	85.3	Confident	47 Å²	47	49.8 Å²	49.8	18%	0.177	25%	0.245	C	C	.	.	H	α-helix	trans	-48.8	-42.9	-173.9	-60.7	-171.1	-155.6	149.3	9	114.2	G221 G222 G224 R228 W229 L230 L317 T320 Y321 D324	G221-R226 WeakPolarHBondContact O-CG 3.48Å; G222-R226 PolarHBondContact O-NE 3.49Å; G224-R226 PolarHBondContact O-N 3.41Å; R226-R228 VanDerWaalsContact C-N 3.3Å; R226-R228 PolarHBondContact O-N 3.03Å; R226-W229 PolarHBondContact O-N 3.23Å; R226-L230 WeakPolarHBondContact O-CG 3.5Å; R226-L230 PolarHBondContact O-N 3.32Å; R226-L317 HydrophobicContact CB-CB 4.25Å; R226-L317 HydrophobicContact CG-CB 4.42Å; R226-L317 HydrophobicContact CG-CD2 4.41Å; R226-T320 PolarHBondContact NH1-O 3.2Å; R226-T320 PolarHBondContact NH1-OG1 2.64Å; R226-Y321 HydrophobicContact CB-CD2 3.97Å; R226-Y321 HydrophobicContact CB-CG 4.41Å; R226-D324 IonicContact CZ-OD2 3.56Å; R226-D324 IonicContact NH1-OD2 2.7Å; R226-D324 PolarHBondContact NH1-OD2 2.86Å; R226-D324 IonicContact NH2-OD2 3.64Å; R226-D324 PolarHBondContact NH2-OD2 3.15Å
227	P	86.7	Confident	85.9	Confident	2 Å²	2	44.6 Å²	44.6	1%	0.013	22%	0.222	C	C	.	.	H	α-helix	trans	-61.8	-28.7	174.8	-25.1	36.2	0	0	0	115.3	Q225 A231 Y321 F401	Q225-P227 VanDerWaalsContact C-N 3.32Å; Q225-P227 VanDerWaalsContact O-N 3.17Å; P227-A231 WeakPolarHBondContact O-CB 3.42Å; P227-A231 PolarHBondContact O-N 3.42Å; P227-Y321 HydrophobicContact CG-CD2 4.13Å; P227-Y321 HydrophobicContact CG-CE1 4.08Å; P227-Y321 HydrophobicContact CG-CE2 3.66Å; P227-F401 HydrophobicContact CB-CB 3.82Å; P227-F401 HydrophobicContact CG-CB 4.09Å
228	R	88.8	Confident	86.4	Confident	125 Å²	125	44.1 Å²	44.1	47%	0.472	22%	0.22	S	C	.	.	H	α-helix	trans	-77	-36.3	174.5	-64.6	-171	178.3	-171.2	-3.7	112.3	Q225 R226 L230 A231 V232	Q225-R228 HydrophobicContact CB-CB 4.13Å; Q225-R228 HydrophobicContact CB-CG 4Å; Q225-R228 WeakPolarHBondContact O-CA 3.39Å; Q225-R228 WeakPolarHBondContact O-CB 3.34Å; Q225-R228 PolarHBondContact O-N 3.29Å; R226-R228 VanDerWaalsContact C-N 3.3Å; R226-R228 PolarHBondContact O-N 3.03Å; R228-L230 VanDerWaalsContact C-N 3.31Å; R228-A231 PolarHBondContact O-N 2.69Å; R228-V232 WeakPolarHBondContact O-CB 3.46Å; R228-V232 VanDerWaalsContact O-CG2 3.3Å; R228-V232 WeakPolarHBondContact O-CG2 3.48Å; R228-V232 PolarHBondContact O-N 2.91Å
229	W	90.6	Very high	87.2	Confident	78 Å²	78	45.8 Å²	45.8	30%	0.295	23%	0.228	S	C	.	.	H	α-helix	trans	-65.8	-36.9	172.6	-77	96.1	0	0	0	111.5	F216 F220 Q225 R226 G233 L317	F216-W229 HydrophobicContact CE1-CH2 4.02Å; F216-W229 HydrophobicContact CE1-CZ3 4.37Å; F220-W229 HydrophobicContact CB-CZ2 4.37Å; Q225-W229 PolarHBondContact O-N 2.7Å; R226-W229 PolarHBondContact O-N 3.23Å; W229-G233 PolarHBondContact O-N 2.7Å; W229-L317 HydrophobicContact CB-CD1 3.44Å; W229-L317 VanDerWaalsContact CB-CD1 3.44Å; W229-L317 HydrophobicContact CG-CD1 4.05Å
230	L	90.7	Very high	88.1	Confident	1 Å²	1	41.8 Å²	41.8	1%	0.005	21%	0.213	C	C	.	.	H	α-helix	trans	-61.3	-48.8	169.4	-74.5	162.4	0	0	0	111.9	F162 M166 R226 R228 G233 G234 P313 I314 L317	F162-L230 HydrophobicContact CE2-CD1 4.24Å; F162-L230 HydrophobicContact CZ-CD1 3.84Å; M166-L230 HydrophobicContact CE-CD2 4.26Å; M166-L230 HydrophobicContact SD-CD1 3.91Å; M166-L230 HydrophobicContact SD-CD2 3.98Å; R226-L230 WeakPolarHBondContact O-CG 3.5Å; R226-L230 PolarHBondContact O-N 3.32Å; R228-L230 VanDerWaalsContact C-N 3.31Å; L230-G233 PolarHBondContact O-N 3Å; L230-G234 PolarHBondContact O-N 2.9Å; L230-P313 HydrophobicContact CD2-CB 4.19Å; L230-P313 VanDerWaalsContact CD2-O 3.29Å; L230-P313 WeakPolarHBondContact CD2-O 3.48Å; L230-I314 HydrophobicContact CD2-CG1 4.43Å; L230-L317 HydrophobicContact CG-CB 4.44Å
231	A	91.8	Very high	88.9	Confident	0 Å²	0	37 Å²	37	0%	0	19%	0.192	C	C	.	.	H	α-helix	trans	-62.4	-43.8	178.6	0	0	0	0	0	112.7	P227 R228 G234 V235 M398 F399	P227-A231 WeakPolarHBondContact O-CB 3.42Å; P227-A231 PolarHBondContact O-N 3.42Å; R228-A231 PolarHBondContact O-N 2.69Å; A231-G234 PolarHBondContact O-N 2.85Å; A231-V235 WeakPolarHBondContact O-CG2 3.36Å; A231-V235 PolarHBondContact O-N 3.41Å; A231-M398 HydrophobicContact CB-CB 3.79Å; A231-F399 HydrophobicContact CB-CB 4.49Å; A231-F399 HydrophobicContact CB-CD1 3.61Å; A231-F399 HydrophobicContact CB-CD2 3.77Å; A231-F399 HydrophobicContact CB-CE1 3.61Å; A231-F399 HydrophobicContact CB-CE2 3.79Å; A231-F399 HydrophobicContact CB-CG 3.68Å; A231-F399 HydrophobicContact CB-CZ 3.7Å
232	V	93.3	Very high	89.9	Confident	72 Å²	72	38.8 Å²	38.8	44%	0.436	21%	0.207	S	C	.	.	H	α-helix	trans	-64.1	-44.1	175.3	170.4	0	0	0	0	111.2	R228 G234 V235 V236 F399	R228-V232 WeakPolarHBondContact O-CB 3.46Å; R228-V232 VanDerWaalsContact O-CG2 3.3Å; R228-V232 WeakPolarHBondContact O-CG2 3.48Å; R228-V232 PolarHBondContact O-N 2.91Å; V232-G234 VanDerWaalsContact C-N 3.29Å; V232-G234 PolarHBondContact O-N 3.5Å; V232-V235 PolarHBondContact O-N 3.29Å; V232-V235 VanDerWaalsContact O-N 3.08Å; V232-V236 WeakPolarHBondContact O-CG2 3.48Å; V232-V236 PolarHBondContact O-N 2.75Å; V232-F399 HydrophobicContact CG2-CE1 4.05Å; V232-F399 HydrophobicContact CG2-CZ 4.22Å
233	G	93.6	Very high	91.1	Very high	5 Å²	5	39.3 Å²	39.3	5%	0.052	20%	0.202	C	C	.	.	H	α-helix	trans	-56.6	-43.7	173.7	0	0	0	0	0	112.2	W229 L230 V235 V236 I237 G310	W229-G233 PolarHBondContact O-N 2.7Å; L230-G233 PolarHBondContact O-N 3Å; G233-V235 PolarHBondContact O-N 2.95Å; G233-V236 PolarHBondContact O-N 2.92Å; G233-I237 WeakPolarHBondContact O-CG1 3.36Å; G233-I237 PolarHBondContact O-N 3.13Å; G233-G310 CarbonylContact C-O 3.29Å; G233-G310 VanDerWaalsContact C-O 3.29Å; G233-G310 VanDerWaalsContact CA-O 3.32Å; G233-G310 WeakPolarHBondContact CA-O 3.25Å; G233-G310 CarbonylContact O-C 3.55Å; G233-G310 VanDerWaalsContact O-CA 3.23Å; G233-G310 WeakPolarHBondContact O-CA 3.37Å
234	G	93.5	Very high	92.1	Very high	0 Å²	0	32.2 Å²	32.2	0%	0	18%	0.175	C	C	.	.	H	α-helix	trans	-57.3	-43.6	172.2	0	0	0	0	0	113.6	L230 A231 V232 V236 I237 A238 I395	L230-G234 PolarHBondContact O-N 2.9Å; A231-G234 PolarHBondContact O-N 2.85Å; V232-G234 VanDerWaalsContact C-N 3.29Å; V232-G234 PolarHBondContact O-N 3.5Å; G234-V236 VanDerWaalsContact C-N 3.31Å; G234-V236 PolarHBondContact O-N 2.76Å; G234-I237 PolarHBondContact O-N 2.89Å; G234-A238 PolarHBondContact O-N 2.92Å; G234-I395 WeakPolarHBondContact O-CD1 3.5Å
235	V	95.4	Very high	93.1	Very high	51 Å²	51	30.8 Å²	30.8	31%	0.309	16%	0.16	S	C	.	.	H	α-helix	trans	-61.9	-41.8	176.4	175.5	0	0	0	0	110.5	A231 V232 G233 I237 A238 V239 I395 F399	A231-V235 WeakPolarHBondContact O-CG2 3.36Å; A231-V235 PolarHBondContact O-N 3.41Å; V232-V235 PolarHBondContact O-N 3.29Å; V232-V235 VanDerWaalsContact O-N 3.08Å; G233-V235 PolarHBondContact O-N 2.95Å; V235-I237 VanDerWaalsContact C-N 3.33Å; V235-I237 PolarHBondContact O-N 3.14Å; V235-A238 PolarHBondContact O-N 3.06Å; V235-V239 HydrophobicContact CG1-CG2 4.31Å; V235-V239 WeakPolarHBondContact O-CG2 3.28Å; V235-V239 PolarHBondContact O-N 3.15Å; V235-I395 HydrophobicContact CG2-CD1 4.33Å; V235-I395 HydrophobicContact CG2-CG2 3.71Å; V235-F399 HydrophobicContact CG2-CE2 4.2Å; V235-F399 HydrophobicContact CG2-CZ 4.33Å
236	V	96.3	Very high	93.6	Very high	43 Å²	43	31.4 Å²	31.4	26%	0.261	17%	0.165	S	C	.	.	H	α-helix	trans	-63.8	-37.5	176.8	179.6	0	0	0	0	111.5	V232 G233 G234 G240 L306	V232-V236 WeakPolarHBondContact O-CG2 3.48Å; V232-V236 PolarHBondContact O-N 2.75Å; G233-V236 PolarHBondContact O-N 2.92Å; G234-V236 VanDerWaalsContact C-N 3.31Å; G234-V236 PolarHBondContact O-N 2.76Å; V236-G240 PolarHBondContact O-N 3.42Å; V236-L306 HydrophobicContact CG1-CB 4.17Å; V236-L306 HydrophobicContact CG1-CD2 4.01Å; V236-L306 VanDerWaalsContact CG1-O 3.31Å; V236-L306 WeakPolarHBondContact CG1-O 3.4Å
237	I	96.3	Very high	93.9	Very high	1 Å²	1	29.2 Å²	29.2	1%	0.005	16%	0.156	C	C	.	.	H	α-helix	trans	-63.1	-47.2	171.4	-61.8	165	0	0	0	111	Q173 M176 G233 G234 V235 V239 G240 A241 I307 G310 I314 M391	Q173-I237 HydrophobicContact CB-CD1 4.42Å; Q173-I237 HydrophobicContact CG-CD1 4.17Å; M176-I237 HydrophobicContact CE-CG2 3.76Å; G233-I237 WeakPolarHBondContact O-CG1 3.36Å; G233-I237 PolarHBondContact O-N 3.13Å; G234-I237 PolarHBondContact O-N 2.89Å; V235-I237 VanDerWaalsContact C-N 3.33Å; V235-I237 PolarHBondContact O-N 3.14Å; I237-V239 VanDerWaalsContact C-N 3.34Å; I237-V239 PolarHBondContact O-N 2.92Å; I237-G240 PolarHBondContact O-N 2.91Å; I237-A241 WeakPolarHBondContact O-CB 3.28Å; I237-A241 PolarHBondContact O-N 2.66Å; I237-I307 HydrophobicContact CG2-CG2 4.37Å; I237-G310 VanDerWaalsContact CG1-C 3.5Å; I237-I314 HydrophobicContact CD1-CD1 3.55Å; I237-M391 HydrophobicContact CB-CE 4.15Å; I237-M391 HydrophobicContact CD1-CE 3.52Å; I237-M391 HydrophobicContact CG1-CE 4.46Å; I237-M391 HydrophobicContact CG2-CE 4.07Å
238	A	96.1	Very high	94.1	Very high	3 Å²	3	30.2 Å²	30.2	3%	0.025	16%	0.161	C	C	.	.	H	α-helix	trans	-62.9	-40.7	-177.7	0	0	0	0	0	112.2	G234 V235 A242 S388 M391 L392	G234-A238 PolarHBondContact O-N 2.92Å; V235-A238 PolarHBondContact O-N 3.06Å; A238-A242 PolarHBondContact O-N 3.1Å; A238-S388 WeakPolarHBondContact CA-OG 3.33Å; A238-S388 PolarHBondContact O-OG 2.81Å; A238-M391 HydrophobicContact CB-CB 4.47Å; A238-L392 HydrophobicContact CB-CD1 4.44Å; A238-L392 HydrophobicContact CB-CD2 3.89Å; A238-L392 HydrophobicContact CB-CG 3.86Å
239	V	96.8	Very high	94.1	Very high	84 Å²	84	29.6 Å²	29.6	51%	0.509	16%	0.162	S	C	.	.	H	α-helix	trans	-66.2	-45	173.1	171.8	0	0	0	0	111.1	V235 I237 A241 A242 L243	V235-V239 HydrophobicContact CG1-CG2 4.31Å; V235-V239 WeakPolarHBondContact O-CG2 3.28Å; V235-V239 PolarHBondContact O-N 3.15Å; I237-V239 VanDerWaalsContact C-N 3.34Å; I237-V239 PolarHBondContact O-N 2.92Å; V239-A241 PolarHBondContact O-N 2.85Å; V239-A242 PolarHBondContact O-N 3.34Å; V239-L243 WeakPolarHBondContact O-CB 3.26Å; V239-L243 PolarHBondContact O-N 2.96Å
240	G	97.1	Very high	94.1	Very high	0 Å²	0	29.7 Å²	29.7	0%	0	17%	0.167	C	C	.	.	H	α-helix	trans	-62.1	-39.6	176.6	0	0	0	0	0	113.1	V236 I237 L243 F244 A303	V236-G240 PolarHBondContact O-N 3.42Å; I237-G240 PolarHBondContact O-N 2.91Å; G240-L243 PolarHBondContact O-N 3.07Å; G240-F244 PolarHBondContact O-N 2.92Å; G240-A303 WeakPolarHBondContact O-CB 3.41Å
241	A	96.7	Very high	93.8	Very high	0 Å²	0	30.1 Å²	30.1	0%	0	17%	0.17	C	C	.	.	H	α-helix	trans	-66.5	-40.6	175.5	0	0	0	0	0	112.5	M176 I237 V239 F244 S245	M176-A241 HydrophobicContact CE-CB 4.17Å; M176-A241 HydrophobicContact SD-CB 3.57Å; M176-A241 VanDerWaalsContact SD-CB 3.57Å; I237-A241 WeakPolarHBondContact O-CB 3.28Å; I237-A241 PolarHBondContact O-N 2.66Å; V239-A241 PolarHBondContact O-N 2.85Å; A241-F244 PolarHBondContact O-N 2.93Å; A241-S245 PolarHBondContact O-N 3.41Å
242	A	95.8	Very high	93.2	Very high	38 Å²	38	34.1 Å²	34.1	31%	0.314	20%	0.196	S	C	.	.	H	α-helix	trans	-64.4	-41.5	172.7	0	0	0	0	0	111.5	A238 V239 F244 S245 L246 L385	A238-A242 PolarHBondContact O-N 3.1Å; V239-A242 PolarHBondContact O-N 3.34Å; A242-F244 VanDerWaalsContact C-N 3.32Å; A242-F244 PolarHBondContact O-N 2.87Å; A242-S245 PolarHBondContact O-N 3.35Å; A242-S245 VanDerWaalsContact O-N 3.15Å; A242-S245 PolarHBondContact O-OG 3.27Å; A242-L246 PolarHBondContact O-N 3.45Å; A242-L246 VanDerWaalsContact O-N 3.09Å; A242-L385 HydrophobicContact CB-CD2 4.39Å
243	L	96.4	Very high	92.3	Very high	41 Å²	41	35 Å²	35	22%	0.215	20%	0.204	C	C	.	.	H	α-helix	trans	-63.1	-36.4	174.6	-171.1	65.5	0	0	0	112.1	V239 G240 S245 L246 P247 L299 C302 A303 L306	V239-L243 WeakPolarHBondContact O-CB 3.26Å; V239-L243 PolarHBondContact O-N 2.96Å; G240-L243 PolarHBondContact O-N 3.07Å; L243-S245 VanDerWaalsContact C-N 3.28Å; L243-S245 PolarHBondContact O-N 2.75Å; L243-L246 HydrophobicContact CD1-CB 4.47Å; L243-L246 HydrophobicContact CD1-CD2 3.84Å; L243-L246 VanDerWaalsContact O-CB 3.29Å; L243-L246 WeakPolarHBondContact O-CB 3.27Å; L243-L246 PolarHBondContact O-N 3.29Å; L243-L246 VanDerWaalsContact O-N 3.13Å; L243-P247 WeakPolarHBondContact O-CD 3.45Å; L243-L299 HydrophobicContact CD1-CD2 3.9Å; L243-C302 HydrophobicContact CD2-CB 4.31Å; L243-A303 HydrophobicContact CB-CB 4.06Å; L243-A303 HydrophobicContact CD2-CB 4.17Å; L243-A303 HydrophobicContact CG-CB 4.09Å; L243-L306 HydrophobicContact CD2-CD1 3.86Å
244	F	95.9	Very high	91.3	Very high	0 Å²	0	37.4 Å²	37.4	0%	0	21%	0.211	C	C	.	.	H	α-helix	trans	-65.1	-32	174.8	-159.1	-86.3	0	0	0	112.2	L181 I188 G240 A241 A242 F300 A303 Q304 W380 F384	L181-F244 HydrophobicContact CD1-CE1 4.11Å; L181-F244 HydrophobicContact CD1-CE2 4.28Å; L181-F244 HydrophobicContact CD1-CZ 3.62Å; I188-F244 HydrophobicContact CD1-CE1 3.72Å; I188-F244 HydrophobicContact CD1-CZ 4.05Å; G240-F244 PolarHBondContact O-N 2.92Å; A241-F244 PolarHBondContact O-N 2.93Å; A242-F244 VanDerWaalsContact C-N 3.32Å; A242-F244 PolarHBondContact O-N 2.87Å; F244-F300 HydrophobicContact CD1-CD1 4.05Å; F244-F300 HydrophobicContact CD1-CE1 4.13Å; F244-F300 HydrophobicContact CD2-CB 4.45Å; F244-F300 AromaticContact CD2-CD1 3.78Å; F244-F300 HydrophobicContact CD2-CD1 3.78Å; F244-F300 AromaticContact CE1-CD1 3.81Å; F244-F300 HydrophobicContact CE1-CD1 3.81Å; F244-F300 AromaticContact CE1-CE1 3.87Å; F244-F300 HydrophobicContact CE1-CE1 3.87Å; F244-F300 HydrophobicContact CE2-CB 3.96Å; F244-F300 AromaticContact CE2-CD1 3.5Å; F244-F300 HydrophobicContact CE2-CD1 3.5Å; F244-F300 HydrophobicContact CE2-CE1 4.38Å; F244-F300 HydrophobicContact CE2-CG 4.12Å; F244-F300 HydrophobicContact CG-CD1 4.03Å; F244-F300 AromaticContact CZ-CD1 3.53Å; F244-F300 HydrophobicContact CZ-CD1 3.53Å; F244-F300 HydrophobicContact CZ-CE1 4Å; F244-F300 HydrophobicContact CZ-CG 4.31Å; F244-F300 WeakPolarHBondContact O-CE1 3.35Å; F244-A303 HydrophobicContact CB-CB 3.8Å; F244-A303 HydrophobicContact CD2-CB 3.86Å; F244-A303 HydrophobicContact CG-CB 4.32Å; F244-Q304 HydrophobicContact CD2-CG 3.92Å; F244-Q304 HydrophobicContact CE2-CG 3.68Å; F244-W380 HydrophobicContact CD1-CZ3 4.42Å; F244-W380 HydrophobicContact CE1-CZ3 4.43Å; F244-F384 HydrophobicContact CD1-CD1 4.07Å; F244-F384 AromaticContact CD1-CD2 3.65Å; F244-F384 HydrophobicContact CD1-CD2 3.65Å; F244-F384 AromaticContact CD1-CE1 3.83Å; F244-F384 HydrophobicContact CD1-CE1 3.83Å; F244-F384 AromaticContact CD1-CE2 3.38Å; F244-F384 HydrophobicContact CD1-CE2 3.38Å; F244-F384 HydrophobicContact CD1-CG 4.01Å; F244-F384 AromaticContact CD1-CZ 3.48Å; F244-F384 HydrophobicContact CD1-CZ 3.48Å; F244-F384 VanDerWaalsContact CD1-CZ 3.48Å; F244-F384 HydrophobicContact CE1-CD2 4.19Å; F244-F384 HydrophobicContact CE1-CE1 4.14Å; F244-F384 AromaticContact CE1-CE2 3.45Å; F244-F384 HydrophobicContact CE1-CE2 3.45Å; F244-F384 VanDerWaalsContact CE1-CE2 3.45Å; F244-F384 AromaticContact CE1-CZ 3.42Å; F244-F384 HydrophobicContact CE1-CZ 3.42Å; F244-F384 VanDerWaalsContact CE1-CZ 3.42Å; F244-F384 HydrophobicContact CG-CD1 4.48Å; F244-F384 HydrophobicContact CG-CE1 4.36Å; F244-F384 HydrophobicContact CG-CZ 4.4Å; F244-F384 HydrophobicContact CZ-CZ 4.32Å
245	S	95.3	Very high	89.7	Confident	3 Å²	3	45.2 Å²	45.2	2%	0.021	25%	0.248	C	C	.	.	H	α-helix	trans	-80.4	-15.5	172.9	66.3	0	0	0	0	114.3	A241 A242 L243 H248 F249 L385	A241-S245 PolarHBondContact O-N 3.41Å; A242-S245 PolarHBondContact O-N 3.35Å; A242-S245 VanDerWaalsContact O-N 3.15Å; A242-S245 PolarHBondContact O-OG 3.27Å; L243-S245 VanDerWaalsContact C-N 3.28Å; L243-S245 PolarHBondContact O-N 2.75Å; S245-H248 PolarHBondContact O-N 3.45Å; S245-F249 WeakPolarHBondContact O-CD2 3.28Å; S245-L385 VanDerWaalsContact OG-CD2 3.28Å; S245-L385 WeakPolarHBondContact OG-CD2 3.34Å
246	L	93.4	Very high	88.1	Confident	66 Å²	66	43.9 Å²	43.9	35%	0.346	24%	0.239	S	C	.	.	H	α-helix	trans	-58.2	-41.9	-173.4	-176.4	64.4	0	0	0	114.1	A242 L243 H248 F249 I250	A242-L246 PolarHBondContact O-N 3.45Å; A242-L246 VanDerWaalsContact O-N 3.09Å; L243-L246 HydrophobicContact CD1-CB 4.47Å; L243-L246 HydrophobicContact CD1-CD2 3.84Å; L243-L246 VanDerWaalsContact O-CB 3.29Å; L243-L246 WeakPolarHBondContact O-CB 3.27Å; L243-L246 PolarHBondContact O-N 3.29Å; L243-L246 VanDerWaalsContact O-N 3.13Å; L246-H248 PolarHBondContact O-N 2.93Å; L246-H248 VanDerWaalsContact O-N 3.09Å; L246-F249 PolarHBondContact O-N 2.76Å; L246-I250 HydrophobicContact CD1-CG2 3.98Å; L246-I250 HydrophobicContact CG-CD1 4.49Å; L246-I250 HydrophobicContact CG-CG2 4.18Å; L246-I250 PolarHBondContact O-N 2.94Å
247	P	92	Very high	85.9	Confident	0 Å²	0	48.7 Å²	48.7	0%	0	26%	0.259	C	S	.	.	H	α-helix	trans	-48.8	-37.7	178.2	-33.9	40.1	0	0	0	114.5	Y192 L243 F249 I250 S251 L299 F300	Y192-P247 HydrophobicContact CE1-CB 4.03Å; Y192-P247 VanDerWaalsContact OH-CB 3.23Å; Y192-P247 WeakPolarHBondContact OH-CB 3.33Å; Y192-P247 PolarHBondContact OH-O 3.4Å; L243-P247 WeakPolarHBondContact O-CD 3.45Å; P247-F249 VanDerWaalsContact C-N 3.29Å; P247-F249 PolarHBondContact O-N 3.43Å; P247-I250 PolarHBondContact O-N 2.95Å; P247-S251 VanDerWaalsContact O-CB 3.23Å; P247-S251 WeakPolarHBondContact O-CB 3.46Å; P247-S251 PolarHBondContact O-N 3.43Å; P247-S251 PolarHBondContact O-OG 3.08Å; P247-S251 VanDerWaalsContact O-OG 3.12Å; P247-L299 HydrophobicContact CG-CB 4.09Å; P247-L299 HydrophobicContact CG-CD1 4.25Å; P247-F300 HydrophobicContact CB-CE1 4.25Å; P247-F300 HydrophobicContact CB-CE2 4.33Å; P247-F300 HydrophobicContact CB-CZ 3.84Å; P247-F300 HydrophobicContact CG-CD1 4.24Å; P247-F300 HydrophobicContact CG-CE1 3.83Å; P247-F300 HydrophobicContact CG-CE2 4.25Å; P247-F300 HydrophobicContact CG-CZ 3.83Å
248	H	89.8	Confident	83.5	Confident	24 Å²	24	53.7 Å²	53.7	11%	0.111	28%	0.282	C	S	.	.	H	α-helix	trans	-58.7	-39.1	178.1	174.3	45.5	0	0	0	112.9	Y192 S245 L246 S251 D362 W380 W381	Y192-H248 PolarHBondContact OH-N 3.45Å; Y192-H248 VanDerWaalsContact OH-N 3.16Å; S245-H248 PolarHBondContact O-N 3.45Å; L246-H248 PolarHBondContact O-N 2.93Å; L246-H248 VanDerWaalsContact O-N 3.09Å; H248-S251 PolarHBondContact O-OG 2.91Å; H248-D362 IonicContact CE1-OD1 2.94Å; H248-D362 PolarHBondContact CE1-OD1 2.99Å; H248-D362 IonicContact NE2-OD1 3.88Å; H248-W380 HydrophobicContact CB-CH2 4.02Å; H248-W380 HydrophobicContact CB-CZ2 3.67Å; H248-W381 HydrophobicContact CB-CB 4.15Å; H248-W381 HydrophobicContact CB-CG 4.18Å; H248-W381 AromaticContact CD2-CD1 3.33Å; H248-W381 AromaticContact CD2-CD2 3.48Å; H248-W381 VanDerWaalsContact CD2-CD2 3.48Å; H248-W381 AromaticContact CD2-CE2 3.41Å; H248-W381 VanDerWaalsContact CD2-CE2 3.41Å; H248-W381 AromaticContact CD2-CG 3.46Å; H248-W381 VanDerWaalsContact CD2-CG 3.46Å; H248-W381 AromaticContact CD2-NE1 3.31Å; H248-W381 PolarHBondContact CD2-NE1 3.45Å; H248-W381 VanDerWaalsContact CD2-NE1 3.31Å; H248-W381 AromaticContact CE1-NE1 3.66Å; H248-W381 AromaticContact CG-CD1 3.56Å; H248-W381 AromaticContact CG-CG 3.85Å; H248-W381 AromaticContact CG-NE1 3.91Å; H248-W381 AromaticContact ND1-CD1 3.97Å; H248-W381 AromaticContact NE2-CD1 3.64Å; H248-W381 AromaticContact NE2-CD2 3.95Å; H248-W381 AromaticContact NE2-CE2 3.34Å; H248-W381 VanDerWaalsContact NE2-CE2 3.34Å; H248-W381 AromaticContact NE2-CZ2 3.76Å; H248-W381 AromaticContact NE2-NE1 3.13Å; H248-W381 PolarHBondContact NE2-NE1 3.41Å; H248-W381 VanDerWaalsContact NE2-NE1 3.13Å
249	F	90.1	Very high	80.9	Confident	112 Å²	112	55 Å²	55	49%	0.491	29%	0.288	S	S	.	.	H	α-helix	trans	-88.3	-12.3	-173.7	-56.2	-72.5	0	0	0	114	S245 L246 P247 W381 L385	S245-F249 WeakPolarHBondContact O-CD2 3.28Å; L246-F249 PolarHBondContact O-N 2.76Å; P247-F249 VanDerWaalsContact C-N 3.29Å; P247-F249 PolarHBondContact O-N 3.43Å; F249-W381 HydrophobicContact CE1-CE3 4.49Å; F249-W381 HydrophobicContact CE1-CZ3 4.36Å; F249-W381 HydrophobicContact CE2-CE3 4.36Å; F249-W381 HydrophobicContact CZ-CD2 4.29Å; F249-W381 AromaticContact CZ-CE3 3.66Å; F249-W381 HydrophobicContact CZ-CE3 3.66Å; F249-W381 HydrophobicContact CZ-CH2 4.43Å; F249-W381 AromaticContact CZ-CZ3 3.76Å; F249-W381 HydrophobicContact CZ-CZ3 3.76Å; F249-L385 HydrophobicContact CE2-CD1 4.05Å; F249-L385 HydrophobicContact CZ-CD1 3.91Å
250	I	89.1	Confident	78	Confident	79 Å²	79	57.2 Å²	57.2	41%	0.405	30%	0.297	S	S	.	.	H	α-helix	trans	-106.7	-29	177.3	64.3	173.2	0	0	0	112.6	L246 P247 Y296 L299	L246-I250 HydrophobicContact CD1-CG2 3.98Å; L246-I250 HydrophobicContact CG-CD1 4.49Å; L246-I250 HydrophobicContact CG-CG2 4.18Å; L246-I250 PolarHBondContact O-N 2.94Å; P247-I250 PolarHBondContact O-N 2.95Å; I250-Y296 HydrophobicContact CD1-CD1 4.2Å; I250-Y296 HydrophobicContact CD1-CE1 4.05Å; I250-Y296 HydrophobicContact CG1-CD1 4.49Å; I250-Y296 HydrophobicContact CG1-CE1 4.11Å; I250-L299 HydrophobicContact CD1-CD1 3.52Å
251	S	84.3	Confident	75.2	Confident	10 Å²	10	63.4 Å²	63.4	7%	0.07	34%	0.34	C	S	.	.	S	Bend	trans	-65.9	150.6	172	73.2	0	0	0	0	110.4	P247 H248	P247-S251 VanDerWaalsContact O-CB 3.23Å; P247-S251 WeakPolarHBondContact O-CB 3.46Å; P247-S251 PolarHBondContact O-N 3.43Å; P247-S251 PolarHBondContact O-OG 3.08Å; P247-S251 VanDerWaalsContact O-OG 3.12Å; H248-S251 PolarHBondContact O-OG 2.91Å
252	P	79.6	Confident	72.4	Confident	84 Å²	84	68.9 Å²	68.9	55%	0.545	38%	0.378	S	S	.	.	P	Polyproline II helix	trans	-56.3	150.1	171.1	23.5	-33.4	0	0	0	111.3	R191	R191-P252 PolarHBondContact NH2-O 3.34Å
253	P	74.3	Confident	69.9	Low	92 Å²	92	68.4 Å²	68.4	60%	0.597	37%	0.374	S	S	*	.	P	Polyproline II helix	trans	-56.9	144.4	179.4	25.3	-34.8	0	0	0	110.6	Q255	P253-Q255 VanDerWaalsContact C-N 3.32Å; P253-Q255 PolarHBondContact O-N 2.73Å
254	Y	72.9	Confident	67.6	Low	54 Å²	54	68.4 Å²	68.4	21%	0.212	38%	0.384	C	S	.	.			trans	-75.9	87.5	-177.8	-176.9	-116.3	0	0	0	110.1	I256 Y360 V361 R375 V377	Y254-I256 HydrophobicContact CD1-CG1 4.45Å; Y254-I256 HydrophobicContact CE1-CG1 3.95Å; Y254-I256 PolarHBondContact O-N 2.99Å; Y254-Y360 HydrophobicContact CD1-CE2 4.35Å; Y254-Y360 VanDerWaalsContact CD1-OH 3.29Å; Y254-Y360 WeakPolarHBondContact CD1-OH 3.47Å; Y254-Y360 PolarHBondContact O-OH 3.35Å; Y254-V361 HydrophobicContact CD1-CG1 4.03Å; Y254-V361 HydrophobicContact CG-CG1 4.5Å; Y254-R375 WeakPolarHBondContact CE1-O 3.47Å; Y254-R375 PolarHBondContact OH-O 3.48Å; Y254-V377 HydrophobicContact CD1-CB 4.14Å; Y254-V377 HydrophobicContact CD1-CG2 3.97Å; Y254-V377 HydrophobicContact CE1-CB 4.04Å; Y254-V377 HydrophobicContact CE1-CG2 3.49Å; Y254-V377 VanDerWaalsContact CE1-CG2 3.49Å; Y254-V377 HydrophobicContact CE2-CG2 4.33Å
255	Q	60.6	Low	65.5	Low	164 Å²	164	74.1 Å²	74.1	77%	0.766	41%	0.411	S	S	*	.			trans	-72.4	104.6	171.1	-65.3	-173.7	3.7	0	0	108.7	P253 Q257	P253-Q255 VanDerWaalsContact C-N 3.32Å; P253-Q255 PolarHBondContact O-N 2.73Å; Q255-Q257 PolarHBondContact O-N 3.36Å
256	I	61.5	Low	63.7	Low	24 Å²	24	79.9 Å²	79.9	12%	0.123	44%	0.437	C	S	.	.			trans	-59.7	125.8	150.9	-58.9	150.1	0	0	0	105.6	Y254 E258 Y360 V367 I369	Y254-I256 HydrophobicContact CD1-CG1 4.45Å; Y254-I256 HydrophobicContact CE1-CG1 3.95Å; Y254-I256 PolarHBondContact O-N 2.99Å; I256-E258 HydrophobicContact CG2-CG 4.01Å; I256-E258 PolarHBondContact O-N 3.43Å; I256-Y360 HydrophobicContact CD1-CE2 3.66Å; I256-Y360 WeakPolarHBondContact CD1-OH 3.23Å; I256-Y360 HydrophobicContact CG1-CE2 4.39Å; I256-Y360 WeakPolarHBondContact CG1-OH 3.41Å; I256-V367 HydrophobicContact CD1-CB 4.47Å; I256-V367 HydrophobicContact CD1-CG1 3.55Å; I256-V367 HydrophobicContact CD1-CG2 4.13Å; I256-I369 HydrophobicContact CD1-CD1 3.9Å; I256-I369 HydrophobicContact CG2-CD1 3.95Å
257	Q	49.1	Very low	62.5	Low	144 Å²	144	78.4 Å²	78.4	67%	0.673	44%	0.438	S	S	*	.			trans	-76.7	67.7	174.3	-165.1	159.7	-4.6	0	0	109.8	Q255 M259	Q255-Q257 PolarHBondContact O-N 3.36Å; Q257-M259 PolarHBondContact O-N 2.96Å
258	E	46.5	Very low	61.9	Low	106 Å²	106	79 Å²	79	50%	0.495	44%	0.441	S	S	.	.			trans	-64.7	91.7	157.6	-71.1	-169.4	-177.9	0	0	107	I256 N260	I256-E258 HydrophobicContact CG2-CG 4.01Å; I256-E258 PolarHBondContact O-N 3.43Å; E258-N260 PolarHBondContact O-N 2.93Å
259	M	41.8	Very low	61.6	Low	30 Å²	30	78.8 Å²	78.8	15%	0.148	44%	0.442	C	S	.	.			trans	-47.3	117	166.4	-67.1	163	175.6	0	0	107.8	Q257 S261 A263 E266 E598	Q257-M259 PolarHBondContact O-N 2.96Å; M259-S261 PolarHBondContact O-N 2.94Å; M259-A263 HydrophobicContact CB-CB 4.46Å; M259-E266 HydrophobicContact CE-CB 4.14Å; M259-E266 HydrophobicContact SD-CB 3.9Å; M259-E598 WeakPolarHBondContact CE-OE1 3.4Å
260	N	34.9	Very low	61.2	Low	130 Å²	130	78.5 Å²	78.5	70%	0.695	44%	0.442	S	S	*	.			trans	-49.4	140.4	-178.6	-76.7	-57.2	0	0	0	109.7	E258 S262 A263	E258-N260 PolarHBondContact O-N 2.93Å; N260-S262 PolarHBondContact O-N 2.7Å; N260-A263 WeakPolarHBondContact O-CB 3.48Å; N260-A263 PolarHBondContact O-N 2.92Å
261	S	39.4	Very low	60.2	Low	130 Å²	130	78.2 Å²	78.2	91%	0.909	45%	0.447	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.9	7.7	-170.6	-47	0	0	0	0	116.2	M259	M259-S261 PolarHBondContact O-N 2.94Å
262	S	36.9	Very low	59.2	Low	116 Å²	116	84.2 Å²	84.2	81%	0.811	47%	0.474	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.5	-15.8	165.4	48.8	0	0	0	0	113.8	N260 G264	N260-S262 PolarHBondContact O-N 2.7Å; S262-G264 PolarHBondContact O-N 2.95Å
263	A	44.9	Very low	57.8	Low	27 Å²	27	87.8 Å²	87.8	22%	0.223	49%	0.489	C	S	.	.			trans	-98.5	46.5	-175.7	0	0	0	0	0	112.9	M259 N260 H265 E266	M259-A263 HydrophobicContact CB-CB 4.46Å; N260-A263 WeakPolarHBondContact O-CB 3.48Å; N260-A263 PolarHBondContact O-N 2.92Å; A263-H265 PolarHBondContact O-N 3.34Å; A263-E266 HydrophobicContact CB-CG 4.11Å; A263-E266 PolarHBondContact O-N 2.91Å
264	G	47.7	Very low	56.4	Low	41 Å²	41	85.9 Å²	85.9	42%	0.423	49%	0.486	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.4	10.9	-174.9	0	0	0	0	0	117.1	S262	S262-G264 PolarHBondContact O-N 2.95Å
265	H	51.8	Low	54.7	Low	121 Å²	121	88 Å²	88	56%	0.56	51%	0.508	S	S	*	.	T	Hydrogen-bonded Turn	trans	-134	-6.3	-176.9	-75.7	-68.1	0	0	0	114	A263 Q270	A263-H265 PolarHBondContact O-N 3.34Å; H265-Q270 PolarHBondContact O-NE2 3.02Å
266	E	56.2	Low	53.8	Low	123 Å²	123	90.3 Å²	90.3	58%	0.575	51%	0.51	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.2	133.1	174.3	-67.8	-171.3	157.7	0	0	109.9	M259 A263	M259-E266 HydrophobicContact CE-CB 4.14Å; M259-E266 HydrophobicContact SD-CB 3.9Å; A263-E266 HydrophobicContact CB-CG 4.11Å; A263-E266 PolarHBondContact O-N 2.91Å
267	G	68.5	Low	52.6	Low	35 Å²	35	99 Å²	99	36%	0.361	54%	0.541	S	S	.	.	T	Hydrogen-bonded Turn	trans	80.2	6.3	-178.7	0	0	0	0	0	116.1	C614	G267-C614 VanDerWaalsContact O-CB 3.31Å; G267-C614 WeakPolarHBondContact O-CB 3.39Å; G267-C614 PolarHBondContact O-N 3.47Å; G267-C614 VanDerWaalsContact O-N 3.08Å
268	L	81.1	Confident	52.1	Low	14 Å²	14	98.6 Å²	98.6	7%	0.073	54%	0.539	C	S	.	.	S	Bend	trans	-93.2	160	169.4	-60.5	-175.6	0	0	0	111.6	P613 V621 Y631	L268-P613 HydrophobicContact CD2-CB 4.18Å; L268-P613 HydrophobicContact CD2-CG 4.49Å; L268-V621 HydrophobicContact CD1-CB 4.36Å; L268-V621 HydrophobicContact CD1-CG1 4.13Å; L268-Y631 HydrophobicContact CD2-CD1 3.68Å; L268-Y631 HydrophobicContact CD2-CE1 3.9Å
269	C	83	Confident	51.7	Low	18 Å²	18	100.1 Å²	100.1	12%	0.122	55%	0.55	C	S	.	*			trans	-70.7	128	170.3	174.2	0	0	0	0	110.4	C592 C618	C269-C592 HydrophobicContact CB-CB 3.68Å; C269-C592 WeakPolarHBondContact CB-SG 3.21Å; C269-C592 WeakPolarHBondContact SG-CB 3.29Å; C269-C592 CovalentContact SG-SG 2.03Å; C269-C592 PolarHBondContact SG-SG 2.94Å; C269-C618 PolarHBondContact N-O 3.26Å
270	Q	80.6	Confident	51.3	Low	107 Å²	107	106.8 Å²	106.8	50%	0.5	58%	0.581	S	S	.	*			trans	-136.6	135.6	167.5	-61.4	-175.1	40.5	0	0	109.1	H265 E272 C592	H265-Q270 PolarHBondContact O-NE2 3.02Å; Q270-E272 PolarHBondContact O-N 3.08Å; Q270-C592 WeakPolarHBondContact O-CA 3.35Å
271	S	69.4	Low	51.7	Low	72 Å²	72	107.2 Å²	107.2	50%	0.503	59%	0.588	S	S	.	*			trans	-76.9	108.1	178.8	-173.3	0	0	0	0	110.2	N273	S271-N273 VanDerWaalsContact C-N 3.3Å; S271-N273 PolarHBondContact O-N 3.38Å
272	E	61.8	Low	51.9	Low	136 Å²	136	105 Å²	105	64%	0.636	58%	0.577	S	S	*	*			trans	-69	80.4	178.1	-78	-157.8	126.9	0	0	112.6	Q270 G274	Q270-E272 PolarHBondContact O-N 3.08Å; E272-G274 PolarHBondContact O-N 2.87Å
273	N	51	Low	52	Low	160 Å²	160	104.7 Å²	104.7	86%	0.856	58%	0.575	S	S	*	*			trans	-77.5	58.9	172.3	-80.3	-11.8	0	0	0	112.4	S271	S271-N273 VanDerWaalsContact C-N 3.3Å; S271-N273 PolarHBondContact O-N 3.38Å
274	G	44.6	Very low	52.1	Low	52 Å²	52	105.4 Å²	105.4	54%	0.536	58%	0.578	S	S	.	*	S	Bend	trans	144	138.4	160.9	0	0	0	0	0	116.6	E272	E272-G274 PolarHBondContact O-N 2.87Å
275	S	38.1	Very low	52.3	Low	97 Å²	97	106.7 Å²	106.7	68%	0.678	58%	0.579	S	S	*	*			trans	58.8	107.3	177.4	67.2	0	0	0	0	115.6	R277	S275-R277 PolarHBondContact O-N 2.98Å
276	R	40.4	Very low	52.1	Low	214 Å²	214	109.8 Å²	109.8	81%	0.808	59%	0.586	S	S	*	*			trans	-60.1	82.1	164.3	176.4	179	172.2	167.1	-4.2	109.8	E278	R276-E278 HydrophobicContact CG-CG 4.16Å; R276-E278 IonicContact CZ-OE1 3.41Å; R276-E278 IonicContact NE-OE1 2.66Å; R276-E278 PolarHBondContact NE-OE1 3.28Å; R276-E278 IonicContact NH2-OE1 2.68Å; R276-E278 PolarHBondContact NH2-OE1 3Å; R276-E278 PolarHBondContact O-N 3.34Å
277	R	37.6	Very low	51.7	Low	207 Å²	207	111.2 Å²	111.2	78%	0.781	60%	0.597	S	S	*	*			trans	-74.2	100.2	156.7	-80.5	-174.9	169.8	175.5	-2.3	106.2	S275 L279	S275-R277 PolarHBondContact O-N 2.98Å; R277-L279 PolarHBondContact O-N 3.15Å
278	E	37.3	Very low	50.9	Low	135 Å²	135	116.6 Å²	116.6	63%	0.631	61%	0.613	S	S	*	*			trans	-64.7	75.3	152.5	-74.4	170.1	177.3	0	0	107.2	R276 E280	R276-E278 HydrophobicContact CG-CG 4.16Å; R276-E278 IonicContact CZ-OE1 3.41Å; R276-E278 IonicContact NE-OE1 2.66Å; R276-E278 PolarHBondContact NE-OE1 3.28Å; R276-E278 IonicContact NH2-OE1 2.68Å; R276-E278 PolarHBondContact NH2-OE1 3Å; R276-E278 PolarHBondContact O-N 3.34Å; E278-E280 PolarHBondContact O-N 3.19Å; E278-E280 VanDerWaalsContact O-N 3.11Å
279	L	39.5	Very low	49.6	Very low	138 Å²	138	121.3 Å²	121.3	72%	0.723	64%	0.635	S	S	*	*			trans	-57.6	115.6	160.6	-176	74.4	0	0	0	104.6	R277 V281	R277-L279 PolarHBondContact O-N 3.15Å; L279-V281 PolarHBondContact O-N 3.31Å
280	E	33.4	Very low	48.5	Very low	169 Å²	169	122 Å²	122	79%	0.79	65%	0.646	S	S	*	*			trans	-48.3	132.6	-161.5	-63.5	168.6	122	0	0	110.9	E278 A282	E278-E280 PolarHBondContact O-N 3.19Å; E278-E280 VanDerWaalsContact O-N 3.11Å; E280-A282 VanDerWaalsContact C-N 3.26Å; E280-A282 PolarHBondContact O-N 2.93Å
281	V	42.2	Very low	47.9	Very low	139 Å²	139	122.3 Å²	122.3	84%	0.842	65%	0.651	S	S	*	*			trans	-56.5	102.3	162	173	0	0	0	0	105	L279 S283	L279-V281 PolarHBondContact O-N 3.31Å; V281-S283 WeakPolarHBondContact O-CA 3.39Å; V281-S283 PolarHBondContact O-N 3.35Å
282	A	44.4	Very low	48.2	Very low	84 Å²	84	122.8 Å²	122.8	69%	0.694	65%	0.645	S	S	*	*			trans	-47.5	114	-164.8	0	0	0	0	0	108.7	E280 C284	E280-A282 VanDerWaalsContact C-N 3.26Å; E280-A282 PolarHBondContact O-N 2.93Å; A282-C284 VanDerWaalsContact C-N 3.32Å; A282-C284 PolarHBondContact O-N 2.89Å
283	S	38.9	Very low	49	Very low	109 Å²	109	118.8 Å²	118.8	76%	0.762	63%	0.626	S	S	*	*			trans	-67.7	92.6	-155.3	58.7	0	0	0	0	110.1	V281 P285	V281-S283 WeakPolarHBondContact O-CA 3.39Å; V281-S283 PolarHBondContact O-N 3.35Å; S283-P285 WeakPolarHBondContact O-CD 3.44Å; S283-P285 VanDerWaalsContact O-N 3.14Å
284	C	46.9	Very low	50.6	Low	43 Å²	43	116.1 Å²	116.1	29%	0.291	61%	0.612	S	S	.	*			trans	-42.7	115.8	-167	-84.6	0	0	0	0	112.1	A282 R286 C753	A282-C284 VanDerWaalsContact C-N 3.32Å; A282-C284 PolarHBondContact O-N 2.89Å; C284-R286 HydrophobicContact CB-CG 4.09Å; C284-R286 PolarHBondContact O-N 3.46Å; C284-C753 HydrophobicContact CB-CB 3.67Å; C284-C753 WeakPolarHBondContact CB-SG 3.43Å; C284-C753 WeakPolarHBondContact SG-CA 3.4Å; C284-C753 WeakPolarHBondContact SG-CB 3.4Å; C284-C753 CovalentContact SG-SG 2.03Å; C284-C753 PolarHBondContact SG-SG 3.02Å
285	P	51.5	Low	52.7	Low	68 Å²	68	117.4 Å²	117.4	44%	0.442	61%	0.606	S	S	.	*			trans	-69.2	58.3	176.3	-20.6	34.8	0	0	0	112.6	S283 D287 Q288 E289	S283-P285 WeakPolarHBondContact O-CD 3.44Å; S283-P285 VanDerWaalsContact O-N 3.14Å; P285-D287 PolarHBondContact O-N 3.4Å; P285-Q288 PolarHBondContact O-N 2.85Å; P285-E289 PolarHBondContact O-N 3.23Å
286	R	47.1	Very low	55.1	Low	186 Å²	186	113.9 Å²	113.9	70%	0.702	58%	0.578	S	S	*	*	H	α-helix	trans	-51.4	-32.3	-171.1	-76.9	-178.5	169.7	166.5	-0.8	113.4	C284	C284-R286 HydrophobicContact CB-CG 4.09Å; C284-R286 PolarHBondContact O-N 3.46Å
287	D	49.2	Very low	57.4	Low	152 Å²	152	104.9 Å²	104.9	81%	0.813	55%	0.546	S	S	*	.	H	α-helix	trans	-86.1	-11.9	-176.3	-52.7	-46.7	0	0	0	113.9	P285	P285-D287 PolarHBondContact O-N 3.4Å
288	Q	51.2	Low	60	Low	148 Å²	148	97.1 Å²	97.1	69%	0.692	53%	0.527	S	S	*	.	H	α-helix	trans	-105.5	-56.9	176.1	-73.2	-171.4	-12.3	0	0	112.5	P285 G290 N291 E292	P285-Q288 PolarHBondContact O-N 2.85Å; Q288-G290 VanDerWaalsContact C-N 3.33Å; Q288-G290 PolarHBondContact O-N 3.41Å; Q288-N291 WeakPolarHBondContact O-CB 3.2Å; Q288-N291 PolarHBondContact O-N 3.35Å; Q288-E292 PolarHBondContact O-N 3.29Å; Q288-E292 VanDerWaalsContact O-N 3.12Å
289	E	54.3	Low	62.7	Low	113 Å²	113	92.1 Å²	92.1	53%	0.528	50%	0.504	S	S	.	.	H	α-helix	trans	-63.3	-38.2	-174.9	-69.2	-178.6	110.6	0	0	112.6	P285 N291 E292 H293	P285-E289 PolarHBondContact O-N 3.23Å; E289-N291 PolarHBondContact O-N 2.92Å; E289-E292 PolarHBondContact O-N 3.46Å; E289-H293 PolarHBondContact O-N 3.46Å
290	G	59.7	Low	65.3	Low	34 Å²	34	85.6 Å²	85.6	35%	0.351	47%	0.47	S	S	.	.	H	α-helix	trans	-63.6	-27.9	175.1	0	0	0	0	0	113.3	Q288 N294	Q288-G290 VanDerWaalsContact C-N 3.33Å; Q288-G290 PolarHBondContact O-N 3.41Å; G290-N294 PolarHBondContact O-N 2.97Å; G290-N294 PolarHBondContact O-ND2 2.88Å
291	N	66.8	Low	68.3	Low	113 Å²	113	79.4 Å²	79.4	60%	0.604	44%	0.442	S	S	*	.	H	α-helix	trans	-80.9	-39.5	178.7	-158	36.6	0	0	0	111.3	Q288 E289 N294 L295	Q288-N291 WeakPolarHBondContact O-CB 3.2Å; Q288-N291 PolarHBondContact O-N 3.35Å; E289-N291 PolarHBondContact O-N 2.92Å; N291-N294 PolarHBondContact O-N 2.94Å; N291-L295 WeakPolarHBondContact O-CB 3.01Å; N291-L295 PolarHBondContact O-N 2.97Å
292	E	75.5	Confident	70.8	Confident	82 Å²	82	75.9 Å²	75.9	38%	0.383	42%	0.423	S	S	.	.	H	α-helix	trans	-63	-45.1	174.3	-72.4	-61.8	123.2	0	0	112.4	Q288 E289 N294 L295 Y296	Q288-E292 PolarHBondContact O-N 3.29Å; Q288-E292 VanDerWaalsContact O-N 3.12Å; E289-E292 PolarHBondContact O-N 3.46Å; E292-N294 PolarHBondContact O-N 2.8Å; E292-L295 WeakPolarHBondContact O-CB 3.49Å; E292-L295 PolarHBondContact O-N 2.77Å; E292-L295 VanDerWaalsContact O-N 3.16Å; E292-Y296 HydrophobicContact CB-CE2 4.11Å; E292-Y296 VanDerWaalsContact O-CD2 3.22Å; E292-Y296 WeakPolarHBondContact O-CD2 3.38Å; E292-Y296 VanDerWaalsContact O-CG 3.29Å; E292-Y296 PolarHBondContact O-N 3.11Å; E292-Y296 VanDerWaalsContact OE2-CZ 3.3Å; E292-Y296 PolarHBondContact OE2-OH 2.83Å
293	H	80.3	Confident	73.3	Confident	52 Å²	52	71.9 Å²	71.9	24%	0.241	39%	0.39	C	S	.	.	H	α-helix	trans	-58	-47.8	175.5	174.4	95.5	0	0	0	111.6	Y192 E289 L295 Y296 V297	Y192-H293 PolarHBondContact O-CE1 2.97Å; Y192-H293 VanDerWaalsContact O-CE1 3.25Å; Y192-H293 PolarHBondContact O-ND1 2.75Å; E289-H293 PolarHBondContact O-N 3.46Å; H293-L295 VanDerWaalsContact C-N 3.31Å; H293-L295 PolarHBondContact O-N 3.28Å; H293-Y296 PolarHBondContact O-N 3.44Å; H293-V297 WeakPolarHBondContact O-CG2 3.47Å; H293-V297 PolarHBondContact O-N 3.26Å; H293-V297 VanDerWaalsContact O-N 3.09Å
294	N	83.7	Confident	76.1	Confident	104 Å²	104	66.8 Å²	66.8	56%	0.556	35%	0.354	S	S	*	.	H	α-helix	trans	-61.9	-36.4	176.6	-81.3	-57.7	0	0	0	112.5	G290 N291 E292 A298	G290-N294 PolarHBondContact O-N 2.97Å; G290-N294 PolarHBondContact O-ND2 2.88Å; N291-N294 PolarHBondContact O-N 2.94Å; E292-N294 PolarHBondContact O-N 2.8Å; N294-A298 VanDerWaalsContact O-CB 3.29Å; N294-A298 WeakPolarHBondContact O-CB 3.45Å; N294-A298 PolarHBondContact O-N 3.29Å
295	L	88.6	Confident	78.4	Confident	79 Å²	79	66.9 Å²	66.9	41%	0.414	35%	0.351	S	S	.	.	H	α-helix	trans	-62.1	-46.2	174.8	176.8	63.5	0	0	0	111.8	N291 E292 H293 A298 L299	N291-L295 WeakPolarHBondContact O-CB 3.01Å; N291-L295 PolarHBondContact O-N 2.97Å; E292-L295 WeakPolarHBondContact O-CB 3.49Å; E292-L295 PolarHBondContact O-N 2.77Å; E292-L295 VanDerWaalsContact O-N 3.16Å; H293-L295 VanDerWaalsContact C-N 3.31Å; H293-L295 PolarHBondContact O-N 3.28Å; L295-A298 PolarHBondContact O-N 2.85Å; L295-L299 HydrophobicContact CD1-CD1 4.41Å; L295-L299 HydrophobicContact CD1-CG 4.48Å; L295-L299 HydrophobicContact CG-CD1 4.27Å; L295-L299 WeakPolarHBondContact O-CG 3.46Å; L295-L299 PolarHBondContact O-N 3.31Å
296	Y	88.8	Confident	80.6	Confident	23 Å²	23	66.1 Å²	66.1	9%	0.09	34%	0.343	C	S	.	.	H	α-helix	trans	-65.9	-42.2	179.3	-51.9	-34.4	0	0	0	111.9	Y192 I250 E292 H293 L299 F300	Y192-Y296 AromaticContact CD1-CD2 3.62Å; Y192-Y296 HydrophobicContact CD1-CD2 3.62Å; Y192-Y296 HydrophobicContact CD1-CE2 4.43Å; Y192-Y296 HydrophobicContact CD1-CG 4.05Å; Y192-Y296 AromaticContact CE1-CD2 3.82Å; Y192-Y296 HydrophobicContact CE1-CD2 3.82Å; Y192-Y296 HydrophobicContact CE1-CE2 4.42Å; Y192-Y296 HydrophobicContact CE1-CG 4.01Å; I250-Y296 HydrophobicContact CD1-CD1 4.2Å; I250-Y296 HydrophobicContact CD1-CE1 4.05Å; I250-Y296 HydrophobicContact CG1-CD1 4.49Å; I250-Y296 HydrophobicContact CG1-CE1 4.11Å; E292-Y296 HydrophobicContact CB-CE2 4.11Å; E292-Y296 VanDerWaalsContact O-CD2 3.22Å; E292-Y296 WeakPolarHBondContact O-CD2 3.38Å; E292-Y296 VanDerWaalsContact O-CG 3.29Å; E292-Y296 PolarHBondContact O-N 3.11Å; E292-Y296 VanDerWaalsContact OE2-CZ 3.3Å; E292-Y296 PolarHBondContact OE2-OH 2.83Å; H293-Y296 PolarHBondContact O-N 3.44Å; Y296-L299 PolarHBondContact O-N 3.44Å; Y296-F300 WeakPolarHBondContact O-CD2 3.3Å; Y296-F300 PolarHBondContact O-N 2.89Å; Y296-F300 VanDerWaalsContact O-N 3.08Å
297	V	89.1	Confident	82.9	Confident	24 Å²	24	57.2 Å²	57.2	15%	0.145	31%	0.309	C	S	.	.	H	α-helix	trans	-60.1	-45.7	173.7	173.8	0	0	0	0	111.2	L194 H293 L299 F300 I301	L194-V297 HydrophobicContact CD2-CG2 3.54Å; H293-V297 WeakPolarHBondContact O-CG2 3.47Å; H293-V297 PolarHBondContact O-N 3.26Å; H293-V297 VanDerWaalsContact O-N 3.09Å; V297-L299 VanDerWaalsContact C-N 3.34Å; V297-L299 PolarHBondContact O-N 2.92Å; V297-F300 PolarHBondContact O-N 2.92Å; V297-I301 HydrophobicContact CG1-CD1 3.89Å; V297-I301 WeakPolarHBondContact O-CG1 3.47Å; V297-I301 PolarHBondContact O-N 3.31Å
298	A	91.9	Very high	85.1	Confident	45 Å²	45	50 Å²	50	37%	0.372	27%	0.271	S	S	.	.	H	α-helix	trans	-61.3	-40.1	177	0	0	0	0	0	112.4	N294 L295 I301 C302	N294-A298 VanDerWaalsContact O-CB 3.29Å; N294-A298 WeakPolarHBondContact O-CB 3.45Å; N294-A298 PolarHBondContact O-N 3.29Å; L295-A298 PolarHBondContact O-N 2.85Å; A298-I301 PolarHBondContact O-N 3.32Å; A298-C302 WeakPolarHBondContact O-CB 3.41Å; A298-C302 PolarHBondContact O-N 3.49Å; A298-C302 PolarHBondContact O-SG 2.93Å
299	L	93.7	Very high	87.2	Confident	30 Å²	30	46.1 Å²	46.1	16%	0.157	25%	0.253	C	S	.	.	H	α-helix	trans	-62.1	-45.2	175.6	-74.1	168.3	0	0	0	112.1	L243 P247 I250 L295 Y296 V297 C302 A303	L243-L299 HydrophobicContact CD1-CD2 3.9Å; P247-L299 HydrophobicContact CG-CB 4.09Å; P247-L299 HydrophobicContact CG-CD1 4.25Å; I250-L299 HydrophobicContact CD1-CD1 3.52Å; L295-L299 HydrophobicContact CD1-CD1 4.41Å; L295-L299 HydrophobicContact CD1-CG 4.48Å; L295-L299 HydrophobicContact CG-CD1 4.27Å; L295-L299 WeakPolarHBondContact O-CG 3.46Å; L295-L299 PolarHBondContact O-N 3.31Å; Y296-L299 PolarHBondContact O-N 3.44Å; V297-L299 VanDerWaalsContact C-N 3.34Å; V297-L299 PolarHBondContact O-N 2.92Å; L299-C302 PolarHBondContact O-N 3.48Å; L299-A303 VanDerWaalsContact O-CB 3.24Å; L299-A303 WeakPolarHBondContact O-CB 3.43Å; L299-A303 PolarHBondContact O-N 3.34Å
300	F	94.9	Very high	89.1	Confident	0 Å²	0	40.8 Å²	40.8	0%	0	23%	0.229	C	C	.	.	H	α-helix	trans	-62.2	-42.1	175.5	-68.5	-55.7	0	0	0	112.2	I188 Y192 L202 F244 P247 Y296 V297 A303 Q304 W380	I188-F300 HydrophobicContact CG2-CE2 4.09Å; I188-F300 HydrophobicContact CG2-CZ 4.02Å; Y192-F300 AromaticContact CD2-CE2 3.86Å; Y192-F300 HydrophobicContact CD2-CE2 3.86Å; Y192-F300 AromaticContact CD2-CZ 3.92Å; Y192-F300 HydrophobicContact CD2-CZ 3.92Å; Y192-F300 AromaticContact CE2-CE2 3.98Å; Y192-F300 HydrophobicContact CE2-CE2 3.98Å; Y192-F300 AromaticContact CE2-CZ 3.6Å; Y192-F300 HydrophobicContact CE2-CZ 3.6Å; Y192-F300 HydrophobicContact CG-CE2 4.18Å; L202-F300 HydrophobicContact CD1-CB 3.87Å; L202-F300 HydrophobicContact CD1-CD2 4.29Å; L202-F300 HydrophobicContact CD1-CG 4.18Å; L202-F300 HydrophobicContact CD2-CB 3.59Å; L202-F300 HydrophobicContact CG-CB 4.36Å; F244-F300 HydrophobicContact CD1-CD1 4.05Å; F244-F300 HydrophobicContact CD1-CE1 4.13Å; F244-F300 HydrophobicContact CD2-CB 4.45Å; F244-F300 AromaticContact CD2-CD1 3.78Å; F244-F300 HydrophobicContact CD2-CD1 3.78Å; F244-F300 AromaticContact CE1-CD1 3.81Å; F244-F300 HydrophobicContact CE1-CD1 3.81Å; F244-F300 AromaticContact CE1-CE1 3.87Å; F244-F300 HydrophobicContact CE1-CE1 3.87Å; F244-F300 HydrophobicContact CE2-CB 3.96Å; F244-F300 AromaticContact CE2-CD1 3.5Å; F244-F300 HydrophobicContact CE2-CD1 3.5Å; F244-F300 HydrophobicContact CE2-CE1 4.38Å; F244-F300 HydrophobicContact CE2-CG 4.12Å; F244-F300 HydrophobicContact CG-CD1 4.03Å; F244-F300 AromaticContact CZ-CD1 3.53Å; F244-F300 HydrophobicContact CZ-CD1 3.53Å; F244-F300 HydrophobicContact CZ-CE1 4Å; F244-F300 HydrophobicContact CZ-CG 4.31Å; F244-F300 WeakPolarHBondContact O-CE1 3.35Å; P247-F300 HydrophobicContact CB-CE1 4.25Å; P247-F300 HydrophobicContact CB-CE2 4.33Å; P247-F300 HydrophobicContact CB-CZ 3.84Å; P247-F300 HydrophobicContact CG-CD1 4.24Å; P247-F300 HydrophobicContact CG-CE1 3.83Å; P247-F300 HydrophobicContact CG-CE2 4.25Å; P247-F300 HydrophobicContact CG-CZ 3.83Å; Y296-F300 WeakPolarHBondContact O-CD2 3.3Å; Y296-F300 PolarHBondContact O-N 2.89Å; Y296-F300 VanDerWaalsContact O-N 3.08Å; V297-F300 PolarHBondContact O-N 2.92Å; F300-A303 PolarHBondContact O-N 3.24Å; F300-Q304 WeakPolarHBondContact O-CG 3.45Å; F300-Q304 PolarHBondContact O-N 3.47Å; F300-W380 AromaticContact CE1-CH2 3.98Å; F300-W380 HydrophobicContact CE1-CH2 3.98Å; F300-W380 AromaticContact CE1-CZ3 3.85Å; F300-W380 HydrophobicContact CE1-CZ3 3.85Å; F300-W380 AromaticContact CZ-CH2 3.99Å; F300-W380 HydrophobicContact CZ-CH2 3.99Å; F300-W380 HydrophobicContact CZ-CZ3 4.21Å
301	I	95.1	Very high	90.7	Very high	40 Å²	40	39.1 Å²	39.1	21%	0.205	21%	0.212	C	C	.	.	H	α-helix	trans	-61.5	-50.9	176	-71.9	172.8	0	0	0	110.9	L201 L202 V297 A298 A303 Q304 I305	L201-I301 HydrophobicContact CD2-CD1 4.36Å; L202-I301 HydrophobicContact CD2-CG1 3.62Å; V297-I301 HydrophobicContact CG1-CD1 3.89Å; V297-I301 WeakPolarHBondContact O-CG1 3.47Å; V297-I301 PolarHBondContact O-N 3.31Å; A298-I301 PolarHBondContact O-N 3.32Å; I301-A303 VanDerWaalsContact C-N 3.32Å; I301-A303 PolarHBondContact O-N 3.25Å; I301-Q304 PolarHBondContact O-N 3.47Å; I301-I305 HydrophobicContact CG2-CD1 3.81Å; I301-I305 WeakPolarHBondContact O-CG1 3.32Å; I301-I305 PolarHBondContact O-N 3.34Å
302	C	95.9	Very high	91.9	Very high	65 Å²	65	34 Å²	34	44%	0.439	19%	0.185	S	C	.	.	H	α-helix	trans	-60.5	-41.4	178.6	-72.3	0	0	0	0	112	L243 A298 L299 I305 L306	L243-C302 HydrophobicContact CD2-CB 4.31Å; A298-C302 WeakPolarHBondContact O-CB 3.41Å; A298-C302 PolarHBondContact O-N 3.49Å; A298-C302 PolarHBondContact O-SG 2.93Å; L299-C302 PolarHBondContact O-N 3.48Å; C302-I305 PolarHBondContact O-N 3.21Å; C302-L306 VanDerWaalsContact O-CG 3.31Å; C302-L306 WeakPolarHBondContact O-CG 3.29Å; C302-L306 PolarHBondContact O-N 3.38Å
303	A	96.8	Very high	92.7	Very high	0 Å²	0	30.2 Å²	30.2	0%	0	17%	0.167	C	C	.	.	H	α-helix	trans	-61.1	-46.6	175.9	0	0	0	0	0	112.5	G240 L243 F244 L299 F300 I301 L306 I307	G240-A303 WeakPolarHBondContact O-CB 3.41Å; L243-A303 HydrophobicContact CB-CB 4.06Å; L243-A303 HydrophobicContact CD2-CB 4.17Å; L243-A303 HydrophobicContact CG-CB 4.09Å; F244-A303 HydrophobicContact CB-CB 3.8Å; F244-A303 HydrophobicContact CD2-CB 3.86Å; F244-A303 HydrophobicContact CG-CB 4.32Å; L299-A303 VanDerWaalsContact O-CB 3.24Å; L299-A303 WeakPolarHBondContact O-CB 3.43Å; L299-A303 PolarHBondContact O-N 3.34Å; F300-A303 PolarHBondContact O-N 3.24Å; I301-A303 VanDerWaalsContact C-N 3.32Å; I301-A303 PolarHBondContact O-N 3.25Å; A303-L306 PolarHBondContact O-N 3.43Å; A303-I307 WeakPolarHBondContact O-CD1 3.31Å; A303-I307 VanDerWaalsContact O-CG1 3.27Å; A303-I307 WeakPolarHBondContact O-CG1 3.31Å; A303-I307 PolarHBondContact O-N 3.01Å
304	Q	96.2	Very high	93.2	Very high	1 Å²	1	27.8 Å²	27.8	1%	0.005	16%	0.156	C	C	.	.	H	α-helix	trans	-67.7	-37.8	178.6	-70.3	-65.9	-8.1	0	0	112.6	L202 C205 F244 F300 I301 L306 I307 G308	L202-Q304 WeakPolarHBondContact O-CG 3.23Å; C205-Q304 HydrophobicContact CB-CB 3.87Å; F244-Q304 HydrophobicContact CD2-CG 3.92Å; F244-Q304 HydrophobicContact CE2-CG 3.68Å; F300-Q304 WeakPolarHBondContact O-CG 3.45Å; F300-Q304 PolarHBondContact O-N 3.47Å; I301-Q304 PolarHBondContact O-N 3.47Å; Q304-L306 VanDerWaalsContact C-N 3.34Å; Q304-L306 PolarHBondContact O-N 3.37Å; Q304-I307 PolarHBondContact O-N 3.21Å; Q304-G308 PolarHBondContact O-N 2.94Å
305	I	96.6	Very high	93.3	Very high	45 Å²	45	26.8 Å²	26.8	23%	0.231	15%	0.145	C	C	.	.	H	α-helix	trans	-59.5	-45.5	172.5	-71.9	169.6	0	0	0	110.6	C205 I301 C302 G308 M309	C205-I305 HydrophobicContact CB-CG1 4.22Å; I301-I305 HydrophobicContact CG2-CD1 3.81Å; I301-I305 WeakPolarHBondContact O-CG1 3.32Å; I301-I305 PolarHBondContact O-N 3.34Å; C302-I305 PolarHBondContact O-N 3.21Å; I305-G308 PolarHBondContact O-N 3.28Å; I305-M309 HydrophobicContact CG2-CG 4.48Å; I305-M309 HydrophobicContact CG2-SD 3.92Å; I305-M309 VanDerWaalsContact O-CG 3.28Å; I305-M309 WeakPolarHBondContact O-CG 3.37Å; I305-M309 PolarHBondContact O-N 3.47Å
306	L	96.4	Very high	93.2	Very high	52 Å²	52	24.5 Å²	24.5	27%	0.272	13%	0.134	S	C	.	.	H	α-helix	trans	-61.7	-45.7	176	-72.5	169.1	0	0	0	112.1	V236 L243 C302 A303 Q304 G308 M309 G310	V236-L306 HydrophobicContact CG1-CB 4.17Å; V236-L306 HydrophobicContact CG1-CD2 4.01Å; V236-L306 VanDerWaalsContact CG1-O 3.31Å; V236-L306 WeakPolarHBondContact CG1-O 3.4Å; L243-L306 HydrophobicContact CD2-CD1 3.86Å; C302-L306 VanDerWaalsContact O-CG 3.31Å; C302-L306 WeakPolarHBondContact O-CG 3.29Å; C302-L306 PolarHBondContact O-N 3.38Å; A303-L306 PolarHBondContact O-N 3.43Å; Q304-L306 VanDerWaalsContact C-N 3.34Å; Q304-L306 PolarHBondContact O-N 3.37Å; L306-G308 VanDerWaalsContact C-N 3.3Å; L306-G308 PolarHBondContact O-N 3Å; L306-M309 PolarHBondContact O-N 3.17Å; L306-G310 PolarHBondContact O-N 3.35Å
307	I	96.8	Very high	93.1	Very high	0 Å²	0	23.6 Å²	23.6	0%	0	13%	0.131	C	C	.	.	H	α-helix	trans	-60.8	-40.9	176.3	-64.6	160.2	0	0	0	110.6	M176 V177 F206 I237 A303 Q304 G310 S311	M176-I307 HydrophobicContact CE-CB 4.5Å; M176-I307 HydrophobicContact CE-CD1 3.82Å; M176-I307 HydrophobicContact CE-CG1 4Å; M176-I307 HydrophobicContact CE-CG2 3.62Å; V177-I307 HydrophobicContact CG2-CG2 3.55Å; F206-I307 HydrophobicContact CD2-CB 4.46Å; F206-I307 HydrophobicContact CD2-CG2 3.92Å; F206-I307 HydrophobicContact CE2-CG2 4.03Å; I237-I307 HydrophobicContact CG2-CG2 4.37Å; A303-I307 WeakPolarHBondContact O-CD1 3.31Å; A303-I307 VanDerWaalsContact O-CG1 3.27Å; A303-I307 WeakPolarHBondContact O-CG1 3.31Å; A303-I307 PolarHBondContact O-N 3.01Å; Q304-I307 PolarHBondContact O-N 3.21Å; I307-G310 PolarHBondContact O-N 3.15Å; I307-S311 WeakPolarHBondContact O-CB 3.31Å; I307-S311 PolarHBondContact O-N 3.39Å; I307-S311 PolarHBondContact O-OG 3.25Å
308	G	95.3	Very high	93.1	Very high	0 Å²	0	22.4 Å²	22.4	0%	0	12%	0.124	C	C	.	.	H	α-helix	trans	-57.6	-51	172	0	0	0	0	0	112.9	F206 S210 Q304 I305 L306 G310 S311 T312	F206-G308 VanDerWaalsContact O-CA 3.25Å; F206-G308 WeakPolarHBondContact O-CA 3.29Å; S210-G308 WeakPolarHBondContact CA-O 3.48Å; S210-G308 VanDerWaalsContact CB-O 3.26Å; S210-G308 WeakPolarHBondContact CB-O 3.46Å; Q304-G308 PolarHBondContact O-N 2.94Å; I305-G308 PolarHBondContact O-N 3.28Å; L306-G308 VanDerWaalsContact C-N 3.3Å; L306-G308 PolarHBondContact O-N 3Å; G308-G310 PolarHBondContact O-N 3.25Å; G308-S311 PolarHBondContact O-N 3.2Å; G308-S311 PolarHBondContact O-OG 2.75Å; G308-T312 PolarHBondContact O-N 2.95Å; G308-T312 PolarHBondContact O-OG1 2.63Å
309	M	94.8	Very high	92.9	Very high	66 Å²	66	21 Å²	21	33%	0.325	11%	0.111	S	C	.	.	H	α-helix	trans	-60.3	-45	177.1	-68.2	168.4	71.1	0	0	112	G209 V213 I305 L306 T312 P313	G209-M309 WeakPolarHBondContact O-CG 3.43Å; V213-M309 HydrophobicContact CG1-CB 4.41Å; V213-M309 HydrophobicContact CG1-CE 3.85Å; V213-M309 HydrophobicContact CG1-CG 3.9Å; V213-M309 HydrophobicContact CG2-CB 4.01Å; V213-M309 HydrophobicContact CG2-CG 4.05Å; I305-M309 HydrophobicContact CG2-CG 4.48Å; I305-M309 HydrophobicContact CG2-SD 3.92Å; I305-M309 VanDerWaalsContact O-CG 3.28Å; I305-M309 WeakPolarHBondContact O-CG 3.37Å; I305-M309 PolarHBondContact O-N 3.47Å; L306-M309 PolarHBondContact O-N 3.17Å; M309-T312 WeakPolarHBondContact O-CB 3.48Å; M309-T312 PolarHBondContact O-N 2.95Å; M309-P313 WeakPolarHBondContact O-CD 3.47Å
310	G	94.8	Very high	92.5	Very high	1 Å²	1	22.7 Å²	22.7	1%	0.01	12%	0.122	C	C	.	.	H	α-helix	trans	-73	-28.4	-177.2	0	0	0	0	0	114.8	G233 I237 L306 I307 G308 T312 P313	G233-G310 CarbonylContact C-O 3.29Å; G233-G310 VanDerWaalsContact C-O 3.29Å; G233-G310 VanDerWaalsContact CA-O 3.32Å; G233-G310 WeakPolarHBondContact CA-O 3.25Å; G233-G310 CarbonylContact O-C 3.55Å; G233-G310 VanDerWaalsContact O-CA 3.23Å; G233-G310 WeakPolarHBondContact O-CA 3.37Å; I237-G310 VanDerWaalsContact CG1-C 3.5Å; L306-G310 PolarHBondContact O-N 3.35Å; I307-G310 PolarHBondContact O-N 3.15Å; G308-G310 PolarHBondContact O-N 3.25Å; G310-T312 VanDerWaalsContact C-N 3.34Å; G310-P313 WeakPolarHBondContact O-CD 3.36Å
311	S	93.3	Very high	92	Very high	0 Å²	0	22.9 Å²	22.9	0%	0	12%	0.123	C	C	.	.	H	α-helix	trans	-72.2	-26.4	174.4	70.1	0	0	0	0	113.4	F206 I307 G308 I314	F206-S311 VanDerWaalsContact CE2-OG 3.31Å; F206-S311 WeakPolarHBondContact CE2-OG 3.45Å; F206-S311 WeakPolarHBondContact CZ-OG 3.26Å; I307-S311 WeakPolarHBondContact O-CB 3.31Å; I307-S311 PolarHBondContact O-N 3.39Å; I307-S311 PolarHBondContact O-OG 3.25Å; G308-S311 PolarHBondContact O-N 3.2Å; G308-S311 PolarHBondContact O-OG 2.75Å; S311-I314 VanDerWaalsContact O-CB 3.25Å; S311-I314 WeakPolarHBondContact O-CB 3.35Å; S311-I314 PolarHBondContact O-N 3.05Å
312	T	91.6	Very high	91.6	Very high	5 Å²	5	21 Å²	21	3%	0.031	11%	0.114	C	C	.	.	H	α-helix	trans	-60.4	-41.5	-171.3	-64.7	0	0	0	0	114.4	S210 V213 V214 I217 G308 M309 G310 I314 T316	S210-T312 WeakPolarHBondContact CA-OG1 3.43Å; S210-T312 VanDerWaalsContact CB-OG1 3.29Å; S210-T312 WeakPolarHBondContact CB-OG1 3.17Å; S210-T312 PolarHBondContact O-OG1 3.14Å; V213-T312 HydrophobicContact CG2-CG2 4.12Å; V214-T312 HydrophobicContact CB-CG2 3.86Å; V214-T312 HydrophobicContact CG2-CG2 3.96Å; I217-T312 HydrophobicContact CB-CG2 4.42Å; I217-T312 HydrophobicContact CD1-CG2 4.16Å; G308-T312 PolarHBondContact O-N 2.95Å; G308-T312 PolarHBondContact O-OG1 2.63Å; M309-T312 WeakPolarHBondContact O-CB 3.48Å; M309-T312 PolarHBondContact O-N 2.95Å; G310-T312 VanDerWaalsContact C-N 3.34Å; T312-I314 VanDerWaalsContact C-N 3.27Å; T312-I314 PolarHBondContact O-N 3.35Å; T312-T316 WeakPolarHBondContact O-CG2 3.25Å; T312-T316 PolarHBondContact O-N 2.86Å; T312-T316 PolarHBondContact O-OG1 3.03Å
313	P	91.4	Very high	91	Very high	2 Å²	2	21.8 Å²	21.8	1%	0.013	11%	0.113	C	C	.	.	H	α-helix	trans	-55	-36.7	168.7	-28.4	35.4	0	0	0	114.5	I217 L230 M309 G310 Y315 T316 L317 G318	I217-P313 HydrophobicContact CD1-CG 3.97Å; I217-P313 HydrophobicContact CG2-CB 4.35Å; I217-P313 HydrophobicContact CG2-CG 3.89Å; L230-P313 HydrophobicContact CD2-CB 4.19Å; L230-P313 VanDerWaalsContact CD2-O 3.29Å; L230-P313 WeakPolarHBondContact CD2-O 3.48Å; M309-P313 WeakPolarHBondContact O-CD 3.47Å; G310-P313 WeakPolarHBondContact O-CD 3.36Å; P313-Y315 PolarHBondContact O-N 2.69Å; P313-T316 PolarHBondContact O-N 3.31Å; P313-L317 HydrophobicContact CB-CD1 4.31Å; P313-L317 WeakPolarHBondContact O-CA 3.16Å; P313-L317 WeakPolarHBondContact O-CB 3.1Å; P313-L317 PolarHBondContact O-N 3.42Å; P313-G318 PolarHBondContact O-N 2.93Å
314	I	91.9	Very high	90.4	Very high	1 Å²	1	26.7 Å²	26.7	1%	0.005	14%	0.14	C	C	.	.	H	α-helix	trans	-62.4	-47.2	-174	-53.6	-179.7	0	0	0	109.9	M166 L169 T170 Q173 L230 I237 S311 T312 G318 P319 M391	M166-I314 HydrophobicContact CE-CG2 3.7Å; L169-I314 HydrophobicContact CB-CD1 4.35Å; T170-I314 HydrophobicContact CG2-CG2 3.51Å; Q173-I314 HydrophobicContact CB-CD1 4.42Å; L230-I314 HydrophobicContact CD2-CG1 4.43Å; I237-I314 HydrophobicContact CD1-CD1 3.55Å; S311-I314 VanDerWaalsContact O-CB 3.25Å; S311-I314 WeakPolarHBondContact O-CB 3.35Å; S311-I314 PolarHBondContact O-N 3.05Å; T312-I314 VanDerWaalsContact C-N 3.27Å; T312-I314 PolarHBondContact O-N 3.35Å; I314-G318 WeakPolarHBondContact O-CA 3.33Å; I314-G318 PolarHBondContact O-N 3.25Å; I314-P319 WeakPolarHBondContact O-CD 3.42Å; I314-M391 HydrophobicContact CD1-CE 4.34Å
315	Y	86.4	Confident	89.8	Confident	83 Å²	83	28.2 Å²	28.2	33%	0.325	15%	0.148	S	C	.	.	H	α-helix	trans	-85.3	-8.9	-178.4	-67	-74.6	0	0	0	115.2	T170 Q173 P313 P319 Y339	T170-Y315 HydrophobicContact CG2-CE1 4.46Å; Q173-Y315 VanDerWaalsContact OE1-CE2 3.22Å; Q173-Y315 PolarHBondContact OE1-OH 3.14Å; P313-Y315 PolarHBondContact O-N 2.69Å; Y315-P319 WeakPolarHBondContact O-CG 3.37Å; Y315-Y339 HydrophobicContact CD1-CE1 4.46Å
316	T	85.8	Confident	89.2	Confident	32 Å²	32	27.1 Å²	27.1	20%	0.196	14%	0.143	C	C	.	.	H	α-helix	trans	-111.8	-52.2	-179	54.6	0	0	0	0	112.9	V214 T312 P313 T320	V214-T316 HydrophobicContact CG2-CG2 4.03Å; T312-T316 WeakPolarHBondContact O-CG2 3.25Å; T312-T316 PolarHBondContact O-N 2.86Å; T312-T316 PolarHBondContact O-OG1 3.03Å; P313-T316 PolarHBondContact O-N 3.31Å; T316-T320 WeakPolarHBondContact O-CG2 3.45Å; T316-T320 PolarHBondContact O-OG1 3.4Å
317	L	87.3	Confident	88.6	Confident	3 Å²	3	31 Å²	31	2%	0.016	16%	0.158	C	C	.	.	H	α-helix	trans	-88.5	-26.3	-176.9	-54.6	-178.6	0	0	0	112.3	I217 R226 W229 L230 P313 T320 Y321	I217-L317 HydrophobicContact CG2-CD1 3.9Å; I217-L317 HydrophobicContact CG2-CG 4.23Å; R226-L317 HydrophobicContact CB-CB 4.25Å; R226-L317 HydrophobicContact CG-CB 4.42Å; R226-L317 HydrophobicContact CG-CD2 4.41Å; W229-L317 HydrophobicContact CB-CD1 3.44Å; W229-L317 VanDerWaalsContact CB-CD1 3.44Å; W229-L317 HydrophobicContact CG-CD1 4.05Å; L230-L317 HydrophobicContact CG-CB 4.44Å; P313-L317 HydrophobicContact CB-CD1 4.31Å; P313-L317 WeakPolarHBondContact O-CA 3.16Å; P313-L317 WeakPolarHBondContact O-CB 3.1Å; P313-L317 PolarHBondContact O-N 3.42Å; L317-T320 WeakPolarHBondContact CA-OG1 3.44Å; L317-T320 PolarHBondContact O-OG1 2.93Å; L317-Y321 WeakPolarHBondContact O-CB 3.44Å; L317-Y321 PolarHBondContact O-N 3.02Å
318	G	88.9	Confident	87.8	Confident	0 Å²	0	38.4 Å²	38.4	0%	0	19%	0.19	C	C	.	.	H	α-helix	trans	-60.5	-64.1	173.9	0	0	0	0	0	113.1	P313 I314 T320 Y321 L322	P313-G318 PolarHBondContact O-N 2.93Å; I314-G318 WeakPolarHBondContact O-CA 3.33Å; I314-G318 PolarHBondContact O-N 3.25Å; G318-T320 VanDerWaalsContact C-N 3.33Å; G318-T320 PolarHBondContact O-N 3.23Å; G318-Y321 PolarHBondContact O-N 3.04Å; G318-L322 WeakPolarHBondContact O-CB 3.45Å; G318-L322 PolarHBondContact O-N 3.36Å
319	P	86.8	Confident	87.1	Confident	15 Å²	15	44.2 Å²	44.2	10%	0.097	22%	0.221	C	C	.	.	H	α-helix	trans	-53.2	-47.6	178	-24.4	27.6	0	0	0	113	I314 Y315 Y321 L322 D323 L335 M338 Y339	I314-P319 WeakPolarHBondContact O-CD 3.42Å; Y315-P319 WeakPolarHBondContact O-CG 3.37Å; P319-Y321 PolarHBondContact O-N 2.88Å; P319-L322 WeakPolarHBondContact O-CB 3.31Å; P319-L322 PolarHBondContact O-N 3.24Å; P319-D323 PolarHBondContact O-N 3.19Å; P319-L335 HydrophobicContact CB-CD2 3.66Å; P319-M338 HydrophobicContact CB-CE 3.98Å; P319-M338 HydrophobicContact CG-CE 3.66Å; P319-Y339 WeakPolarHBondContact CG-OH 3.46Å
320	T	85.1	Confident	86.6	Confident	65 Å²	65	44.2 Å²	44.2	40%	0.399	22%	0.223	S	C	.	.	H	α-helix	trans	-68.4	-35.2	-176.8	55.1	0	0	0	0	112.5	R226 T316 L317 G318 D324	R226-T320 PolarHBondContact NH1-O 3.2Å; R226-T320 PolarHBondContact NH1-OG1 2.64Å; T316-T320 WeakPolarHBondContact O-CG2 3.45Å; T316-T320 PolarHBondContact O-OG1 3.4Å; L317-T320 WeakPolarHBondContact CA-OG1 3.44Å; L317-T320 PolarHBondContact O-OG1 2.93Å; G318-T320 VanDerWaalsContact C-N 3.33Å; G318-T320 PolarHBondContact O-N 3.23Å; T320-D324 WeakPolarHBondContact O-CB 3.05Å; T320-D324 PolarHBondContact O-N 3.33Å; T320-D324 VanDerWaalsContact O-N 3.13Å
321	Y	85.8	Confident	85.9	Confident	4 Å²	4	44.2 Å²	44.2	2%	0.016	22%	0.223	C	C	.	.	H	α-helix	trans	-71.8	-35.4	173.1	-174.3	-89.8	0	0	0	112.1	F162 R226 P227 L317 G318 P319 N325 P402	F162-Y321 AromaticContact CD1-CD1 3.9Å; F162-Y321 HydrophobicContact CD1-CD1 3.9Å; F162-Y321 HydrophobicContact CD1-CE1 4.14Å; F162-Y321 HydrophobicContact CD2-CD1 4.16Å; F162-Y321 AromaticContact CD2-CE1 3.88Å; F162-Y321 HydrophobicContact CD2-CE1 3.88Å; F162-Y321 AromaticContact CE1-CD1 3.45Å; F162-Y321 HydrophobicContact CE1-CD1 3.45Å; F162-Y321 VanDerWaalsContact CE1-CD1 3.45Å; F162-Y321 HydrophobicContact CE1-CE1 4.09Å; F162-Y321 HydrophobicContact CE1-CG 4.45Å; F162-Y321 AromaticContact CE2-CD1 3.72Å; F162-Y321 HydrophobicContact CE2-CD1 3.72Å; F162-Y321 AromaticContact CE2-CE1 3.82Å; F162-Y321 HydrophobicContact CE2-CE1 3.82Å; F162-Y321 HydrophobicContact CG-CD1 4.25Å; F162-Y321 HydrophobicContact CG-CE1 4.05Å; F162-Y321 AromaticContact CZ-CD1 3.35Å; F162-Y321 HydrophobicContact CZ-CD1 3.35Å; F162-Y321 AromaticContact CZ-CE1 3.94Å; F162-Y321 HydrophobicContact CZ-CE1 3.94Å; F162-Y321 HydrophobicContact CZ-CG 4.2Å; R226-Y321 HydrophobicContact CB-CD2 3.97Å; R226-Y321 HydrophobicContact CB-CG 4.41Å; P227-Y321 HydrophobicContact CG-CD2 4.13Å; P227-Y321 HydrophobicContact CG-CE1 4.08Å; P227-Y321 HydrophobicContact CG-CE2 3.66Å; L317-Y321 WeakPolarHBondContact O-CB 3.44Å; L317-Y321 PolarHBondContact O-N 3.02Å; G318-Y321 PolarHBondContact O-N 3.04Å; P319-Y321 PolarHBondContact O-N 2.88Å; Y321-N325 WeakPolarHBondContact CD2-ND2 3.4Å; Y321-N325 WeakPolarHBondContact CE2-ND2 3.33Å; Y321-N325 WeakPolarHBondContact O-CB 3.49Å; Y321-N325 PolarHBondContact O-N 3.44Å; Y321-N325 PolarHBondContact O-ND2 3.24Å; Y321-P402 PolarHBondContact OH-O 2.94Å
322	L	86	Confident	85.4	Confident	2 Å²	2	48.2 Å²	48.2	1%	0.01	25%	0.25	C	S	.	.	H	α-helix	trans	-62.5	-47.7	175.4	-168.7	64.5	0	0	0	110.9	F162 L163 G318 P319 N325 V326 Y334 L335 M338	F162-L322 HydrophobicContact CD1-CD1 3.91Å; F162-L322 HydrophobicContact CE1-CB 4.41Å; F162-L322 HydrophobicContact CE1-CD1 4.3Å; L163-L322 HydrophobicContact CB-CD1 4.25Å; L163-L322 HydrophobicContact CD1-CD1 4.24Å; L163-L322 HydrophobicContact CD1-CD2 4.01Å; G318-L322 WeakPolarHBondContact O-CB 3.45Å; G318-L322 PolarHBondContact O-N 3.36Å; P319-L322 WeakPolarHBondContact O-CB 3.31Å; P319-L322 PolarHBondContact O-N 3.24Å; L322-N325 PolarHBondContact O-N 2.86Å; L322-V326 HydrophobicContact CD1-CG2 4.18Å; L322-V326 HydrophobicContact CG-CG2 4.5Å; L322-V326 WeakPolarHBondContact O-CB 3.23Å; L322-V326 WeakPolarHBondContact O-CG2 3.44Å; L322-V326 PolarHBondContact O-N 3.06Å; L322-Y334 HydrophobicContact CD1-CD2 4.25Å; L322-L335 HydrophobicContact CD2-CD2 4.14Å; L322-L335 HydrophobicContact CD2-CG 4.44Å; L322-M338 HydrophobicContact CD2-CE 4.43Å; L322-M338 HydrophobicContact CD2-SD 4.08Å
323	D	84.1	Confident	85.1	Confident	80 Å²	80	52.6 Å²	52.6	43%	0.428	27%	0.273	S	S	.	.	H	α-helix	trans	-62.4	-51.5	177.8	-168.8	64.7	0	0	0	112.3	P319 N325 V326 A331	P319-D323 PolarHBondContact O-N 3.19Å; D323-N325 PolarHBondContact O-N 3.12Å; D323-V326 PolarHBondContact O-N 3.44Å; D323-A331 VanDerWaalsContact OD1-CB 3.23Å; D323-A331 WeakPolarHBondContact OD1-CB 3.29Å
324	D	84.3	Confident	85	Confident	104 Å²	104	53.9 Å²	53.9	56%	0.556	28%	0.278	S	S	*	.	H	α-helix	trans	-58.4	-18.9	179.9	-89.9	-35.2	0	0	0	114.6	R226 T320	R226-D324 IonicContact CZ-OD2 3.56Å; R226-D324 IonicContact NH1-OD2 2.7Å; R226-D324 PolarHBondContact NH1-OD2 2.86Å; R226-D324 IonicContact NH2-OD2 3.64Å; R226-D324 PolarHBondContact NH2-OD2 3.15Å; T320-D324 WeakPolarHBondContact O-CB 3.05Å; T320-D324 PolarHBondContact O-N 3.33Å; T320-D324 VanDerWaalsContact O-N 3.13Å
325	N	81.9	Confident	84.6	Confident	32 Å²	32	55.6 Å²	55.6	17%	0.171	29%	0.287	C	S	.	.	H	α-helix	trans	-120.7	1.6	-172.8	-66.2	-90.7	0	0	0	114.5	Y321 L322 D323 L405	Y321-N325 WeakPolarHBondContact CD2-ND2 3.4Å; Y321-N325 WeakPolarHBondContact CE2-ND2 3.33Å; Y321-N325 WeakPolarHBondContact O-CB 3.49Å; Y321-N325 PolarHBondContact O-N 3.44Å; Y321-N325 PolarHBondContact O-ND2 3.24Å; L322-N325 PolarHBondContact O-N 2.86Å; D323-N325 PolarHBondContact O-N 3.12Å; N325-L405 HydrophobicContact CB-CB 4.13Å; N325-L405 HydrophobicContact CB-CD1 3.96Å; N325-L405 HydrophobicContact CB-CG 4.2Å; N325-L405 PolarHBondContact OD1-N 3.26Å
326	V	85.8	Confident	84.6	Confident	23 Å²	23	54 Å²	54	14%	0.139	29%	0.291	C	S	.	.	S	Bend	trans	-106.6	164.8	175.4	176.1	0	0	0	0	109.3	L322 D323 N330 A331 Y334	L322-V326 HydrophobicContact CD1-CG2 4.18Å; L322-V326 HydrophobicContact CG-CG2 4.5Å; L322-V326 WeakPolarHBondContact O-CB 3.23Å; L322-V326 WeakPolarHBondContact O-CG2 3.44Å; L322-V326 PolarHBondContact O-N 3.06Å; D323-V326 PolarHBondContact O-N 3.44Å; V326-N330 HydrophobicContact CG1-CB 3.84Å; V326-A331 HydrophobicContact CB-CB 4.3Å; V326-A331 HydrophobicContact CG1-CB 4.22Å; V326-Y334 HydrophobicContact CB-CD2 4.46Å; V326-Y334 HydrophobicContact CG1-CD2 3.92Å; V326-Y334 HydrophobicContact CG1-CE2 4.23Å; V326-Y334 HydrophobicContact CG1-CG 4.17Å; V326-Y334 HydrophobicContact CG2-CD2 3.6Å; V326-Y334 HydrophobicContact CG2-CE2 4.07Å; V326-Y334 HydrophobicContact CG2-CG 4.42Å
327	K	83.2	Confident	84.8	Confident	132 Å²	132	55.8 Å²	55.8	57%	0.574	30%	0.299	S	S	*	.			trans	-67.2	137.1	168.6	-74	-172.6	167.8	-161.4	0	109	D329 N330 A331	K327-D329 PolarHBondContact O-N 2.94Å; K327-D329 VanDerWaalsContact O-N 3.14Å; K327-N330 HydrophobicContact CB-CB 4.48Å; K327-N330 CarbonylContact O-C 3.56Å; K327-N330 PolarHBondContact O-N 2.87Å; K327-A331 PolarHBondContact O-N 3.43Å
328	K	79.5	Confident	84.9	Confident	156 Å²	156	55.8 Å²	55.8	68%	0.678	30%	0.299	S	S	*	.	H	α-helix	trans	-49.2	-44	177.8	-65.1	-165	172.4	-164.6	0	112.4	N330 A331 S443	K328-N330 PolarHBondContact O-N 3.05Å; K328-N330 VanDerWaalsContact O-N 3.14Å; K328-A331 PolarHBondContact O-N 3.07Å; K328-S443 PolarHBondContact NZ-OG 3.42Å
329	D	80.5	Confident	84.9	Confident	122 Å²	122	61.2 Å²	61.2	65%	0.652	32%	0.32	S	S	*	.	H	α-helix	trans	-54.9	-29.1	176.5	-14.2	-46.1	0	0	0	114.5	K327	K327-D329 PolarHBondContact O-N 2.94Å; K327-D329 VanDerWaalsContact O-N 3.14Å
330	N	83.9	Confident	85	Confident	67 Å²	67	64.6 Å²	64.6	36%	0.358	34%	0.34	S	S	.	.	H	α-helix	trans	-110.1	-10.9	-177	-67.8	-15.9	0	0	0	113.5	V326 K327 K328 L333 Y334	V326-N330 HydrophobicContact CG1-CB 3.84Å; K327-N330 HydrophobicContact CB-CB 4.48Å; K327-N330 CarbonylContact O-C 3.56Å; K327-N330 PolarHBondContact O-N 2.87Å; K328-N330 PolarHBondContact O-N 3.05Å; K328-N330 VanDerWaalsContact O-N 3.14Å; N330-L333 PolarHBondContact O-N 3.33Å; N330-Y334 HydrophobicContact CB-CE1 4.44Å; N330-Y334 WeakPolarHBondContact O-CD1 3.17Å; N330-Y334 PolarHBondContact O-N 3.15Å
331	A	81.6	Confident	85.3	Confident	1 Å²	1	64.2 Å²	64.2	1%	0.008	33%	0.334	C	S	.	.	H	α-helix	trans	-68.1	-42.2	-169.8	0	0	0	0	0	111.8	D323 V326 K327 K328 L333 Y334 L335	D323-A331 VanDerWaalsContact OD1-CB 3.23Å; D323-A331 WeakPolarHBondContact OD1-CB 3.29Å; V326-A331 HydrophobicContact CB-CB 4.3Å; V326-A331 HydrophobicContact CG1-CB 4.22Å; K327-A331 PolarHBondContact O-N 3.43Å; K328-A331 PolarHBondContact O-N 3.07Å; A331-L333 VanDerWaalsContact C-N 3.32Å; A331-L333 PolarHBondContact O-N 3.49Å; A331-Y334 PolarHBondContact O-N 3.17Å; A331-Y334 VanDerWaalsContact O-N 3.15Å; A331-L335 WeakPolarHBondContact O-CB 3.4Å; A331-L335 VanDerWaalsContact O-CG 3.31Å; A331-L335 WeakPolarHBondContact O-CG 3.03Å; A331-L335 PolarHBondContact O-N 3.02Å
332	S	81.9	Confident	85.5	Confident	83 Å²	83	64.5 Å²	64.5	58%	0.58	34%	0.338	S	S	*	.	H	α-helix	trans	-57.5	-41.3	173.1	53.8	0	0	0	0	112.9	A336	S332-A336 WeakPolarHBondContact O-CB 3.14Å; S332-A336 PolarHBondContact O-N 3.24Å
333	L	85.8	Confident	85.5	Confident	97 Å²	97	67.4 Å²	67.4	51%	0.508	36%	0.363	S	S	.	.	H	α-helix	trans	-65.3	-42.4	175	177.4	63.5	0	0	0	111.7	N330 A331 A336 I337	N330-L333 PolarHBondContact O-N 3.33Å; A331-L333 VanDerWaalsContact C-N 3.32Å; A331-L333 PolarHBondContact O-N 3.49Å; L333-A336 PolarHBondContact O-N 3.25Å; L333-I337 HydrophobicContact CD1-CD1 4.21Å; L333-I337 HydrophobicContact CD1-CG1 4.45Å; L333-I337 HydrophobicContact CG-CD1 4.06Å; L333-I337 VanDerWaalsContact O-CG1 3.29Å; L333-I337 WeakPolarHBondContact O-CG1 3.48Å; L333-I337 PolarHBondContact O-N 2.87Å
334	Y	87.8	Confident	85.9	Confident	30 Å²	30	67.9 Å²	67.9	12%	0.118	37%	0.365	C	S	.	.	H	α-helix	trans	-68.1	-38.7	-179.6	-81.4	32.6	0	0	0	111	L163 L322 V326 N330 A331 M338	L163-Y334 HydrophobicContact CB-CD2 4.29Å; L163-Y334 WeakPolarHBondContact CD1-O 3.09Å; L163-Y334 HydrophobicContact CD2-CD1 4.22Å; L163-Y334 HydrophobicContact CD2-CD2 3.78Å; L163-Y334 HydrophobicContact CD2-CE1 4.42Å; L163-Y334 HydrophobicContact CD2-CE2 4.02Å; L163-Y334 HydrophobicContact CD2-CG 3.89Å; L163-Y334 HydrophobicContact CG-CD2 4.42Å; L322-Y334 HydrophobicContact CD1-CD2 4.25Å; V326-Y334 HydrophobicContact CB-CD2 4.46Å; V326-Y334 HydrophobicContact CG1-CD2 3.92Å; V326-Y334 HydrophobicContact CG1-CE2 4.23Å; V326-Y334 HydrophobicContact CG1-CG 4.17Å; V326-Y334 HydrophobicContact CG2-CD2 3.6Å; V326-Y334 HydrophobicContact CG2-CE2 4.07Å; V326-Y334 HydrophobicContact CG2-CG 4.42Å; N330-Y334 HydrophobicContact CB-CE1 4.44Å; N330-Y334 WeakPolarHBondContact O-CD1 3.17Å; N330-Y334 PolarHBondContact O-N 3.15Å; A331-Y334 PolarHBondContact O-N 3.17Å; A331-Y334 VanDerWaalsContact O-N 3.15Å; Y334-M338 PolarHBondContact O-N 2.71Å
335	L	85.4	Confident	86.3	Confident	37 Å²	37	62.9 Å²	62.9	19%	0.194	34%	0.338	C	S	.	.	H	α-helix	trans	-61.9	-45.9	170.9	-70.9	167.2	0	0	0	111.7	P319 L322 A331 I337 M338 Y339	P319-L335 HydrophobicContact CB-CD2 3.66Å; L322-L335 HydrophobicContact CD2-CD2 4.14Å; L322-L335 HydrophobicContact CD2-CG 4.44Å; A331-L335 WeakPolarHBondContact O-CB 3.4Å; A331-L335 VanDerWaalsContact O-CG 3.31Å; A331-L335 WeakPolarHBondContact O-CG 3.03Å; A331-L335 PolarHBondContact O-N 3.02Å; L335-I337 PolarHBondContact O-N 3.25Å; L335-M338 HydrophobicContact CD2-CE 3.8Å; L335-M338 PolarHBondContact O-N 3.41Å; L335-Y339 HydrophobicContact CB-CE2 4.45Å; L335-Y339 WeakPolarHBondContact O-CD2 3.32Å; L335-Y339 PolarHBondContact O-N 2.89Å
336	A	85.1	Confident	86.9	Confident	50 Å²	50	62.1 Å²	62.1	41%	0.413	34%	0.335	S	S	.	.	H	α-helix	trans	-60.3	-44.6	178.7	0	0	0	0	0	112.4	S332 L333 M338 Y339 V340	S332-A336 WeakPolarHBondContact O-CB 3.14Å; S332-A336 PolarHBondContact O-N 3.24Å; L333-A336 PolarHBondContact O-N 3.25Å; A336-M338 VanDerWaalsContact C-N 3.33Å; A336-M338 PolarHBondContact O-N 3.4Å; A336-Y339 PolarHBondContact O-N 3.44Å; A336-V340 WeakPolarHBondContact O-CG2 3.38Å; A336-V340 PolarHBondContact O-N 2.94Å
337	I	89.9	Confident	87.3	Confident	69 Å²	69	61.8 Å²	61.8	35%	0.354	34%	0.335	S	S	.	.	H	α-helix	trans	-59	-44.5	176.9	-67.3	162.6	0	0	0	111	L333 L335 V340 M341	L333-I337 HydrophobicContact CD1-CD1 4.21Å; L333-I337 HydrophobicContact CD1-CG1 4.45Å; L333-I337 HydrophobicContact CG-CD1 4.06Å; L333-I337 VanDerWaalsContact O-CG1 3.29Å; L333-I337 WeakPolarHBondContact O-CG1 3.48Å; L333-I337 PolarHBondContact O-N 2.87Å; L335-I337 PolarHBondContact O-N 3.25Å; I337-V340 PolarHBondContact O-N 2.78Å; I337-M341 WeakPolarHBondContact O-CG 3.49Å; I337-M341 PolarHBondContact O-N 3.3Å
338	M	89.9	Confident	87.9	Confident	3 Å²	3	56.9 Å²	56.9	2%	0.015	32%	0.319	C	S	.	.	H	α-helix	trans	-63.7	-40.4	178.8	174.6	-170.9	70.4	0	0	112.9	L163 M166 T170 P319 L322 Y334 L335 A336 G342	L163-M338 HydrophobicContact CD1-CB 4.45Å; M166-M338 HydrophobicContact CB-SD 4.25Å; M166-M338 HydrophobicContact CE-SD 4Å; T170-M338 HydrophobicContact CG2-CG 4.01Å; T170-M338 PolarHBondContact OG1-O 3.01Å; P319-M338 HydrophobicContact CB-CE 3.98Å; P319-M338 HydrophobicContact CG-CE 3.66Å; L322-M338 HydrophobicContact CD2-CE 4.43Å; L322-M338 HydrophobicContact CD2-SD 4.08Å; Y334-M338 PolarHBondContact O-N 2.71Å; L335-M338 HydrophobicContact CD2-CE 3.8Å; L335-M338 PolarHBondContact O-N 3.41Å; A336-M338 VanDerWaalsContact C-N 3.33Å; A336-M338 PolarHBondContact O-N 3.4Å; M338-G342 PolarHBondContact O-N 2.94Å; M338-G342 VanDerWaalsContact O-N 3.12Å
339	Y	88.2	Confident	88.7	Confident	114 Å²	114	49.5 Å²	49.5	45%	0.447	29%	0.287	S	S	.	.	H	α-helix	trans	-72.4	-36.2	175.7	-71.1	-59.2	0	0	0	112.8	Y315 P319 L335 A336 M341 G342 A343	Y315-Y339 HydrophobicContact CD1-CE1 4.46Å; P319-Y339 WeakPolarHBondContact CG-OH 3.46Å; L335-Y339 HydrophobicContact CB-CE2 4.45Å; L335-Y339 WeakPolarHBondContact O-CD2 3.32Å; L335-Y339 PolarHBondContact O-N 2.89Å; A336-Y339 PolarHBondContact O-N 3.44Å; Y339-M341 VanDerWaalsContact C-N 3.35Å; Y339-G342 CarbonylContact O-C 3.39Å; Y339-G342 WeakPolarHBondContact O-CA 3.49Å; Y339-G342 PolarHBondContact O-N 3.17Å; Y339-G342 VanDerWaalsContact O-N 3.16Å; Y339-A343 PolarHBondContact O-N 2.9Å
340	V	89.9	Confident	89.4	Confident	86 Å²	86	43.8 Å²	43.8	52%	0.521	26%	0.256	S	S	.	.	H	α-helix	trans	-62.4	-41.7	172.7	168.5	0	0	0	0	111	A336 I337 G342 A343 L344	A336-V340 WeakPolarHBondContact O-CG2 3.38Å; A336-V340 PolarHBondContact O-N 2.94Å; I337-V340 PolarHBondContact O-N 2.78Å; V340-G342 VanDerWaalsContact C-N 3.3Å; V340-G342 PolarHBondContact O-N 3.31Å; V340-A343 CarbonylContact O-C 3.38Å; V340-A343 PolarHBondContact O-N 2.84Å; V340-A343 VanDerWaalsContact O-N 3.08Å; V340-L344 HydrophobicContact CG1-CD1 4.15Å; V340-L344 HydrophobicContact CG1-CG 4.48Å; V340-L344 WeakPolarHBondContact O-CG 3.43Å; V340-L344 PolarHBondContact O-N 3.3Å
341	M	90.6	Very high	90	Very high	56 Å²	56	43.9 Å²	43.9	28%	0.276	26%	0.256	S	S	.	.	H	α-helix	trans	-63.4	-35.6	173.2	-70.3	-59.1	-50.9	0	0	112.5	C167 F171 I337 Y339 A343 L344 G345	C167-M341 HydrophobicContact CB-CB 4.2Å; C167-M341 HydrophobicContact CB-CG 3.94Å; F171-M341 HydrophobicContact CB-CE 4Å; F171-M341 HydrophobicContact CD2-CE 3.76Å; F171-M341 HydrophobicContact CE2-CE 4.45Å; F171-M341 HydrophobicContact CG-CE 3.94Å; I337-M341 WeakPolarHBondContact O-CG 3.49Å; I337-M341 PolarHBondContact O-N 3.3Å; Y339-M341 VanDerWaalsContact C-N 3.35Å; M341-A343 VanDerWaalsContact C-N 3.34Å; M341-L344 PolarHBondContact O-N 3.49Å; M341-L344 HydrophobicContact SD-CD1 4.05Å; M341-G345 PolarHBondContact O-N 3.49Å
342	G	90.3	Very high	90.7	Very high	10 Å²	10	46 Å²	46	10%	0.103	27%	0.267	C	S	.	.	H	α-helix	trans	-62.5	-37.4	169.5	0	0	0	0	0	113.3	S174 M338 Y339 V340 P346	S174-G342 VanDerWaalsContact CB-O 3.27Å; S174-G342 WeakPolarHBondContact CB-O 3.13Å; S174-G342 PolarHBondContact OG-O 2.78Å; M338-G342 PolarHBondContact O-N 2.94Å; M338-G342 VanDerWaalsContact O-N 3.12Å; Y339-G342 CarbonylContact O-C 3.39Å; Y339-G342 WeakPolarHBondContact O-CA 3.49Å; Y339-G342 PolarHBondContact O-N 3.17Å; Y339-G342 VanDerWaalsContact O-N 3.16Å; V340-G342 VanDerWaalsContact C-N 3.3Å; V340-G342 PolarHBondContact O-N 3.31Å; G342-P346 WeakPolarHBondContact O-CD 3.37Å
343	A	87.2	Confident	91.4	Very high	64 Å²	64	42 Å²	42	53%	0.529	24%	0.239	S	C	.	.	H	α-helix	trans	-77.4	-21.6	177.9	0	0	0	0	0	114	Y339 V340 M341 P346	Y339-A343 PolarHBondContact O-N 2.9Å; V340-A343 CarbonylContact O-C 3.38Å; V340-A343 PolarHBondContact O-N 2.84Å; V340-A343 VanDerWaalsContact O-N 3.08Å; M341-A343 VanDerWaalsContact C-N 3.34Å; A343-P346 WeakPolarHBondContact O-CD 3.37Å
344	L	91.3	Very high	91.7	Very high	89 Å²	89	37.4 Å²	37.4	47%	0.466	22%	0.215	S	C	.	.	H	α-helix	trans	-80.7	-22.6	172.7	-70.9	171.2	0	0	0	113	F171 V340 M341 A347 A348	F171-L344 HydrophobicContact CD2-CB 4.46Å; F171-L344 HydrophobicContact CE2-CB 4.39Å; V340-L344 HydrophobicContact CG1-CD1 4.15Å; V340-L344 HydrophobicContact CG1-CG 4.48Å; V340-L344 WeakPolarHBondContact O-CG 3.43Å; V340-L344 PolarHBondContact O-N 3.3Å; M341-L344 PolarHBondContact O-N 3.49Å; M341-L344 HydrophobicContact SD-CD1 4.05Å; L344-A347 PolarHBondContact O-N 3.06Å; L344-A348 PolarHBondContact O-N 2.99Å
345	G	93.8	Very high	92.1	Very high	0 Å²	0	39.7 Å²	39.7	0%	0	23%	0.232	C	C	.	.	H	α-helix	trans	-50.1	-54.4	178.1	0	0	0	0	0	114	L175 M341 A347 A348 G349	L175-G345 VanDerWaalsContact CA-O 3.25Å; L175-G345 WeakPolarHBondContact CA-O 3.25Å; L175-G345 WeakPolarHBondContact CB-O 3.42Å; M341-G345 PolarHBondContact O-N 3.49Å; G345-A347 PolarHBondContact O-N 3.29Å; G345-A348 PolarHBondContact O-N 3.48Å; G345-A348 VanDerWaalsContact O-N 3.15Å; G345-G349 PolarHBondContact O-N 2.99Å
346	P	93.8	Very high	92.5	Very high	16 Å²	16	39.5 Å²	39.5	10%	0.104	23%	0.231	C	C	.	.	H	α-helix	trans	-61.4	-40.7	-174.2	-24.3	35.6	0	0	0	112.7	S174 G179 G342 A343 A348 G349 Y350	S174-P346 WeakPolarHBondContact OG-CD 3.25Å; G179-P346 WeakPolarHBondContact CA-O 3.38Å; G342-P346 WeakPolarHBondContact O-CD 3.37Å; A343-P346 WeakPolarHBondContact O-CD 3.37Å; P346-A348 PolarHBondContact O-N 3.16Å; P346-G349 WeakPolarHBondContact O-CA 3.48Å; P346-G349 PolarHBondContact O-N 3.2Å; P346-Y350 HydrophobicContact CB-CE2 4.3Å; P346-Y350 WeakPolarHBondContact O-CD2 3.3Å; P346-Y350 PolarHBondContact O-N 3.46Å
347	A	93.7	Very high	92.9	Very high	16 Å²	16	37.3 Å²	37.3	13%	0.132	21%	0.212	C	C	.	.	H	α-helix	trans	-57.7	-48.2	175.8	0	0	0	0	0	111.5	L344 G345 G349 Y350 L351 V512	L344-A347 PolarHBondContact O-N 3.06Å; G345-A347 PolarHBondContact O-N 3.29Å; A347-G349 VanDerWaalsContact C-N 3.26Å; A347-G349 PolarHBondContact O-N 3.31Å; A347-Y350 PolarHBondContact O-N 2.87Å; A347-L351 VanDerWaalsContact O-CG 3.3Å; A347-L351 WeakPolarHBondContact O-CG 3.44Å; A347-L351 PolarHBondContact O-N 2.92Å; A347-L351 VanDerWaalsContact O-N 3.17Å; A347-V512 HydrophobicContact CB-CB 3.92Å; A347-V512 HydrophobicContact CB-CG1 3.85Å; A347-V512 HydrophobicContact CB-CG2 4.39Å
348	A	95.6	Very high	92.8	Very high	29 Å²	29	34.7 Å²	34.7	24%	0.24	20%	0.203	C	C	.	.	H	α-helix	trans	-64.2	-32	174.6	0	0	0	0	0	112.4	F171 L175 L344 G345 P346 L351 L352	F171-A348 HydrophobicContact CE2-CB 3.86Å; F171-A348 HydrophobicContact CZ-CB 3.56Å; L175-A348 HydrophobicContact CD1-CB 3.89Å; L175-A348 HydrophobicContact CG-CB 4.32Å; L344-A348 PolarHBondContact O-N 2.99Å; G345-A348 PolarHBondContact O-N 3.48Å; G345-A348 VanDerWaalsContact O-N 3.15Å; P346-A348 PolarHBondContact O-N 3.16Å; A348-L351 PolarHBondContact O-N 3.38Å; A348-L352 VanDerWaalsContact O-CB 3.25Å; A348-L352 WeakPolarHBondContact O-CB 3.32Å; A348-L352 PolarHBondContact O-N 3.46Å
349	G	96.4	Very high	92.8	Very high	0 Å²	0	40.7 Å²	40.7	0%	0	23%	0.229	C	C	.	.	H	α-helix	trans	-69.4	-42.6	178.4	0	0	0	0	0	113.2	G345 P346 A347 G353	G345-G349 PolarHBondContact O-N 2.99Å; P346-G349 WeakPolarHBondContact O-CA 3.48Å; P346-G349 PolarHBondContact O-N 3.2Å; A347-G349 VanDerWaalsContact C-N 3.26Å; A347-G349 PolarHBondContact O-N 3.31Å; G349-G353 WeakPolarHBondContact O-CA 3.44Å; G349-G353 PolarHBondContact O-N 3.46Å
350	Y	96.1	Very high	92.8	Very high	3 Å²	3	36.6 Å²	36.6	1%	0.012	21%	0.213	C	C	.	.	H	α-helix	trans	-65.2	-38	172.6	-73.8	-67.3	0	0	0	112.8	S178 S182 P346 A347 G353 G354 I485 P489 T507 G508 V512	S178-Y350 PolarHBondContact O-OH 3.05Å; S182-Y350 WeakPolarHBondContact CB-OH 3.4Å; P346-Y350 HydrophobicContact CB-CE2 4.3Å; P346-Y350 WeakPolarHBondContact O-CD2 3.3Å; P346-Y350 PolarHBondContact O-N 3.46Å; A347-Y350 PolarHBondContact O-N 2.87Å; Y350-G353 PolarHBondContact O-N 3.44Å; Y350-G354 PolarHBondContact O-N 3.07Å; Y350-I485 WeakPolarHBondContact OH-CA 3.31Å; Y350-I485 WeakPolarHBondContact OH-CG2 3.34Å; Y350-I485 PolarHBondContact OH-O 3.44Å; Y350-P489 HydrophobicContact CD1-CG 4.3Å; Y350-P489 HydrophobicContact CE1-CG 3.83Å; Y350-T507 HydrophobicContact CD1-CG2 3.69Å; Y350-T507 HydrophobicContact CD2-CG2 4.08Å; Y350-T507 HydrophobicContact CE1-CG2 3.51Å; Y350-T507 HydrophobicContact CE2-CG2 3.97Å; Y350-T507 HydrophobicContact CG-CG2 3.99Å; Y350-G508 VanDerWaalsContact CB-CA 3.45Å; Y350-V512 HydrophobicContact CD2-CG2 3.93Å; Y350-V512 HydrophobicContact CE2-CG2 3.94Å
351	L	96.4	Very high	92.6	Very high	68 Å²	68	32.6 Å²	32.6	36%	0.356	19%	0.188	S	C	.	.	H	α-helix	trans	-70.7	-46.2	178.4	-68.2	170.8	0	0	0	111.4	A347 A348 G353 V355 I505	A347-L351 VanDerWaalsContact O-CG 3.3Å; A347-L351 WeakPolarHBondContact O-CG 3.44Å; A347-L351 PolarHBondContact O-N 2.92Å; A347-L351 VanDerWaalsContact O-N 3.17Å; A348-L351 PolarHBondContact O-N 3.38Å; L351-G353 VanDerWaalsContact C-N 3.28Å; L351-G353 PolarHBondContact O-N 3.04Å; L351-V355 WeakPolarHBondContact O-CG2 3.35Å; L351-V355 PolarHBondContact O-N 3.37Å; L351-V355 VanDerWaalsContact O-N 3.07Å; L351-I505 HydrophobicContact CD2-CG2 4.16Å
352	L	96.2	Very high	92.3	Very high	45 Å²	45	31.6 Å²	31.6	24%	0.236	18%	0.184	C	C	.	.	H	α-helix	trans	-59.9	-42.6	171.7	-179.7	67.2	0	0	0	111	L175 Y180 A348 V355 L356 L386	L175-L352 HydrophobicContact CD2-CD2 3.91Å; Y180-L352 HydrophobicContact CD2-CD2 4.45Å; Y180-L352 HydrophobicContact CD2-CG 4.39Å; A348-L352 VanDerWaalsContact O-CB 3.25Å; A348-L352 WeakPolarHBondContact O-CB 3.32Å; A348-L352 PolarHBondContact O-N 3.46Å; L352-V355 PolarHBondContact O-N 3.17Å; L352-L356 HydrophobicContact CD1-CD1 3.8Å; L352-L356 HydrophobicContact CD1-CG 4.09Å; L352-L356 HydrophobicContact CD2-CD1 4.44Å; L352-L356 HydrophobicContact CG-CD1 3.83Å; L352-L356 HydrophobicContact CG-CG 4.38Å; L352-L356 WeakPolarHBondContact O-CB 3.27Å; L352-L356 WeakPolarHBondContact O-CG 3.32Å; L352-L356 PolarHBondContact O-N 3.21Å; L352-L386 HydrophobicContact CD1-CD2 4.2Å; L352-L386 HydrophobicContact CD2-CD2 4.34Å
353	G	95.1	Very high	91.7	Very high	0 Å²	0	35.6 Å²	35.6	0%	0	21%	0.208	C	C	.	.	H	α-helix	trans	-51.3	-64.8	173	0	0	0	0	0	112.9	S183 G349 Y350 L351 V355 L356 I357	S183-G353 WeakPolarHBondContact OG-CA 3.31Å; G349-G353 WeakPolarHBondContact O-CA 3.44Å; G349-G353 PolarHBondContact O-N 3.46Å; Y350-G353 PolarHBondContact O-N 3.44Å; L351-G353 VanDerWaalsContact C-N 3.28Å; L351-G353 PolarHBondContact O-N 3.04Å; G353-V355 VanDerWaalsContact C-N 3.25Å; G353-V355 PolarHBondContact O-N 3.31Å; G353-L356 PolarHBondContact O-N 3.16Å; G353-L356 VanDerWaalsContact O-N 3.12Å; G353-I357 VanDerWaalsContact O-CG1 3.3Å; G353-I357 WeakPolarHBondContact O-CG1 3.43Å; G353-I357 PolarHBondContact O-N 3.36Å
354	G	94.1	Very high	91	Very high	0 Å²	0	42.1 Å²	42.1	0%	0	23%	0.225	C	C	.	.	H	α-helix	trans	-59.1	-33.1	-178.7	0	0	0	0	0	113.8	Y350 G358 S501	Y350-G354 PolarHBondContact O-N 3.07Å; G354-G358 PolarHBondContact O-N 3.02Å; G354-S501 VanDerWaalsContact O-CB 3.28Å; G354-S501 WeakPolarHBondContact O-CB 3.44Å; G354-S501 PolarHBondContact O-OG 3.24Å
355	V	95	Very high	90	Very high	79 Å²	79	41.4 Å²	41.4	48%	0.479	22%	0.224	S	C	.	.	H	α-helix	trans	-70	-49	172.8	170.7	0	0	0	0	111.5	L351 L352 G353 G358 F359	L351-V355 WeakPolarHBondContact O-CG2 3.35Å; L351-V355 PolarHBondContact O-N 3.37Å; L351-V355 VanDerWaalsContact O-N 3.07Å; L352-V355 PolarHBondContact O-N 3.17Å; G353-V355 VanDerWaalsContact C-N 3.25Å; G353-V355 PolarHBondContact O-N 3.31Å; V355-G358 PolarHBondContact O-N 2.98Å; V355-F359 HydrophobicContact CG1-CE2 4.24Å; V355-F359 VanDerWaalsContact O-CD2 3.29Å; V355-F359 WeakPolarHBondContact O-CD2 3.37Å; V355-F359 WeakPolarHBondContact O-CE2 3.4Å
356	L	94.4	Very high	88.5	Confident	32 Å²	32	48 Å²	48	17%	0.168	26%	0.264	C	S	.	.	H	α-helix	trans	-68.1	-43.1	-176.9	-70.3	177.5	0	0	0	112.5	Y180 L352 G353 G358 F359 N379	Y180-L356 HydrophobicContact CE2-CB 4.33Å; Y180-L356 HydrophobicContact CE2-CD1 3.8Å; L352-L356 HydrophobicContact CD1-CD1 3.8Å; L352-L356 HydrophobicContact CD1-CG 4.09Å; L352-L356 HydrophobicContact CD2-CD1 4.44Å; L352-L356 HydrophobicContact CG-CD1 3.83Å; L352-L356 HydrophobicContact CG-CG 4.38Å; L352-L356 WeakPolarHBondContact O-CB 3.27Å; L352-L356 WeakPolarHBondContact O-CG 3.32Å; L352-L356 PolarHBondContact O-N 3.21Å; G353-L356 PolarHBondContact O-N 3.16Å; G353-L356 VanDerWaalsContact O-N 3.12Å; L356-G358 PolarHBondContact O-N 2.73Å; L356-F359 PolarHBondContact O-N 3.22Å; L356-F359 VanDerWaalsContact O-N 3.08Å; L356-N379 WeakPolarHBondContact O-CB 3.38Å
357	I	93.3	Very high	87.2	Confident	4 Å²	4	49.1 Å²	49.1	2%	0.021	27%	0.271	C	S	.	.	T	Hydrogen-bonded Turn	trans	-71.7	-7.2	175.3	72.8	-163.8	0	0	0	113.5	S183 V184 G353 F376 G378 A500	S183-I357 VanDerWaalsContact O-CD1 3.32Å; S183-I357 WeakPolarHBondContact O-CD1 3.3Å; V184-I357 HydrophobicContact CG1-CG2 3.76Å; G353-I357 VanDerWaalsContact O-CG1 3.3Å; G353-I357 WeakPolarHBondContact O-CG1 3.43Å; G353-I357 PolarHBondContact O-N 3.36Å; I357-F376 WeakPolarHBondContact O-CE1 3.28Å; I357-G378 WeakPolarHBondContact O-CA 3.22Å; I357-A500 HydrophobicContact CD1-CB 3.97Å
358	G	88.6	Confident	85.7	Confident	15 Å²	15	55.9 Å²	55.9	16%	0.155	31%	0.305	C	S	.	.	T	Hydrogen-bonded Turn	trans	-73.5	-16.4	168.1	0	0	0	0	0	113.4	G354 V355 L356 Q371	G354-G358 PolarHBondContact O-N 3.02Å; V355-G358 PolarHBondContact O-N 2.98Å; L356-G358 PolarHBondContact O-N 2.73Å; G358-Q371 PolarHBondContact O-NE2 3.43Å
359	F	89.1	Confident	84.4	Confident	129 Å²	129	56 Å²	56	57%	0.566	30%	0.301	S	S	*	.	S	Bend	trans	-97.1	145.8	170.8	-59.1	-79.7	0	0	0	110.4	V355 L356 G378 N379	V355-F359 HydrophobicContact CG1-CE2 4.24Å; V355-F359 VanDerWaalsContact O-CD2 3.29Å; V355-F359 WeakPolarHBondContact O-CD2 3.37Å; V355-F359 WeakPolarHBondContact O-CE2 3.4Å; L356-F359 PolarHBondContact O-N 3.22Å; L356-F359 VanDerWaalsContact O-N 3.08Å; F359-G378 CarbonylContact O-C 3.39Å; F359-G378 VanDerWaalsContact O-CA 3.31Å; F359-G378 WeakPolarHBondContact O-CA 3.4Å; F359-N379 PolarHBondContact O-N 3.39Å
360	Y	87.6	Confident	83.2	Confident	28 Å²	28	60.6 Å²	60.6	11%	0.11	33%	0.326	C	S	.	.	B	Isolated β-bridge	trans	-60.6	150.6	176.8	-175.2	-108.3	0	0	0	112.3	Y254 I256 D362 T365 V367 F376	Y254-Y360 HydrophobicContact CD1-CE2 4.35Å; Y254-Y360 VanDerWaalsContact CD1-OH 3.29Å; Y254-Y360 WeakPolarHBondContact CD1-OH 3.47Å; Y254-Y360 PolarHBondContact O-OH 3.35Å; I256-Y360 HydrophobicContact CD1-CE2 3.66Å; I256-Y360 WeakPolarHBondContact CD1-OH 3.23Å; I256-Y360 HydrophobicContact CG1-CE2 4.39Å; I256-Y360 WeakPolarHBondContact CG1-OH 3.41Å; Y360-D362 VanDerWaalsContact C-N 3.28Å; Y360-D362 HydrophobicContact CD1-CB 4.23Å; Y360-D362 HydrophobicContact CE1-CB 3.98Å; Y360-D362 PolarHBondContact O-N 2.72Å; Y360-T365 WeakPolarHBondContact CD1-OG1 3.34Å; Y360-T365 VanDerWaalsContact CE1-OG1 3.24Å; Y360-T365 WeakPolarHBondContact CE1-OG1 3.23Å; Y360-V367 HydrophobicContact CD1-CG2 4.43Å; Y360-V367 HydrophobicContact CE1-CG2 4.14Å; Y360-F376 HydrophobicContact CD2-CD2 4.22Å; Y360-F376 HydrophobicContact CD2-CE2 4.13Å
361	V	87	Confident	82.4	Confident	1 Å²	1	63.3 Å²	63.3	1%	0.006	34%	0.338	C	S	.	.	S	Bend	trans	-56.6	-35.9	-172.6	62.2	0	0	0	0	114.3	Y254 P363 V377 W381	Y254-V361 HydrophobicContact CD1-CG1 4.03Å; Y254-V361 HydrophobicContact CG-CG1 4.5Å; V361-P363 WeakPolarHBondContact O-CD 3.28Å; V361-V377 HydrophobicContact CB-CB 4.28Å; V361-V377 HydrophobicContact CB-CG1 3.97Å; V361-V377 WeakPolarHBondContact CB-O 3.37Å; V361-V377 HydrophobicContact CG1-CB 4.14Å; V361-V377 HydrophobicContact CG1-CG1 4.24Å; V361-V377 HydrophobicContact CG2-CG1 4.23Å; V361-V377 PolarHBondContact N-O 3.35Å; V361-W381 PolarHBondContact O-NE1 2.86Å
362	D	83.5	Confident	81.2	Confident	35 Å²	35	64.3 Å²	64.3	19%	0.187	34%	0.344	C	S	.	.	S	Bend	trans	-111.3	98.8	179.4	-78.1	-62	0	0	0	111	H248 Y360 K364 T365	H248-D362 IonicContact CE1-OD1 2.94Å; H248-D362 PolarHBondContact CE1-OD1 2.99Å; H248-D362 IonicContact NE2-OD1 3.88Å; Y360-D362 VanDerWaalsContact C-N 3.28Å; Y360-D362 HydrophobicContact CD1-CB 4.23Å; Y360-D362 HydrophobicContact CE1-CB 3.98Å; Y360-D362 PolarHBondContact O-N 2.72Å; D362-K364 PolarHBondContact O-N 3.17Å; D362-T365 HydrophobicContact CB-CG2 4.5Å; D362-T365 PolarHBondContact O-N 2.92Å; D362-T365 PolarHBondContact O-OG1 3.31Å
363	P	77.3	Confident	80	Confident	94 Å²	94	63.7 Å²	63.7	61%	0.61	34%	0.341	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.4	5.7	-172.9	-23.5	35.3	0	0	0	116.5	V361 W381	V361-P363 WeakPolarHBondContact O-CD 3.28Å; P363-W381 HydrophobicContact CG-CZ2 4.44Å
364	K	72.8	Confident	78.8	Confident	202 Å²	202	65.3 Å²	65.3	88%	0.878	35%	0.352	S	S	*	.	T	Hydrogen-bonded Turn	trans	-106.2	-20.6	-179.3	-65.6	-179.5	-178.3	174.8	0	113.3	D362	D362-K364 PolarHBondContact O-N 3.17Å
365	T	70.9	Confident	77.8	Confident	73 Å²	73	69 Å²	69	45%	0.448	37%	0.365	S	S	.	.	S	Bend	trans	-89	116.9	179.1	48.7	0	0	0	0	109.1	Y360 D362 V367	Y360-T365 WeakPolarHBondContact CD1-OG1 3.34Å; Y360-T365 VanDerWaalsContact CE1-OG1 3.24Å; Y360-T365 WeakPolarHBondContact CE1-OG1 3.23Å; D362-T365 HydrophobicContact CB-CG2 4.5Å; D362-T365 PolarHBondContact O-N 2.92Å; D362-T365 PolarHBondContact O-OG1 3.31Å; T365-V367 PolarHBondContact O-N 3.01Å
366	V	62.4	Low	77.3	Confident	140 Å²	140	66.4 Å²	66.4	85%	0.848	35%	0.348	S	S	*	.			trans	-78.7	101.8	173.2	-177.3	0	0	0	0	107.8
367	V	64.8	Low	76.9	Confident	38 Å²	38	65 Å²	65	23%	0.23	34%	0.34	C	S	.	.			trans	-116	123.6	-176.3	174.8	0	0	0	0	108.5	I256 Y360 T365 I369	I256-V367 HydrophobicContact CD1-CB 4.47Å; I256-V367 HydrophobicContact CD1-CG1 3.55Å; I256-V367 HydrophobicContact CD1-CG2 4.13Å; Y360-V367 HydrophobicContact CD1-CG2 4.43Å; Y360-V367 HydrophobicContact CE1-CG2 4.14Å; T365-V367 PolarHBondContact O-N 3.01Å; V367-I369 VanDerWaalsContact C-N 3.26Å; V367-I369 HydrophobicContact CG1-CB 3.77Å; V367-I369 HydrophobicContact CG1-CD1 3.81Å; V367-I369 HydrophobicContact CG1-CG1 3.61Å; V367-I369 PolarHBondContact O-N 3.33Å; V367-I369 VanDerWaalsContact O-N 3.16Å
368	N	63.5	Low	76.7	Confident	159 Å²	159	64.8 Å²	64.8	85%	0.85	34%	0.339	S	S	*	.			trans	-90	55.2	179.9	-73.1	-26.7	0	0	0	111.3
369	I	68.6	Low	76.9	Confident	30 Å²	30	64.6 Å²	64.6	15%	0.154	34%	0.335	C	S	.	.			trans	-120.6	131.1	179.8	-63.8	-176.1	0	0	0	109.8	I256 V367 D373	I256-I369 HydrophobicContact CD1-CD1 3.9Å; I256-I369 HydrophobicContact CG2-CD1 3.95Å; V367-I369 VanDerWaalsContact C-N 3.26Å; V367-I369 HydrophobicContact CG1-CB 3.77Å; V367-I369 HydrophobicContact CG1-CD1 3.81Å; V367-I369 HydrophobicContact CG1-CG1 3.61Å; V367-I369 PolarHBondContact O-N 3.33Å; V367-I369 VanDerWaalsContact O-N 3.16Å; I369-D373 HydrophobicContact CG2-CB 3.3Å
370	D	70.9	Confident	77.2	Confident	98 Å²	98	58.4 Å²	58.4	52%	0.524	31%	0.308	S	S	.	.			trans	-78	155.9	179.1	-178.1	32.9	0	0	0	112.3	N372 D373	D370-N372 PolarHBondContact O-N 3.04Å; D370-N372 PolarHBondContact OD2-ND2 3.12Å; D370-D373 WeakPolarHBondContact O-CB 3.49Å; D370-D373 PolarHBondContact O-N 3.37Å
371	Q	78.8	Confident	77.5	Confident	60 Å²	60	59 Å²	59	28%	0.28	31%	0.309	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.1	-10	-178.9	-61	-179.4	1.7	0	0	114.1	G358 F376 P499	G358-Q371 PolarHBondContact O-NE2 3.43Å; Q371-F376 HydrophobicContact CG-CE1 4.23Å; Q371-F376 HydrophobicContact CG-CE2 4.43Å; Q371-F376 HydrophobicContact CG-CZ 4.1Å; Q371-P499 HydrophobicContact CB-CB 3.92Å; Q371-P499 HydrophobicContact CB-CG 3.91Å
372	N	71.3	Confident	77.9	Confident	88 Å²	88	60 Å²	60	47%	0.471	32%	0.317	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.2	-13.4	175.3	-63.7	-56.9	0	0	0	113.3	D370 P499	D370-N372 PolarHBondContact O-N 3.04Å; D370-N372 PolarHBondContact OD2-ND2 3.12Å; N372-P499 VanDerWaalsContact OD1-CD 3.24Å; N372-P499 WeakPolarHBondContact OD1-CD 2.94Å; N372-P499 WeakPolarHBondContact OD1-CG 2.97Å
373	D	71.6	Confident	78.4	Confident	33 Å²	33	58.3 Å²	58.3	18%	0.176	31%	0.308	C	S	.	.	S	Bend	trans	-69.3	132.5	178.1	-169.6	-57.5	0	0	0	110.7	I369 D370 R375 F376	I369-D373 HydrophobicContact CG2-CB 3.3Å; D370-D373 WeakPolarHBondContact O-CB 3.49Å; D370-D373 PolarHBondContact O-N 3.37Å; D373-R375 PolarHBondContact O-N 3.03Å; D373-R375 VanDerWaalsContact O-N 3.1Å; D373-R375 VanDerWaalsContact OD1-CB 3.23Å; D373-R375 WeakPolarHBondContact OD1-CB 3.47Å; D373-R375 WeakPolarHBondContact OD1-CG 3.31Å; D373-R375 IonicContact OD1-CZ 3.48Å; D373-R375 PolarHBondContact OD1-N 3.16Å; D373-R375 IonicContact OD1-NE 2.67Å; D373-R375 PolarHBondContact OD1-NE 3.42Å; D373-R375 IonicContact OD1-NH2 2.71Å; D373-R375 IonicContact OD2-CZ 2.97Å; D373-R375 IonicContact OD2-NE 3.06Å; D373-R375 PolarHBondContact OD2-NE 2.95Å; D373-R375 IonicContact OD2-NH2 2.85Å; D373-R375 PolarHBondContact OD2-NH2 3.08Å; D373-F376 WeakPolarHBondContact O-CB 3.42Å; D373-F376 PolarHBondContact O-N 3.29Å
374	P	69	Low	79.3	Confident	34 Å²	34	53.9 Å²	53.9	22%	0.221	28%	0.279	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60.7	-20.7	179.9	25.3	-35.6	0	0	0	114.3	Y599 P601	P374-Y599 HydrophobicContact CB-CE1 4.14Å; P374-Y599 HydrophobicContact CG-CE1 4.31Å; P374-P601 HydrophobicContact CG-CG 3.8Å
375	R	74	Confident	80.4	Confident	77 Å²	77	46.6 Å²	46.6	29%	0.291	25%	0.249	S	C	.	.	T	Hydrogen-bonded Turn	trans	-86.6	-5	177.8	-54.3	166.8	-65.9	170.7	4.1	112.7	Y254 D373 V377	Y254-R375 WeakPolarHBondContact CE1-O 3.47Å; Y254-R375 PolarHBondContact OH-O 3.48Å; D373-R375 PolarHBondContact O-N 3.03Å; D373-R375 VanDerWaalsContact O-N 3.1Å; D373-R375 VanDerWaalsContact OD1-CB 3.23Å; D373-R375 WeakPolarHBondContact OD1-CB 3.47Å; D373-R375 WeakPolarHBondContact OD1-CG 3.31Å; D373-R375 IonicContact OD1-CZ 3.48Å; D373-R375 PolarHBondContact OD1-N 3.16Å; D373-R375 IonicContact OD1-NE 2.67Å; D373-R375 PolarHBondContact OD1-NE 3.42Å; D373-R375 IonicContact OD1-NH2 2.71Å; D373-R375 IonicContact OD2-CZ 2.97Å; D373-R375 IonicContact OD2-NE 3.06Å; D373-R375 PolarHBondContact OD2-NE 2.95Å; D373-R375 IonicContact OD2-NH2 2.85Å; D373-R375 PolarHBondContact OD2-NH2 3.08Å; R375-V377 PolarHBondContact O-N 3.26Å
376	F	83.4	Confident	81.6	Confident	24 Å²	24	47.6 Å²	47.6	11%	0.105	25%	0.252	C	S	.	.			trans	-71.1	113.4	177.9	-176.3	-87.8	0	0	0	111.1	I357 Y360 Q371 D373	I357-F376 WeakPolarHBondContact O-CE1 3.28Å; Y360-F376 HydrophobicContact CD2-CD2 4.22Å; Y360-F376 HydrophobicContact CD2-CE2 4.13Å; Q371-F376 HydrophobicContact CG-CE1 4.23Å; Q371-F376 HydrophobicContact CG-CE2 4.43Å; Q371-F376 HydrophobicContact CG-CZ 4.1Å; D373-F376 WeakPolarHBondContact O-CB 3.42Å; D373-F376 PolarHBondContact O-N 3.29Å
377	V	86.9	Confident	83.2	Confident	2 Å²	2	41.1 Å²	41.1	1%	0.012	21%	0.212	C	C	.	.			trans	-103.9	119	171.2	-178	0	0	0	0	108.9	R191 Y254 V361 R375	R191-V377 HydrophobicContact CB-CG1 4.1Å; Y254-V377 HydrophobicContact CD1-CB 4.14Å; Y254-V377 HydrophobicContact CD1-CG2 3.97Å; Y254-V377 HydrophobicContact CE1-CB 4.04Å; Y254-V377 HydrophobicContact CE1-CG2 3.49Å; Y254-V377 VanDerWaalsContact CE1-CG2 3.49Å; Y254-V377 HydrophobicContact CE2-CG2 4.33Å; V361-V377 HydrophobicContact CB-CB 4.28Å; V361-V377 HydrophobicContact CB-CG1 3.97Å; V361-V377 WeakPolarHBondContact CB-O 3.37Å; V361-V377 HydrophobicContact CG1-CB 4.14Å; V361-V377 HydrophobicContact CG1-CG1 4.24Å; V361-V377 HydrophobicContact CG2-CG1 4.23Å; V361-V377 PolarHBondContact N-O 3.35Å; R375-V377 PolarHBondContact O-N 3.26Å
378	G	89.6	Confident	84.6	Confident	0 Å²	0	39.8 Å²	39.8	0%	0	21%	0.205	C	C	.	.	B	Isolated β-bridge	trans	-80.6	160.2	178.4	0	0	0	0	0	114	I357 F359 W380	I357-G378 WeakPolarHBondContact O-CA 3.22Å; F359-G378 CarbonylContact O-C 3.39Å; F359-G378 VanDerWaalsContact O-CA 3.31Å; F359-G378 WeakPolarHBondContact O-CA 3.4Å; G378-W380 PolarHBondContact O-N 2.96Å
379	N	92.8	Very high	86.1	Confident	11 Å²	11	37.2 Å²	37.2	6%	0.059	19%	0.19	C	C	.	.			trans	-71	85.7	-179.9	-169.8	-32.4	0	0	0	112.9	Y180 L356 F359 W381 S382	Y180-N379 PolarHBondContact OH-O 3.3Å; L356-N379 WeakPolarHBondContact O-CB 3.38Å; F359-N379 PolarHBondContact O-N 3.39Å; N379-W381 PolarHBondContact OD1-NE1 2.96Å; N379-S382 VanDerWaalsContact CG-OG 3.32Å; N379-S382 WeakPolarHBondContact OD1-CB 3.1Å; N379-S382 PolarHBondContact OD1-N 2.81Å; N379-S382 PolarHBondContact OD1-OG 2.9Å
380	W	94.3	Very high	87.3	Confident	0 Å²	0	36.3 Å²	36.3	0%	0	19%	0.187	C	C	.	.			trans	-85.3	-16.7	-178.4	63.9	-92.9	0	0	0	114.9	Y180 V184 I188 Y192 F244 H248 F300 G378 F384	Y180-W380 WeakPolarHBondContact CE1-O 3.45Å; Y180-W380 VanDerWaalsContact OH-C 3.25Å; Y180-W380 PolarHBondContact OH-O 3.44Å; V184-W380 HydrophobicContact CB-CB 3.78Å; V184-W380 HydrophobicContact CG1-CB 3.92Å; V184-W380 HydrophobicContact CG2-CB 4.44Å; I188-W380 HydrophobicContact CD1-CD2 4.33Å; I188-W380 HydrophobicContact CD1-CE3 3.81Å; I188-W380 HydrophobicContact CD1-CZ3 4.4Å; I188-W380 HydrophobicContact CG1-CB 4.21Å; I188-W380 HydrophobicContact CG1-CD2 3.81Å; I188-W380 HydrophobicContact CG1-CE3 3.8Å; I188-W380 HydrophobicContact CG1-CG 3.98Å; Y192-W380 HydrophobicContact CE2-CH2 4.13Å; Y192-W380 AromaticContact CE2-CZ2 3.64Å; Y192-W380 HydrophobicContact CE2-CZ2 3.64Å; Y192-W380 AromaticContact CZ-CZ2 3.94Å; Y192-W380 VanDerWaalsContact OH-CZ2 3.28Å; Y192-W380 WeakPolarHBondContact OH-CZ2 3.25Å; F244-W380 HydrophobicContact CD1-CZ3 4.42Å; F244-W380 HydrophobicContact CE1-CZ3 4.43Å; H248-W380 HydrophobicContact CB-CH2 4.02Å; H248-W380 HydrophobicContact CB-CZ2 3.67Å; F300-W380 AromaticContact CE1-CH2 3.98Å; F300-W380 HydrophobicContact CE1-CH2 3.98Å; F300-W380 AromaticContact CE1-CZ3 3.85Å; F300-W380 HydrophobicContact CE1-CZ3 3.85Å; F300-W380 AromaticContact CZ-CH2 3.99Å; F300-W380 HydrophobicContact CZ-CH2 3.99Å; F300-W380 HydrophobicContact CZ-CZ3 4.21Å; G378-W380 PolarHBondContact O-N 2.96Å; W380-F384 HydrophobicContact CE3-CE2 4.43Å; W380-F384 WeakPolarHBondContact O-CD2 3.46Å; W380-F384 WeakPolarHBondContact O-CE2 3.27Å
381	W	94.8	Very high	88.3	Confident	39 Å²	39	31.7 Å²	31.7	15%	0.148	16%	0.162	C	C	.	.	S	Bend	trans	-91.7	-33.4	-170.9	57.9	-95.3	0	0	0	112.7	H248 F249 V361 P363 N379 G383 F384 L385	H248-W381 HydrophobicContact CB-CB 4.15Å; H248-W381 HydrophobicContact CB-CG 4.18Å; H248-W381 AromaticContact CD2-CD1 3.33Å; H248-W381 AromaticContact CD2-CD2 3.48Å; H248-W381 VanDerWaalsContact CD2-CD2 3.48Å; H248-W381 AromaticContact CD2-CE2 3.41Å; H248-W381 VanDerWaalsContact CD2-CE2 3.41Å; H248-W381 AromaticContact CD2-CG 3.46Å; H248-W381 VanDerWaalsContact CD2-CG 3.46Å; H248-W381 AromaticContact CD2-NE1 3.31Å; H248-W381 PolarHBondContact CD2-NE1 3.45Å; H248-W381 VanDerWaalsContact CD2-NE1 3.31Å; H248-W381 AromaticContact CE1-NE1 3.66Å; H248-W381 AromaticContact CG-CD1 3.56Å; H248-W381 AromaticContact CG-CG 3.85Å; H248-W381 AromaticContact CG-NE1 3.91Å; H248-W381 AromaticContact ND1-CD1 3.97Å; H248-W381 AromaticContact NE2-CD1 3.64Å; H248-W381 AromaticContact NE2-CD2 3.95Å; H248-W381 AromaticContact NE2-CE2 3.34Å; H248-W381 VanDerWaalsContact NE2-CE2 3.34Å; H248-W381 AromaticContact NE2-CZ2 3.76Å; H248-W381 AromaticContact NE2-NE1 3.13Å; H248-W381 PolarHBondContact NE2-NE1 3.41Å; H248-W381 VanDerWaalsContact NE2-NE1 3.13Å; F249-W381 HydrophobicContact CE1-CE3 4.49Å; F249-W381 HydrophobicContact CE1-CZ3 4.36Å; F249-W381 HydrophobicContact CE2-CE3 4.36Å; F249-W381 HydrophobicContact CZ-CD2 4.29Å; F249-W381 AromaticContact CZ-CE3 3.66Å; F249-W381 HydrophobicContact CZ-CE3 3.66Å; F249-W381 HydrophobicContact CZ-CH2 4.43Å; F249-W381 AromaticContact CZ-CZ3 3.76Å; F249-W381 HydrophobicContact CZ-CZ3 3.76Å; V361-W381 PolarHBondContact O-NE1 2.86Å; P363-W381 HydrophobicContact CG-CZ2 4.44Å; N379-W381 PolarHBondContact OD1-NE1 2.96Å; W381-G383 VanDerWaalsContact C-N 3.34Å; W381-G383 PolarHBondContact O-N 2.92Å; W381-F384 PolarHBondContact O-N 3.43Å; W381-L385 HydrophobicContact CE3-CD1 3.9Å; W381-L385 HydrophobicContact CZ3-CD1 3.91Å
382	S	94.4	Very high	88.9	Confident	22 Å²	22	32 Å²	32	15%	0.154	17%	0.165	C	C	.	.	H	α-helix	trans	-63.8	-34.3	-170.7	56.9	0	0	0	0	113.8	N379 F384 L385 L386	N379-S382 VanDerWaalsContact CG-OG 3.32Å; N379-S382 WeakPolarHBondContact OD1-CB 3.1Å; N379-S382 PolarHBondContact OD1-N 2.81Å; N379-S382 PolarHBondContact OD1-OG 2.9Å; S382-F384 VanDerWaalsContact C-N 3.34Å; S382-F384 PolarHBondContact O-N 3.24Å; S382-L385 PolarHBondContact O-N 3.25Å; S382-L386 WeakPolarHBondContact O-CB 3.32Å; S382-L386 PolarHBondContact O-N 3Å
383	G	94.8	Very high	89.7	Confident	0 Å²	0	33.2 Å²	33.2	0%	0	17%	0.171	C	C	.	.	H	α-helix	trans	-67.8	-31.1	179	0	0	0	0	0	113.3	Y180 W381 L386 C387	Y180-G383 VanDerWaalsContact CZ-CA 3.43Å; Y180-G383 WeakPolarHBondContact OH-CA 3.24Å; Y180-G383 PolarHBondContact OH-N 3.02Å; Y180-G383 VanDerWaalsContact OH-N 3.07Å; W381-G383 VanDerWaalsContact C-N 3.34Å; W381-G383 PolarHBondContact O-N 2.92Å; G383-L386 PolarHBondContact O-N 3.01Å; G383-C387 WeakPolarHBondContact O-CB 3.37Å; G383-C387 PolarHBondContact O-N 2.92Å; G383-C387 PolarHBondContact O-SG 2.94Å
384	F	96.4	Very high	90.4	Very high	1 Å²	1	32.3 Å²	32.3	0%	0.004	17%	0.167	C	C	.	.	H	α-helix	trans	-68.2	-40.6	174.2	-66.1	-72.7	0	0	0	111.7	M176 Y180 L181 V184 F244 W380 W381 S382 C387 S388	M176-F384 HydrophobicContact CG-CD1 3.75Å; M176-F384 HydrophobicContact CG-CE1 3.98Å; M176-F384 HydrophobicContact SD-CD1 4.04Å; Y180-F384 HydrophobicContact CD1-CD1 4.26Å; Y180-F384 HydrophobicContact CD1-CD2 4.06Å; Y180-F384 AromaticContact CD1-CE1 3.99Å; Y180-F384 HydrophobicContact CD1-CE1 3.99Å; Y180-F384 AromaticContact CD1-CE2 3.78Å; Y180-F384 HydrophobicContact CD1-CE2 3.78Å; Y180-F384 HydrophobicContact CD1-CG 4.28Å; Y180-F384 AromaticContact CD1-CZ 3.74Å; Y180-F384 HydrophobicContact CD1-CZ 3.74Å; Y180-F384 AromaticContact CE1-CD2 3.61Å; Y180-F384 HydrophobicContact CE1-CD2 3.61Å; Y180-F384 AromaticContact CE1-CE2 3.54Å; Y180-F384 HydrophobicContact CE1-CE2 3.54Å; Y180-F384 HydrophobicContact CE1-CG 4.12Å; Y180-F384 HydrophobicContact CE1-CZ 4.02Å; L181-F384 HydrophobicContact CB-CZ 4.47Å; L181-F384 HydrophobicContact CD1-CZ 4.05Å; V184-F384 HydrophobicContact CG2-CE2 4.08Å; V184-F384 HydrophobicContact CG2-CZ 4.18Å; F244-F384 HydrophobicContact CD1-CD1 4.07Å; F244-F384 AromaticContact CD1-CD2 3.65Å; F244-F384 HydrophobicContact CD1-CD2 3.65Å; F244-F384 AromaticContact CD1-CE1 3.83Å; F244-F384 HydrophobicContact CD1-CE1 3.83Å; F244-F384 AromaticContact CD1-CE2 3.38Å; F244-F384 HydrophobicContact CD1-CE2 3.38Å; F244-F384 HydrophobicContact CD1-CG 4.01Å; F244-F384 AromaticContact CD1-CZ 3.48Å; F244-F384 HydrophobicContact CD1-CZ 3.48Å; F244-F384 VanDerWaalsContact CD1-CZ 3.48Å; F244-F384 HydrophobicContact CE1-CD2 4.19Å; F244-F384 HydrophobicContact CE1-CE1 4.14Å; F244-F384 AromaticContact CE1-CE2 3.45Å; F244-F384 HydrophobicContact CE1-CE2 3.45Å; F244-F384 VanDerWaalsContact CE1-CE2 3.45Å; F244-F384 AromaticContact CE1-CZ 3.42Å; F244-F384 HydrophobicContact CE1-CZ 3.42Å; F244-F384 VanDerWaalsContact CE1-CZ 3.42Å; F244-F384 HydrophobicContact CG-CD1 4.48Å; F244-F384 HydrophobicContact CG-CE1 4.36Å; F244-F384 HydrophobicContact CG-CZ 4.4Å; F244-F384 HydrophobicContact CZ-CZ 4.32Å; W380-F384 HydrophobicContact CE3-CE2 4.43Å; W380-F384 WeakPolarHBondContact O-CD2 3.46Å; W380-F384 WeakPolarHBondContact O-CE2 3.27Å; W381-F384 PolarHBondContact O-N 3.43Å; S382-F384 VanDerWaalsContact C-N 3.34Å; S382-F384 PolarHBondContact O-N 3.24Å; F384-C387 PolarHBondContact O-N 3.23Å; F384-S388 WeakPolarHBondContact O-CB 3.42Å; F384-S388 PolarHBondContact O-N 3.44Å
385	L	95.8	Very high	91.2	Very high	50 Å²	50	30.9 Å²	30.9	26%	0.262	16%	0.157	S	C	.	.	H	α-helix	trans	-67.2	-41.9	173.7	-70.8	179.7	0	0	0	112.1	A242 S245 F249 W381 S382 C387 S388 I389	A242-L385 HydrophobicContact CB-CD2 4.39Å; S245-L385 VanDerWaalsContact OG-CD2 3.28Å; S245-L385 WeakPolarHBondContact OG-CD2 3.34Å; F249-L385 HydrophobicContact CE2-CD1 4.05Å; F249-L385 HydrophobicContact CZ-CD1 3.91Å; W381-L385 HydrophobicContact CE3-CD1 3.9Å; W381-L385 HydrophobicContact CZ3-CD1 3.91Å; S382-L385 PolarHBondContact O-N 3.25Å; L385-C387 VanDerWaalsContact C-N 3.33Å; L385-C387 PolarHBondContact O-N 3.03Å; L385-S388 WeakPolarHBondContact O-CB 3.39Å; L385-S388 PolarHBondContact O-N 3.09Å; L385-I389 WeakPolarHBondContact O-CG1 3.45Å; L385-I389 PolarHBondContact O-N 2.95Å
386	L	95.4	Very high	91.5	Very high	94 Å²	94	34.8 Å²	34.8	49%	0.492	18%	0.177	S	C	.	.	H	α-helix	trans	-58.9	-44.4	174.3	-178.2	61.8	0	0	0	111.3	L352 S382 G383 A390	L352-L386 HydrophobicContact CD1-CD2 4.2Å; L352-L386 HydrophobicContact CD2-CD2 4.34Å; S382-L386 WeakPolarHBondContact O-CB 3.32Å; S382-L386 PolarHBondContact O-N 3Å; G383-L386 PolarHBondContact O-N 3.01Å; L386-A390 VanDerWaalsContact O-CB 3.31Å; L386-A390 WeakPolarHBondContact O-CB 3.45Å; L386-A390 PolarHBondContact O-N 3.33Å
387	C	95.2	Very high	91.4	Very high	4 Å²	4	35.9 Å²	35.9	3%	0.027	19%	0.186	C	C	.	.	H	α-helix	trans	-65.6	-40	174.6	-68.1	0	0	0	0	112.4	I172 M176 G383 F384 L385 A390 M391	I172-C387 HydrophobicContact CG2-CB 4.01Å; M176-C387 HydrophobicContact CB-CB 4.2Å; M176-C387 HydrophobicContact CG-CB 4.04Å; M176-C387 HydrophobicContact SD-CB 3.72Å; G383-C387 WeakPolarHBondContact O-CB 3.37Å; G383-C387 PolarHBondContact O-N 2.92Å; G383-C387 PolarHBondContact O-SG 2.94Å; F384-C387 PolarHBondContact O-N 3.23Å; L385-C387 VanDerWaalsContact C-N 3.33Å; L385-C387 PolarHBondContact O-N 3.03Å; C387-A390 PolarHBondContact O-N 3.05Å; C387-M391 VanDerWaalsContact O-CG 3.25Å; C387-M391 WeakPolarHBondContact O-CG 3.48Å; C387-M391 PolarHBondContact O-N 3.38Å
388	S	95.4	Very high	91.2	Very high	10 Å²	10	35.8 Å²	35.8	7%	0.07	19%	0.186	C	C	.	.	H	α-helix	trans	-60.3	-48.5	176.5	-174.4	0	0	0	0	111.6	A238 F384 L385 A390 M391 L392	A238-S388 WeakPolarHBondContact CA-OG 3.33Å; A238-S388 PolarHBondContact O-OG 2.81Å; F384-S388 WeakPolarHBondContact O-CB 3.42Å; F384-S388 PolarHBondContact O-N 3.44Å; L385-S388 WeakPolarHBondContact O-CB 3.39Å; L385-S388 PolarHBondContact O-N 3.09Å; S388-A390 PolarHBondContact O-N 3.48Å; S388-M391 PolarHBondContact O-N 2.87Å; S388-L392 WeakPolarHBondContact O-CG 3.48Å; S388-L392 PolarHBondContact O-N 2.96Å
389	I	94.6	Very high	90.9	Very high	104 Å²	104	39.9 Å²	39.9	53%	0.533	20%	0.203	S	C	.	.	H	α-helix	trans	-61.7	-45.8	176.1	-65.5	165.9	0	0	0	110.6	L385 M391 L392 L393	L385-I389 WeakPolarHBondContact O-CG1 3.45Å; L385-I389 PolarHBondContact O-N 2.95Å; I389-M391 VanDerWaalsContact C-N 3.34Å; I389-M391 PolarHBondContact O-N 3.34Å; I389-L392 PolarHBondContact O-N 3.24Å; I389-L393 WeakPolarHBondContact O-CG 3.42Å; I389-L393 PolarHBondContact O-N 3.04Å; I389-L393 VanDerWaalsContact O-N 3.16Å
390	A	93.6	Very high	90.4	Very high	11 Å²	11	42.1 Å²	42.1	9%	0.091	22%	0.224	C	C	.	.	H	α-helix	trans	-57.3	-44.1	176.7	0	0	0	0	0	112.4	Y168 I172 L386 C387 S388 L393	Y168-A390 HydrophobicContact CE1-CB 4.32Å; Y168-A390 WeakPolarHBondContact CE1-O 3.47Å; Y168-A390 WeakPolarHBondContact OH-CB 3.46Å; I172-A390 HydrophobicContact CD1-CB 4.21Å; I172-A390 HydrophobicContact CG1-CB 4.34Å; I172-A390 HydrophobicContact CG2-CB 4.3Å; L386-A390 VanDerWaalsContact O-CB 3.31Å; L386-A390 WeakPolarHBondContact O-CB 3.45Å; L386-A390 PolarHBondContact O-N 3.33Å; C387-A390 PolarHBondContact O-N 3.05Å; S388-A390 PolarHBondContact O-N 3.48Å; A390-L393 PolarHBondContact O-N 3.39Å
391	M	91.8	Very high	89.7	Confident	1 Å²	1	42.4 Å²	42.4	1%	0.005	23%	0.225	C	C	.	.	H	α-helix	trans	-62.8	-45.8	176	-69.8	-67.3	-80.3	0	0	111.6	L169 I172 I237 A238 I314 C387 S388 I389 L393 V394 I395	L169-M391 HydrophobicContact CD2-CE 3.65Å; L169-M391 HydrophobicContact CD2-SD 3.7Å; I172-M391 HydrophobicContact CB-CG 4.48Å; I172-M391 HydrophobicContact CB-SD 3.85Å; I172-M391 HydrophobicContact CG2-CG 3.73Å; I172-M391 HydrophobicContact CG2-SD 3.75Å; I237-M391 HydrophobicContact CB-CE 4.15Å; I237-M391 HydrophobicContact CD1-CE 3.52Å; I237-M391 HydrophobicContact CG1-CE 4.46Å; I237-M391 HydrophobicContact CG2-CE 4.07Å; A238-M391 HydrophobicContact CB-CB 4.47Å; I314-M391 HydrophobicContact CD1-CE 4.34Å; C387-M391 VanDerWaalsContact O-CG 3.25Å; C387-M391 WeakPolarHBondContact O-CG 3.48Å; C387-M391 PolarHBondContact O-N 3.38Å; S388-M391 PolarHBondContact O-N 2.87Å; I389-M391 VanDerWaalsContact C-N 3.34Å; I389-M391 PolarHBondContact O-N 3.34Å; M391-L393 VanDerWaalsContact C-N 3.28Å; M391-L393 PolarHBondContact O-N 3.12Å; M391-V394 PolarHBondContact O-N 3.31Å; M391-V394 VanDerWaalsContact O-N 3.12Å; M391-I395 HydrophobicContact CB-CD1 4.22Å; M391-I395 VanDerWaalsContact O-CD1 3.28Å; M391-I395 WeakPolarHBondContact O-CD1 3.34Å; M391-I395 VanDerWaalsContact O-CG1 3.23Å; M391-I395 WeakPolarHBondContact O-CG1 3.37Å; M391-I395 PolarHBondContact O-N 3.02Å; M391-I395 VanDerWaalsContact O-N 3.08Å
392	L	90.9	Very high	88.6	Confident	66 Å²	66	42.7 Å²	42.7	35%	0.346	23%	0.232	S	C	.	.	H	α-helix	trans	-57.3	-38.4	179.3	-71.6	171	0	0	0	112.8	A238 S388 I389 V394 I395 F396	A238-L392 HydrophobicContact CB-CD1 4.44Å; A238-L392 HydrophobicContact CB-CD2 3.89Å; A238-L392 HydrophobicContact CB-CG 3.86Å; S388-L392 WeakPolarHBondContact O-CG 3.48Å; S388-L392 PolarHBondContact O-N 2.96Å; I389-L392 PolarHBondContact O-N 3.24Å; L392-V394 VanDerWaalsContact C-N 3.29Å; L392-V394 PolarHBondContact O-N 2.89Å; L392-I395 HydrophobicContact CD2-CD1 4.28Å; L392-I395 PolarHBondContact O-N 3.15Å; L392-F396 WeakPolarHBondContact O-CD2 3.42Å
393	L	89.6	Confident	87.4	Confident	115 Å²	115	48.4 Å²	48.4	60%	0.602	25%	0.254	S	S	*	.	H	α-helix	trans	-59.9	-34.6	177.4	-68.3	172.8	0	0	0	113.5	I389 A390 M391 P397	I389-L393 WeakPolarHBondContact O-CG 3.42Å; I389-L393 PolarHBondContact O-N 3.04Å; I389-L393 VanDerWaalsContact O-N 3.16Å; A390-L393 PolarHBondContact O-N 3.39Å; M391-L393 VanDerWaalsContact C-N 3.28Å; M391-L393 PolarHBondContact O-N 3.12Å; L393-P397 VanDerWaalsContact O-CD 3.25Å; L393-P397 WeakPolarHBondContact O-CD 3.26Å
394	V	85.8	Confident	85.9	Confident	14 Å²	14	56.5 Å²	56.5	9%	0.085	29%	0.289	C	S	.	.	H	α-helix	trans	-92.6	-21.1	-178.7	176.6	0	0	0	0	113	C165 Y168 L169 M391 L392 F396 P397 M398	C165-V394 HydrophobicContact CB-CG1 3.82Å; Y168-V394 HydrophobicContact CD1-CB 4.12Å; Y168-V394 HydrophobicContact CD1-CG2 3.39Å; Y168-V394 HydrophobicContact CE1-CB 4.5Å; Y168-V394 HydrophobicContact CE1-CG2 3.62Å; Y168-V394 HydrophobicContact CG-CG2 3.96Å; L169-V394 HydrophobicContact CD1-CG1 4.35Å; L169-V394 HydrophobicContact CD2-CB 4.33Å; L169-V394 HydrophobicContact CD2-CG1 4.11Å; L169-V394 HydrophobicContact CG-CG1 3.96Å; M391-V394 PolarHBondContact O-N 3.31Å; M391-V394 VanDerWaalsContact O-N 3.12Å; L392-V394 VanDerWaalsContact C-N 3.29Å; L392-V394 PolarHBondContact O-N 2.89Å; V394-F396 PolarHBondContact O-N 3.24Å; V394-P397 VanDerWaalsContact O-CD 3.3Å; V394-P397 WeakPolarHBondContact O-CD 3.31Å; V394-M398 HydrophobicContact CG1-CG 4.4Å; V394-M398 VanDerWaalsContact O-CG 3.25Å; V394-M398 WeakPolarHBondContact O-CG 3.36Å; V394-M398 PolarHBondContact O-N 3.38Å
395	I	85.4	Confident	84.4	Confident	4 Å²	4	57.4 Å²	57.4	2%	0.021	29%	0.294	C	S	.	.	H	α-helix	trans	-63.4	-39.5	175.2	-75	159.4	0	0	0	112.5	G234 V235 M391 L392 M398 F399	G234-I395 WeakPolarHBondContact O-CD1 3.5Å; V235-I395 HydrophobicContact CG2-CD1 4.33Å; V235-I395 HydrophobicContact CG2-CG2 3.71Å; M391-I395 HydrophobicContact CB-CD1 4.22Å; M391-I395 VanDerWaalsContact O-CD1 3.28Å; M391-I395 WeakPolarHBondContact O-CD1 3.34Å; M391-I395 VanDerWaalsContact O-CG1 3.23Å; M391-I395 WeakPolarHBondContact O-CG1 3.37Å; M391-I395 PolarHBondContact O-N 3.02Å; M391-I395 VanDerWaalsContact O-N 3.08Å; L392-I395 HydrophobicContact CD2-CD1 4.28Å; L392-I395 PolarHBondContact O-N 3.15Å; I395-M398 WeakPolarHBondContact O-CB 3.23Å; I395-M398 PolarHBondContact O-N 2.79Å; I395-M398 VanDerWaalsContact O-N 3.07Å; I395-F399 HydrophobicContact CG2-CD2 3.83Å; I395-F399 HydrophobicContact CG2-CE2 3.47Å; I395-F399 VanDerWaalsContact CG2-CE2 3.47Å; I395-F399 HydrophobicContact CG2-CZ 4.5Å; I395-F399 WeakPolarHBondContact O-CD2 3.13Å; I395-F399 PolarHBondContact O-N 2.89Å; I395-F399 VanDerWaalsContact O-N 3.16Å
396	F	81.8	Confident	82.3	Confident	158 Å²	158	58.6 Å²	58.6	69%	0.693	31%	0.305	S	S	*	.	H	α-helix	trans	-59.7	-47.7	178.2	-73.5	-72.2	0	0	0	113.1	L392 V394 M398	L392-F396 WeakPolarHBondContact O-CD2 3.42Å; V394-F396 PolarHBondContact O-N 3.24Å; F396-M398 PolarHBondContact O-N 3.31Å
397	P	81	Confident	80.3	Confident	47 Å²	47	58.9 Å²	58.9	31%	0.305	31%	0.312	S	S	.	.	H	α-helix	trans	-53.4	-44.9	166	-29.5	33.6	0	0	0	114.5	L156 L393 V394 F399 A400 F401	L156-P397 HydrophobicContact CD2-CB 4.41Å; L393-P397 VanDerWaalsContact O-CD 3.25Å; L393-P397 WeakPolarHBondContact O-CD 3.26Å; V394-P397 VanDerWaalsContact O-CD 3.3Å; V394-P397 WeakPolarHBondContact O-CD 3.31Å; P397-F399 PolarHBondContact O-N 3.13Å; P397-A400 PolarHBondContact O-N 2.62Å; P397-F401 VanDerWaalsContact O-CD2 3.31Å; P397-F401 WeakPolarHBondContact O-CD2 3.44Å
398	M	82.2	Confident	78.1	Confident	0 Å²	0	67.2 Å²	67.2	0%	0	34%	0.343	C	S	.	.	H	α-helix	trans	-60.3	-40.3	-175.1	-68.5	-85.7	83	0	0	113.1	F162 C165 L169 A231 V394 I395 F396 A400 F401	F162-M398 HydrophobicContact CD2-CE 3.61Å; F162-M398 HydrophobicContact CE2-CE 3.69Å; F162-M398 HydrophobicContact CE2-SD 4.26Å; C165-M398 HydrophobicContact CB-CE 3.4Å; C165-M398 VanDerWaalsContact CB-CE 3.4Å; C165-M398 HydrophobicContact CB-SD 4Å; L169-M398 HydrophobicContact CD1-CG 4.01Å; L169-M398 HydrophobicContact CD1-SD 3.74Å; A231-M398 HydrophobicContact CB-CB 3.79Å; V394-M398 HydrophobicContact CG1-CG 4.4Å; V394-M398 VanDerWaalsContact O-CG 3.25Å; V394-M398 WeakPolarHBondContact O-CG 3.36Å; V394-M398 PolarHBondContact O-N 3.38Å; I395-M398 WeakPolarHBondContact O-CB 3.23Å; I395-M398 PolarHBondContact O-N 2.79Å; I395-M398 VanDerWaalsContact O-N 3.07Å; F396-M398 PolarHBondContact O-N 3.31Å; M398-A400 PolarHBondContact O-N 3.43Å; M398-A400 VanDerWaalsContact O-N 3.16Å; M398-F401 HydrophobicContact CE-CD2 3.51Å; M398-F401 HydrophobicContact CE-CE2 3.32Å; M398-F401 HydrophobicContact CE-CG 4.43Å; M398-F401 HydrophobicContact CE-CZ 4.16Å; M398-F401 PolarHBondContact O-N 2.84Å
399	F	83.8	Confident	75.7	Confident	86 Å²	86	74 Å²	74	38%	0.377	37%	0.373	S	S	.	.	H	α-helix	trans	-60.4	-23.2	176	-82.3	-64	0	0	0	114.4	A231 V232 V235 I395 P397	A231-F399 HydrophobicContact CB-CB 4.49Å; A231-F399 HydrophobicContact CB-CD1 3.61Å; A231-F399 HydrophobicContact CB-CD2 3.77Å; A231-F399 HydrophobicContact CB-CE1 3.61Å; A231-F399 HydrophobicContact CB-CE2 3.79Å; A231-F399 HydrophobicContact CB-CG 3.68Å; A231-F399 HydrophobicContact CB-CZ 3.7Å; V232-F399 HydrophobicContact CG2-CE1 4.05Å; V232-F399 HydrophobicContact CG2-CZ 4.22Å; V235-F399 HydrophobicContact CG2-CE2 4.2Å; V235-F399 HydrophobicContact CG2-CZ 4.33Å; I395-F399 HydrophobicContact CG2-CD2 3.83Å; I395-F399 HydrophobicContact CG2-CE2 3.47Å; I395-F399 VanDerWaalsContact CG2-CE2 3.47Å; I395-F399 HydrophobicContact CG2-CZ 4.5Å; I395-F399 WeakPolarHBondContact O-CD2 3.13Å; I395-F399 PolarHBondContact O-N 2.89Å; I395-F399 VanDerWaalsContact O-N 3.16Å; P397-F399 PolarHBondContact O-N 3.13Å
400	A	81.2	Confident	73.2	Confident	58 Å²	58	77.3 Å²	77.3	48%	0.479	38%	0.383	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.9	-4.8	-174	0	0	0	0	0	114.5	L156 P397 M398	L156-A400 HydrophobicContact CD1-CB 3.44Å; L156-A400 VanDerWaalsContact CD1-CB 3.44Å; P397-A400 PolarHBondContact O-N 2.62Å; M398-A400 PolarHBondContact O-N 3.43Å; M398-A400 VanDerWaalsContact O-N 3.16Å
401	F	79.7	Confident	70.8	Confident	7 Å²	7	87.1 Å²	87.1	3%	0.031	42%	0.418	C	S	.	.	S	Bend	trans	-70.2	143.9	175.4	-82.6	-90.7	0	0	0	112.5	L156 C161 F162 P227 P397 M398 L405	L156-F401 HydrophobicContact CB-CD1 4.42Å; L156-F401 HydrophobicContact CB-CE1 4.33Å; L156-F401 HydrophobicContact CD2-CD2 3.71Å; L156-F401 HydrophobicContact CD2-CE1 4.21Å; L156-F401 HydrophobicContact CD2-CE2 3.31Å; L156-F401 HydrophobicContact CD2-CG 4.33Å; L156-F401 HydrophobicContact CD2-CZ 3.61Å; L156-F401 VanDerWaalsContact O-CD1 3.28Å; L156-F401 WeakPolarHBondContact O-CD1 3.39Å; L156-F401 WeakPolarHBondContact O-CE1 3.37Å; C161-F401 HydrophobicContact CB-CZ 4.4Å; F162-F401 HydrophobicContact CB-CD1 4.36Å; F162-F401 HydrophobicContact CB-CE1 3.7Å; F162-F401 HydrophobicContact CB-CZ 4Å; F162-F401 HydrophobicContact CD2-CD1 4.07Å; F162-F401 HydrophobicContact CD2-CD2 4.43Å; F162-F401 HydrophobicContact CD2-CE1 4.08Å; F162-F401 HydrophobicContact CD2-CE2 4.42Å; F162-F401 HydrophobicContact CD2-CG 4.25Å; F162-F401 HydrophobicContact CD2-CZ 4.25Å; F162-F401 HydrophobicContact CG-CE1 4.39Å; P227-F401 HydrophobicContact CB-CB 3.82Å; P227-F401 HydrophobicContact CG-CB 4.09Å; P397-F401 VanDerWaalsContact O-CD2 3.31Å; P397-F401 WeakPolarHBondContact O-CD2 3.44Å; M398-F401 HydrophobicContact CE-CD2 3.51Å; M398-F401 HydrophobicContact CE-CE2 3.32Å; M398-F401 HydrophobicContact CE-CG 4.43Å; M398-F401 HydrophobicContact CE-CZ 4.16Å; M398-F401 PolarHBondContact O-N 2.84Å; F401-L405 HydrophobicContact CD1-CD2 4.25Å
402	P	71.4	Confident	68.3	Low	45 Å²	45	95.6 Å²	95.6	29%	0.292	46%	0.455	S	S	.	.			trans	-73.3	162.8	179.5	32.1	-36.8	0	0	0	112.5	Y321 K404 L405	Y321-P402 PolarHBondContact OH-O 2.94Å; P402-K404 WeakPolarHBondContact CG-O 3.33Å; P402-K404 PolarHBondContact O-N 2.99Å; P402-K404 VanDerWaalsContact O-N 3.15Å; P402-L405 HydrophobicContact CG-CD2 3.97Å
403	K	69.3	Low	65.9	Low	141 Å²	141	101.1 Å²	101.1	61%	0.613	48%	0.476	S	S	*	.	S	Bend	trans	-57.8	-27.5	176.4	-65.2	-165.7	-174	-174.3	0	114.4	Q225	Q225-K403 HydrophobicContact CB-CG 4.43Å; Q225-K403 VanDerWaalsContact CD-CE 3.49Å; Q225-K403 HydrophobicContact CG-CD 4.06Å; Q225-K403 HydrophobicContact CG-CG 3.86Å
404	K	64.2	Low	63.4	Low	171 Å²	171	104.8 Å²	104.8	74%	0.743	49%	0.487	S	S	*	.	S	Bend	trans	-148.3	139	175.4	-62.3	-169.1	177.4	-167.3	0	107.7	P402	P402-K404 WeakPolarHBondContact CG-O 3.33Å; P402-K404 PolarHBondContact O-N 2.99Å; P402-K404 VanDerWaalsContact O-N 3.15Å
405	L	64.8	Low	61.1	Low	20 Å²	20	112.9 Å²	112.9	11%	0.105	52%	0.521	C	S	.	.	P	Polyproline II helix	trans	-72.1	133.3	173.3	-68.8	178.7	0	0	0	109.9	N325 F401 P402	N325-L405 HydrophobicContact CB-CB 4.13Å; N325-L405 HydrophobicContact CB-CD1 3.96Å; N325-L405 HydrophobicContact CB-CG 4.2Å; N325-L405 PolarHBondContact OD1-N 3.26Å; F401-L405 HydrophobicContact CD1-CD2 4.25Å; P402-L405 HydrophobicContact CG-CD2 3.97Å
406	P	51.9	Low	58.6	Low	75 Å²	75	122 Å²	122	49%	0.487	56%	0.561	S	S	.	*	P	Polyproline II helix	trans	-71.4	127.9	-176.5	27.6	-33.4	0	0	0	111	T157 R408	T157-P406 HydrophobicContact CG2-CG 3.94Å; P406-R408 PolarHBondContact O-N 3.31Å; P406-R408 VanDerWaalsContact O-N 3.11Å
407	P	53.3	Low	56.5	Low	99 Å²	99	122.9 Å²	122.9	64%	0.643	57%	0.569	S	S	*	*	P	Polyproline II helix	trans	-61.8	118	-173.2	21.5	-32.6	0	0	0	112.2	H409 K410	P407-H409 PolarHBondContact O-N 2.93Å; P407-K410 PolarHBondContact O-N 3.11Å
408	R	48.4	Very low	54.1	Low	180 Å²	180	125.5 Å²	125.5	68%	0.679	59%	0.589	S	S	*	*	T	Hydrogen-bonded Turn	trans	-51.3	-16.8	-166.1	-168.5	165.7	171.1	140.6	-1.9	116.2	D158 P406	D158-R408 IonicContact OD1-NH1 2.7Å; D158-R408 PolarHBondContact OD1-NH1 3.25Å; D158-R408 IonicContact OD2-NH1 2.78Å; D158-R408 PolarHBondContact OD2-NH1 3.4Å; P406-R408 PolarHBondContact O-N 3.31Å; P406-R408 VanDerWaalsContact O-N 3.11Å
409	H	45.6	Very low	51.8	Low	152 Å²	152	130.6 Å²	130.6	70%	0.704	62%	0.624	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92.5	-28.7	-177.2	-96.2	-101.8	0	0	0	116.7	P407 R411 K412	P407-H409 PolarHBondContact O-N 2.93Å; H409-R411 PolarHBondContact O-N 3.05Å; H409-R411 VanDerWaalsContact O-N 3.15Å; H409-K412 PolarHBondContact O-N 3.31Å
410	K	42.4	Very low	49.5	Very low	173 Å²	173	134.6 Å²	134.6	75%	0.752	65%	0.649	S	S	*	*	H	α-helix	trans	-68.3	-18.3	-171.4	-73.9	-164.2	176.7	-175.4	0	114.3	P407	P407-K410 PolarHBondContact O-N 3.11Å
411	R	42.5	Very low	47	Very low	218 Å²	218	134.8 Å²	134.8	82%	0.823	66%	0.657	S	S	*	*	H	α-helix	trans	-78.7	-17.7	175.8	-68.3	-174.4	91.2	170.3	5.3	115.2	H409	H409-R411 PolarHBondContact O-N 3.05Å; H409-R411 VanDerWaalsContact O-N 3.15Å
412	K	39.4	Very low	44.5	Very low	179 Å²	179	142 Å²	142	78%	0.778	70%	0.695	S	S	*	*	H	α-helix	trans	-83.2	-32.9	177.2	-82.3	-165.1	173.5	-172	0	113.8	H409	H409-K412 PolarHBondContact O-N 3.31Å
413	K	39.3	Very low	42.5	Very low	182 Å²	182	145.8 Å²	145.8	79%	0.791	72%	0.717	S	S	*	*	H	α-helix	trans	-75.1	-43.2	173.9	-102.7	-169	174	-171.7	0	112.8	K415 K416	K413-K415 PolarHBondContact O-N 2.94Å; K413-K416 PolarHBondContact O-N 3.46Å
414	K	37.8	Very low	40.4	Very low	191 Å²	191	144 Å²	144	83%	0.83	72%	0.723	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74	12	-176.6	-143.2	-172.7	-177.5	-176.6	0	115.6
415	K	37.1	Very low	38.6	Very low	185 Å²	185	140 Å²	140	80%	0.804	72%	0.716	S	S	*	*	T	Hydrogen-bonded Turn	trans	-127.3	15.4	171.9	-144.3	-164.2	-179	-162.9	0	113.3	K413	K413-K415 PolarHBondContact O-N 2.94Å
416	K	33.1	Very low	36.8	Very low	195 Å²	195	145.3 Å²	145.3	85%	0.848	75%	0.745	S	S	*	*	S	Bend	trans	-134	23	177.3	-141.6	-168.3	-175	-162	0	112.6	K413	K413-K416 PolarHBondContact O-N 3.46Å
417	M	37.1	Very low	35.6	Very low	177 Å²	177	149.1 Å²	149.1	87%	0.872	76%	0.761	S	S	*	*	S	Bend	trans	-145.8	40.1	-173.1	-160	79.4	-174.8	0	0	110.7
418	S	31.3	Very low	34.4	Very low	101 Å²	101	151 Å²	151	71%	0.706	77%	0.766	S	S	*	*	S	Bend	trans	-157.4	36.7	-175	67.5	0	0	0	0	111.4
419	S	34.8	Very low	33.3	Very low	108 Å²	108	146.9 Å²	146.9	76%	0.755	76%	0.76	S	S	*	*	S	Bend	trans	-166.4	61.1	-177.4	-179.4	0	0	0	0	110.7
420	L	34	Very low	32.4	Very low	170 Å²	170	148.6 Å²	148.6	89%	0.89	77%	0.766	S	S	*	*			trans	179.6	135.2	143.6	-119.8	67.4	0	0	0	108.7
421	G	30.4	Very low	31.6	Very low	62 Å²	62	148.7 Å²	148.7	64%	0.639	77%	0.766	S	S	*	*			trans	-84.4	-175.5	143.9	0	0	0	0	0	108.9
422	D	26.7	Very low	30.7	Very low	158 Å²	158	145.7 Å²	145.7	85%	0.845	76%	0.761	S	S	*	*			cis	-159.5	-170.5	6	-149.9	-30.5	0	0	0	108.8
423	V	29.8	Very low	30.1	Very low	124 Å²	124	147.3 Å²	147.3	75%	0.752	77%	0.768	S	S	*	*			trans	83.7	104.1	164.4	-168.1	0	0	0	0	119.3
424	S	25.3	Very low	29.2	Very low	105 Å²	105	144.5 Å²	144.5	73%	0.734	77%	0.772	S	S	*	*			trans	61.6	141.9	132.1	-138.9	0	0	0	0	125.9
425	S	24.8	Very low	28.4	Very low	85 Å²	85	140.6 Å²	140.6	59%	0.594	77%	0.769	S	S	*	*			trans	78.6	101.2	146.3	-68.6	0	0	0	0	123.5
426	D	27.5	Very low	27.7	Very low	133 Å²	133	136.6 Å²	136.6	71%	0.711	76%	0.764	S	S	*	*				65.4	122.5	110.4	-43.9	-36.6	0	0	0	121.9
427	D	27.5	Very low	27.2	Very low	154 Å²	154	136.1 Å²	136.1	82%	0.824	76%	0.762	S	S	*	*			trans	58.1	146.5	154.5	-59.5	-29.4	0	0	0	120
428	D	27.6	Very low	26.6	Very low	139 Å²	139	135.5 Å²	135.5	74%	0.743	76%	0.762	S	S	*	*			cis	-152.2	159.9	25.9	-155.7	0.3	0	0	0	115.3
429	V	26.3	Very low	26.2	Very low	94 Å²	94	138.4 Å²	138.4	57%	0.57	76%	0.764	S	S	*	*			trans	66	109.2	150.7	154.6	0	0	0	0	123
430	K	26	Very low	25.7	Very low	188 Å²	188	140.5 Å²	140.5	82%	0.817	77%	0.767	S	S	*	*			trans	62.7	120.2	141.3	-61.8	171.4	-168.5	155	0	122.5
431	K	25.2	Very low	25.4	Very low	175 Å²	175	138.6 Å²	138.6	76%	0.761	76%	0.762	S	S	*	*				-161	138.2	99.5	-118.3	-177.8	178.1	-112.9	0	116.1
432	E	24.2	Very low	25.2	Very low	155 Å²	155	139.7 Å²	139.7	72%	0.724	76%	0.76	S	S	*	*			trans	31.4	117.1	151.3	-69	163.3	135.5	0	0	122.3
433	K	25.5	Very low	25.3	Very low	212 Å²	212	136.6 Å²	136.6	92%	0.922	75%	0.751	S	S	*	*			trans	-85	133	146.3	-81.9	178.3	173.6	174.4	0	110
434	S	20.7	Very low	25.3	Very low	124 Å²	124	134.4 Å²	134.4	87%	0.867	74%	0.741	S	S	*	*			trans	-164.3	172.4	137.4	64.5	0	0	0	0	110.5
435	S	21.9	Very low	26.1	Very low	109 Å²	109	135.3 Å²	135.3	76%	0.762	74%	0.735	S	S	*	*			trans	-99.3	145	-167.1	-177.6	0	0	0	0	113.8
436	S	22	Very low	26.5	Very low	100 Å²	100	134.9 Å²	134.9	70%	0.699	74%	0.744	S	S	*	*			trans	133.6	148.4	130.2	73.8	0	0	0	0	116
437	K	23.3	Very low	27.5	Very low	185 Å²	185	134.6 Å²	134.6	80%	0.804	74%	0.737	S	S	*	*			trans	54.3	80.2	164.9	-64.9	177.1	179.8	173.1	0	116.8	Q439	K437-Q439 PolarHBondContact O-N 3.5Å
438	D	23.4	Very low	28.3	Very low	165 Å²	165	128.2 Å²	128.2	88%	0.882	71%	0.707	S	S	*	*			trans	-58.4	101.9	144.9	-107	-31.9	0	0	0	108.5	N440	D438-N440 PolarHBondContact O-N 2.94Å; D438-N440 VanDerWaalsContact O-N 3.09Å
439	Q	23.4	Very low	29.6	Very low	161 Å²	161	130.7 Å²	130.7	75%	0.752	71%	0.712	S	S	*	*			trans	-71.9	103.1	171.5	-69.7	-170.8	8.9	0	0	108.5	K437 V441	K437-Q439 PolarHBondContact O-N 3.5Å; Q439-V441 VanDerWaalsContact C-N 3.35Å; Q439-V441 PolarHBondContact O-N 3.02Å
440	N	23.8	Very low	30.9	Very low	153 Å²	153	131.1 Å²	131.1	82%	0.818	71%	0.711	S	S	*	*			trans	-58.6	100.4	162.8	-80.8	-56.3	0	0	0	108.6	D438 S442	D438-N440 PolarHBondContact O-N 2.94Å; D438-N440 VanDerWaalsContact O-N 3.09Å; N440-S442 PolarHBondContact O-N 3.22Å
441	V	27.4	Very low	32.8	Very low	129 Å²	129	127.5 Å²	127.5	78%	0.782	70%	0.699	S	S	*	*			trans	-71.6	66.6	167.2	-173.9	0	0	0	0	108.3	Q439 S443	Q439-V441 VanDerWaalsContact C-N 3.35Å; Q439-V441 PolarHBondContact O-N 3.02Å; V441-S443 VanDerWaalsContact C-N 3.25Å; V441-S443 PolarHBondContact O-N 2.76Å
442	S	26.2	Very low	34.9	Very low	86 Å²	86	127.4 Å²	127.4	60%	0.601	70%	0.699	S	S	*	*			trans	-79.2	82	173.9	-158.9	0	0	0	0	106.8	N440 S444	N440-S442 PolarHBondContact O-N 3.22Å; S442-S444 PolarHBondContact O-N 2.9Å; S442-S444 PolarHBondContact OG-OG 2.88Å; S442-S444 VanDerWaalsContact OG-OG 3.05Å
443	S	29.6	Very low	37.1	Very low	93 Å²	93	123.7 Å²	123.7	65%	0.65	68%	0.684	S	S	*	*			trans	-71.7	50.1	169.1	66.9	0	0	0	0	110.7	K328 V441	K328-S443 PolarHBondContact NZ-OG 3.42Å; V441-S443 VanDerWaalsContact C-N 3.25Å; V441-S443 PolarHBondContact O-N 2.76Å
444	S	30.8	Very low	39.4	Very low	78 Å²	78	117 Å²	117	55%	0.545	66%	0.658	S	S	.	*			trans	-106.9	121.1	170.2	57.4	0	0	0	0	107.2	S442 G446	S442-S444 PolarHBondContact O-N 2.9Å; S442-S444 PolarHBondContact OG-OG 2.88Å; S442-S444 VanDerWaalsContact OG-OG 3.05Å; S444-G446 PolarHBondContact O-N 3.27Å
445	M	41.5	Very low	42.2	Very low	124 Å²	124	114.6 Å²	114.6	61%	0.611	64%	0.639	S	S	*	*			trans	-49.2	139	-178.9	-66.2	159	57.5	0	0	111.3	F447 P716	M445-F447 PolarHBondContact O-N 2.92Å; M445-P716 HydrophobicContact CE-CB 3.76Å; M445-P716 HydrophobicContact CE-CG 4.45Å; M445-P716 HydrophobicContact SD-CB 4.02Å; M445-P716 HydrophobicContact SD-CG 4.37Å
446	G	33.5	Very low	45	Very low	76 Å²	76	115.5 Å²	115.5	78%	0.784	63%	0.63	S	S	*	*			trans	-70.3	32.4	-180	0	0	0	0	0	114.9	S444 G448	S444-G446 PolarHBondContact O-N 3.27Å; G446-G448 PolarHBondContact O-N 3.5Å
447	F	47.1	Very low	47.7	Very low	126 Å²	126	111.9 Å²	111.9	55%	0.553	61%	0.606	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.2	122	-171.4	-156.7	-101.8	0	0	0	110.8	M445 L454 F717	M445-F447 PolarHBondContact O-N 2.92Å; F447-L454 HydrophobicContact CE2-CD1 3.59Å; F447-L454 HydrophobicContact CZ-CD1 3.73Å; F447-F717 HydrophobicContact CE2-CD2 4.2Å; F447-F717 HydrophobicContact CE2-CE2 4.5Å
448	G	45.4	Very low	50.4	Low	20 Å²	20	104 Å²	104	21%	0.206	58%	0.575	C	S	.	*	T	Hydrogen-bonded Turn	trans	82.1	34.7	175.7	0	0	0	0	0	116	R223 G446	R223-G448 PolarHBondContact NH2-O 3.14Å; G446-G448 PolarHBondContact O-N 3.5Å
449	K	53.5	Low	53.3	Low	191 Å²	191	101.9 Å²	101.9	83%	0.83	56%	0.563	S	S	*	*	S	Bend	trans	-78.8	-54.5	149.8	-85.1	-170.8	172.1	-175	0	110.5
450	D	55.1	Low	56.2	Low	104 Å²	104	101.8 Å²	101.8	56%	0.556	56%	0.555	S	S	*	*			trans	-119.7	98.6	-179.2	-73	-79.9	0	0	0	111.9	K452 D453	D450-K452 PolarHBondContact O-N 3.32Å; D450-D453 PolarHBondContact O-N 2.93Å
451	I	66.4	Low	59.2	Low	111 Å²	111	94.6 Å²	94.6	57%	0.569	52%	0.517	S	S	*	.	G	3₁₀ helix	trans	-63.2	-26.3	175.5	-66.2	171.1	0	0	0	111.1	Y219 D453 L454 P455	Y219-I451 HydrophobicContact CE2-CD1 4.2Å; I451-D453 VanDerWaalsContact C-N 3.27Å; I451-D453 PolarHBondContact O-N 3.04Å; I451-L454 WeakPolarHBondContact O-CB 3.39Å; I451-L454 PolarHBondContact O-N 3.28Å; I451-P455 WeakPolarHBondContact O-CD 3.26Å
452	K	68.9	Low	62	Low	173 Å²	173	90.5 Å²	90.5	75%	0.752	49%	0.49	S	S	*	.	G	3₁₀ helix	trans	-68.2	-19.2	-179.7	-64.7	-175.8	179	-178.8	0	114.4	D450	D450-K452 PolarHBondContact O-N 3.32Å
453	D	70.1	Confident	64.9	Low	78 Å²	78	90.4 Å²	90.4	42%	0.417	49%	0.49	S	S	.	.	G	3₁₀ helix	trans	-96.8	-12.6	178.2	-69.5	-33	0	0	0	113.4	D450 I451 K456 A457	D450-D453 PolarHBondContact O-N 2.93Å; I451-D453 VanDerWaalsContact C-N 3.27Å; I451-D453 PolarHBondContact O-N 3.04Å; D453-K456 PolarHBondContact O-N 3.29Å; D453-K456 WeakPolarHBondContact OD1-CD 3.5Å; D453-K456 WeakPolarHBondContact OD1-CE 3.41Å; D453-K456 IonicContact OD1-NZ 2.69Å; D453-K456 PolarHBondContact OD1-NZ 3.3Å; D453-A457 PolarHBondContact O-N 2.92Å
454	L	73	Confident	67.8	Low	70 Å²	70	87.8 Å²	87.8	37%	0.366	47%	0.469	S	S	.	.	H	α-helix	trans	-53.5	-49.1	173.9	-167.5	75.3	0	0	0	113.5	F447 I451 K456 A457 A458 F717	F447-L454 HydrophobicContact CE2-CD1 3.59Å; F447-L454 HydrophobicContact CZ-CD1 3.73Å; I451-L454 WeakPolarHBondContact O-CB 3.39Å; I451-L454 PolarHBondContact O-N 3.28Å; L454-K456 VanDerWaalsContact C-N 3.34Å; L454-K456 PolarHBondContact O-N 3.25Å; L454-A457 PolarHBondContact O-N 3.21Å; L454-A458 WeakPolarHBondContact O-CB 3.44Å; L454-A458 PolarHBondContact O-N 3.33Å; L454-F717 HydrophobicContact CD1-CE2 3.66Å; L454-F717 HydrophobicContact CD1-CZ 4.07Å
455	P	80	Confident	70.6	Confident	74 Å²	74	88.2 Å²	88.2	48%	0.481	46%	0.463	S	S	.	.	H	α-helix	trans	-67.1	-32.7	177.7	25.9	-34.8	0	0	0	112.9	I451 A458 L459	I451-P455 WeakPolarHBondContact O-CD 3.26Å; P455-A458 PolarHBondContact O-N 3.22Å; P455-L459 WeakPolarHBondContact O-CB 3.49Å; P455-L459 WeakPolarHBondContact O-CG 3.47Å; P455-L459 PolarHBondContact O-N 3.27Å
456	K	81.3	Confident	73	Confident	129 Å²	129	82.5 Å²	82.5	56%	0.561	44%	0.435	S	S	*	.	H	α-helix	trans	-66.8	-41.4	176.2	-56.7	178.2	-165.7	160.1	0	111.3	D453 L454 R460	D453-K456 PolarHBondContact O-N 3.29Å; D453-K456 WeakPolarHBondContact OD1-CD 3.5Å; D453-K456 WeakPolarHBondContact OD1-CE 3.41Å; D453-K456 IonicContact OD1-NZ 2.69Å; D453-K456 PolarHBondContact OD1-NZ 3.3Å; L454-K456 VanDerWaalsContact C-N 3.34Å; L454-K456 PolarHBondContact O-N 3.25Å; K456-R460 PolarHBondContact O-N 2.97Å
457	A	77.3	Confident	75.8	Confident	24 Å²	24	78.9 Å²	78.9	20%	0.198	40%	0.398	C	S	.	.	H	α-helix	trans	-66.7	-42.3	175.2	0	0	0	0	0	111.5	D453 L454 R460 I461 F717	D453-A457 PolarHBondContact O-N 2.92Å; L454-A457 PolarHBondContact O-N 3.21Å; A457-R460 WeakPolarHBondContact O-CB 3.48Å; A457-R460 PolarHBondContact O-N 3.41Å; A457-I461 PolarHBondContact O-N 2.9Å; A457-I461 VanDerWaalsContact O-N 3.13Å; A457-F717 HydrophobicContact CB-CD1 4.4Å; A457-F717 HydrophobicContact CB-CE1 3.55Å; A457-F717 HydrophobicContact CB-CZ 4.05Å
458	A	81.6	Confident	78.1	Confident	18 Å²	18	75 Å²	75	15%	0.149	38%	0.383	C	S	.	.	H	α-helix	trans	-59.6	-48.5	175.7	0	0	0	0	0	111.4	L454 P455 R460 I461 L462 F717 M721	L454-A458 WeakPolarHBondContact O-CB 3.44Å; L454-A458 PolarHBondContact O-N 3.33Å; P455-A458 PolarHBondContact O-N 3.22Å; A458-R460 VanDerWaalsContact C-N 3.33Å; A458-R460 PolarHBondContact O-N 3.47Å; A458-I461 PolarHBondContact O-N 2.89Å; A458-L462 WeakPolarHBondContact O-CB 3.21Å; A458-L462 VanDerWaalsContact O-CG 3.29Å; A458-L462 WeakPolarHBondContact O-CG 3.45Å; A458-L462 PolarHBondContact O-N 3.38Å; A458-F717 HydrophobicContact CB-CZ 4.09Å; A458-M721 HydrophobicContact CB-SD 4.15Å
459	L	83.7	Confident	80.4	Confident	121 Å²	121	76 Å²	76	63%	0.634	38%	0.382	S	S	*	.	H	α-helix	trans	-60.5	-38.8	176.3	-73.7	169	0	0	0	112.6	P455 S463	P455-L459 WeakPolarHBondContact O-CB 3.49Å; P455-L459 WeakPolarHBondContact O-CG 3.47Å; P455-L459 PolarHBondContact O-N 3.27Å; L459-S463 VanDerWaalsContact O-CB 3.24Å; L459-S463 WeakPolarHBondContact O-CB 3.16Å; L459-S463 PolarHBondContact O-N 3.06Å
460	R	84.9	Confident	82.4	Confident	159 Å²	159	67 Å²	67	60%	0.6	34%	0.342	S	S	*	.	H	α-helix	trans	-59.2	-47.6	174.8	-175.5	-168.6	-63.8	155.1	-1.3	112	K456 A457 A458 S463 E714	K456-R460 PolarHBondContact O-N 2.97Å; A457-R460 WeakPolarHBondContact O-CB 3.48Å; A457-R460 PolarHBondContact O-N 3.41Å; A458-R460 VanDerWaalsContact C-N 3.33Å; A458-R460 PolarHBondContact O-N 3.47Å; R460-S463 PolarHBondContact O-N 2.93Å; R460-E714 IonicContact NH1-OE1 3.08Å; R460-E714 PolarHBondContact NH1-OE1 3.47Å; R460-E714 VanDerWaalsContact NH1-OE1 3.08Å
461	I	86.2	Confident	84.2	Confident	3 Å²	3	62 Å²	62	2%	0.015	32%	0.316	C	S	.	.	H	α-helix	trans	-71.2	-40.5	-178.2	-67.1	-177.3	0	0	0	111.1	A457 A458 S463 N464 F467 V710 E714 F717 A718	A457-I461 PolarHBondContact O-N 2.9Å; A457-I461 VanDerWaalsContact O-N 3.13Å; A458-I461 PolarHBondContact O-N 2.89Å; I461-S463 VanDerWaalsContact C-N 3.26Å; I461-S463 PolarHBondContact O-N 3.01Å; I461-N464 WeakPolarHBondContact O-CB 3.41Å; I461-N464 PolarHBondContact O-N 2.67Å; I461-F467 HydrophobicContact CG2-CD1 3.54Å; I461-F467 HydrophobicContact CG2-CD2 4.23Å; I461-F467 HydrophobicContact CG2-CE1 3.62Å; I461-F467 HydrophobicContact CG2-CE2 4.29Å; I461-F467 HydrophobicContact CG2-CG 3.87Å; I461-F467 HydrophobicContact CG2-CZ 4Å; I461-F467 WeakPolarHBondContact O-CD1 3.49Å; I461-V710 HydrophobicContact CG2-CG1 4.35Å; I461-E714 HydrophobicContact CD1-CB 4.01Å; I461-E714 WeakPolarHBondContact CG1-OE2 3.07Å; I461-F717 HydrophobicContact CD1-CD1 3.45Å; I461-F717 VanDerWaalsContact CD1-CD1 3.45Å; I461-F717 HydrophobicContact CD1-CE1 3.85Å; I461-F717 HydrophobicContact CD1-CG 4.46Å; I461-A718 HydrophobicContact CD1-CB 4.28Å; I461-A718 HydrophobicContact CG2-CB 4.21Å
462	L	85.4	Confident	85.6	Confident	42 Å²	42	59 Å²	59	22%	0.22	30%	0.3	C	S	.	.	H	α-helix	trans	-65.2	-29.4	174.6	-67.7	169.2	0	0	0	112.5	A458 N464 F467 L468 M721 L725	A458-L462 WeakPolarHBondContact O-CB 3.21Å; A458-L462 VanDerWaalsContact O-CG 3.29Å; A458-L462 WeakPolarHBondContact O-CG 3.45Å; A458-L462 PolarHBondContact O-N 3.38Å; L462-N464 PolarHBondContact O-N 3.16Å; L462-F467 HydrophobicContact CD2-CE1 4.25Å; L462-L468 HydrophobicContact CD2-CD1 4.37Å; L462-M721 HydrophobicContact CD1-CE 4.18Å; L462-M721 HydrophobicContact CD1-SD 4.19Å; L462-M721 HydrophobicContact CD2-CE 4.37Å; L462-M721 HydrophobicContact CD2-CG 4.05Å; L462-M721 HydrophobicContact CG-CG 4.28Å; L462-M721 HydrophobicContact CG-SD 4.49Å; L462-L725 HydrophobicContact CD2-CD1 4Å
463	S	87.8	Confident	86.8	Confident	85 Å²	85	51.1 Å²	51.1	59%	0.594	27%	0.267	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.9	-11.5	172.5	-172.6	0	0	0	0	113.8	L459 R460 I461 M465	L459-S463 VanDerWaalsContact O-CB 3.24Å; L459-S463 WeakPolarHBondContact O-CB 3.16Å; L459-S463 PolarHBondContact O-N 3.06Å; R460-S463 PolarHBondContact O-N 2.93Å; I461-S463 VanDerWaalsContact C-N 3.26Å; I461-S463 PolarHBondContact O-N 3.01Å; S463-M465 WeakPolarHBondContact O-CE 3.4Å; S463-M465 PolarHBondContact O-N 3.01Å
464	N	90.3	Very high	87.9	Confident	37 Å²	37	48.9 Å²	48.9	20%	0.198	25%	0.253	C	S	.	.			trans	-81	96.5	172.1	-178.5	2.8	0	0	0	109.5	I461 L462 T466 F467 L468 S709 K796	I461-N464 WeakPolarHBondContact O-CB 3.41Å; I461-N464 PolarHBondContact O-N 2.67Å; L462-N464 PolarHBondContact O-N 3.16Å; N464-T466 PolarHBondContact O-N 3.26Å; N464-T466 PolarHBondContact OD1-N 3.09Å; N464-F467 HydrophobicContact CB-CB 4.22Å; N464-F467 WeakPolarHBondContact O-CA 3.48Å; N464-F467 WeakPolarHBondContact O-CB 3.3Å; N464-F467 PolarHBondContact O-N 3.13Å; N464-L468 PolarHBondContact O-N 3.34Å; N464-S709 PolarHBondContact ND2-O 3.47Å; N464-K796 PolarHBondContact OD1-NZ 3.42Å
465	M	90.4	Very high	89	Confident	88 Å²	88	46.1 Å²	46.1	43%	0.433	24%	0.239	S	C	.	.	H	α-helix	trans	-48	-34.7	-176.6	-60.9	-64.6	97.5	0	0	114.1	S463 L468 F469	S463-M465 WeakPolarHBondContact O-CE 3.4Å; S463-M465 PolarHBondContact O-N 3.01Å; M465-L468 HydrophobicContact CE-CD2 4.02Å; M465-L468 PolarHBondContact O-N 3.33Å; M465-F469 HydrophobicContact CB-CD2 4.39Å; M465-F469 HydrophobicContact CB-CE2 3.99Å; M465-F469 WeakPolarHBondContact O-CB 3.37Å; M465-F469 WeakPolarHBondContact O-CD2 3.47Å; M465-F469 VanDerWaalsContact O-CG 3.25Å; M465-F469 WeakPolarHBondContact O-CG 3.19Å; M465-F469 PolarHBondContact O-N 3.12Å
466	T	91.9	Very high	89.7	Confident	4 Å²	4	43 Å²	43	3%	0.025	22%	0.22	C	C	.	.	H	α-helix	trans	-66.8	-40.3	176.8	-49.1	0	0	0	0	112.6	N464 V470 T789 I793 K796	N464-T466 PolarHBondContact O-N 3.26Å; N464-T466 PolarHBondContact OD1-N 3.09Å; T466-V470 WeakPolarHBondContact O-CG1 3.19Å; T466-V470 PolarHBondContact O-N 3.46Å; T466-T789 HydrophobicContact CG2-CG2 4.33Å; T466-I793 HydrophobicContact CG2-CD1 4.07Å; T466-I793 HydrophobicContact CG2-CG1 3.64Å; T466-K796 PolarHBondContact OG1-NZ 3.09Å
467	F	92.4	Very high	90.3	Very high	0 Å²	0	37.5 Å²	37.5	0%	0	20%	0.196	C	C	.	.	H	α-helix	trans	-70.2	-39.8	174.8	172.7	-93.4	0	0	0	111.3	I461 L462 N464 V470 S471 T706 V710 A718 M721 Q722	I461-F467 HydrophobicContact CG2-CD1 3.54Å; I461-F467 HydrophobicContact CG2-CD2 4.23Å; I461-F467 HydrophobicContact CG2-CE1 3.62Å; I461-F467 HydrophobicContact CG2-CE2 4.29Å; I461-F467 HydrophobicContact CG2-CG 3.87Å; I461-F467 HydrophobicContact CG2-CZ 4Å; I461-F467 WeakPolarHBondContact O-CD1 3.49Å; L462-F467 HydrophobicContact CD2-CE1 4.25Å; N464-F467 HydrophobicContact CB-CB 4.22Å; N464-F467 WeakPolarHBondContact O-CA 3.48Å; N464-F467 WeakPolarHBondContact O-CB 3.3Å; N464-F467 PolarHBondContact O-N 3.13Å; F467-V470 WeakPolarHBondContact O-CG1 3.37Å; F467-S471 WeakPolarHBondContact CZ-OG 3.4Å; F467-S471 VanDerWaalsContact O-CB 3.25Å; F467-S471 WeakPolarHBondContact O-CB 3.14Å; F467-S471 PolarHBondContact O-N 3.28Å; F467-S471 PolarHBondContact O-OG 3.36Å; F467-T706 HydrophobicContact CD2-CG2 3.78Å; F467-T706 HydrophobicContact CE2-CG2 3.61Å; F467-V710 HydrophobicContact CB-CG1 4.39Å; F467-V710 HydrophobicContact CD2-CG1 4.16Å; F467-V710 HydrophobicContact CG-CG1 4.45Å; F467-A718 HydrophobicContact CD2-CB 4.27Å; F467-A718 HydrophobicContact CE2-CB 3.77Å; F467-A718 HydrophobicContact CZ-CB 4.36Å; F467-A718 WeakPolarHBondContact CZ-O 3.22Å; F467-M721 HydrophobicContact CE1-CG 4.43Å; F467-M721 HydrophobicContact CZ-CB 4.39Å; F467-Q722 HydrophobicContact CE2-CB 4.44Å; F467-Q722 HydrophobicContact CZ-CB 4.17Å
468	L	93.9	Very high	91.1	Very high	45 Å²	45	36.6 Å²	36.6	24%	0.236	19%	0.188	C	C	.	.	H	α-helix	trans	-64.4	-50.8	178.9	-175	63.9	0	0	0	111.6	L462 N464 M465 V470 S471 L472	L462-L468 HydrophobicContact CD2-CD1 4.37Å; N464-L468 PolarHBondContact O-N 3.34Å; M465-L468 HydrophobicContact CE-CD2 4.02Å; M465-L468 PolarHBondContact O-N 3.33Å; L468-V470 PolarHBondContact O-N 3.38Å; L468-S471 PolarHBondContact O-N 2.93Å; L468-L472 HydrophobicContact CD1-CD1 4.24Å; L468-L472 HydrophobicContact CD1-CG 4.41Å; L468-L472 HydrophobicContact CG-CD1 4.02Å; L468-L472 WeakPolarHBondContact O-CG 3.48Å; L468-L472 PolarHBondContact O-N 2.85Å
469	F	95.2	Very high	91.7	Very high	41 Å²	41	36 Å²	36	18%	0.18	18%	0.183	C	C	.	.	H	α-helix	trans	-64.4	-40.9	-180	-62.9	-38	0	0	0	112.8	M465 S471 L472 S473 F785 L788 T789	M465-F469 HydrophobicContact CB-CD2 4.39Å; M465-F469 HydrophobicContact CB-CE2 3.99Å; M465-F469 WeakPolarHBondContact O-CB 3.37Å; M465-F469 WeakPolarHBondContact O-CD2 3.47Å; M465-F469 VanDerWaalsContact O-CG 3.25Å; M465-F469 WeakPolarHBondContact O-CG 3.19Å; M465-F469 PolarHBondContact O-N 3.12Å; F469-S471 VanDerWaalsContact C-N 3.31Å; F469-S471 PolarHBondContact O-N 2.8Å; F469-L472 PolarHBondContact O-N 2.87Å; F469-S473 WeakPolarHBondContact O-CB 3.46Å; F469-S473 PolarHBondContact O-N 3.45Å; F469-F785 AromaticContact CD1-CD1 3.9Å; F469-F785 HydrophobicContact CD1-CD1 3.9Å; F469-F785 HydrophobicContact CD1-CE1 4.24Å; F469-L788 HydrophobicContact CD1-CD1 4.45Å; F469-L788 HydrophobicContact CD2-CB 3.86Å; F469-L788 HydrophobicContact CE1-CD1 4.26Å; F469-L788 HydrophobicContact CE2-CB 4.13Å; F469-L788 HydrophobicContact CG-CB 4.08Å; F469-L788 HydrophobicContact CZ-CD1 4.42Å; F469-T789 VanDerWaalsContact C-OG1 3.27Å; F469-T789 VanDerWaalsContact CB-OG1 3.25Å; F469-T789 WeakPolarHBondContact CB-OG1 3.45Å
470	V	94.4	Very high	92.2	Very high	1 Å²	1	30.3 Å²	30.3	1%	0.006	15%	0.153	C	C	.	.	H	α-helix	trans	-67.3	-34.8	176.4	74.4	0	0	0	0	111.6	T466 F467 L468 Y474 A702 V705 T706 T789	T466-V470 WeakPolarHBondContact O-CG1 3.19Å; T466-V470 PolarHBondContact O-N 3.46Å; F467-V470 WeakPolarHBondContact O-CG1 3.37Å; L468-V470 PolarHBondContact O-N 3.38Å; V470-Y474 VanDerWaalsContact O-CB 3.28Å; V470-Y474 WeakPolarHBondContact O-CB 3.38Å; V470-Y474 PolarHBondContact O-N 3.39Å; V470-A702 HydrophobicContact CG2-CB 4.44Å; V470-V705 HydrophobicContact CB-CG1 4.24Å; V470-V705 HydrophobicContact CG2-CB 4.16Å; V470-V705 HydrophobicContact CG2-CG1 3.86Å; V470-T706 HydrophobicContact CG1-CG2 4.42Å; V470-T706 WeakPolarHBondContact CG1-OG1 3.29Å; V470-T789 HydrophobicContact CB-CG2 3.86Å; V470-T789 HydrophobicContact CG2-CG2 4.32Å; V470-T789 PolarHBondContact N-OG1 3.35Å; V470-T789 VanDerWaalsContact N-OG1 3.14Å
471	S	93.4	Very high	92.6	Very high	0 Å²	0	25 Å²	25	0%	0	14%	0.138	C	C	.	.	H	α-helix	trans	-68.9	-41	175.9	-61	0	0	0	0	112.4	F467 L468 F469 Y474 T475	F467-S471 WeakPolarHBondContact CZ-OG 3.4Å; F467-S471 VanDerWaalsContact O-CB 3.25Å; F467-S471 WeakPolarHBondContact O-CB 3.14Å; F467-S471 PolarHBondContact O-N 3.28Å; F467-S471 PolarHBondContact O-OG 3.36Å; L468-S471 PolarHBondContact O-N 2.93Å; F469-S471 VanDerWaalsContact C-N 3.31Å; F469-S471 PolarHBondContact O-N 2.8Å; S471-Y474 PolarHBondContact O-N 2.89Å; S471-T475 WeakPolarHBondContact O-CB 3.35Å; S471-T475 PolarHBondContact O-N 2.89Å; S471-T475 PolarHBondContact O-OG1 3.5Å
472	L	94.7	Very high	93	Very high	46 Å²	46	25.8 Å²	25.8	24%	0.241	14%	0.143	C	C	.	.	H	α-helix	trans	-66.6	-41.5	175.3	-70.4	170.6	0	0	0	111.9	L468 F469 T475 A476 F785	L468-L472 HydrophobicContact CD1-CD1 4.24Å; L468-L472 HydrophobicContact CD1-CG 4.41Å; L468-L472 HydrophobicContact CG-CD1 4.02Å; L468-L472 WeakPolarHBondContact O-CG 3.48Å; L468-L472 PolarHBondContact O-N 2.85Å; F469-L472 PolarHBondContact O-N 2.87Å; L472-T475 WeakPolarHBondContact O-CB 3.28Å; L472-T475 PolarHBondContact O-N 3.18Å; L472-A476 PolarHBondContact O-N 2.98Å; L472-F785 HydrophobicContact CB-CD1 4.18Å; L472-F785 HydrophobicContact CB-CD2 3.82Å; L472-F785 HydrophobicContact CB-CE1 4.32Å; L472-F785 HydrophobicContact CB-CE2 3.95Å; L472-F785 HydrophobicContact CB-CG 3.95Å; L472-F785 HydrophobicContact CB-CZ 4.21Å; L472-F785 HydrophobicContact CD1-CD1 4.28Å; L472-F785 HydrophobicContact CD1-CE1 3.8Å; L472-F785 HydrophobicContact CD1-CE2 4.45Å; L472-F785 HydrophobicContact CD1-CZ 3.9Å
473	S	95.3	Very high	93.4	Very high	8 Å²	8	23.8 Å²	23.8	6%	0.056	13%	0.133	C	C	.	.	H	α-helix	trans	-59.5	-49.3	172.8	-175.8	0	0	0	0	111.7	F469 T475 A476 E477 G782	F469-S473 WeakPolarHBondContact O-CB 3.46Å; F469-S473 PolarHBondContact O-N 3.45Å; S473-T475 VanDerWaalsContact C-N 3.26Å; S473-T475 PolarHBondContact O-N 2.97Å; S473-A476 PolarHBondContact O-N 2.82Å; S473-E477 PolarHBondContact O-N 2.89Å; S473-G782 WeakPolarHBondContact CB-O 3.42Å; S473-G782 PolarHBondContact OG-O 3.46Å
474	Y	93.6	Very high	93.6	Very high	32 Å²	32	20.3 Å²	20.3	13%	0.125	11%	0.107	C	C	.	.	H	α-helix	trans	-65.6	-29.3	178.3	-169.6	-131	0	0	0	112.5	V470 S471 C478 Q699 A702 Q722 L726	V470-Y474 VanDerWaalsContact O-CB 3.28Å; V470-Y474 WeakPolarHBondContact O-CB 3.38Å; V470-Y474 PolarHBondContact O-N 3.39Å; S471-Y474 PolarHBondContact O-N 2.89Å; Y474-C478 VanDerWaalsContact O-CB 3.25Å; Y474-C478 WeakPolarHBondContact O-CB 3.37Å; Y474-C478 PolarHBondContact O-N 3.33Å; Y474-C478 PolarHBondContact O-SG 3.32Å; Y474-Q699 HydrophobicContact CE2-CB 4.4Å; Y474-Q699 HydrophobicContact CE2-CG 4.3Å; Y474-A702 HydrophobicContact CD2-CB 4.13Å; Y474-Q722 HydrophobicContact CD1-CG 4.38Å; Y474-L726 HydrophobicContact CD1-CD1 3.94Å; Y474-L726 HydrophobicContact CD1-CD2 3.97Å; Y474-L726 HydrophobicContact CD1-CG 4.44Å; Y474-L726 HydrophobicContact CE1-CD1 3.69Å; Y474-L726 HydrophobicContact CE1-CD2 4.36Å
475	T	94.9	Very high	93.7	Very high	11 Å²	11	21.3 Å²	21.3	7%	0.067	11%	0.112	C	C	.	.	H	α-helix	trans	-66.2	-45.8	172.9	-59.6	0	0	0	0	111.8	S471 L472 S473 C478 A479 L729 A730	S471-T475 WeakPolarHBondContact O-CB 3.35Å; S471-T475 PolarHBondContact O-N 2.89Å; S471-T475 PolarHBondContact O-OG1 3.5Å; L472-T475 WeakPolarHBondContact O-CB 3.28Å; L472-T475 PolarHBondContact O-N 3.18Å; S473-T475 VanDerWaalsContact C-N 3.26Å; S473-T475 PolarHBondContact O-N 2.97Å; T475-C478 PolarHBondContact O-N 3.33Å; T475-A479 WeakPolarHBondContact O-CB 3.43Å; T475-A479 PolarHBondContact O-N 3.35Å; T475-L729 HydrophobicContact CG2-CB 3.59Å; T475-A730 HydrophobicContact CG2-CB 3.89Å; T475-A730 WeakPolarHBondContact O-CB 3.33Å
476	A	95.3	Very high	93.8	Very high	9 Å²	9	17.2 Å²	17.2	7%	0.074	9%	0.092	C	C	.	.	H	α-helix	trans	-63.8	-42.3	176	0	0	0	0	0	112.1	L472 S473 A479 I480	L472-A476 PolarHBondContact O-N 2.98Å; S473-A476 PolarHBondContact O-N 2.82Å; A476-A479 PolarHBondContact O-N 3.11Å; A476-I480 WeakPolarHBondContact O-CD1 3.21Å; A476-I480 WeakPolarHBondContact O-CG1 3.2Å; A476-I480 PolarHBondContact O-N 3.18Å
477	E	93.4	Very high	94	Very high	13 Å²	13	17 Å²	17	6%	0.061	9%	0.091	C	C	.	.	H	α-helix	trans	-60.7	-44.8	173.2	-74.3	-72.5	175.6	0	0	112.1	S473 I480 V481 S544 T695 K779	S473-E477 PolarHBondContact O-N 2.89Å; E477-I480 PolarHBondContact O-N 3.38Å; E477-V481 WeakPolarHBondContact O-CG2 3.29Å; E477-V481 PolarHBondContact O-N 3.22Å; E477-S544 PolarHBondContact OE1-OG 3.16Å; E477-T695 WeakPolarHBondContact OE2-CG2 3.45Å; E477-K779 VanDerWaalsContact CD-NZ 3.25Å; E477-K779 IonicContact OE1-NZ 2.75Å; E477-K779 PolarHBondContact OE1-NZ 3Å; E477-K779 IonicContact OE2-NZ 3.08Å; E477-K779 PolarHBondContact OE2-NZ 3.26Å
478	C	93.5	Very high	94.1	Very high	6 Å²	6	17.1 Å²	17.1	4%	0.041	9%	0.091	C	C	.	.	H	α-helix	trans	-66.7	-34.4	176.5	-83.8	0	0	0	0	113.5	Y474 T475 V481 T482 L726 A730 Y731	Y474-C478 VanDerWaalsContact O-CB 3.25Å; Y474-C478 WeakPolarHBondContact O-CB 3.37Å; Y474-C478 PolarHBondContact O-N 3.33Å; Y474-C478 PolarHBondContact O-SG 3.32Å; T475-C478 PolarHBondContact O-N 3.33Å; C478-V481 PolarHBondContact O-N 3.25Å; C478-T482 PolarHBondContact O-N 2.94Å; C478-T482 PolarHBondContact O-OG1 3.35Å; C478-L726 HydrophobicContact CB-CD2 3.78Å; C478-A730 HydrophobicContact CB-CB 4.28Å; C478-Y731 HydrophobicContact CB-CE1 3.99Å
479	A	95.7	Very high	94.1	Very high	4 Å²	4	15.1 Å²	15.1	3%	0.033	8%	0.081	C	C	.	.	H	α-helix	trans	-58.8	-48.1	174.2	0	0	0	0	0	110.9	T475 A476 V481 T482 A483 A730 T734	T475-A479 WeakPolarHBondContact O-CB 3.43Å; T475-A479 PolarHBondContact O-N 3.35Å; A476-A479 PolarHBondContact O-N 3.11Å; A479-V481 VanDerWaalsContact C-N 3.3Å; A479-V481 PolarHBondContact O-N 2.95Å; A479-T482 PolarHBondContact O-N 2.63Å; A479-T482 VanDerWaalsContact O-N 3.14Å; A479-A483 PolarHBondContact O-N 3.32Å; A479-A730 HydrophobicContact CB-CB 4.02Å; A479-T734 HydrophobicContact CB-CG2 4.32Å; A479-T734 WeakPolarHBondContact CB-OG1 3.37Å; A479-T734 WeakPolarHBondContact O-CG2 3.09Å
480	I	94.6	Very high	94	Very high	3 Å²	3	13.5 Å²	13.5	2%	0.015	7%	0.074	C	C	.	.	H	α-helix	trans	-60.7	-40.7	178.3	-61.5	151.3	0	0	0	111.4	A476 E477 A483 F484 F551 A775 L778 K779	A476-I480 WeakPolarHBondContact O-CD1 3.21Å; A476-I480 WeakPolarHBondContact O-CG1 3.2Å; A476-I480 PolarHBondContact O-N 3.18Å; E477-I480 PolarHBondContact O-N 3.38Å; I480-A483 PolarHBondContact O-N 2.72Å; I480-F484 HydrophobicContact CG2-CD1 4.27Å; I480-F484 HydrophobicContact CG2-CE1 4.14Å; I480-F484 HydrophobicContact CG2-CZ 4.38Å; I480-F484 WeakPolarHBondContact O-CB 3.42Å; I480-F484 WeakPolarHBondContact O-CD1 3.45Å; I480-F484 WeakPolarHBondContact O-CG 3.45Å; I480-F484 PolarHBondContact O-N 2.89Å; I480-F551 HydrophobicContact CG2-CZ 3.82Å; I480-A775 HydrophobicContact CG1-CB 4.48Å; I480-A775 HydrophobicContact CG2-CB 4.3Å; I480-L778 HydrophobicContact CD1-CB 3.91Å; I480-L778 HydrophobicContact CG1-CB 3.87Å; I480-L778 HydrophobicContact CG1-CD1 4.31Å; I480-K779 HydrophobicContact CD1-CB 4.36Å; I480-K779 HydrophobicContact CD1-CD 3.58Å; I480-K779 HydrophobicContact CD1-CG 3.6Å
481	V	93	Very high	93.9	Very high	47 Å²	47	13.5 Å²	13.5	29%	0.285	7%	0.073	S	C	.	.	H	α-helix	trans	-62.9	-43.5	175.5	173.9	0	0	0	0	111.6	E477 C478 A479 F484 I485	E477-V481 WeakPolarHBondContact O-CG2 3.29Å; E477-V481 PolarHBondContact O-N 3.22Å; C478-V481 PolarHBondContact O-N 3.25Å; A479-V481 VanDerWaalsContact C-N 3.3Å; A479-V481 PolarHBondContact O-N 2.95Å; V481-F484 PolarHBondContact O-N 3.18Å; V481-I485 HydrophobicContact CG1-CD1 3.83Å; V481-I485 WeakPolarHBondContact O-CB 3.25Å; V481-I485 VanDerWaalsContact O-CG1 3.3Å; V481-I485 WeakPolarHBondContact O-CG1 3.25Å; V481-I485 PolarHBondContact O-N 2.74Å
482	T	93.3	Very high	93.9	Very high	19 Å²	19	13.5 Å²	13.5	12%	0.117	7%	0.073	C	C	.	.	H	α-helix	trans	-65.1	-41.3	176.3	-66.1	0	0	0	0	112.4	C478 A479 I485 T486 Y731 T734 P735	C478-T482 PolarHBondContact O-N 2.94Å; C478-T482 PolarHBondContact O-OG1 3.35Å; A479-T482 PolarHBondContact O-N 2.63Å; A479-T482 VanDerWaalsContact O-N 3.14Å; T482-I485 PolarHBondContact O-N 2.96Å; T482-T486 WeakPolarHBondContact O-CB 3.45Å; T482-T486 PolarHBondContact O-N 3.09Å; T482-T486 PolarHBondContact O-OG1 3.5Å; T482-Y731 WeakPolarHBondContact OG1-CD1 3.13Å; T482-Y731 WeakPolarHBondContact OG1-CE1 3.47Å; T482-T734 HydrophobicContact CG2-CG2 4.32Å; T482-P735 HydrophobicContact CG2-CG 3.88Å
483	A	94.5	Very high	93.6	Very high	0 Å²	0	12.6 Å²	12.6	0%	0	7%	0.068	C	C	.	.	H	α-helix	trans	-60.9	-46.7	175.5	0	0	0	0	0	111.3	A479 I480 T486 F487 T734 F738 Y771	A479-A483 PolarHBondContact O-N 3.32Å; I480-A483 PolarHBondContact O-N 2.72Å; A483-T486 PolarHBondContact O-N 3.15Å; A483-F487 PolarHBondContact O-N 3.3Å; A483-T734 HydrophobicContact CB-CG2 3.71Å; A483-F738 HydrophobicContact CB-CD1 3.87Å; A483-F738 HydrophobicContact CB-CD2 3.5Å; A483-F738 VanDerWaalsContact CB-CD2 3.5Å; A483-F738 HydrophobicContact CB-CE1 3.84Å; A483-F738 HydrophobicContact CB-CE2 3.46Å; A483-F738 VanDerWaalsContact CB-CE2 3.46Å; A483-F738 HydrophobicContact CB-CG 3.7Å; A483-F738 HydrophobicContact CB-CZ 3.63Å; A483-Y771 PolarHBondContact O-OH 3.45Å
484	F	92.8	Very high	93.3	Very high	12 Å²	12	13.1 Å²	13.1	5%	0.053	7%	0.072	C	C	.	.	H	α-helix	trans	-65.5	-44.5	179.7	-82.2	26.8	0	0	0	111.5	I480 V481 T486 I488 F551 L688 T692 Y771 F772 A775	I480-F484 HydrophobicContact CG2-CD1 4.27Å; I480-F484 HydrophobicContact CG2-CE1 4.14Å; I480-F484 HydrophobicContact CG2-CZ 4.38Å; I480-F484 WeakPolarHBondContact O-CB 3.42Å; I480-F484 WeakPolarHBondContact O-CD1 3.45Å; I480-F484 WeakPolarHBondContact O-CG 3.45Å; I480-F484 PolarHBondContact O-N 2.89Å; V481-F484 PolarHBondContact O-N 3.18Å; F484-T486 VanDerWaalsContact C-N 3.3Å; F484-T486 PolarHBondContact O-N 3.07Å; F484-I488 WeakPolarHBondContact O-CB 3.36Å; F484-I488 WeakPolarHBondContact O-CG2 3.3Å; F484-I488 PolarHBondContact O-N 3.09Å; F484-F551 HydrophobicContact CE1-CE1 4.29Å; F484-F551 HydrophobicContact CE1-CZ 4.44Å; F484-F551 HydrophobicContact CE2-CE1 4.39Å; F484-F551 HydrophobicContact CE2-CZ 4.05Å; F484-F551 AromaticContact CZ-CE1 3.58Å; F484-F551 HydrophobicContact CZ-CE1 3.58Å; F484-F551 AromaticContact CZ-CZ 3.63Å; F484-F551 HydrophobicContact CZ-CZ 3.63Å; F484-L688 HydrophobicContact CD2-CD1 4.24Å; F484-L688 HydrophobicContact CE2-CD1 3.72Å; F484-T692 HydrophobicContact CD2-CG2 4.35Å; F484-Y771 HydrophobicContact CD1-CE1 4.21Å; F484-Y771 AromaticContact CE1-CE1 3.9Å; F484-Y771 HydrophobicContact CE1-CE1 3.9Å; F484-F772 HydrophobicContact CE1-CD1 4.39Å; F484-F772 HydrophobicContact CE1-CE1 4.14Å; F484-F772 HydrophobicContact CZ-CD1 4.08Å; F484-F772 AromaticContact CZ-CE1 3.71Å; F484-F772 HydrophobicContact CZ-CE1 3.71Å; F484-A775 HydrophobicContact CE1-CB 4.19Å
485	I	91.3	Very high	93.1	Very high	58 Å²	58	11.6 Å²	11.6	30%	0.297	7%	0.066	S	C	.	.	H	α-helix	trans	-56.5	-46.4	171.9	-73.7	170	0	0	0	110.3	S178 S182 Y350 V481 T482	S178-I485 WeakPolarHBondContact O-CG2 3.38Å; S182-I485 VanDerWaalsContact CB-O 3.24Å; S182-I485 WeakPolarHBondContact CB-O 3.35Å; S182-I485 PolarHBondContact OG-O 3Å; Y350-I485 WeakPolarHBondContact OH-CA 3.31Å; Y350-I485 WeakPolarHBondContact OH-CG2 3.34Å; Y350-I485 PolarHBondContact OH-O 3.44Å; V481-I485 HydrophobicContact CG1-CD1 3.83Å; V481-I485 WeakPolarHBondContact O-CB 3.25Å; V481-I485 VanDerWaalsContact O-CG1 3.3Å; V481-I485 WeakPolarHBondContact O-CG1 3.25Å; V481-I485 PolarHBondContact O-N 2.74Å; T482-I485 PolarHBondContact O-N 2.96Å
486	T	93.7	Very high	92.7	Very high	3 Å²	3	11.6 Å²	11.6	2%	0.018	7%	0.065	C	C	.	.	H	α-helix	trans	-69.1	-47	-175	-53	0	0	0	0	113.1	I185 V203 T482 A483 F484 P735	I185-T486 HydrophobicContact CD1-CG2 3.74Å; V203-T486 HydrophobicContact CB-CG2 4.48Å; V203-T486 HydrophobicContact CG2-CG2 3.97Å; T482-T486 WeakPolarHBondContact O-CB 3.45Å; T482-T486 PolarHBondContact O-N 3.09Å; T482-T486 PolarHBondContact O-OG1 3.5Å; A483-T486 PolarHBondContact O-N 3.15Å; F484-T486 VanDerWaalsContact C-N 3.3Å; F484-T486 PolarHBondContact O-N 3.07Å; T486-P735 HydrophobicContact CG2-CB 4.33Å
487	F	95.5	Very high	92.2	Very high	0 Å²	0	13.4 Å²	13.4	0%	0	8%	0.084	C	C	.	.	H	α-helix	trans	-120.1	-1.5	-164.3	-64	-62.1	0	0	0	115.9	A483 P489 K490 F491 P735 F738 I742 Y771	A483-F487 PolarHBondContact O-N 3.3Å; F487-P489 VanDerWaalsContact C-CD 3.43Å; F487-K490 HydrophobicContact CD1-CD 4.19Å; F487-K490 WeakPolarHBondContact O-CB 3.23Å; F487-K490 PolarHBondContact O-N 3.31Å; F487-F491 WeakPolarHBondContact O-CB 3.39Å; F487-F491 PolarHBondContact O-N 3.08Å; F487-P735 WeakPolarHBondContact CE2-O 3.48Å; F487-F738 HydrophobicContact CD2-CB 3.96Å; F487-F738 HydrophobicContact CE2-CB 3.9Å; F487-I742 HydrophobicContact CB-CD1 3.91Å; F487-I742 HydrophobicContact CD1-CD1 3.85Å; F487-I742 HydrophobicContact CD2-CD1 3.85Å; F487-I742 HydrophobicContact CE1-CD1 4.29Å; F487-I742 HydrophobicContact CE2-CD1 4.28Å; F487-I742 HydrophobicContact CG-CD1 3.61Å; F487-I742 HydrophobicContact CZ-CD1 4.49Å; F487-Y771 HydrophobicContact CB-CE2 4.05Å
488	I	93.4	Very high	91.9	Very high	1 Å²	1	14.2 Å²	14.2	1%	0.005	9%	0.088	C	C	.	.	H	α-helix	trans	-64.8	-30	179	-152.4	70	0	0	0	114.7	F484 F491 I492 T507 I511 L688 Y771	F484-I488 WeakPolarHBondContact O-CB 3.36Å; F484-I488 WeakPolarHBondContact O-CG2 3.3Å; F484-I488 PolarHBondContact O-N 3.09Å; I488-F491 HydrophobicContact CD1-CB 4.18Å; I488-F491 HydrophobicContact CD1-CD1 4.1Å; I488-F491 HydrophobicContact CD1-CG 4.31Å; I488-F491 PolarHBondContact O-N 3.12Å; I488-I492 HydrophobicContact CG1-CD1 4.16Å; I488-I492 HydrophobicContact CG1-CG1 4.49Å; I488-I492 VanDerWaalsContact O-CG1 3.3Å; I488-I492 WeakPolarHBondContact O-CG1 3.41Å; I488-I492 PolarHBondContact O-N 3.02Å; I488-T507 HydrophobicContact CG2-CG2 3.5Å; I488-I511 HydrophobicContact CB-CD1 4.44Å; I488-I511 HydrophobicContact CG1-CD1 3.91Å; I488-I511 HydrophobicContact CG2-CD1 3.66Å; I488-L688 HydrophobicContact CD1-CD2 4.09Å; I488-L688 HydrophobicContact CG1-CD2 3.95Å; I488-Y771 HydrophobicContact CD1-CE1 4.19Å
489	P	94.1	Very high	91.7	Very high	3 Å²	3	14.3 Å²	14.3	2%	0.019	9%	0.089	C	C	.	.	H	α-helix	trans	-64.9	-45	171.7	-18.1	32.4	0	0	0	111.2	Y350 F487 F491 I492 E493 A503 T507	Y350-P489 HydrophobicContact CD1-CG 4.3Å; Y350-P489 HydrophobicContact CE1-CG 3.83Å; F487-P489 VanDerWaalsContact C-CD 3.43Å; P489-F491 VanDerWaalsContact C-N 3.34Å; P489-F491 PolarHBondContact O-N 3.49Å; P489-I492 PolarHBondContact O-N 3.37Å; P489-E493 WeakPolarHBondContact O-CB 3.39Å; P489-E493 PolarHBondContact O-N 3.49Å; P489-A503 WeakPolarHBondContact O-CB 3.15Å; P489-T507 HydrophobicContact CG-CG2 4.22Å
490	K	93.6	Very high	91.4	Very high	7 Å²	7	14.7 Å²	14.7	3%	0.03	9%	0.092	C	C	.	.	H	α-helix	trans	-60.7	-40.5	175.9	179.2	168	179.2	165.2	0	112.4	T186 E189 S196 F487 S494 Y762	T186-K490 HydrophobicContact CG2-CB 3.54Å; T186-K490 HydrophobicContact CG2-CD 3.81Å; T186-K490 HydrophobicContact CG2-CG 3.54Å; E189-K490 IonicContact OE1-NZ 3.94Å; E189-K490 PolarHBondContact OE1-NZ 3.17Å; E189-K490 WeakPolarHBondContact OE2-CE 3.42Å; E189-K490 IonicContact OE2-NZ 3.87Å; E189-K490 PolarHBondContact OE2-NZ 2.86Å; S196-K490 PolarHBondContact OG-NZ 3.29Å; F487-K490 HydrophobicContact CD1-CD 4.19Å; F487-K490 WeakPolarHBondContact O-CB 3.23Å; F487-K490 PolarHBondContact O-N 3.31Å; K490-S494 WeakPolarHBondContact O-CB 3.34Å; K490-S494 PolarHBondContact O-N 3.22Å; K490-Y762 WeakPolarHBondContact CE-OH 3.24Å; K490-Y762 PolarHBondContact NZ-OH 3.5Å
491	F	93.1	Very high	91.4	Very high	1 Å²	1	15.2 Å²	15.2	0%	0.004	10%	0.096	C	C	.	.	H	α-helix	trans	-61.3	-48.9	173.9	-174.8	-92	0	0	0	111.1	F487 I488 P489 S494 Q495 F684 F767 R768 Y771 F772	F487-F491 WeakPolarHBondContact O-CB 3.39Å; F487-F491 PolarHBondContact O-N 3.08Å; I488-F491 HydrophobicContact CD1-CB 4.18Å; I488-F491 HydrophobicContact CD1-CD1 4.1Å; I488-F491 HydrophobicContact CD1-CG 4.31Å; I488-F491 PolarHBondContact O-N 3.12Å; P489-F491 VanDerWaalsContact C-N 3.34Å; P489-F491 PolarHBondContact O-N 3.49Å; F491-S494 PolarHBondContact O-N 2.96Å; F491-Q495 HydrophobicContact CD1-CG 3.94Å; F491-Q495 HydrophobicContact CD2-CG 4.02Å; F491-Q495 HydrophobicContact CE1-CB 4.41Å; F491-Q495 HydrophobicContact CE1-CG 3.65Å; F491-Q495 HydrophobicContact CE2-CG 3.74Å; F491-Q495 HydrophobicContact CG-CG 4.1Å; F491-Q495 HydrophobicContact CZ-CG 3.53Å; F491-Q495 WeakPolarHBondContact O-CB 3.29Å; F491-Q495 WeakPolarHBondContact O-CG 3.47Å; F491-Q495 PolarHBondContact O-N 3.13Å; F491-F684 HydrophobicContact CD1-CE1 4.43Å; F491-F684 AromaticContact CD1-CZ 3.84Å; F491-F684 HydrophobicContact CD1-CZ 3.84Å; F491-F684 HydrophobicContact CE1-CE1 4.31Å; F491-F684 AromaticContact CE1-CE2 3.76Å; F491-F684 HydrophobicContact CE1-CE2 3.76Å; F491-F684 AromaticContact CE1-CZ 3.47Å; F491-F684 HydrophobicContact CE1-CZ 3.47Å; F491-F684 VanDerWaalsContact CE1-CZ 3.47Å; F491-F767 HydrophobicContact CB-CZ 4.37Å; F491-F767 HydrophobicContact CD2-CD2 4.12Å; F491-F767 AromaticContact CD2-CE2 3.65Å; F491-F767 HydrophobicContact CD2-CE2 3.65Å; F491-F767 AromaticContact CD2-CZ 3.9Å; F491-F767 HydrophobicContact CD2-CZ 3.9Å; F491-F767 HydrophobicContact CE2-CD2 4.31Å; F491-F767 HydrophobicContact CE2-CE2 4.28Å; F491-R768 HydrophobicContact CZ-CB 4.39Å; F491-R768 HydrophobicContact CZ-CG 4.24Å; F491-Y771 AromaticContact CD2-CD1 3.71Å; F491-Y771 HydrophobicContact CD2-CD1 3.71Å; F491-Y771 HydrophobicContact CD2-CE1 4.09Å; F491-Y771 HydrophobicContact CD2-CG 4.06Å; F491-Y771 AromaticContact CE2-CD1 3.89Å; F491-Y771 HydrophobicContact CE2-CD1 3.89Å; F491-Y771 HydrophobicContact CE2-CG 4.29Å; F491-Y771 HydrophobicContact CG-CD1 4.38Å; F491-Y771 HydrophobicContact CG-CE1 4.34Å; F491-F772 HydrophobicContact CD1-CZ 4.36Å; F491-F772 AromaticContact CE1-CE2 3.66Å; F491-F772 HydrophobicContact CE1-CE2 3.66Å; F491-F772 AromaticContact CE1-CZ 3.73Å; F491-F772 HydrophobicContact CE1-CZ 3.73Å; F491-F772 HydrophobicContact CE2-CE2 4.02Å; F491-F772 HydrophobicContact CE2-CZ 4.36Å; F491-F772 HydrophobicContact CZ-CD2 4.12Å; F491-F772 AromaticContact CZ-CE2 3.28Å; F491-F772 HydrophobicContact CZ-CE2 3.28Å; F491-F772 AromaticContact CZ-CZ 3.74Å; F491-F772 HydrophobicContact CZ-CZ 3.74Å
492	I	92	Very high	91.3	Very high	0 Å²	0	17.5 Å²	17.5	0%	0	10%	0.102	C	C	.	.	H	α-helix	trans	-66.1	-42.7	-179.3	-68	166.3	0	0	0	111.4	I488 P489 F496 I498 A503 L681 F684 L685	I488-I492 HydrophobicContact CG1-CD1 4.16Å; I488-I492 HydrophobicContact CG1-CG1 4.49Å; I488-I492 VanDerWaalsContact O-CG1 3.3Å; I488-I492 WeakPolarHBondContact O-CG1 3.41Å; I488-I492 PolarHBondContact O-N 3.02Å; P489-I492 PolarHBondContact O-N 3.37Å; I492-F496 HydrophobicContact CG2-CD2 4.3Å; I492-F496 PolarHBondContact O-N 3.2Å; I492-I498 HydrophobicContact CG2-CD1 3.65Å; I492-I498 HydrophobicContact CG2-CG1 4.07Å; I492-A503 HydrophobicContact CB-CB 4Å; I492-A503 HydrophobicContact CG2-CB 3.75Å; I492-L681 HydrophobicContact CG2-CD1 4.4Å; I492-F684 HydrophobicContact CD1-CE1 4.5Å; I492-F684 HydrophobicContact CG1-CE1 4.02Å; I492-L685 HydrophobicContact CD1-CD2 4.16Å
493	E	89.8	Confident	91.4	Very high	28 Å²	28	16.6 Å²	16.6	13%	0.131	10%	0.097	C	C	.	.	H	α-helix	trans	-55.9	-55.3	173.9	178.8	-179.4	167.2	0	0	110.9	T186 K190 P489 G497 I498 A500 A503	T186-E493 VanDerWaalsContact CB-OE2 3.24Å; T186-E493 WeakPolarHBondContact CB-OE2 3.1Å; T186-E493 WeakPolarHBondContact CG2-OE2 3.23Å; T186-E493 PolarHBondContact OG1-OE2 2.91Å; K190-E493 IonicContact NZ-OE1 2.69Å; K190-E493 PolarHBondContact NZ-OE1 3.32Å; P489-E493 WeakPolarHBondContact O-CB 3.39Å; P489-E493 PolarHBondContact O-N 3.49Å; E493-G497 VanDerWaalsContact O-CA 3.32Å; E493-G497 WeakPolarHBondContact O-CA 3.25Å; E493-G497 PolarHBondContact O-N 3.09Å; E493-I498 WeakPolarHBondContact CA-O 3.49Å; E493-A500 WeakPolarHBondContact OE2-CB 3.35Å; E493-A503 HydrophobicContact CB-CB 4.28Å
494	S	88.3	Confident	91.4	Very high	18 Å²	18	16.6 Å²	16.6	13%	0.126	10%	0.097	C	C	.	.	H	α-helix	trans	-72.2	-34.8	-175.2	-177.8	0	0	0	0	114.2	K490 F491 V764	K490-S494 WeakPolarHBondContact O-CB 3.34Å; K490-S494 PolarHBondContact O-N 3.22Å; F491-S494 PolarHBondContact O-N 2.96Å; S494-V764 WeakPolarHBondContact O-CG1 3.28Å
495	Q	88.6	Confident	91.5	Very high	0 Å²	0	18.4 Å²	18.4	0%	0	11%	0.107	C	C	.	.	H	α-helix	trans	-77.8	-45.3	-175.5	-69.5	-84.2	-36	0	0	112	F491 C559 V764	F491-Q495 HydrophobicContact CD1-CG 3.94Å; F491-Q495 HydrophobicContact CD2-CG 4.02Å; F491-Q495 HydrophobicContact CE1-CB 4.41Å; F491-Q495 HydrophobicContact CE1-CG 3.65Å; F491-Q495 HydrophobicContact CE2-CG 3.74Å; F491-Q495 HydrophobicContact CG-CG 4.1Å; F491-Q495 HydrophobicContact CZ-CG 3.53Å; F491-Q495 WeakPolarHBondContact O-CB 3.29Å; F491-Q495 WeakPolarHBondContact O-CG 3.47Å; F491-Q495 PolarHBondContact O-N 3.13Å; Q495-C559 WeakPolarHBondContact O-CB 3.49Å; Q495-C559 PolarHBondContact O-SG 3.42Å; Q495-V764 PolarHBondContact NE2-O 2.86Å; Q495-V764 PolarHBondContact OE1-O 3.12Å
496	F	87.6	Confident	91.6	Very high	12 Å²	12	19.5 Å²	19.5	5%	0.053	11%	0.107	C	C	.	.	H	α-helix	trans	-99.7	-3.9	-173.3	-59.3	-80.4	0	0	0	113.2	I492 I498 C559 L681 F684	I492-F496 HydrophobicContact CG2-CD2 4.3Å; I492-F496 PolarHBondContact O-N 3.2Å; F496-I498 VanDerWaalsContact C-N 3.25Å; F496-I498 HydrophobicContact CB-CG2 4.27Å; F496-I498 PolarHBondContact O-N 3.32Å; F496-C559 WeakPolarHBondContact CD1-SG 3.39Å; F496-L681 HydrophobicContact CB-CD1 4.14Å; F496-L681 HydrophobicContact CD1-CB 3.68Å; F496-L681 HydrophobicContact CD1-CD1 4Å; F496-L681 HydrophobicContact CD1-CG 4.41Å; F496-L681 HydrophobicContact CD2-CD1 3.73Å; F496-L681 VanDerWaalsContact CE1-CA 3.49Å; F496-L681 HydrophobicContact CE1-CB 4.06Å; F496-L681 HydrophobicContact CE1-CD1 4.41Å; F496-L681 HydrophobicContact CE2-CD1 4.16Å; F496-L681 HydrophobicContact CG-CB 4.18Å; F496-L681 HydrophobicContact CG-CD1 3.66Å; F496-L681 HydrophobicContact CG-CG 4.43Å; F496-L681 HydrophobicContact CZ-CD1 4.49Å; F496-F684 HydrophobicContact CE1-CB 4.34Å; F496-F684 HydrophobicContact CE2-CB 4.39Å; F496-F684 AromaticContact CE2-CD1 3.55Å; F496-F684 HydrophobicContact CE2-CD1 3.55Å; F496-F684 HydrophobicContact CE2-CD2 4.49Å; F496-F684 AromaticContact CE2-CE1 3.92Å; F496-F684 HydrophobicContact CE2-CE1 3.92Å; F496-F684 AromaticContact CE2-CG 3.88Å; F496-F684 HydrophobicContact CE2-CG 3.88Å; F496-F684 HydrophobicContact CZ-CB 3.64Å; F496-F684 AromaticContact CZ-CD1 3.7Å; F496-F684 HydrophobicContact CZ-CD1 3.7Å; F496-F684 HydrophobicContact CZ-CD2 4.14Å; F496-F684 HydrophobicContact CZ-CE1 4.42Å; F496-F684 AromaticContact CZ-CG 3.54Å; F496-F684 HydrophobicContact CZ-CG 3.54Å
497	G	84.1	Confident	91.6	Very high	46 Å²	46	19.4 Å²	19.4	47%	0.474	11%	0.107	S	C	.	.			trans	68.5	20.5	178.2	0	0	0	0	0	114.2	E493	E493-G497 VanDerWaalsContact O-CA 3.32Å; E493-G497 WeakPolarHBondContact O-CA 3.25Å; E493-G497 PolarHBondContact O-N 3.09Å
498	I	87	Confident	91.5	Very high	30 Å²	30	19.4 Å²	19.4	15%	0.154	11%	0.107	C	C	.	.			trans	-93.2	150	-178	70.2	170.7	0	0	0	111.7	I492 E493 F496 K502 A503 Y506 L681	I492-I498 HydrophobicContact CG2-CD1 3.65Å; I492-I498 HydrophobicContact CG2-CG1 4.07Å; E493-I498 WeakPolarHBondContact CA-O 3.49Å; F496-I498 VanDerWaalsContact C-N 3.25Å; F496-I498 HydrophobicContact CB-CG2 4.27Å; F496-I498 PolarHBondContact O-N 3.32Å; I498-K502 HydrophobicContact CD1-CB 4.07Å; I498-A503 HydrophobicContact CD1-CB 4.3Å; I498-A503 HydrophobicContact CG1-CB 4.27Å; I498-Y506 HydrophobicContact CD1-CD2 3.79Å; I498-Y506 HydrophobicContact CD1-CE2 3.61Å; I498-L681 HydrophobicContact CD1-CD2 4.39Å; I498-L681 HydrophobicContact CG2-CD2 4.37Å
499	P	89.5	Confident	91.4	Very high	9 Å²	9	24.6 Å²	24.6	6%	0.058	13%	0.134	C	C	.	.			trans	-54.8	142.8	177.6	-30.2	36.3	0	0	0	114.1	Q371 N372 S501 K502 A503	Q371-P499 HydrophobicContact CB-CB 3.92Å; Q371-P499 HydrophobicContact CB-CG 3.91Å; N372-P499 VanDerWaalsContact OD1-CD 3.24Å; N372-P499 WeakPolarHBondContact OD1-CD 2.94Å; N372-P499 WeakPolarHBondContact OD1-CG 2.97Å; P499-S501 PolarHBondContact O-N 3.19Å; P499-K502 PolarHBondContact O-N 3.41Å; P499-A503 PolarHBondContact O-N 3.37Å; P499-A503 VanDerWaalsContact O-N 3.08Å
500	A	90.4	Very high	91.3	Very high	12 Å²	12	26.4 Å²	26.4	10%	0.099	14%	0.143	C	C	.	.	H	α-helix	trans	-48.6	-35.5	176.3	0	0	0	0	0	113.1	I357 E493 S504	I357-A500 HydrophobicContact CD1-CB 3.97Å; E493-A500 WeakPolarHBondContact OE2-CB 3.35Å; A500-S504 VanDerWaalsContact O-CB 3.29Å; A500-S504 WeakPolarHBondContact O-CB 3.46Å; A500-S504 PolarHBondContact O-N 2.91Å; A500-S504 PolarHBondContact O-OG 2.03Å
501	S	92.9	Very high	91.1	Very high	14 Å²	14	26.9 Å²	26.9	10%	0.098	15%	0.146	C	C	.	.	H	α-helix	trans	-54.5	-55.3	172.8	174.7	0	0	0	0	112.4	G354 P499 S504 I505	G354-S501 VanDerWaalsContact O-CB 3.28Å; G354-S501 WeakPolarHBondContact O-CB 3.44Å; G354-S501 PolarHBondContact O-OG 3.24Å; P499-S501 PolarHBondContact O-N 3.19Å; S501-S504 PolarHBondContact O-N 3.06Å; S501-I505 WeakPolarHBondContact O-CG1 3.42Å; S501-I505 PolarHBondContact O-N 2.72Å
502	K	92.5	Very high	90.9	Very high	95 Å²	95	28.3 Å²	28.3	41%	0.413	16%	0.155	S	C	.	.	H	α-helix	trans	-68	-42.3	-178.8	-62.1	-179.8	-171.1	165.4	0	111.2	I498 P499 S504 I505 Y506	I498-K502 HydrophobicContact CD1-CB 4.07Å; P499-K502 PolarHBondContact O-N 3.41Å; K502-S504 VanDerWaalsContact C-N 3.32Å; K502-S504 PolarHBondContact O-N 3.06Å; K502-I505 PolarHBondContact O-N 3.41Å; K502-Y506 HydrophobicContact CB-CE2 4.25Å; K502-Y506 VanDerWaalsContact O-CD2 3.28Å; K502-Y506 WeakPolarHBondContact O-CD2 3.46Å; K502-Y506 PolarHBondContact O-N 3.3Å
503	A	93.8	Very high	90.8	Very high	0 Å²	0	31.2 Å²	31.2	0%	0	17%	0.173	C	C	.	.	H	α-helix	trans	-58.6	-41.9	176.4	0	0	0	0	0	112.6	P489 I492 E493 I498 P499 T507	P489-A503 WeakPolarHBondContact O-CB 3.15Å; I492-A503 HydrophobicContact CB-CB 4Å; I492-A503 HydrophobicContact CG2-CB 3.75Å; E493-A503 HydrophobicContact CB-CB 4.28Å; I498-A503 HydrophobicContact CD1-CB 4.3Å; I498-A503 HydrophobicContact CG1-CB 4.27Å; P499-A503 PolarHBondContact O-N 3.37Å; P499-A503 VanDerWaalsContact O-N 3.08Å; A503-T507 WeakPolarHBondContact O-CB 3.38Å; A503-T507 PolarHBondContact O-N 3.45Å; A503-T507 VanDerWaalsContact O-N 3.09Å; A503-T507 PolarHBondContact O-OG1 3.42Å
504	S	95.1	Very high	90.9	Very high	0 Å²	0	29.9 Å²	29.9	0%	0	17%	0.167	C	C	.	.	H	α-helix	trans	-67.3	-43.7	175.2	-63.2	0	0	0	0	112.1	S183 A500 S501 K502 Y506 T507 G508	S183-S504 WeakPolarHBondContact CB-OG 3.47Å; A500-S504 VanDerWaalsContact O-CB 3.29Å; A500-S504 WeakPolarHBondContact O-CB 3.46Å; A500-S504 PolarHBondContact O-N 2.91Å; A500-S504 PolarHBondContact O-OG 2.03Å; S501-S504 PolarHBondContact O-N 3.06Å; K502-S504 VanDerWaalsContact C-N 3.32Å; K502-S504 PolarHBondContact O-N 3.06Å; S504-Y506 PolarHBondContact O-N 3.2Å; S504-T507 WeakPolarHBondContact O-CB 3.38Å; S504-T507 PolarHBondContact O-N 2.97Å; S504-G508 PolarHBondContact O-N 2.85Å
505	I	95.2	Very high	91.1	Very high	50 Å²	50	30.6 Å²	30.6	26%	0.256	17%	0.174	S	C	.	.	H	α-helix	trans	-61.2	-45.3	177.5	-70.6	164.4	0	0	0	111.4	L351 S501 K502 T507 G508 L509	L351-I505 HydrophobicContact CD2-CG2 4.16Å; S501-I505 WeakPolarHBondContact O-CG1 3.42Å; S501-I505 PolarHBondContact O-N 2.72Å; K502-I505 PolarHBondContact O-N 3.41Å; I505-T507 VanDerWaalsContact C-N 3.32Å; I505-T507 PolarHBondContact O-N 3.33Å; I505-G508 PolarHBondContact O-N 3.26Å; I505-L509 VanDerWaalsContact O-CB 3.28Å; I505-L509 WeakPolarHBondContact O-CB 3.03Å; I505-L509 PolarHBondContact O-N 2.96Å
506	Y	93.9	Very high	91.2	Very high	80 Å²	80	32.2 Å²	32.2	31%	0.314	19%	0.191	S	C	.	.	H	α-helix	trans	-62.5	-39.3	175.7	-62	-36.1	0	0	0	112.1	I498 K502 S504 L509 I510 L681 L685	I498-Y506 HydrophobicContact CD1-CD2 3.79Å; I498-Y506 HydrophobicContact CD1-CE2 3.61Å; K502-Y506 HydrophobicContact CB-CE2 4.25Å; K502-Y506 VanDerWaalsContact O-CD2 3.28Å; K502-Y506 WeakPolarHBondContact O-CD2 3.46Å; K502-Y506 PolarHBondContact O-N 3.3Å; S504-Y506 PolarHBondContact O-N 3.2Å; Y506-L509 PolarHBondContact O-N 3.12Å; Y506-I510 VanDerWaalsContact O-CB 3.29Å; Y506-I510 WeakPolarHBondContact O-CB 3.41Å; Y506-I510 WeakPolarHBondContact O-CG1 3.25Å; Y506-I510 PolarHBondContact O-N 2.92Å; Y506-L681 HydrophobicContact CE2-CD2 4.35Å; Y506-L685 HydrophobicContact CD2-CD1 4.26Å; Y506-L685 HydrophobicContact CG-CD1 4.26Å
507	T	92.9	Very high	91.4	Very high	1 Å²	1	35.4 Å²	35.4	1%	0.006	21%	0.211	C	C	.	.	I	π-helix	trans	-59.6	-49.8	174.3	-60.6	0	0	0	0	111.5	Y350 I488 P489 A503 S504 I505 I511	Y350-T507 HydrophobicContact CD1-CG2 3.69Å; Y350-T507 HydrophobicContact CD2-CG2 4.08Å; Y350-T507 HydrophobicContact CE1-CG2 3.51Å; Y350-T507 HydrophobicContact CE2-CG2 3.97Å; Y350-T507 HydrophobicContact CG-CG2 3.99Å; I488-T507 HydrophobicContact CG2-CG2 3.5Å; P489-T507 HydrophobicContact CG-CG2 4.22Å; A503-T507 WeakPolarHBondContact O-CB 3.38Å; A503-T507 PolarHBondContact O-N 3.45Å; A503-T507 VanDerWaalsContact O-N 3.09Å; A503-T507 PolarHBondContact O-OG1 3.42Å; S504-T507 WeakPolarHBondContact O-CB 3.38Å; S504-T507 PolarHBondContact O-N 2.97Å; I505-T507 VanDerWaalsContact C-N 3.32Å; I505-T507 PolarHBondContact O-N 3.33Å; T507-I511 HydrophobicContact CG2-CD1 4.25Å; T507-I511 WeakPolarHBondContact O-CB 3.47Å; T507-I511 PolarHBondContact O-N 2.89Å
508	G	92.8	Very high	91.9	Very high	1 Å²	1	33.2 Å²	33.2	1%	0.01	19%	0.189	C	C	.	.	I	π-helix	trans	-65.1	-37.9	179.6	0	0	0	0	0	114.4	Y350 S504 I505 P513	Y350-G508 VanDerWaalsContact CB-CA 3.45Å; S504-G508 PolarHBondContact O-N 2.85Å; I505-G508 PolarHBondContact O-N 3.26Å; G508-P513 WeakPolarHBondContact O-CD 3.37Å
509	L	92.9	Very high	92.1	Very high	109 Å²	109	35.2 Å²	35.2	57%	0.571	20%	0.199	S	C	*	.	I	π-helix	trans	-84.8	-32.5	-174.5	-174.5	61.8	0	0	0	113.9	I505 Y506 P513	I505-L509 VanDerWaalsContact O-CB 3.28Å; I505-L509 WeakPolarHBondContact O-CB 3.03Å; I505-L509 PolarHBondContact O-N 2.96Å; Y506-L509 PolarHBondContact O-N 3.12Å; L509-P513 WeakPolarHBondContact O-CG 3.1Å
510	I	91.2	Very high	92.3	Very high	41 Å²	41	39.8 Å²	39.8	21%	0.21	23%	0.226	C	C	.	.	I	π-helix	trans	-103.1	-50.3	-172.3	-57.8	175.6	0	0	0	111	Y506 S514 L685 F689	Y506-I510 VanDerWaalsContact O-CB 3.29Å; Y506-I510 WeakPolarHBondContact O-CB 3.41Å; Y506-I510 WeakPolarHBondContact O-CG1 3.25Å; Y506-I510 PolarHBondContact O-N 2.92Å; I510-S514 WeakPolarHBondContact O-CB 3.4Å; I510-S514 PolarHBondContact O-N 3.42Å; I510-L685 HydrophobicContact CD1-CB 4.15Å; I510-L685 HydrophobicContact CD1-CD1 3.98Å; I510-L685 HydrophobicContact CD1-CD2 4.23Å; I510-L685 HydrophobicContact CD1-CG 4.35Å; I510-F689 HydrophobicContact CG2-CB 3.97Å; I510-F689 HydrophobicContact CG2-CD2 3.85Å; I510-F689 HydrophobicContact CG2-CG 4.39Å
511	I	89.1	Confident	92.4	Very high	18 Å²	18	42.6 Å²	42.6	9%	0.092	24%	0.24	C	C	.	.	I	π-helix	trans	-79.3	-45.3	-166	-61.6	174.4	0	0	0	111.6	I488 T507 S514 A515 L688 T692	I488-I511 HydrophobicContact CB-CD1 4.44Å; I488-I511 HydrophobicContact CG1-CD1 3.91Å; I488-I511 HydrophobicContact CG2-CD1 3.66Å; T507-I511 HydrophobicContact CG2-CD1 4.25Å; T507-I511 WeakPolarHBondContact O-CB 3.47Å; T507-I511 PolarHBondContact O-N 2.89Å; I511-S514 WeakPolarHBondContact O-CB 3.27Å; I511-S514 PolarHBondContact O-N 2.97Å; I511-A515 PolarHBondContact O-N 3.4Å; I511-A515 VanDerWaalsContact O-N 3.13Å; I511-L688 HydrophobicContact CD1-CD2 3.54Å; I511-L688 HydrophobicContact CD1-CG 4.17Å; I511-L688 HydrophobicContact CG1-CD2 4.17Å; I511-L688 HydrophobicContact CG1-CG 4.37Å; I511-T692 HydrophobicContact CG2-CG2 4.13Å
512	V	88.6	Confident	92.4	Very high	31 Å²	31	42 Å²	42	19%	0.188	24%	0.235	C	C	.	.	H	α-helix	trans	-67.8	-43.6	-178.4	-169.1	0	0	0	0	112	A347 Y350 S514 A515 G516	A347-V512 HydrophobicContact CB-CB 3.92Å; A347-V512 HydrophobicContact CB-CG1 3.85Å; A347-V512 HydrophobicContact CB-CG2 4.39Å; Y350-V512 HydrophobicContact CD2-CG2 3.93Å; Y350-V512 HydrophobicContact CE2-CG2 3.94Å; V512-S514 PolarHBondContact O-N 3.34Å; V512-A515 PolarHBondContact O-N 2.99Å; V512-G516 PolarHBondContact O-N 3.2Å
513	P	89.8	Confident	92.3	Very high	60 Å²	60	39 Å²	39	39%	0.39	23%	0.231	S	C	.	.	H	α-helix	trans	-65.2	-35.9	173.4	-26.5	39.8	0	0	0	113.3	G508 L509 A515 G516 V517	G508-P513 WeakPolarHBondContact O-CD 3.37Å; L509-P513 WeakPolarHBondContact O-CG 3.1Å; P513-A515 PolarHBondContact O-N 3.22Å; P513-G516 PolarHBondContact O-N 3.49Å; P513-V517 WeakPolarHBondContact O-CG2 3.09Å; P513-V517 PolarHBondContact O-N 3Å
514	S	92.7	Very high	92.3	Very high	0 Å²	0	45.2 Å²	45.2	0%	0	26%	0.256	C	S	.	.	H	α-helix	trans	-55.3	-49	173.5	-179.3	0	0	0	0	112.2	I510 I511 V512 G516 V517 G518 F689 T692 L693	I510-S514 WeakPolarHBondContact O-CB 3.4Å; I510-S514 PolarHBondContact O-N 3.42Å; I511-S514 WeakPolarHBondContact O-CB 3.27Å; I511-S514 PolarHBondContact O-N 2.97Å; V512-S514 PolarHBondContact O-N 3.34Å; S514-G516 VanDerWaalsContact C-N 3.33Å; S514-G516 PolarHBondContact O-N 2.98Å; S514-V517 PolarHBondContact O-N 2.85Å; S514-G518 PolarHBondContact O-N 3.17Å; S514-F689 PolarHBondContact OG-O 2.99Å; S514-T692 WeakPolarHBondContact CB-OG1 3.27Å; S514-T692 PolarHBondContact OG-OG1 3.16Å; S514-L693 WeakPolarHBondContact OG-CB 3.39Å; S514-L693 PolarHBondContact OG-N 3.47Å; S514-L693 VanDerWaalsContact OG-N 3.15Å
515	A	91.9	Very high	92.3	Very high	33 Å²	33	47.2 Å²	47.2	27%	0.273	27%	0.266	S	S	.	.	H	α-helix	trans	-61.3	-41.2	176.9	0	0	0	0	0	112	I511 V512 P513 G518 I519 A696	I511-A515 PolarHBondContact O-N 3.4Å; I511-A515 VanDerWaalsContact O-N 3.13Å; V512-A515 PolarHBondContact O-N 2.99Å; P513-A515 PolarHBondContact O-N 3.22Å; A515-G518 PolarHBondContact O-N 3.01Å; A515-I519 WeakPolarHBondContact O-CG1 3.24Å; A515-I519 PolarHBondContact O-N 3.26Å; A515-A696 HydrophobicContact CB-CB 4.17Å; A515-A696 WeakPolarHBondContact O-CB 3.29Å
516	G	90.6	Very high	92.1	Very high	34 Å²	34	45.5 Å²	45.5	35%	0.351	26%	0.257	S	S	.	.	H	α-helix	trans	-60.3	-47	174.7	0	0	0	0	0	113.1	V512 P513 S514 I519 V520	V512-G516 PolarHBondContact O-N 3.2Å; P513-G516 PolarHBondContact O-N 3.49Å; S514-G516 VanDerWaalsContact C-N 3.33Å; S514-G516 PolarHBondContact O-N 2.98Å; G516-I519 PolarHBondContact O-N 3.31Å; G516-V520 WeakPolarHBondContact O-CG2 3.26Å; G516-V520 PolarHBondContact O-N 2.69Å; G516-V520 VanDerWaalsContact O-N 3.12Å
517	V	92.8	Very high	92	Very high	79 Å²	79	49.9 Å²	49.9	48%	0.479	28%	0.278	S	S	.	.	H	α-helix	trans	-62.1	-43	176	172	0	0	0	0	111	P513 S514 V520 L521 L693	P513-V517 WeakPolarHBondContact O-CG2 3.09Å; P513-V517 PolarHBondContact O-N 3Å; S514-V517 PolarHBondContact O-N 2.85Å; V517-V520 PolarHBondContact O-N 2.9Å; V517-L521 VanDerWaalsContact O-CB 3.3Å; V517-L521 WeakPolarHBondContact O-CB 3.48Å; V517-L521 PolarHBondContact O-N 3.03Å; V517-L693 HydrophobicContact CG1-CD1 4Å
518	G	93.7	Very high	92	Very high	0 Å²	0	56.5 Å²	56.5	0%	0	31%	0.306	C	S	.	.	H	α-helix	trans	-59.4	-48.4	176.3	0	0	0	0	0	113.1	S514 A515 V520 L521 G522 L693 C697	S514-G518 PolarHBondContact O-N 3.17Å; A515-G518 PolarHBondContact O-N 3.01Å; G518-V520 VanDerWaalsContact C-N 3.35Å; G518-V520 PolarHBondContact O-N 3.28Å; G518-L521 PolarHBondContact O-N 3.05Å; G518-G522 PolarHBondContact O-N 3.1Å; G518-L693 WeakPolarHBondContact CA-O 3.46Å; G518-C697 VanDerWaalsContact O-CA 3.27Å; G518-C697 WeakPolarHBondContact O-CA 3.48Å
519	I	92.4	Very high	92	Very high	72 Å²	72	61.6 Å²	61.6	37%	0.369	33%	0.333	S	S	.	.	H	α-helix	trans	-58.9	-45.2	176.9	-69.9	164.1	0	0	0	111.1	A515 G516 G522 G523 A696 P700	A515-I519 WeakPolarHBondContact O-CG1 3.24Å; A515-I519 PolarHBondContact O-N 3.26Å; G516-I519 PolarHBondContact O-N 3.31Å; I519-G522 PolarHBondContact O-N 3.32Å; I519-G523 PolarHBondContact O-N 3.12Å; I519-A696 HydrophobicContact CG1-CB 4.18Å; I519-P700 HydrophobicContact CG2-CG 4.23Å; I519-P700 WeakPolarHBondContact O-CG 3.34Å
520	V	92.4	Very high	92	Very high	105 Å²	105	65.4 Å²	65.4	64%	0.636	35%	0.345	S	S	*	.	H	α-helix	trans	-65	-42.3	178.7	172.5	0	0	0	0	111.2	G516 V517 G518 G523 Y524	G516-V520 WeakPolarHBondContact O-CG2 3.26Å; G516-V520 PolarHBondContact O-N 2.69Å; G516-V520 VanDerWaalsContact O-N 3.12Å; V517-V520 PolarHBondContact O-N 2.9Å; G518-V520 VanDerWaalsContact C-N 3.35Å; G518-V520 PolarHBondContact O-N 3.28Å; V520-G523 PolarHBondContact O-N 2.99Å; V520-Y524 WeakPolarHBondContact O-CB 3.29Å; V520-Y524 PolarHBondContact O-N 2.86Å
521	L	93.6	Very high	91.9	Very high	72 Å²	72	65.2 Å²	65.2	38%	0.377	34%	0.344	S	S	.	.	H	α-helix	trans	-63.1	-46.2	177.5	-179.9	60.1	0	0	0	111.8	V517 G518 G523 Y524 I525 L693	V517-L521 VanDerWaalsContact O-CB 3.3Å; V517-L521 WeakPolarHBondContact O-CB 3.48Å; V517-L521 PolarHBondContact O-N 3.03Å; G518-L521 PolarHBondContact O-N 3.05Å; L521-G523 PolarHBondContact O-N 3.49Å; L521-Y524 PolarHBondContact O-N 3.39Å; L521-I525 HydrophobicContact CD1-CD1 4.1Å; L521-I525 HydrophobicContact CD1-CG1 4.29Å; L521-I525 HydrophobicContact CG-CD1 3.95Å; L521-I525 VanDerWaalsContact O-CG1 3.29Å; L521-I525 WeakPolarHBondContact O-CG1 3.49Å; L521-I525 PolarHBondContact O-N 3.27Å; L521-L693 HydrophobicContact CD2-CD2 4.01Å
522	G	92.5	Very high	91.8	Very high	0 Å²	0	65.7 Å²	65.7	0%	0	35%	0.353	C	S	.	.	H	α-helix	trans	-59.5	-46.8	176.2	0	0	0	0	0	112.2	G518 I519 Y524 I525 I526 C697	G518-G522 PolarHBondContact O-N 3.1Å; I519-G522 PolarHBondContact O-N 3.32Å; G522-Y524 VanDerWaalsContact C-N 3.33Å; G522-Y524 PolarHBondContact O-N 3.3Å; G522-I525 PolarHBondContact O-N 2.98Å; G522-I526 WeakPolarHBondContact O-CD1 3.24Å; G522-I526 VanDerWaalsContact O-CG1 3.3Å; G522-I526 WeakPolarHBondContact O-CG1 3.48Å; G522-I526 PolarHBondContact O-N 3.07Å; G522-I526 VanDerWaalsContact O-N 3.12Å; G522-C697 VanDerWaalsContact CA-SG 3.5Å
523	G	91.3	Very high	91.8	Very high	32 Å²	32	65.4 Å²	65.4	33%	0.33	35%	0.354	S	S	.	.	H	α-helix	trans	-61.9	-38	174.9	0	0	0	0	0	113.2	I519 V520 L521 K527	I519-G523 PolarHBondContact O-N 3.12Å; V520-G523 PolarHBondContact O-N 2.99Å; L521-G523 PolarHBondContact O-N 3.49Å; G523-K527 WeakPolarHBondContact O-CB 3.33Å; G523-K527 PolarHBondContact O-N 3.42Å; G523-K527 VanDerWaalsContact O-N 3.09Å
524	Y	92.9	Very high	91.8	Very high	132 Å²	132	66.4 Å²	66.4	52%	0.518	35%	0.35	S	S	.	.	H	α-helix	trans	-66.6	-43.9	175.6	176.6	-94.4	0	0	0	112.4	V520 L521 G522 K527 K528	V520-Y524 WeakPolarHBondContact O-CB 3.29Å; V520-Y524 PolarHBondContact O-N 2.86Å; L521-Y524 PolarHBondContact O-N 3.39Å; G522-Y524 VanDerWaalsContact C-N 3.33Å; G522-Y524 PolarHBondContact O-N 3.3Å; Y524-K527 PolarHBondContact O-N 3.12Å; Y524-K528 HydrophobicContact CE1-CB 4.3Å; Y524-K528 HydrophobicContact CE1-CD 3.86Å; Y524-K528 WeakPolarHBondContact O-CB 3.46Å; Y524-K528 PolarHBondContact O-N 3.16Å
525	I	94.4	Very high	91.8	Very high	42 Å²	42	70.7 Å²	70.7	22%	0.215	37%	0.37	C	S	.	.	H	α-helix	trans	-59.3	-49.5	177.6	-69.7	164.1	0	0	0	110.3	L521 G522 K527 K528 L529 L539	L521-I525 HydrophobicContact CD1-CD1 4.1Å; L521-I525 HydrophobicContact CD1-CG1 4.29Å; L521-I525 HydrophobicContact CG-CD1 3.95Å; L521-I525 VanDerWaalsContact O-CG1 3.29Å; L521-I525 WeakPolarHBondContact O-CG1 3.49Å; L521-I525 PolarHBondContact O-N 3.27Å; G522-I525 PolarHBondContact O-N 2.98Å; I525-K527 VanDerWaalsContact C-N 3.31Å; I525-K527 PolarHBondContact O-N 3.42Å; I525-K528 PolarHBondContact O-N 3.12Å; I525-L529 HydrophobicContact CG2-CD1 3.82Å; I525-L529 HydrophobicContact CG2-CG 4.49Å; I525-L529 WeakPolarHBondContact O-CB 3.49Å; I525-L529 WeakPolarHBondContact O-CG 3.46Å; I525-L529 PolarHBondContact O-N 2.68Å; I525-L539 HydrophobicContact CB-CD2 4.38Å; I525-L539 HydrophobicContact CG2-CD1 4.31Å; I525-L539 HydrophobicContact CG2-CD2 3.68Å
526	I	91	Very high	91.8	Very high	13 Å²	13	69.1 Å²	69.1	7%	0.067	36%	0.357	C	S	.	.	H	α-helix	trans	-58.4	-44.3	178.2	-63.6	164.3	0	0	0	110.9	G522 K530 L531 L539 P700 S701 I704	G522-I526 WeakPolarHBondContact O-CD1 3.24Å; G522-I526 VanDerWaalsContact O-CG1 3.3Å; G522-I526 WeakPolarHBondContact O-CG1 3.48Å; G522-I526 PolarHBondContact O-N 3.07Å; G522-I526 VanDerWaalsContact O-N 3.12Å; I526-K530 WeakPolarHBondContact O-CA 3.41Å; I526-K530 PolarHBondContact O-N 3.26Å; I526-L531 HydrophobicContact CG1-CD1 4.23Å; I526-L531 HydrophobicContact CG2-CB 4.3Å; I526-L531 PolarHBondContact O-N 3.27Å; I526-L539 HydrophobicContact CG1-CD2 3.92Å; I526-P700 HydrophobicContact CD1-CB 3.87Å; I526-S701 WeakPolarHBondContact CD1-OG 3.43Å; I526-I704 HydrophobicContact CD1-CD1 4.06Å; I526-I704 HydrophobicContact CG2-CD1 3.79Å
527	K	91.6	Very high	92	Very high	172 Å²	172	67.5 Å²	67.5	75%	0.748	34%	0.341	S	S	*	.	H	α-helix	trans	-66.8	-45	178.7	-176.4	-179.1	177.1	-176.1	0	112.7	G523 Y524 I525 K530	G523-K527 WeakPolarHBondContact O-CB 3.33Å; G523-K527 PolarHBondContact O-N 3.42Å; G523-K527 VanDerWaalsContact O-N 3.09Å; Y524-K527 PolarHBondContact O-N 3.12Å; I525-K527 VanDerWaalsContact C-N 3.31Å; I525-K527 PolarHBondContact O-N 3.42Å; K527-K530 PolarHBondContact O-N 3.41Å
528	K	93.6	Very high	92.1	Very high	140 Å²	140	69.2 Å²	69.2	61%	0.609	34%	0.342	S	S	*	.	H	α-helix	trans	-65.5	-44.5	-178.5	-175.9	-176.9	-179.6	179.8	0	111.3	Y524 I525	Y524-K528 HydrophobicContact CE1-CB 4.3Å; Y524-K528 HydrophobicContact CE1-CD 3.86Å; Y524-K528 WeakPolarHBondContact O-CB 3.46Å; Y524-K528 PolarHBondContact O-N 3.16Å; I525-K528 PolarHBondContact O-N 3.12Å
529	L	92.4	Very high	92.1	Very high	108 Å²	108	70.5 Å²	70.5	57%	0.565	35%	0.348	S	S	*	.	H	α-helix	trans	-87.7	-2.9	-177.6	-57.5	179.7	0	0	0	113.6	I525 L531	I525-L529 HydrophobicContact CG2-CD1 3.82Å; I525-L529 HydrophobicContact CG2-CG 4.49Å; I525-L529 WeakPolarHBondContact O-CB 3.49Å; I525-L529 WeakPolarHBondContact O-CG 3.46Å; I525-L529 PolarHBondContact O-N 2.68Å; L529-L531 VanDerWaalsContact C-N 3.28Å; L529-L531 HydrophobicContact CB-CD2 3.42Å; L529-L531 VanDerWaalsContact CB-CD2 3.42Å; L529-L531 HydrophobicContact CB-CG 3.87Å; L529-L531 HydrophobicContact CD1-CD2 4.21Å; L529-L531 HydrophobicContact CG-CD2 4.47Å; L529-L531 PolarHBondContact O-N 3.42Å
530	K	92.6	Very high	92.1	Very high	190 Å²	190	67.2 Å²	67.2	83%	0.826	33%	0.332	S	S	*	.	T	Hydrogen-bonded Turn	trans	52	41.5	-178.7	-57.9	178.4	-178.4	173.7	0	113.3	I526 K527 G532	I526-K530 WeakPolarHBondContact O-CA 3.41Å; I526-K530 PolarHBondContact O-N 3.26Å; K527-K530 PolarHBondContact O-N 3.41Å; K530-G532 PolarHBondContact O-N 3.27Å
531	L	89.1	Confident	92.3	Very high	36 Å²	36	63.5 Å²	63.5	19%	0.188	31%	0.308	C	S	.	.			trans	-62.4	134.8	-170.8	-56	-174.1	0	0	0	112.5	I526 L529 E535 L539	I526-L531 HydrophobicContact CG1-CD1 4.23Å; I526-L531 HydrophobicContact CG2-CB 4.3Å; I526-L531 PolarHBondContact O-N 3.27Å; L529-L531 VanDerWaalsContact C-N 3.28Å; L529-L531 HydrophobicContact CB-CD2 3.42Å; L529-L531 VanDerWaalsContact CB-CD2 3.42Å; L529-L531 HydrophobicContact CB-CG 3.87Å; L529-L531 HydrophobicContact CD1-CD2 4.21Å; L529-L531 HydrophobicContact CG-CD2 4.47Å; L529-L531 PolarHBondContact O-N 3.42Å; L531-E535 HydrophobicContact CB-CB 4Å; L531-E535 HydrophobicContact CD2-CB 3.83Å; L531-E535 HydrophobicContact CG-CB 4.33Å; L531-L539 HydrophobicContact CD1-CB 4.15Å; L531-L539 HydrophobicContact CD1-CD2 3.7Å
532	G	88.8	Confident	92.4	Very high	28 Å²	28	64.2 Å²	64.2	29%	0.289	31%	0.312	S	S	.	.			trans	-80.6	-167.4	168.4	0	0	0	0	0	112	K530 E535 S536	K530-G532 PolarHBondContact O-N 3.27Å; G532-E535 WeakPolarHBondContact CA-OE2 3.33Å; G532-E535 PolarHBondContact N-OE2 2.99Å; G532-S536 WeakPolarHBondContact O-CB 3.29Å; G532-S536 PolarHBondContact O-N 3.39Å; G532-S536 PolarHBondContact O-OG 3.11Å
533	A	87.4	Confident	92.4	Very high	26 Å²	26	64.9 Å²	64.9	22%	0.215	32%	0.316	C	S	.	.	H	α-helix	trans	-67.9	-44.5	-177.2	0	0	0	0	0	112.3	A537 R708	A533-A537 WeakPolarHBondContact O-CB 3Å; A533-A537 PolarHBondContact O-N 2.9Å; A533-R708 HydrophobicContact CB-CB 3.81Å; A533-R708 HydrophobicContact CB-CG 4.26Å
534	R	90.9	Very high	92.5	Very high	80 Å²	80	63.5 Å²	63.5	30%	0.302	30%	0.301	S	S	.	.	H	α-helix	trans	-65.7	-40.5	178.7	172.4	167.7	160.9	-174.2	-8	112.6	K538 I793 E797	R534-K538 WeakPolarHBondContact O-CB 3.37Å; R534-K538 PolarHBondContact O-N 2.82Å; R534-I793 HydrophobicContact CB-CG2 3.87Å; R534-E797 WeakPolarHBondContact CB-OE1 3.2Å; R534-E797 WeakPolarHBondContact CD-OE2 3.42Å; R534-E797 IonicContact CZ-OE2 2.79Å; R534-E797 IonicContact NE-OE2 3.12Å; R534-E797 IonicContact NH1-OE2 2.65Å; R534-E797 PolarHBondContact NH1-OE2 3.01Å
535	E	93	Very high	92.6	Very high	90 Å²	90	58 Å²	58	42%	0.421	29%	0.285	S	S	.	.	H	α-helix	trans	-76.2	-34.7	179.8	-51.7	78.5	-174.8	0	0	111.3	L531 G532 K538 L539	L531-E535 HydrophobicContact CB-CB 4Å; L531-E535 HydrophobicContact CD2-CB 3.83Å; L531-E535 HydrophobicContact CG-CB 4.33Å; G532-E535 WeakPolarHBondContact CA-OE2 3.33Å; G532-E535 PolarHBondContact N-OE2 2.99Å; E535-K538 PolarHBondContact O-N 2.6Å; E535-L539 WeakPolarHBondContact O-CB 3.16Å; E535-L539 PolarHBondContact O-N 3.46Å
536	S	91.9	Very high	92.6	Very high	0 Å²	0	59 Å²	59	0%	0	29%	0.293	C	S	.	.	H	α-helix	trans	-64.1	-41.9	170.2	-59.6	0	0	0	0	111.4	G532 K538 L539 A540	G532-S536 WeakPolarHBondContact O-CB 3.29Å; G532-S536 PolarHBondContact O-N 3.39Å; G532-S536 PolarHBondContact O-OG 3.11Å; S536-K538 VanDerWaalsContact C-N 3.34Å; S536-K538 PolarHBondContact O-N 2.85Å; S536-L539 PolarHBondContact O-N 3.32Å; S536-A540 PolarHBondContact O-N 3.08Å
537	A	93.6	Very high	92.7	Very high	0 Å²	0	58.4 Å²	58.4	0%	0	29%	0.29	C	S	.	.	H	α-helix	trans	-64.1	-37.6	173.3	0	0	0	0	0	112.2	A533 M541 V705 W790 I793	A533-A537 WeakPolarHBondContact O-CB 3Å; A533-A537 PolarHBondContact O-N 2.9Å; A537-M541 WeakPolarHBondContact O-CB 3.33Å; A537-M541 PolarHBondContact O-N 2.9Å; A537-V705 HydrophobicContact CB-CG2 3.84Å; A537-W790 HydrophobicContact CB-CB 4.05Å; A537-I793 HydrophobicContact CB-CD1 3.95Å
538	K	94.6	Very high	92.7	Very high	116 Å²	116	52.3 Å²	52.3	50%	0.504	27%	0.265	S	S	.	.	H	α-helix	trans	-64.7	-42.7	173.3	-169.2	-173.1	176.9	-171.4	0	111.7	R534 E535 S536 M541 I542	R534-K538 WeakPolarHBondContact O-CB 3.37Å; R534-K538 PolarHBondContact O-N 2.82Å; E535-K538 PolarHBondContact O-N 2.6Å; S536-K538 VanDerWaalsContact C-N 3.34Å; S536-K538 PolarHBondContact O-N 2.85Å; K538-M541 PolarHBondContact O-N 3.02Å; K538-I542 HydrophobicContact CG-CD1 4.08Å; K538-I542 VanDerWaalsContact O-CG1 3.3Å; K538-I542 WeakPolarHBondContact O-CG1 2.99Å; K538-I542 PolarHBondContact O-N 2.79Å
539	L	93.8	Very high	92.6	Very high	26 Å²	26	51.5 Å²	51.5	14%	0.136	27%	0.267	C	S	.	.	H	α-helix	trans	-61.9	-47.3	176.1	177.8	61.3	0	0	0	111.1	I525 I526 L531 E535 S536 M541 I542 C543	I525-L539 HydrophobicContact CB-CD2 4.38Å; I525-L539 HydrophobicContact CG2-CD1 4.31Å; I525-L539 HydrophobicContact CG2-CD2 3.68Å; I526-L539 HydrophobicContact CG1-CD2 3.92Å; L531-L539 HydrophobicContact CD1-CB 4.15Å; L531-L539 HydrophobicContact CD1-CD2 3.7Å; E535-L539 WeakPolarHBondContact O-CB 3.16Å; E535-L539 PolarHBondContact O-N 3.46Å; S536-L539 PolarHBondContact O-N 3.32Å; L539-M541 VanDerWaalsContact C-N 3.33Å; L539-M541 PolarHBondContact O-N 2.03Å; L539-I542 PolarHBondContact O-N 3.31Å; L539-C543 PolarHBondContact O-N 3.31Å; L539-C543 PolarHBondContact O-SG 3.19Å; L539-C543 VanDerWaalsContact O-SG 3.39Å
540	A	93.9	Very high	92.5	Very high	4 Å²	4	47.8 Å²	47.8	3%	0.033	25%	0.25	C	C	.	.	H	α-helix	trans	-59.8	-42	177.3	0	0	0	0	0	112.3	S536 C543 S544 I786	S536-A540 PolarHBondContact O-N 3.08Å; A540-C543 PolarHBondContact O-N 2.91Å; A540-S544 WeakPolarHBondContact O-CB 3.45Å; A540-S544 PolarHBondContact O-N 2.93Å; A540-I786 HydrophobicContact CB-CD1 3.89Å; A540-I786 HydrophobicContact CB-CG1 3.84Å
541	M	95.1	Very high	92.2	Very high	26 Å²	26	38.8 Å²	38.8	13%	0.128	21%	0.21	C	C	.	.	H	α-helix	trans	-60.8	-44.9	174.1	-173.8	-162	-50.1	0	0	112.1	A537 K538 L539 S544 G545 F783 I786 F787 W790	A537-M541 WeakPolarHBondContact O-CB 3.33Å; A537-M541 PolarHBondContact O-N 2.9Å; K538-M541 PolarHBondContact O-N 3.02Å; L539-M541 VanDerWaalsContact C-N 3.33Å; L539-M541 PolarHBondContact O-N 2.03Å; M541-S544 PolarHBondContact O-N 3.03Å; M541-G545 PolarHBondContact O-N 3.35Å; M541-F783 HydrophobicContact CG-CD2 4.44Å; M541-F783 HydrophobicContact CG-CE2 3.76Å; M541-F783 HydrophobicContact CG-CZ 4.26Å; M541-I786 HydrophobicContact CB-CG1 4.39Å; M541-I786 HydrophobicContact CB-CG2 4.18Å; M541-I786 HydrophobicContact CG-CG2 4.4Å; M541-F787 HydrophobicContact CE-CD2 4Å; M541-F787 HydrophobicContact SD-CD2 3.99Å; M541-W790 HydrophobicContact CE-CB 3.38Å; M541-W790 HydrophobicContact CE-CD2 3.55Å; M541-W790 HydrophobicContact CE-CE3 3.73Å; M541-W790 HydrophobicContact CE-CG 3.41Å; M541-W790 VanDerWaalsContact CE-CG 3.41Å
542	I	95.6	Very high	91.9	Very high	88 Å²	88	40 Å²	40	45%	0.451	22%	0.222	S	C	.	.	H	α-helix	trans	-63.5	-48.2	177.5	-68.9	164.3	0	0	0	110.4	K538 L539 S544 G545 V546	K538-I542 HydrophobicContact CG-CD1 4.08Å; K538-I542 VanDerWaalsContact O-CG1 3.3Å; K538-I542 WeakPolarHBondContact O-CG1 2.99Å; K538-I542 PolarHBondContact O-N 2.79Å; L539-I542 PolarHBondContact O-N 3.31Å; I542-S544 PolarHBondContact O-N 3.37Å; I542-G545 PolarHBondContact O-N 2.76Å; I542-V546 HydrophobicContact CG2-CG2 4.36Å; I542-V546 WeakPolarHBondContact O-CG2 3.06Å; I542-V546 PolarHBondContact O-N 3.4Å
543	C	94	Very high	91.8	Very high	13 Å²	13	40.6 Å²	40.6	9%	0.088	22%	0.22	C	C	.	.	H	α-helix	trans	-62	-40.9	178.2	-67	0	0	0	0	112.3	L539 A540 S547 I694 A698	L539-C543 PolarHBondContact O-N 3.31Å; L539-C543 PolarHBondContact O-SG 3.19Å; L539-C543 VanDerWaalsContact O-SG 3.39Å; A540-C543 PolarHBondContact O-N 2.91Å; C543-S547 WeakPolarHBondContact O-CB 3.47Å; C543-S547 PolarHBondContact O-N 3.19Å; C543-I694 WeakPolarHBondContact O-CG2 3.3Å; C543-A698 HydrophobicContact CB-CB 3.92Å
544	S	93.3	Very high	91.7	Very high	3 Å²	3	39.3 Å²	39.3	2%	0.021	21%	0.21	C	C	.	.	H	α-helix	trans	-68.5	-40.1	177.3	-165.8	0	0	0	0	111.7	E477 A540 M541 I542 S547 L548	E477-S544 PolarHBondContact OE1-OG 3.16Å; A540-S544 WeakPolarHBondContact O-CB 3.45Å; A540-S544 PolarHBondContact O-N 2.93Å; M541-S544 PolarHBondContact O-N 3.03Å; I542-S544 PolarHBondContact O-N 3.37Å; S544-S547 WeakPolarHBondContact O-CB 3.44Å; S544-S547 PolarHBondContact O-N 2.61Å; S544-L548 PolarHBondContact O-N 3.01Å
545	G	94.4	Very high	91.4	Very high	18 Å²	18	37.5 Å²	37.5	19%	0.186	20%	0.204	C	C	.	.	H	α-helix	trans	-66.1	-44.5	175.2	0	0	0	0	0	113.8	M541 I542 S547 L548 L549	M541-G545 PolarHBondContact O-N 3.35Å; I542-G545 PolarHBondContact O-N 2.76Å; G545-S547 VanDerWaalsContact C-N 3.33Å; G545-L548 PolarHBondContact O-N 3.43Å; G545-L549 PolarHBondContact O-N 2.89Å; G545-L549 VanDerWaalsContact O-N 3.16Å
546	V	94.6	Very high	90.8	Very high	63 Å²	63	39.8 Å²	39.8	38%	0.382	22%	0.218	S	C	.	.	H	α-helix	trans	-65.2	-39.5	173.1	176.9	0	0	0	0	110.4	I542 L548 L549 C550 I694	I542-V546 HydrophobicContact CG2-CG2 4.36Å; I542-V546 WeakPolarHBondContact O-CG2 3.06Å; I542-V546 PolarHBondContact O-N 3.4Å; V546-L548 PolarHBondContact O-N 3.45Å; V546-L549 PolarHBondContact O-N 3.3Å; V546-C550 PolarHBondContact O-N 2.93Å; V546-C550 PolarHBondContact O-SG 3.21Å; V546-I694 HydrophobicContact CB-CG2 4.35Å; V546-I694 HydrophobicContact CG1-CD1 4.04Å; V546-I694 HydrophobicContact CG1-CG2 4.27Å
547	S	92.4	Very high	90.4	Very high	0 Å²	0	40.7 Å²	40.7	0%	0	22%	0.223	C	C	.	.	H	α-helix	trans	-58.5	-46.6	174.2	-180	0	0	0	0	111.6	C543 S544 G545 L549 C550 F551 T695 K779	C543-S547 WeakPolarHBondContact O-CB 3.47Å; C543-S547 PolarHBondContact O-N 3.19Å; S544-S547 WeakPolarHBondContact O-CB 3.44Å; S544-S547 PolarHBondContact O-N 2.61Å; G545-S547 VanDerWaalsContact C-N 3.33Å; S547-L549 VanDerWaalsContact C-N 3.3Å; S547-L549 PolarHBondContact O-N 3.41Å; S547-C550 CarbonylContact O-C 3.46Å; S547-C550 PolarHBondContact O-N 2.93Å; S547-C550 VanDerWaalsContact O-N 3.11Å; S547-F551 WeakPolarHBondContact O-CD2 3.12Å; S547-F551 PolarHBondContact O-N 3.02Å; S547-T695 PolarHBondContact OG-OG1 2.93Å; S547-K779 WeakPolarHBondContact OG-CE 3.46Å; S547-K779 PolarHBondContact OG-NZ 3Å
548	L	92.1	Very high	89.7	Confident	44 Å²	44	41.3 Å²	41.3	23%	0.23	23%	0.23	C	C	.	.	H	α-helix	trans	-58.1	-40.1	176.7	-179.7	65.6	0	0	0	112.3	S544 G545 V546 F551 A776 K779 F780	S544-L548 PolarHBondContact O-N 3.01Å; G545-L548 PolarHBondContact O-N 3.43Å; V546-L548 PolarHBondContact O-N 3.45Å; L548-F551 WeakPolarHBondContact O-CB 3.09Å; L548-F551 PolarHBondContact O-N 2.74Å; L548-A776 HydrophobicContact CD1-CB 4.33Å; L548-A776 WeakPolarHBondContact CD1-O 3.45Å; L548-K779 HydrophobicContact CD1-CB 3.79Å; L548-F780 HydrophobicContact CD1-CB 4.47Å; L548-F780 HydrophobicContact CD2-CB 4.41Å; L548-F780 HydrophobicContact CD2-CD2 4.08Å
549	L	91.1	Very high	89.1	Confident	123 Å²	123	36.2 Å²	36.2	64%	0.644	21%	0.208	S	C	*	.	H	α-helix	trans	-65.8	-43.9	173.5	-67.8	174.6	0	0	0	111.7	G545 V546 S547 F551 S552	G545-L549 PolarHBondContact O-N 2.89Å; G545-L549 VanDerWaalsContact O-N 3.16Å; V546-L549 PolarHBondContact O-N 3.3Å; S547-L549 VanDerWaalsContact C-N 3.3Å; S547-L549 PolarHBondContact O-N 3.41Å; L549-F551 VanDerWaalsContact C-N 3.28Å; L549-F551 PolarHBondContact O-N 3.35Å; L549-S552 WeakPolarHBondContact O-CB 3.42Å; L549-S552 PolarHBondContact O-N 3.35Å; L549-S552 VanDerWaalsContact O-N 3.07Å; L549-S552 PolarHBondContact O-OG 3.43Å
550	C	89.9	Confident	88.4	Confident	29 Å²	29	43 Å²	43	20%	0.196	24%	0.239	C	C	.	.	H	α-helix	trans	-67.4	-27.2	176.4	-63.1	0	0	0	0	112.8	V546 S547 S552 T553 V691	V546-C550 PolarHBondContact O-N 2.93Å; V546-C550 PolarHBondContact O-SG 3.21Å; S547-C550 CarbonylContact O-C 3.46Å; S547-C550 PolarHBondContact O-N 2.93Å; S547-C550 VanDerWaalsContact O-N 3.11Å; C550-S552 PolarHBondContact O-N 2.93Å; C550-T553 PolarHBondContact O-N 3.27Å; C550-T553 PolarHBondContact O-OG1 3.05Å; C550-T553 VanDerWaalsContact O-OG1 3.08Å; C550-V691 HydrophobicContact CB-CG2 3.53Å; C550-V691 WeakPolarHBondContact O-CG2 3.37Å
551	F	87.3	Confident	87.4	Confident	1 Å²	1	44.7 Å²	44.7	0%	0.004	25%	0.251	C	S	.	.	H	α-helix	trans	-60.7	-30.2	170.7	-100.6	-91.6	0	0	0	111.9	I480 F484 S547 L548 L549 T553 L554 F555 V691 F772 A775 K779	I480-F551 HydrophobicContact CG2-CZ 3.82Å; F484-F551 HydrophobicContact CE1-CE1 4.29Å; F484-F551 HydrophobicContact CE1-CZ 4.44Å; F484-F551 HydrophobicContact CE2-CE1 4.39Å; F484-F551 HydrophobicContact CE2-CZ 4.05Å; F484-F551 AromaticContact CZ-CE1 3.58Å; F484-F551 HydrophobicContact CZ-CE1 3.58Å; F484-F551 AromaticContact CZ-CZ 3.63Å; F484-F551 HydrophobicContact CZ-CZ 3.63Å; S547-F551 WeakPolarHBondContact O-CD2 3.12Å; S547-F551 PolarHBondContact O-N 3.02Å; L548-F551 WeakPolarHBondContact O-CB 3.09Å; L548-F551 PolarHBondContact O-N 2.74Å; L549-F551 VanDerWaalsContact C-N 3.28Å; L549-F551 PolarHBondContact O-N 3.35Å; F551-T553 VanDerWaalsContact C-N 3.29Å; F551-T553 PolarHBondContact O-N 2.99Å; F551-L554 HydrophobicContact CD1-CD1 4.41Å; F551-L554 PolarHBondContact O-N 3.12Å; F551-F555 WeakPolarHBondContact O-CD2 3.22Å; F551-F555 WeakPolarHBondContact O-CE2 3.37Å; F551-V691 HydrophobicContact CD2-CG1 3.56Å; F551-V691 HydrophobicContact CE2-CG1 3.24Å; F551-V691 HydrophobicContact CG-CG1 4.32Å; F551-V691 HydrophobicContact CZ-CG1 3.79Å; F551-F772 HydrophobicContact CD1-CD1 4.44Å; F551-F772 HydrophobicContact CE1-CD1 4.26Å; F551-A775 HydrophobicContact CD1-CB 4.3Å; F551-A775 HydrophobicContact CE1-CB 3.59Å; F551-A775 HydrophobicContact CZ-CB 4.33Å; F551-K779 HydrophobicContact CD2-CG 4.02Å; F551-K779 HydrophobicContact CE2-CD 4.33Å; F551-K779 HydrophobicContact CE2-CG 3.98Å; F551-K779 HydrophobicContact CZ-CG 4.49Å
552	S	82.4	Confident	86.3	Confident	63 Å²	63	44 Å²	44	44%	0.441	25%	0.248	S	C	.	.	H	α-helix	trans	-64.2	-28.5	178.8	75.3	0	0	0	0	114	L549 C550 L554 F555	L549-S552 WeakPolarHBondContact O-CB 3.42Å; L549-S552 PolarHBondContact O-N 3.35Å; L549-S552 VanDerWaalsContact O-N 3.07Å; L549-S552 PolarHBondContact O-OG 3.43Å; C550-S552 PolarHBondContact O-N 2.93Å; S552-L554 VanDerWaalsContact C-N 3.32Å; S552-L554 PolarHBondContact O-N 3.43Å; S552-F555 PolarHBondContact O-N 3.25Å
553	T	85.6	Confident	85.4	Confident	39 Å²	39	43.5 Å²	43.5	24%	0.239	25%	0.246	C	C	.	.	H	α-helix	trans	-73	-25.8	178.8	71.9	0	0	0	0	112.6	C550 F551 F555 I556 V557 F687	C550-T553 PolarHBondContact O-N 3.27Å; C550-T553 PolarHBondContact O-OG1 3.05Å; C550-T553 VanDerWaalsContact O-OG1 3.08Å; F551-T553 VanDerWaalsContact C-N 3.29Å; F551-T553 PolarHBondContact O-N 2.99Å; T553-F555 PolarHBondContact O-N 2.58Å; T553-I556 PolarHBondContact O-N 2.84Å; T553-I556 VanDerWaalsContact O-N 3.16Å; T553-V557 PolarHBondContact O-N 3.5Å; T553-V557 VanDerWaalsContact O-N 3.15Å; T553-F687 HydrophobicContact CG2-CE1 4.43Å; T553-F687 WeakPolarHBondContact OG1-CD1 3.32Å
554	L	86.1	Confident	84.6	Confident	0 Å²	0	43.3 Å²	43.3	0%	0	24%	0.244	C	C	.	.	H	α-helix	trans	-70.3	-15.6	178.1	-58.9	-179.8	0	0	0	113.6	F551 S552 F684 F687 L688 V691 F772	F551-L554 HydrophobicContact CD1-CD1 4.41Å; F551-L554 PolarHBondContact O-N 3.12Å; S552-L554 VanDerWaalsContact C-N 3.32Å; S552-L554 PolarHBondContact O-N 3.43Å; L554-F684 HydrophobicContact CD2-CD2 4.17Å; L554-F684 HydrophobicContact CD2-CE2 4.06Å; L554-F687 HydrophobicContact CD2-CB 3.69Å; L554-L688 HydrophobicContact CD1-CD1 4.35Å; L554-L688 HydrophobicContact CD2-CB 4.48Å; L554-V691 HydrophobicContact CD1-CB 4.4Å; L554-V691 HydrophobicContact CD1-CG1 4.25Å; L554-V691 HydrophobicContact CD1-CG2 4.05Å; L554-V691 HydrophobicContact CG-CG2 4.36Å; L554-F772 HydrophobicContact CB-CD1 4.3Å; L554-F772 HydrophobicContact CB-CD2 3.79Å; L554-F772 HydrophobicContact CB-CE1 4.34Å; L554-F772 HydrophobicContact CB-CE2 3.8Å; L554-F772 HydrophobicContact CB-CG 4.06Å; L554-F772 HydrophobicContact CB-CZ 4.11Å; L554-F772 HydrophobicContact CD1-CD1 4.1Å; L554-F772 HydrophobicContact CD1-CE1 3.8Å; L554-F772 HydrophobicContact CD1-CZ 4.1Å; L554-F772 WeakPolarHBondContact O-CD2 3.05Å
555	F	84.2	Confident	83.6	Confident	42 Å²	42	43.3 Å²	43.3	18%	0.184	25%	0.245	C	C	.	.	H	α-helix	trans	-77.4	-34.1	171.1	-64.5	-99.7	0	0	0	112	F551 S552 T553 R768 F769 F772 G773 A776	F551-F555 WeakPolarHBondContact O-CD2 3.22Å; F551-F555 WeakPolarHBondContact O-CE2 3.37Å; S552-F555 PolarHBondContact O-N 3.25Å; T553-F555 PolarHBondContact O-N 2.58Å; F555-R768 PolarHBondContact O-NE 3.31Å; F555-F769 HydrophobicContact CB-CE1 4.3Å; F555-F769 AromaticContact CD1-CD1 3.72Å; F555-F769 HydrophobicContact CD1-CD1 3.72Å; F555-F769 HydrophobicContact CD1-CE1 4.11Å; F555-F769 HydrophobicContact CE1-CD1 4.45Å; F555-F772 HydrophobicContact CD1-CB 4.34Å; F555-F772 HydrophobicContact CD2-CB 4.32Å; F555-F772 HydrophobicContact CE1-CB 3.99Å; F555-F772 HydrophobicContact CE2-CB 3.96Å; F555-F772 HydrophobicContact CZ-CB 3.8Å; F555-F772 WeakPolarHBondContact CZ-O 3.07Å; F555-G773 VanDerWaalsContact CE1-N 3.34Å; F555-A776 HydrophobicContact CE2-CB 4.28Å; F555-A776 HydrophobicContact CZ-CB 4.06Å
556	I	81.4	Confident	82.3	Confident	137 Å²	137	42.9 Å²	42.9	70%	0.703	24%	0.241	S	C	*	.	H	α-helix	trans	-79.1	-41.3	-176.2	-55.1	174.4	0	0	0	110.1	T553 G558	T553-I556 PolarHBondContact O-N 2.84Å; T553-I556 VanDerWaalsContact O-N 3.16Å; I556-G558 PolarHBondContact O-N 3.36Å
557	V	83.2	Confident	81.2	Confident	20 Å²	20	41.1 Å²	41.1	12%	0.121	23%	0.229	C	C	.	.	S	Bend	trans	-90.3	104.2	-174.3	-170.8	0	0	0	0	111.1	T553 P683 F684 F687	T553-V557 PolarHBondContact O-N 3.5Å; T553-V557 VanDerWaalsContact O-N 3.15Å; V557-P683 HydrophobicContact CG1-CB 4.43Å; V557-P683 HydrophobicContact CG1-CG 4.28Å; V557-F684 HydrophobicContact CG1-CB 3.88Å; V557-F687 HydrophobicContact CG2-CD2 3.89Å; V557-F687 HydrophobicContact CG2-CE2 3.85Å
558	G	78.8	Confident	80.1	Confident	13 Å²	13	44.1 Å²	44.1	13%	0.134	25%	0.245	C	C	.	.	S	Bend	trans	-166	-163.4	172.4	0	0	0	0	0	111.5	I556 T680	I556-G558 PolarHBondContact O-N 3.36Å; G558-T680 VanDerWaalsContact C-OG1 3.28Å; G558-T680 PolarHBondContact O-OG1 2.84Å
559	C	82.3	Confident	79.1	Confident	8 Å²	8	44.7 Å²	44.7	5%	0.054	25%	0.247	C	C	.	.			trans	-105.8	170.8	173.1	-46.9	0	0	0	0	111	Q495 F496 C678 R768	Q495-C559 WeakPolarHBondContact O-CB 3.49Å; Q495-C559 PolarHBondContact O-SG 3.42Å; F496-C559 WeakPolarHBondContact CD1-SG 3.39Å; C559-C678 VanDerWaalsContact CA-SG 3.55Å; C559-C678 HydrophobicContact CB-CB 4.02Å; C559-C678 WeakPolarHBondContact CB-SG 3.36Å; C559-C678 WeakPolarHBondContact SG-CB 3.4Å; C559-C678 CovalentContact SG-SG 2.02Å; C559-C678 PolarHBondContact SG-SG 2.87Å; C559-R768 PolarHBondContact O-NH1 3.39Å
560	E	78.4	Confident	77.8	Confident	168 Å²	168	40.8 Å²	40.8	79%	0.785	23%	0.229	S	C	*	.	P	Polyproline II helix	trans	-88.9	161.7	167.6	-63.2	-176	160.2	0	0	111.3	R676 V764	E560-R676 PolarHBondContact O-NE 2.89Å; E560-R676 PolarHBondContact O-NH2 3.29Å; E560-V764 VanDerWaalsContact C-CG2 3.45Å; E560-V764 WeakPolarHBondContact O-CG2 3.04Å
561	S	73	Confident	76.6	Confident	40 Å²	40	40.9 Å²	40.9	28%	0.28	23%	0.226	S	C	.	.	P	Polyproline II helix	trans	-62.6	140.8	172.3	46.9	0	0	0	0	111.2
562	I	72.6	Confident	75.1	Confident	13 Å²	13	43.9 Å²	43.9	7%	0.067	24%	0.244	C	C	.	.	P	Polyproline II helix	trans	-63.6	147	166.2	37.6	165.9	0	0	0	110.1	L564 N568 K673 R676 E761	I562-L564 HydrophobicContact CB-CD1 4.21Å; I562-L564 HydrophobicContact CD1-CD1 3.6Å; I562-L564 HydrophobicContact CD1-CG 4.5Å; I562-L564 HydrophobicContact CG1-CD1 3.53Å; I562-L564 WeakPolarHBondContact O-CD1 3.42Å; I562-L564 PolarHBondContact O-N 3.16Å; I562-N568 PolarHBondContact O-ND2 3Å; I562-K673 HydrophobicContact CD1-CD 4.32Å; I562-R676 HydrophobicContact CG2-CG 3.77Å; I562-R676 VanDerWaalsContact N-NH2 3.14Å; I562-E761 HydrophobicContact CD1-CG 4.15Å; I562-E761 HydrophobicContact CG1-CG 4.33Å; I562-E761 WeakPolarHBondContact CG1-OE1 3.34Å
563	N	75.9	Confident	73.6	Confident	77 Å²	77	47 Å²	47	41%	0.412	26%	0.26	S	S	.	.			trans	-78.6	105.2	174.3	-68.2	-44.5	0	0	0	109	I569 I608 T609	N563-I569 HydrophobicContact CB-CD1 3.69Å; N563-I569 HydrophobicContact CB-CG1 4.3Å; N563-I608 HydrophobicContact CB-CG1 4.4Å; N563-I608 WeakPolarHBondContact O-CG2 3.1Å; N563-T609 PolarHBondContact O-N 3.12Å
564	L	76.8	Confident	71.8	Confident	8 Å²	8	46.6 Å²	46.6	4%	0.042	26%	0.264	C	S	.	.	B	Isolated β-bridge	trans	-98.7	126.5	172.3	-77.7	86.4	0	0	0	111.6	I562 I567 N568 I569 T609 E761	I562-L564 HydrophobicContact CB-CD1 4.21Å; I562-L564 HydrophobicContact CD1-CD1 3.6Å; I562-L564 HydrophobicContact CD1-CG 4.5Å; I562-L564 HydrophobicContact CG1-CD1 3.53Å; I562-L564 WeakPolarHBondContact O-CD1 3.42Å; I562-L564 PolarHBondContact O-N 3.16Å; L564-I567 HydrophobicContact CB-CB 4.06Å; L564-I567 HydrophobicContact CB-CD1 4.4Å; L564-I567 HydrophobicContact CD2-CD1 3.84Å; L564-I567 PolarHBondContact O-N 3.45Å; L564-N568 PolarHBondContact O-N 2.74Å; L564-I569 PolarHBondContact O-N 3.48Å; L564-T609 VanDerWaalsContact CA-O 3.31Å; L564-T609 WeakPolarHBondContact CA-O 3.31Å; L564-E761 HydrophobicContact CD1-CG 4.44Å
565	G	72.5	Confident	69.5	Low	4 Å²	4	53 Å²	53	4%	0.041	31%	0.306	C	S	.	.	B	Isolated β-bridge	trans	-62.7	131.2	170.5	0	0	0	0	0	112	I567 I569 T609	G565-I567 VanDerWaalsContact C-N 3.25Å; G565-I567 PolarHBondContact O-N 3.09Å; G565-I569 CarbonylContact C-O 3.59Å; G565-T609 PolarHBondContact N-O 3.25Å; G565-T609 VanDerWaalsContact N-O 3.16Å
566	G	67.8	Low	67.4	Low	9 Å²	9	56.6 Å²	56.6	9%	0.093	33%	0.332	C	S	.	.	T	Hydrogen-bonded Turn	trans	78.7	-4.8	-178.7	0	0	0	0	0	116.1	I569 Y571 N583	G566-I569 PolarHBondContact N-O 2.97Å; G566-Y571 VanDerWaalsContact CA-CE2 3.41Å; G566-N583 CarbonylContact C-O 3.59Å; G566-N583 WeakPolarHBondContact CA-O 3.1Å; G566-N583 CarbonylContact O-C 3.18Å; G566-N583 PolarHBondContact O-N 2.88Å; G566-N583 VanDerWaalsContact O-O 3.08Å
567	I	71.9	Confident	65.7	Low	26 Å²	26	56.8 Å²	56.8	13%	0.133	33%	0.333	C	S	.	.	T	Hydrogen-bonded Turn	trans	-122.4	-56.3	-179.3	-60.4	167.5	0	0	0	110.9	L564 G565 L584 M747 L748	L564-I567 HydrophobicContact CB-CB 4.06Å; L564-I567 HydrophobicContact CB-CD1 4.4Å; L564-I567 HydrophobicContact CD2-CD1 3.84Å; L564-I567 PolarHBondContact O-N 3.45Å; G565-I567 VanDerWaalsContact C-N 3.25Å; G565-I567 PolarHBondContact O-N 3.09Å; I567-L584 HydrophobicContact CD1-CD2 4.08Å; I567-L584 HydrophobicContact CG1-CD2 4.06Å; I567-M747 HydrophobicContact CG2-CE 3.72Å; I567-L748 HydrophobicContact CD1-CD1 4.31Å
568	N	69.6	Low	63.4	Low	62 Å²	62	61.3 Å²	61.3	33%	0.332	36%	0.361	S	S	.	.	T	Hydrogen-bonded Turn	trans	-103.3	-31.7	179.6	-67.5	-10.5	0	0	0	112	I562 L564 M747	I562-N568 PolarHBondContact O-ND2 3Å; L564-N568 PolarHBondContact O-N 2.74Å; N568-M747 WeakPolarHBondContact OD1-CE 3.35Å
569	I	70.3	Confident	61.7	Low	57 Å²	57	66.7 Å²	66.7	29%	0.292	38%	0.384	S	S	.	.	B	Isolated β-bridge	trans	-121.5	127.5	174.5	-59.7	-170.9	0	0	0	108.8	N563 L564 G565 G566 I608	N563-I569 HydrophobicContact CB-CD1 3.69Å; N563-I569 HydrophobicContact CB-CG1 4.3Å; L564-I569 PolarHBondContact O-N 3.48Å; G565-I569 CarbonylContact C-O 3.59Å; G566-I569 PolarHBondContact N-O 2.97Å; I569-I608 HydrophobicContact CD1-CD1 4.08Å; I569-I608 HydrophobicContact CD1-CG1 4.31Å; I569-I608 HydrophobicContact CG2-CD1 4.41Å
570	P	64.8	Low	59.6	Low	40 Å²	40	73 Å²	73	26%	0.26	42%	0.423	S	S	.	.			trans	-71.4	142.8	175.6	30.8	-34.9	0	0	0	111.2	T572 L577 M579	P570-T572 PolarHBondContact O-N 3.04Å; P570-T572 VanDerWaalsContact O-N 3.1Å; P570-L577 HydrophobicContact CG-CD2 4.18Å; P570-M579 HydrophobicContact CB-CE 3.87Å; P570-M579 HydrophobicContact CB-CG 4.42Å
571	Y	64	Low	58	Low	32 Å²	32	72.2 Å²	72.2	13%	0.125	42%	0.419	C	S	.	.	S	Bend	trans	-61.4	-16.8	175.6	-72.3	-84.3	0	0	0	114.2	G566 L584 Y610 L615 C636	G566-Y571 VanDerWaalsContact CA-CE2 3.41Å; Y571-L584 WeakPolarHBondContact CE2-O 3.26Å; Y571-L584 PolarHBondContact OH-O 3.44Å; Y571-Y610 HydrophobicContact CD1-CE1 4.2Å; Y571-Y610 AromaticContact CE1-CD1 3.71Å; Y571-Y610 HydrophobicContact CE1-CD1 3.71Å; Y571-Y610 AromaticContact CE1-CE1 3.58Å; Y571-Y610 HydrophobicContact CE1-CE1 3.58Å; Y571-L615 PolarHBondContact OH-O 2.86Å; Y571-C636 HydrophobicContact CD1-CB 3.85Å; Y571-C636 HydrophobicContact CE1-CB 3.81Å
572	T	55.5	Low	57.5	Low	63 Å²	63	76.2 Å²	76.2	39%	0.387	43%	0.428	S	S	.	.	S	Bend	trans	-119.7	124.1	-174.3	56	0	0	0	0	111.6	P570 G574	P570-T572 PolarHBondContact O-N 3.04Å; P570-T572 VanDerWaalsContact O-N 3.1Å; T572-G574 PolarHBondContact O-N 2.92Å
573	T	51	Low	57.2	Low	128 Å²	128	79.7 Å²	79.7	79%	0.785	45%	0.446	S	S	*	.			trans	-77.3	56.1	174.9	42.8	0	0	0	0	112.6
574	G	47.1	Very low	57	Low	31 Å²	31	77.5 Å²	77.5	32%	0.32	43%	0.434	S	S	.	.			trans	-88	154.8	174.6	0	0	0	0	0	113.1	T572 T576	T572-G574 PolarHBondContact O-N 2.92Å; G574-T576 PolarHBondContact O-N 2.99Å
575	P	39	Very low	56.8	Low	134 Å²	134	80.1 Å²	80.1	87%	0.87	45%	0.451	S	S	*	.	S	Bend	trans	-73.3	-6.2	-175.1	29.6	-35.9	0	0	0	115.1	L577	P575-L577 PolarHBondContact O-N 3.46Å
576	T	39.5	Very low	56.9	Low	119 Å²	119	80.5 Å²	80.5	73%	0.73	46%	0.455	S	S	*	.			trans	-96.9	71.2	-177.4	49.1	0	0	0	0	111.9	G574 T578	G574-T576 PolarHBondContact O-N 2.99Å; T576-T578 VanDerWaalsContact C-N 3.32Å; T576-T578 PolarHBondContact O-N 3.35Å
577	L	45.6	Very low	57.2	Low	140 Å²	140	84.7 Å²	84.7	73%	0.733	48%	0.483	S	S	*	.			trans	-77.9	67.8	-177.6	-74.3	173.3	0	0	0	114.1	P570 P575	P570-L577 HydrophobicContact CG-CD2 4.18Å; P575-L577 PolarHBondContact O-N 3.46Å
578	T	35.4	Very low	57.6	Low	115 Å²	115	85.2 Å²	85.2	71%	0.706	49%	0.488	S	S	*	.			trans	-142.4	100.1	158.6	41.4	0	0	0	0	111	T576 T580	T576-T578 VanDerWaalsContact C-N 3.32Å; T576-T578 PolarHBondContact O-N 3.35Å; T578-T580 PolarHBondContact O-N 3.01Å
579	M	43.1	Very low	58.2	Low	127 Å²	127	82.3 Å²	82.3	63%	0.626	47%	0.473	S	S	*	.			trans	-83.7	94.2	170.7	-76.5	-65.8	168.9	0	0	110.2	P570 H581	P570-M579 HydrophobicContact CB-CE 3.87Å; P570-M579 HydrophobicContact CB-CG 4.42Å; M579-H581 VanDerWaalsContact C-N 3.25Å
580	T	38.2	Very low	58.7	Low	140 Å²	140	83.8 Å²	83.8	86%	0.859	48%	0.484	S	S	*	.	S	Bend	trans	-77.2	-11.4	172.7	51.6	0	0	0	0	113.2	T578	T578-T580 PolarHBondContact O-N 3.01Å
581	H	44.7	Very low	59.5	Low	151 Å²	151	87.2 Å²	87.2	70%	0.699	50%	0.5	S	S	*	.	S	Bend	trans	-133.2	133.4	177	-150.1	-81.3	0	0	0	109.4	M579 N583	M579-H581 VanDerWaalsContact C-N 3.25Å; H581-N583 PolarHBondContact O-N 3.2Å
582	R	61.3	Low	60.3	Low	125 Å²	125	86.2 Å²	86.2	47%	0.472	50%	0.498	S	S	.	.			trans	-64.7	131.9	170.7	-64.7	176.3	-177.8	160.4	-1.3	107.8	C746 M747	R582-C746 PolarHBondContact NH2-O 3.41Å; R582-M747 PolarHBondContact NH1-O 2.9Å; R582-M747 PolarHBondContact NH2-SD 3.27Å
583	N	66.7	Low	61.3	Low	85 Å²	85	86.1 Å²	86.1	46%	0.455	51%	0.509	S	S	.	.			trans	-142	110.8	178.6	-169.3	9.9	0	0	0	111	G566 H581 T585	G566-N583 CarbonylContact C-O 3.59Å; G566-N583 WeakPolarHBondContact CA-O 3.1Å; G566-N583 CarbonylContact O-C 3.18Å; G566-N583 PolarHBondContact O-N 2.88Å; G566-N583 VanDerWaalsContact O-O 3.08Å; H581-N583 PolarHBondContact O-N 3.2Å; N583-T585 VanDerWaalsContact C-N 3.32Å; N583-T585 PolarHBondContact ND2-O 2.89Å; N583-T585 PolarHBondContact OD1-N 3.49Å; N583-T585 PolarHBondContact OD1-OG1 3.26Å; N583-T585 VanDerWaalsContact OD1-OG1 3.07Å
584	L	72.9	Confident	62.6	Low	31 Å²	31	81.2 Å²	81.2	16%	0.162	48%	0.48	C	S	.	.			trans	-78.7	-15	-179.4	-69.8	168.3	0	0	0	112.9	I567 Y571 N589 F611 L615	I567-L584 HydrophobicContact CD1-CD2 4.08Å; I567-L584 HydrophobicContact CG1-CD2 4.06Å; Y571-L584 WeakPolarHBondContact CE2-O 3.26Å; Y571-L584 PolarHBondContact OH-O 3.44Å; L584-N589 PolarHBondContact O-ND2 2.88Å; L584-N589 VanDerWaalsContact O-ND2 3.09Å; L584-F611 HydrophobicContact CD1-CD2 4.06Å; L584-F611 HydrophobicContact CD1-CE2 4.1Å; L584-F611 HydrophobicContact CD2-CB 4.18Å; L584-F611 HydrophobicContact CD2-CD2 4.02Å; L584-F611 HydrophobicContact CD2-CG 4.32Å; L584-L615 HydrophobicContact CB-CD1 4.27Å; L584-L615 HydrophobicContact CB-CD2 4.49Å
585	T	72.1	Confident	63.7	Low	63 Å²	63	87.4 Å²	87.4	39%	0.387	49%	0.493	S	S	.	.			trans	-96.8	142.1	175.2	24.5	0	0	0	0	113	N583 N589	N583-T585 VanDerWaalsContact C-N 3.32Å; N583-T585 PolarHBondContact ND2-O 2.89Å; N583-T585 PolarHBondContact OD1-N 3.49Å; N583-T585 PolarHBondContact OD1-OG1 3.26Å; N583-T585 VanDerWaalsContact OD1-OG1 3.07Å; T585-N589 VanDerWaalsContact CA-OD1 3.24Å; T585-N589 WeakPolarHBondContact CA-OD1 3.27Å
586	G	74.1	Confident	65.1	Low	12 Å²	12	85.3 Å²	85.3	12%	0.124	47%	0.474	C	S	.	.			trans	-146.3	178.2	173.4	0	0	0	0	0	110.7	C588 N589 V590	G586-C588 PolarHBondContact O-N 3.33Å; G586-N589 PolarHBondContact N-OD1 3.11Å; G586-N589 PolarHBondContact O-N 3.39Å; G586-N589 VanDerWaalsContact O-N 3.07Å; G586-N589 PolarHBondContact O-OD1 3.37Å; G586-N589 VanDerWaalsContact O-OD1 3.1Å; G586-V590 WeakPolarHBondContact O-CB 3.45Å; G586-V590 PolarHBondContact O-N 2.61Å
587	S	75.3	Confident	66.3	Low	98 Å²	98	85.2 Å²	85.2	69%	0.685	47%	0.465	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.8	-21.1	-175	52.7	0	0	0	0	114.8
588	C	79.1	Confident	67.4	Low	36 Å²	36	81.4 Å²	81.4	24%	0.243	44%	0.444	C	S	.	.	T	Hydrogen-bonded Turn	trans	-87.1	-16.1	179.7	57.1	0	0	0	0	114.9	G586 G635 C636	G586-C588 PolarHBondContact O-N 3.33Å; C588-G635 VanDerWaalsContact CB-O 3.29Å; C588-G635 WeakPolarHBondContact CB-O 3.24Å; C588-C636 VanDerWaalsContact C-SG 3.58Å; C588-C636 HydrophobicContact CB-CB 3.93Å; C588-C636 WeakPolarHBondContact CB-SG 3.47Å; C588-C636 WeakPolarHBondContact SG-CA 3.41Å; C588-C636 WeakPolarHBondContact SG-CB 3.43Å; C588-C636 CovalentContact SG-SG 2.03Å; C588-C636 PolarHBondContact SG-SG 2.82Å
589	N	82.9	Confident	69.3	Low	2 Å²	2	76.9 Å²	76.9	1%	0.011	41%	0.414	C	S	.	.	T	Hydrogen-bonded Turn	trans	-130.9	-4.1	-178.1	66.7	13.7	0	0	0	114.8	L584 T585 G586 N591 C592 L615	L584-N589 PolarHBondContact O-ND2 2.88Å; L584-N589 VanDerWaalsContact O-ND2 3.09Å; T585-N589 VanDerWaalsContact CA-OD1 3.24Å; T585-N589 WeakPolarHBondContact CA-OD1 3.27Å; G586-N589 PolarHBondContact N-OD1 3.11Å; G586-N589 PolarHBondContact O-N 3.39Å; G586-N589 VanDerWaalsContact O-N 3.07Å; G586-N589 PolarHBondContact O-OD1 3.37Å; G586-N589 VanDerWaalsContact O-OD1 3.1Å; N589-N591 VanDerWaalsContact C-N 3.26Å; N589-N591 PolarHBondContact O-N 3.07Å; N589-C592 VanDerWaalsContact CA-SG 3.54Å; N589-C592 VanDerWaalsContact O-CB 3.26Å; N589-C592 WeakPolarHBondContact O-CB 3.35Å; N589-C592 PolarHBondContact O-N 2.93Å; N589-C592 VanDerWaalsContact O-N 3.09Å; N589-C592 PolarHBondContact O-SG 3.38Å; N589-C592 VanDerWaalsContact O-SG 3.41Å; N589-L615 PolarHBondContact ND2-O 3.44Å
590	V	81.1	Confident	71.1	Confident	87 Å²	87	72.1 Å²	72.1	53%	0.527	39%	0.394	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.5	-30.6	-177.2	61.5	0	0	0	0	114.2	G586	G586-V590 WeakPolarHBondContact O-CB 3.45Å; G586-V590 PolarHBondContact O-N 2.61Å
591	N	81.8	Confident	73.3	Confident	113 Å²	113	65.7 Å²	65.7	60%	0.604	36%	0.355	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.1	0.2	179.9	-66.4	-7	0	0	0	113.9	N589	N589-N591 VanDerWaalsContact C-N 3.26Å; N589-N591 PolarHBondContact O-N 3.07Å
592	C	80.6	Confident	75.3	Confident	11 Å²	11	58.5 Å²	58.5	7%	0.074	32%	0.322	C	S	.	.	S	Bend	trans	-87.8	-6.1	-170.5	-59.5	0	0	0	0	115.3	C269 Q270 N589 C594	C269-C592 HydrophobicContact CB-CB 3.68Å; C269-C592 WeakPolarHBondContact CB-SG 3.21Å; C269-C592 WeakPolarHBondContact SG-CB 3.29Å; C269-C592 CovalentContact SG-SG 2.03Å; C269-C592 PolarHBondContact SG-SG 2.94Å; Q270-C592 WeakPolarHBondContact O-CA 3.35Å; N589-C592 VanDerWaalsContact CA-SG 3.54Å; N589-C592 VanDerWaalsContact O-CB 3.26Å; N589-C592 WeakPolarHBondContact O-CB 3.35Å; N589-C592 PolarHBondContact O-N 2.93Å; N589-C592 VanDerWaalsContact O-N 3.09Å; N589-C592 PolarHBondContact O-SG 3.38Å; N589-C592 VanDerWaalsContact O-SG 3.41Å; C592-C594 WeakPolarHBondContact CB-SG 3.38Å; C592-C594 PolarHBondContact O-N 3.31Å
593	G	75.9	Confident	76.6	Confident	60 Å²	60	54 Å²	54	62%	0.619	31%	0.309	S	S	*	.			trans	64.5	19.2	-178.1	0	0	0	0	0	115.8	R595	G593-R595 PolarHBondContact O-N 3.23Å
594	C	77.6	Confident	77.6	Confident	25 Å²	25	50.1 Å²	50.1	17%	0.169	29%	0.289	C	S	.	.			trans	-60	134.6	-165.8	-57.6	0	0	0	0	115.3	C592 I596 C614 L615	C592-C594 WeakPolarHBondContact CB-SG 3.38Å; C592-C594 PolarHBondContact O-N 3.31Å; C594-I596 PolarHBondContact O-N 3.37Å; C594-C614 WeakPolarHBondContact CA-SG 3.21Å; C594-C614 HydrophobicContact CB-CB 3.82Å; C594-C614 WeakPolarHBondContact CB-SG 3.39Å; C594-C614 WeakPolarHBondContact SG-CB 3.45Å; C594-C614 PolarHBondContact SG-O 2.81Å; C594-C614 CovalentContact SG-SG 2.04Å; C594-C614 PolarHBondContact SG-SG 3.12Å; C594-L615 HydrophobicContact CB-CD2 3.66Å; C594-L615 HydrophobicContact CB-CG 3.87Å
595	R	70.9	Confident	78.2	Confident	161 Å²	161	50.3 Å²	50.3	61%	0.608	29%	0.293	S	S	*	.			trans	-70.8	122.2	168.5	-65.3	180	178.9	169	0.3	110.3	G593 N612	G593-R595 PolarHBondContact O-N 3.23Å; R595-N612 PolarHBondContact O-ND2 3.1Å
596	I	68.7	Low	78.6	Confident	91 Å²	91	47.8 Å²	47.8	47%	0.467	28%	0.277	S	S	.	.	S	Bend	trans	-88.5	-4.5	-179.8	61.8	171.8	0	0	0	114.3	C594 F611	C594-I596 PolarHBondContact O-N 3.37Å; I596-F611 WeakPolarHBondContact O-CE1 3.3Å; I596-F611 WeakPolarHBondContact O-CZ 3.34Å
597	H	63.7	Low	79	Confident	117 Å²	117	49.1 Å²	49.1	54%	0.542	29%	0.291	S	S	.	.	S	Bend	trans	-94.3	-9	-179.2	-63.8	-78.9	0	0	0	113.6
598	E	68.5	Low	79.4	Confident	60 Å²	60	45.6 Å²	45.6	28%	0.28	26%	0.264	S	S	.	.			trans	-105.1	99.3	-174.4	-171.7	175.6	171.8	0	0	110.8	M259 F611 N612	M259-E598 WeakPolarHBondContact CE-OE1 3.4Å; E598-F611 VanDerWaalsContact O-CE1 3.25Å; E598-F611 WeakPolarHBondContact O-CE1 3.34Å; E598-N612 WeakPolarHBondContact O-CB 3.33Å; E598-N612 PolarHBondContact O-ND2 2.89Å
599	Y	77	Confident	79.8	Confident	19 Å²	19	44 Å²	44	8%	0.075	25%	0.253	C	S	.	.			trans	-87.5	108.5	-179.6	-178.7	-117	0	0	0	111.3	P374 P601 F611 K673 L748 W760	P374-Y599 HydrophobicContact CB-CE1 4.14Å; P374-Y599 HydrophobicContact CG-CE1 4.31Å; Y599-P601 HydrophobicContact CE1-CG 3.95Å; Y599-P601 HydrophobicContact CE2-CB 4.03Å; Y599-P601 HydrophobicContact CE2-CG 4.13Å; Y599-F611 HydrophobicContact CD2-CD1 4.39Å; Y599-F611 AromaticContact CD2-CD2 3.95Å; Y599-F611 HydrophobicContact CD2-CD2 3.95Å; Y599-F611 HydrophobicContact CD2-CE1 4.48Å; Y599-F611 HydrophobicContact CD2-CE2 4.05Å; Y599-F611 HydrophobicContact CD2-CG 4.13Å; Y599-F611 HydrophobicContact CD2-CZ 4.31Å; Y599-F611 HydrophobicContact CE2-CD2 4.48Å; Y599-K673 WeakPolarHBondContact OH-CE 3.31Å; Y599-L748 HydrophobicContact CD2-CD2 3.8Å; Y599-L748 HydrophobicContact CE2-CD2 3.7Å; Y599-L748 HydrophobicContact CG-CD2 4.46Å; Y599-W760 VanDerWaalsContact CB-CZ3 3.48Å; Y599-W760 HydrophobicContact CD1-CB 4.05Å; Y599-W760 AromaticContact CD1-CD2 3.9Å; Y599-W760 HydrophobicContact CD1-CD2 3.9Å; Y599-W760 HydrophobicContact CD1-CE3 4.1Å; Y599-W760 AromaticContact CD1-CG 3.92Å; Y599-W760 HydrophobicContact CD1-CG 3.92Å; Y599-W760 HydrophobicContact CD2-CE3 4.35Å; Y599-W760 HydrophobicContact CE1-CB 3.92Å; Y599-W760 HydrophobicContact CE1-CG 4.28Å; Y599-W760 HydrophobicContact CG-CD2 4.05Å; Y599-W760 AromaticContact CG-CE3 3.76Å; Y599-W760 HydrophobicContact CG-CE3 3.76Å; Y599-W760 HydrophobicContact CG-CG 4.5Å; Y599-W760 HydrophobicContact CG-CZ3 4.21Å
600	A	79.2	Confident	79.9	Confident	27 Å²	27	44.2 Å²	44.2	22%	0.223	25%	0.254	C	S	.	.			trans	-139.8	69.2	-177.5	0	0	0	0	0	108.7	F611 N612	A600-F611 CarbonylContact C-O 3.58Å; A600-F611 PolarHBondContact N-O 3.23Å; A600-F611 VanDerWaalsContact N-O 3.09Å; A600-N612 HydrophobicContact CB-CB 4.26Å; A600-N612 WeakPolarHBondContact O-CA 3.34Å
601	P	85.2	Confident	80	Confident	5 Å²	5	40.3 Å²	40.3	3%	0.032	23%	0.23	C	C	.	.			trans	-62.2	144.3	-162.7	23.7	-34.5	0	0	0	113	P374 Y599 T609 Y610 G672 K673	P374-P601 HydrophobicContact CG-CG 3.8Å; Y599-P601 HydrophobicContact CE1-CG 3.95Å; Y599-P601 HydrophobicContact CE2-CB 4.03Å; Y599-P601 HydrophobicContact CE2-CG 4.13Å; P601-T609 HydrophobicContact CB-CG2 3.9Å; P601-Y610 VanDerWaalsContact CA-O 3.25Å; P601-Y610 WeakPolarHBondContact CA-O 3.49Å; P601-G672 CarbonylContact C-O 3.55Å; P601-G672 CarbonylContact O-C 3.56Å; P601-G672 WeakPolarHBondContact O-CA 3.32Å; P601-G672 PolarHBondContact O-N 3.45Å; P601-G672 VanDerWaalsContact O-O 3.11Å; P601-K673 HydrophobicContact CB-CG 4.19Å; P601-K673 HydrophobicContact CG-CG 3.95Å
602	V	86.2	Confident	80.1	Confident	1 Å²	1	35.3 Å²	35.3	1%	0.006	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	142.4	176.4	-58.4	0	0	0	0	110.4	T609 Y610 P613 A616 Y631 A669 L670 G672	V602-T609 CarbonylContact O-C 3.6Å; V602-T609 WeakPolarHBondContact O-CA 3.36Å; V602-Y610 PolarHBondContact N-O 3.3Å; V602-Y610 VanDerWaalsContact N-O 3.12Å; V602-Y610 PolarHBondContact O-N 3.34Å; V602-P613 HydrophobicContact CG1-CB 4.23Å; V602-P613 HydrophobicContact CG1-CG 4.38Å; V602-A616 HydrophobicContact CG2-CB 3.87Å; V602-Y631 HydrophobicContact CG1-CD2 3.74Å; V602-Y631 HydrophobicContact CG1-CE2 3.64Å; V602-A669 HydrophobicContact CB-CB 3.95Å; V602-A669 HydrophobicContact CG2-CB 3.79Å; V602-L670 CarbonylContact C-O 3.5Å; V602-L670 VanDerWaalsContact CA-O 3.26Å; V602-L670 WeakPolarHBondContact CA-O 3.39Å; V602-L670 WeakPolarHBondContact CB-O 3.28Å; V602-G672 CarbonylContact C-O 3.5Å; V602-G672 WeakPolarHBondContact CA-O 3.2Å; V602-G672 PolarHBondContact N-O 3.04Å
603	C	88.1	Confident	80.4	Confident	30 Å²	30	35.2 Å²	35.2	20%	0.203	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.1	113.3	176.3	-177.6	0	0	0	0	110.1	A669 L670 G672 C674	C603-A669 CarbonylContact O-C 3.47Å; C603-A669 WeakPolarHBondContact O-CA 3.3Å; C603-L670 PolarHBondContact N-O 3.45Å; C603-L670 PolarHBondContact O-N 3.19Å; C603-G672 PolarHBondContact N-O 3.13Å; C603-C674 WeakPolarHBondContact CA-SG 3.06Å; C603-C674 HydrophobicContact CB-CB 3.95Å; C603-C674 WeakPolarHBondContact CB-SG 3.27Å; C603-C674 WeakPolarHBondContact SG-CA 3.46Å; C603-C674 WeakPolarHBondContact SG-CB 3.23Å; C603-C674 CovalentContact SG-SG 2.04Å; C603-C674 PolarHBondContact SG-SG 3.42Å
604	G	87.9	Confident	80.9	Confident	3 Å²	3	32.7 Å²	32.7	3%	0.031	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.7	156.3	175.5	0	0	0	0	0	112.9	D606 G607 I608	G604-D606 PolarHBondContact O-N 3.29Å; G604-D606 VanDerWaalsContact O-N 3.09Å; G604-G607 PolarHBondContact O-N 2.94Å; G604-I608 PolarHBondContact N-O 2.78Å
605	S	85.5	Confident	81.3	Confident	35 Å²	35	31.5 Å²	31.5	25%	0.245	17%	0.167	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.9	-5.1	177.1	64.4	0	0	0	0	115.2	Y668	S605-Y668 PolarHBondContact N-O 3.39Å
606	D	81	Confident	82	Confident	11 Å²	11	23.8 Å²	23.8	6%	0.059	14%	0.138	C	C	.	.	T	Hydrogen-bonded Turn	trans	-84.1	-13.4	167.1	42.9	30.3	0	0	0	114	G604 I608 Y610 V637 Q638 R640	G604-D606 PolarHBondContact O-N 3.29Å; G604-D606 VanDerWaalsContact O-N 3.09Å; D606-I608 HydrophobicContact CB-CG1 4.49Å; D606-I608 WeakPolarHBondContact OD1-CB 3.28Å; D606-I608 PolarHBondContact OD1-N 3.45Å; D606-Y610 PolarHBondContact OD2-OH 3.32Å; D606-V637 WeakPolarHBondContact OD2-CA 3.03Å; D606-Q638 HydrophobicContact CB-CB 4.38Å; D606-Q638 PolarHBondContact OD2-N 3.4Å; D606-R640 PolarHBondContact O-NH1 3.16Å; D606-R640 VanDerWaalsContact O-NH1 3.12Å
607	G	81.8	Confident	82.8	Confident	39 Å²	39	19.6 Å²	19.6	40%	0.402	12%	0.117	S	C	.	.	S	Bend	trans	86.5	16.9	-172.5	0	0	0	0	0	114.1	G604 C674	G604-G607 PolarHBondContact O-N 2.94Å; G607-C674 VanDerWaalsContact C-SG 3.56Å
608	I	84.8	Confident	84	Confident	24 Å²	24	14 Å²	14	12%	0.123	9%	0.091	C	C	.	.	P	Polyproline II helix	trans	-98.2	137.1	175.4	-60.6	175.4	0	0	0	109.2	N563 I569 G604 D606 Y610 C674	N563-I608 HydrophobicContact CB-CG1 4.4Å; N563-I608 WeakPolarHBondContact O-CG2 3.1Å; I569-I608 HydrophobicContact CD1-CD1 4.08Å; I569-I608 HydrophobicContact CD1-CG1 4.31Å; I569-I608 HydrophobicContact CG2-CD1 4.41Å; G604-I608 PolarHBondContact N-O 2.78Å; D606-I608 HydrophobicContact CB-CG1 4.49Å; D606-I608 WeakPolarHBondContact OD1-CB 3.28Å; D606-I608 PolarHBondContact OD1-N 3.45Å; I608-Y610 HydrophobicContact CB-CD2 4.46Å; I608-Y610 HydrophobicContact CB-CE2 3.68Å; I608-Y610 HydrophobicContact CG2-CD2 4.24Å; I608-Y610 HydrophobicContact CG2-CE1 4.45Å; I608-Y610 HydrophobicContact CG2-CE2 3.7Å; I608-Y610 WeakPolarHBondContact O-CD2 3.35Å; I608-Y610 WeakPolarHBondContact O-CE2 3.34Å; I608-C674 VanDerWaalsContact C-SG 3.57Å; I608-C674 PolarHBondContact O-SG 3.18Å
609	T	86.8	Confident	84.8	Confident	2 Å²	2	13.7 Å²	13.7	1%	0.012	10%	0.095	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.8	125.1	172.2	-57.8	0	0	0	0	109.6	N563 L564 G565 P601 V602 K673 C674	N563-T609 PolarHBondContact O-N 3.12Å; L564-T609 VanDerWaalsContact CA-O 3.31Å; L564-T609 WeakPolarHBondContact CA-O 3.31Å; G565-T609 PolarHBondContact N-O 3.25Å; G565-T609 VanDerWaalsContact N-O 3.16Å; P601-T609 HydrophobicContact CB-CG2 3.9Å; V602-T609 CarbonylContact O-C 3.6Å; V602-T609 WeakPolarHBondContact O-CA 3.36Å; T609-K673 HydrophobicContact CG2-CB 4.38Å; T609-K673 HydrophobicContact CG2-CG 4.44Å; T609-C674 WeakPolarHBondContact OG1-CB 3.46Å; T609-C674 PolarHBondContact OG1-N 3.41Å; T609-C674 VanDerWaalsContact OG1-N 3.08Å; T609-C674 PolarHBondContact OG1-SG 3.16Å
610	Y	85.9	Confident	85.1	Confident	8 Å²	8	15.1 Å²	15.1	3%	0.031	11%	0.106	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	153	177.1	-65.3	-97.5	0	0	0	110	Y571 P601 V602 D606 I608 A616 C636 V637	Y571-Y610 HydrophobicContact CD1-CE1 4.2Å; Y571-Y610 AromaticContact CE1-CD1 3.71Å; Y571-Y610 HydrophobicContact CE1-CD1 3.71Å; Y571-Y610 AromaticContact CE1-CE1 3.58Å; Y571-Y610 HydrophobicContact CE1-CE1 3.58Å; P601-Y610 VanDerWaalsContact CA-O 3.25Å; P601-Y610 WeakPolarHBondContact CA-O 3.49Å; V602-Y610 PolarHBondContact N-O 3.3Å; V602-Y610 VanDerWaalsContact N-O 3.12Å; V602-Y610 PolarHBondContact O-N 3.34Å; D606-Y610 PolarHBondContact OD2-OH 3.32Å; I608-Y610 HydrophobicContact CB-CD2 4.46Å; I608-Y610 HydrophobicContact CB-CE2 3.68Å; I608-Y610 HydrophobicContact CG2-CD2 4.24Å; I608-Y610 HydrophobicContact CG2-CE1 4.45Å; I608-Y610 HydrophobicContact CG2-CE2 3.7Å; I608-Y610 WeakPolarHBondContact O-CD2 3.35Å; I608-Y610 WeakPolarHBondContact O-CE2 3.34Å; Y610-A616 HydrophobicContact CD1-CB 4.1Å; Y610-A616 HydrophobicContact CD2-CB 4.36Å; Y610-A616 HydrophobicContact CG-CB 3.79Å; Y610-C636 HydrophobicContact CD1-CB 4.45Å; Y610-C636 HydrophobicContact CE1-CB 3.89Å; Y610-C636 PolarHBondContact OH-O 3.4Å; Y610-V637 HydrophobicContact CD2-CG2 4.19Å; Y610-V637 HydrophobicContact CE2-CG2 3.79Å
611	F	82.3	Confident	85.3	Confident	4 Å²	4	16.3 Å²	16.3	2%	0.018	11%	0.111	C	C	.	.	S	Bend	trans	-66.2	-42.5	-170.1	-177.4	-78.5	0	0	0	113.4	L584 I596 E598 Y599 A600 L615 L748 W760	L584-F611 HydrophobicContact CD1-CD2 4.06Å; L584-F611 HydrophobicContact CD1-CE2 4.1Å; L584-F611 HydrophobicContact CD2-CB 4.18Å; L584-F611 HydrophobicContact CD2-CD2 4.02Å; L584-F611 HydrophobicContact CD2-CG 4.32Å; I596-F611 WeakPolarHBondContact O-CE1 3.3Å; I596-F611 WeakPolarHBondContact O-CZ 3.34Å; E598-F611 VanDerWaalsContact O-CE1 3.25Å; E598-F611 WeakPolarHBondContact O-CE1 3.34Å; Y599-F611 HydrophobicContact CD2-CD1 4.39Å; Y599-F611 AromaticContact CD2-CD2 3.95Å; Y599-F611 HydrophobicContact CD2-CD2 3.95Å; Y599-F611 HydrophobicContact CD2-CE1 4.48Å; Y599-F611 HydrophobicContact CD2-CE2 4.05Å; Y599-F611 HydrophobicContact CD2-CG 4.13Å; Y599-F611 HydrophobicContact CD2-CZ 4.31Å; Y599-F611 HydrophobicContact CE2-CD2 4.48Å; A600-F611 CarbonylContact C-O 3.58Å; A600-F611 PolarHBondContact N-O 3.23Å; A600-F611 VanDerWaalsContact N-O 3.09Å; F611-L615 HydrophobicContact CB-CD1 3.89Å; F611-L615 HydrophobicContact CD1-CD1 3.66Å; F611-L615 HydrophobicContact CE1-CD1 4.42Å; F611-L615 HydrophobicContact CG-CD1 3.97Å; F611-L748 HydrophobicContact CD2-CD1 4.33Å; F611-L748 HydrophobicContact CD2-CD2 3.87Å; F611-L748 HydrophobicContact CE2-CD1 3.7Å; F611-L748 HydrophobicContact CE2-CD2 3.64Å; F611-L748 HydrophobicContact CE2-CG 4.24Å; F611-W760 HydrophobicContact CE2-CZ3 4.42Å; F611-W760 HydrophobicContact CZ-CZ3 4.05Å
612	N	84.1	Confident	84.9	Confident	9 Å²	9	17.6 Å²	17.6	5%	0.048	13%	0.125	C	C	.	.	S	Bend	trans	-156.1	163.5	172.3	65.8	29.3	0	0	0	109.4	R595 E598 A600 C614 L615 A616	R595-N612 PolarHBondContact O-ND2 3.1Å; E598-N612 WeakPolarHBondContact O-CB 3.33Å; E598-N612 PolarHBondContact O-ND2 2.89Å; A600-N612 HydrophobicContact CB-CB 4.26Å; A600-N612 WeakPolarHBondContact O-CA 3.34Å; N612-C614 VanDerWaalsContact C-N 3.31Å; N612-C614 PolarHBondContact O-N 3.2Å; N612-L615 PolarHBondContact O-N 3.32Å; N612-L615 VanDerWaalsContact O-N 3.1Å; N612-L615 WeakPolarHBondContact OD1-CB 3.36Å; N612-L615 VanDerWaalsContact OD1-CG 3.32Å; N612-L615 WeakPolarHBondContact OD1-CG 3.48Å; N612-L615 PolarHBondContact OD1-N 2.92Å; N612-A616 PolarHBondContact O-N 2.91Å
613	P	86.6	Confident	84	Confident	9 Å²	9	23.8 Å²	23.8	6%	0.058	16%	0.158	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.1	-32.4	-174.4	18.2	-28.7	0	0	0	114	L268 V602 A616 G617 C618 Y631	L268-P613 HydrophobicContact CD2-CB 4.18Å; L268-P613 HydrophobicContact CD2-CG 4.49Å; V602-P613 HydrophobicContact CG1-CB 4.23Å; V602-P613 HydrophobicContact CG1-CG 4.38Å; P613-A616 WeakPolarHBondContact O-CB 3.47Å; P613-A616 PolarHBondContact O-N 3.11Å; P613-G617 PolarHBondContact O-N 3.03Å; P613-C618 HydrophobicContact CB-CB 4.27Å; P613-C618 WeakPolarHBondContact O-CB 3.39Å; P613-C618 PolarHBondContact O-N 3.12Å; P613-Y631 HydrophobicContact CB-CD1 3.78Å; P613-Y631 HydrophobicContact CB-CD2 4.23Å; P613-Y631 HydrophobicContact CB-CE1 3.92Å; P613-Y631 HydrophobicContact CB-CE2 4.35Å; P613-Y631 HydrophobicContact CB-CG 3.95Å; P613-Y631 HydrophobicContact CG-CD1 4.26Å; P613-Y631 HydrophobicContact CG-CE1 3.87Å; P613-Y631 HydrophobicContact CG-CE2 4.35Å
614	C	86.7	Confident	82.8	Confident	6 Å²	6	25.2 Å²	25.2	4%	0.041	16%	0.164	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.3	-47.1	171.2	-171.4	0	0	0	0	112.2	G267 C594 N612 A616 G617	G267-C614 VanDerWaalsContact O-CB 3.31Å; G267-C614 WeakPolarHBondContact O-CB 3.39Å; G267-C614 PolarHBondContact O-N 3.47Å; G267-C614 VanDerWaalsContact O-N 3.08Å; C594-C614 WeakPolarHBondContact CA-SG 3.21Å; C594-C614 HydrophobicContact CB-CB 3.82Å; C594-C614 WeakPolarHBondContact CB-SG 3.39Å; C594-C614 WeakPolarHBondContact SG-CB 3.45Å; C594-C614 PolarHBondContact SG-O 2.81Å; C594-C614 CovalentContact SG-SG 2.04Å; C594-C614 PolarHBondContact SG-SG 3.12Å; N612-C614 VanDerWaalsContact C-N 3.31Å; N612-C614 PolarHBondContact O-N 3.2Å; C614-A616 VanDerWaalsContact C-N 3.27Å; C614-A616 PolarHBondContact O-N 3.34Å; C614-G617 WeakPolarHBondContact O-CA 3.18Å; C614-G617 PolarHBondContact O-N 3.45Å
615	L	85.5	Confident	81.1	Confident	0 Å²	0	31.5 Å²	31.5	0%	0	21%	0.207	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72.7	-18.5	178.6	-69.6	169.7	0	0	0	113.1	Y571 L584 N589 C594 F611 N612 G617 C636	Y571-L615 PolarHBondContact OH-O 2.86Å; L584-L615 HydrophobicContact CB-CD1 4.27Å; L584-L615 HydrophobicContact CB-CD2 4.49Å; N589-L615 PolarHBondContact ND2-O 3.44Å; C594-L615 HydrophobicContact CB-CD2 3.66Å; C594-L615 HydrophobicContact CB-CG 3.87Å; F611-L615 HydrophobicContact CB-CD1 3.89Å; F611-L615 HydrophobicContact CD1-CD1 3.66Å; F611-L615 HydrophobicContact CE1-CD1 4.42Å; F611-L615 HydrophobicContact CG-CD1 3.97Å; N612-L615 PolarHBondContact O-N 3.32Å; N612-L615 VanDerWaalsContact O-N 3.1Å; N612-L615 WeakPolarHBondContact OD1-CB 3.36Å; N612-L615 VanDerWaalsContact OD1-CG 3.32Å; N612-L615 WeakPolarHBondContact OD1-CG 3.48Å; N612-L615 PolarHBondContact OD1-N 2.92Å; L615-G617 PolarHBondContact O-N 3.35Å; L615-C636 PolarHBondContact O-SG 2.98Å
616	A	86.3	Confident	79.7	Confident	0 Å²	0	34.9 Å²	34.9	0%	0	23%	0.226	C	C	.	.	T	Hydrogen-bonded Turn	trans	-75.9	-5.7	164	0	0	0	0	0	113.2	V602 Y610 N612 P613 C614 C618 C634 C636 V637	V602-A616 HydrophobicContact CG2-CB 3.87Å; Y610-A616 HydrophobicContact CD1-CB 4.1Å; Y610-A616 HydrophobicContact CD2-CB 4.36Å; Y610-A616 HydrophobicContact CG-CB 3.79Å; N612-A616 PolarHBondContact O-N 2.91Å; P613-A616 WeakPolarHBondContact O-CB 3.47Å; P613-A616 PolarHBondContact O-N 3.11Å; C614-A616 VanDerWaalsContact C-N 3.27Å; C614-A616 PolarHBondContact O-N 3.34Å; A616-C618 VanDerWaalsContact C-N 3.31Å; A616-C634 CarbonylContact O-C 3.49Å; A616-C636 VanDerWaalsContact O-CB 3.32Å; A616-C636 WeakPolarHBondContact O-CB 3.41Å; A616-C636 PolarHBondContact O-N 2.78Å; A616-V637 HydrophobicContact CB-CG2 4.3Å
617	G	86.3	Confident	78.7	Confident	3 Å²	3	37.6 Å²	37.6	3%	0.031	26%	0.256	C	S	.	.	T	Hydrogen-bonded Turn	trans	73.4	17.8	-177.6	0	0	0	0	0	114	P613 C614 L615 G635	P613-G617 PolarHBondContact O-N 3.03Å; C614-G617 WeakPolarHBondContact O-CA 3.18Å; C614-G617 PolarHBondContact O-N 3.45Å; L615-G617 PolarHBondContact O-N 3.35Å; G617-G635 PolarHBondContact O-N 3.04Å
618	C	87.9	Confident	78	Confident	0 Å²	0	38.1 Å²	38.1	0%	0	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.3	127.1	-176.1	-55.7	0	0	0	0	111.7	C269 P613 A616 C634	C269-C618 PolarHBondContact N-O 3.26Å; P613-C618 HydrophobicContact CB-CB 4.27Å; P613-C618 WeakPolarHBondContact O-CB 3.39Å; P613-C618 PolarHBondContact O-N 3.12Å; A616-C618 VanDerWaalsContact C-N 3.31Å; C618-C634 HydrophobicContact CB-CB 4.05Å; C618-C634 WeakPolarHBondContact CB-SG 3.34Å; C618-C634 WeakPolarHBondContact SG-CB 3.43Å; C618-C634 CovalentContact SG-SG 2.04Å; C618-C634 PolarHBondContact SG-SG 3.32Å
619	S	86.4	Confident	77.6	Confident	52 Å²	52	41.3 Å²	41.3	36%	0.364	26%	0.263	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.8	-20.4	-175.5	-50	0	0	0	0	113.3	T632 D633	S619-T632 PolarHBondContact N-O 2.65Å; S619-D633 PolarHBondContact N-O 2.78Å; S619-D633 PolarHBondContact OG-O 3.36Å
620	T	82.6	Confident	77.5	Confident	50 Å²	50	42.8 Å²	42.8	31%	0.307	27%	0.271	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134	156.5	-173.8	50.5	0	0	0	0	112	Y631 T632 D633	T620-Y631 WeakPolarHBondContact O-CA 3.24Å; T620-T632 PolarHBondContact N-O 2.73Å; T620-T632 PolarHBondContact O-N 3.49Å; T620-T632 VanDerWaalsContact OG1-C 3.28Å; T620-T632 WeakPolarHBondContact OG1-CB 3.44Å; T620-T632 PolarHBondContact OG1-O 3.22Å; T620-T632 PolarHBondContact OG1-OG1 2.64Å; T620-D633 WeakPolarHBondContact CG2-OD2 3.15Å; T620-D633 PolarHBondContact OG1-OD2 3.05Å
621	V	83.4	Confident	77.6	Confident	52 Å²	52	43.3 Å²	43.3	32%	0.315	27%	0.273	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.8	130.9	177.2	64.5	0	0	0	0	111.5	L268 R629 Y631	L268-V621 HydrophobicContact CD1-CB 4.36Å; L268-V621 HydrophobicContact CD1-CG1 4.13Å; V621-R629 HydrophobicContact CG2-CB 4.24Å; V621-Y631 HydrophobicContact CB-CD1 3.78Å; V621-Y631 HydrophobicContact CB-CE1 3.98Å; V621-Y631 HydrophobicContact CG2-CD1 3.61Å; V621-Y631 HydrophobicContact CG2-CE1 3.5Å; V621-Y631 HydrophobicContact CG2-CG 4.44Å
622	G	76.4	Confident	77.7	Confident	32 Å²	32	45.6 Å²	45.6	33%	0.33	29%	0.287	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113	161.2	166.6	0	0	0	0	0	111.4	N630	G622-N630 PolarHBondContact N-O 3.32Å; G622-N630 PolarHBondContact O-N 3.45Å
623	N	68.1	Low	77.8	Confident	131 Å²	131	48.6 Å²	48.6	70%	0.701	30%	0.303	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-104.7	119.9	169.8	-69.3	-30.9	0	0	0	108.6
624	D	61.7	Low	77.8	Confident	60 Å²	60	48.3 Å²	48.3	32%	0.321	30%	0.301	S	S	.	.			trans	-73.1	156.8	170.7	-73.2	-22.9	0	0	0	110.4	T626 G627 T628 N630	D624-T626 PolarHBondContact O-N 3.22Å; D624-G627 PolarHBondContact O-N 3.02Å; D624-T628 PolarHBondContact N-O 3.37Å; D624-N630 PolarHBondContact OD1-ND2 2.87Å; D624-N630 PolarHBondContact OD2-ND2 3.3Å
625	S	52.4	Low	77.7	Confident	135 Å²	135	50.5 Å²	50.5	94%	0.944	33%	0.325	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.7	-9.1	-179.8	54.8	0	0	0	0	114.7
626	T	55.9	Low	77.6	Confident	106 Å²	106	51 Å²	51	65%	0.65	33%	0.328	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.4	-9.2	172.5	55.9	0	0	0	0	113.8	D624 T628	D624-T626 PolarHBondContact O-N 3.22Å; T626-T628 VanDerWaalsContact C-N 3.33Å; T626-T628 PolarHBondContact OG1-N 2.98Å; T626-T628 PolarHBondContact OG1-OG1 3.22Å
627	G	60	Low	77.5	Confident	67 Å²	67	51.5 Å²	51.5	69%	0.691	33%	0.331	S	S	*	.	S	Bend	trans	86.1	-1.2	-170.1	0	0	0	0	0	114.3	D624	D624-G627 PolarHBondContact O-N 3.02Å
628	T	67.1	Low	76.9	Confident	51 Å²	51	54.5 Å²	54.5	31%	0.313	34%	0.344	S	S	.	.			trans	-74.1	134.8	173.4	-47.1	0	0	0	0	110.1	D624 T626	D624-T628 PolarHBondContact N-O 3.37Å; T626-T628 VanDerWaalsContact C-N 3.33Å; T626-T628 PolarHBondContact OG1-N 2.98Å; T626-T628 PolarHBondContact OG1-OG1 3.22Å
629	R	77	Confident	75.3	Confident	91 Å²	91	55.9 Å²	55.9	34%	0.343	35%	0.354	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76	128.5	168.7	-64.6	-178.2	-175.9	-173.3	-1	109.5	V621 Y631 S671	V621-R629 HydrophobicContact CG2-CB 4.24Å; R629-Y631 HydrophobicContact CB-CE2 3.98Å; R629-Y631 WeakPolarHBondContact CD-OH 3.43Å; R629-S671 WeakPolarHBondContact O-CB 3.49Å; R629-S671 PolarHBondContact O-N 3.28Å
630	N	85.6	Confident	73.6	Confident	33 Å²	33	60.4 Å²	60.4	18%	0.176	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	111.6	-177.9	-174.9	-6.2	0	0	0	107.7	G622 D624 L670	G622-N630 PolarHBondContact N-O 3.32Å; G622-N630 PolarHBondContact O-N 3.45Å; D624-N630 PolarHBondContact OD1-ND2 2.87Å; D624-N630 PolarHBondContact OD2-ND2 3.3Å; N630-L670 HydrophobicContact CB-CD2 4.02Å
631	Y	86.4	Confident	71.5	Confident	19 Å²	19	63.7 Å²	63.7	8%	0.075	38%	0.375	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.3	134.9	-176.4	-57.8	-81.9	0	0	0	109.7	L268 V602 P613 T620 V621 R629 C634 Y668 A669	L268-Y631 HydrophobicContact CD2-CD1 3.68Å; L268-Y631 HydrophobicContact CD2-CE1 3.9Å; V602-Y631 HydrophobicContact CG1-CD2 3.74Å; V602-Y631 HydrophobicContact CG1-CE2 3.64Å; P613-Y631 HydrophobicContact CB-CD1 3.78Å; P613-Y631 HydrophobicContact CB-CD2 4.23Å; P613-Y631 HydrophobicContact CB-CE1 3.92Å; P613-Y631 HydrophobicContact CB-CE2 4.35Å; P613-Y631 HydrophobicContact CB-CG 3.95Å; P613-Y631 HydrophobicContact CG-CD1 4.26Å; P613-Y631 HydrophobicContact CG-CE1 3.87Å; P613-Y631 HydrophobicContact CG-CE2 4.35Å; T620-Y631 WeakPolarHBondContact O-CA 3.24Å; V621-Y631 HydrophobicContact CB-CD1 3.78Å; V621-Y631 HydrophobicContact CB-CE1 3.98Å; V621-Y631 HydrophobicContact CG2-CD1 3.61Å; V621-Y631 HydrophobicContact CG2-CE1 3.5Å; V621-Y631 HydrophobicContact CG2-CG 4.44Å; R629-Y631 HydrophobicContact CB-CE2 3.98Å; R629-Y631 WeakPolarHBondContact CD-OH 3.43Å; Y631-C634 PolarHBondContact O-SG 2.84Å; Y631-Y668 CarbonylContact O-C 3.47Å; Y631-Y668 WeakPolarHBondContact O-CA 3.48Å; Y631-Y668 WeakPolarHBondContact O-CB 3.13Å; Y631-A669 WeakPolarHBondContact CB-O 3.25Å; Y631-A669 WeakPolarHBondContact CD2-O 3.44Å; Y631-A669 PolarHBondContact N-O 3.18Å; Y631-A669 PolarHBondContact O-N 3.49Å
632	T	86	Confident	69.5	Low	51 Å²	51	65.5 Å²	65.5	31%	0.313	39%	0.386	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	172	-177.1	41.5	0	0	0	0	111.4	S619 T620 C634	S619-T632 PolarHBondContact N-O 2.65Å; T620-T632 PolarHBondContact N-O 2.73Å; T620-T632 PolarHBondContact O-N 3.49Å; T620-T632 VanDerWaalsContact OG1-C 3.28Å; T620-T632 WeakPolarHBondContact OG1-CB 3.44Å; T620-T632 PolarHBondContact OG1-O 3.22Å; T620-T632 PolarHBondContact OG1-OG1 2.64Å; T632-C634 VanDerWaalsContact C-N 3.28Å; T632-C634 PolarHBondContact O-N 3.07Å
633	D	86.6	Confident	67.9	Low	73 Å²	73	67.9 Å²	67.9	39%	0.39	39%	0.39	S	S	.	.	E	Extended strand (participates in β ladder)	trans	55.1	44.8	-176.9	-44.3	-37.5	0	0	0	111.6	S619 T620 G635 G667	S619-D633 PolarHBondContact N-O 2.78Å; S619-D633 PolarHBondContact OG-O 3.36Å; T620-D633 WeakPolarHBondContact CG2-OD2 3.15Å; T620-D633 PolarHBondContact OG1-OD2 3.05Å; D633-G635 PolarHBondContact O-N 3.45Å; D633-G667 PolarHBondContact N-O 3Å; D633-G667 VanDerWaalsContact N-O 3.15Å
634	C	86.6	Confident	66.6	Low	2 Å²	2	66 Å²	66	1%	0.014	38%	0.384	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.3	92.2	-174.3	-57.8	0	0	0	0	112.4	A616 C618 Y631 T632 C636 V637 G667	A616-C634 CarbonylContact O-C 3.49Å; C618-C634 HydrophobicContact CB-CB 4.05Å; C618-C634 WeakPolarHBondContact CB-SG 3.34Å; C618-C634 WeakPolarHBondContact SG-CB 3.43Å; C618-C634 CovalentContact SG-SG 2.04Å; C618-C634 PolarHBondContact SG-SG 3.32Å; Y631-C634 PolarHBondContact O-SG 2.84Å; T632-C634 VanDerWaalsContact C-N 3.28Å; T632-C634 PolarHBondContact O-N 3.07Å; C634-C636 PolarHBondContact O-N 2.88Å; C634-V637 HydrophobicContact CB-CB 3.91Å; C634-V637 HydrophobicContact CB-CG2 3.58Å; C634-V637 PolarHBondContact O-N 3.03Å; C634-G667 WeakPolarHBondContact CB-O 3.34Å; C634-G667 PolarHBondContact N-O 3.18Å
635	G	83.4	Confident	65.7	Low	53 Å²	53	67.7 Å²	67.7	55%	0.546	40%	0.398	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60	-18.2	-173	0	0	0	0	0	116.7	C588 G617 D633	C588-G635 VanDerWaalsContact CB-O 3.29Å; C588-G635 WeakPolarHBondContact CB-O 3.24Å; G617-G635 PolarHBondContact O-N 3.04Å; D633-G635 PolarHBondContact O-N 3.45Å
636	C	82.7	Confident	65.2	Low	10 Å²	10	67.1 Å²	67.1	7%	0.068	39%	0.394	C	S	.	.	T	Hydrogen-bonded Turn	trans	-96.9	-5.4	175.2	-63.7	0	0	0	0	114.6	Y571 C588 Y610 L615 A616 C634	Y571-C636 HydrophobicContact CD1-CB 3.85Å; Y571-C636 HydrophobicContact CE1-CB 3.81Å; C588-C636 VanDerWaalsContact C-SG 3.58Å; C588-C636 HydrophobicContact CB-CB 3.93Å; C588-C636 WeakPolarHBondContact CB-SG 3.47Å; C588-C636 WeakPolarHBondContact SG-CA 3.41Å; C588-C636 WeakPolarHBondContact SG-CB 3.43Å; C588-C636 CovalentContact SG-SG 2.03Å; C588-C636 PolarHBondContact SG-SG 2.82Å; Y610-C636 HydrophobicContact CD1-CB 4.45Å; Y610-C636 HydrophobicContact CE1-CB 3.89Å; Y610-C636 PolarHBondContact OH-O 3.4Å; L615-C636 PolarHBondContact O-SG 2.98Å; A616-C636 VanDerWaalsContact O-CB 3.32Å; A616-C636 WeakPolarHBondContact O-CB 3.41Å; A616-C636 PolarHBondContact O-N 2.78Å; C634-C636 PolarHBondContact O-N 2.88Å
637	V	84.3	Confident	64.8	Low	10 Å²	10	67.7 Å²	67.7	6%	0.061	40%	0.402	C	S	.	.	S	Bend	trans	-96.7	123.8	-175.6	179.3	0	0	0	0	110	D606 Y610 A616 C634 S639 A669	D606-V637 WeakPolarHBondContact OD2-CA 3.03Å; Y610-V637 HydrophobicContact CD2-CG2 4.19Å; Y610-V637 HydrophobicContact CE2-CG2 3.79Å; A616-V637 HydrophobicContact CB-CG2 4.3Å; C634-V637 HydrophobicContact CB-CB 3.91Å; C634-V637 HydrophobicContact CB-CG2 3.58Å; C634-V637 PolarHBondContact O-N 3.03Å; V637-S639 PolarHBondContact O-N 3.15Å; V637-A669 HydrophobicContact CG2-CB 4.47Å
638	Q	73.8	Confident	64.1	Low	67 Å²	67	68.4 Å²	68.4	31%	0.313	41%	0.41	S	S	.	.			trans	-88.2	101.8	-174.4	-65.2	-172.1	10.4	0	0	111.9	D606 R640	D606-Q638 HydrophobicContact CB-CB 4.38Å; D606-Q638 PolarHBondContact OD2-N 3.4Å; Q638-R640 PolarHBondContact O-N 3.33Å
639	S	54.5	Low	63.2	Low	29 Å²	29	69 Å²	69	20%	0.203	43%	0.425	C	S	.	.			trans	-63.6	100.5	179.5	-160.6	0	0	0	0	112.3	V637 Q641 N666	V637-S639 PolarHBondContact O-N 3.15Å; S639-Q641 PolarHBondContact O-N 3.33Å; S639-N666 PolarHBondContact OG-O 3.23Å
640	R	51.6	Low	61.5	Low	146 Å²	146	74.3 Å²	74.3	55%	0.551	45%	0.454	S	S	*	.			trans	-79.4	81.3	178.4	-74.9	-177	174.6	159.3	0.9	111.7	D606 Q638 V642	D606-R640 PolarHBondContact O-NH1 3.16Å; D606-R640 VanDerWaalsContact O-NH1 3.12Å; Q638-R640 PolarHBondContact O-N 3.33Å; R640-V642 PolarHBondContact O-N 2.82Å; R640-V642 VanDerWaalsContact O-N 3.1Å
641	Q	38	Very low	59.9	Low	119 Å²	119	78.8 Å²	78.8	56%	0.556	48%	0.483	S	S	*	.			trans	-68.9	105.6	166.2	-73.1	-165.6	-10.6	0	0	111	S639 I643	S639-Q641 PolarHBondContact O-N 3.33Å; Q641-I643 HydrophobicContact CB-CG1 4.44Å; Q641-I643 PolarHBondContact O-N 3.48Å
642	V	42.4	Very low	58.1	Low	91 Å²	91	85.2 Å²	85.2	55%	0.552	52%	0.518	S	S	*	.			trans	-75.8	90	168.6	-177.8	0	0	0	0	108.4	R640 T644 V657	R640-V642 PolarHBondContact O-N 2.82Å; R640-V642 VanDerWaalsContact O-N 3.1Å; V642-T644 PolarHBondContact O-N 2.7Å; V642-V657 HydrophobicContact CG1-CG1 4.05Å
643	I	41.9	Very low	55.9	Low	82 Å²	82	92 Å²	92	42%	0.421	55%	0.546	S	S	.	.			trans	-75.7	91.4	173.4	-55	175.9	0	0	0	108.3	Q641 P645 Y662	Q641-I643 HydrophobicContact CB-CG1 4.44Å; Q641-I643 PolarHBondContact O-N 3.48Å; I643-P645 VanDerWaalsContact O-CD 3.31Å; I643-P645 WeakPolarHBondContact O-CD 3.4Å; I643-Y662 HydrophobicContact CD1-CE2 4.21Å
644	T	40.6	Very low	53.8	Low	92 Å²	92	96.5 Å²	96.5	56%	0.564	57%	0.57	S	S	*	*			trans	-69.6	115.1	159.5	29.3	0	0	0	0	108.6	V642 S646	V642-T644 PolarHBondContact O-N 2.7Å; T644-S646 PolarHBondContact O-N 3.04Å
645	P	43.8	Very low	51.4	Low	95 Å²	95	103.6 Å²	103.6	62%	0.617	60%	0.603	S	S	*	*			trans	-63.8	132.2	173	27.2	-33.1	0	0	0	108.8	I643 S647	I643-P645 VanDerWaalsContact O-CD 3.31Å; I643-P645 WeakPolarHBondContact O-CD 3.4Å; P645-S647 PolarHBondContact O-N 2.66Å
646	S	41.7	Very low	49.4	Very low	123 Å²	123	107.5 Å²	107.5	86%	0.86	61%	0.61	S	S	*	*			trans	-63.4	124.9	178.6	-170.1	0	0	0	0	109.9	T644 G648	T644-S646 PolarHBondContact O-N 3.04Å; S646-G648 VanDerWaalsContact C-N 3.34Å; S646-G648 PolarHBondContact O-N 2.9Å
647	S	46.2	Very low	47.5	Very low	117 Å²	117	110.8 Å²	110.8	82%	0.818	63%	0.63	S	S	*	*			trans	-71.2	81.7	-167.3	-60.8	0	0	0	0	113.2	P645 G649	P645-S647 PolarHBondContact O-N 2.66Å; S647-G649 PolarHBondContact O-N 2.79Å
648	G	45.7	Very low	45.6	Very low	83 Å²	83	115.3 Å²	115.3	86%	0.856	65%	0.653	S	S	*	*			trans	-68.1	56	169.2	0	0	0	0	0	114	S646	S646-G648 VanDerWaalsContact C-N 3.34Å; S646-G648 PolarHBondContact O-N 2.9Å
649	G	48.5	Very low	44.2	Very low	62 Å²	62	115.2 Å²	115.2	64%	0.639	66%	0.657	S	S	*	*	S	Bend	trans	60.9	69.9	155.9	0	0	0	0	0	119	S647	S647-G649 PolarHBondContact O-N 2.79Å
650	Q	41.4	Very low	43.4	Very low	203 Å²	203	119.1 Å²	119.1	95%	0.949	67%	0.67	S	S	*	*			trans	-159.1	160	137.8	-111.5	167.9	39.4	0	0	111.4
651	V	51.7	Low	43.2	Very low	128 Å²	128	116 Å²	116	78%	0.776	67%	0.667	S	S	*	*			trans	-116.3	150.7	-165.6	-173.9	0	0	0	0	110.6
652	N	48.5	Very low	43.4	Very low	153 Å²	153	115.3 Å²	115.3	82%	0.818	66%	0.66	S	S	*	*			trans	74.7	57	175.7	-61.5	-23.1	0	0	0	118.3
653	Q	40	Very low	43.6	Very low	193 Å²	193	118 Å²	118	90%	0.902	67%	0.67	S	S	*	*	S	Bend	trans	-135.6	163.4	149.3	-74.4	-161.5	-11.8	0	0	111.1	Q655	Q653-Q655 PolarHBondContact O-N 3.48Å
654	L	42.8	Very low	43.9	Very low	168 Å²	168	119.2 Å²	119.2	88%	0.88	68%	0.678	S	S	*	*			trans	-57.8	127	-177.9	-80.9	75.6	0	0	0	110.7	L656	L654-L656 VanDerWaalsContact C-N 3.28Å; L654-L656 PolarHBondContact O-N 3.45Å
655	Q	36.6	Very low	44.5	Very low	151 Å²	151	122.4 Å²	122.4	71%	0.706	69%	0.687	S	S	*	*			trans	-73.5	83.8	174	-171.8	171.3	-5	0	0	109.9	Q653 V657	Q653-Q655 PolarHBondContact O-N 3.48Å; Q655-V657 PolarHBondContact O-N 3.45Å
656	L	41	Very low	45.5	Very low	135 Å²	135	123.5 Å²	123.5	71%	0.707	69%	0.687	S	S	*	*			trans	-67.5	95.4	177.2	-172	74.5	0	0	0	109.8	L654 I658	L654-L656 VanDerWaalsContact C-N 3.28Å; L654-L656 PolarHBondContact O-N 3.45Å; L656-I658 VanDerWaalsContact C-N 3.32Å; L656-I658 HydrophobicContact CD2-CD1 4.03Å; L656-I658 HydrophobicContact CD2-CG1 3.81Å; L656-I658 HydrophobicContact CG-CG1 3.94Å; L656-I658 PolarHBondContact O-N 3.34Å
657	V	42.9	Very low	47.3	Very low	79 Å²	79	117.8 Å²	117.8	48%	0.479	65%	0.648	S	S	.	*			trans	-73	87.8	174.8	-175.3	0	0	0	0	109	V642 Q655 V659	V642-V657 HydrophobicContact CG1-CG1 4.05Å; Q655-V657 PolarHBondContact O-N 3.45Å; V657-V659 VanDerWaalsContact C-N 3.35Å; V657-V659 HydrophobicContact CG1-CG2 4.04Å; V657-V659 PolarHBondContact O-N 3.36Å
658	I	44.5	Very low	49.1	Very low	105 Å²	105	117.5 Å²	117.5	54%	0.538	63%	0.63	S	S	.	*			trans	-73.1	90	175.1	-52.2	177.9	0	0	0	108.7	L656 K660	L656-I658 VanDerWaalsContact C-N 3.32Å; L656-I658 HydrophobicContact CD2-CD1 4.03Å; L656-I658 HydrophobicContact CD2-CG1 3.81Å; L656-I658 HydrophobicContact CG-CG1 3.94Å; L656-I658 PolarHBondContact O-N 3.34Å; I658-K660 VanDerWaalsContact C-N 3.32Å; I658-K660 HydrophobicContact CG2-CG 4.06Å; I658-K660 PolarHBondContact O-N 3.05Å
659	V	43.5	Very low	51.1	Low	66 Å²	66	113.6 Å²	113.6	40%	0.4	59%	0.589	S	S	.	*			trans	-70.8	89.6	169.8	-174.7	0	0	0	0	108.7	V657 T661	V657-V659 VanDerWaalsContact C-N 3.35Å; V657-V659 HydrophobicContact CG1-CG2 4.04Å; V657-V659 PolarHBondContact O-N 3.36Å; V659-T661 HydrophobicContact CG1-CG2 4.3Å; V659-T661 PolarHBondContact O-N 3.26Å; V659-T661 VanDerWaalsContact O-N 3.13Å
660	K	38.4	Very low	52.9	Low	110 Å²	110	113.8 Å²	113.8	48%	0.478	58%	0.575	S	S	.	*			trans	-72.9	99.1	167.8	-77.5	-167	175.9	-174.4	0	109.4	I658 Y662	I658-K660 VanDerWaalsContact C-N 3.32Å; I658-K660 HydrophobicContact CG2-CG 4.06Å; I658-K660 PolarHBondContact O-N 3.05Å; K660-Y662 VanDerWaalsContact C-N 3.34Å; K660-Y662 HydrophobicContact CB-CD2 4.05Å; K660-Y662 HydrophobicContact CB-CE2 3.65Å; K660-Y662 HydrophobicContact CD-CE1 4.2Å; K660-Y662 HydrophobicContact CD-CE2 3.96Å; K660-Y662 WeakPolarHBondContact CD-OH 3.4Å; K660-Y662 HydrophobicContact CG-CE2 4.5Å; K660-Y662 PolarHBondContact NZ-OH 3.45Å; K660-Y662 WeakPolarHBondContact O-CD2 3.5Å; K660-Y662 PolarHBondContact O-N 2.94Å
661	T	47.5	Very low	54.8	Low	80 Å²	80	106.2 Å²	106.2	49%	0.491	54%	0.544	S	S	.	.			trans	-71.3	87.9	167.3	48.9	0	0	0	0	109.9	V659	V659-T661 HydrophobicContact CG1-CG2 4.3Å; V659-T661 PolarHBondContact O-N 3.26Å; V659-T661 VanDerWaalsContact O-N 3.13Å
662	Y	41.4	Very low	56.1	Low	105 Å²	105	101.2 Å²	101.2	41%	0.412	52%	0.519	S	S	.	.			trans	-77.6	129.1	167.4	-60.9	-80.7	0	0	0	109.2	I643 K660 N664	I643-Y662 HydrophobicContact CD1-CE2 4.21Å; K660-Y662 VanDerWaalsContact C-N 3.34Å; K660-Y662 HydrophobicContact CB-CD2 4.05Å; K660-Y662 HydrophobicContact CB-CE2 3.65Å; K660-Y662 HydrophobicContact CD-CE1 4.2Å; K660-Y662 HydrophobicContact CD-CE2 3.96Å; K660-Y662 WeakPolarHBondContact CD-OH 3.4Å; K660-Y662 HydrophobicContact CG-CE2 4.5Å; K660-Y662 PolarHBondContact NZ-OH 3.45Å; K660-Y662 WeakPolarHBondContact O-CD2 3.5Å; K660-Y662 PolarHBondContact O-N 2.94Å; Y662-N664 PolarHBondContact O-N 3.44Å
663	L	47.9	Very low	57.7	Low	147 Å²	147	97 Å²	97	77%	0.77	49%	0.493	S	S	*	.			trans	-74.2	96.7	155.8	-80	81.1	0	0	0	106.5
664	N	46.5	Very low	59.7	Low	109 Å²	109	88.6 Å²	88.6	58%	0.583	46%	0.455	S	S	*	.			trans	-147.4	101.5	172.5	-99.1	0.8	0	0	0	110.2	Y662 N666	Y662-N664 PolarHBondContact O-N 3.44Å; N664-N666 VanDerWaalsContact C-N 3.25Å; N664-N666 PolarHBondContact O-N 2.96Å
665	E	53.4	Low	61.2	Low	159 Å²	159	88.5 Å²	88.5	74%	0.743	46%	0.456	S	S	*	.	S	Bend	trans	52.6	-51.6	144	-58.6	177.8	150.8	0	0	119.3	G667	E665-G667 VanDerWaalsContact C-N 3.31Å; E665-G667 PolarHBondContact O-N 2.86Å; E665-G667 VanDerWaalsContact O-N 3.11Å
666	N	66.2	Low	62.9	Low	117 Å²	117	84 Å²	84	63%	0.626	43%	0.433	S	S	*	.			trans	-93.4	50.8	-169.8	-60.4	19.5	0	0	0	112.4	S639 N664	S639-N666 PolarHBondContact OG-O 3.23Å; N664-N666 VanDerWaalsContact C-N 3.25Å; N664-N666 PolarHBondContact O-N 2.96Å
667	G	77.8	Confident	64.2	Low	3 Å²	3	84.2 Å²	84.2	3%	0.031	44%	0.439	C	S	.	.			trans	-75.2	138.7	165.2	0	0	0	0	0	110.4	D633 C634 E665	D633-G667 PolarHBondContact N-O 3Å; D633-G667 VanDerWaalsContact N-O 3.15Å; C634-G667 WeakPolarHBondContact CB-O 3.34Å; C634-G667 PolarHBondContact N-O 3.18Å; E665-G667 VanDerWaalsContact C-N 3.31Å; E665-G667 PolarHBondContact O-N 2.86Å; E665-G667 VanDerWaalsContact O-N 3.11Å
668	Y	85.7	Confident	65.7	Low	112 Å²	112	81.9 Å²	81.9	44%	0.439	43%	0.426	S	S	.	.			trans	-132	152	174.6	74.7	-91.9	0	0	0	110.6	S605 Y631	S605-Y668 PolarHBondContact N-O 3.39Å; Y631-Y668 CarbonylContact O-C 3.47Å; Y631-Y668 WeakPolarHBondContact O-CA 3.48Å; Y631-Y668 WeakPolarHBondContact O-CB 3.13Å
669	A	87.3	Confident	67.5	Low	0 Å²	0	84.1 Å²	84.1	0%	0	44%	0.439	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.4	135.8	179.4	0	0	0	0	0	111.9	V602 C603 Y631 V637	V602-A669 HydrophobicContact CB-CB 3.95Å; V602-A669 HydrophobicContact CG2-CB 3.79Å; C603-A669 CarbonylContact O-C 3.47Å; C603-A669 WeakPolarHBondContact O-CA 3.3Å; Y631-A669 WeakPolarHBondContact CB-O 3.25Å; Y631-A669 WeakPolarHBondContact CD2-O 3.44Å; Y631-A669 PolarHBondContact N-O 3.18Å; Y631-A669 PolarHBondContact O-N 3.49Å; V637-A669 HydrophobicContact CG2-CB 4.47Å
670	L	86.3	Confident	69.6	Low	67 Å²	67	83 Å²	83	35%	0.351	43%	0.433	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	143.7	177.6	-59.9	179.2	0	0	0	110.8	V602 C603 N630 G672	V602-L670 CarbonylContact C-O 3.5Å; V602-L670 VanDerWaalsContact CA-O 3.26Å; V602-L670 WeakPolarHBondContact CA-O 3.39Å; V602-L670 WeakPolarHBondContact CB-O 3.28Å; C603-L670 PolarHBondContact N-O 3.45Å; C603-L670 PolarHBondContact O-N 3.19Å; N630-L670 HydrophobicContact CB-CD2 4.02Å; L670-G672 PolarHBondContact O-N 3.2Å
671	S	81.2	Confident	72	Confident	43 Å²	43	79.1 Å²	79.1	30%	0.301	42%	0.417	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.5	124.2	174.9	-170.2	0	0	0	0	111.9	R629	R629-S671 WeakPolarHBondContact O-CB 3.49Å; R629-S671 PolarHBondContact O-N 3.28Å
672	G	79.2	Confident	74	Confident	23 Å²	23	81 Å²	81	24%	0.237	42%	0.423	C	S	.	.	S	Bend	trans	124.6	173	-177.2	0	0	0	0	0	113.6	P601 V602 C603 L670	P601-G672 CarbonylContact C-O 3.55Å; P601-G672 CarbonylContact O-C 3.56Å; P601-G672 WeakPolarHBondContact O-CA 3.32Å; P601-G672 PolarHBondContact O-N 3.45Å; P601-G672 VanDerWaalsContact O-O 3.11Å; V602-G672 CarbonylContact C-O 3.5Å; V602-G672 WeakPolarHBondContact CA-O 3.2Å; V602-G672 PolarHBondContact N-O 3.04Å; C603-G672 PolarHBondContact N-O 3.13Å; L670-G672 PolarHBondContact O-N 3.2Å
673	K	81.9	Confident	76.4	Confident	66 Å²	66	78.3 Å²	78.3	29%	0.287	42%	0.418	S	S	.	.	P	Polyproline II helix	trans	-77.6	152.9	170.2	-57.6	-175.7	-177.2	-169	0	109.4	I562 Y599 P601 T609 W760 E761	I562-K673 HydrophobicContact CD1-CD 4.32Å; Y599-K673 WeakPolarHBondContact OH-CE 3.31Å; P601-K673 HydrophobicContact CB-CG 4.19Å; P601-K673 HydrophobicContact CG-CG 3.95Å; T609-K673 HydrophobicContact CG2-CB 4.38Å; T609-K673 HydrophobicContact CG2-CG 4.44Å; K673-W760 PolarHBondContact NZ-O 2.8Å; K673-E761 IonicContact NZ-OE2 2.94Å; K673-E761 PolarHBondContact NZ-OE2 3.25Å
674	C	82.6	Confident	78.4	Confident	16 Å²	16	71.4 Å²	71.4	11%	0.108	38%	0.382	C	S	.	.	P	Polyproline II helix	trans	-65.9	139.8	173	-65.7	0	0	0	0	111.9	C603 G607 I608 T609 R676	C603-C674 WeakPolarHBondContact CA-SG 3.06Å; C603-C674 HydrophobicContact CB-CB 3.95Å; C603-C674 WeakPolarHBondContact CB-SG 3.27Å; C603-C674 WeakPolarHBondContact SG-CA 3.46Å; C603-C674 WeakPolarHBondContact SG-CB 3.23Å; C603-C674 CovalentContact SG-SG 2.04Å; C603-C674 PolarHBondContact SG-SG 3.42Å; G607-C674 VanDerWaalsContact C-SG 3.56Å; I608-C674 VanDerWaalsContact C-SG 3.57Å; I608-C674 PolarHBondContact O-SG 3.18Å; T609-C674 WeakPolarHBondContact OG1-CB 3.46Å; T609-C674 PolarHBondContact OG1-N 3.41Å; T609-C674 VanDerWaalsContact OG1-N 3.08Å; T609-C674 PolarHBondContact OG1-SG 3.16Å; C674-R676 PolarHBondContact O-N 3.38Å
675	D	74.3	Confident	80.6	Confident	166 Å²	166	67 Å²	67	89%	0.888	36%	0.358	S	S	*	.	P	Polyproline II helix	trans	-61	131.5	177.2	-88.7	-36	0	0	0	112.2
676	R	72.1	Confident	82.5	Confident	57 Å²	57	63.9 Å²	63.9	22%	0.215	35%	0.346	C	S	.	.			trans	-95.6	111.2	173.3	-77.1	165.9	136.8	141	-10.9	109.3	E560 I562 C674 C678 E761	E560-R676 PolarHBondContact O-NE 2.89Å; E560-R676 PolarHBondContact O-NH2 3.29Å; I562-R676 HydrophobicContact CG2-CG 3.77Å; I562-R676 VanDerWaalsContact N-NH2 3.14Å; C674-R676 PolarHBondContact O-N 3.38Å; R676-C678 PolarHBondContact O-N 3.46Å; R676-E761 IonicContact CZ-OE1 3.41Å; R676-E761 IonicContact NH1-OE1 3.77Å; R676-E761 PolarHBondContact NH1-OE1 3.39Å; R676-E761 IonicContact NH2-OE1 3.8Å
677	T	67.4	Low	83.8	Confident	138 Å²	138	61.8 Å²	61.8	85%	0.847	33%	0.331	S	S	*	.			trans	-73.5	60.1	174.7	49.8	0	0	0	0	112.6	N679	T677-N679 PolarHBondContact O-N 3.18Å
678	C	74.6	Confident	84.4	Confident	30 Å²	30	61.7 Å²	61.7	20%	0.203	33%	0.33	C	S	.	.			trans	-95	83.2	-169.8	-164.8	0	0	0	0	113.6	C559 R676 T680	C559-C678 VanDerWaalsContact CA-SG 3.55Å; C559-C678 HydrophobicContact CB-CB 4.02Å; C559-C678 WeakPolarHBondContact CB-SG 3.36Å; C559-C678 WeakPolarHBondContact SG-CB 3.4Å; C559-C678 CovalentContact SG-SG 2.02Å; C559-C678 PolarHBondContact SG-SG 2.87Å; R676-C678 PolarHBondContact O-N 3.46Å; C678-T680 PolarHBondContact O-N 2.9Å; C678-T680 PolarHBondContact SG-OG1 3.09Å
679	N	81.5	Confident	84.8	Confident	152 Å²	152	60 Å²	60	81%	0.813	33%	0.325	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68	-0.8	178.4	-69.3	-16.9	0	0	0	114.7	T677	T677-N679 PolarHBondContact O-N 3.18Å
680	T	87.8	Confident	85.2	Confident	44 Å²	44	63 Å²	63	27%	0.27	34%	0.34	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.9	-4.8	-175.4	58.7	0	0	0	0	114.6	G558 C678 I682 P683 F684	G558-T680 VanDerWaalsContact C-OG1 3.28Å; G558-T680 PolarHBondContact O-OG1 2.84Å; C678-T680 PolarHBondContact O-N 2.9Å; C678-T680 PolarHBondContact SG-OG1 3.09Å; T680-I682 PolarHBondContact O-N 2.88Å; T680-P683 WeakPolarHBondContact O-CD 3.44Å; T680-P683 WeakPolarHBondContact O-CG 3.22Å; T680-F684 VanDerWaalsContact O-CB 3.27Å; T680-F684 WeakPolarHBondContact O-CB 3.15Å; T680-F684 PolarHBondContact O-N 3.17Å
681	L	88.8	Confident	85.5	Confident	28 Å²	28	59.9 Å²	59.9	15%	0.147	32%	0.324	C	S	.	.	H	α-helix	trans	-57	-48	177.8	175.1	62	0	0	0	113	I492 F496 I498 Y506 F684 L685	I492-L681 HydrophobicContact CG2-CD1 4.4Å; F496-L681 HydrophobicContact CB-CD1 4.14Å; F496-L681 HydrophobicContact CD1-CB 3.68Å; F496-L681 HydrophobicContact CD1-CD1 4Å; F496-L681 HydrophobicContact CD1-CG 4.41Å; F496-L681 HydrophobicContact CD2-CD1 3.73Å; F496-L681 VanDerWaalsContact CE1-CA 3.49Å; F496-L681 HydrophobicContact CE1-CB 4.06Å; F496-L681 HydrophobicContact CE1-CD1 4.41Å; F496-L681 HydrophobicContact CE2-CD1 4.16Å; F496-L681 HydrophobicContact CG-CB 4.18Å; F496-L681 HydrophobicContact CG-CD1 3.66Å; F496-L681 HydrophobicContact CG-CG 4.43Å; F496-L681 HydrophobicContact CZ-CD1 4.49Å; I498-L681 HydrophobicContact CD1-CD2 4.39Å; I498-L681 HydrophobicContact CG2-CD2 4.37Å; Y506-L681 HydrophobicContact CE2-CD2 4.35Å; L681-F684 PolarHBondContact O-N 2.98Å; L681-L685 HydrophobicContact CD1-CD1 4.01Å; L681-L685 HydrophobicContact CD1-CG 4.2Å; L681-L685 HydrophobicContact CG-CD1 4.19Å; L681-L685 WeakPolarHBondContact O-CG 3.26Å; L681-L685 PolarHBondContact O-N 3.34Å
682	I	89.9	Confident	86.1	Confident	120 Å²	120	58.5 Å²	58.5	62%	0.615	31%	0.314	S	S	*	.	H	α-helix	trans	-64.4	-52.5	-178.3	-60.8	176.5	0	0	0	111.7	T680 F684 L685 I686	T680-I682 PolarHBondContact O-N 2.88Å; I682-F684 VanDerWaalsContact C-N 3.29Å; I682-F684 PolarHBondContact O-N 3.34Å; I682-L685 PolarHBondContact O-N 2.79Å; I682-I686 HydrophobicContact CG2-CD1 4.06Å; I682-I686 WeakPolarHBondContact O-CG1 3.41Å; I682-I686 PolarHBondContact O-N 3.46Å; I682-I686 VanDerWaalsContact O-N 3.1Å
683	P	91.3	Very high	86.8	Confident	48 Å²	48	58.9 Å²	58.9	31%	0.312	31%	0.31	S	S	.	.	H	α-helix	trans	-63.3	-33.2	176.2	22.1	-31.3	0	0	0	112.7	V557 T680 I686 F687	V557-P683 HydrophobicContact CG1-CB 4.43Å; V557-P683 HydrophobicContact CG1-CG 4.28Å; T680-P683 WeakPolarHBondContact O-CD 3.44Å; T680-P683 WeakPolarHBondContact O-CG 3.22Å; P683-I686 PolarHBondContact O-N 2.96Å; P683-F687 HydrophobicContact CB-CE2 4.34Å; P683-F687 WeakPolarHBondContact O-CD2 3.29Å; P683-F687 PolarHBondContact O-N 3.15Å
684	F	91.7	Very high	87.4	Confident	1 Å²	1	57.4 Å²	57.4	0%	0.004	31%	0.305	C	S	.	.	H	α-helix	trans	-58.3	-48.9	172.6	172.5	-98.3	0	0	0	111.8	F491 I492 F496 L554 V557 T680 L681 I682 I686 F687 L688 F772	F491-F684 HydrophobicContact CD1-CE1 4.43Å; F491-F684 AromaticContact CD1-CZ 3.84Å; F491-F684 HydrophobicContact CD1-CZ 3.84Å; F491-F684 HydrophobicContact CE1-CE1 4.31Å; F491-F684 AromaticContact CE1-CE2 3.76Å; F491-F684 HydrophobicContact CE1-CE2 3.76Å; F491-F684 AromaticContact CE1-CZ 3.47Å; F491-F684 HydrophobicContact CE1-CZ 3.47Å; F491-F684 VanDerWaalsContact CE1-CZ 3.47Å; I492-F684 HydrophobicContact CD1-CE1 4.5Å; I492-F684 HydrophobicContact CG1-CE1 4.02Å; F496-F684 HydrophobicContact CE1-CB 4.34Å; F496-F684 HydrophobicContact CE2-CB 4.39Å; F496-F684 AromaticContact CE2-CD1 3.55Å; F496-F684 HydrophobicContact CE2-CD1 3.55Å; F496-F684 HydrophobicContact CE2-CD2 4.49Å; F496-F684 AromaticContact CE2-CE1 3.92Å; F496-F684 HydrophobicContact CE2-CE1 3.92Å; F496-F684 AromaticContact CE2-CG 3.88Å; F496-F684 HydrophobicContact CE2-CG 3.88Å; F496-F684 HydrophobicContact CZ-CB 3.64Å; F496-F684 AromaticContact CZ-CD1 3.7Å; F496-F684 HydrophobicContact CZ-CD1 3.7Å; F496-F684 HydrophobicContact CZ-CD2 4.14Å; F496-F684 HydrophobicContact CZ-CE1 4.42Å; F496-F684 AromaticContact CZ-CG 3.54Å; F496-F684 HydrophobicContact CZ-CG 3.54Å; L554-F684 HydrophobicContact CD2-CD2 4.17Å; L554-F684 HydrophobicContact CD2-CE2 4.06Å; V557-F684 HydrophobicContact CG1-CB 3.88Å; T680-F684 VanDerWaalsContact O-CB 3.27Å; T680-F684 WeakPolarHBondContact O-CB 3.15Å; T680-F684 PolarHBondContact O-N 3.17Å; L681-F684 PolarHBondContact O-N 2.98Å; I682-F684 VanDerWaalsContact C-N 3.29Å; I682-F684 PolarHBondContact O-N 3.34Å; F684-I686 VanDerWaalsContact C-N 3.28Å; F684-I686 PolarHBondContact O-N 3.38Å; F684-F687 PolarHBondContact O-N 3.14Å; F684-L688 HydrophobicContact CE1-CD2 3.71Å; F684-L688 HydrophobicContact CZ-CD2 3.87Å; F684-L688 VanDerWaalsContact O-CB 3.27Å; F684-L688 WeakPolarHBondContact O-CB 3.41Å; F684-L688 PolarHBondContact O-N 2.71Å; F684-F772 AromaticContact CE2-CE2 3.85Å; F684-F772 HydrophobicContact CE2-CE2 3.85Å; F684-F772 AromaticContact CE2-CZ 3.72Å; F684-F772 HydrophobicContact CE2-CZ 3.72Å; F684-F772 HydrophobicContact CZ-CE2 4.42Å; F684-F772 AromaticContact CZ-CZ 3.94Å; F684-F772 HydrophobicContact CZ-CZ 3.94Å
685	L	91.9	Very high	87.9	Confident	16 Å²	16	57.1 Å²	57.1	8%	0.084	30%	0.303	C	S	.	.	H	α-helix	trans	-62.3	-34.4	177.9	-68.8	171.7	0	0	0	112.3	I492 Y506 I510 L681 I682 F689	I492-L685 HydrophobicContact CD1-CD2 4.16Å; Y506-L685 HydrophobicContact CD2-CD1 4.26Å; Y506-L685 HydrophobicContact CG-CD1 4.26Å; I510-L685 HydrophobicContact CD1-CB 4.15Å; I510-L685 HydrophobicContact CD1-CD1 3.98Å; I510-L685 HydrophobicContact CD1-CD2 4.23Å; I510-L685 HydrophobicContact CD1-CG 4.35Å; L681-L685 HydrophobicContact CD1-CD1 4.01Å; L681-L685 HydrophobicContact CD1-CG 4.2Å; L681-L685 HydrophobicContact CG-CD1 4.19Å; L681-L685 WeakPolarHBondContact O-CG 3.26Å; L681-L685 PolarHBondContact O-N 3.34Å; I682-L685 PolarHBondContact O-N 2.79Å; L685-F689 WeakPolarHBondContact O-CB 3.21Å; L685-F689 PolarHBondContact O-N 2.86Å
686	I	93.1	Very high	88.8	Confident	94 Å²	94	49.3 Å²	49.3	48%	0.482	26%	0.261	S	S	.	.	H	α-helix	trans	-67.9	-47.8	174.7	-66.3	167.3	0	0	0	111.3	I682 P683 F684 L688 F689 I690	I682-I686 HydrophobicContact CG2-CD1 4.06Å; I682-I686 WeakPolarHBondContact O-CG1 3.41Å; I682-I686 PolarHBondContact O-N 3.46Å; I682-I686 VanDerWaalsContact O-N 3.1Å; P683-I686 PolarHBondContact O-N 2.96Å; F684-I686 VanDerWaalsContact C-N 3.28Å; F684-I686 PolarHBondContact O-N 3.38Å; I686-L688 VanDerWaalsContact C-N 3.33Å; I686-L688 PolarHBondContact O-N 2.93Å; I686-F689 WeakPolarHBondContact O-CB 3.43Å; I686-F689 PolarHBondContact O-N 3.37Å; I686-I690 HydrophobicContact CG2-CD1 4.05Å; I686-I690 WeakPolarHBondContact O-CG1 3.49Å; I686-I690 PolarHBondContact O-N 3.4Å
687	F	92.9	Very high	89.8	Confident	74 Å²	74	47 Å²	47	33%	0.325	25%	0.254	S	S	.	.	H	α-helix	trans	-63.7	-39.6	176.3	-73.3	-61.3	0	0	0	111.8	T553 L554 V557 P683 F684 I690 V691	T553-F687 HydrophobicContact CG2-CE1 4.43Å; T553-F687 WeakPolarHBondContact OG1-CD1 3.32Å; L554-F687 HydrophobicContact CD2-CB 3.69Å; V557-F687 HydrophobicContact CG2-CD2 3.89Å; V557-F687 HydrophobicContact CG2-CE2 3.85Å; P683-F687 HydrophobicContact CB-CE2 4.34Å; P683-F687 WeakPolarHBondContact O-CD2 3.29Å; P683-F687 PolarHBondContact O-N 3.15Å; F684-F687 PolarHBondContact O-N 3.14Å; F687-I690 PolarHBondContact O-N 3.03Å; F687-V691 WeakPolarHBondContact O-CB 3.38Å; F687-V691 VanDerWaalsContact O-CG2 3.29Å; F687-V691 WeakPolarHBondContact O-CG2 3.45Å; F687-V691 PolarHBondContact O-N 2.95Å
688	L	92	Very high	91	Very high	1 Å²	1	40.8 Å²	40.8	1%	0.005	22%	0.217	C	C	.	.	H	α-helix	trans	-64.9	-38.9	176.6	-175	59.8	0	0	0	111.8	F484 I488 I511 L554 F684 I686 T692	F484-L688 HydrophobicContact CD2-CD1 4.24Å; F484-L688 HydrophobicContact CE2-CD1 3.72Å; I488-L688 HydrophobicContact CD1-CD2 4.09Å; I488-L688 HydrophobicContact CG1-CD2 3.95Å; I511-L688 HydrophobicContact CD1-CD2 3.54Å; I511-L688 HydrophobicContact CD1-CG 4.17Å; I511-L688 HydrophobicContact CG1-CD2 4.17Å; I511-L688 HydrophobicContact CG1-CG 4.37Å; L554-L688 HydrophobicContact CD1-CD1 4.35Å; L554-L688 HydrophobicContact CD2-CB 4.48Å; F684-L688 HydrophobicContact CE1-CD2 3.71Å; F684-L688 HydrophobicContact CZ-CD2 3.87Å; F684-L688 VanDerWaalsContact O-CB 3.27Å; F684-L688 WeakPolarHBondContact O-CB 3.41Å; F684-L688 PolarHBondContact O-N 2.71Å; I686-L688 VanDerWaalsContact C-N 3.33Å; I686-L688 PolarHBondContact O-N 2.93Å; L688-T692 HydrophobicContact CD1-CG2 4.23Å; L688-T692 WeakPolarHBondContact O-CB 3.3Å; L688-T692 VanDerWaalsContact O-CG2 3.27Å; L688-T692 WeakPolarHBondContact O-CG2 3.29Å; L688-T692 PolarHBondContact O-N 3.24Å; L688-T692 PolarHBondContact O-OG1 3.31Å
689	F	94.2	Very high	91.8	Very high	75 Å²	75	41.1 Å²	41.1	33%	0.329	22%	0.216	S	C	.	.	H	α-helix	trans	-58.8	-49.2	171	178.2	-86.4	0	0	0	111.1	I510 S514 L685 I686 T692 L693	I510-F689 HydrophobicContact CG2-CB 3.97Å; I510-F689 HydrophobicContact CG2-CD2 3.85Å; I510-F689 HydrophobicContact CG2-CG 4.39Å; S514-F689 PolarHBondContact OG-O 2.99Å; L685-F689 WeakPolarHBondContact O-CB 3.21Å; L685-F689 PolarHBondContact O-N 2.86Å; I686-F689 WeakPolarHBondContact O-CB 3.43Å; I686-F689 PolarHBondContact O-N 3.37Å; F689-T692 WeakPolarHBondContact CA-OG1 3.47Å; F689-T692 PolarHBondContact O-N 2.84Å; F689-T692 PolarHBondContact O-OG1 3.44Å; F689-L693 HydrophobicContact CE1-CD1 3.79Å; F689-L693 HydrophobicContact CZ-CD1 4.09Å; F689-L693 WeakPolarHBondContact O-CB 3.27Å; F689-L693 PolarHBondContact O-N 3.15Å
690	I	94.3	Very high	92.2	Very high	64 Å²	64	34.9 Å²	34.9	33%	0.328	18%	0.183	S	C	.	.	H	α-helix	trans	-62	-47.4	179.2	-66.4	165	0	0	0	111.4	I686 F687 T692 L693 I694	I686-I690 HydrophobicContact CG2-CD1 4.05Å; I686-I690 WeakPolarHBondContact O-CG1 3.49Å; I686-I690 PolarHBondContact O-N 3.4Å; F687-I690 PolarHBondContact O-N 3.03Å; I690-T692 VanDerWaalsContact C-N 3.33Å; I690-T692 PolarHBondContact O-N 2.97Å; I690-L693 PolarHBondContact O-N 2.87Å; I690-I694 HydrophobicContact CG2-CD1 3.65Å; I690-I694 HydrophobicContact CG2-CG1 4.46Å; I690-I694 VanDerWaalsContact O-CG1 3.3Å; I690-I694 WeakPolarHBondContact O-CG1 3.12Å; I690-I694 PolarHBondContact O-N 3.08Å
691	V	93.2	Very high	92.4	Very high	1 Å²	1	32.8 Å²	32.8	1%	0.006	17%	0.17	C	C	.	.	H	α-helix	trans	-59.5	-41.9	178.8	166.4	0	0	0	0	111.9	C550 F551 L554 F687 T695	C550-V691 HydrophobicContact CB-CG2 3.53Å; C550-V691 WeakPolarHBondContact O-CG2 3.37Å; F551-V691 HydrophobicContact CD2-CG1 3.56Å; F551-V691 HydrophobicContact CE2-CG1 3.24Å; F551-V691 HydrophobicContact CG-CG1 4.32Å; F551-V691 HydrophobicContact CZ-CG1 3.79Å; L554-V691 HydrophobicContact CD1-CB 4.4Å; L554-V691 HydrophobicContact CD1-CG1 4.25Å; L554-V691 HydrophobicContact CD1-CG2 4.05Å; L554-V691 HydrophobicContact CG-CG2 4.36Å; F687-V691 WeakPolarHBondContact O-CB 3.38Å; F687-V691 VanDerWaalsContact O-CG2 3.29Å; F687-V691 WeakPolarHBondContact O-CG2 3.45Å; F687-V691 PolarHBondContact O-N 2.95Å; V691-T695 VanDerWaalsContact O-CB 3.26Å; V691-T695 WeakPolarHBondContact O-CB 3.45Å; V691-T695 PolarHBondContact O-N 3.31Å; V691-T695 PolarHBondContact O-OG1 2.86Å
692	T	93.1	Very high	92.4	Very high	14 Å²	14	32 Å²	32	9%	0.086	17%	0.168	C	C	.	.	H	α-helix	trans	-73.5	-39.1	-179.4	50.5	0	0	0	0	112.1	F484 I511 S514 L688 F689 I690 T695 A696	F484-T692 HydrophobicContact CD2-CG2 4.35Å; I511-T692 HydrophobicContact CG2-CG2 4.13Å; S514-T692 WeakPolarHBondContact CB-OG1 3.27Å; S514-T692 PolarHBondContact OG-OG1 3.16Å; L688-T692 HydrophobicContact CD1-CG2 4.23Å; L688-T692 WeakPolarHBondContact O-CB 3.3Å; L688-T692 VanDerWaalsContact O-CG2 3.27Å; L688-T692 WeakPolarHBondContact O-CG2 3.29Å; L688-T692 PolarHBondContact O-N 3.24Å; L688-T692 PolarHBondContact O-OG1 3.31Å; F689-T692 WeakPolarHBondContact CA-OG1 3.47Å; F689-T692 PolarHBondContact O-N 2.84Å; F689-T692 PolarHBondContact O-OG1 3.44Å; I690-T692 VanDerWaalsContact C-N 3.33Å; I690-T692 PolarHBondContact O-N 2.97Å; T692-T695 PolarHBondContact O-N 3.32Å; T692-A696 WeakPolarHBondContact O-CB 3.38Å; T692-A696 PolarHBondContact O-N 2.87Å
693	L	95	Very high	92.3	Very high	32 Å²	32	29.2 Å²	29.2	17%	0.168	15%	0.153	C	C	.	.	H	α-helix	trans	-61.6	-48.8	174.4	-171.6	156	0	0	0	111.5	S514 V517 G518 L521 F689 I690 A696 C697	S514-L693 WeakPolarHBondContact OG-CB 3.39Å; S514-L693 PolarHBondContact OG-N 3.47Å; S514-L693 VanDerWaalsContact OG-N 3.15Å; V517-L693 HydrophobicContact CG1-CD1 4Å; G518-L693 WeakPolarHBondContact CA-O 3.46Å; L521-L693 HydrophobicContact CD2-CD2 4.01Å; F689-L693 HydrophobicContact CE1-CD1 3.79Å; F689-L693 HydrophobicContact CZ-CD1 4.09Å; F689-L693 WeakPolarHBondContact O-CB 3.27Å; F689-L693 PolarHBondContact O-N 3.15Å; I690-L693 PolarHBondContact O-N 2.87Å; L693-A696 PolarHBondContact O-N 2.86Å; L693-C697 WeakPolarHBondContact O-CB 3.32Å; L693-C697 PolarHBondContact O-N 3.41Å
694	I	94.1	Very high	92.2	Very high	34 Å²	34	29.4 Å²	29.4	17%	0.174	15%	0.151	C	C	.	.	H	α-helix	trans	-67.2	-39.3	-179	-64.6	171.9	0	0	0	110.9	C543 V546 I690 C697	C543-I694 WeakPolarHBondContact O-CG2 3.3Å; V546-I694 HydrophobicContact CB-CG2 4.35Å; V546-I694 HydrophobicContact CG1-CD1 4.04Å; V546-I694 HydrophobicContact CG1-CG2 4.27Å; I690-I694 HydrophobicContact CG2-CD1 3.65Å; I690-I694 HydrophobicContact CG2-CG1 4.46Å; I690-I694 VanDerWaalsContact O-CG1 3.3Å; I690-I694 WeakPolarHBondContact O-CG1 3.12Å; I690-I694 PolarHBondContact O-N 3.08Å; I694-C697 WeakPolarHBondContact O-CB 3.4Å; I694-C697 PolarHBondContact O-N 2.94Å
695	T	92.8	Very high	92.2	Very high	10 Å²	10	29.4 Å²	29.4	6%	0.061	15%	0.152	C	C	.	.	H	α-helix	trans	-59.1	-50.9	172.5	-66.1	0	0	0	0	111.4	E477 S547 V691 T692 C697 A698 K779	E477-T695 WeakPolarHBondContact OE2-CG2 3.45Å; S547-T695 PolarHBondContact OG-OG1 2.93Å; V691-T695 VanDerWaalsContact O-CB 3.26Å; V691-T695 WeakPolarHBondContact O-CB 3.45Å; V691-T695 PolarHBondContact O-N 3.31Å; V691-T695 PolarHBondContact O-OG1 2.86Å; T692-T695 PolarHBondContact O-N 3.32Å; T695-C697 VanDerWaalsContact C-N 3.28Å; T695-C697 PolarHBondContact O-N 3.38Å; T695-A698 WeakPolarHBondContact O-CB 3.44Å; T695-A698 PolarHBondContact O-N 3.13Å; T695-A698 VanDerWaalsContact O-N 3.13Å; T695-K779 PolarHBondContact OG1-NZ 3.06Å
696	A	93.1	Very high	92	Very high	2 Å²	2	28.7 Å²	28.7	2%	0.017	15%	0.148	C	C	.	.	H	α-helix	trans	-66.3	-30	-176.8	0	0	0	0	0	112.8	A515 I519 T692 L693 A698 Q699	A515-A696 HydrophobicContact CB-CB 4.17Å; A515-A696 WeakPolarHBondContact O-CB 3.29Å; I519-A696 HydrophobicContact CG1-CB 4.18Å; T692-A696 WeakPolarHBondContact O-CB 3.38Å; T692-A696 PolarHBondContact O-N 2.87Å; L693-A696 PolarHBondContact O-N 2.86Å; A696-A698 PolarHBondContact O-N 3.31Å; A696-Q699 PolarHBondContact O-N 3.36Å; A696-Q699 VanDerWaalsContact O-N 3.16Å
697	C	93.8	Very high	91.7	Very high	8 Å²	8	26.7 Å²	26.7	5%	0.054	14%	0.138	C	C	.	.	H	α-helix	trans	-59.7	-26.8	172.9	-168.3	0	0	0	0	113.8	G518 G522 L693 I694 T695	G518-C697 VanDerWaalsContact O-CA 3.27Å; G518-C697 WeakPolarHBondContact O-CA 3.48Å; G522-C697 VanDerWaalsContact CA-SG 3.5Å; L693-C697 WeakPolarHBondContact O-CB 3.32Å; L693-C697 PolarHBondContact O-N 3.41Å; I694-C697 WeakPolarHBondContact O-CB 3.4Å; I694-C697 PolarHBondContact O-N 2.94Å; T695-C697 VanDerWaalsContact C-N 3.28Å; T695-C697 PolarHBondContact O-N 3.38Å
698	A	91.8	Very high	91.5	Very high	9 Å²	9	31.1 Å²	31.1	7%	0.074	15%	0.152	C	C	.	.	H	α-helix	trans	-74.2	-26	176.7	0	0	0	0	0	113.6	C543 T695 A696 S701 A702	C543-A698 HydrophobicContact CB-CB 3.92Å; T695-A698 WeakPolarHBondContact O-CB 3.44Å; T695-A698 PolarHBondContact O-N 3.13Å; T695-A698 VanDerWaalsContact O-N 3.13Å; A696-A698 PolarHBondContact O-N 3.31Å; A698-S701 VanDerWaalsContact O-CB 3.31Å; A698-S701 WeakPolarHBondContact O-CB 3.3Å; A698-S701 PolarHBondContact O-N 2.75Å; A698-S701 VanDerWaalsContact O-N 3.17Å; A698-A702 PolarHBondContact O-N 3.22Å; A698-A702 VanDerWaalsContact O-N 3.15Å
699	Q	91.3	Very high	91.2	Very high	37 Å²	37	32 Å²	32	17%	0.173	16%	0.159	C	C	.	.	H	α-helix	trans	-62.1	-45.9	-169.4	-58.9	-177.4	-0.7	0	0	114.4	Y474 A696 S701 A702 I703	Y474-Q699 HydrophobicContact CE2-CB 4.4Å; Y474-Q699 HydrophobicContact CE2-CG 4.3Å; A696-Q699 PolarHBondContact O-N 3.36Å; A696-Q699 VanDerWaalsContact O-N 3.16Å; Q699-S701 PolarHBondContact O-N 2.69Å; Q699-A702 PolarHBondContact O-N 3.2Å; Q699-I703 WeakPolarHBondContact O-CG1 3.25Å; Q699-I703 PolarHBondContact O-N 3.45Å; Q699-I703 VanDerWaalsContact O-N 3.12Å
700	P	91.1	Very high	90.9	Very high	20 Å²	20	29.1 Å²	29.1	13%	0.13	15%	0.147	C	C	.	.	H	α-helix	trans	-61	-33.2	177.2	-23.1	35	0	0	0	112.8	I519 I526 I704	I519-P700 HydrophobicContact CG2-CG 4.23Å; I519-P700 WeakPolarHBondContact O-CG 3.34Å; I526-P700 HydrophobicContact CD1-CB 3.87Å; P700-I704 WeakPolarHBondContact O-CG1 3.32Å; P700-I704 PolarHBondContact O-N 3.18Å; P700-I704 VanDerWaalsContact O-N 3.07Å
701	S	91.3	Very high	90.5	Very high	0 Å²	0	31.9 Å²	31.9	0%	0	16%	0.163	C	C	.	.	H	α-helix	trans	-66.3	-46.2	177.9	-53.8	0	0	0	0	111.1	I526 A698 Q699 I703 I704 V705	I526-S701 WeakPolarHBondContact CD1-OG 3.43Å; A698-S701 VanDerWaalsContact O-CB 3.31Å; A698-S701 WeakPolarHBondContact O-CB 3.3Å; A698-S701 PolarHBondContact O-N 2.75Å; A698-S701 VanDerWaalsContact O-N 3.17Å; Q699-S701 PolarHBondContact O-N 2.69Å; S701-I703 PolarHBondContact O-N 2.77Å; S701-I704 PolarHBondContact O-N 2.85Å; S701-V705 VanDerWaalsContact O-CG2 3.3Å; S701-V705 WeakPolarHBondContact O-CG2 3.4Å; S701-V705 PolarHBondContact O-N 2.89Å
702	A	89.3	Confident	89.8	Confident	11 Å²	11	38.4 Å²	38.4	9%	0.091	19%	0.193	C	C	.	.	H	α-helix	trans	-62.1	-41.7	177	0	0	0	0	0	112.4	V470 Y474 A698 Q699 V705 T706	V470-A702 HydrophobicContact CG2-CB 4.44Å; Y474-A702 HydrophobicContact CD2-CB 4.13Å; A698-A702 PolarHBondContact O-N 3.22Å; A698-A702 VanDerWaalsContact O-N 3.15Å; Q699-A702 PolarHBondContact O-N 3.2Å; A702-V705 PolarHBondContact O-N 3.28Å; A702-T706 WeakPolarHBondContact O-CB 3.45Å; A702-T706 PolarHBondContact O-N 3.07Å; A702-T706 PolarHBondContact O-OG1 3.25Å
703	I	87.9	Confident	88.9	Confident	62 Å²	62	46.7 Å²	46.7	32%	0.318	23%	0.231	S	C	.	.	H	α-helix	trans	-62.4	-44.6	176.6	-65.9	166.1	0	0	0	110.9	Q699 S701 T706 L707	Q699-I703 WeakPolarHBondContact O-CG1 3.25Å; Q699-I703 PolarHBondContact O-N 3.45Å; Q699-I703 VanDerWaalsContact O-N 3.12Å; S701-I703 PolarHBondContact O-N 2.77Å; I703-T706 WeakPolarHBondContact O-CB 3.32Å; I703-T706 PolarHBondContact O-N 3.33Å; I703-L707 HydrophobicContact CG2-CD1 4.03Å; I703-L707 WeakPolarHBondContact O-CG 3.25Å; I703-L707 PolarHBondContact O-N 2.84Å
704	I	88.6	Confident	88	Confident	53 Å²	53	47.5 Å²	47.5	27%	0.272	23%	0.233	S	C	.	.	H	α-helix	trans	-68.1	-39.7	179.5	-74.6	171.9	0	0	0	111.7	I526 P700 S701 T706 L707 R708	I526-I704 HydrophobicContact CD1-CD1 4.06Å; I526-I704 HydrophobicContact CG2-CD1 3.79Å; P700-I704 WeakPolarHBondContact O-CG1 3.32Å; P700-I704 PolarHBondContact O-N 3.18Å; P700-I704 VanDerWaalsContact O-N 3.07Å; S701-I704 PolarHBondContact O-N 2.85Å; I704-T706 VanDerWaalsContact C-N 3.34Å; I704-L707 PolarHBondContact O-N 2.8Å; I704-R708 HydrophobicContact CG2-CG 4.4Å; I704-R708 WeakPolarHBondContact O-CB 3.4Å; I704-R708 WeakPolarHBondContact O-CG 3.3Å; I704-R708 PolarHBondContact O-N 3.46Å
705	V	90.8	Very high	87.3	Confident	1 Å²	1	48.7 Å²	48.7	1%	0.006	24%	0.236	C	C	.	.	H	α-helix	trans	-60.8	-44.2	172.2	172.9	0	0	0	0	110.8	V470 A537 S701 A702 R708 S709 T789 I793	V470-V705 HydrophobicContact CB-CG1 4.24Å; V470-V705 HydrophobicContact CG2-CB 4.16Å; V470-V705 HydrophobicContact CG2-CG1 3.86Å; A537-V705 HydrophobicContact CB-CG2 3.84Å; S701-V705 VanDerWaalsContact O-CG2 3.3Å; S701-V705 WeakPolarHBondContact O-CG2 3.4Å; S701-V705 PolarHBondContact O-N 2.89Å; A702-V705 PolarHBondContact O-N 3.28Å; V705-R708 PolarHBondContact O-N 3.5Å; V705-S709 WeakPolarHBondContact O-CB 3.39Å; V705-S709 PolarHBondContact O-N 2.91Å; V705-T789 HydrophobicContact CG1-CG2 3.72Å; V705-I793 HydrophobicContact CG1-CD1 3.9Å
706	T	88.8	Confident	86.4	Confident	1 Å²	1	51.2 Å²	51.2	1%	0.006	25%	0.253	C	S	.	.	H	α-helix	trans	-58.4	-51.8	176.4	-52	0	0	0	0	110.9	F467 V470 A702 I703 I704 R708 S709 Q722	F467-T706 HydrophobicContact CD2-CG2 3.78Å; F467-T706 HydrophobicContact CE2-CG2 3.61Å; V470-T706 HydrophobicContact CG1-CG2 4.42Å; V470-T706 WeakPolarHBondContact CG1-OG1 3.29Å; A702-T706 WeakPolarHBondContact O-CB 3.45Å; A702-T706 PolarHBondContact O-N 3.07Å; A702-T706 PolarHBondContact O-OG1 3.25Å; I703-T706 WeakPolarHBondContact O-CB 3.32Å; I703-T706 PolarHBondContact O-N 3.33Å; I704-T706 VanDerWaalsContact C-N 3.34Å; T706-R708 PolarHBondContact O-N 3.5Å; T706-S709 PolarHBondContact O-N 2.89Å; T706-S709 VanDerWaalsContact O-N 3.08Å; T706-S709 PolarHBondContact O-OG 3.12Å; T706-Q722 PolarHBondContact OG1-NE2 3.02Å; T706-Q722 VanDerWaalsContact OG1-NE2 3.07Å
707	L	86.9	Confident	85.7	Confident	52 Å²	52	53.2 Å²	53.2	27%	0.272	26%	0.261	S	S	.	.	H	α-helix	trans	-63.3	-25.8	179.2	-73.5	171.4	0	0	0	114.1	I703 I704 R715 L719	I703-L707 HydrophobicContact CG2-CD1 4.03Å; I703-L707 WeakPolarHBondContact O-CG 3.25Å; I703-L707 PolarHBondContact O-N 2.84Å; I704-L707 PolarHBondContact O-N 2.8Å; L707-R715 HydrophobicContact CD2-CB 4.06Å; L707-R715 HydrophobicContact CD2-CG 4.06Å; L707-R715 PolarHBondContact O-NE 2.68Å; L707-L719 HydrophobicContact CD2-CD1 3.98Å; L707-L719 HydrophobicContact CD2-CD2 4.3Å; L707-L719 HydrophobicContact CD2-CG 4.09Å
708	R	87.6	Confident	85	Confident	167 Å²	167	52.9 Å²	52.9	63%	0.63	26%	0.259	S	S	*	.	H	α-helix	trans	-89.9	-13.2	175.6	-66.9	-69.9	-173	157	3.4	113.5	A533 I704 V705 T706 V710	A533-R708 HydrophobicContact CB-CB 3.81Å; A533-R708 HydrophobicContact CB-CG 4.26Å; I704-R708 HydrophobicContact CG2-CG 4.4Å; I704-R708 WeakPolarHBondContact O-CB 3.4Å; I704-R708 WeakPolarHBondContact O-CG 3.3Å; I704-R708 PolarHBondContact O-N 3.46Å; V705-R708 PolarHBondContact O-N 3.5Å; T706-R708 PolarHBondContact O-N 3.5Å; R708-V710 VanDerWaalsContact C-N 3.34Å
709	S	87.3	Confident	84.5	Confident	20 Å²	20	55.8 Å²	55.8	14%	0.14	27%	0.272	C	S	.	.	H	α-helix	trans	-79.9	-14.2	-179.6	73.2	0	0	0	0	114.3	N464 V705 T706	N464-S709 PolarHBondContact ND2-O 3.47Å; V705-S709 WeakPolarHBondContact O-CB 3.39Å; V705-S709 PolarHBondContact O-N 2.91Å; T706-S709 PolarHBondContact O-N 2.89Å; T706-S709 VanDerWaalsContact O-N 3.08Å; T706-S709 PolarHBondContact O-OG 3.12Å
710	V	88	Confident	83.9	Confident	13 Å²	13	55.7 Å²	55.7	8%	0.079	28%	0.281	C	S	.	.	S	Bend	trans	-130.3	156.9	-176.4	-62.3	0	0	0	0	111.7	I461 F467 R708 R715 A718	I461-V710 HydrophobicContact CG2-CG1 4.35Å; F467-V710 HydrophobicContact CB-CG1 4.39Å; F467-V710 HydrophobicContact CD2-CG1 4.16Å; F467-V710 HydrophobicContact CG-CG1 4.45Å; R708-V710 VanDerWaalsContact C-N 3.34Å; V710-R715 HydrophobicContact CG2-CB 4.41Å; V710-R715 HydrophobicContact CG2-CG 3.8Å; V710-A718 HydrophobicContact CB-CB 4.4Å; V710-A718 HydrophobicContact CG1-CB 4.05Å; V710-A718 HydrophobicContact CG2-CB 3.76Å
711	D	84.5	Confident	83.5	Confident	123 Å²	123	56.1 Å²	56.1	66%	0.658	28%	0.282	S	S	*	.			trans	-64.9	152.7	179.1	-72.9	-54.7	0	0	0	113.1	Q713 E714 R715	D711-Q713 PolarHBondContact O-N 2.88Å; D711-E714 PolarHBondContact O-N 3.5Å; D711-R715 PolarHBondContact O-N 2.89Å; D711-R715 VanDerWaalsContact O-N 3.09Å
712	E	78.9	Confident	83.3	Confident	138 Å²	138	56.5 Å²	56.5	65%	0.645	28%	0.284	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.1	-31.8	-171.3	-49.9	-129.8	124.7	0	0	113.3	R715	E712-R715 IonicContact OE1-CZ 3.12Å; E712-R715 IonicContact OE1-NH1 2.69Å; E712-R715 PolarHBondContact OE1-NH1 2.87Å; E712-R715 IonicContact OE1-NH2 2.73Å; E712-R715 PolarHBondContact OE1-NH2 2.94Å; E712-R715 IonicContact OE2-NH1 3.86Å
713	Q	75	Confident	83.1	Confident	188 Å²	188	60.1 Å²	60.1	88%	0.879	30%	0.298	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.2	-27.5	179.5	-55.6	-176.7	21	0	0	112.8	D711	D711-Q713 PolarHBondContact O-N 2.88Å
714	E	75.1	Confident	83	Confident	48 Å²	48	60 Å²	60	22%	0.224	30%	0.3	C	S	.	.	T	Hydrogen-bonded Turn	trans	-93.5	-17.9	-178.3	-67.1	-165.6	162.8	0	0	112.6	R460 I461 D711 P716 F717 A718	R460-E714 IonicContact NH1-OE1 3.08Å; R460-E714 PolarHBondContact NH1-OE1 3.47Å; R460-E714 VanDerWaalsContact NH1-OE1 3.08Å; I461-E714 HydrophobicContact CD1-CB 4.01Å; I461-E714 WeakPolarHBondContact CG1-OE2 3.07Å; D711-E714 PolarHBondContact O-N 3.5Å; E714-P716 VanDerWaalsContact C-CD 3.5Å; E714-F717 PolarHBondContact O-N 3.42Å; E714-A718 PolarHBondContact O-N 3Å
715	R	79.8	Confident	83	Confident	60 Å²	60	58.5 Å²	58.5	23%	0.226	29%	0.292	C	S	.	.	H	α-helix	trans	-42.5	-49.5	179.8	-77.3	176.6	-173.3	146.8	11.6	116.1	L707 V710 D711 E712 F717 A718 L719	L707-R715 HydrophobicContact CD2-CB 4.06Å; L707-R715 HydrophobicContact CD2-CG 4.06Å; L707-R715 PolarHBondContact O-NE 2.68Å; V710-R715 HydrophobicContact CG2-CB 4.41Å; V710-R715 HydrophobicContact CG2-CG 3.8Å; D711-R715 PolarHBondContact O-N 2.89Å; D711-R715 VanDerWaalsContact O-N 3.09Å; E712-R715 IonicContact OE1-CZ 3.12Å; E712-R715 IonicContact OE1-NH1 2.69Å; E712-R715 PolarHBondContact OE1-NH1 2.87Å; E712-R715 IonicContact OE1-NH2 2.73Å; E712-R715 PolarHBondContact OE1-NH2 2.94Å; E712-R715 IonicContact OE2-NH1 3.86Å; R715-F717 VanDerWaalsContact C-N 3.3Å; R715-F717 PolarHBondContact O-N 3.24Å; R715-A718 PolarHBondContact O-N 3.47Å; R715-L719 PolarHBondContact O-N 3.21Å
716	P	74.8	Confident	83	Confident	63 Å²	63	58.9 Å²	58.9	41%	0.409	29%	0.294	S	S	.	.	H	α-helix	trans	-68.5	-31.6	-177.6	-18.1	32.9	0	0	0	112.4	M445 E714 G720	M445-P716 HydrophobicContact CE-CB 3.76Å; M445-P716 HydrophobicContact CE-CG 4.45Å; M445-P716 HydrophobicContact SD-CB 4.02Å; M445-P716 HydrophobicContact SD-CG 4.37Å; E714-P716 VanDerWaalsContact C-CD 3.5Å; P716-G720 PolarHBondContact O-N 3.04Å; P716-G720 VanDerWaalsContact O-N 3.11Å
717	F	77.7	Confident	83	Confident	43 Å²	43	59.7 Å²	59.7	19%	0.189	30%	0.297	C	S	.	.	H	α-helix	trans	-77.4	-35.7	177.2	177.1	-122.3	0	0	0	111.4	F447 L454 A457 A458 I461 E714 R715 G720 M721	F447-F717 HydrophobicContact CE2-CD2 4.2Å; F447-F717 HydrophobicContact CE2-CE2 4.5Å; L454-F717 HydrophobicContact CD1-CE2 3.66Å; L454-F717 HydrophobicContact CD1-CZ 4.07Å; A457-F717 HydrophobicContact CB-CD1 4.4Å; A457-F717 HydrophobicContact CB-CE1 3.55Å; A457-F717 HydrophobicContact CB-CZ 4.05Å; A458-F717 HydrophobicContact CB-CZ 4.09Å; I461-F717 HydrophobicContact CD1-CD1 3.45Å; I461-F717 VanDerWaalsContact CD1-CD1 3.45Å; I461-F717 HydrophobicContact CD1-CE1 3.85Å; I461-F717 HydrophobicContact CD1-CG 4.46Å; E714-F717 PolarHBondContact O-N 3.42Å; R715-F717 VanDerWaalsContact C-N 3.3Å; R715-F717 PolarHBondContact O-N 3.24Å; F717-G720 PolarHBondContact O-N 3.17Å; F717-M721 PolarHBondContact O-N 3.09Å
718	A	79.7	Confident	83.2	Confident	1 Å²	1	60.3 Å²	60.3	1%	0.008	30%	0.303	C	S	.	.	H	α-helix	trans	-61.3	-44.5	170.6	0	0	0	0	0	112.4	I461 F467 V710 E714 R715 G720 M721 Q722	I461-A718 HydrophobicContact CD1-CB 4.28Å; I461-A718 HydrophobicContact CG2-CB 4.21Å; F467-A718 HydrophobicContact CD2-CB 4.27Å; F467-A718 HydrophobicContact CE2-CB 3.77Å; F467-A718 HydrophobicContact CZ-CB 4.36Å; F467-A718 WeakPolarHBondContact CZ-O 3.22Å; V710-A718 HydrophobicContact CB-CB 4.4Å; V710-A718 HydrophobicContact CG1-CB 4.05Å; V710-A718 HydrophobicContact CG2-CB 3.76Å; E714-A718 PolarHBondContact O-N 3Å; R715-A718 PolarHBondContact O-N 3.47Å; A718-G720 VanDerWaalsContact C-N 3.33Å; A718-G720 PolarHBondContact O-N 2.92Å; A718-M721 PolarHBondContact O-N 3.5Å; A718-Q722 WeakPolarHBondContact O-CB 3.32Å; A718-Q722 PolarHBondContact O-N 3.43Å
719	L	80.3	Confident	83.5	Confident	70 Å²	70	56.6 Å²	56.6	37%	0.366	30%	0.295	S	S	.	.	H	α-helix	trans	-61.2	-40.7	171.8	-73.3	-178.4	0	0	0	112.1	L707 R715 Q722 F723	L707-L719 HydrophobicContact CD2-CD1 3.98Å; L707-L719 HydrophobicContact CD2-CD2 4.3Å; L707-L719 HydrophobicContact CD2-CG 4.09Å; R715-L719 PolarHBondContact O-N 3.21Å; L719-Q722 PolarHBondContact O-N 3.47Å; L719-F723 PolarHBondContact O-N 2.86Å
720	G	78.6	Confident	83.8	Confident	35 Å²	35	55.6 Å²	55.6	36%	0.361	29%	0.288	S	S	.	.	H	α-helix	trans	-61.8	-43.1	174.9	0	0	0	0	0	113	P716 F717 A718 F723 V724	P716-G720 PolarHBondContact O-N 3.04Å; P716-G720 VanDerWaalsContact O-N 3.11Å; F717-G720 PolarHBondContact O-N 3.17Å; A718-G720 VanDerWaalsContact C-N 3.33Å; A718-G720 PolarHBondContact O-N 2.92Å; G720-F723 PolarHBondContact O-N 3.07Å; G720-V724 WeakPolarHBondContact O-CG2 3.36Å; G720-V724 PolarHBondContact O-N 2.83Å; G720-V724 VanDerWaalsContact O-N 3.09Å
721	M	83.3	Confident	84.1	Confident	29 Å²	29	57.7 Å²	57.7	14%	0.143	30%	0.295	C	S	.	.	H	α-helix	trans	-64.7	-42.2	175	-172.2	66.6	-120.6	0	0	111.5	A458 L462 F467 F717 A718 F723 V724 L725	A458-M721 HydrophobicContact CB-SD 4.15Å; L462-M721 HydrophobicContact CD1-CE 4.18Å; L462-M721 HydrophobicContact CD1-SD 4.19Å; L462-M721 HydrophobicContact CD2-CE 4.37Å; L462-M721 HydrophobicContact CD2-CG 4.05Å; L462-M721 HydrophobicContact CG-CG 4.28Å; L462-M721 HydrophobicContact CG-SD 4.49Å; F467-M721 HydrophobicContact CE1-CG 4.43Å; F467-M721 HydrophobicContact CZ-CB 4.39Å; F717-M721 PolarHBondContact O-N 3.09Å; A718-M721 PolarHBondContact O-N 3.5Å; M721-F723 VanDerWaalsContact C-N 3.34Å; M721-F723 PolarHBondContact O-N 2.66Å; M721-V724 HydrophobicContact CE-CB 4.27Å; M721-V724 HydrophobicContact CE-CG1 4.19Å; M721-V724 PolarHBondContact O-N 3.09Å; M721-L725 HydrophobicContact CE-CD2 4.02Å; M721-L725 HydrophobicContact CE-CG 3.92Å; M721-L725 WeakPolarHBondContact O-CG 3.48Å; M721-L725 PolarHBondContact O-N 3.49Å
722	Q	86.1	Confident	84.6	Confident	8 Å²	8	53.2 Å²	53.2	4%	0.037	27%	0.271	C	S	.	.	H	α-helix	trans	-60.4	-42.9	174.7	-172	175.8	50.6	0	0	111.3	F467 Y474 T706 A718 L719 V724 L725 L726	F467-Q722 HydrophobicContact CE2-CB 4.44Å; F467-Q722 HydrophobicContact CZ-CB 4.17Å; Y474-Q722 HydrophobicContact CD1-CG 4.38Å; T706-Q722 PolarHBondContact OG1-NE2 3.02Å; T706-Q722 VanDerWaalsContact OG1-NE2 3.07Å; A718-Q722 WeakPolarHBondContact O-CB 3.32Å; A718-Q722 PolarHBondContact O-N 3.43Å; L719-Q722 PolarHBondContact O-N 3.47Å; Q722-V724 VanDerWaalsContact C-N 3.34Å; Q722-V724 PolarHBondContact O-N 3.22Å; Q722-L725 WeakPolarHBondContact O-CB 3.46Å; Q722-L725 PolarHBondContact O-N 2.94Å; Q722-L726 HydrophobicContact CG-CD1 4.38Å; Q722-L726 VanDerWaalsContact O-CG 3.27Å; Q722-L726 WeakPolarHBondContact O-CG 3.29Å; Q722-L726 PolarHBondContact O-N 3.33Å
723	F	85	Confident	85.4	Confident	88 Å²	88	48.6 Å²	48.6	39%	0.386	25%	0.253	S	S	.	.	H	α-helix	trans	-63.7	-36	176.2	-174.1	-107.8	0	0	0	113.2	L719 G720 M721 R727	L719-F723 PolarHBondContact O-N 2.86Å; G720-F723 PolarHBondContact O-N 3.07Å; M721-F723 VanDerWaalsContact C-N 3.34Å; M721-F723 PolarHBondContact O-N 2.66Å; F723-R727 HydrophobicContact CZ-CG 4.42Å; F723-R727 PolarHBondContact O-N 3.4Å; F723-R727 VanDerWaalsContact O-N 3.15Å
724	V	85.8	Confident	86.4	Confident	59 Å²	59	39.6 Å²	39.6	36%	0.358	21%	0.211	S	C	.	.	H	α-helix	trans	-63.5	-49.2	171.4	172.3	0	0	0	0	110.6	G720 M721 Q722 L726 R727 T728	G720-V724 WeakPolarHBondContact O-CG2 3.36Å; G720-V724 PolarHBondContact O-N 2.83Å; G720-V724 VanDerWaalsContact O-N 3.09Å; M721-V724 HydrophobicContact CE-CB 4.27Å; M721-V724 HydrophobicContact CE-CG1 4.19Å; M721-V724 PolarHBondContact O-N 3.09Å; Q722-V724 VanDerWaalsContact C-N 3.34Å; Q722-V724 PolarHBondContact O-N 3.22Å; V724-L726 VanDerWaalsContact C-N 3.34Å; V724-L726 PolarHBondContact O-N 3.32Å; V724-R727 PolarHBondContact O-N 3.44Å; V724-T728 HydrophobicContact CG1-CG2 4.45Å; V724-T728 PolarHBondContact O-N 2.96Å; V724-T728 PolarHBondContact O-OG1 2.91Å
725	L	89.2	Confident	87.4	Confident	22 Å²	22	37.3 Å²	37.3	12%	0.115	20%	0.2	C	C	.	.	H	α-helix	trans	-55.9	-47.1	177.1	-69	173.7	0	0	0	111.8	L462 M721 Q722 R727 T728 L729	L462-L725 HydrophobicContact CD2-CD1 4Å; M721-L725 HydrophobicContact CE-CD2 4.02Å; M721-L725 HydrophobicContact CE-CG 3.92Å; M721-L725 WeakPolarHBondContact O-CG 3.48Å; M721-L725 PolarHBondContact O-N 3.49Å; Q722-L725 WeakPolarHBondContact O-CB 3.46Å; Q722-L725 PolarHBondContact O-N 2.94Å; L725-R727 VanDerWaalsContact C-N 3.35Å; L725-R727 PolarHBondContact O-N 3.17Å; L725-T728 PolarHBondContact O-N 3.19Å; L725-T728 PolarHBondContact O-OG1 3.01Å; L725-L729 HydrophobicContact CD2-CD1 4.11Å; L725-L729 VanDerWaalsContact O-CB 3.28Å; L725-L729 WeakPolarHBondContact O-CB 3.28Å; L725-L729 PolarHBondContact O-N 2.92Å
726	L	90.2	Very high	88.1	Confident	8 Å²	8	37.2 Å²	37.2	4%	0.042	20%	0.204	C	C	.	.	H	α-helix	trans	-57.5	-45.3	178.2	-71.1	171.6	0	0	0	111.9	Y474 C478 Q722 V724 A730 Y731	Y474-L726 HydrophobicContact CD1-CD1 3.94Å; Y474-L726 HydrophobicContact CD1-CD2 3.97Å; Y474-L726 HydrophobicContact CD1-CG 4.44Å; Y474-L726 HydrophobicContact CE1-CD1 3.69Å; Y474-L726 HydrophobicContact CE1-CD2 4.36Å; C478-L726 HydrophobicContact CB-CD2 3.78Å; Q722-L726 HydrophobicContact CG-CD1 4.38Å; Q722-L726 VanDerWaalsContact O-CG 3.27Å; Q722-L726 WeakPolarHBondContact O-CG 3.29Å; Q722-L726 PolarHBondContact O-N 3.33Å; V724-L726 VanDerWaalsContact C-N 3.34Å; V724-L726 PolarHBondContact O-N 3.32Å; L726-A730 CarbonylContact O-C 3.59Å; L726-A730 WeakPolarHBondContact O-CA 3.48Å; L726-A730 VanDerWaalsContact O-CB 3.26Å; L726-A730 WeakPolarHBondContact O-CB 3.47Å; L726-A730 PolarHBondContact O-N 2.92Å; L726-Y731 PolarHBondContact O-N 3.38Å
727	R	90.5	Very high	89.1	Confident	19 Å²	19	37.5 Å²	37.5	7%	0.072	20%	0.197	C	C	.	.	I	π-helix	trans	-66.6	-45.6	178.5	-77.5	-174.9	146.9	-176.7	-14.1	112.7	D207 S210 L211 F723 V724 L725 Y731 I732	D207-R727 IonicContact OD1-CZ 3.17Å; D207-R727 IonicContact OD1-NE 2.7Å; D207-R727 PolarHBondContact OD1-NE 2.94Å; D207-R727 IonicContact OD1-NH2 2.75Å; D207-R727 PolarHBondContact OD1-NH2 3.17Å; S210-R727 PolarHBondContact OG-NH1 2.92Å; S210-R727 PolarHBondContact OG-NH2 3.08Å; L211-R727 HydrophobicContact CD1-CB 4.06Å; L211-R727 HydrophobicContact CD2-CB 3.97Å; L211-R727 HydrophobicContact CD2-CG 4.45Å; L211-R727 HydrophobicContact CG-CB 4.19Å; F723-R727 HydrophobicContact CZ-CG 4.42Å; F723-R727 PolarHBondContact O-N 3.4Å; F723-R727 VanDerWaalsContact O-N 3.15Å; V724-R727 PolarHBondContact O-N 3.44Å; L725-R727 VanDerWaalsContact C-N 3.35Å; L725-R727 PolarHBondContact O-N 3.17Å; R727-Y731 HydrophobicContact CG-CD2 3.82Å; R727-Y731 HydrophobicContact CG-CE2 4.37Å; R727-I732 WeakPolarHBondContact O-CB 3.46Å; R727-I732 WeakPolarHBondContact O-CG1 3.38Å; R727-I732 PolarHBondContact O-N 2.81Å; R727-I732 VanDerWaalsContact O-N 3.1Å
728	T	91	Very high	90	Very high	64 Å²	64	35.4 Å²	35.4	39%	0.393	19%	0.188	S	C	.	.	I	π-helix	trans	-74.7	-31.9	-176.5	53.1	0	0	0	0	114	L211 V724 L725 P733	L211-T728 HydrophobicContact CD1-CG2 3.96Å; V724-T728 HydrophobicContact CG1-CG2 4.45Å; V724-T728 PolarHBondContact O-N 2.96Å; V724-T728 PolarHBondContact O-OG1 2.91Å; L725-T728 PolarHBondContact O-N 3.19Å; L725-T728 PolarHBondContact O-OG1 3.01Å; T728-P733 WeakPolarHBondContact O-CD 3.41Å
729	L	93.2	Very high	90.7	Very high	89 Å²	89	35.4 Å²	35.4	47%	0.466	19%	0.187	S	C	.	.	I	π-helix	trans	-111.2	-20.1	-171.3	-59.5	178.2	0	0	0	114.2	T475 L725 P733	T475-L729 HydrophobicContact CG2-CB 3.59Å; L725-L729 HydrophobicContact CD2-CD1 4.11Å; L725-L729 VanDerWaalsContact O-CB 3.28Å; L725-L729 WeakPolarHBondContact O-CB 3.28Å; L725-L729 PolarHBondContact O-N 2.92Å; L729-P733 VanDerWaalsContact O-CG 3.28Å; L729-P733 WeakPolarHBondContact O-CG 3.35Å
730	A	94.3	Very high	91.4	Very high	0 Å²	0	34.1 Å²	34.1	0%	0	19%	0.187	C	C	.	.	I	π-helix	trans	-110.2	-68.5	172.2	0	0	0	0	0	111.5	T475 C478 A479 L726 I732 P733 T734	T475-A730 HydrophobicContact CG2-CB 3.89Å; T475-A730 WeakPolarHBondContact O-CB 3.33Å; C478-A730 HydrophobicContact CB-CB 4.28Å; A479-A730 HydrophobicContact CB-CB 4.02Å; L726-A730 CarbonylContact O-C 3.59Å; L726-A730 WeakPolarHBondContact O-CA 3.48Å; L726-A730 VanDerWaalsContact O-CB 3.26Å; L726-A730 WeakPolarHBondContact O-CB 3.47Å; L726-A730 PolarHBondContact O-N 2.92Å; A730-I732 PolarHBondContact O-N 3.29Å; A730-P733 WeakPolarHBondContact O-CD 3.27Å; A730-T734 WeakPolarHBondContact O-CB 3.35Å; A730-T734 PolarHBondContact O-N 3.4Å; A730-T734 PolarHBondContact O-OG1 3.37Å
731	Y	92.7	Very high	92.2	Very high	56 Å²	56	34.4 Å²	34.4	22%	0.22	18%	0.182	C	C	.	.	I	π-helix	trans	-65.6	-39.8	-162.3	-58.8	-15.4	0	0	0	114	D207 C478 T482 L726 R727 P735	D207-Y731 WeakPolarHBondContact OD2-CB 3.41Å; C478-Y731 HydrophobicContact CB-CE1 3.99Å; T482-Y731 WeakPolarHBondContact OG1-CD1 3.13Å; T482-Y731 WeakPolarHBondContact OG1-CE1 3.47Å; L726-Y731 PolarHBondContact O-N 3.38Å; R727-Y731 HydrophobicContact CG-CD2 3.82Å; R727-Y731 HydrophobicContact CG-CE2 4.37Å; Y731-P735 WeakPolarHBondContact O-CD 3.41Å
732	I	94.9	Very high	92.7	Very high	30 Å²	30	33 Å²	33	15%	0.154	18%	0.175	C	C	.	.	T	Hydrogen-bonded Turn	trans	-73.5	-52.4	178.4	-67.2	169.4	0	0	0	113	S204 D207 I208 L211 R727 A730 I736	S204-I732 VanDerWaalsContact CB-O 3.29Å; S204-I732 WeakPolarHBondContact CB-O 3.19Å; S204-I732 PolarHBondContact OG-O 2.91Å; D207-I732 HydrophobicContact CB-CD1 4.31Å; D207-I732 HydrophobicContact CB-CG1 3.77Å; I208-I732 HydrophobicContact CD1-CG2 4.16Å; I208-I732 HydrophobicContact CG1-CD1 3.77Å; I208-I732 HydrophobicContact CG1-CG1 4.01Å; I208-I732 HydrophobicContact CG1-CG2 4.02Å; L211-I732 HydrophobicContact CD1-CD1 3.59Å; R727-I732 WeakPolarHBondContact O-CB 3.46Å; R727-I732 WeakPolarHBondContact O-CG1 3.38Å; R727-I732 PolarHBondContact O-N 2.81Å; R727-I732 VanDerWaalsContact O-N 3.1Å; A730-I732 PolarHBondContact O-N 3.29Å; I732-I736 WeakPolarHBondContact O-CD1 3.17Å
733	P	96	Very high	93	Very high	40 Å²	40	33.3 Å²	33.3	26%	0.26	18%	0.177	S	C	.	.	H	α-helix	trans	-72.9	-30.9	-176.6	26.8	-35.4	0	0	0	113.7	T728 L729 A730 I736 Y737	T728-P733 WeakPolarHBondContact O-CD 3.41Å; L729-P733 VanDerWaalsContact O-CG 3.28Å; L729-P733 WeakPolarHBondContact O-CG 3.35Å; A730-P733 WeakPolarHBondContact O-CD 3.27Å; P733-I736 PolarHBondContact O-N 3.1Å; P733-Y737 VanDerWaalsContact C-CD1 3.49Å; P733-Y737 HydrophobicContact CB-CD1 4.06Å; P733-Y737 HydrophobicContact CB-CE1 4.15Å; P733-Y737 WeakPolarHBondContact O-CD1 3.19Å; P733-Y737 PolarHBondContact O-N 3.02Å
734	T	96.3	Very high	93.4	Very high	0 Å²	0	34.4 Å²	34.4	0%	0	19%	0.191	C	C	.	.	H	α-helix	trans	-61	-53.5	-168.4	-62.6	0	0	0	0	114.3	A479 T482 A483 A730 I736 Y737 F738	A479-T734 HydrophobicContact CB-CG2 4.32Å; A479-T734 WeakPolarHBondContact CB-OG1 3.37Å; A479-T734 WeakPolarHBondContact O-CG2 3.09Å; T482-T734 HydrophobicContact CG2-CG2 4.32Å; A483-T734 HydrophobicContact CB-CG2 3.71Å; A730-T734 WeakPolarHBondContact O-CB 3.35Å; A730-T734 PolarHBondContact O-N 3.4Å; A730-T734 PolarHBondContact O-OG1 3.37Å; T734-I736 PolarHBondContact O-N 3.25Å; T734-Y737 VanDerWaalsContact CA-CE1 3.41Å; T734-Y737 PolarHBondContact O-N 3.29Å; T734-Y737 PolarHBondContact OG1-OH 3.36Å; T734-F738 HydrophobicContact CG2-CD2 3.6Å; T734-F738 HydrophobicContact CG2-CE2 3.93Å; T734-F738 WeakPolarHBondContact O-CB 3.46Å; T734-F738 PolarHBondContact O-N 2.97Å
735	P	95.5	Very high	93.6	Very high	0 Å²	0	32 Å²	32	0%	0	18%	0.176	C	C	.	.	H	α-helix	trans	-56.8	-37.7	177.8	-27.2	37.4	0	0	0	112.6	G200 V203 T482 T486 F487 Y731 G739	G200-P735 VanDerWaalsContact O-CB 3.23Å; G200-P735 WeakPolarHBondContact O-CB 3.24Å; V203-P735 HydrophobicContact CB-CB 4.29Å; V203-P735 HydrophobicContact CB-CG 4.34Å; V203-P735 HydrophobicContact CG1-CG 4.12Å; T482-P735 HydrophobicContact CG2-CG 3.88Å; T486-P735 HydrophobicContact CG2-CB 4.33Å; F487-P735 WeakPolarHBondContact CE2-O 3.48Å; Y731-P735 WeakPolarHBondContact O-CD 3.41Å; P735-G739 PolarHBondContact O-N 2.91Å
736	I	95.9	Very high	93.6	Very high	58 Å²	58	31.2 Å²	31.2	30%	0.297	17%	0.173	S	C	.	.	H	α-helix	trans	-67	-51.7	-178.2	-55.7	170	0	0	0	110.8	L201 I732 P733 T734 G739 A740	L201-I736 HydrophobicContact CB-CG1 4.32Å; L201-I736 HydrophobicContact CD1-CD1 3.86Å; L201-I736 HydrophobicContact CD1-CG1 4.37Å; I732-I736 WeakPolarHBondContact O-CD1 3.17Å; P733-I736 PolarHBondContact O-N 3.1Å; T734-I736 PolarHBondContact O-N 3.25Å; I736-G739 PolarHBondContact O-N 2.93Å; I736-A740 PolarHBondContact O-N 3.23Å
737	Y	95.9	Very high	93.2	Very high	68 Å²	68	32.9 Å²	32.9	27%	0.267	18%	0.18	S	C	.	.	H	α-helix	trans	-77.7	-31.1	-177.1	74.4	-111.8	0	0	0	113.2	P733 T734 V741 L774 L778	P733-Y737 VanDerWaalsContact C-CD1 3.49Å; P733-Y737 HydrophobicContact CB-CD1 4.06Å; P733-Y737 HydrophobicContact CB-CE1 4.15Å; P733-Y737 WeakPolarHBondContact O-CD1 3.19Å; P733-Y737 PolarHBondContact O-N 3.02Å; T734-Y737 VanDerWaalsContact CA-CE1 3.41Å; T734-Y737 PolarHBondContact O-N 3.29Å; T734-Y737 PolarHBondContact OG1-OH 3.36Å; Y737-V741 WeakPolarHBondContact O-CB 3.19Å; Y737-V741 WeakPolarHBondContact O-CG2 3.46Å; Y737-V741 PolarHBondContact O-N 3.3Å; Y737-L774 HydrophobicContact CD2-CD2 3.86Å; Y737-L774 HydrophobicContact CE2-CD1 4.26Å; Y737-L774 HydrophobicContact CE2-CD2 3.85Å; Y737-L774 HydrophobicContact CE2-CG 4.24Å; Y737-L778 HydrophobicContact CE2-CD1 4.29Å; Y737-L778 WeakPolarHBondContact OH-CD1 3.31Å
738	F	96.4	Very high	92.5	Very high	0 Å²	0	33 Å²	33	0%	0	18%	0.182	C	C	.	.	H	α-helix	trans	-65.7	-41.3	168.8	-92.5	-91.6	0	0	0	110.8	A483 F487 T734 V741 I742 Y771 L774 A775 L778	A483-F738 HydrophobicContact CB-CD1 3.87Å; A483-F738 HydrophobicContact CB-CD2 3.5Å; A483-F738 VanDerWaalsContact CB-CD2 3.5Å; A483-F738 HydrophobicContact CB-CE1 3.84Å; A483-F738 HydrophobicContact CB-CE2 3.46Å; A483-F738 VanDerWaalsContact CB-CE2 3.46Å; A483-F738 HydrophobicContact CB-CG 3.7Å; A483-F738 HydrophobicContact CB-CZ 3.63Å; F487-F738 HydrophobicContact CD2-CB 3.96Å; F487-F738 HydrophobicContact CE2-CB 3.9Å; T734-F738 HydrophobicContact CG2-CD2 3.6Å; T734-F738 HydrophobicContact CG2-CE2 3.93Å; T734-F738 WeakPolarHBondContact O-CB 3.46Å; T734-F738 PolarHBondContact O-N 2.97Å; F738-V741 PolarHBondContact O-N 2.91Å; F738-I742 VanDerWaalsContact O-CG1 3.26Å; F738-I742 WeakPolarHBondContact O-CG1 3.29Å; F738-I742 PolarHBondContact O-N 3.22Å; F738-Y771 AromaticContact CD1-CD2 3.73Å; F738-Y771 HydrophobicContact CD1-CD2 3.73Å; F738-Y771 AromaticContact CD1-CE2 3.67Å; F738-Y771 HydrophobicContact CD1-CE2 3.67Å; F738-Y771 HydrophobicContact CE1-CD2 4.03Å; F738-Y771 HydrophobicContact CE1-CE2 4.04Å; F738-L774 HydrophobicContact CD1-CD2 3.92Å; F738-L774 HydrophobicContact CD2-CD2 4.01Å; F738-L774 HydrophobicContact CE1-CB 4.27Å; F738-L774 HydrophobicContact CE1-CD2 3.81Å; F738-L774 HydrophobicContact CE1-CG 4.08Å; F738-L774 HydrophobicContact CE2-CD2 3.9Å; F738-L774 HydrophobicContact CE2-CG 4.06Å; F738-L774 HydrophobicContact CG-CD2 4.03Å; F738-L774 HydrophobicContact CZ-CB 4.27Å; F738-L774 HydrophobicContact CZ-CD2 3.8Å; F738-L774 HydrophobicContact CZ-CG 3.75Å; F738-A775 HydrophobicContact CZ-CB 4.33Å; F738-L778 HydrophobicContact CE2-CD1 3.76Å; F738-L778 HydrophobicContact CZ-CD1 4.04Å
739	G	94.6	Very high	92.1	Very high	0 Å²	0	32.2 Å²	32.2	0%	0	17%	0.172	C	C	.	.	H	α-helix	trans	-56.6	-51.8	172.6	0	0	0	0	0	112.1	S196 P735 I736 V741 I742 D743	S196-G739 VanDerWaalsContact C-CA 3.45Å; S196-G739 WeakPolarHBondContact CB-O 3.41Å; S196-G739 VanDerWaalsContact O-CA 3.31Å; S196-G739 WeakPolarHBondContact O-CA 3.25Å; P735-G739 PolarHBondContact O-N 2.91Å; I736-G739 PolarHBondContact O-N 2.93Å; G739-V741 PolarHBondContact O-N 2.75Å; G739-I742 WeakPolarHBondContact O-CB 3.23Å; G739-I742 PolarHBondContact O-N 3.41Å; G739-D743 PolarHBondContact O-N 2.81Å
740	A	94.3	Very high	91.2	Very high	43 Å²	43	29.2 Å²	29.2	36%	0.355	16%	0.156	S	C	.	.	H	α-helix	trans	-58.7	-33.7	176.9	0	0	0	0	0	113.4	I736 D743 T744	I736-A740 PolarHBondContact O-N 3.23Å; A740-D743 PolarHBondContact O-N 3.18Å; A740-T744 PolarHBondContact O-N 3.23Å
741	V	94.9	Very high	89.9	Confident	42 Å²	42	33 Å²	33	26%	0.255	17%	0.174	S	C	.	.	H	α-helix	trans	-77.8	-23.8	176.1	166.5	0	0	0	0	113	Y737 F738 G739 T744 V770 L774	Y737-V741 WeakPolarHBondContact O-CB 3.19Å; Y737-V741 WeakPolarHBondContact O-CG2 3.46Å; Y737-V741 PolarHBondContact O-N 3.3Å; F738-V741 PolarHBondContact O-N 2.91Å; G739-V741 PolarHBondContact O-N 2.75Å; V741-T744 PolarHBondContact O-OG1 2.9Å; V741-V770 HydrophobicContact CG1-CB 3.75Å; V741-V770 HydrophobicContact CG1-CG2 3.58Å; V741-L774 HydrophobicContact CB-CD2 4.25Å; V741-L774 HydrophobicContact CG1-CD2 4.16Å; V741-L774 HydrophobicContact CG2-CD2 4.14Å
742	I	94.3	Very high	88.5	Confident	0 Å²	0	33.8 Å²	33.8	0%	0	18%	0.182	C	C	.	.	H	α-helix	trans	-71.7	-44.8	168.3	-66.6	164.6	0	0	0	109.4	S196 F487 F738 G739 T744 T745 Y762 F767 Y771	S196-I742 WeakPolarHBondContact OG-CG2 3.32Å; F487-I742 HydrophobicContact CB-CD1 3.91Å; F487-I742 HydrophobicContact CD1-CD1 3.85Å; F487-I742 HydrophobicContact CD2-CD1 3.85Å; F487-I742 HydrophobicContact CE1-CD1 4.29Å; F487-I742 HydrophobicContact CE2-CD1 4.28Å; F487-I742 HydrophobicContact CG-CD1 3.61Å; F487-I742 HydrophobicContact CZ-CD1 4.49Å; F738-I742 VanDerWaalsContact O-CG1 3.26Å; F738-I742 WeakPolarHBondContact O-CG1 3.29Å; F738-I742 PolarHBondContact O-N 3.22Å; G739-I742 WeakPolarHBondContact O-CB 3.23Å; G739-I742 PolarHBondContact O-N 3.41Å; I742-T744 VanDerWaalsContact C-N 3.31Å; I742-T744 PolarHBondContact O-N 2.93Å; I742-T745 PolarHBondContact O-N 3.08Å; I742-T745 PolarHBondContact O-OG1 2.94Å; I742-Y762 HydrophobicContact CG2-CD1 4.16Å; I742-Y762 HydrophobicContact CG2-CE1 3.52Å; I742-F767 HydrophobicContact CB-CE2 4.44Å; I742-F767 HydrophobicContact CD1-CE2 4.23Å; I742-F767 HydrophobicContact CD1-CZ 4.42Å; I742-F767 HydrophobicContact CG1-CD2 4.36Å; I742-F767 HydrophobicContact CG1-CE2 3.67Å; I742-F767 HydrophobicContact CG1-CZ 4.15Å; I742-F767 HydrophobicContact CG2-CE1 4.38Å; I742-F767 HydrophobicContact CG2-CE2 4.15Å; I742-F767 HydrophobicContact CG2-CZ 3.97Å; I742-Y771 HydrophobicContact CD1-CD2 4.38Å; I742-Y771 HydrophobicContact CD1-CE2 4.39Å; I742-Y771 HydrophobicContact CG1-CD2 4.36Å
743	D	93.1	Very high	86.8	Confident	14 Å²	14	34.6 Å²	34.6	8%	0.075	19%	0.19	C	C	.	.	H	α-helix	trans	-58.7	-34.5	-179.2	-71.5	-28.3	0	0	0	113.5	S196 S197 G739 A740 T745 C746 W749	S196-D743 WeakPolarHBondContact CA-OD1 3.39Å; S196-D743 WeakPolarHBondContact CB-OD1 3.44Å; S196-D743 PolarHBondContact N-OD1 3.14Å; S196-D743 PolarHBondContact N-OD2 3.08Å; S196-D743 PolarHBondContact OG-OD1 3.25Å; S197-D743 VanDerWaalsContact CB-OD2 3.26Å; S197-D743 WeakPolarHBondContact CB-OD2 3.5Å; S197-D743 PolarHBondContact N-OD2 3.18Å; S197-D743 PolarHBondContact OG-OD2 3.28Å; G739-D743 PolarHBondContact O-N 2.81Å; A740-D743 PolarHBondContact O-N 3.18Å; D743-T745 PolarHBondContact O-N 3.16Å; D743-C746 WeakPolarHBondContact O-CB 3.32Å; D743-C746 PolarHBondContact O-N 3Å; D743-W749 HydrophobicContact CB-CH2 3.87Å; D743-W749 HydrophobicContact CB-CZ2 4.39Å; D743-W749 WeakPolarHBondContact O-CZ2 3.07Å
744	T	91.8	Very high	85.1	Confident	110 Å²	110	35.3 Å²	35.3	68%	0.675	20%	0.204	S	C	*	.	T	Hydrogen-bonded Turn	trans	-64.8	-18.6	176.1	58.8	0	0	0	0	113.9	A740 V741 I742	A740-T744 PolarHBondContact O-N 3.23Å; V741-T744 PolarHBondContact O-OG1 2.9Å; I742-T744 VanDerWaalsContact C-N 3.31Å; I742-T744 PolarHBondContact O-N 2.93Å
745	T	91.1	Very high	83.6	Confident	9 Å²	9	39.8 Å²	39.8	6%	0.055	23%	0.231	C	C	.	.	T	Hydrogen-bonded Turn	trans	-94.9	6.6	179.8	67.9	0	0	0	0	113.3	I742 D743 M747 Y762 D763 F767 V770	I742-T745 PolarHBondContact O-N 3.08Å; I742-T745 PolarHBondContact O-OG1 2.94Å; D743-T745 PolarHBondContact O-N 3.16Å; T745-M747 PolarHBondContact O-N 3.21Å; T745-Y762 WeakPolarHBondContact O-CA 3.28Å; T745-D763 PolarHBondContact O-N 2.93Å; T745-F767 HydrophobicContact CG2-CB 4.43Å; T745-V770 HydrophobicContact CG2-CG1 4.46Å; T745-V770 HydrophobicContact CG2-CG2 3.6Å
746	C	88.2	Confident	82.5	Confident	6 Å²	6	43.3 Å²	43.3	4%	0.041	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.5	117.1	176.7	-173.1	0	0	0	0	112.1	R582 D743 L748 W749 C759 Y762	R582-C746 PolarHBondContact NH2-O 3.41Å; D743-C746 WeakPolarHBondContact O-CB 3.32Å; D743-C746 PolarHBondContact O-N 3Å; C746-L748 PolarHBondContact SG-O 2.82Å; C746-L748 VanDerWaalsContact SG-O 3.35Å; C746-W749 HydrophobicContact CB-CD2 4.1Å; C746-W749 HydrophobicContact CB-CH2 4.14Å; C746-W749 HydrophobicContact CB-CZ2 3.59Å; C746-W749 VanDerWaalsContact SG-CE2 3.59Å; C746-C759 WeakPolarHBondContact CA-SG 3.17Å; C746-C759 HydrophobicContact CB-CB 3.9Å; C746-C759 WeakPolarHBondContact CB-SG 3.38Å; C746-C759 WeakPolarHBondContact SG-CB 3.07Å; C746-C759 CovalentContact SG-SG 2.03Å; C746-C759 PolarHBondContact SG-SG 3.1Å; C746-Y762 HydrophobicContact CB-CD1 4.39Å; C746-Y762 HydrophobicContact CB-CE1 4.45Å
747	M	81.6	Confident	81.7	Confident	42 Å²	42	40.7 Å²	40.7	21%	0.207	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.5	-28.4	175.5	-73.6	-62.1	-79.1	0	0	112.2	I567 N568 R582 T745 E761 D763	I567-M747 HydrophobicContact CG2-CE 3.72Å; N568-M747 WeakPolarHBondContact OD1-CE 3.35Å; R582-M747 PolarHBondContact NH1-O 2.9Å; R582-M747 PolarHBondContact NH2-SD 3.27Å; T745-M747 PolarHBondContact O-N 3.21Å; M747-E761 PolarHBondContact N-O 3.41Å; M747-D763 HydrophobicContact CG-CB 3.63Å; M747-D763 HydrophobicContact SD-CB 4.31Å
748	L	77.4	Confident	81.2	Confident	21 Å²	21	37.6 Å²	37.6	11%	0.11	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.3	111.1	177.8	-175.1	65.7	0	0	0	112.1	I567 Y599 F611 C746 C759 W760 E761	I567-L748 HydrophobicContact CD1-CD1 4.31Å; Y599-L748 HydrophobicContact CD2-CD2 3.8Å; Y599-L748 HydrophobicContact CE2-CD2 3.7Å; Y599-L748 HydrophobicContact CG-CD2 4.46Å; F611-L748 HydrophobicContact CD2-CD1 4.33Å; F611-L748 HydrophobicContact CD2-CD2 3.87Å; F611-L748 HydrophobicContact CE2-CD1 3.7Å; F611-L748 HydrophobicContact CE2-CD2 3.64Å; F611-L748 HydrophobicContact CE2-CG 4.24Å; C746-L748 PolarHBondContact SG-O 2.82Å; C746-L748 VanDerWaalsContact SG-O 3.35Å; L748-C759 PolarHBondContact O-SG 3Å; L748-C759 VanDerWaalsContact O-SG 3.36Å; L748-W760 HydrophobicContact CD2-CB 4.26Å; L748-W760 HydrophobicContact CD2-CE3 3.81Å; L748-W760 HydrophobicContact CG-CB 4.41Å; L748-W760 HydrophobicContact CG-CE3 3.86Å; L748-W760 PolarHBondContact O-N 3.1Å; L748-E761 PolarHBondContact N-O 3.21Å
749	W	81.6	Confident	80.7	Confident	49 Å²	49	38.4 Å²	38.4	19%	0.186	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85	140.1	175.4	-69.1	100.9	0	0	0	111.1	R195 D743 C746 Q751 H756 G757 C759	R195-W749 HydrophobicContact CG-CH2 4.47Å; R195-W749 HydrophobicContact CG-CZ3 4.01Å; D743-W749 HydrophobicContact CB-CH2 3.87Å; D743-W749 HydrophobicContact CB-CZ2 4.39Å; D743-W749 WeakPolarHBondContact O-CZ2 3.07Å; C746-W749 HydrophobicContact CB-CD2 4.1Å; C746-W749 HydrophobicContact CB-CH2 4.14Å; C746-W749 HydrophobicContact CB-CZ2 3.59Å; C746-W749 VanDerWaalsContact SG-CE2 3.59Å; W749-Q751 HydrophobicContact CB-CG 4.35Å; W749-Q751 PolarHBondContact O-N 3.35Å; W749-H756 VanDerWaalsContact CB-ND1 3.27Å; W749-H756 WeakPolarHBondContact CB-ND1 3.03Å; W749-H756 AromaticContact CD1-CE1 3.74Å; W749-H756 AromaticContact CD1-ND1 3.3Å; W749-H756 VanDerWaalsContact CD1-ND1 3.3Å; W749-H756 HydrophobicContact CD2-CB 4.13Å; W749-H756 AromaticContact CD2-ND1 3.75Å; W749-H756 HydrophobicContact CE3-CB 4.15Å; W749-H756 HydrophobicContact CG-CB 4.33Å; W749-H756 AromaticContact CG-CE1 3.96Å; W749-H756 AromaticContact CG-ND1 3.11Å; W749-H756 AromaticContact NE1-ND1 3.96Å; W749-G757 VanDerWaalsContact CE3-O 3.3Å; W749-G757 VanDerWaalsContact CZ3-O 3.26Å; W749-G757 WeakPolarHBondContact CZ3-O 3.32Å; W749-C759 HydrophobicContact CE3-CB 4.4Å; W749-C759 HydrophobicContact CZ3-CB 4.45Å
750	Q	74.2	Confident	80	Confident	26 Å²	26	41.5 Å²	41.5	12%	0.121	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-60.4	129.6	153.9	-175.9	169.8	0.8	0	0	108.7	S193 D752 G757 S758 W760	S193-Q750 VanDerWaalsContact OG-CD 3.3Å; S193-Q750 PolarHBondContact OG-NE2 2.85Å; Q750-D752 PolarHBondContact NE2-OD1 3.07Å; Q750-D752 PolarHBondContact NE2-OD2 3.28Å; Q750-D752 VanDerWaalsContact NE2-OD2 3.12Å; Q750-G757 PolarHBondContact O-N 3.21Å; Q750-S758 VanDerWaalsContact CB-O 3.24Å; Q750-S758 WeakPolarHBondContact CB-O 3.4Å; Q750-S758 PolarHBondContact N-O 2.98Å; Q750-S758 PolarHBondContact OE1-OG 3.22Å; Q750-W760 HydrophobicContact CB-CD2 4.24Å; Q750-W760 HydrophobicContact CB-CZ2 3.83Å; Q750-W760 HydrophobicContact CG-CH2 4.44Å; Q750-W760 HydrophobicContact CG-CZ2 3.63Å
751	Q	68.1	Low	79.5	Confident	79 Å²	79	40.1 Å²	40.1	37%	0.369	23%	0.227	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	89.1	-179.4	-77.1	-167.4	-44.4	0	0	110.8	W749 V755 H756	W749-Q751 HydrophobicContact CB-CG 4.35Å; W749-Q751 PolarHBondContact O-N 3.35Å; Q751-V755 WeakPolarHBondContact CA-O 3.45Å; Q751-H756 PolarHBondContact NE2-CE1 2.63Å; Q751-H756 PolarHBondContact NE2-NE2 3.04Å
752	D	61.8	Low	79.1	Confident	73 Å²	73	39 Å²	39	39%	0.39	22%	0.218	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-86	111.1	174.5	-52.4	-38.7	0	0	0	107.2	S193 Q750 G754 V755	S193-D752 WeakPolarHBondContact CB-OD2 3.26Å; S193-D752 PolarHBondContact OG-OD2 3.09Å; Q750-D752 PolarHBondContact NE2-OD1 3.07Å; Q750-D752 PolarHBondContact NE2-OD2 3.28Å; Q750-D752 VanDerWaalsContact NE2-OD2 3.12Å; D752-G754 PolarHBondContact O-N 2.04Å; D752-V755 PolarHBondContact N-O 2.94Å; D752-V755 PolarHBondContact O-N 3.21Å
753	C	61	Low	78.8	Confident	47 Å²	47	40.3 Å²	40.3	32%	0.318	23%	0.225	S	C	.	.	T	Hydrogen-bonded Turn	trans	53.1	24.6	178.5	-78.3	0	0	0	0	117.5	C284	C284-C753 HydrophobicContact CB-CB 3.67Å; C284-C753 WeakPolarHBondContact CB-SG 3.43Å; C284-C753 WeakPolarHBondContact SG-CA 3.4Å; C284-C753 WeakPolarHBondContact SG-CB 3.4Å; C284-C753 CovalentContact SG-SG 2.03Å; C284-C753 PolarHBondContact SG-SG 3.02Å
754	G	58.7	Low	78.5	Confident	54 Å²	54	39.7 Å²	39.7	56%	0.557	22%	0.221	S	C	*	.	T	Hydrogen-bonded Turn	trans	94.4	-0.3	-179.6	0	0	0	0	0	114.7	D752	D752-G754 PolarHBondContact O-N 2.04Å
755	V	66.1	Low	78.3	Confident	95 Å²	95	36.6 Å²	36.6	58%	0.576	20%	0.202	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-90.6	130.7	171.3	-176.7	0	0	0	0	109.1	Q751 D752 G757	Q751-V755 WeakPolarHBondContact CA-O 3.45Å; D752-V755 PolarHBondContact N-O 2.94Å; D752-V755 PolarHBondContact O-N 3.21Å; V755-G757 PolarHBondContact O-N 3.09Å
756	H	72.8	Confident	78.3	Confident	73 Å²	73	38.7 Å²	38.7	34%	0.338	22%	0.218	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.2	113.5	173.4	-70.9	-87.4	0	0	0	110.3	R195 W749 Q751	R195-H756 VanDerWaalsContact CZ-O 3.27Å; R195-H756 PolarHBondContact NE-O 2.91Å; R195-H756 PolarHBondContact NH2-O 3.42Å; W749-H756 VanDerWaalsContact CB-ND1 3.27Å; W749-H756 WeakPolarHBondContact CB-ND1 3.03Å; W749-H756 AromaticContact CD1-CE1 3.74Å; W749-H756 AromaticContact CD1-ND1 3.3Å; W749-H756 VanDerWaalsContact CD1-ND1 3.3Å; W749-H756 HydrophobicContact CD2-CB 4.13Å; W749-H756 AromaticContact CD2-ND1 3.75Å; W749-H756 HydrophobicContact CE3-CB 4.15Å; W749-H756 HydrophobicContact CG-CB 4.33Å; W749-H756 AromaticContact CG-CE1 3.96Å; W749-H756 AromaticContact CG-ND1 3.11Å; W749-H756 AromaticContact NE1-ND1 3.96Å; Q751-H756 PolarHBondContact NE2-CE1 2.63Å; Q751-H756 PolarHBondContact NE2-NE2 3.04Å
757	G	79.1	Confident	78.4	Confident	4 Å²	4	38.4 Å²	38.4	4%	0.041	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.2	-127.4	179.5	0	0	0	0	0	113	S193 R195 W749 Q750 V755	S193-G757 CarbonylContact O-C 3.18Å; S193-G757 WeakPolarHBondContact O-CA 3.31Å; R195-G757 WeakPolarHBondContact CG-O 3.39Å; W749-G757 VanDerWaalsContact CE3-O 3.3Å; W749-G757 VanDerWaalsContact CZ3-O 3.26Å; W749-G757 WeakPolarHBondContact CZ3-O 3.32Å; Q750-G757 PolarHBondContact O-N 3.21Å; V755-G757 PolarHBondContact O-N 3.09Å
758	S	84.5	Confident	78.9	Confident	3 Å²	3	37.6 Å²	37.6	2%	0.021	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.6	168.1	173.9	84.2	0	0	0	0	112.3	E189 S193 L194 Q750	E189-S758 WeakPolarHBondContact O-CB 3.45Å; S193-S758 PolarHBondContact O-N 3.35Å; L194-S758 WeakPolarHBondContact O-CA 3.41Å; L194-S758 WeakPolarHBondContact O-CB 3.4Å; Q750-S758 VanDerWaalsContact CB-O 3.24Å; Q750-S758 WeakPolarHBondContact CB-O 3.4Å; Q750-S758 PolarHBondContact N-O 2.98Å; Q750-S758 PolarHBondContact OE1-OG 3.22Å
759	C	86.5	Confident	79.5	Confident	16 Å²	16	41.6 Å²	41.6	11%	0.108	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	126.4	174.3	-170.6	0	0	0	0	111.1	C746 L748 W749 E761 Y762	C746-C759 WeakPolarHBondContact CA-SG 3.17Å; C746-C759 HydrophobicContact CB-CB 3.9Å; C746-C759 WeakPolarHBondContact CB-SG 3.38Å; C746-C759 WeakPolarHBondContact SG-CB 3.07Å; C746-C759 CovalentContact SG-SG 2.03Å; C746-C759 PolarHBondContact SG-SG 3.1Å; L748-C759 PolarHBondContact O-SG 3Å; L748-C759 VanDerWaalsContact O-SG 3.36Å; W749-C759 HydrophobicContact CE3-CB 4.4Å; W749-C759 HydrophobicContact CZ3-CB 4.45Å; C759-E761 PolarHBondContact SG-O 3.07Å; C759-Y762 HydrophobicContact CB-CD1 4.48Å; C759-Y762 HydrophobicContact CB-CE1 3.79Å; C759-Y762 HydrophobicContact CB-CE2 3.89Å; C759-Y762 VanDerWaalsContact CB-CZ 3.46Å; C759-Y762 WeakPolarHBondContact CB-OH 3.33Å
760	W	79	Confident	80	Confident	65 Å²	65	41.7 Å²	41.7	25%	0.246	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.2	-30.5	-178.5	-68.5	-28.5	0	0	0	113.8	Y599 F611 K673 L748 Q750	Y599-W760 VanDerWaalsContact CB-CZ3 3.48Å; Y599-W760 HydrophobicContact CD1-CB 4.05Å; Y599-W760 AromaticContact CD1-CD2 3.9Å; Y599-W760 HydrophobicContact CD1-CD2 3.9Å; Y599-W760 HydrophobicContact CD1-CE3 4.1Å; Y599-W760 AromaticContact CD1-CG 3.92Å; Y599-W760 HydrophobicContact CD1-CG 3.92Å; Y599-W760 HydrophobicContact CD2-CE3 4.35Å; Y599-W760 HydrophobicContact CE1-CB 3.92Å; Y599-W760 HydrophobicContact CE1-CG 4.28Å; Y599-W760 HydrophobicContact CG-CD2 4.05Å; Y599-W760 AromaticContact CG-CE3 3.76Å; Y599-W760 HydrophobicContact CG-CE3 3.76Å; Y599-W760 HydrophobicContact CG-CG 4.5Å; Y599-W760 HydrophobicContact CG-CZ3 4.21Å; F611-W760 HydrophobicContact CE2-CZ3 4.42Å; F611-W760 HydrophobicContact CZ-CZ3 4.05Å; K673-W760 PolarHBondContact NZ-O 2.8Å; L748-W760 HydrophobicContact CD2-CB 4.26Å; L748-W760 HydrophobicContact CD2-CE3 3.81Å; L748-W760 HydrophobicContact CG-CB 4.41Å; L748-W760 HydrophobicContact CG-CE3 3.86Å; L748-W760 PolarHBondContact O-N 3.1Å; Q750-W760 HydrophobicContact CB-CD2 4.24Å; Q750-W760 HydrophobicContact CB-CZ2 3.83Å; Q750-W760 HydrophobicContact CG-CH2 4.44Å; Q750-W760 HydrophobicContact CG-CZ2 3.63Å
761	E	83.4	Confident	80.9	Confident	15 Å²	15	40.5 Å²	40.5	7%	0.07	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.9	134.6	172.2	-168.8	74.2	-157.7	0	0	110.9	I562 L564 K673 R676 M747 L748 C759	I562-E761 HydrophobicContact CD1-CG 4.15Å; I562-E761 HydrophobicContact CG1-CG 4.33Å; I562-E761 WeakPolarHBondContact CG1-OE1 3.34Å; L564-E761 HydrophobicContact CD1-CG 4.44Å; K673-E761 IonicContact NZ-OE2 2.94Å; K673-E761 PolarHBondContact NZ-OE2 3.25Å; R676-E761 IonicContact CZ-OE1 3.41Å; R676-E761 IonicContact NH1-OE1 3.77Å; R676-E761 PolarHBondContact NH1-OE1 3.39Å; R676-E761 IonicContact NH2-OE1 3.8Å; M747-E761 PolarHBondContact N-O 3.41Å; L748-E761 PolarHBondContact N-O 3.21Å; C759-E761 PolarHBondContact SG-O 3.07Å
762	Y	87.3	Confident	82.1	Confident	17 Å²	17	36.8 Å²	36.8	7%	0.067	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	152.3	175.5	-60	-96.1	0	0	0	110.4	S196 K490 I742 T745 C746 C759 V764 F767	S196-Y762 PolarHBondContact OG-OH 2.85Å; K490-Y762 WeakPolarHBondContact CE-OH 3.24Å; K490-Y762 PolarHBondContact NZ-OH 3.5Å; I742-Y762 HydrophobicContact CG2-CD1 4.16Å; I742-Y762 HydrophobicContact CG2-CE1 3.52Å; T745-Y762 WeakPolarHBondContact O-CA 3.28Å; C746-Y762 HydrophobicContact CB-CD1 4.39Å; C746-Y762 HydrophobicContact CB-CE1 4.45Å; C759-Y762 HydrophobicContact CB-CD1 4.48Å; C759-Y762 HydrophobicContact CB-CE1 3.79Å; C759-Y762 HydrophobicContact CB-CE2 3.89Å; C759-Y762 VanDerWaalsContact CB-CZ 3.46Å; C759-Y762 WeakPolarHBondContact CB-OH 3.33Å; Y762-V764 PolarHBondContact O-N 3.03Å; Y762-F767 HydrophobicContact CD1-CD1 4.47Å; Y762-F767 HydrophobicContact CG-CD1 4.15Å; Y762-F767 HydrophobicContact CG-CE1 4.41Å
763	D	87.7	Confident	83.6	Confident	29 Å²	29	34.3 Å²	34.3	16%	0.155	20%	0.202	C	C	.	.			trans	-71.2	102	160	171.8	26.7	0	0	0	108.6	T745 M747 T765 S766 F767	T745-D763 PolarHBondContact O-N 2.93Å; M747-D763 HydrophobicContact CG-CB 3.63Å; M747-D763 HydrophobicContact SD-CB 4.31Å; D763-T765 PolarHBondContact O-N 3.36Å; D763-T765 VanDerWaalsContact O-N 3.14Å; D763-T765 WeakPolarHBondContact OD1-CB 3.25Å; D763-T765 PolarHBondContact OD1-N 3.47Å; D763-T765 PolarHBondContact OD1-OG1 3.39Å; D763-T765 VanDerWaalsContact OD1-OG1 3.09Å; D763-S766 PolarHBondContact O-N 3.08Å; D763-S766 WeakPolarHBondContact OD2-CB 3.02Å; D763-S766 PolarHBondContact OD2-N 3.1Å; D763-S766 PolarHBondContact OD2-OG 3.01Å; D763-F767 WeakPolarHBondContact O-CB 3.49Å; D763-F767 PolarHBondContact O-N 3.16Å
764	V	87.8	Confident	85.2	Confident	0 Å²	0	34.1 Å²	34.1	0%	0	20%	0.197	C	C	.	.	H	α-helix	trans	-57.9	-26.3	177.7	-56	0	0	0	0	112.5	S494 Q495 E560 Y762 R768	S494-V764 WeakPolarHBondContact O-CG1 3.28Å; Q495-V764 PolarHBondContact NE2-O 2.86Å; Q495-V764 PolarHBondContact OE1-O 3.12Å; E560-V764 VanDerWaalsContact C-CG2 3.45Å; E560-V764 WeakPolarHBondContact O-CG2 3.04Å; Y762-V764 PolarHBondContact O-N 3.03Å; V764-R768 VanDerWaalsContact O-CB 3.29Å; V764-R768 WeakPolarHBondContact O-CB 3.24Å; V764-R768 PolarHBondContact O-N 3.08Å
765	T	87.7	Confident	86.9	Confident	45 Å²	45	31.5 Å²	31.5	28%	0.276	17%	0.171	S	C	.	.	H	α-helix	trans	-69.1	-61.5	177.8	-42.7	0	0	0	0	109.5	D763 F767 R768 F769	D763-T765 PolarHBondContact O-N 3.36Å; D763-T765 VanDerWaalsContact O-N 3.14Å; D763-T765 WeakPolarHBondContact OD1-CB 3.25Å; D763-T765 PolarHBondContact OD1-N 3.47Å; D763-T765 PolarHBondContact OD1-OG1 3.39Å; D763-T765 VanDerWaalsContact OD1-OG1 3.09Å; T765-F767 VanDerWaalsContact C-N 3.31Å; T765-F767 PolarHBondContact O-N 3.43Å; T765-R768 PolarHBondContact O-N 2.86Å; T765-R768 VanDerWaalsContact O-N 3.17Å; T765-F769 HydrophobicContact CG2-CD2 4.12Å; T765-F769 HydrophobicContact CG2-CE2 3.98Å; T765-F769 VanDerWaalsContact O-CD2 3.26Å; T765-F769 WeakPolarHBondContact O-CD2 3.46Å; T765-F769 PolarHBondContact O-N 3.1Å; T765-F769 VanDerWaalsContact O-N 3.09Å
766	S	89.2	Confident	88.2	Confident	54 Å²	54	27.8 Å²	27.8	38%	0.378	15%	0.15	S	C	.	.	H	α-helix	trans	-56.1	-44.4	175.3	-63.5	0	0	0	0	111.8	D763 R768 F769 V770	D763-S766 PolarHBondContact O-N 3.08Å; D763-S766 WeakPolarHBondContact OD2-CB 3.02Å; D763-S766 PolarHBondContact OD2-N 3.1Å; D763-S766 PolarHBondContact OD2-OG 3.01Å; S766-R768 PolarHBondContact O-N 2.96Å; S766-F769 PolarHBondContact O-N 2.03Å; S766-F769 VanDerWaalsContact O-N 3.16Å; S766-V770 WeakPolarHBondContact O-CG2 3.31Å; S766-V770 PolarHBondContact O-N 3.09Å
767	F	90.8	Very high	89.2	Confident	0 Å²	0	27.7 Å²	27.7	0%	0	16%	0.157	C	C	.	.	H	α-helix	trans	-56.6	-46.5	177.5	-173.4	-179	0	0	0	111	F491 I742 T745 Y762 D763 T765 F769 Y771	F491-F767 HydrophobicContact CB-CZ 4.37Å; F491-F767 HydrophobicContact CD2-CD2 4.12Å; F491-F767 AromaticContact CD2-CE2 3.65Å; F491-F767 HydrophobicContact CD2-CE2 3.65Å; F491-F767 AromaticContact CD2-CZ 3.9Å; F491-F767 HydrophobicContact CD2-CZ 3.9Å; F491-F767 HydrophobicContact CE2-CD2 4.31Å; F491-F767 HydrophobicContact CE2-CE2 4.28Å; I742-F767 HydrophobicContact CB-CE2 4.44Å; I742-F767 HydrophobicContact CD1-CE2 4.23Å; I742-F767 HydrophobicContact CD1-CZ 4.42Å; I742-F767 HydrophobicContact CG1-CD2 4.36Å; I742-F767 HydrophobicContact CG1-CE2 3.67Å; I742-F767 HydrophobicContact CG1-CZ 4.15Å; I742-F767 HydrophobicContact CG2-CE1 4.38Å; I742-F767 HydrophobicContact CG2-CE2 4.15Å; I742-F767 HydrophobicContact CG2-CZ 3.97Å; T745-F767 HydrophobicContact CG2-CB 4.43Å; Y762-F767 HydrophobicContact CD1-CD1 4.47Å; Y762-F767 HydrophobicContact CG-CD1 4.15Å; Y762-F767 HydrophobicContact CG-CE1 4.41Å; D763-F767 WeakPolarHBondContact O-CB 3.49Å; D763-F767 PolarHBondContact O-N 3.16Å; T765-F767 VanDerWaalsContact C-N 3.31Å; T765-F767 PolarHBondContact O-N 3.43Å; F767-F769 PolarHBondContact O-N 2.02Å; F767-Y771 HydrophobicContact CE2-CD2 4.13Å; F767-Y771 HydrophobicContact CE2-CG 4.24Å; F767-Y771 WeakPolarHBondContact O-CB 3.48Å; F767-Y771 PolarHBondContact O-N 2.84Å
768	R	91.4	Very high	90	Very high	25 Å²	25	29.1 Å²	29.1	9%	0.094	16%	0.164	C	C	.	.	H	α-helix	trans	-61.4	-44.6	176.7	-173.1	167.4	70.1	-110.8	8.4	112	F491 F555 C559 V764 T765 S766 F772	F491-R768 HydrophobicContact CZ-CB 4.39Å; F491-R768 HydrophobicContact CZ-CG 4.24Å; F555-R768 PolarHBondContact O-NE 3.31Å; C559-R768 PolarHBondContact O-NH1 3.39Å; V764-R768 VanDerWaalsContact O-CB 3.29Å; V764-R768 WeakPolarHBondContact O-CB 3.24Å; V764-R768 PolarHBondContact O-N 3.08Å; T765-R768 PolarHBondContact O-N 2.86Å; T765-R768 VanDerWaalsContact O-N 3.17Å; S766-R768 PolarHBondContact O-N 2.96Å; R768-F772 HydrophobicContact CG-CD2 4.01Å; R768-F772 HydrophobicContact CG-CE2 4.3Å; R768-F772 PolarHBondContact O-N 3.21Å
769	F	90.9	Very high	90.5	Very high	105 Å²	105	29 Å²	29	46%	0.461	16%	0.163	S	C	.	.	H	α-helix	trans	-67.8	-44.3	179.9	-80.5	-72	0	0	0	113.3	F555 T765 S766 F767 G773	F555-F769 HydrophobicContact CB-CE1 4.3Å; F555-F769 AromaticContact CD1-CD1 3.72Å; F555-F769 HydrophobicContact CD1-CD1 3.72Å; F555-F769 HydrophobicContact CD1-CE1 4.11Å; F555-F769 HydrophobicContact CE1-CD1 4.45Å; T765-F769 HydrophobicContact CG2-CD2 4.12Å; T765-F769 HydrophobicContact CG2-CE2 3.98Å; T765-F769 VanDerWaalsContact O-CD2 3.26Å; T765-F769 WeakPolarHBondContact O-CD2 3.46Å; T765-F769 PolarHBondContact O-N 3.1Å; T765-F769 VanDerWaalsContact O-N 3.09Å; S766-F769 PolarHBondContact O-N 2.03Å; S766-F769 VanDerWaalsContact O-N 3.16Å; F767-F769 PolarHBondContact O-N 2.02Å; F769-G773 WeakPolarHBondContact O-CA 3.32Å; F769-G773 PolarHBondContact O-N 3.23Å
770	V	92.7	Very high	90.9	Very high	51 Å²	51	33.7 Å²	33.7	31%	0.309	18%	0.182	S	C	.	.	H	α-helix	trans	-74.7	-38.9	-179.3	-56.6	0	0	0	0	112.3	V741 T745 S766 G773 L774	V741-V770 HydrophobicContact CG1-CB 3.75Å; V741-V770 HydrophobicContact CG1-CG2 3.58Å; T745-V770 HydrophobicContact CG2-CG1 4.46Å; T745-V770 HydrophobicContact CG2-CG2 3.6Å; S766-V770 WeakPolarHBondContact O-CG2 3.31Å; S766-V770 PolarHBondContact O-N 3.09Å; V770-G773 PolarHBondContact O-N 3.45Å; V770-L774 WeakPolarHBondContact O-CB 3.32Å; V770-L774 PolarHBondContact O-N 2.81Å
771	Y	93.1	Very high	91.7	Very high	1 Å²	1	33.9 Å²	33.9	0%	0.004	19%	0.19	C	C	.	.	H	α-helix	trans	-67.6	-50.9	-177.1	-175.4	-99.2	0	0	0	111.8	A483 F484 F487 I488 F491 F738 I742 F767 A775	A483-Y771 PolarHBondContact O-OH 3.45Å; F484-Y771 HydrophobicContact CD1-CE1 4.21Å; F484-Y771 AromaticContact CE1-CE1 3.9Å; F484-Y771 HydrophobicContact CE1-CE1 3.9Å; F487-Y771 HydrophobicContact CB-CE2 4.05Å; I488-Y771 HydrophobicContact CD1-CE1 4.19Å; F491-Y771 AromaticContact CD2-CD1 3.71Å; F491-Y771 HydrophobicContact CD2-CD1 3.71Å; F491-Y771 HydrophobicContact CD2-CE1 4.09Å; F491-Y771 HydrophobicContact CD2-CG 4.06Å; F491-Y771 AromaticContact CE2-CD1 3.89Å; F491-Y771 HydrophobicContact CE2-CD1 3.89Å; F491-Y771 HydrophobicContact CE2-CG 4.29Å; F491-Y771 HydrophobicContact CG-CD1 4.38Å; F491-Y771 HydrophobicContact CG-CE1 4.34Å; F738-Y771 AromaticContact CD1-CD2 3.73Å; F738-Y771 HydrophobicContact CD1-CD2 3.73Å; F738-Y771 AromaticContact CD1-CE2 3.67Å; F738-Y771 HydrophobicContact CD1-CE2 3.67Å; F738-Y771 HydrophobicContact CE1-CD2 4.03Å; F738-Y771 HydrophobicContact CE1-CE2 4.04Å; I742-Y771 HydrophobicContact CD1-CD2 4.38Å; I742-Y771 HydrophobicContact CD1-CE2 4.39Å; I742-Y771 HydrophobicContact CG1-CD2 4.36Å; F767-Y771 HydrophobicContact CE2-CD2 4.13Å; F767-Y771 HydrophobicContact CE2-CG 4.24Å; F767-Y771 WeakPolarHBondContact O-CB 3.48Å; F767-Y771 PolarHBondContact O-N 2.84Å; Y771-A775 PolarHBondContact O-N 3.05Å
772	F	92.9	Very high	92.3	Very high	0 Å²	0	33.1 Å²	33.1	0%	0	19%	0.186	C	C	.	.	H	α-helix	trans	-76.9	-27	174.2	-65.4	-51.3	0	0	0	112.7	F484 F491 F551 L554 F555 F684 R768 A775 A776	F484-F772 HydrophobicContact CE1-CD1 4.39Å; F484-F772 HydrophobicContact CE1-CE1 4.14Å; F484-F772 HydrophobicContact CZ-CD1 4.08Å; F484-F772 AromaticContact CZ-CE1 3.71Å; F484-F772 HydrophobicContact CZ-CE1 3.71Å; F491-F772 HydrophobicContact CD1-CZ 4.36Å; F491-F772 AromaticContact CE1-CE2 3.66Å; F491-F772 HydrophobicContact CE1-CE2 3.66Å; F491-F772 AromaticContact CE1-CZ 3.73Å; F491-F772 HydrophobicContact CE1-CZ 3.73Å; F491-F772 HydrophobicContact CE2-CE2 4.02Å; F491-F772 HydrophobicContact CE2-CZ 4.36Å; F491-F772 HydrophobicContact CZ-CD2 4.12Å; F491-F772 AromaticContact CZ-CE2 3.28Å; F491-F772 HydrophobicContact CZ-CE2 3.28Å; F491-F772 AromaticContact CZ-CZ 3.74Å; F491-F772 HydrophobicContact CZ-CZ 3.74Å; F551-F772 HydrophobicContact CD1-CD1 4.44Å; F551-F772 HydrophobicContact CE1-CD1 4.26Å; L554-F772 HydrophobicContact CB-CD1 4.3Å; L554-F772 HydrophobicContact CB-CD2 3.79Å; L554-F772 HydrophobicContact CB-CE1 4.34Å; L554-F772 HydrophobicContact CB-CE2 3.8Å; L554-F772 HydrophobicContact CB-CG 4.06Å; L554-F772 HydrophobicContact CB-CZ 4.11Å; L554-F772 HydrophobicContact CD1-CD1 4.1Å; L554-F772 HydrophobicContact CD1-CE1 3.8Å; L554-F772 HydrophobicContact CD1-CZ 4.1Å; L554-F772 WeakPolarHBondContact O-CD2 3.05Å; F555-F772 HydrophobicContact CD1-CB 4.34Å; F555-F772 HydrophobicContact CD2-CB 4.32Å; F555-F772 HydrophobicContact CE1-CB 3.99Å; F555-F772 HydrophobicContact CE2-CB 3.96Å; F555-F772 HydrophobicContact CZ-CB 3.8Å; F555-F772 WeakPolarHBondContact CZ-O 3.07Å; F684-F772 AromaticContact CE2-CE2 3.85Å; F684-F772 HydrophobicContact CE2-CE2 3.85Å; F684-F772 AromaticContact CE2-CZ 3.72Å; F684-F772 HydrophobicContact CE2-CZ 3.72Å; F684-F772 HydrophobicContact CZ-CE2 4.42Å; F684-F772 AromaticContact CZ-CZ 3.94Å; F684-F772 HydrophobicContact CZ-CZ 3.94Å; R768-F772 HydrophobicContact CG-CD2 4.01Å; R768-F772 HydrophobicContact CG-CE2 4.3Å; R768-F772 PolarHBondContact O-N 3.21Å; F772-A775 PolarHBondContact O-N 3.03Å; F772-A776 WeakPolarHBondContact O-CB 3.47Å; F772-A776 PolarHBondContact O-N 2.87Å
773	G	93.2	Very high	92.7	Very high	21 Å²	21	35 Å²	35	22%	0.216	20%	0.195	C	C	.	.	H	α-helix	trans	-60.6	-45	173	0	0	0	0	0	112.3	F555 F769 V770 S777	F555-G773 VanDerWaalsContact CE1-N 3.34Å; F769-G773 WeakPolarHBondContact O-CA 3.32Å; F769-G773 PolarHBondContact O-N 3.23Å; V770-G773 PolarHBondContact O-N 3.45Å; G773-S777 WeakPolarHBondContact O-CB 3.4Å; G773-S777 PolarHBondContact O-N 3.16Å; G773-S777 PolarHBondContact O-OG 2.84Å
774	L	94.4	Very high	93.2	Very high	43 Å²	43	36.5 Å²	36.5	23%	0.225	21%	0.205	C	C	.	.	H	α-helix	trans	-66.5	-45.4	175.3	-178.5	58.2	0	0	0	111.7	Y737 F738 V741 V770 A776 S777 L778	Y737-L774 HydrophobicContact CD2-CD2 3.86Å; Y737-L774 HydrophobicContact CE2-CD1 4.26Å; Y737-L774 HydrophobicContact CE2-CD2 3.85Å; Y737-L774 HydrophobicContact CE2-CG 4.24Å; F738-L774 HydrophobicContact CD1-CD2 3.92Å; F738-L774 HydrophobicContact CD2-CD2 4.01Å; F738-L774 HydrophobicContact CE1-CB 4.27Å; F738-L774 HydrophobicContact CE1-CD2 3.81Å; F738-L774 HydrophobicContact CE1-CG 4.08Å; F738-L774 HydrophobicContact CE2-CD2 3.9Å; F738-L774 HydrophobicContact CE2-CG 4.06Å; F738-L774 HydrophobicContact CG-CD2 4.03Å; F738-L774 HydrophobicContact CZ-CB 4.27Å; F738-L774 HydrophobicContact CZ-CD2 3.8Å; F738-L774 HydrophobicContact CZ-CG 3.75Å; V741-L774 HydrophobicContact CB-CD2 4.25Å; V741-L774 HydrophobicContact CG1-CD2 4.16Å; V741-L774 HydrophobicContact CG2-CD2 4.14Å; V770-L774 WeakPolarHBondContact O-CB 3.32Å; V770-L774 PolarHBondContact O-N 2.81Å; L774-A776 PolarHBondContact O-N 3.37Å; L774-S777 WeakPolarHBondContact O-CB 3.34Å; L774-S777 PolarHBondContact O-N 2.71Å; L774-L778 HydrophobicContact CD1-CD1 4.49Å; L774-L778 HydrophobicContact CG-CD1 4.37Å; L774-L778 WeakPolarHBondContact O-CG 3.32Å; L774-L778 PolarHBondContact O-N 3.08Å
775	A	93.8	Very high	93.6	Very high	0 Å²	0	38.9 Å²	38.9	0%	0	22%	0.215	C	C	.	.	H	α-helix	trans	-63	-39.9	176.8	0	0	0	0	0	113	I480 F484 F551 F738 Y771 F772 L778 K779	I480-A775 HydrophobicContact CG1-CB 4.48Å; I480-A775 HydrophobicContact CG2-CB 4.3Å; F484-A775 HydrophobicContact CE1-CB 4.19Å; F551-A775 HydrophobicContact CD1-CB 4.3Å; F551-A775 HydrophobicContact CE1-CB 3.59Å; F551-A775 HydrophobicContact CZ-CB 4.33Å; F738-A775 HydrophobicContact CZ-CB 4.33Å; Y771-A775 PolarHBondContact O-N 3.05Å; F772-A775 PolarHBondContact O-N 3.03Å; A775-L778 PolarHBondContact O-N 3.31Å; A775-K779 WeakPolarHBondContact O-CG 3.42Å; A775-K779 PolarHBondContact O-N 3.02Å
776	A	94.2	Very high	94	Very high	16 Å²	16	36.9 Å²	36.9	13%	0.132	20%	0.203	C	C	.	.	H	α-helix	trans	-69.6	-35	175.5	0	0	0	0	0	112	L548 F555 F772 L774 K779 F780	L548-A776 HydrophobicContact CD1-CB 4.33Å; L548-A776 WeakPolarHBondContact CD1-O 3.45Å; F555-A776 HydrophobicContact CE2-CB 4.28Å; F555-A776 HydrophobicContact CZ-CB 4.06Å; F772-A776 WeakPolarHBondContact O-CB 3.47Å; F772-A776 PolarHBondContact O-N 2.87Å; L774-A776 PolarHBondContact O-N 3.37Å; A776-K779 WeakPolarHBondContact O-CB 3.06Å; A776-K779 PolarHBondContact O-N 2.69Å; A776-F780 PolarHBondContact O-N 3.43Å
777	S	94.6	Very high	94.3	Very high	71 Å²	71	38.6 Å²	38.6	50%	0.497	20%	0.204	S	C	.	.	H	α-helix	trans	-64.2	-44.6	173	-60.9	0	0	0	0	111.3	G773 L774 F780 V781	G773-S777 WeakPolarHBondContact O-CB 3.4Å; G773-S777 PolarHBondContact O-N 3.16Å; G773-S777 PolarHBondContact O-OG 2.84Å; L774-S777 WeakPolarHBondContact O-CB 3.34Å; L774-S777 PolarHBondContact O-N 2.71Å; S777-F780 PolarHBondContact O-N 3.28Å; S777-V781 WeakPolarHBondContact O-CG2 3.43Å; S777-V781 PolarHBondContact O-N 2.03Å
778	L	94.8	Very high	94.6	Very high	34 Å²	34	41.4 Å²	41.4	18%	0.178	22%	0.218	C	C	.	.	H	α-helix	trans	-63.1	-39.2	172.8	-69.6	166.1	0	0	0	111.8	I480 Y737 F738 L774 A775 V781 G782	I480-L778 HydrophobicContact CD1-CB 3.91Å; I480-L778 HydrophobicContact CG1-CB 3.87Å; I480-L778 HydrophobicContact CG1-CD1 4.31Å; Y737-L778 HydrophobicContact CE2-CD1 4.29Å; Y737-L778 WeakPolarHBondContact OH-CD1 3.31Å; F738-L778 HydrophobicContact CE2-CD1 3.76Å; F738-L778 HydrophobicContact CZ-CD1 4.04Å; L774-L778 HydrophobicContact CD1-CD1 4.49Å; L774-L778 HydrophobicContact CG-CD1 4.37Å; L774-L778 WeakPolarHBondContact O-CG 3.32Å; L774-L778 PolarHBondContact O-N 3.08Å; A775-L778 PolarHBondContact O-N 3.31Å; L778-V781 PolarHBondContact O-N 2.88Å; L778-G782 PolarHBondContact O-N 3.33Å
779	K	94.8	Very high	94.7	Very high	0 Å²	0	40.2 Å²	40.2	0%	0	21%	0.214	C	C	.	.	H	α-helix	trans	-59.5	-45.8	171.9	-81.1	-61.5	-166.5	171	0	111.8	E477 I480 S547 L548 F551 T695 A775 A776 G782 F783	E477-K779 VanDerWaalsContact CD-NZ 3.25Å; E477-K779 IonicContact OE1-NZ 2.75Å; E477-K779 PolarHBondContact OE1-NZ 3Å; E477-K779 IonicContact OE2-NZ 3.08Å; E477-K779 PolarHBondContact OE2-NZ 3.26Å; I480-K779 HydrophobicContact CD1-CB 4.36Å; I480-K779 HydrophobicContact CD1-CD 3.58Å; I480-K779 HydrophobicContact CD1-CG 3.6Å; S547-K779 WeakPolarHBondContact OG-CE 3.46Å; S547-K779 PolarHBondContact OG-NZ 3Å; L548-K779 HydrophobicContact CD1-CB 3.79Å; F551-K779 HydrophobicContact CD2-CG 4.02Å; F551-K779 HydrophobicContact CE2-CD 4.33Å; F551-K779 HydrophobicContact CE2-CG 3.98Å; F551-K779 HydrophobicContact CZ-CG 4.49Å; T695-K779 PolarHBondContact OG1-NZ 3.06Å; A775-K779 WeakPolarHBondContact O-CG 3.42Å; A775-K779 PolarHBondContact O-N 3.02Å; A776-K779 WeakPolarHBondContact O-CB 3.06Å; A776-K779 PolarHBondContact O-N 2.69Å; K779-G782 CarbonylContact O-C 3.58Å; K779-G782 PolarHBondContact O-N 3.05Å; K779-F783 WeakPolarHBondContact O-CB 3.45Å; K779-F783 PolarHBondContact O-N 3.02Å
780	F	95.9	Very high	95	Very high	116 Å²	116	37.6 Å²	37.6	51%	0.509	20%	0.201	S	C	.	.	H	α-helix	trans	-63.3	-43.5	179.7	-179.6	-101.7	0	0	0	111.8	L548 A776 S777 F783 V784	L548-F780 HydrophobicContact CD1-CB 4.47Å; L548-F780 HydrophobicContact CD2-CB 4.41Å; L548-F780 HydrophobicContact CD2-CD2 4.08Å; A776-F780 PolarHBondContact O-N 3.43Å; S777-F780 PolarHBondContact O-N 3.28Å; F780-F783 WeakPolarHBondContact O-CB 3.5Å; F780-F783 PolarHBondContact O-N 2.83Å; F780-V784 HydrophobicContact CE1-CG2 4.13Å; F780-V784 HydrophobicContact CZ-CG2 4.15Å; F780-V784 WeakPolarHBondContact O-CG2 3.21Å; F780-V784 PolarHBondContact O-N 3.04Å
781	V	96.1	Very high	95.1	Very high	68 Å²	68	41 Å²	41	41%	0.412	21%	0.209	S	C	.	.	H	α-helix	trans	-61	-44.5	172.6	171.8	0	0	0	0	111.2	S777 L778 F783 V784 F785	S777-V781 WeakPolarHBondContact O-CG2 3.43Å; S777-V781 PolarHBondContact O-N 2.03Å; L778-V781 PolarHBondContact O-N 2.88Å; V781-F783 VanDerWaalsContact C-N 3.33Å; V781-F783 PolarHBondContact O-N 2.83Å; V781-V784 PolarHBondContact O-N 2.99Å; V781-F785 HydrophobicContact CG1-CD2 3.81Å; V781-F785 HydrophobicContact CG1-CE2 3.49Å; V781-F785 VanDerWaalsContact CG1-CE2 3.49Å; V781-F785 VanDerWaalsContact O-CD2 3.23Å; V781-F785 WeakPolarHBondContact O-CD2 3.29Å; V781-F785 PolarHBondContact O-N 2.78Å; V781-F785 VanDerWaalsContact O-N 3.08Å
782	G	95.4	Very high	95.1	Very high	0 Å²	0	42 Å²	42	0%	0	22%	0.216	C	C	.	.	H	α-helix	trans	-60.1	-39.4	174.2	0	0	0	0	0	113.5	S473 L778 K779 F785 I786	S473-G782 WeakPolarHBondContact CB-O 3.42Å; S473-G782 PolarHBondContact OG-O 3.46Å; L778-G782 PolarHBondContact O-N 3.33Å; K779-G782 CarbonylContact O-C 3.58Å; K779-G782 PolarHBondContact O-N 3.05Å; G782-F785 PolarHBondContact O-N 3.49Å; G782-I786 PolarHBondContact O-N 2.83Å
783	F	95.9	Very high	95.1	Very high	56 Å²	56	42.7 Å²	42.7	25%	0.246	22%	0.22	C	C	.	.	H	α-helix	trans	-64.5	-45.1	176	178	-96.1	0	0	0	111.9	M541 K779 F780 V781 F785 I786 F787	M541-F783 HydrophobicContact CG-CD2 4.44Å; M541-F783 HydrophobicContact CG-CE2 3.76Å; M541-F783 HydrophobicContact CG-CZ 4.26Å; K779-F783 WeakPolarHBondContact O-CB 3.45Å; K779-F783 PolarHBondContact O-N 3.02Å; F780-F783 WeakPolarHBondContact O-CB 3.5Å; F780-F783 PolarHBondContact O-N 2.83Å; V781-F783 VanDerWaalsContact C-N 3.33Å; V781-F783 PolarHBondContact O-N 2.83Å; F783-F785 VanDerWaalsContact C-N 3.32Å; F783-F785 PolarHBondContact O-N 2.04Å; F783-I786 VanDerWaalsContact O-CG2 3.27Å; F783-I786 WeakPolarHBondContact O-CG2 3.5Å; F783-I786 PolarHBondContact O-N 2.94Å; F783-F787 WeakPolarHBondContact O-CB 3.43Å; F783-F787 PolarHBondContact O-N 3.33Å
784	V	97.1	Very high	95.1	Very high	60 Å²	60	46 Å²	46	36%	0.364	23%	0.228	S	C	.	.	H	α-helix	trans	-60.1	-42.9	174.4	172.3	0	0	0	0	110.7	F780 V781 F787 L788	F780-V784 HydrophobicContact CE1-CG2 4.13Å; F780-V784 HydrophobicContact CZ-CG2 4.15Å; F780-V784 WeakPolarHBondContact O-CG2 3.21Å; F780-V784 PolarHBondContact O-N 3.04Å; V781-V784 PolarHBondContact O-N 2.99Å; V784-F787 WeakPolarHBondContact O-CB 3.33Å; V784-F787 PolarHBondContact O-N 2.79Å; V784-L788 HydrophobicContact CG1-CD1 4.15Å; V784-L788 WeakPolarHBondContact O-CG 3.02Å; V784-L788 PolarHBondContact O-N 3.05Å
785	F	96.8	Very high	95	Very high	51 Å²	51	47.6 Å²	47.6	22%	0.224	23%	0.234	C	C	.	.	H	α-helix	trans	-68.5	-36.8	178	-74	-54	0	0	0	114	F469 L472 V781 G782 F783 L788 T789	F469-F785 AromaticContact CD1-CD1 3.9Å; F469-F785 HydrophobicContact CD1-CD1 3.9Å; F469-F785 HydrophobicContact CD1-CE1 4.24Å; L472-F785 HydrophobicContact CB-CD1 4.18Å; L472-F785 HydrophobicContact CB-CD2 3.82Å; L472-F785 HydrophobicContact CB-CE1 4.32Å; L472-F785 HydrophobicContact CB-CE2 3.95Å; L472-F785 HydrophobicContact CB-CG 3.95Å; L472-F785 HydrophobicContact CB-CZ 4.21Å; L472-F785 HydrophobicContact CD1-CD1 4.28Å; L472-F785 HydrophobicContact CD1-CE1 3.8Å; L472-F785 HydrophobicContact CD1-CE2 4.45Å; L472-F785 HydrophobicContact CD1-CZ 3.9Å; V781-F785 HydrophobicContact CG1-CD2 3.81Å; V781-F785 HydrophobicContact CG1-CE2 3.49Å; V781-F785 VanDerWaalsContact CG1-CE2 3.49Å; V781-F785 VanDerWaalsContact O-CD2 3.23Å; V781-F785 WeakPolarHBondContact O-CD2 3.29Å; V781-F785 PolarHBondContact O-N 2.78Å; V781-F785 VanDerWaalsContact O-N 3.08Å; G782-F785 PolarHBondContact O-N 3.49Å; F783-F785 VanDerWaalsContact C-N 3.32Å; F783-F785 PolarHBondContact O-N 2.04Å; F785-L788 HydrophobicContact CD1-CD1 4.29Å; F785-L788 PolarHBondContact O-N 2.87Å; F785-T789 WeakPolarHBondContact O-CB 3.26Å; F785-T789 PolarHBondContact O-N 2.85Å; F785-T789 PolarHBondContact O-OG1 3.46Å
786	I	95.4	Very high	94.8	Very high	3 Å²	3	52.3 Å²	52.3	2%	0.015	26%	0.255	C	S	.	.	H	α-helix	trans	-72.3	-30.8	173.4	-167	65.8	0	0	0	111.9	A540 M541 G782 F783 T789 W790	A540-I786 HydrophobicContact CB-CD1 3.89Å; A540-I786 HydrophobicContact CB-CG1 3.84Å; M541-I786 HydrophobicContact CB-CG1 4.39Å; M541-I786 HydrophobicContact CB-CG2 4.18Å; M541-I786 HydrophobicContact CG-CG2 4.4Å; G782-I786 PolarHBondContact O-N 2.83Å; F783-I786 VanDerWaalsContact O-CG2 3.27Å; F783-I786 WeakPolarHBondContact O-CG2 3.5Å; F783-I786 PolarHBondContact O-N 2.94Å; I786-T789 HydrophobicContact CD1-CG2 4.29Å; I786-T789 WeakPolarHBondContact O-CB 3.42Å; I786-T789 PolarHBondContact O-N 3.44Å; I786-W790 PolarHBondContact O-N 3.12Å
787	F	96.3	Very high	94.5	Very high	90 Å²	90	54.4 Å²	54.4	40%	0.395	26%	0.262	S	S	.	.	H	α-helix	trans	-62.2	-49.5	169.8	178	-94.5	0	0	0	111.8	M541 F783 V784 T789 W790 Y791	M541-F787 HydrophobicContact CE-CD2 4Å; M541-F787 HydrophobicContact SD-CD2 3.99Å; F783-F787 WeakPolarHBondContact O-CB 3.43Å; F783-F787 PolarHBondContact O-N 3.33Å; V784-F787 WeakPolarHBondContact O-CB 3.33Å; V784-F787 PolarHBondContact O-N 2.79Å; F787-T789 VanDerWaalsContact C-N 3.27Å; F787-T789 PolarHBondContact O-N 2.74Å; F787-W790 HydrophobicContact CE2-CE3 4.49Å; F787-W790 HydrophobicContact CE2-CZ3 4.42Å; F787-W790 PolarHBondContact O-N 2.96Å; F787-Y791 WeakPolarHBondContact O-CB 3.37Å; F787-Y791 PolarHBondContact O-N 3.29Å
788	L	95.9	Very high	94.3	Very high	58 Å²	58	52.5 Å²	52.5	30%	0.304	25%	0.25	S	S	.	.	H	α-helix	trans	-60.8	-35.7	174.4	-70.8	172.9	0	0	0	112.3	F469 V784 F785 S792	F469-L788 HydrophobicContact CD1-CD1 4.45Å; F469-L788 HydrophobicContact CD2-CB 3.86Å; F469-L788 HydrophobicContact CE1-CD1 4.26Å; F469-L788 HydrophobicContact CE2-CB 4.13Å; F469-L788 HydrophobicContact CG-CB 4.08Å; F469-L788 HydrophobicContact CZ-CD1 4.42Å; V784-L788 HydrophobicContact CG1-CD1 4.15Å; V784-L788 WeakPolarHBondContact O-CG 3.02Å; V784-L788 PolarHBondContact O-N 3.05Å; F785-L788 HydrophobicContact CD1-CD1 4.29Å; F785-L788 PolarHBondContact O-N 2.87Å; L788-S792 VanDerWaalsContact O-CB 3.26Å; L788-S792 WeakPolarHBondContact O-CB 3.49Å; L788-S792 PolarHBondContact O-N 3.19Å; L788-S792 PolarHBondContact O-OG 2.82Å
789	T	95.3	Very high	94	Very high	0 Å²	0	54.8 Å²	54.8	0%	0	26%	0.26	C	S	.	.	H	α-helix	trans	-61.8	-53.2	173.5	-59.1	0	0	0	0	111.3	T466 F469 V470 V705 F785 I786 F787 Y791 S792 I793	T466-T789 HydrophobicContact CG2-CG2 4.33Å; F469-T789 VanDerWaalsContact C-OG1 3.27Å; F469-T789 VanDerWaalsContact CB-OG1 3.25Å; F469-T789 WeakPolarHBondContact CB-OG1 3.45Å; V470-T789 HydrophobicContact CB-CG2 3.86Å; V470-T789 HydrophobicContact CG2-CG2 4.32Å; V470-T789 PolarHBondContact N-OG1 3.35Å; V470-T789 VanDerWaalsContact N-OG1 3.14Å; V705-T789 HydrophobicContact CG1-CG2 3.72Å; F785-T789 WeakPolarHBondContact O-CB 3.26Å; F785-T789 PolarHBondContact O-N 2.85Å; F785-T789 PolarHBondContact O-OG1 3.46Å; I786-T789 HydrophobicContact CD1-CG2 4.29Å; I786-T789 WeakPolarHBondContact O-CB 3.42Å; I786-T789 PolarHBondContact O-N 3.44Å; F787-T789 VanDerWaalsContact C-N 3.27Å; F787-T789 PolarHBondContact O-N 2.74Å; T789-Y791 PolarHBondContact O-N 3.46Å; T789-S792 WeakPolarHBondContact O-CB 3.4Å; T789-S792 PolarHBondContact O-N 2.81Å; T789-I793 HydrophobicContact CG2-CD1 4.09Å; T789-I793 WeakPolarHBondContact O-CG1 3.03Å; T789-I793 PolarHBondContact O-N 3.38Å
790	W	95.9	Very high	93.6	Very high	51 Å²	51	56.9 Å²	56.9	19%	0.193	28%	0.278	C	S	.	.	H	α-helix	trans	-61	-43.7	178.3	173.8	83.8	0	0	0	112.1	A537 M541 I786 F787 S792 I793 K794	A537-W790 HydrophobicContact CB-CB 4.05Å; M541-W790 HydrophobicContact CE-CB 3.38Å; M541-W790 HydrophobicContact CE-CD2 3.55Å; M541-W790 HydrophobicContact CE-CE3 3.73Å; M541-W790 HydrophobicContact CE-CG 3.41Å; M541-W790 VanDerWaalsContact CE-CG 3.41Å; I786-W790 PolarHBondContact O-N 3.12Å; F787-W790 HydrophobicContact CE2-CE3 4.49Å; F787-W790 HydrophobicContact CE2-CZ3 4.42Å; F787-W790 PolarHBondContact O-N 2.96Å; W790-S792 PolarHBondContact O-N 3.32Å; W790-I793 PolarHBondContact O-N 2.95Å; W790-K794 HydrophobicContact CH2-CD 3.87Å; W790-K794 HydrophobicContact CZ2-CD 4.11Å; W790-K794 HydrophobicContact CZ3-CD 4.28Å; W790-K794 WeakPolarHBondContact O-CB 3.34Å; W790-K794 PolarHBondContact O-N 2.95Å
791	Y	95.3	Very high	93.2	Very high	121 Å²	121	56.4 Å²	56.4	48%	0.475	28%	0.277	S	S	.	.	H	α-helix	trans	-60.7	-44.4	176	-177.8	-89.2	0	0	0	111.4	F787 T789 I793 K794 H795	F787-Y791 WeakPolarHBondContact O-CB 3.37Å; F787-Y791 PolarHBondContact O-N 3.29Å; T789-Y791 PolarHBondContact O-N 3.46Å; Y791-I793 VanDerWaalsContact C-N 3.33Å; Y791-I793 PolarHBondContact O-N 3.36Å; Y791-K794 PolarHBondContact O-N 3.15Å; Y791-H795 WeakPolarHBondContact O-CB 3.44Å; Y791-H795 PolarHBondContact O-N 2.04Å
792	S	93.9	Very high	92.8	Very high	22 Å²	22	59.4 Å²	59.4	15%	0.154	28%	0.281	C	S	.	.	H	α-helix	trans	-61.2	-39.2	177.1	-62	0	0	0	0	112.7	L788 T789 W790 K796	L788-S792 VanDerWaalsContact O-CB 3.26Å; L788-S792 WeakPolarHBondContact O-CB 3.49Å; L788-S792 PolarHBondContact O-N 3.19Å; L788-S792 PolarHBondContact O-OG 2.82Å; T789-S792 WeakPolarHBondContact O-CB 3.4Å; T789-S792 PolarHBondContact O-N 2.81Å; W790-S792 PolarHBondContact O-N 3.32Å; S792-K796 WeakPolarHBondContact O-CB 3.46Å; S792-K796 WeakPolarHBondContact O-CG 3.07Å; S792-K796 PolarHBondContact O-N 3.34Å
793	I	92.9	Very high	92.1	Very high	15 Å²	15	68.3 Å²	68.3	8%	0.077	32%	0.315	C	S	.	.	H	α-helix	trans	-67.2	-51.1	175.8	-65.6	164.3	0	0	0	110	T466 R534 A537 V705 T789 W790 Y791 H795 K796 E797	T466-I793 HydrophobicContact CG2-CD1 4.07Å; T466-I793 HydrophobicContact CG2-CG1 3.64Å; R534-I793 HydrophobicContact CB-CG2 3.87Å; A537-I793 HydrophobicContact CB-CD1 3.95Å; V705-I793 HydrophobicContact CG1-CD1 3.9Å; T789-I793 HydrophobicContact CG2-CD1 4.09Å; T789-I793 WeakPolarHBondContact O-CG1 3.03Å; T789-I793 PolarHBondContact O-N 3.38Å; W790-I793 PolarHBondContact O-N 2.95Å; Y791-I793 VanDerWaalsContact C-N 3.33Å; Y791-I793 PolarHBondContact O-N 3.36Å; I793-H795 VanDerWaalsContact C-N 3.25Å; I793-H795 PolarHBondContact O-N 3.48Å; I793-K796 PolarHBondContact O-N 2.94Å; I793-E797 WeakPolarHBondContact CG2-OE1 3.45Å; I793-E797 WeakPolarHBondContact O-CG 3.42Å; I793-E797 PolarHBondContact O-N 3.17Å
794	K	93.4	Very high	91.2	Very high	90 Å²	90	75 Å²	75	39%	0.391	34%	0.338	S	S	.	.	H	α-helix	trans	-55.5	-39.7	176.5	-177.8	-173	173.6	-171.1	0	112	W790 Y791 A798	W790-K794 HydrophobicContact CH2-CD 3.87Å; W790-K794 HydrophobicContact CZ2-CD 4.11Å; W790-K794 HydrophobicContact CZ3-CD 4.28Å; W790-K794 WeakPolarHBondContact O-CB 3.34Å; W790-K794 PolarHBondContact O-N 2.95Å; Y791-K794 PolarHBondContact O-N 3.15Å; K794-A798 VanDerWaalsContact O-CB 3.31Å; K794-A798 WeakPolarHBondContact O-CB 3.21Å; K794-A798 PolarHBondContact O-N 3.13Å
795	H	91.4	Very high	90.3	Very high	77 Å²	77	79.3 Å²	79.3	36%	0.356	35%	0.354	S	S	.	.	H	α-helix	trans	-68.5	-46.2	177.9	-171.8	-92.4	0	0	0	112.2	Y791 I793 E797 A798 Q799	Y791-H795 WeakPolarHBondContact O-CB 3.44Å; Y791-H795 PolarHBondContact O-N 2.04Å; I793-H795 VanDerWaalsContact C-N 3.25Å; I793-H795 PolarHBondContact O-N 3.48Å; H795-E797 VanDerWaalsContact C-N 3.32Å; H795-E797 PolarHBondContact O-N 3.36Å; H795-A798 PolarHBondContact O-N 2.81Å; H795-Q799 PolarHBondContact CE1-NE2 2.8Å; H795-Q799 PolarHBondContact CE1-OE1 2.97Å; H795-Q799 VanDerWaalsContact CE1-OE1 3.32Å; H795-Q799 PolarHBondContact ND1-OE1 2.87Å; H795-Q799 WeakPolarHBondContact O-CG 3.39Å; H795-Q799 PolarHBondContact O-N 2.88Å
796	K	88.9	Confident	89.1	Confident	99 Å²	99	83.8 Å²	83.8	43%	0.43	38%	0.376	S	S	.	.	H	α-helix	trans	-58.4	-42.8	175.3	-78.5	175.3	172.5	177.3	0	111.7	N464 T466 S792 I793 Q799 A800	N464-K796 PolarHBondContact OD1-NZ 3.42Å; T466-K796 PolarHBondContact OG1-NZ 3.09Å; S792-K796 WeakPolarHBondContact O-CB 3.46Å; S792-K796 WeakPolarHBondContact O-CG 3.07Å; S792-K796 PolarHBondContact O-N 3.34Å; I793-K796 PolarHBondContact O-N 2.94Å; K796-Q799 PolarHBondContact O-N 2.91Å; K796-A800 WeakPolarHBondContact O-CB 3.08Å; K796-A800 PolarHBondContact O-N 3.27Å
797	E	88.9	Confident	87.5	Confident	60 Å²	60	89.7 Å²	89.7	28%	0.28	41%	0.407	S	S	.	.	H	α-helix	trans	-63.6	-51.1	175.1	-71.5	171.9	-169.2	0	0	111.9	R534 I793 H795 Q799 A800 E801	R534-E797 WeakPolarHBondContact CB-OE1 3.2Å; R534-E797 WeakPolarHBondContact CD-OE2 3.42Å; R534-E797 IonicContact CZ-OE2 2.79Å; R534-E797 IonicContact NE-OE2 3.12Å; R534-E797 IonicContact NH1-OE2 2.65Å; R534-E797 PolarHBondContact NH1-OE2 3.01Å; I793-E797 WeakPolarHBondContact CG2-OE1 3.45Å; I793-E797 WeakPolarHBondContact O-CG 3.42Å; I793-E797 PolarHBondContact O-N 3.17Å; H795-E797 VanDerWaalsContact C-N 3.32Å; H795-E797 PolarHBondContact O-N 3.36Å; E797-Q799 PolarHBondContact O-N 3.01Å; E797-A800 PolarHBondContact O-N 3Å; E797-E801 WeakPolarHBondContact O-CG 3.14Å; E797-E801 PolarHBondContact O-N 2.94Å
798	A	89.9	Confident	85.7	Confident	31 Å²	31	89.6 Å²	89.6	26%	0.256	42%	0.415	S	S	.	.	H	α-helix	trans	-67.5	-14.7	179	0	0	0	0	0	114.1	K794 H795 R802	K794-A798 VanDerWaalsContact O-CB 3.31Å; K794-A798 WeakPolarHBondContact O-CB 3.21Å; K794-A798 PolarHBondContact O-N 3.13Å; H795-A798 PolarHBondContact O-N 2.81Å; A798-R802 PolarHBondContact O-NE 2.95Å; A798-R802 PolarHBondContact O-NH2 3.11Å
799	Q	88.3	Confident	83.7	Confident	82 Å²	82	92.9 Å²	92.9	38%	0.383	44%	0.44	S	S	.	.	H	α-helix	trans	-81.5	-46.5	165	-75.7	-177.1	-57.4	0	0	111.1	H795 K796 E797 E801 R802 W803	H795-Q799 PolarHBondContact CE1-NE2 2.8Å; H795-Q799 PolarHBondContact CE1-OE1 2.97Å; H795-Q799 VanDerWaalsContact CE1-OE1 3.32Å; H795-Q799 PolarHBondContact ND1-OE1 2.87Å; H795-Q799 WeakPolarHBondContact O-CG 3.39Å; H795-Q799 PolarHBondContact O-N 2.88Å; K796-Q799 PolarHBondContact O-N 2.91Å; E797-Q799 PolarHBondContact O-N 3.01Å; Q799-E801 VanDerWaalsContact C-N 3.31Å; Q799-E801 PolarHBondContact O-N 2.66Å; Q799-R802 PolarHBondContact O-N 3.2Å; Q799-W803 PolarHBondContact O-N 2.62Å
800	A	86.7	Confident	81.6	Confident	45 Å²	45	100.6 Å²	100.6	37%	0.372	48%	0.481	S	S	.	.	H	α-helix	trans	-61.4	-37.3	178.6	0	0	0	0	0	112.8	K796 E797 W803 R804	K796-A800 WeakPolarHBondContact O-CB 3.08Å; K796-A800 PolarHBondContact O-N 3.27Å; E797-A800 PolarHBondContact O-N 3Å; A800-W803 PolarHBondContact O-N 3.35Å; A800-R804 WeakPolarHBondContact O-CG 3.42Å; A800-R804 PolarHBondContact O-N 2.93Å
801	E	88.6	Confident	79.3	Confident	105 Å²	105	100.7 Å²	100.7	49%	0.491	50%	0.497	S	S	.	.	H	α-helix	trans	-60.9	-48.3	172.4	-72.2	168.6	172	0	0	111.5	E797 Q799 W803 R804 Q805	E797-E801 WeakPolarHBondContact O-CG 3.14Å; E797-E801 PolarHBondContact O-N 2.94Å; Q799-E801 VanDerWaalsContact C-N 3.31Å; Q799-E801 PolarHBondContact O-N 2.66Å; E801-W803 PolarHBondContact O-N 3.06Å; E801-R804 WeakPolarHBondContact O-CB 3.45Å; E801-R804 PolarHBondContact O-N 2.96Å; E801-Q805 WeakPolarHBondContact O-CG 3.15Å; E801-Q805 PolarHBondContact O-N 2.87Å; E801-Q805 VanDerWaalsContact O-N 3.1Å
802	R	86.7	Confident	77.1	Confident	132 Å²	132	100.8 Å²	100.8	50%	0.498	51%	0.511	S	S	.	.	H	α-helix	trans	-62.9	-41.4	175.6	-84	179.6	-76.9	176.6	-4.9	112.4	A798 Q799 R804 Q805 H806	A798-R802 PolarHBondContact O-NE 2.95Å; A798-R802 PolarHBondContact O-NH2 3.11Å; Q799-R802 PolarHBondContact O-N 3.2Å; R802-R804 VanDerWaalsContact C-N 3.32Å; R802-R804 PolarHBondContact O-N 2.93Å; R802-Q805 WeakPolarHBondContact O-CB 3.31Å; R802-Q805 PolarHBondContact O-N 2.94Å; R802-Q805 VanDerWaalsContact O-N 3.12Å; R802-H806 PolarHBondContact O-N 3.39Å; R802-H806 VanDerWaalsContact O-N 3.14Å; R802-H806 PolarHBondContact O-ND1 2.71Å
803	W	79.6	Confident	74.8	Confident	187 Å²	187	105.2 Å²	105.2	71%	0.708	54%	0.536	S	S	*	.	H	α-helix	trans	-61.8	-37.6	174.8	-80.4	113.1	0	0	0	112.6	Q799 A800 E801 Q805 H806 L807	Q799-W803 PolarHBondContact O-N 2.62Å; A800-W803 PolarHBondContact O-N 3.35Å; E801-W803 PolarHBondContact O-N 3.06Å; W803-Q805 VanDerWaalsContact C-N 3.33Å; W803-Q805 PolarHBondContact O-N 3.1Å; W803-H806 PolarHBondContact O-N 3.05Å; W803-L807 PolarHBondContact O-N 3.41Å
804	R	78.9	Confident	72.4	Confident	195 Å²	195	109.5 Å²	109.5	74%	0.736	57%	0.568	S	S	*	*	H	α-helix	trans	-63.7	-36.4	172.2	-71.5	179	-168.2	-173.9	5.6	112.7	A800 E801 R802 H806 L807	A800-R804 WeakPolarHBondContact O-CG 3.42Å; A800-R804 PolarHBondContact O-N 2.93Å; E801-R804 WeakPolarHBondContact O-CB 3.45Å; E801-R804 PolarHBondContact O-N 2.96Å; R802-R804 VanDerWaalsContact C-N 3.32Å; R802-R804 PolarHBondContact O-N 2.93Å; R804-H806 VanDerWaalsContact C-N 3.29Å; R804-H806 PolarHBondContact O-N 2.97Å; R804-L807 PolarHBondContact O-N 3.03Å
805	Q	77.1	Confident	69.9	Low	151 Å²	151	113.7 Å²	113.7	71%	0.706	59%	0.589	S	S	*	*	H	α-helix	trans	-71.5	-20.1	176.9	-69.2	169.4	-22	0	0	113.6	E801 R802 W803	E801-Q805 WeakPolarHBondContact O-CG 3.15Å; E801-Q805 PolarHBondContact O-N 2.87Å; E801-Q805 VanDerWaalsContact O-N 3.1Å; R802-Q805 WeakPolarHBondContact O-CB 3.31Å; R802-Q805 PolarHBondContact O-N 2.94Å; R802-Q805 VanDerWaalsContact O-N 3.12Å; W803-Q805 VanDerWaalsContact C-N 3.33Å; W803-Q805 PolarHBondContact O-N 3.1Å
806	H	71.1	Confident	67.5	Low	145 Å²	145	117.5 Å²	117.5	67%	0.671	61%	0.611	S	S	*	*	T	Hydrogen-bonded Turn	trans	-95.6	-3	178.2	-71.1	67.5	0	0	0	113.6	R802 W803 R804	R802-H806 PolarHBondContact O-N 3.39Å; R802-H806 VanDerWaalsContact O-N 3.14Å; R802-H806 PolarHBondContact O-ND1 2.71Å; W803-H806 PolarHBondContact O-N 3.05Å; R804-H806 VanDerWaalsContact C-N 3.29Å; R804-H806 PolarHBondContact O-N 2.97Å
807	L	63.2	Low	65.1	Low	127 Å²	127	118.6 Å²	118.6	67%	0.665	63%	0.626	S	S	*	*	S	Bend	trans	-79.1	126.8	170.2	-84.9	156.6	0	0	0	109.5	W803 R804	W803-L807 PolarHBondContact O-N 3.41Å; R804-L807 PolarHBondContact O-N 3.03Å
808	P	57.2	Low	62.7	Low	88 Å²	88	120.7 Å²	120.7	57%	0.571	65%	0.646	S	S	*	*			trans	-65.5	149.7	177.6	27.6	-34.5	0	0	0	111.1	L810	P808-L810 HydrophobicContact CG-CD1 4.42Å; P808-L810 PolarHBondContact O-N 3.31Å
809	P	54	Low	60.3	Low	128 Å²	128	128.9 Å²	128.9	83%	0.831	68%	0.678	S	S	*	*	S	Bend	trans	-76.2	68.8	-174.3	32.2	-37	0	0	0	112.7
810	L	50.8	Low	57.8	Low	162 Å²	162	130 Å²	130	85%	0.848	70%	0.701	S	S	*	*			trans	-112	97.2	176.6	-78.4	165.4	0	0	0	110.3	P808	P808-L810 HydrophobicContact CG-CD1 4.42Å; P808-L810 PolarHBondContact O-N 3.31Å
811	G	47.7	Very low	55.3	Low	53 Å²	53	132 Å²	132	55%	0.546	73%	0.726	S	S	.	*	S	Bend	trans	164.9	-48.5	168.1	0	0	0	0	0	116.3	V813 S814	G811-V813 PolarHBondContact O-N 3.37Å; G811-S814 PolarHBondContact O-N 3.28Å; G811-S814 VanDerWaalsContact O-N 3.17Å
812	T	50.5	Low	52.6	Low	122 Å²	122	130.6 Å²	130.6	75%	0.748	74%	0.74	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.2	-7.7	-165.5	39.2	0	0	0	0	116.2	S814	T812-S814 VanDerWaalsContact C-N 3.34Å
813	V	44.5	Very low	49.9	Very low	115 Å²	115	135.5 Å²	135.5	70%	0.697	76%	0.759	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.1	-25.4	174.1	-176.8	0	0	0	0	111.8	G811 E815 L816	G811-V813 PolarHBondContact O-N 3.37Å; V813-E815 PolarHBondContact O-N 2.81Å; V813-L816 PolarHBondContact O-N 2.81Å
814	S	42.5	Very low	47.7	Very low	105 Å²	105	136 Å²	136	73%	0.734	77%	0.766	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.1	-14.6	-171.9	-164.7	0	0	0	0	115.4	G811 T812	G811-S814 PolarHBondContact O-N 3.28Å; G811-S814 VanDerWaalsContact O-N 3.17Å; T812-S814 VanDerWaalsContact C-N 3.34Å
815	E	41.5	Very low	45.3	Very low	178 Å²	178	132.3 Å²	132.3	83%	0.832	77%	0.77	S	S	*	*	T	Hydrogen-bonded Turn	trans	-94.1	-16.5	176.3	-72.4	-169.7	123.8	0	0	113.3	V813	V813-E815 PolarHBondContact O-N 2.81Å
816	L	40	Very low	43.4	Very low	158 Å²	158	134 Å²	134	83%	0.827	78%	0.777	S	S	*	*	S	Bend	trans	-90.5	-4.7	-170.8	-144.9	72.7	0	0	0	114.7	V813	V813-L816 PolarHBondContact O-N 2.81Å
817	V	40.4	Very low	41.4	Very low	121 Å²	121	132 Å²	132	73%	0.733	79%	0.786	S	S	*	*	S	Bend	trans	-110.1	32.1	-174.8	-160.8	0	0	0	0	111.9
818	C	37.4	Very low	39.9	Very low	105 Å²	105	137.7 Å²	137.7	71%	0.709	80%	0.799	S	S	*	*	S	Bend	trans	-133.6	25.2	-177.4	-85.4	0	0	0	0	115.3
819	H	40.6	Very low	39.1	Very low	203 Å²	203	140.1 Å²	140.1	94%	0.94	81%	0.812	S	S	*	*			trans	-138.2	83.2	167.2	-89.9	-57.1	0	0	0	113.5
820	A	35.9	Very low	38.2	Very low	104 Å²	104	145.9 Å²	145.9	86%	0.86	82%	0.817	S	S	*	*			trans	-149.4	139.8	161.5	0	0	0	0	0	110.2
821	G	32.5	Very low	37.4	Very low	87 Å²	87	143.5 Å²	143.5	90%	0.897	81%	0.814	S	S	*	*			trans	82.2	160.2	-179.5	0	0	0	0	0	114.8
822	G	32.8	Very low	36.6	Very low	76 Å²	76	146.6 Å²	146.6	78%	0.784	83%	0.826	S	S	*	*			trans	-161.5	-170.4	-177.2	0	0	0	0	0	114.5
823	R	30.3	Very low	36	Very low	235 Å²	235	146 Å²	146	89%	0.887	82%	0.824	S	S	*	*			trans	77	112.5	-175.6	-73.2	-176.5	165.6	179.5	-2.1	118.2
824	K	32.1	Very low	35.3	Very low	199 Å²	199	146.9 Å²	146.9	87%	0.865	83%	0.83	S	S	*	*			trans	70.4	123.9	134.7	-67.4	-170.9	173.2	-172.3	0	121.2
825	S	29.6	Very low	34.7	Very low	116 Å²	116	151.2 Å²	151.2	81%	0.811	84%	0.835	S	S	*	*			trans	104.1	159.9	140.4	-144.3	0	0	0	0	118.7
826	H	35.9	Very low	34.3	Very low	186 Å²	186	149.5 Å²	149.5	86%	0.861	83%	0.831	S	S	*	*			trans	-62.4	143.7	-157.4	-57.5	-85	0	0	0	117.3
827	A	30.5	Very low	33.9	Very low	104 Å²	104	147.3 Å²	147.3	86%	0.86	83%	0.826	S	S	*	*			trans	-149.5	157.4	145.3	0	0	0	0	0	112
828	R	32.2	Very low	33.6	Very low	247 Å²	247	147.5 Å²	147.5	93%	0.932	83%	0.829	S	S	*	*			trans	-75.8	157.3	-177.7	-77.1	175	168.1	128.9	-4.6	113.3
829	T	40.4	Very low	33.3	Very low	138 Å²	138	153.1 Å²	153.1	85%	0.847	84%	0.836	S	S	*	*			trans	-65.9	142.8	163.6	46.3	0	0	0	0	112.8
830	R	33.7	Very low	33	Very low	250 Å²	250	149.4 Å²	149.4	94%	0.943	83%	0.83	S	S	*	*			trans	-148.6	150.5	147	-117.4	179.2	-179.4	-169	-1.3	110.6
831	S	35.2	Very low	32.5	Very low	111 Å²	111	151.8 Å²	151.8	78%	0.776	83%	0.828	S	S	*	*	P	Polyproline II helix	trans	-76.6	142.2	-166.6	49	0	0	0	0	115
832	C	30.1	Very low	32.6	Very low	119 Å²	119	154.1 Å²	154.1	80%	0.804	82%	0.824	S	S	*	*	P	Polyproline II helix	trans	-92.3	141.8	156.4	-63.5	0	0	0	0	110.3
833	P	37.7	Very low	32.6	Very low	110 Å²	110	156.3 Å²	156.3	71%	0.714	83%	0.825	S	S	*	*	P	Polyproline II helix	trans	-80.3	149.8	174.3	33.2	-34.2	0	0	0	111.8
834	V	30.7	Very low	32.5	Very low	133 Å²	133	151.8 Å²	151.8	81%	0.806	82%	0.823	S	S	*	*	P	Polyproline II helix	trans	-89.6	122.8	170.9	176.2	0	0	0	0	109.1
835	F	28.8	Very low	32.3	Very low	195 Å²	195	146.8 Å²	146.8	86%	0.855	82%	0.819	S	S	*	*	P	Polyproline II helix	trans	-70.6	129.4	170.8	-95.2	-96.3	0	0	0	110.7
836	I	34.3	Very low	32.1	Very low	143 Å²	143	149.5 Å²	149.5	73%	0.733	82%	0.821	S	S	*	*			trans	-113	125.1	169.5	-61.3	173.9	0	0	0	106.9
837	P	31.7	Very low	31.7	Very low	111 Å²	111	147.7 Å²	147.7	72%	0.721	82%	0.816	S	S	*	*	P	Polyproline II helix	trans	-71.8	134	175.4	29.3	-33.2	0	0	0	110.3
838	P	33.4	Very low	31.5	Very low	125 Å²	125	150.3 Å²	150.3	81%	0.812	82%	0.815	S	S	*	*	P	Polyproline II helix	trans	-72.5	149.3	178.8	30.1	-34.7	0	0	0	111.7
839	R	30.9	Very low	31.2	Very low	223 Å²	223	144 Å²	144	84%	0.842	80%	0.8	S	S	*	*	P	Polyproline II helix	trans	-85.8	148.9	159.1	-70.8	-179.5	174.1	-179.2	-3.1	109
840	P	33.9	Very low	30.6	Very low	125 Å²	125	148.1 Å²	148.1	81%	0.812	80%	0.8	S	S	*	*	P	Polyproline II helix	trans	-78.2	123	168.6	31.4	-31.5	0	0	0	110.3
841	D	26.8	Very low	30.2	Very low	155 Å²	155	139.4 Å²	139.4	83%	0.829	79%	0.788	S	S	*	*	P	Polyproline II helix	trans	-91.1	152.3	165.6	-74.3	-45.8	0	0	0	110.5
842	V	32.9	Very low	29.8	Very low	135 Å²	135	142.8 Å²	142.8	82%	0.818	79%	0.791	S	S	*	*	P	Polyproline II helix	trans	-102.6	127.4	-175.6	176.5	0	0	0	0	111.1
843	P	32.8	Very low	29.7	Very low	123 Å²	123	142.2 Å²	142.2	80%	0.799	79%	0.788	S	S	*	*	P	Polyproline II helix	trans	-97.5	152.8	160.5	35.2	-29.3	0	0	0	112.1
844	V	29.4	Very low	29.2	Very low	140 Å²	140	141.2 Å²	141.2	85%	0.848	78%	0.784	S	S	*	*			trans	-113.9	128.2	179	172.6	0	0	0	0	109.9
845	A	28.2	Very low	29.1	Very low	93 Å²	93	142.5 Å²	142.5	77%	0.769	79%	0.785	S	S	*	*			trans	-175.5	126.6	148.3	0	0	0	0	0	114.9
846	M	25	Very low	29.1	Very low	173 Å²	173	137.3 Å²	137.3	85%	0.852	77%	0.773	S	S	*	*			trans	35.2	122.9	137.4	-74.5	-179	155.8	0	0	125
847	L	27.1	Very low	28.8	Very low	148 Å²	148	136.4 Å²	136.4	78%	0.775	78%	0.778	S	S	*	*				75.4	153.8	126.9	-78.1	165	0	0	0	123.4
848	L	26.6	Very low	29.4	Very low	160 Å²	160	137.4 Å²	137.4	84%	0.838	79%	0.785	S	S	*	*			trans	67.7	119.7	178	-58.6	167.4	0	0	0	114.2
849	D	25.6	Very low	29.2	Very low	113 Å²	113	134.6 Å²	134.6	60%	0.604	78%	0.778	S	S	*	*			cis	100.2	122.3	36.9	-170.4	40.9	0	0	0	113.1
850	R	27.5	Very low	29.3	Very low	226 Å²	226	132.3 Å²	132.3	85%	0.853	78%	0.783	S	S	*	*			trans	54.2	152.8	176.2	-73.5	158.2	171.1	132.4	-13.7	117.8
851	G	25.4	Very low	29.1	Very low	66 Å²	66	129.6 Å²	129.6	68%	0.68	78%	0.778	S	S	*	*			cis	171.5	171.4	-6.5	0	0	0	0	0	112.6
852	H	27.4	Very low	29.3	Very low	183 Å²	183	130.6 Å²	130.6	85%	0.847	78%	0.782	S	S	*	*			trans	35.7	115.4	155.3	-72.8	-17.9	0	0	0	120.3
853	S	27.2	Very low	29.1	Very low	107 Å²	107	133.7 Å²	133.7	75%	0.748	79%	0.785	S	S	*	*				97.7	153.8	99.4	74.9	0	0	0	0	113.6
854	S	27.6	Very low	29	Very low	89 Å²	89	131.2 Å²	131.2	62%	0.622	77%	0.774	S	S	*	*			cis	-175.6	160	-18.8	50.7	0	0	0	0	110.5
855	L	29.1	Very low	29.1	Very low	160 Å²	160	132.1 Å²	132.1	84%	0.838	77%	0.773	S	S	*	*			trans	67.3	153.4	159.4	-62.5	155.5	0	0	0	117.4
856	S	27.9	Very low	29.6	Very low	86 Å²	86	132.7 Å²	132.7	60%	0.601	77%	0.769	S	S	*	*			cis	-172.8	137.5	-25.7	52	0	0	0	0	113.7
857	C	28.3	Very low	30.7	Very low	124 Å²	124	130.3 Å²	130.3	84%	0.838	77%	0.766	S	S	*	*			trans	62	174	146.5	-63.1	0	0	0	0	119.2
858	P	44.1	Very low	31.2	Very low	131 Å²	131	129.2 Å²	129.2	85%	0.851	77%	0.768	S	S	*	*			cis	-112.6	178.8	-14.1	39.6	-27.1	0	0	0	112.5
859	G	30.3	Very low	31.3	Very low	66 Å²	66	127.9 Å²	127.9	68%	0.68	77%	0.766	S	S	*	*			cis	160	116.8	-10.1	0	0	0	0	0	113
860	N	32.5	Very low	31.5	Very low	176 Å²	176	127.1 Å²	127.1	94%	0.941	77%	0.769	S	S	*	*			trans	-174.4	134.3	159.9	-102.6	-18	0	0	0	108.3
861	G	29.4	Very low	31.6	Very low	68 Å²	68	123.9 Å²	123.9	70%	0.701	77%	0.768	S	S	*	*			cis	169.5	42.6	-4.4	0	0	0	0	0	116.2
862	L	31.2	Very low	32.9	Very low	175 Å²	175	125.8 Å²	125.8	92%	0.916	77%	0.768	S	S	*	*			trans	-159.6	139.8	171.4	-109.1	157.6	0	0	0	113.7
863	K	29.6	Very low	33	Very low	201 Å²	201	124.2 Å²	124.2	87%	0.874	76%	0.761	S	S	*	*			trans	-164.6	153.5	178.6	-113.6	-164.9	175.1	-178.4	0	106.9
864	A	30.4	Very low	33.1	Very low	70 Å²	70	125.9 Å²	125.9	58%	0.579	76%	0.757	S	S	*	*			cis	-163.8	-163	-7.6	0	0	0	0	0	108.8
865	I	30.9	Very low	33.2	Very low	160 Å²	160	129.7 Å²	129.7	82%	0.821	76%	0.764	S	S	*	*			trans	73.7	144.4	157.3	-62.3	142.4	0	0	0	115.7
866	P	37.6	Very low	33.3	Very low	105 Å²	105	134 Å²	134	68%	0.682	77%	0.769	S	S	*	*			cis	-132	-161.4	-35.9	39.2	-18.8	0	0	0	111
867	P	49	Very low	33.3	Very low	122 Å²	122	133.2 Å²	133.2	79%	0.792	78%	0.776	S	S	*	*			trans	-94.8	147	164.7	35.1	-33.6	0	0	0	113.9
868	P	37.2	Very low	33.5	Very low	125 Å²	125	133.6 Å²	133.6	81%	0.812	78%	0.78	S	S	*	*			trans	-123.2	173.5	168.8	39.9	-28.9	0	0	0	114.6
869	V	30.1	Very low	33.1	Very low	133 Å²	133	131.6 Å²	131.6	81%	0.806	77%	0.774	S	S	*	*			trans	-140.5	125.4	-171.4	172.3	0	0	0	0	113.2
870	S	29.6	Very low	33.3	Very low	96 Å²	96	137.4 Å²	137.4	67%	0.671	78%	0.783	S	S	*	*			trans	71.2	170	151.3	78.2	0	0	0	0	123.2
871	L	29.8	Very low	33.5	Very low	158 Å²	158	139 Å²	139	83%	0.827	80%	0.799	S	S	*	*			trans	82.7	152.5	161.2	-68.7	161.8	0	0	0	118.9
872	P	51.7	Low	33.7	Very low	106 Å²	106	142.6 Å²	142.6	69%	0.688	80%	0.804	S	S	*	*			cis	-125.2	-151.8	-2.4	40.4	-21.1	0	0	0	112.8
873	H	29.4	Very low	33.9	Very low	151 Å²	151	140.9 Å²	140.9	70%	0.699	80%	0.798	S	S	*	*			cis	-158.9	173.7	-2.2	-143.5	-86.7	0	0	0	111.7
874	H	29.4	Very low	34.1	Very low	142 Å²	142	137.6 Å²	137.6	66%	0.657	79%	0.794	S	S	*	*			trans	68.9	104.7	154	-79.3	-48.2	0	0	0	126.2
875	H	30.7	Very low	34.3	Very low	168 Å²	168	141.5 Å²	141.5	78%	0.778	81%	0.807	S	S	*	*				77.7	135.1	125.2	-88	-39.9	0	0	0	126.8
876	R	30.8	Very low	34.5	Very low	250 Å²	250	140.4 Å²	140.4	94%	0.943	81%	0.806	S	S	*	*			trans	66.4	130.4	165	-73.9	-176.1	170.9	-179.6	-2.8	117.6
877	G	28.5	Very low	34.3	Very low	71 Å²	71	142.7 Å²	142.7	73%	0.732	81%	0.814	S	S	*	*			cis	156.5	146.1	-13.4	0	0	0	0	0	114.6
878	S	32.3	Very low	33.3	Very low	132 Å²	132	144.2 Å²	144.2	92%	0.923	82%	0.816	S	S	*	*			trans	65.5	153.4	172	-73.9	0	0	0	0	117.5
879	A	35.8	Very low	33	Very low	89 Å²	89	145.7 Å²	145.7	74%	0.736	82%	0.816	S	S	*	*			cis	-159.6	-173.6	-13.4	0	0	0	0	0	110.2
880	H	34.2	Very low	33.2	Very low	187 Å²	187	146.8 Å²	146.8	87%	0.866	82%	0.817	S	S	*	*			trans	-40.7	145	168	-64.3	-91.8	0	0	0	113.1
881	V	36.9	Very low	33.6	Very low	211 Å²	211	151.4 Å²	151.4	100%	1.279	83%	0.83	S	S	*	*				-146.9	0	64.6	158.5	0	0	0	0	111.5

Retrieved 881 of 881 residues in 455.8 ms (Link to these results)

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