A0A087YCB5_POEFO Loading...

Solute carrier family 12 member 2

AlphaFold DB , UniProt , Accession A0A087YCB5, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 947 aa.

						>A0A087YCB5_POEFO|A0A087YCB5
MSEPSSAPSAPADSATMENDFLAPDAGQRPSGPTPSQSRFQVDLVSEAAGASEEKSASSENSAAGGDEAKGRFRVVNFADPNGSGSGASPEAVPPEGLQNGDTVMSETSLHSSTGGQHHYHYDTHTNTYYLRTFGHNTIDAVPKIDFYRQTAAPLGEKLVRPTLSELHDGLEKEPFEDGFPNGDELSPAEEAAAKEAAEPKGVVKFGWIKGVLVSHFKNSGLIPLYLLYQTLLGQEGHSALACVIVGMATVVTTITGLSTSAIATNGFVRGGGAYYLISRSLGPEFGGSIGLIFAFANAVAVAMYVVGFAETVVELLKGVDALMTDDINDIRIIGTITVIVLLGISVAGMEWEAKAQIFLLVVLVTAIVNYFIGSFISVELKKPSGFFGYDAEIMWENMGPDFRDETFFSVFAIFFPAATGILAGANISGDLADPQMAIPKGTLLAILITGIVYLGVAVSTGSCIVRDASGNLNDTITTQFTANCTGASCKFGFDFSSCKSQKNCRYGLHYDFQVMSLVSGFSPIISAGIFSATLSSALASLVSAPKVFQQALCKDNIYPYIGIFAKGYGKNNEPLRGYILTFGIALAFILIAELNTIAPIISNFFLASYALINFSVFHASLANSPGWRPSFKYYNMWVSLAGAVLCCVVMFVINWAAALLTNVIVMALYIYVSHKKPDVNWGSSTQALTYQQALTHTLHLSAVEDHVKNFRRPQCLVMTGYPNSRPALLDLVHTFTKNVGLMICGHVRMGYRKPNFKDLAADQSRYQRWLMRNETKAFYTPVFAEDLRQGSQYLLQAAGLGRLRPNTLVLGFKNDWRDGDMMNVETYINMIHDAFDFQYGAVILRLQEGLDVSHIQGQDELLSSQEKSSGAKDVIVSIDTSKDSDCDSSKPSSKTTSLQNSPAVQKGQSAHFLQLTQEAADTDMADGKYYKANYYTRSSLVCYVCL
					

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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	33.8	Very low	36.9	Very low	237 Å²	237	126.1 Å²	126.1	100%	1.167	81%	0.805	S	S	*	*				0	78.2	0	-76.4	176	166.2	0	0	106.1
2	S	32.7	Very low	36.1	Very low	119 Å²	119	122.5 Å²	122.5	83%	0.832	80%	0.795	S	S	*	*				75	98.8	91.4	-45.9	0	0	0	0	111.4
3	E	38.1	Very low	35.4	Very low	177 Å²	177	124.6 Å²	124.6	83%	0.827	80%	0.796	S	S	*	*			trans	-38.6	161.7	154.8	-110.6	178.6	-157.3	0	0	113.5
4	P	51.5	Low	34.7	Very low	124 Å²	124	123.7 Å²	123.7	81%	0.805	80%	0.795	S	S	*	*				-155.1	-171.2	72.1	40.7	-17.7	0	0	0	117.8
5	S	33.2	Very low	34.2	Very low	92 Å²	92	120.9 Å²	120.9	64%	0.643	79%	0.786	S	S	*	*			trans	-107.3	170	-164.3	49.5	0	0	0	0	115
6	S	34.2	Very low	33.7	Very low	108 Å²	108	120.9 Å²	120.9	76%	0.755	78%	0.784	S	S	*	*			trans	94.5	120.6	137.9	73.5	0	0	0	0	123.7
7	A	31.6	Very low	33.3	Very low	95 Å²	95	123.3 Å²	123.3	79%	0.785	79%	0.785	S	S	*	*			trans	68.9	173.7	134.9	0	0	0	0	0	119.9
8	P	47.6	Very low	32.9	Very low	112 Å²	112	124.6 Å²	124.6	73%	0.727	78%	0.779	S	S	*	*			cis	-148.5	174.2	5.9	44.2	-23.5	0	0	0	119.4
9	S	27.9	Very low	32.6	Very low	108 Å²	108	124.3 Å²	124.3	76%	0.755	77%	0.772	S	S	*	*			trans	28.1	144.2	141.6	64.7	0	0	0	0	126.1
10	A	33	Very low	32.2	Very low	91 Å²	91	124.5 Å²	124.5	75%	0.752	77%	0.767	S	S	*	*			trans	-57.6	169.5	163.5	0	0	0	0	0	115.4
11	P	42.5	Very low	31.9	Very low	124 Å²	124	127 Å²	127	81%	0.805	77%	0.768	S	S	*	*				-155.3	157	108.8	37	-17.2	0	0	0	118.7
12	A	27.1	Very low	31.5	Very low	83 Å²	83	123.2 Å²	123.2	69%	0.686	75%	0.751	S	S	*	*			trans	59.9	137.5	131.9	0	0	0	0	0	125.9
13	D	27.2	Very low	31.3	Very low	150 Å²	150	121.6 Å²	121.6	80%	0.802	75%	0.745	S	S	*	*			trans	95.2	113.1	134.1	-69.9	-16	0	0	0	124.4
14	S	25.9	Very low	31.4	Very low	112 Å²	112	118.5 Å²	118.5	78%	0.783	74%	0.74	S	S	*	*				108.5	122.2	116.8	72.4	0	0	0	0	121.7
15	A	26.4	Very low	30.2	Very low	81 Å²	81	120 Å²	120	67%	0.669	74%	0.741	S	S	*	*				87.6	117.9	126.2	0	0	0	0	0	122.6
16	T	26.5	Very low	29.9	Very low	121 Å²	121	120.1 Å²	120.1	74%	0.742	75%	0.748	S	S	*	*				92.2	126.9	124.7	49	0	0	0	0	123.2
17	M	26.1	Very low	29.4	Very low	162 Å²	162	118.4 Å²	118.4	80%	0.798	75%	0.747	S	S	*	*			trans	75.1	137.7	146.4	-66.7	175	169.3	0	0	117.5
18	E	27.3	Very low	29.3	Very low	146 Å²	146	123.3 Å²	123.3	68%	0.682	75%	0.754	S	S	*	*			cis	-167.7	143.7	4.9	-114.3	179.1	137.6	0	0	108.3
19	N	26.7	Very low	28.2	Very low	120 Å²	120	129.2 Å²	129.2	64%	0.642	76%	0.762	S	S	*	*			trans	52	147.8	138.1	-53.5	-12.2	0	0	0	121.1
20	D	24.7	Very low	28.9	Very low	128 Å²	128	129.4 Å²	129.4	68%	0.684	76%	0.76	S	S	*	*			cis	-171.1	130.6	-13.4	-106.1	-29.9	0	0	0	103.8
21	F	25.1	Very low	28.6	Very low	178 Å²	178	130.6 Å²	130.6	78%	0.781	76%	0.763	S	S	*	*				57	109.9	98.9	-105.6	-77.8	0	0	0	116
22	L	26.6	Very low	27.9	Very low	157 Å²	157	128 Å²	128	82%	0.822	76%	0.758	S	S	*	*				156.2	136.9	112.3	-83.5	160.9	0	0	0	113.3
23	A	27.2	Very low	28.2	Very low	84 Å²	84	130.1 Å²	130.1	69%	0.694	77%	0.766	S	S	*	*			trans	-58.6	-173.1	154	0	0	0	0	0	110.4
24	P	41.6	Very low	28.3	Very low	112 Å²	112	129 Å²	129	73%	0.727	77%	0.765	S	S	*	*			cis	-150.6	-169.3	17.6	37	-10.7	0	0	0	116.3
25	D	26.2	Very low	29.1	Very low	156 Å²	156	129.3 Å²	129.3	83%	0.834	76%	0.763	S	S	*	*			trans	95.6	125.1	139.1	-96.3	-19.9	0	0	0	124.7
26	A	26	Very low	29.2	Very low	95 Å²	95	130.4 Å²	130.4	79%	0.785	77%	0.766	S	S	*	*			trans	69.5	117.8	132.1	0	0	0	0	0	122.6
27	G	24.9	Very low	29.3	Very low	71 Å²	71	133.8 Å²	133.8	73%	0.732	77%	0.774	S	S	*	*				125	125.7	113.4	0	0	0	0	0	119.3
28	Q	29.5	Very low	29.5	Very low	199 Å²	199	131.3 Å²	131.3	93%	0.93	77%	0.772	S	S	*	*			trans	95.1	106.8	139.8	-62.1	179.6	-14.3	0	0	120.9
29	R	23.5	Very low	29.6	Very low	235 Å²	235	134.5 Å²	134.5	89%	0.887	78%	0.778	S	S	*	*			trans	-64	179.3	141.1	-67.9	179.2	175.1	173.5	-1	110.1
30	P	42.1	Very low	29.6	Very low	112 Å²	112	136.5 Å²	136.5	73%	0.727	78%	0.781	S	S	*	*			cis	-135.1	178.3	-7.6	28.9	-5.8	0	0	0	114
31	S	27.5	Very low	29.5	Very low	117 Å²	117	139.1 Å²	139.1	82%	0.818	79%	0.79	S	S	*	*				156.7	117.6	120.3	50.9	0	0	0	0	112.3
32	G	27.8	Very low	29.5	Very low	68 Å²	68	136.7 Å²	136.7	70%	0.701	79%	0.789	S	S	*	*			trans	-73.9	-168.1	166.7	0	0	0	0	0	112.3
33	P	33.5	Very low	29.4	Very low	129 Å²	129	135.9 Å²	135.9	84%	0.838	79%	0.785	S	S	*	*				-137.5	155.9	60.8	33.1	-14.1	0	0	0	116.8
34	T	29.2	Very low	29.3	Very low	127 Å²	127	138.6 Å²	138.6	78%	0.779	79%	0.787	S	S	*	*			trans	-61.5	-171.3	157.6	44.4	0	0	0	0	111.9
35	P	42.8	Very low	28.5	Very low	117 Å²	117	140.1 Å²	140.1	76%	0.76	79%	0.794	S	S	*	*			cis	-131.6	173.8	3.3	23.7	3.9	0	0	0	112.7
36	S	28.1	Very low	28.5	Very low	104 Å²	104	137.2 Å²	137.2	73%	0.727	79%	0.787	S	S	*	*				-174.1	124.1	59.2	54	0	0	0	0	113.5
37	Q	29.8	Very low	28.5	Very low	193 Å²	193	142 Å²	142	90%	0.902	79%	0.793	S	S	*	*			trans	40.7	137	132.9	-60.5	-175	-14.1	0	0	120
38	S	29	Very low	28.5	Very low	109 Å²	109	142.8 Å²	142.8	76%	0.762	79%	0.792	S	S	*	*			cis	-165.4	131.8	35.8	63.5	0	0	0	0	109.8
39	R	30.6	Very low	28.3	Very low	214 Å²	214	138.6 Å²	138.6	81%	0.808	79%	0.792	S	S	*	*				78.1	125.7	88.7	-162.2	178.2	-144.1	-157.9	0.1	112.9
40	F	25.8	Very low	28.3	Very low	162 Å²	162	130.9 Å²	130.9	71%	0.711	79%	0.785	S	S	*	*			cis	-157.9	147.1	18.1	-123.2	-53.1	0	0	0	110.6
41	Q	23.4	Very low	27.5	Very low	183 Å²	183	130.4 Å²	130.4	86%	0.855	79%	0.79	S	S	*	*			trans	-131.7	147.5	166.9	-173.6	168.6	1.4	0	0	107.7
42	V	24.8	Very low	27.4	Very low	127 Å²	127	130 Å²	130	77%	0.77	79%	0.788	S	S	*	*			trans	-128.3	125.9	172.9	175.5	0	0	0	0	107.4
43	D	23.3	Very low	27.3	Very low	139 Å²	139	136.3 Å²	136.3	74%	0.743	80%	0.799	S	S	*	*			trans	-157.8	148.7	145	-127.1	-13.6	0	0	0	113.9
44	L	25.3	Very low	26.8	Very low	141 Å²	141	139.4 Å²	139.4	74%	0.738	80%	0.802	S	S	*	*			trans	65.1	124.6	153.9	-71.3	153.9	0	0	0	121.7
45	V	25.5	Very low	26.6	Very low	144 Å²	144	143.2 Å²	143.2	87%	0.873	81%	0.808	S	S	*	*			trans	-141.4	127.6	142	178.6	0	0	0	0	110
46	S	25.6	Very low	25.6	Very low	96 Å²	96	142.9 Å²	142.9	67%	0.671	81%	0.809	S	S	*	*			trans	-110.2	163.2	158.7	45	0	0	0	0	109.7
47	E	25.8	Very low	25.4	Very low	195 Å²	195	142.2 Å²	142.2	91%	0.911	81%	0.809	S	S	*	*			trans	91.7	162.7	156.3	-114.5	-175.9	158.6	0	0	120.8
48	A	25.1	Very low	25	Very low	88 Å²	88	138.1 Å²	138.1	73%	0.727	80%	0.802	S	S	*	*			trans	-115.6	176	-139.8	0	0	0	0	0	114.1
49	A	25.6	Very low	24.8	Very low	111 Å²	111	137.9 Å²	137.9	92%	0.917	80%	0.8	S	S	*	*			trans	67.4	142.3	166.1	0	0	0	0	0	117.3
50	G	23.7	Very low	24.4	Very low	73 Å²	73	136 Å²	136	75%	0.753	80%	0.801	S	S	*	*			cis	170.9	169.1	1.8	0	0	0	0	0	110.6
51	A	25.4	Very low	24.3	Very low	101 Å²	101	135.2 Å²	135.2	84%	0.835	80%	0.804	S	S	*	*			trans	66.8	145.7	162.3	0	0	0	0	0	118
52	S	24.8	Very low	24.3	Very low	109 Å²	109	132 Å²	132	76%	0.762	80%	0.802	S	S	*	*			cis	-163	150	28.7	-35.7	0	0	0	0	107.7
53	E	25.3	Very low	24.2	Very low	200 Å²	200	130.4 Å²	130.4	94%	0.935	80%	0.802	S	S	*	*				-171.6	149.5	93	-97.6	-175.1	159.3	0	0	111.6
54	E	24.7	Very low	24.2	Very low	194 Å²	194	129 Å²	129	91%	0.907	81%	0.81	S	S	*	*			trans	-85.6	146.9	-174.4	-61.1	174.7	136.7	0	0	114.2
55	K	24.6	Very low	24.2	Very low	208 Å²	208	126.1 Å²	126.1	90%	0.904	81%	0.813	S	S	*	*				-163.8	133.9	127.4	-125.7	174.5	-177.1	173.5	0	113.2
56	S	22.1	Very low	24.1	Very low	110 Å²	110	122.7 Å²	122.7	77%	0.769	81%	0.808	S	S	*	*			trans	-69.8	147.2	178.9	52.9	0	0	0	0	115.5
57	A	23.8	Very low	24.1	Very low	90 Å²	90	125.6 Å²	125.6	74%	0.744	82%	0.816	S	S	*	*				160.1	115.7	117.6	0	0	0	0	0	113.7
58	S	21.6	Very low	24.1	Very low	107 Å²	107	124.1 Å²	124.1	75%	0.748	81%	0.809	S	S	*	*			trans	39.9	129.8	133.7	69.5	0	0	0	0	123.6
59	S	23.6	Very low	24.2	Very low	104 Å²	104	124.9 Å²	124.9	73%	0.727	82%	0.815	S	S	*	*				116.6	112.3	128.8	-58.5	0	0	0	0	119.3
60	E	23	Very low	24.2	Very low	175 Å²	175	128.5 Å²	128.5	82%	0.818	81%	0.81	S	S	*	*			trans	58.6	119	132.6	-66.9	-170.9	156.2	0	0	123.6
61	N	23.6	Very low	24.3	Very low	144 Å²	144	128.6 Å²	128.6	77%	0.77	81%	0.811	S	S	*	*			trans	62.7	125.3	130.9	-80.2	-14.3	0	0	0	122.4
62	S	23.3	Very low	24.4	Very low	116 Å²	116	134.3 Å²	134.3	81%	0.811	81%	0.811	S	S	*	*				106.7	127.8	125.8	69.3	0	0	0	0	120.5
63	A	23.2	Very low	24.3	Very low	94 Å²	94	139.2 Å²	139.2	78%	0.777	82%	0.819	S	S	*	*			trans	80.6	108.5	145.3	0	0	0	0	0	121.4
64	A	22.9	Very low	24.4	Very low	110 Å²	110	139.8 Å²	139.8	91%	0.909	81%	0.813	S	S	*	*				65.4	132.3	123.4	0	0	0	0	0	121.8
65	G	24	Very low	24.4	Very low	79 Å²	79	137.4 Å²	137.4	81%	0.814	81%	0.811	S	S	*	*			trans	151.5	111.8	147.9	0	0	0	0	0	115
66	G	24.5	Very low	24.6	Very low	73 Å²	73	132.1 Å²	132.1	75%	0.753	80%	0.796	S	S	*	*			trans	-72.8	167.2	-177.2	0	0	0	0	0	117.3
67	D	25.7	Very low	24.7	Very low	157 Å²	157	135 Å²	135	84%	0.84	80%	0.803	S	S	*	*			trans	87.7	125.1	139.2	-66.7	-25.7	0	0	0	124.5
68	E	25.1	Very low	25	Very low	163 Å²	163	138.4 Å²	138.4	76%	0.762	80%	0.801	S	S	*	*			trans	48.9	122.1	144.3	-73.9	-166.6	116	0	0	121.4
69	A	26.9	Very low	25.2	Very low	104 Å²	104	138.2 Å²	138.2	86%	0.86	81%	0.806	S	S	*	*				-167.5	139.1	111.5	0	0	0	0	0	113.9
70	K	26.8	Very low	25.4	Very low	187 Å²	187	139.6 Å²	139.6	81%	0.813	81%	0.805	S	S	*	*			trans	-63.8	152.8	173.7	-72.8	150.1	167.1	148.7	0	114.4
71	G	25.6	Very low	26.3	Very low	76 Å²	76	136 Å²	136	78%	0.784	80%	0.797	S	S	*	*			trans	-141.4	104.1	147.1	0	0	0	0	0	108.5
72	R	27.9	Very low	26.5	Very low	220 Å²	220	137 Å²	137	83%	0.83	80%	0.802	S	S	*	*				92.5	114.7	65.7	-166.6	-178.1	-166.4	-177.5	4	111.4
73	F	21.6	Very low	26.8	Very low	212 Å²	212	134.8 Å²	134.8	93%	0.93	80%	0.798	S	S	*	*			trans	-128.9	119	148	-111.2	-90.3	0	0	0	107.3
74	R	27.9	Very low	27	Very low	213 Å²	213	136.4 Å²	136.4	80%	0.804	80%	0.804	S	S	*	*			trans	-139.4	128.8	168.4	-126.2	-172.8	-172.6	-179.2	2.9	108.2
75	V	25.9	Very low	27.2	Very low	144 Å²	144	134.5 Å²	134.5	87%	0.873	80%	0.795	S	S	*	*			trans	-69.7	142.4	177.9	174.3	0	0	0	0	110
76	V	27.8	Very low	27.2	Very low	96 Å²	96	136.9 Å²	136.9	58%	0.582	80%	0.799	S	S	*	*			trans	-94.6	139.1	-174.6	-161.2	0	0	0	0	108.8	F78	V76-F78 HydrophobicContact CB-CD2 4.47Å; V76-F78 HydrophobicContact CB-CE2 4.37Å; V76-F78 HydrophobicContact CG1-CD2 3.86Å; V76-F78 HydrophobicContact CG1-CE2 3.85Å
77	N	25.1	Very low	27.3	Very low	171 Å²	171	137 Å²	137	91%	0.914	80%	0.8	S	S	*	*			trans	-122.1	126.7	151.7	-122.2	8.4	0	0	0	107.4
78	F	28.5	Very low	27.3	Very low	161 Å²	161	134.6 Å²	134.6	71%	0.706	80%	0.802	S	S	*	*			trans	-84.4	140.3	-171.2	-88.5	-96.3	0	0	0	112.1	V76	V76-F78 HydrophobicContact CB-CD2 4.47Å; V76-F78 HydrophobicContact CB-CE2 4.37Å; V76-F78 HydrophobicContact CG1-CD2 3.86Å; V76-F78 HydrophobicContact CG1-CE2 3.85Å
79	A	25.7	Very low	27.2	Very low	104 Å²	104	132.2 Å²	132.2	86%	0.86	80%	0.804	S	S	*	*			trans	-154.8	109.6	141.3	0	0	0	0	0	108.7
80	D	29	Very low	28	Very low	132 Å²	132	132 Å²	132	71%	0.706	79%	0.794	S	S	*	*			trans	-84.9	-179.9	171.2	-80.7	-36.6	0	0	0	110.7
81	P	40.9	Very low	27.9	Very low	100 Å²	100	131.7 Å²	131.7	65%	0.649	80%	0.795	S	S	*	*			cis	-136.2	179.4	-48	37.9	-21	0	0	0	113.5
82	N	29.4	Very low	27.8	Very low	164 Å²	164	132.1 Å²	132.1	88%	0.877	79%	0.791	S	S	*	*			trans	79.1	120.9	153.6	-70.8	-11.5	0	0	0	122.7
83	G	29.1	Very low	27.7	Very low	70 Å²	70	128.2 Å²	128.2	72%	0.722	79%	0.791	S	S	*	*				121.4	77.1	121.7	0	0	0	0	0	120.1
84	S	27.7	Very low	28.9	Very low	128 Å²	128	123.2 Å²	123.2	90%	0.895	78%	0.78	S	S	*	*			trans	46.8	124.3	142.8	63	0	0	0	0	123.2
85	G	26.2	Very low	29.6	Very low	70 Å²	70	118 Å²	118	72%	0.722	77%	0.774	S	S	*	*			trans	109.3	105.3	132.1	0	0	0	0	0	119.4
86	S	25.2	Very low	29.6	Very low	129 Å²	129	120.4 Å²	120.4	90%	0.902	78%	0.776	S	S	*	*			trans	44.4	124.9	144.9	61.3	0	0	0	0	122.5
87	G	24.7	Very low	29.5	Very low	75 Å²	75	119.4 Å²	119.4	77%	0.773	79%	0.785	S	S	*	*			trans	107.2	119.1	135.4	0	0	0	0	0	118.8
88	A	26	Very low	29.5	Very low	107 Å²	107	118.2 Å²	118.2	88%	0.884	78%	0.778	S	S	*	*			trans	57.8	130.8	146.2	0	0	0	0	0	122.5
89	S	24	Very low	29.6	Very low	114 Å²	114	117.4 Å²	117.4	80%	0.797	78%	0.776	S	S	*	*			trans	-53.9	177.2	160	-115.5	0	0	0	0	114.1
90	P	43.9	Very low	29.7	Very low	100 Å²	100	119.6 Å²	119.6	65%	0.649	77%	0.773	S	S	*	*			cis	-139.5	-168.7	-10.3	34.1	-10.6	0	0	0	114.7
91	E	24.5	Very low	29.6	Very low	180 Å²	180	116.6 Å²	116.6	84%	0.841	77%	0.773	S	S	*	*			trans	86.9	120.8	148.7	-89.7	170.4	138.1	0	0	123.7
92	A	23.3	Very low	28.9	Very low	84 Å²	84	119 Å²	119	69%	0.694	78%	0.781	S	S	*	*				90	113.8	124.5	0	0	0	0	0	123.2
93	V	26.1	Very low	28.8	Very low	138 Å²	138	117 Å²	117	84%	0.836	78%	0.775	S	S	*	*				93.6	141.8	128	175.3	0	0	0	0	119.5
94	P	46.8	Very low	28.7	Very low	108 Å²	108	120.4 Å²	120.4	70%	0.701	78%	0.781	S	S	*	*			trans	-104.7	-166.2	-158.9	45.7	-31.1	0	0	0	111.5
95	P	41.7	Very low	28.8	Very low	102 Å²	102	122.7 Å²	122.7	66%	0.662	78%	0.78	S	S	*	*				-159.7	178.9	67	40.3	-15.4	0	0	0	118.4
96	E	26	Very low	28.8	Very low	196 Å²	196	124 Å²	124	92%	0.916	78%	0.778	S	S	*	*			trans	74.1	132.1	139.5	-83.3	167.7	-169.3	0	0	124
97	G	25.8	Very low	28.8	Very low	75 Å²	75	126 Å²	126	77%	0.773	77%	0.773	S	S	*	*			trans	166	28.3	163.7	0	0	0	0	0	123.5
98	L	25.7	Very low	28.7	Very low	146 Å²	146	127.9 Å²	127.9	76%	0.764	77%	0.77	S	S	*	*			trans	67.8	104.1	141.5	-139.1	70	0	0	0	122.8
99	Q	29.4	Very low	28.7	Very low	143 Å²	143	127.9 Å²	127.9	67%	0.668	76%	0.763	S	S	*	*				92.8	124.6	118.9	-80	173.3	-12.6	0	0	127
100	N	28	Very low	28.9	Very low	151 Å²	151	129 Å²	129	81%	0.807	76%	0.759	S	S	*	*			trans	84.4	128.4	140	-58.5	-14	0	0	0	118.4
101	G	27.8	Very low	28	Very low	68 Å²	68	132.3 Å²	132.3	70%	0.701	77%	0.766	S	S	*	*			cis	176.6	164.2	2.3	0	0	0	0	0	111.8
102	D	24.8	Very low	28.1	Very low	151 Å²	151	128.2 Å²	128.2	81%	0.807	76%	0.757	S	S	*	*			trans	79.1	91.4	166.4	-60.8	-23.6	0	0	0	119.6
103	T	28.6	Very low	28.3	Very low	122 Å²	122	128.9 Å²	128.9	75%	0.748	76%	0.756	S	S	*	*				77.5	114	78.3	58.4	0	0	0	0	114.2
104	V	27.6	Very low	28.3	Very low	141 Å²	141	128.6 Å²	128.6	86%	0.855	76%	0.755	S	S	*	*				-175.9	113.7	105	162.6	0	0	0	0	107.9
105	M	27.9	Very low	27.3	Very low	176 Å²	176	127.3 Å²	127.3	87%	0.867	76%	0.762	S	S	*	*			trans	-71.9	151.9	160	-69.8	-85	-160.9	0	0	108.5
106	S	26.5	Very low	26.6	Very low	98 Å²	98	125.3 Å²	125.3	69%	0.685	76%	0.76	S	S	*	*				168.2	160.6	92.2	54.2	0	0	0	0	106.8
107	E	25.7	Very low	26.7	Very low	170 Å²	170	125.6 Å²	125.6	79%	0.794	76%	0.761	S	S	*	*			cis	-169.9	138.3	22.8	-133.1	158.4	-134.4	0	0	109.6
108	T	23.8	Very low	26.8	Very low	116 Å²	116	130 Å²	130	71%	0.712	76%	0.761	S	S	*	*			trans	19.6	134.8	131.5	-11.8	0	0	0	0	118.9
109	S	25.9	Very low	26.9	Very low	106 Å²	106	131.7 Å²	131.7	74%	0.741	77%	0.765	S	S	*	*				172.3	130.8	65.3	45.4	0	0	0	0	114.4
110	L	26.4	Very low	26.8	Very low	138 Å²	138	135.1 Å²	135.1	72%	0.723	77%	0.773	S	S	*	*				34.3	134.6	129.9	-69.4	159.8	0	0	0	125.6
111	H	26.8	Very low	26.7	Very low	170 Å²	170	136.1 Å²	136.1	79%	0.787	77%	0.772	S	S	*	*			trans	76.3	143.7	142.6	-74.2	-51	0	0	0	119.3
112	S	25.7	Very low	26.7	Very low	94 Å²	94	142.9 Å²	142.9	66%	0.657	78%	0.778	S	S	*	*			cis	-168.4	152.9	10	179.4	0	0	0	0	111.1
113	S	26.6	Very low	26.8	Very low	97 Å²	97	142.1 Å²	142.1	68%	0.678	77%	0.774	S	S	*	*			trans	45.2	128.9	144.9	63.4	0	0	0	0	120.3
114	T	27.5	Very low	27	Very low	133 Å²	133	142.2 Å²	142.2	82%	0.816	78%	0.775	S	S	*	*				177.7	138.3	63.5	-47.3	0	0	0	0	109.6
115	G	26.3	Very low	27.5	Very low	81 Å²	81	143.7 Å²	143.7	84%	0.835	77%	0.772	S	S	*	*			trans	54.2	117	143.6	0	0	0	0	0	122.5
116	G	26.4	Very low	27.8	Very low	60 Å²	60	141.2 Å²	141.2	62%	0.619	77%	0.767	S	S	*	*			trans	152.7	124.8	155	0	0	0	0	0	114.2	H118	G116-H118 PolarHBondContact O-CD2 3.43Å; G116-H118 PolarHBondContact O-N 3.18Å
117	Q	28.7	Very low	28	Very low	202 Å²	202	143.3 Å²	143.3	94%	0.944	77%	0.77	S	S	*	*	P	Polyproline II helix	trans	-63.4	118.6	177.7	-72	176.6	-39	0	0	111.2
118	H	26.8	Very low	28.5	Very low	166 Å²	166	142.4 Å²	142.4	77%	0.769	78%	0.777	S	S	*	*	P	Polyproline II helix	trans	-96.3	119.6	173.8	-78.9	-86.4	0	0	0	111.3	G116	G116-H118 PolarHBondContact O-CD2 3.43Å; G116-H118 PolarHBondContact O-N 3.18Å
119	H	28.3	Very low	29	Very low	183 Å²	183	146.1 Å²	146.1	85%	0.847	78%	0.779	S	S	*	*	P	Polyproline II helix	trans	-65	123.9	154.7	-82.1	-86.5	0	0	0	108.5	H121	H119-H121 PolarHBondContact O-N 3.26Å; H119-H121 VanDerWaalsContact O-N 3.11Å
120	Y	26.2	Very low	29.4	Very low	215 Å²	215	151.5 Å²	151.5	84%	0.843	79%	0.785	S	S	*	*			trans	-71.4	102.8	173	-71.8	-82.8	0	0	0	109.9
121	H	26.3	Very low	29.9	Very low	171 Å²	171	152.7 Å²	152.7	79%	0.792	79%	0.791	S	S	*	*			trans	-73.9	120.3	154.2	-101.5	-93.4	0	0	0	107.7	H119 D123	H119-H121 PolarHBondContact O-N 3.26Å; H119-H121 VanDerWaalsContact O-N 3.11Å; H121-D123 PolarHBondContact O-N 3.04Å
122	Y	28.7	Very low	30.4	Very low	210 Å²	210	156.4 Å²	156.4	82%	0.824	80%	0.798	S	S	*	*			trans	-81.5	102.2	163.4	-102	-86.1	0	0	0	107.8	T124	Y122-T124 PolarHBondContact O-N 3.37Å
123	D	26	Very low	31	Very low	135 Å²	135	157.1 Å²	157.1	72%	0.722	80%	0.799	S	S	*	*			trans	-69.3	115.4	164.1	-91.4	-34.8	0	0	0	109.4	H121 H125	H121-D123 PolarHBondContact O-N 3.04Å; D123-H125 VanDerWaalsContact C-N 3.29Å; D123-H125 PolarHBondContact O-N 3.13Å
124	T	33.2	Very low	31.6	Very low	125 Å²	125	162 Å²	162	77%	0.767	81%	0.808	S	S	*	*			trans	-94.6	49.5	171.4	54.6	0	0	0	0	111.4	Y122	Y122-T124 PolarHBondContact O-N 3.37Å
125	H	37.8	Very low	32.4	Very low	172 Å²	172	159.5 Å²	159.5	80%	0.796	81%	0.808	S	S	*	*			trans	-129.7	95.9	166.6	-83.7	-85.6	0	0	0	109.2	D123	D123-H125 VanDerWaalsContact C-N 3.29Å; D123-H125 PolarHBondContact O-N 3.13Å
126	T	33.3	Very low	33	Very low	123 Å²	123	163.3 Å²	163.3	76%	0.755	80%	0.804	S	S	*	*			trans	-152	96.7	161.8	4.1	0	0	0	0	110.3
127	N	31.3	Very low	33.5	Very low	142 Å²	142	168.2 Å²	168.2	76%	0.759	82%	0.816	S	S	*	*			trans	39.1	100.9	138.3	-66	-50.4	0	0	0	118.3	Y129	N127-Y129 PolarHBondContact O-N 3.07Å
128	T	37.6	Very low	34.3	Very low	151 Å²	151	163.7 Å²	163.7	93%	0.926	80%	0.803	S	S	*	*			trans	-73.4	54.3	164.9	47.7	0	0	0	0	112.6
129	Y	33.2	Very low	35.5	Very low	195 Å²	195	162.4 Å²	162.4	77%	0.765	80%	0.8	S	S	*	*			trans	-106.2	1.1	-178.6	-125.2	-86.6	0	0	0	115.6	N127	N127-Y129 PolarHBondContact O-N 3.07Å
130	Y	34.2	Very low	36.4	Very low	218 Å²	218	159.2 Å²	159.2	86%	0.855	79%	0.789	S	S	*	*	S	Bend	trans	-132.5	40	-173.7	-79.4	-74.7	0	0	0	116.5
131	L	36.9	Very low	37.7	Very low	164 Å²	164	151.8 Å²	151.8	86%	0.859	77%	0.772	S	S	*	*			trans	-132.8	65.2	161.5	-115.2	98.8	0	0	0	111.6	T133	L131-T133 PolarHBondContact O-N 3.1Å; L131-T133 VanDerWaalsContact O-N 3.14Å
132	R	38	Very low	38.9	Very low	247 Å²	247	149.9 Å²	149.9	93%	0.932	77%	0.772	S	S	*	*			trans	-70.3	98.8	159.9	-99	-177.9	174	168	-0.1	108.2
133	T	37.8	Very low	39.9	Very low	109 Å²	109	144 Å²	144	67%	0.669	76%	0.76	S	S	*	*			trans	-73.8	142.6	167.5	-52.4	0	0	0	0	108.7	L131 G135	L131-T133 PolarHBondContact O-N 3.1Å; L131-T133 VanDerWaalsContact O-N 3.14Å; T133-G135 PolarHBondContact O-N 3.32Å; T133-G135 VanDerWaalsContact O-N 3.16Å
134	F	39.1	Very low	41.3	Very low	201 Å²	201	144.3 Å²	144.3	88%	0.882	76%	0.755	S	S	*	*	S	Bend	trans	-44.7	112.7	-173	-75.4	-94	0	0	0	114.8	H136	F134-H136 VanDerWaalsContact C-N 3.35Å; F134-H136 PolarHBondContact O-N 3.41Å
135	G	43.3	Very low	42.3	Very low	79 Å²	79	144.3 Å²	144.3	81%	0.814	75%	0.749	S	S	*	*	S	Bend	trans	73.1	-3.3	146.8	0	0	0	0	0	119.8	T133	T133-G135 PolarHBondContact O-N 3.32Å; T133-G135 VanDerWaalsContact O-N 3.16Å
136	H	40	Very low	43.1	Very low	161 Å²	161	141.2 Å²	141.2	75%	0.745	74%	0.738	S	S	*	*			trans	-126.8	117.8	172.4	-74.5	77	0	0	0	110	F134 T138	F134-H136 VanDerWaalsContact C-N 3.35Å; F134-H136 PolarHBondContact O-N 3.41Å; H136-T138 VanDerWaalsContact C-N 3.35Å; H136-T138 PolarHBondContact O-N 2.58Å
137	N	37.1	Very low	44.4	Very low	163 Å²	163	138.6 Å²	138.6	87%	0.872	72%	0.716	S	S	*	*			trans	-71.7	90.4	170.3	-73.7	-12.5	0	0	0	108.5
138	T	45.2	Very low	45.5	Very low	108 Å²	108	137.1 Å²	137.1	66%	0.663	70%	0.701	S	S	*	*			trans	-75.3	123.7	167	50.8	0	0	0	0	108.5	H136 D140	H136-T138 VanDerWaalsContact C-N 3.35Å; H136-T138 PolarHBondContact O-N 2.58Å; T138-D140 PolarHBondContact O-N 3.21Å
139	I	52.3	Low	46.4	Very low	139 Å²	139	138.7 Å²	138.7	71%	0.713	69%	0.69	S	S	*	*			trans	-71.7	-7.1	175.7	-62.8	167.2	0	0	0	111	L171	I139-L171 HydrophobicContact CG2-CD2 4.17Å
140	D	47.6	Very low	47	Very low	115 Å²	115	138.9 Å²	138.9	62%	0.615	70%	0.698	S	S	*	*	S	Bend	trans	-73	132.6	-177.2	-64.5	-25.8	0	0	0	112.5	T138 V142	T138-D140 PolarHBondContact O-N 3.21Å; D140-V142 PolarHBondContact O-N 2.97Å
141	A	52.5	Low	47.4	Very low	59 Å²	59	132.3 Å²	132.3	49%	0.488	68%	0.681	S	S	.	*	P	Polyproline II helix	trans	-62.9	132.8	172.9	0	0	0	0	0	110.8	L167	A141-L167 HydrophobicContact CB-CD2 4.13Å
142	V	51.8	Low	47.8	Very low	131 Å²	131	129.9 Å²	129.9	79%	0.794	68%	0.684	S	S	*	*	P	Polyproline II helix	trans	-60.5	128.8	178	-177	0	0	0	0	109.2	D140 K144	D140-V142 PolarHBondContact O-N 2.97Å; V142-K144 PolarHBondContact O-N 3.11Å; V142-K144 VanDerWaalsContact O-N 3.15Å
143	P	49.1	Very low	48.1	Very low	88 Å²	88	121.4 Å²	121.4	57%	0.571	67%	0.667	S	S	*	*	P	Polyproline II helix	trans	-60.9	120.9	-177.4	20	-30	0	0	0	111	I145 Y148	P143-I145 PolarHBondContact O-N 2.69Å; P143-Y148 HydrophobicContact CB-CD2 4.31Å; P143-Y148 HydrophobicContact CB-CE2 3.64Å
144	K	55.1	Low	48.3	Very low	140 Å²	140	122.6 Å²	122.6	61%	0.609	68%	0.676	S	S	*	*	P	Polyproline II helix	trans	-68.9	125.4	172.9	-64.5	-175.3	-178.1	177.4	0	109.3	V142 D146 F147 Y148	V142-K144 PolarHBondContact O-N 3.11Å; V142-K144 VanDerWaalsContact O-N 3.15Å; K144-D146 PolarHBondContact O-N 3.5Å; K144-D146 VanDerWaalsContact O-N 3.1Å; K144-F147 HydrophobicContact CB-CD2 3.8Å; K144-F147 HydrophobicContact CB-CE2 3.9Å; K144-F147 HydrophobicContact CD-CE2 4.09Å; K144-F147 HydrophobicContact CG-CE2 4.39Å; K144-F147 PolarHBondContact O-N 3.28Å; K144-Y148 WeakPolarHBondContact O-CD2 2.99Å
145	I	55.3	Low	48.3	Very low	126 Å²	126	121.2 Å²	121.2	65%	0.646	68%	0.677	S	S	*	*	G	3₁₀ helix	trans	-61.8	-22.9	-174	-165.4	146	0	0	0	113.4	P143 F147 Y148 R149	P143-I145 PolarHBondContact O-N 2.69Å; I145-F147 VanDerWaalsContact C-N 3.26Å; I145-F147 PolarHBondContact O-N 3.4Å; I145-Y148 PolarHBondContact O-N 3.5Å; I145-R149 PolarHBondContact O-N 3.22Å; I145-R149 VanDerWaalsContact O-N 3.12Å
146	D	54.4	Low	48.3	Very low	106 Å²	106	120.6 Å²	120.6	57%	0.567	67%	0.671	S	S	*	*	G	3₁₀ helix	trans	-62.7	-29.5	179.8	-54.8	-42.1	0	0	0	113.1	K144 Y148	K144-D146 PolarHBondContact O-N 3.5Å; K144-D146 VanDerWaalsContact O-N 3.1Å; D146-Y148 VanDerWaalsContact C-N 3.31Å
147	F	60.2	Low	48.6	Very low	68 Å²	68	121.9 Å²	121.9	30%	0.298	68%	0.677	S	S	.	*	G	3₁₀ helix	trans	-80.2	-10.8	175.5	-59.5	-65.8	0	0	0	113.9	K144 I145 L159 P162	K144-F147 HydrophobicContact CB-CD2 3.8Å; K144-F147 HydrophobicContact CB-CE2 3.9Å; K144-F147 HydrophobicContact CD-CE2 4.09Å; K144-F147 HydrophobicContact CG-CE2 4.39Å; K144-F147 PolarHBondContact O-N 3.28Å; I145-F147 VanDerWaalsContact C-N 3.26Å; I145-F147 PolarHBondContact O-N 3.4Å; F147-L159 HydrophobicContact CD1-CB 4Å; F147-L159 HydrophobicContact CE1-CB 4.19Å; F147-L159 HydrophobicContact CE1-CD1 4.37Å; F147-P162 HydrophobicContact CD2-CG 4.43Å; F147-P162 HydrophobicContact CE2-CG 4.49Å; F147-P162 HydrophobicContact CG-CG 4.46Å
148	Y	55.6	Low	49.2	Very low	111 Å²	111	123.8 Å²	123.8	44%	0.435	68%	0.678	S	S	.	*	T	Hydrogen-bonded Turn	trans	-116.6	-3.8	-173	-65.2	-92.5	0	0	0	113	P143 K144 I145 D146 Q150 R161	P143-Y148 HydrophobicContact CB-CD2 4.31Å; P143-Y148 HydrophobicContact CB-CE2 3.64Å; K144-Y148 WeakPolarHBondContact O-CD2 2.99Å; I145-Y148 PolarHBondContact O-N 3.5Å; D146-Y148 VanDerWaalsContact C-N 3.31Å; Y148-Q150 PolarHBondContact O-N 2.99Å; Y148-R161 VanDerWaalsContact CE1-CZ 3.47Å
149	R	55.6	Low	49.6	Very low	184 Å²	184	123.4 Å²	123.4	69%	0.694	67%	0.671	S	S	*	*			trans	-81.4	99.8	-178.3	-137.8	-166.3	168.7	167.5	-0.4	111.1	I145 T151	I145-R149 PolarHBondContact O-N 3.22Å; I145-R149 VanDerWaalsContact O-N 3.12Å; R149-T151 WeakPolarHBondContact CD-OG1 3.03Å; R149-T151 VanDerWaalsContact CG-OG1 3.27Å; R149-T151 WeakPolarHBondContact CG-OG1 3.12Å; R149-T151 PolarHBondContact NE-OG1 2.81Å; R149-T151 PolarHBondContact O-N 3.35Å
150	Q	46.9	Very low	49.5	Very low	199 Å²	199	121.8 Å²	121.8	93%	0.93	67%	0.667	S	S	*	*			trans	-80.6	88.9	157.5	-73.1	-178.3	2.3	0	0	108	Y148	Y148-Q150 PolarHBondContact O-N 2.99Å
151	T	41.9	Very low	49.9	Very low	81 Å²	81	124.1 Å²	124.1	50%	0.497	67%	0.667	S	S	.	*			trans	-123.6	125.3	168.8	-35.2	0	0	0	0	110	R149 A153	R149-T151 WeakPolarHBondContact CD-OG1 3.03Å; R149-T151 VanDerWaalsContact CG-OG1 3.27Å; R149-T151 WeakPolarHBondContact CG-OG1 3.12Å; R149-T151 PolarHBondContact NE-OG1 2.81Å; R149-T151 PolarHBondContact O-N 3.35Å; T151-A153 PolarHBondContact O-N 3.35Å
152	A	45.6	Very low	50	Low	113 Å²	113	122.9 Å²	122.9	93%	0.934	65%	0.654	S	S	*	*			trans	-68.6	53	176.7	0	0	0	0	0	112.7
153	A	44	Very low	50.2	Low	68 Å²	68	120.1 Å²	120.1	56%	0.562	64%	0.638	S	S	*	*			trans	-96.2	133.5	172.5	0	0	0	0	0	109.5	T151 L155	T151-A153 PolarHBondContact O-N 3.35Å; A153-L155 PolarHBondContact O-N 3.11Å
154	P	41.3	Very low	50.2	Low	135 Å²	135	122 Å²	122	88%	0.877	64%	0.643	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.8	7.6	-168	-10.6	27.3	0	0	0	115.4
155	L	39.7	Very low	50.1	Low	172 Å²	172	118.8 Å²	118.8	90%	0.901	64%	0.638	S	S	*	*	T	Hydrogen-bonded Turn	trans	-138.1	32.5	-161.9	-135.9	100.9	0	0	0	115.3	A153	A153-L155 PolarHBondContact O-N 3.11Å
156	G	43.3	Very low	50.1	Low	66 Å²	66	118.6 Å²	118.6	68%	0.68	63%	0.634	S	S	*	*	S	Bend	trans	-142.6	134.8	174.7	0	0	0	0	0	112.6
157	E	46.3	Very low	50.1	Low	187 Å²	187	116.8 Å²	116.8	87%	0.874	62%	0.624	S	S	*	*			trans	-61.2	135.8	175.2	-74.5	-175	159.9	0	0	111	L159	E157-L159 PolarHBondContact O-N 3.4Å; E157-L159 VanDerWaalsContact O-N 3.13Å
158	K	48.9	Very low	49.7	Very low	203 Å²	203	118.2 Å²	118.2	88%	0.883	63%	0.631	S	S	*	*			trans	-79.8	95.4	-178.9	-166.9	179.1	-177.2	-177.4	0	109.3	V160	K158-V160 PolarHBondContact O-N 3.41Å
159	L	54.6	Low	49.4	Very low	101 Å²	101	117.9 Å²	117.9	53%	0.529	64%	0.637	S	S	.	*	P	Polyproline II helix	trans	-71.1	125.7	173.9	-67.1	169.2	0	0	0	110	F147 E157	F147-L159 HydrophobicContact CD1-CB 4Å; F147-L159 HydrophobicContact CE1-CB 4.19Å; F147-L159 HydrophobicContact CE1-CD1 4.37Å; E157-L159 PolarHBondContact O-N 3.4Å; E157-L159 VanDerWaalsContact O-N 3.13Å
160	V	50.6	Low	48.9	Very low	104 Å²	104	111.3 Å²	111.3	63%	0.63	63%	0.627	S	S	*	*	P	Polyproline II helix	trans	-77.2	146.2	178.1	178.4	0	0	0	0	109.3	K158	K158-V160 PolarHBondContact O-N 3.41Å
161	R	55.7	Low	48.7	Very low	164 Å²	164	106.1 Å²	106.1	62%	0.619	61%	0.605	S	S	*	*	P	Polyproline II helix	trans	-59.6	126.5	177.4	-177.8	-172.5	-78.5	-154.7	2.1	110.1	Y148	Y148-R161 VanDerWaalsContact CE1-CZ 3.47Å
162	P	53.5	Low	48.6	Very low	33 Å²	33	110.5 Å²	110.5	21%	0.214	62%	0.62	C	S	.	*	P	Polyproline II helix	trans	-66.6	152.4	177.4	23.6	-30.6	0	0	0	112.2	F147 E166 L167	F147-P162 HydrophobicContact CD2-CG 4.43Å; F147-P162 HydrophobicContact CE2-CG 4.49Å; F147-P162 HydrophobicContact CG-CG 4.46Å; P162-E166 HydrophobicContact CB-CB 4.38Å; P162-L167 HydrophobicContact CB-CD1 4.33Å; P162-L167 HydrophobicContact CG-CD1 4.04Å
163	T	55.6	Low	48.3	Very low	73 Å²	73	113.9 Å²	113.9	45%	0.448	61%	0.613	S	S	.	*	P	Polyproline II helix	trans	-78.7	156.2	175.7	63.8	0	0	0	0	111.1	S165 E166 L167	T163-S165 PolarHBondContact O-N 2Å; T163-S165 PolarHBondContact OG1-OG 3.34Å; T163-E166 PolarHBondContact N-OE2 2.96Å; T163-E166 PolarHBondContact O-N 3.41Å; T163-E166 PolarHBondContact OG1-N 3.43Å; T163-L167 PolarHBondContact O-N 3.01Å; T163-L167 VanDerWaalsContact O-N 3.13Å
164	L	51.1	Low	47.5	Very low	129 Å²	129	118.2 Å²	118.2	68%	0.675	62%	0.622	S	S	*	*	H	α-helix	trans	-58.9	-31.3	179.4	-166.7	124	0	0	0	112.2	L167 H168	L164-L167 PolarHBondContact O-N 3.36Å; L164-H168 VanDerWaalsContact CD2-CE1 3.42Å; L164-H168 WeakPolarHBondContact CD2-CE1 3.47Å; L164-H168 PolarHBondContact O-N 3.05Å
165	S	52	Low	47.1	Very low	71 Å²	71	117.4 Å²	117.4	50%	0.497	62%	0.617	S	S	.	*	H	α-helix	trans	-67.5	-39.3	172.2	42.7	0	0	0	0	113.8	T163 L167 H168 D169	T163-S165 PolarHBondContact O-N 2Å; T163-S165 PolarHBondContact OG1-OG 3.34Å; S165-L167 VanDerWaalsContact C-N 3.3Å; S165-L167 PolarHBondContact O-N 3.25Å; S165-H168 PolarHBondContact O-N 3.17Å; S165-D169 PolarHBondContact O-N 3.37Å
166	E	56	Low	46.5	Very low	122 Å²	122	118.4 Å²	118.4	57%	0.57	61%	0.614	S	S	*	*	H	α-helix	trans	-68.1	-30.6	175.2	-84	176	149.7	0	0	112.5	P162 T163 G170	P162-E166 HydrophobicContact CB-CB 4.38Å; T163-E166 PolarHBondContact N-OE2 2.96Å; T163-E166 PolarHBondContact O-N 3.41Å; T163-E166 PolarHBondContact OG1-N 3.43Å; E166-G170 PolarHBondContact O-N 2.77Å
167	L	53.7	Low	46	Very low	68 Å²	68	124.4 Å²	124.4	36%	0.356	62%	0.624	S	S	.	*	H	α-helix	trans	-70.1	-33.7	173.3	-93.5	132	0	0	0	112.6	A141 P162 T163 L164 S165	A141-L167 HydrophobicContact CB-CD2 4.13Å; P162-L167 HydrophobicContact CB-CD1 4.33Å; P162-L167 HydrophobicContact CG-CD1 4.04Å; T163-L167 PolarHBondContact O-N 3.01Å; T163-L167 VanDerWaalsContact O-N 3.13Å; L164-L167 PolarHBondContact O-N 3.36Å; S165-L167 VanDerWaalsContact C-N 3.3Å; S165-L167 PolarHBondContact O-N 3.25Å
168	H	51	Low	45.2	Very low	98 Å²	98	122.5 Å²	122.5	45%	0.454	62%	0.62	S	S	.	*	H	α-helix	trans	-78.2	-37.1	176.5	-68.4	174.4	0	0	0	112.5	L164 S165 G170 L171	L164-H168 VanDerWaalsContact CD2-CE1 3.42Å; L164-H168 WeakPolarHBondContact CD2-CE1 3.47Å; L164-H168 PolarHBondContact O-N 3.05Å; S165-H168 PolarHBondContact O-N 3.17Å; H168-G170 VanDerWaalsContact C-N 3.26Å; H168-G170 PolarHBondContact O-N 3.34Å; H168-L171 WeakPolarHBondContact O-CB 3.29Å; H168-L171 PolarHBondContact O-N 3.19Å; H168-L171 VanDerWaalsContact O-N 3.13Å
169	D	49.6	Very low	44.2	Very low	105 Å²	105	115.9 Å²	115.9	56%	0.561	61%	0.61	S	S	*	*	H	α-helix	trans	-67.1	-26	176.8	-75.3	-5.5	0	0	0	112.6	S165 L171	S165-D169 PolarHBondContact O-N 3.37Å; D169-L171 VanDerWaalsContact C-N 3.26Å; D169-L171 PolarHBondContact O-N 3.24Å
170	G	45.2	Very low	42.8	Very low	46 Å²	46	120.9 Å²	120.9	47%	0.474	63%	0.628	S	S	.	*	T	Hydrogen-bonded Turn	trans	-69.2	-22.1	173.3	0	0	0	0	0	114	E166 H168	E166-G170 PolarHBondContact O-N 2.77Å; H168-G170 VanDerWaalsContact C-N 3.26Å; H168-G170 PolarHBondContact O-N 3.34Å
171	L	44.2	Very low	42.3	Very low	90 Å²	90	120.7 Å²	120.7	47%	0.471	63%	0.629	S	S	.	*	G	3₁₀ helix	trans	-80.1	-22.1	-178.4	-122.2	133.2	0	0	0	112.7	I139 H168 D169 K173	I139-L171 HydrophobicContact CG2-CD2 4.17Å; H168-L171 WeakPolarHBondContact O-CB 3.29Å; H168-L171 PolarHBondContact O-N 3.19Å; H168-L171 VanDerWaalsContact O-N 3.13Å; D169-L171 VanDerWaalsContact C-N 3.26Å; D169-L171 PolarHBondContact O-N 3.24Å; L171-K173 VanDerWaalsContact C-N 3.28Å; L171-K173 PolarHBondContact O-N 3.12Å
172	E	39.1	Very low	40.9	Very low	173 Å²	173	120.8 Å²	120.8	81%	0.808	64%	0.641	S	S	*	*	G	3₁₀ helix	trans	-80.1	-6.9	176	-71.1	-173.4	165.9	0	0	113.3
173	K	38.2	Very low	40.3	Very low	183 Å²	183	122.4 Å²	122.4	80%	0.796	66%	0.664	S	S	*	*	G	3₁₀ helix	trans	-109.8	13.5	-174.1	-90	-176.2	178.5	174.3	0	115.7	L171	L171-K173 VanDerWaalsContact C-N 3.28Å; L171-K173 PolarHBondContact O-N 3.12Å
174	E	28.5	Very low	39	Very low	160 Å²	160	126.8 Å²	126.8	75%	0.748	69%	0.685	S	S	*	*	S	Bend	trans	-90.3	115.7	167.9	-70.7	-79.6	155.4	0	0	108.5	F176	E174-F176 PolarHBondContact O-N 3.48Å
175	P	32.8	Very low	38.1	Very low	117 Å²	117	130.3 Å²	130.3	76%	0.76	70%	0.698	S	S	*	*			trans	-71.1	120.1	175.5	-3.3	19.5	0	0	0	108.7	E177	P175-E177 PolarHBondContact O-N 3.07Å
176	F	26.1	Very low	37.2	Very low	193 Å²	193	133.4 Å²	133.4	85%	0.846	71%	0.708	S	S	*	*			trans	-62.5	113.9	162.4	-112.4	-99.7	0	0	0	108.3	E174 D178	E174-F176 PolarHBondContact O-N 3.48Å; F176-D178 PolarHBondContact O-N 3.37Å; F176-D178 VanDerWaalsContact O-N 3.17Å
177	E	32.8	Very low	36.6	Very low	192 Å²	192	130.7 Å²	130.7	90%	0.897	70%	0.702	S	S	*	*			trans	-74.5	93	168.8	-128.8	-169.2	162.1	0	0	108.3	P175	P175-E177 PolarHBondContact O-N 3.07Å
178	D	29.9	Very low	36.2	Very low	148 Å²	148	132.5 Å²	132.5	79%	0.791	72%	0.718	S	S	*	*			trans	-93.1	102.2	161.8	-84.7	-22	0	0	0	108.1	F176	F176-D178 PolarHBondContact O-N 3.37Å; F176-D178 VanDerWaalsContact O-N 3.17Å
179	G	27.6	Very low	36.1	Very low	64 Å²	64	131 Å²	131	66%	0.66	72%	0.723	S	S	*	*			trans	-69.1	130.7	170.1	0	0	0	0	0	111.2
180	F	25.9	Very low	35.9	Very low	206 Å²	206	131.8 Å²	131.8	90%	0.904	72%	0.724	S	S	*	*				176.9	160.2	123.8	-94.3	-56.7	0	0	0	110.7
181	P	39.5	Very low	35.9	Very low	100 Å²	100	136.1 Å²	136.1	65%	0.649	73%	0.731	S	S	*	*				-97.7	148.9	-117.7	38.5	-33.3	0	0	0	112.5
182	N	26.8	Very low	36.1	Very low	165 Å²	165	134.5 Å²	134.5	88%	0.882	73%	0.731	S	S	*	*			trans	-178.2	132.9	130.7	-85.9	-27.8	0	0	0	109.1
183	G	41.2	Very low	36.4	Very low	68 Å²	68	129 Å²	129	70%	0.701	72%	0.715	S	S	*	*			trans	-68.7	144	-171.3	0	0	0	0	0	113.9
184	D	28.9	Very low	36.7	Very low	164 Å²	164	123.2 Å²	123.2	88%	0.877	70%	0.701	S	S	*	*				-162.6	113.8	126.1	-87	-28	0	0	0	106.8	L186	D184-L186 PolarHBondContact O-N 3.24Å
185	E	30.4	Very low	37.5	Very low	204 Å²	204	123 Å²	123	95%	0.953	70%	0.698	S	S	*	*	P	Polyproline II helix	trans	-67.4	122.4	176.4	-73.9	-178.4	146.2	0	0	109.8
186	L	33.8	Very low	37.9	Very low	136 Å²	136	125.3 Å²	125.3	71%	0.712	70%	0.699	S	S	*	*	P	Polyproline II helix	trans	-74	135.4	166	-121.3	80.6	0	0	0	109.5	D184 E190	D184-L186 PolarHBondContact O-N 3.24Å; L186-E190 HydrophobicContact CD2-CB 4.23Å
187	S	43.9	Very low	38.5	Very low	64 Å²	64	120.3 Å²	120.3	45%	0.448	69%	0.693	S	S	.	*	P	Polyproline II helix	trans	-62.6	142.2	-177	169	0	0	0	0	112.3	A189 E190	S187-A189 PolarHBondContact O-N 2.89Å; S187-A189 PolarHBondContact OG-N 2.02Å; S187-E190 PolarHBondContact O-N 2.87Å
188	P	45	Very low	38.7	Very low	106 Å²	106	114.9 Å²	114.9	69%	0.688	68%	0.681	S	S	*	*	H	α-helix	trans	-53.9	-18.4	173.8	-23.7	31.3	0	0	0	114.5	A192	P188-A192 WeakPolarHBondContact O-CB 3.28Å; P188-A192 PolarHBondContact O-N 2.99Å; P188-A192 VanDerWaalsContact O-N 3.12Å
189	A	48	Very low	38.6	Very low	68 Å²	68	115.2 Å²	115.2	56%	0.562	68%	0.677	S	S	*	*	H	α-helix	trans	-74.6	-32.1	177.7	0	0	0	0	0	113.5	S187 A193	S187-A189 PolarHBondContact O-N 2.89Å; S187-A189 PolarHBondContact OG-N 2.02Å; A189-A193 WeakPolarHBondContact O-CB 2.93Å; A189-A193 PolarHBondContact O-N 3.38Å
190	E	47	Very low	39	Very low	121 Å²	121	117.7 Å²	117.7	57%	0.565	68%	0.682	S	S	*	*	H	α-helix	trans	-77.7	-32.2	176.4	-87.5	-179.9	135.6	0	0	111.7	L186 S187 A193 A194	L186-E190 HydrophobicContact CD2-CB 4.23Å; S187-E190 PolarHBondContact O-N 2.87Å; E190-A193 PolarHBondContact O-N 3.02Å; E190-A194 WeakPolarHBondContact O-CB 3.11Å; E190-A194 PolarHBondContact O-N 3.26Å
191	E	44.6	Very low	39.4	Very low	137 Å²	137	117.6 Å²	117.6	64%	0.64	68%	0.681	S	S	*	*	H	α-helix	trans	-71.5	-34.3	173.4	-157.2	-179.1	173.1	0	0	111.9	K195	E191-K195 PolarHBondContact O-N 3.31Å
192	A	47.8	Very low	39.3	Very low	56 Å²	56	115.9 Å²	115.9	46%	0.463	68%	0.682	S	S	.	*	H	α-helix	trans	-67.8	-40.8	171.2	0	0	0	0	0	112.3	P188 K195 E196	P188-A192 WeakPolarHBondContact O-CB 3.28Å; P188-A192 PolarHBondContact O-N 2.99Å; P188-A192 VanDerWaalsContact O-N 3.12Å; A192-K195 PolarHBondContact O-N 3.06Å; A192-E196 PolarHBondContact O-N 2.7Å
193	A	45.8	Very low	40.5	Very low	58 Å²	58	113.4 Å²	113.4	48%	0.479	67%	0.672	S	S	.	*	H	α-helix	trans	-67.4	-34.6	176.6	0	0	0	0	0	112.7	A189 E190 E196 A197	A189-A193 WeakPolarHBondContact O-CB 2.93Å; A189-A193 PolarHBondContact O-N 3.38Å; E190-A193 PolarHBondContact O-N 3.02Å; A193-E196 PolarHBondContact O-N 2.68Å; A193-A197 WeakPolarHBondContact O-CB 3.17Å; A193-A197 PolarHBondContact O-N 3.32Å
194	A	45.2	Very low	41.1	Very low	61 Å²	61	116 Å²	116	50%	0.504	67%	0.674	S	S	.	*	H	α-helix	trans	-71.1	-34.1	173.5	0	0	0	0	0	112.5	E190 A197 A198	E190-A194 WeakPolarHBondContact O-CB 3.11Å; E190-A194 PolarHBondContact O-N 3.26Å; A194-A197 PolarHBondContact O-N 3.36Å; A194-A198 WeakPolarHBondContact O-CB 3.29Å; A194-A198 PolarHBondContact O-N 2.78Å
195	K	45.3	Very low	43.1	Very low	155 Å²	155	114.4 Å²	114.4	67%	0.674	66%	0.659	S	S	*	*	H	α-helix	trans	-68.5	-37.3	171	-98.5	179	175	169.5	0	112.8	E191 A192 A197 A198	E191-K195 PolarHBondContact O-N 3.31Å; A192-K195 PolarHBondContact O-N 3.06Å; K195-A197 VanDerWaalsContact C-N 3.34Å; K195-A198 PolarHBondContact O-N 2.72Å
196	E	39.9	Very low	45.3	Very low	166 Å²	166	107.8 Å²	107.8	78%	0.776	63%	0.628	S	S	*	*	H	α-helix	trans	-70.3	-28.2	173.1	-77.3	-162.1	158.7	0	0	113.1	A192 A193	A192-E196 PolarHBondContact O-N 2.7Å; A193-E196 PolarHBondContact O-N 2.68Å
197	A	39.5	Very low	47.5	Very low	88 Å²	88	103.2 Å²	103.2	73%	0.727	61%	0.613	S	S	*	*	H	α-helix	trans	-79	-16.4	175.5	0	0	0	0	0	113.8	A193 A194 K195	A193-A197 WeakPolarHBondContact O-CB 3.17Å; A193-A197 PolarHBondContact O-N 3.32Å; A194-A197 PolarHBondContact O-N 3.36Å; K195-A197 VanDerWaalsContact C-N 3.34Å
198	A	36.9	Very low	49.4	Very low	77 Å²	77	104.4 Å²	104.4	64%	0.636	61%	0.608	S	S	*	*	S	Bend	trans	-94.4	-5.7	-178.9	0	0	0	0	0	114.2	A194 K195 P200	A194-A198 WeakPolarHBondContact O-CB 3.29Å; A194-A198 PolarHBondContact O-N 2.78Å; K195-A198 PolarHBondContact O-N 2.72Å; A198-P200 VanDerWaalsContact O-CD 3.24Å; A198-P200 WeakPolarHBondContact O-CD 3.06Å
199	E	27.6	Very low	51.2	Low	155 Å²	155	103.7 Å²	103.7	72%	0.724	60%	0.597	S	S	*	*	S	Bend	trans	-83.4	111.2	165.2	-71.9	-163.3	163.9	0	0	109.4	K201	E199-K201 PolarHBondContact O-N 2.65Å
200	P	36.4	Very low	52.6	Low	117 Å²	117	107 Å²	107	76%	0.76	60%	0.599	S	S	*	*			trans	-61.1	115.6	160.3	27	-29.4	0	0	0	105.2	A198 G202	A198-P200 VanDerWaalsContact O-CD 3.24Å; A198-P200 WeakPolarHBondContact O-CD 3.06Å; P200-G202 VanDerWaalsContact C-N 3.3Å; P200-G202 WeakPolarHBondContact O-CA 3.47Å; P200-G202 PolarHBondContact O-N 3.39Å
201	K	33.9	Very low	53.9	Low	203 Å²	203	101.4 Å²	101.4	88%	0.883	57%	0.574	S	S	*	*			trans	-41.1	100.9	171.1	-80.3	-178.1	177	177.9	0	108	E199 V203	E199-K201 PolarHBondContact O-N 2.65Å; K201-V203 PolarHBondContact O-N 3.29Å
202	G	38.2	Very low	55.6	Low	64 Å²	64	94.9 Å²	94.9	66%	0.66	54%	0.543	S	S	*	.			trans	-65.3	108	-171.7	0	0	0	0	0	106.7	P200 V204	P200-G202 VanDerWaalsContact C-N 3.3Å; P200-G202 WeakPolarHBondContact O-CA 3.47Å; P200-G202 PolarHBondContact O-N 3.39Å; G202-V204 PolarHBondContact O-N 2.86Å
203	V	50.2	Low	57.3	Low	113 Å²	113	93 Å²	93	69%	0.685	53%	0.525	S	S	*	.			trans	-54.7	115.2	164.7	178.7	0	0	0	0	104.9	K201 K205	K201-V203 PolarHBondContact O-N 3.29Å; V203-K205 PolarHBondContact O-N 2.97Å
204	V	55.4	Low	58.8	Low	122 Å²	122	91.3 Å²	91.3	74%	0.739	51%	0.509	S	S	*	.			trans	-57.3	103.5	-178.4	178.6	0	0	0	0	107.4	G202 F206	G202-V204 PolarHBondContact O-N 2.86Å; V204-F206 PolarHBondContact O-N 2.68Å
205	K	70.8	Confident	60.3	Low	131 Å²	131	89.1 Å²	89.1	57%	0.57	49%	0.49	S	S	*	.	P	Polyproline II helix	trans	-64.8	136.5	-178.7	-66.3	-172.3	178.8	-178.7	0	109.4	V203 D431 A433	V203-K205 PolarHBondContact O-N 2.97Å; K205-D431 CarbonylContact C-O 3.55Å; K205-D431 WeakPolarHBondContact CA-O 3.24Å; K205-A433 HydrophobicContact CB-CB 3.99Å
206	F	74.9	Confident	61.8	Low	66 Å²	66	82 Å²	82	29%	0.289	46%	0.459	S	S	.	.	B	Isolated β-bridge	trans	-74.7	141.5	179.8	-61.5	-66	0	0	0	110.7	V204 K210 D431 L432 A433	V204-F206 PolarHBondContact O-N 2.68Å; F206-K210 HydrophobicContact CD1-CD 3.77Å; F206-K210 HydrophobicContact CD1-CG 3.96Å; F206-K210 HydrophobicContact CE1-CD 4.1Å; F206-K210 HydrophobicContact CE1-CG 4.49Å; F206-D431 HydrophobicContact CD2-CB 3.99Å; F206-D431 HydrophobicContact CE2-CB 4.32Å; F206-D431 PolarHBondContact N-O 3Å; F206-L432 WeakPolarHBondContact O-CA 3.31Å; F206-A433 PolarHBondContact O-N 3.38Å
207	G	80.8	Confident	63.5	Low	39 Å²	39	76 Å²	76	40%	0.402	43%	0.431	S	S	.	.	P	Polyproline II helix	trans	-75.7	171.9	166.4	0	0	0	0	0	111.9	I209 K210 G211	G207-I209 VanDerWaalsContact C-N 3.29Å; G207-I209 PolarHBondContact O-N 2.96Å; G207-K210 PolarHBondContact O-N 3.37Å; G207-G211 WeakPolarHBondContact O-CA 3.34Å; G207-G211 PolarHBondContact O-N 3.21Å
208	W	84.1	Confident	65	Low	89 Å²	89	72.8 Å²	72.8	34%	0.337	40%	0.4	S	S	.	.	H	α-helix	trans	-60.7	-33.2	-176.6	68.8	-89	0	0	0	114.2	V212 L213 A438 L445	W208-V212 WeakPolarHBondContact O-CA 3.47Å; W208-V212 WeakPolarHBondContact O-CB 3.27Å; W208-V212 PolarHBondContact O-N 3.47Å; W208-L213 HydrophobicContact CZ3-CD2 4.32Å; W208-L213 PolarHBondContact O-N 3.17Å; W208-A438 HydrophobicContact CB-CB 3.43Å; W208-A438 VanDerWaalsContact CB-CB 3.43Å; W208-L445 HydrophobicContact CH2-CD2 4.1Å; W208-L445 HydrophobicContact CZ3-CD2 3.85Å
209	I	83.8	Confident	66.5	Low	91 Å²	91	69.5 Å²	69.5	47%	0.467	37%	0.372	S	S	.	.	I	π-helix	trans	-68.7	-57.4	179.4	-56	172.1	0	0	0	110.2	G207 L213 V214	G207-I209 VanDerWaalsContact C-N 3.29Å; G207-I209 PolarHBondContact O-N 2.96Å; I209-L213 HydrophobicContact CG2-CD2 4.23Å; I209-L213 WeakPolarHBondContact O-CB 3.39Å; I209-L213 PolarHBondContact O-N 3.21Å; I209-V214 WeakPolarHBondContact O-CG2 3.34Å; I209-V214 PolarHBondContact O-N 3.02Å
210	K	76.9	Confident	68.1	Low	138 Å²	138	62.2 Å²	62.2	60%	0.6	34%	0.338	S	S	*	.	I	π-helix	trans	-72.3	-34.8	-176	-173.9	173.1	174.4	-175.1	0	112.3	F206 G207	F206-K210 HydrophobicContact CD1-CD 3.77Å; F206-K210 HydrophobicContact CD1-CG 3.96Å; F206-K210 HydrophobicContact CE1-CD 4.1Å; F206-K210 HydrophobicContact CE1-CG 4.49Å; G207-K210 PolarHBondContact O-N 3.37Å
211	G	74.1	Confident	68.9	Low	3 Å²	3	56.7 Å²	56.7	3%	0.031	30%	0.302	C	S	.	.	I	π-helix	trans	-84.3	-50	-176.1	0	0	0	0	0	113.6	G207 S215	G207-G211 WeakPolarHBondContact O-CA 3.34Å; G207-G211 PolarHBondContact O-N 3.21Å; G211-S215 WeakPolarHBondContact O-CB 3.26Å
212	V	80.5	Confident	69.6	Low	0 Å²	0	47.4 Å²	47.4	0%	0	26%	0.262	C	S	.	.	I	π-helix	trans	-99.1	-56.2	-171.8	-175.3	0	0	0	0	111.5	W208 S215 H216 L432 A438 I439	W208-V212 WeakPolarHBondContact O-CA 3.47Å; W208-V212 WeakPolarHBondContact O-CB 3.27Å; W208-V212 PolarHBondContact O-N 3.47Å; V212-S215 PolarHBondContact O-N 2.6Å; V212-H216 PolarHBondContact O-N 2.84Å; V212-L432 HydrophobicContact CG2-CD1 3.65Å; V212-L432 HydrophobicContact CG2-CD2 3.67Å; V212-L432 HydrophobicContact CG2-CG 4.33Å; V212-A438 HydrophobicContact CG2-CB 4.06Å; V212-I439 HydrophobicContact CG2-CG1 4.42Å
213	L	82.1	Confident	70.1	Confident	17 Å²	17	44.4 Å²	44.4	9%	0.089	23%	0.231	C	C	.	.	I	π-helix	trans	-62.3	-49.9	-174.2	178.2	67.5	0	0	0	111.4	W208 I209 S215 H216 F217 L445 A446 I449	W208-L213 HydrophobicContact CZ3-CD2 4.32Å; W208-L213 PolarHBondContact O-N 3.17Å; I209-L213 HydrophobicContact CG2-CD2 4.23Å; I209-L213 WeakPolarHBondContact O-CB 3.39Å; I209-L213 PolarHBondContact O-N 3.21Å; L213-S215 PolarHBondContact O-N 3.18Å; L213-H216 WeakPolarHBondContact O-CB 3.44Å; L213-H216 PolarHBondContact O-N 3.29Å; L213-F217 HydrophobicContact CD1-CD2 4.28Å; L213-F217 HydrophobicContact CD1-CE2 3.51Å; L213-F217 HydrophobicContact CD1-CZ 3.79Å; L213-F217 HydrophobicContact CD2-CE2 4.15Å; L213-F217 HydrophobicContact CG-CD2 4.09Å; L213-F217 HydrophobicContact CG-CE2 3.55Å; L213-F217 HydrophobicContact CG-CZ 4.33Å; L213-F217 VanDerWaalsContact O-CD2 3.3Å; L213-F217 WeakPolarHBondContact O-CD2 3.42Å; L213-F217 PolarHBondContact O-N 3.48Å; L213-L445 HydrophobicContact CD1-CD2 4.39Å; L213-L445 HydrophobicContact CD1-CG 4.5Å; L213-L445 HydrophobicContact CD2-CD2 4.31Å; L213-A446 HydrophobicContact CD1-CB 3.5Å; L213-A446 VanDerWaalsContact CD1-CB 3.5Å; L213-I449 HydrophobicContact CD1-CD1 4.47Å
214	V	77.8	Confident	70.1	Confident	22 Å²	22	39 Å²	39	13%	0.133	20%	0.198	C	C	.	.	H	α-helix	trans	-64.9	-38.7	177.4	164.4	0	0	0	0	111.9	I209 H216 F217 K218 L361	I209-V214 WeakPolarHBondContact O-CG2 3.34Å; I209-V214 PolarHBondContact O-N 3.02Å; V214-H216 VanDerWaalsContact C-N 3.3Å; V214-H216 PolarHBondContact O-N 3.36Å; V214-F217 PolarHBondContact O-N 3.23Å; V214-K218 HydrophobicContact CG1-CD 4.02Å; V214-K218 VanDerWaalsContact CG1-CE 3.44Å; V214-K218 VanDerWaalsContact O-CG 3.26Å; V214-K218 WeakPolarHBondContact O-CG 3.19Å; V214-K218 PolarHBondContact O-N 3.26Å; V214-K218 VanDerWaalsContact O-N 3.1Å; V214-L361 HydrophobicContact CB-CD2 4.37Å; V214-L361 HydrophobicContact CG1-CD2 3.54Å; V214-L361 HydrophobicContact CG2-CD2 4.09Å
215	S	77	Confident	69.8	Low	16 Å²	16	33.4 Å²	33.4	11%	0.112	16%	0.164	C	C	.	.	H	α-helix	trans	-62.4	-40	175.6	179.6	0	0	0	0	111.4	G211 V212 L213 K218 N219 A424 I428	G211-S215 WeakPolarHBondContact O-CB 3.26Å; V212-S215 PolarHBondContact O-N 2.6Å; L213-S215 PolarHBondContact O-N 3.18Å; S215-K218 PolarHBondContact O-N 3.24Å; S215-N219 WeakPolarHBondContact O-CB 3.35Å; S215-N219 PolarHBondContact O-N 3.17Å; S215-A424 PolarHBondContact OG-O 3.22Å; S215-I428 WeakPolarHBondContact OG-CD1 3.49Å
216	H	77.7	Confident	68.9	Low	4 Å²	4	27.2 Å²	27.2	2%	0.019	14%	0.137	C	C	.	.	H	α-helix	trans	-63.6	-45.4	174.9	-171	77.7	0	0	0	112.3	V212 L213 V214 K218 N219 S220 G421 A446	V212-H216 PolarHBondContact O-N 2.84Å; L213-H216 WeakPolarHBondContact O-CB 3.44Å; L213-H216 PolarHBondContact O-N 3.29Å; V214-H216 VanDerWaalsContact C-N 3.3Å; V214-H216 PolarHBondContact O-N 3.36Å; H216-K218 VanDerWaalsContact C-N 3.25Å; H216-K218 PolarHBondContact O-N 3.15Å; H216-N219 PolarHBondContact O-N 3.28Å; H216-S220 PolarHBondContact CD2-OG 3.19Å; H216-S220 PolarHBondContact CE1-OG 2.8Å; H216-S220 PolarHBondContact ND1-OG 3.1Å; H216-S220 PolarHBondContact NE2-OG 2.8Å; H216-S220 VanDerWaalsContact O-CB 3.23Å; H216-S220 WeakPolarHBondContact O-CB 2.86Å; H216-S220 PolarHBondContact O-N 2.98Å; H216-S220 PolarHBondContact O-OG 3.3Å; H216-G421 PolarHBondContact ND1-O 2.9Å; H216-A446 HydrophobicContact CB-CB 3.64Å; H216-A446 WeakPolarHBondContact CD2-CB 2.97Å; H216-A446 VanDerWaalsContact CG-CB 3.44Å
217	F	74.8	Confident	67.4	Low	41 Å²	41	24.3 Å²	24.3	18%	0.18	13%	0.125	C	C	.	.	H	α-helix	trans	-62.5	-31.4	177.1	-71.4	-50.4	0	0	0	113.7	L213 V214 L361 I449 T450	L213-F217 HydrophobicContact CD1-CD2 4.28Å; L213-F217 HydrophobicContact CD1-CE2 3.51Å; L213-F217 HydrophobicContact CD1-CZ 3.79Å; L213-F217 HydrophobicContact CD2-CE2 4.15Å; L213-F217 HydrophobicContact CG-CD2 4.09Å; L213-F217 HydrophobicContact CG-CE2 3.55Å; L213-F217 HydrophobicContact CG-CZ 4.33Å; L213-F217 VanDerWaalsContact O-CD2 3.3Å; L213-F217 WeakPolarHBondContact O-CD2 3.42Å; L213-F217 PolarHBondContact O-N 3.48Å; V214-F217 PolarHBondContact O-N 3.23Å; F217-L361 HydrophobicContact CB-CD1 4.07Å; F217-I449 HydrophobicContact CE1-CB 3.98Å; F217-I449 HydrophobicContact CE1-CG2 3.71Å; F217-I449 HydrophobicContact CZ-CB 3.81Å; F217-I449 HydrophobicContact CZ-CD1 3.86Å; F217-I449 HydrophobicContact CZ-CG1 4.45Å; F217-I449 HydrophobicContact CZ-CG2 3.59Å; F217-T450 HydrophobicContact CD1-CG2 3.71Å; F217-T450 HydrophobicContact CE1-CG2 3.71Å
218	K	71.6	Confident	65.9	Low	21 Å²	21	22.6 Å²	22.6	9%	0.091	11%	0.106	C	C	.	.	H	α-helix	trans	-73.3	-38.3	176	-68.6	166	173.2	-174.9	0	112.6	V214 S215 H216 Q357 L361 S537	V214-K218 HydrophobicContact CG1-CD 4.02Å; V214-K218 VanDerWaalsContact CG1-CE 3.44Å; V214-K218 VanDerWaalsContact O-CG 3.26Å; V214-K218 WeakPolarHBondContact O-CG 3.19Å; V214-K218 PolarHBondContact O-N 3.26Å; V214-K218 VanDerWaalsContact O-N 3.1Å; S215-K218 PolarHBondContact O-N 3.24Å; H216-K218 VanDerWaalsContact C-N 3.25Å; H216-K218 PolarHBondContact O-N 3.15Å; K218-Q357 HydrophobicContact CD-CB 4.06Å; K218-Q357 WeakPolarHBondContact CE-O 3.28Å; K218-Q357 VanDerWaalsContact NZ-CB 3.35Å; K218-L361 HydrophobicContact CG-CD1 4.16Å; K218-S537 PolarHBondContact O-OG 3.2Å
219	N	67.2	Low	64.3	Low	8 Å²	8	18.4 Å²	18.4	4%	0.043	9%	0.09	C	C	.	.	H	α-helix	trans	-97.8	-23.1	-170.9	-161.3	66.5	0	0	0	114.2	S215 H216 G221 G421 A424 A540	S215-N219 WeakPolarHBondContact O-CB 3.35Å; S215-N219 PolarHBondContact O-N 3.17Å; H216-N219 PolarHBondContact O-N 3.28Å; N219-G221 PolarHBondContact O-N 3.01Å; N219-G421 WeakPolarHBondContact ND2-CA 3.22Å; N219-A424 HydrophobicContact CB-CB 3.39Å; N219-A540 WeakPolarHBondContact OD1-CB 2.93Å
220	S	61.8	Low	62.5	Low	2 Å²	2	14.3 Å²	14.3	1%	0.014	7%	0.069	C	C	.	.	S	Bend	trans	-76.9	86.5	167.4	-42.6	0	0	0	0	105.3	H216 L222 T420	H216-S220 PolarHBondContact CD2-OG 3.19Å; H216-S220 PolarHBondContact CE1-OG 2.8Å; H216-S220 PolarHBondContact ND1-OG 3.1Å; H216-S220 PolarHBondContact NE2-OG 2.8Å; H216-S220 VanDerWaalsContact O-CB 3.23Å; H216-S220 WeakPolarHBondContact O-CB 2.86Å; H216-S220 PolarHBondContact O-N 2.98Å; H216-S220 PolarHBondContact O-OG 3.3Å; S220-L222 PolarHBondContact O-N 3.26Å; S220-T420 WeakPolarHBondContact CA-O 3.3Å
221	G	53.8	Low	61.1	Low	0 Å²	0	8.4 Å²	8.4	0%	0	5%	0.045	C	C	.	.			trans	-51.7	117	-168.4	0	0	0	0	0	109.7	N219 I223 P224 Y454 S537	N219-G221 PolarHBondContact O-N 3.01Å; G221-I223 PolarHBondContact O-N 3.23Å; G221-P224 WeakPolarHBondContact O-CD 3.01Å; G221-Y454 PolarHBondContact O-OH 2.58Å; G221-S537 WeakPolarHBondContact CA-OG 3.07Å
222	L	49.1	Very low	59.8	Low	9 Å²	9	8.3 Å²	8.3	5%	0.047	4%	0.044	C	C	.	.	S	Bend	trans	-72.3	5.2	164	-99.5	124.8	0	0	0	111.6	S220 L225 Y226 L364 I368 Y454 A533	S220-L222 PolarHBondContact O-N 3.26Å; L222-L225 HydrophobicContact CD2-CB 4.05Å; L222-L225 HydrophobicContact CD2-CD1 4.02Å; L222-L225 HydrophobicContact CD2-CD2 3.93Å; L222-L225 HydrophobicContact CD2-CG 4.22Å; L222-L225 WeakPolarHBondContact O-CA 3.32Å; L222-L225 WeakPolarHBondContact O-CB 3.42Å; L222-L225 PolarHBondContact O-N 3.15Å; L222-L225 VanDerWaalsContact O-N 3.08Å; L222-Y226 HydrophobicContact CD2-CE2 4.22Å; L222-Y226 WeakPolarHBondContact O-CD2 3.26Å; L222-Y226 PolarHBondContact O-N 2.87Å; L222-L364 HydrophobicContact CB-CD1 4Å; L222-L364 HydrophobicContact CB-CD2 4.31Å; L222-L364 HydrophobicContact CD1-CD1 4.3Å; L222-L364 HydrophobicContact CD1-CD2 3.75Å; L222-L364 HydrophobicContact CD1-CG 4.18Å; L222-L364 HydrophobicContact CD2-CD1 4.4Å; L222-L364 HydrophobicContact CG-CD1 4.46Å; L222-I368 HydrophobicContact CD1-CD1 4.07Å; L222-I368 HydrophobicContact CD2-CD1 3.63Å; L222-I368 HydrophobicContact CD2-CG1 4.03Å; L222-Y454 HydrophobicContact CG-CE1 4.47Å; L222-A533 HydrophobicContact CB-CB 4.25Å
223	I	47.1	Very low	58.1	Low	1 Å²	1	8.4 Å²	8.4	1%	0.005	4%	0.044	C	C	.	.	H	α-helix	trans	-65.1	-46.2	-179.2	-58	152.9	0	0	0	111.2	G221 L225 Y226 L227 Y305 A533 T534	G221-I223 PolarHBondContact O-N 3.23Å; I223-L225 PolarHBondContact O-N 3.14Å; I223-Y226 PolarHBondContact O-N 3.37Å; I223-L227 HydrophobicContact CG2-CD1 4.4Å; I223-L227 PolarHBondContact O-N 3.15Å; I223-L227 VanDerWaalsContact O-N 3.17Å; I223-Y305 HydrophobicContact CB-CD1 4.37Å; I223-Y305 HydrophobicContact CD1-CD1 3.08Å; I223-Y305 HydrophobicContact CD1-CD2 4.33Å; I223-Y305 HydrophobicContact CD1-CE1 3.58Å; I223-Y305 HydrophobicContact CD1-CG 3.5Å; I223-Y305 VanDerWaalsContact CD1-CG 3.5Å; I223-Y305 HydrophobicContact CG1-CD1 4.31Å; I223-Y305 HydrophobicContact CG2-CD1 4.5Å; I223-A533 HydrophobicContact CG1-CB 3.86Å; I223-T534 HydrophobicContact CB-CG2 4.18Å; I223-T534 VanDerWaalsContact CD1-CA 3.4Å; I223-T534 HydrophobicContact CD1-CG2 4.15Å; I223-T534 HydrophobicContact CG1-CG2 3.64Å; I223-T534 HydrophobicContact CG2-CG2 3.58Å
224	P	50.4	Low	56.2	Low	0 Å²	0	7.6 Å²	7.6	0%	0	4%	0.04	C	C	.	.	I	π-helix	trans	-68.3	-18.7	173	-21.7	39.2	0	0	0	112.3	G221 Y226 L228 Y229 M304 A418	G221-P224 WeakPolarHBondContact O-CD 3.01Å; P224-Y226 VanDerWaalsContact C-N 3.31Å; P224-L228 HydrophobicContact CB-CB 3.83Å; P224-L228 HydrophobicContact CB-CD1 4.49Å; P224-L228 HydrophobicContact CB-CD2 3.83Å; P224-L228 HydrophobicContact CB-CG 4.3Å; P224-L228 HydrophobicContact CG-CD2 4.32Å; P224-L228 CarbonylContact O-C 3.52Å; P224-L228 WeakPolarHBondContact O-CB 3.18Å; P224-L228 PolarHBondContact O-N 3.49Å; P224-Y229 WeakPolarHBondContact O-CB 3.16Å; P224-Y229 PolarHBondContact O-N 3.09Å; P224-M304 HydrophobicContact CG-CE 4.3Å; P224-A418 HydrophobicContact CB-CB 3.49Å; P224-A418 VanDerWaalsContact CB-CB 3.49Å; P224-A418 HydrophobicContact CG-CB 3.55Å
225	L	50.5	Low	54.7	Low	3 Å²	3	8.3 Å²	8.3	2%	0.016	4%	0.042	C	C	.	.	I	π-helix	trans	-67.8	-33.8	174.8	-172	133.2	0	0	0	111.4	L222 I223 Y229 V453 Y454 V457 M516	L222-L225 HydrophobicContact CD2-CB 4.05Å; L222-L225 HydrophobicContact CD2-CD1 4.02Å; L222-L225 HydrophobicContact CD2-CD2 3.93Å; L222-L225 HydrophobicContact CD2-CG 4.22Å; L222-L225 WeakPolarHBondContact O-CA 3.32Å; L222-L225 WeakPolarHBondContact O-CB 3.42Å; L222-L225 PolarHBondContact O-N 3.15Å; L222-L225 VanDerWaalsContact O-N 3.08Å; I223-L225 PolarHBondContact O-N 3.14Å; L225-Y229 WeakPolarHBondContact O-CB 3.17Å; L225-V453 HydrophobicContact CD1-CG1 4.42Å; L225-Y454 HydrophobicContact CB-CE1 4.17Å; L225-Y454 HydrophobicContact CD1-CD1 3.13Å; L225-Y454 HydrophobicContact CD1-CE1 3.33Å; L225-Y454 HydrophobicContact CD1-CG 4.28Å; L225-Y454 HydrophobicContact CG-CD1 4.43Å; L225-Y454 HydrophobicContact CG-CE1 4.38Å; L225-V457 HydrophobicContact CD1-CB 4.35Å; L225-V457 HydrophobicContact CD1-CG2 4.1Å; L225-V457 HydrophobicContact CD2-CG1 4.36Å; L225-V457 HydrophobicContact CD2-CG2 4.26Å; L225-V457 HydrophobicContact CG-CG1 4.43Å; L225-M516 HydrophobicContact CD2-CE 3.43Å; L225-M516 VanDerWaalsContact CD2-CE 3.43Å; L225-M516 HydrophobicContact CG-CE 4.15Å; L225-M516 WeakPolarHBondContact O-CE 3.27Å
226	Y	50	Low	53	Low	2 Å²	2	7.6 Å²	7.6	1%	0.008	4%	0.036	C	C	.	.	I	π-helix	trans	-94.7	-36.7	-176.7	-74.2	-75.7	0	0	0	114.3	L222 I223 P224 Q230 L364 I368 M516 I526 I530	L222-Y226 HydrophobicContact CD2-CE2 4.22Å; L222-Y226 WeakPolarHBondContact O-CD2 3.26Å; L222-Y226 PolarHBondContact O-N 2.87Å; I223-Y226 PolarHBondContact O-N 3.37Å; P224-Y226 VanDerWaalsContact C-N 3.31Å; Y226-Q230 PolarHBondContact O-NE2 3.3Å; Y226-L364 HydrophobicContact CE2-CD1 4.21Å; Y226-I368 WeakPolarHBondContact OH-CG1 3.34Å; Y226-I368 PolarHBondContact OH-N 3.02Å; Y226-M516 HydrophobicContact CD1-CB 4.18Å; Y226-M516 HydrophobicContact CD1-CE 3.83Å; Y226-M516 HydrophobicContact CD1-SD 4.14Å; Y226-M516 HydrophobicContact CE1-CE 4.09Å; Y226-M516 HydrophobicContact CG-CE 4.48Å; Y226-I526 HydrophobicContact CD1-CG2 3.82Å; Y226-I526 HydrophobicContact CE1-CD1 4.25Å; Y226-I526 HydrophobicContact CE1-CG2 3.78Å; Y226-I530 HydrophobicContact CD1-CG1 4.14Å; Y226-I530 HydrophobicContact CD2-CG1 4.19Å; Y226-I530 HydrophobicContact CG-CD1 4.36Å; Y226-I530 HydrophobicContact CG-CG1 3.71Å
227	L	43.5	Very low	51.5	Low	5 Å²	5	7.4 Å²	7.4	3%	0.026	4%	0.036	C	C	.	.	I	π-helix	trans	-100	-47.8	-176	-78.8	161.9	0	0	0	113.3	I223 G308 T312 I530	I223-L227 HydrophobicContact CG2-CD1 4.4Å; I223-L227 PolarHBondContact O-N 3.15Å; I223-L227 VanDerWaalsContact O-N 3.17Å; L227-G308 WeakPolarHBondContact CD1-O 3.02Å; L227-T312 HydrophobicContact CD1-CG2 3.73Å; L227-T312 HydrophobicContact CD2-CG2 3.56Å; L227-T312 HydrophobicContact CG-CG2 3.9Å; L227-I530 HydrophobicContact CD1-CG2 4.26Å
228	L	49.8	Very low	50.8	Low	2 Å²	2	5.6 Å²	5.6	1%	0.01	3%	0.028	C	C	.	.	I	π-helix	trans	-84.3	-21.9	-176.4	-86.6	67.3	0	0	0	113.8	P224 Q230 T231 L232 M304 I414 L595	P224-L228 HydrophobicContact CB-CB 3.83Å; P224-L228 HydrophobicContact CB-CD1 4.49Å; P224-L228 HydrophobicContact CB-CD2 3.83Å; P224-L228 HydrophobicContact CB-CG 4.3Å; P224-L228 HydrophobicContact CG-CD2 4.32Å; P224-L228 CarbonylContact O-C 3.52Å; P224-L228 WeakPolarHBondContact O-CB 3.18Å; P224-L228 PolarHBondContact O-N 3.49Å; L228-Q230 PolarHBondContact O-N 3.21Å; L228-T231 WeakPolarHBondContact O-CB 3.43Å; L228-T231 PolarHBondContact O-N 3.15Å; L228-T231 VanDerWaalsContact O-N 3.08Å; L228-T231 PolarHBondContact O-OG1 2.99Å; L228-L232 PolarHBondContact O-N 3.1Å; L228-M304 HydrophobicContact CD1-CE 4.38Å; L228-M304 HydrophobicContact CD2-CE 3.82Å; L228-I414 HydrophobicContact CB-CG2 4.13Å; L228-I414 HydrophobicContact CD2-CB 4.37Å; L228-I414 HydrophobicContact CD2-CG2 3.27Å; L228-I414 WeakPolarHBondContact CD2-O 3.37Å; L228-I414 HydrophobicContact CG-CG2 3.54Å; L228-L595 HydrophobicContact CD1-CD2 3.25Å; L228-L595 HydrophobicContact CD1-CG 3.84Å
229	Y	51.6	Low	50.2	Low	1 Å²	1	5.2 Å²	5.2	0%	0.004	3%	0.028	C	C	.	.	H	α-helix	trans	-64	-24.1	-177.6	-152.9	-108.3	0	0	0	112.2	P224 L225 L232 L233 F415 Y454 V457 A458	P224-Y229 WeakPolarHBondContact O-CB 3.16Å; P224-Y229 PolarHBondContact O-N 3.09Å; L225-Y229 WeakPolarHBondContact O-CB 3.17Å; Y229-L232 HydrophobicContact CD2-CD1 3.96Å; Y229-L232 HydrophobicContact CE2-CD1 4.15Å; Y229-L232 VanDerWaalsContact O-CB 3.27Å; Y229-L232 WeakPolarHBondContact O-CB 3.17Å; Y229-L232 PolarHBondContact O-N 3.09Å; Y229-L233 HydrophobicContact CD1-CD1 3.56Å; Y229-L233 HydrophobicContact CD1-CG 4.12Å; Y229-L233 HydrophobicContact CE1-CD1 3.34Å; Y229-L233 HydrophobicContact CE1-CG 3.88Å; Y229-L233 WeakPolarHBondContact O-CB 3.35Å; Y229-L233 PolarHBondContact O-N 3.36Å; Y229-F415 HydrophobicContact CD2-CE2 4.45Å; Y229-F415 HydrophobicContact CE2-CE2 4.35Å; Y229-Y454 PolarHBondContact OH-O 3.01Å; Y229-V457 HydrophobicContact CD1-CG1 3.75Å; Y229-V457 HydrophobicContact CE1-CB 4.15Å; Y229-V457 HydrophobicContact CE1-CG1 3.61Å; Y229-A458 HydrophobicContact CE1-CB 4.38Å; Y229-A458 WeakPolarHBondContact OH-CA 3.5Å; Y229-A458 WeakPolarHBondContact OH-CB 3.32Å; Y229-A458 PolarHBondContact OH-N 3.48Å
230	Q	45.7	Very low	50.2	Low	6 Å²	6	6.9 Å²	6.9	3%	0.028	4%	0.043	C	C	.	.	H	α-helix	trans	-79.6	-32.5	178	-51.5	-168.7	34.8	0	0	110.8	Y226 L228 L232 G234 L509 D512 F513 V515 M516	Y226-Q230 PolarHBondContact O-NE2 3.3Å; L228-Q230 PolarHBondContact O-N 3.21Å; Q230-L232 VanDerWaalsContact C-N 3.3Å; Q230-L232 PolarHBondContact O-N 3.17Å; Q230-G234 WeakPolarHBondContact O-CA 3.49Å; Q230-G234 PolarHBondContact O-N 3.15Å; Q230-L509 VanDerWaalsContact O-O 3.11Å; Q230-D512 PolarHBondContact OE1-O 3.03Å; Q230-F513 VanDerWaalsContact NE2-C 3.32Å; Q230-F513 PolarHBondContact NE2-O 3.17Å; Q230-F513 VanDerWaalsContact OE1-CA 3.28Å; Q230-F513 PolarHBondContact OE1-O 3.41Å; Q230-F513 VanDerWaalsContact OE1-O 3.14Å; Q230-V515 HydrophobicContact CG-CG1 4.04Å; Q230-M516 HydrophobicContact CG-CG 4.4Å; Q230-M516 HydrophobicContact CG-SD 4.19Å
231	T	46.2	Very low	50.7	Low	13 Å²	13	9.2 Å²	9.2	8%	0.08	6%	0.055	C	C	.	.	H	α-helix	trans	-64.5	-37.5	165.2	-32.5	0	0	0	0	111.3	L228 Q235	L228-T231 WeakPolarHBondContact O-CB 3.43Å; L228-T231 PolarHBondContact O-N 3.15Å; L228-T231 VanDerWaalsContact O-N 3.08Å; L228-T231 PolarHBondContact O-OG1 2.99Å; T231-Q235 HydrophobicContact CG2-CG 3.93Å; T231-Q235 WeakPolarHBondContact O-CB 2.84Å; T231-Q235 WeakPolarHBondContact O-CG 3.42Å; T231-Q235 PolarHBondContact O-N 3.28Å
232	L	48.2	Very low	51.7	Low	2 Å²	2	9.2 Å²	9.2	1%	0.01	6%	0.055	C	C	.	.	H	α-helix	trans	-66.5	-44.9	177.8	-112.9	166.7	0	0	0	113.4	L228 Y229 Q230 E236 A242 I245 V411 F415	L228-L232 PolarHBondContact O-N 3.1Å; Y229-L232 HydrophobicContact CD2-CD1 3.96Å; Y229-L232 HydrophobicContact CE2-CD1 4.15Å; Y229-L232 VanDerWaalsContact O-CB 3.27Å; Y229-L232 WeakPolarHBondContact O-CB 3.17Å; Y229-L232 PolarHBondContact O-N 3.09Å; Q230-L232 VanDerWaalsContact C-N 3.3Å; Q230-L232 PolarHBondContact O-N 3.17Å; L232-E236 WeakPolarHBondContact O-CB 3.25Å; L232-E236 PolarHBondContact O-N 3.3Å; L232-A242 HydrophobicContact CD2-CB 4.43Å; L232-I245 HydrophobicContact CD2-CB 4.5Å; L232-I245 HydrophobicContact CD2-CD1 3.74Å; L232-I245 HydrophobicContact CD2-CG2 4.22Å; L232-V411 HydrophobicContact CB-CG1 4.36Å; L232-V411 HydrophobicContact CD2-CG1 3.34Å; L232-V411 HydrophobicContact CG-CG1 3.59Å; L232-F415 HydrophobicContact CD1-CB 3.6Å; L232-F415 HydrophobicContact CD1-CD2 3.17Å; L232-F415 HydrophobicContact CD1-CE2 3.99Å; L232-F415 HydrophobicContact CD1-CG 3.56Å; L232-F415 HydrophobicContact CG-CB 4.33Å
233	L	43.8	Very low	53.1	Low	2 Å²	2	10.5 Å²	10.5	1%	0.01	6%	0.064	C	C	.	.	H	α-helix	trans	-90.4	-26.8	-178.3	-74.8	178	0	0	0	113.1	Y229 E236 A242 T461 L509	Y229-L233 HydrophobicContact CD1-CD1 3.56Å; Y229-L233 HydrophobicContact CD1-CG 4.12Å; Y229-L233 HydrophobicContact CE1-CD1 3.34Å; Y229-L233 HydrophobicContact CE1-CG 3.88Å; Y229-L233 WeakPolarHBondContact O-CB 3.35Å; Y229-L233 PolarHBondContact O-N 3.36Å; L233-E236 CarbonylContact C-O 3.21Å; L233-E236 VanDerWaalsContact C-O 3.31Å; L233-E236 WeakPolarHBondContact CA-O 3.4Å; L233-E236 CarbonylContact O-C 3.52Å; L233-E236 VanDerWaalsContact O-C 3.28Å; L233-A242 HydrophobicContact CD2-CB 4Å; L233-T461 HydrophobicContact CD1-CG2 3.61Å; L233-L509 HydrophobicContact CB-CD1 3.98Å; L233-L509 HydrophobicContact CB-CD2 3.87Å; L233-L509 HydrophobicContact CB-CG 3.84Å; L233-L509 WeakPolarHBondContact O-CD2 3.49Å; L233-L509 WeakPolarHBondContact O-CG 3.4Å
234	G	41.4	Very low	54.9	Low	0 Å²	0	14.3 Å²	14.3	0%	0	9%	0.087	C	C	.	.	H	α-helix	trans	-69.1	-71.1	172.4	0	0	0	0	0	108.8	Q230 E236 G237 L509 H510	Q230-G234 WeakPolarHBondContact O-CA 3.49Å; Q230-G234 PolarHBondContact O-N 3.15Å; G234-E236 PolarHBondContact O-N 3.43Å; G234-G237 PolarHBondContact O-N 3.32Å; G234-L509 WeakPolarHBondContact CA-O 3.46Å; G234-H510 PolarHBondContact O-CD2 3.43Å; G234-H510 PolarHBondContact O-CE1 2.78Å; G234-H510 PolarHBondContact O-ND1 2.94Å; G234-H510 PolarHBondContact O-NE2 3.24Å
235	Q	47	Very low	56.6	Low	37 Å²	37	14.3 Å²	14.3	17%	0.173	9%	0.087	C	C	.	.	S	Bend	trans	-68.4	-18.4	-176.5	-53.9	-61.1	-10.6	0	0	114.2	T231 R404 H510	T231-Q235 HydrophobicContact CG2-CG 3.93Å; T231-Q235 WeakPolarHBondContact O-CB 2.84Å; T231-Q235 WeakPolarHBondContact O-CG 3.42Å; T231-Q235 PolarHBondContact O-N 3.28Å; Q235-R404 PolarHBondContact OE1-O 2.87Å; Q235-H510 PolarHBondContact OE1-ND1 3.1Å
236	E	42.2	Very low	58.2	Low	0 Å²	0	14.2 Å²	14.2	0%	0	9%	0.086	C	C	.	.			trans	-117.3	94.7	160.2	-50.4	-159.2	-173.8	0	0	109.1	L232 L233 G234 H238 L241 F403 F408 V411	L232-E236 WeakPolarHBondContact O-CB 3.25Å; L232-E236 PolarHBondContact O-N 3.3Å; L233-E236 CarbonylContact C-O 3.21Å; L233-E236 VanDerWaalsContact C-O 3.31Å; L233-E236 WeakPolarHBondContact CA-O 3.4Å; L233-E236 CarbonylContact O-C 3.52Å; L233-E236 VanDerWaalsContact O-C 3.28Å; G234-E236 PolarHBondContact O-N 3.43Å; E236-H238 HydrophobicContact CB-CB 4.37Å; E236-H238 PolarHBondContact O-N 2.93Å; E236-L241 WeakPolarHBondContact OE2-CB 3.37Å; E236-F403 HydrophobicContact CG-CD1 4.23Å; E236-F403 HydrophobicContact CG-CE1 3.7Å; E236-F403 HydrophobicContact CG-CZ 4.42Å; E236-F403 VanDerWaalsContact OE1-CE1 3.3Å; E236-F403 WeakPolarHBondContact OE1-CE1 3.5Å; E236-F408 WeakPolarHBondContact OE1-CA 3.12Å; E236-V411 HydrophobicContact CG-CG1 4.34Å; E236-V411 HydrophobicContact CG-CG2 4.27Å
237	G	45.6	Very low	60	Low	0 Å²	0	15.3 Å²	15.3	0%	0	10%	0.098	C	C	.	.			trans	-64.3	49.4	164.9	0	0	0	0	0	113.1	G234 N398 G400 R467	G234-G237 PolarHBondContact O-N 3.32Å; G237-N398 CarbonylContact C-O 3.55Å; G237-N398 CarbonylContact O-C 3.51Å; G237-N398 WeakPolarHBondContact O-CA 3.42Å; G237-G400 PolarHBondContact O-N 2.88Å; G237-R467 PolarHBondContact O-NH2 3.12Å
238	H	59.3	Low	62.1	Low	4 Å²	4	17.3 Å²	17.3	2%	0.019	11%	0.108	C	C	.	.			trans	-142.3	88.6	-171.8	-54.6	96.7	0	0	0	109.6	E236 A240 L241 A242 N398 M399 G400 P401 D402	E236-H238 HydrophobicContact CB-CB 4.37Å; E236-H238 PolarHBondContact O-N 2.93Å; H238-A240 PolarHBondContact O-N 3.23Å; H238-L241 HydrophobicContact CB-CB 3.76Å; H238-L241 HydrophobicContact CB-CD1 4.15Å; H238-L241 HydrophobicContact CB-CG 4.14Å; H238-L241 WeakPolarHBondContact NE2-CD1 3.33Å; H238-L241 PolarHBondContact O-N 3.28Å; H238-A242 WeakPolarHBondContact O-CB 3.44Å; H238-A242 PolarHBondContact O-N 2.94Å; H238-N398 CarbonylContact C-O 3.49Å; H238-N398 WeakPolarHBondContact CA-O 3.09Å; H238-N398 PolarHBondContact N-O 3.03Å; H238-M399 PolarHBondContact CD2-O 3.42Å; H238-M399 VanDerWaalsContact CD2-O 3.32Å; H238-G400 PolarHBondContact CD2-O 2.82Å; H238-P401 WeakPolarHBondContact CD2-CD 3.05Å; H238-P401 WeakPolarHBondContact CE1-CA 3.11Å; H238-P401 WeakPolarHBondContact CE1-CB 3.27Å; H238-P401 WeakPolarHBondContact NE2-CA 3.16Å; H238-P401 WeakPolarHBondContact NE2-CB 3.49Å; H238-P401 WeakPolarHBondContact NE2-CD 3.22Å; H238-P401 WeakPolarHBondContact NE2-CG 3.04Å; H238-D402 PolarHBondContact CE1-N 3Å; H238-D402 VanDerWaalsContact CE1-N 3.32Å
239	S	59.9	Low	63.9	Low	13 Å²	13	17.2 Å²	17.2	9%	0.091	11%	0.108	C	C	.	.	H	α-helix	trans	-48.3	-34.6	166.1	53	0	0	0	0	111.8	C243 N398	S239-C243 WeakPolarHBondContact O-CB 3.42Å; S239-C243 PolarHBondContact O-N 2.82Å; S239-C243 VanDerWaalsContact O-N 3.12Å; S239-C243 PolarHBondContact O-SG 3.43Å; S239-N398 PolarHBondContact N-O 3.31Å
240	A	67	Low	65.7	Low	43 Å²	43	18.7 Å²	18.7	36%	0.355	12%	0.117	S	C	.	.	H	α-helix	trans	-69.9	-47.5	178.1	0	0	0	0	0	115	H238 C243 V244 M399	H238-A240 PolarHBondContact O-N 3.23Å; A240-C243 WeakPolarHBondContact O-CB 3.31Å; A240-C243 PolarHBondContact O-N 2.94Å; A240-V244 WeakPolarHBondContact O-CG2 3.39Å; A240-V244 PolarHBondContact O-N 3.17Å; A240-M399 HydrophobicContact CB-CE 4.23Å
241	L	72.5	Confident	68	Low	51 Å²	51	21.9 Å²	21.9	27%	0.267	14%	0.137	S	C	.	.	H	α-helix	trans	-72.4	-35.4	179.4	-74.5	172	0	0	0	111.7	E236 H238 C243 V244 I245 F403 F408	E236-L241 WeakPolarHBondContact OE2-CB 3.37Å; H238-L241 HydrophobicContact CB-CB 3.76Å; H238-L241 HydrophobicContact CB-CD1 4.15Å; H238-L241 HydrophobicContact CB-CG 4.14Å; H238-L241 WeakPolarHBondContact NE2-CD1 3.33Å; H238-L241 PolarHBondContact O-N 3.28Å; L241-C243 VanDerWaalsContact C-N 3.28Å; L241-C243 PolarHBondContact O-N 2.79Å; L241-V244 CarbonylContact O-C 2.99Å; L241-V244 WeakPolarHBondContact O-CA 3.13Å; L241-V244 WeakPolarHBondContact O-CB 3.4Å; L241-V244 PolarHBondContact O-N 3.23Å; L241-I245 WeakPolarHBondContact O-CG1 3.24Å; L241-I245 PolarHBondContact O-N 3.46Å; L241-F403 HydrophobicContact CD1-CZ 4.2Å; L241-F408 HydrophobicContact CD2-CD2 4.45Å; L241-F408 HydrophobicContact CD2-CE2 4.12Å
242	A	73.7	Confident	70.2	Confident	0 Å²	0	21.3 Å²	21.3	0%	0	13%	0.133	C	C	.	.	H	α-helix	trans	-57.9	-43.2	170.2	0	0	0	0	0	110.9	L232 L233 H238 V244 I245 V246	L232-A242 HydrophobicContact CD2-CB 4.43Å; L233-A242 HydrophobicContact CD2-CB 4Å; H238-A242 WeakPolarHBondContact O-CB 3.44Å; H238-A242 PolarHBondContact O-N 2.94Å; A242-V244 VanDerWaalsContact C-N 3.3Å; A242-V244 PolarHBondContact O-N 3Å; A242-I245 PolarHBondContact O-N 2.8Å; A242-V246 VanDerWaalsContact O-CG2 3.26Å; A242-V246 WeakPolarHBondContact O-CG2 3.49Å; A242-V246 PolarHBondContact O-N 3.31Å
243	C	80.3	Confident	72.2	Confident	36 Å²	36	21.3 Å²	21.3	24%	0.243	13%	0.134	C	C	.	.	H	α-helix	trans	-61	-35.9	172	-72.3	0	0	0	0	113	S239 A240 L241 G247 L455	S239-C243 WeakPolarHBondContact O-CB 3.42Å; S239-C243 PolarHBondContact O-N 2.82Å; S239-C243 VanDerWaalsContact O-N 3.12Å; S239-C243 PolarHBondContact O-SG 3.43Å; A240-C243 WeakPolarHBondContact O-CB 3.31Å; A240-C243 PolarHBondContact O-N 2.94Å; L241-C243 VanDerWaalsContact C-N 3.28Å; L241-C243 PolarHBondContact O-N 2.79Å; C243-G247 PolarHBondContact O-N 3.11Å; C243-L455 HydrophobicContact CB-CD2 3.87Å
244	V	85.1	Confident	74.6	Confident	81 Å²	81	23.8 Å²	23.8	49%	0.491	15%	0.149	S	C	.	.	H	α-helix	trans	-67.4	-42.3	174.7	173.9	0	0	0	0	111.4	A240 L241 A242 G247 M248 F408	A240-V244 WeakPolarHBondContact O-CG2 3.39Å; A240-V244 PolarHBondContact O-N 3.17Å; L241-V244 CarbonylContact O-C 2.99Å; L241-V244 WeakPolarHBondContact O-CA 3.13Å; L241-V244 WeakPolarHBondContact O-CB 3.4Å; L241-V244 PolarHBondContact O-N 3.23Å; A242-V244 VanDerWaalsContact C-N 3.3Å; A242-V244 PolarHBondContact O-N 3Å; V244-G247 CarbonylContact O-C 3.31Å; V244-G247 PolarHBondContact O-N 3.25Å; V244-M248 WeakPolarHBondContact O-CB 3.46Å; V244-M248 PolarHBondContact O-N 2.68Å; V244-F408 HydrophobicContact CG1-CZ 4.4Å
245	I	84.4	Confident	77.1	Confident	0 Å²	0	24.8 Å²	24.8	0%	0	15%	0.154	C	C	.	.	H	α-helix	trans	-61.7	-48.4	176.5	-70.7	169.3	0	0	0	110.4	L232 L241 A242 G247 M248 A249 F408 V411 F412 F415	L232-I245 HydrophobicContact CD2-CB 4.5Å; L232-I245 HydrophobicContact CD2-CD1 3.74Å; L232-I245 HydrophobicContact CD2-CG2 4.22Å; L241-I245 WeakPolarHBondContact O-CG1 3.24Å; L241-I245 PolarHBondContact O-N 3.46Å; A242-I245 PolarHBondContact O-N 2.8Å; I245-G247 VanDerWaalsContact C-N 3.33Å; I245-G247 PolarHBondContact O-N 2.82Å; I245-M248 PolarHBondContact O-N 2.96Å; I245-A249 WeakPolarHBondContact O-CB 3.48Å; I245-A249 PolarHBondContact O-N 3.05Å; I245-F408 HydrophobicContact CD1-CD2 4.03Å; I245-F408 HydrophobicContact CD1-CE2 3.76Å; I245-F408 HydrophobicContact CD1-CZ 4.4Å; I245-F408 HydrophobicContact CG1-CD2 4.21Å; I245-F408 HydrophobicContact CG1-CE2 3.45Å; I245-F408 VanDerWaalsContact CG1-CE2 3.45Å; I245-F408 HydrophobicContact CG1-CZ 3.69Å; I245-V411 HydrophobicContact CD1-CB 4.49Å; I245-V411 HydrophobicContact CD1-CG1 4.07Å; I245-F412 HydrophobicContact CG2-CB 4.45Å; I245-F412 HydrophobicContact CG2-CD2 3.94Å; I245-F415 HydrophobicContact CG2-CB 4.07Å; I245-F415 HydrophobicContact CG2-CD1 3.59Å; I245-F415 HydrophobicContact CG2-CE1 4.34Å; I245-F415 HydrophobicContact CG2-CG 4.02Å
246	V	84.7	Confident	79.3	Confident	0 Å²	0	23 Å²	23	0%	0	15%	0.146	C	C	.	.	H	α-helix	trans	-61.3	-43.3	175.3	177.5	0	0	0	0	110.5	A242 M248 A249 T250 F415 L455	A242-V246 VanDerWaalsContact O-CG2 3.26Å; A242-V246 WeakPolarHBondContact O-CG2 3.49Å; A242-V246 PolarHBondContact O-N 3.31Å; V246-M248 PolarHBondContact O-N 3.06Å; V246-A249 PolarHBondContact O-N 3.36Å; V246-T250 HydrophobicContact CG1-CG2 4.27Å; V246-T250 WeakPolarHBondContact O-CB 3.42Å; V246-T250 VanDerWaalsContact O-CG2 3.24Å; V246-T250 WeakPolarHBondContact O-CG2 3.5Å; V246-T250 PolarHBondContact O-N 2.9Å; V246-T250 PolarHBondContact O-OG1 3.1Å; V246-F415 HydrophobicContact CB-CE1 4.39Å; V246-F415 HydrophobicContact CB-CZ 4.35Å; V246-F415 HydrophobicContact CG1-CZ 4.48Å; V246-F415 HydrophobicContact CG2-CE1 3.98Å; V246-F415 HydrophobicContact CG2-CE2 4.26Å; V246-F415 HydrophobicContact CG2-CZ 3.64Å; V246-L455 HydrophobicContact CB-CD2 3.93Å; V246-L455 HydrophobicContact CG1-CD2 3.82Å; V246-L455 HydrophobicContact CG1-CG 3.88Å
247	G	87.3	Confident	81.7	Confident	25 Å²	25	23 Å²	23	26%	0.258	15%	0.146	S	C	.	.	H	α-helix	trans	-58.8	-44.7	174.6	0	0	0	0	0	112.8	C243 V244 I245 T250 V251	C243-G247 PolarHBondContact O-N 3.11Å; V244-G247 CarbonylContact O-C 3.31Å; V244-G247 PolarHBondContact O-N 3.25Å; I245-G247 VanDerWaalsContact C-N 3.33Å; I245-G247 PolarHBondContact O-N 2.82Å; G247-T250 VanDerWaalsContact CA-OG1 3.31Å; G247-T250 WeakPolarHBondContact CA-OG1 3.3Å; G247-T250 PolarHBondContact O-N 3.04Å; G247-T250 PolarHBondContact O-OG1 2.98Å; G247-V251 VanDerWaalsContact O-CG2 3.24Å; G247-V251 WeakPolarHBondContact O-CG2 2.98Å; G247-V251 PolarHBondContact O-N 3.11Å
248	M	88.3	Confident	83.9	Confident	47 Å²	47	24.5 Å²	24.5	23%	0.232	15%	0.153	C	C	.	.	H	α-helix	trans	-66	-45.1	178.9	-170.3	-177.3	-161	0	0	111.6	V244 I245 V246 V251 V252 F412 L646 V650	V244-M248 WeakPolarHBondContact O-CB 3.46Å; V244-M248 PolarHBondContact O-N 2.68Å; I245-M248 PolarHBondContact O-N 2.96Å; V246-M248 PolarHBondContact O-N 3.06Å; M248-V251 PolarHBondContact O-N 3.23Å; M248-V252 WeakPolarHBondContact O-CG2 3.37Å; M248-V252 PolarHBondContact O-N 3.07Å; M248-F412 HydrophobicContact CB-CE2 4.1Å; M248-F412 HydrophobicContact CG-CE2 3.99Å; M248-F412 HydrophobicContact SD-CD2 4.09Å; M248-F412 HydrophobicContact SD-CE2 3.81Å; M248-F412 HydrophobicContact SD-CZ 4.42Å; M248-L646 HydrophobicContact CE-CD1 3.96Å; M248-V650 HydrophobicContact CE-CG2 3.34Å; M248-V650 HydrophobicContact SD-CG2 4.41Å
249	A	88.3	Confident	85.5	Confident	1 Å²	1	24.4 Å²	24.4	1%	0.008	15%	0.153	C	C	.	.	H	α-helix	trans	-65.4	-40	177.6	0	0	0	0	0	112.2	I245 V246 V252 T253 F412 F415 F416 A419	I245-A249 WeakPolarHBondContact O-CB 3.48Å; I245-A249 PolarHBondContact O-N 3.05Å; V246-A249 PolarHBondContact O-N 3.36Å; A249-V252 PolarHBondContact O-N 3.28Å; A249-T253 WeakPolarHBondContact O-CB 3.3Å; A249-T253 WeakPolarHBondContact O-CG2 3.2Å; A249-T253 PolarHBondContact O-N 3.49Å; A249-T253 PolarHBondContact O-OG1 2.72Å; A249-F412 HydrophobicContact CB-CE2 4.3Å; A249-F415 HydrophobicContact CB-CD1 4.14Å; A249-F415 HydrophobicContact CB-CE1 3.79Å; A249-F416 HydrophobicContact CB-CD2 4.46Å; A249-A419 HydrophobicContact CB-CB 3.92Å
250	T	89.4	Confident	87	Confident	31 Å²	31	24.2 Å²	24.2	19%	0.19	15%	0.151	C	C	.	.	H	α-helix	trans	-65.9	-36.6	174.9	51.8	0	0	0	0	111.7	V246 G247 T253 T254	V246-T250 HydrophobicContact CG1-CG2 4.27Å; V246-T250 WeakPolarHBondContact O-CB 3.42Å; V246-T250 VanDerWaalsContact O-CG2 3.24Å; V246-T250 WeakPolarHBondContact O-CG2 3.5Å; V246-T250 PolarHBondContact O-N 2.9Å; V246-T250 PolarHBondContact O-OG1 3.1Å; G247-T250 VanDerWaalsContact CA-OG1 3.31Å; G247-T250 WeakPolarHBondContact CA-OG1 3.3Å; G247-T250 PolarHBondContact O-N 3.04Å; G247-T250 PolarHBondContact O-OG1 2.98Å; T250-T253 WeakPolarHBondContact CA-OG1 3.39Å; T250-T253 PolarHBondContact O-OG1 3.08Å; T250-T253 VanDerWaalsContact O-OG1 3.06Å; T250-T254 WeakPolarHBondContact O-CB 3.48Å; T250-T254 PolarHBondContact O-N 2.73Å; T250-T254 PolarHBondContact O-OG1 3.14Å
251	V	92.8	Very high	88.1	Confident	74 Å²	74	22.1 Å²	22.1	45%	0.448	13%	0.134	S	C	.	.	H	α-helix	trans	-63.2	-48.7	173	168.5	0	0	0	0	111.3	G247 M248 T253 T254 I255 L646	G247-V251 VanDerWaalsContact O-CG2 3.24Å; G247-V251 WeakPolarHBondContact O-CG2 2.98Å; G247-V251 PolarHBondContact O-N 3.11Å; M248-V251 PolarHBondContact O-N 3.23Å; V251-T253 VanDerWaalsContact C-N 3.33Å; V251-T253 PolarHBondContact O-N 2.88Å; V251-T254 PolarHBondContact O-N 3.49Å; V251-I255 HydrophobicContact CG1-CD1 3.83Å; V251-I255 WeakPolarHBondContact O-CG1 3.38Å; V251-I255 PolarHBondContact O-N 3.07Å; V251-L646 HydrophobicContact CG1-CD2 4.2Å
252	V	92.4	Very high	88.9	Confident	0 Å²	0	19.7 Å²	19.7	0%	0	12%	0.122	C	C	.	.	H	α-helix	trans	-57.3	-46.9	178.4	168.4	0	0	0	0	111.4	M248 A249 T256 F416 L607 L646	M248-V252 WeakPolarHBondContact O-CG2 3.37Å; M248-V252 PolarHBondContact O-N 3.07Å; A249-V252 PolarHBondContact O-N 3.28Å; V252-T256 WeakPolarHBondContact O-CB 3.34Å; V252-T256 PolarHBondContact O-N 3.23Å; V252-T256 VanDerWaalsContact O-N 3.11Å; V252-T256 PolarHBondContact O-OG1 3.05Å; V252-F416 HydrophobicContact CB-CE2 4.42Å; V252-F416 HydrophobicContact CG1-CE2 3.89Å; V252-F416 HydrophobicContact CG1-CZ 4.17Å; V252-L607 HydrophobicContact CG1-CD2 4.32Å; V252-L646 HydrophobicContact CG2-CD2 3.57Å; V252-L646 HydrophobicContact CG2-CG 4.04Å
253	T	91.4	Very high	89.7	Confident	3 Å²	3	19.9 Å²	19.9	2%	0.018	12%	0.123	C	C	.	.	H	α-helix	trans	-72.8	-34.6	-178.3	51.6	0	0	0	0	112.4	A249 T250 V251 T256 G257 A419 I422	A249-T253 WeakPolarHBondContact O-CB 3.3Å; A249-T253 WeakPolarHBondContact O-CG2 3.2Å; A249-T253 PolarHBondContact O-N 3.49Å; A249-T253 PolarHBondContact O-OG1 2.72Å; T250-T253 WeakPolarHBondContact CA-OG1 3.39Å; T250-T253 PolarHBondContact O-OG1 3.08Å; T250-T253 VanDerWaalsContact O-OG1 3.06Å; V251-T253 VanDerWaalsContact C-N 3.33Å; V251-T253 PolarHBondContact O-N 2.88Å; T253-T256 PolarHBondContact O-N 3.25Å; T253-G257 PolarHBondContact O-N 3.5Å; T253-A419 HydrophobicContact CG2-CB 3.97Å; T253-A419 WeakPolarHBondContact CG2-O 3.43Å; T253-I422 HydrophobicContact CG2-CG2 4.38Å
254	T	92.9	Very high	90	Very high	53 Å²	53	18.2 Å²	18.2	33%	0.325	11%	0.111	S	C	.	.	H	α-helix	trans	-65.6	-46.4	174.8	-58.5	0	0	0	0	111.2	T250 V251 T256 G257 L258	T250-T254 WeakPolarHBondContact O-CB 3.48Å; T250-T254 PolarHBondContact O-N 2.73Å; T250-T254 PolarHBondContact O-OG1 3.14Å; V251-T254 PolarHBondContact O-N 3.49Å; T254-T256 VanDerWaalsContact C-N 3.3Å; T254-T256 PolarHBondContact O-N 3.5Å; T254-G257 PolarHBondContact O-N 3.34Å; T254-G257 VanDerWaalsContact O-N 3.16Å; T254-L258 WeakPolarHBondContact O-CG 3.17Å; T254-L258 PolarHBondContact O-N 3.23Å
255	I	94.4	Very high	90.1	Very high	22 Å²	22	15.2 Å²	15.2	11%	0.113	9%	0.093	C	C	.	.	H	α-helix	trans	-59.6	-44.8	176.6	-65.8	167.3	0	0	0	110.4	V251 G257 L258 S259 V639	V251-I255 HydrophobicContact CG1-CD1 3.83Å; V251-I255 WeakPolarHBondContact O-CG1 3.38Å; V251-I255 PolarHBondContact O-N 3.07Å; I255-G257 VanDerWaalsContact C-N 3.32Å; I255-G257 PolarHBondContact O-N 2.83Å; I255-L258 WeakPolarHBondContact O-CB 3.08Å; I255-L258 PolarHBondContact O-N 3.2Å; I255-S259 PolarHBondContact O-N 3.34Å; I255-S259 PolarHBondContact O-OG 2.77Å; I255-V639 HydrophobicContact CG1-CG1 4.05Å; I255-V639 HydrophobicContact CG2-CG1 4.13Å; I255-V639 WeakPolarHBondContact CG2-O 3.43Å
256	T	93.2	Very high	90.1	Very high	0 Å²	0	15.9 Å²	15.9	0%	0	10%	0.097	C	C	.	.	H	α-helix	trans	-68.1	-33	178.4	-47.5	0	0	0	0	112.2	V252 T253 T254 S259 T260 I422 Y610 I613 N614	V252-T256 WeakPolarHBondContact O-CB 3.34Å; V252-T256 PolarHBondContact O-N 3.23Å; V252-T256 VanDerWaalsContact O-N 3.11Å; V252-T256 PolarHBondContact O-OG1 3.05Å; T253-T256 PolarHBondContact O-N 3.25Å; T254-T256 VanDerWaalsContact C-N 3.3Å; T254-T256 PolarHBondContact O-N 3.5Å; T256-S259 PolarHBondContact O-N 2.98Å; T256-T260 WeakPolarHBondContact O-CB 3.39Å; T256-T260 PolarHBondContact O-N 3.19Å; T256-T260 PolarHBondContact O-OG1 3.2Å; T256-I422 HydrophobicContact CG2-CD1 3.59Å; T256-Y610 HydrophobicContact CG2-CD1 3.8Å; T256-Y610 HydrophobicContact CG2-CG 3.85Å; T256-I613 HydrophobicContact CG2-CG2 4.25Å; T256-N614 WeakPolarHBondContact CA-OD1 3.47Å; T256-N614 PolarHBondContact OG1-ND2 3.28Å
257	G	92.1	Very high	89.6	Confident	0 Å²	0	18 Å²	18	0%	0	12%	0.118	C	C	.	.	H	α-helix	trans	-64.5	-38.7	171.8	0	0	0	0	0	112.8	T253 T254 I255 T260 S261	T253-G257 PolarHBondContact O-N 3.5Å; T254-G257 PolarHBondContact O-N 3.34Å; T254-G257 VanDerWaalsContact O-N 3.16Å; I255-G257 VanDerWaalsContact C-N 3.32Å; I255-G257 PolarHBondContact O-N 2.83Å; G257-T260 PolarHBondContact O-N 3.4Å; G257-S261 WeakPolarHBondContact O-CB 3Å; G257-S261 PolarHBondContact O-N 2.88Å; G257-S261 PolarHBondContact O-OG 3.08Å
258	L	92.8	Very high	88.6	Confident	30 Å²	30	24.7 Å²	24.7	16%	0.157	14%	0.141	C	C	.	.	H	α-helix	trans	-65	-45.3	172.5	-65.4	170.3	0	0	0	111.2	T254 I255 T260 S261 A262 L444 F632 V639	T254-L258 WeakPolarHBondContact O-CG 3.17Å; T254-L258 PolarHBondContact O-N 3.23Å; I255-L258 WeakPolarHBondContact O-CB 3.08Å; I255-L258 PolarHBondContact O-N 3.2Å; L258-T260 PolarHBondContact O-N 3.04Å; L258-S261 WeakPolarHBondContact O-CB 3.42Å; L258-S261 PolarHBondContact O-N 3.29Å; L258-A262 PolarHBondContact O-N 2.87Å; L258-L444 HydrophobicContact CD2-CD1 4.07Å; L258-L444 HydrophobicContact CD2-CD2 4.16Å; L258-L444 HydrophobicContact CG-CD2 4.41Å; L258-F632 HydrophobicContact CD2-CE1 3.64Å; L258-F632 HydrophobicContact CD2-CZ 4.27Å; L258-V639 HydrophobicContact CD1-CG1 4.46Å
259	S	93.2	Very high	87.5	Confident	2 Å²	2	23.6 Å²	23.6	1%	0.014	14%	0.137	C	C	.	.	H	α-helix	trans	-61.1	-43.7	175.1	-60	0	0	0	0	111.8	I255 T256 S261 A262 I263 N614 S640	I255-S259 PolarHBondContact O-N 3.34Å; I255-S259 PolarHBondContact O-OG 2.77Å; T256-S259 PolarHBondContact O-N 2.98Å; S259-S261 VanDerWaalsContact C-N 3.31Å; S259-S261 PolarHBondContact O-N 3.36Å; S259-A262 WeakPolarHBondContact O-CB 3.38Å; S259-A262 PolarHBondContact O-N 2.92Å; S259-I263 WeakPolarHBondContact O-CG1 3.32Å; S259-I263 PolarHBondContact O-N 2.88Å; S259-N614 VanDerWaalsContact CB-OD1 3.24Å; S259-N614 WeakPolarHBondContact CB-OD1 3.22Å; S259-N614 PolarHBondContact OG-OD1 2.79Å; S259-S640 PolarHBondContact OG-OG 3.02Å
260	T	90.3	Very high	86.1	Confident	9 Å²	9	32 Å²	32	6%	0.055	17%	0.168	C	C	.	.	H	α-helix	trans	-64.4	-37.5	176.4	-55.3	0	0	0	0	111.6	T256 G257 L258 I263 A264 L423	T256-T260 WeakPolarHBondContact O-CB 3.39Å; T256-T260 PolarHBondContact O-N 3.19Å; T256-T260 PolarHBondContact O-OG1 3.2Å; G257-T260 PolarHBondContact O-N 3.4Å; L258-T260 PolarHBondContact O-N 3.04Å; T260-I263 WeakPolarHBondContact O-CB 3.14Å; T260-I263 PolarHBondContact O-N 3.21Å; T260-A264 WeakPolarHBondContact O-CB 3.43Å; T260-A264 PolarHBondContact O-N 3.06Å; T260-L423 HydrophobicContact CG2-CD2 3.81Å
261	S	90	Very high	84.6	Confident	0 Å²	0	33.4 Å²	33.4	0%	0	19%	0.189	C	C	.	.	H	α-helix	trans	-66.7	-36.6	175	-60.5	0	0	0	0	112.1	G257 L258 S259 A264 T265 P440	G257-S261 WeakPolarHBondContact O-CB 3Å; G257-S261 PolarHBondContact O-N 2.88Å; G257-S261 PolarHBondContact O-OG 3.08Å; L258-S261 WeakPolarHBondContact O-CB 3.42Å; L258-S261 PolarHBondContact O-N 3.29Å; S259-S261 VanDerWaalsContact C-N 3.31Å; S259-S261 PolarHBondContact O-N 3.36Å; S261-A264 PolarHBondContact O-N 3.37Å; S261-T265 WeakPolarHBondContact O-CG2 3.32Å; S261-T265 PolarHBondContact O-N 2.71Å; S261-T265 PolarHBondContact O-OG1 2.92Å; S261-P440 WeakPolarHBondContact OG-CA 3.3Å
262	A	90.6	Very high	83.3	Confident	0 Å²	0	30.1 Å²	30.1	0%	0	17%	0.17	C	C	.	.	H	α-helix	trans	-63.9	-42.1	172.6	0	0	0	0	0	111.4	L258 S259 T265 N266 W628 P630 Y635	L258-A262 PolarHBondContact O-N 2.87Å; S259-A262 WeakPolarHBondContact O-CB 3.38Å; S259-A262 PolarHBondContact O-N 2.92Å; A262-T265 PolarHBondContact O-N 3.25Å; A262-T265 PolarHBondContact O-OG1 2.99Å; A262-N266 PolarHBondContact O-N 2.91Å; A262-W628 HydrophobicContact CB-CH2 4.21Å; A262-W628 HydrophobicContact CB-CZ2 4.27Å; A262-P630 HydrophobicContact CB-CB 3.97Å; A262-Y635 HydrophobicContact CB-CD1 4.28Å; A262-Y635 HydrophobicContact CB-CD2 3.53Å; A262-Y635 HydrophobicContact CB-CE2 3.97Å; A262-Y635 HydrophobicContact CB-CG 3.72Å
263	I	89.5	Confident	82.5	Confident	4 Å²	4	30.6 Å²	30.6	2%	0.021	18%	0.175	C	C	.	.	H	α-helix	trans	-62	-45.9	174.2	-64.9	167.2	0	0	0	111.1	S259 T260 T265 N266 L277 I278 S281 L282 I613 V617 W628	S259-I263 WeakPolarHBondContact O-CG1 3.32Å; S259-I263 PolarHBondContact O-N 2.88Å; T260-I263 WeakPolarHBondContact O-CB 3.14Å; T260-I263 PolarHBondContact O-N 3.21Å; I263-T265 VanDerWaalsContact C-N 3.27Å; I263-T265 PolarHBondContact O-N 2.93Å; I263-N266 WeakPolarHBondContact O-CB 3.44Å; I263-N266 PolarHBondContact O-N 3.27Å; I263-L277 HydrophobicContact CG2-CB 4.41Å; I263-L277 WeakPolarHBondContact CG2-O 3.21Å; I263-I278 HydrophobicContact CD1-CG1 4.48Å; I263-S281 PolarHBondContact O-OG 2.92Å; I263-L282 HydrophobicContact CD1-CD1 3.86Å; I263-L282 HydrophobicContact CG1-CD1 4.36Å; I263-I613 HydrophobicContact CD1-CG2 4.04Å; I263-V617 HydrophobicContact CD1-CG2 3.61Å; I263-V617 HydrophobicContact CG1-CG2 3.59Å; I263-W628 HydrophobicContact CG1-CH2 4.08Å; I263-W628 HydrophobicContact CG1-CZ3 4.19Å
264	A	87.5	Confident	81.7	Confident	1 Å²	1	30.7 Å²	30.7	1%	0.008	18%	0.176	C	C	.	.	H	α-helix	trans	-68.4	-24.6	-177.5	0	0	0	0	0	113.5	T260 S261 V269 I439	T260-A264 WeakPolarHBondContact O-CB 3.43Å; T260-A264 PolarHBondContact O-N 3.06Å; S261-A264 PolarHBondContact O-N 3.37Å; A264-V269 VanDerWaalsContact O-CG2 3.24Å; A264-V269 WeakPolarHBondContact O-CG2 3.41Å; A264-I439 HydrophobicContact CB-CB 4.12Å; A264-I439 HydrophobicContact CB-CD1 3.99Å; A264-I439 HydrophobicContact CB-CG2 4Å
265	T	87.4	Confident	81.2	Confident	17 Å²	17	28.7 Å²	28.7	10%	0.104	16%	0.162	C	C	.	.	T	Hydrogen-bonded Turn	trans	-92.8	1.2	176.3	54.7	0	0	0	0	113.1	S261 A262 I263 P440 F632	S261-T265 WeakPolarHBondContact O-CG2 3.32Å; S261-T265 PolarHBondContact O-N 2.71Å; S261-T265 PolarHBondContact O-OG1 2.92Å; A262-T265 PolarHBondContact O-N 3.25Å; A262-T265 PolarHBondContact O-OG1 2.99Å; I263-T265 VanDerWaalsContact C-N 3.27Å; I263-T265 PolarHBondContact O-N 2.93Å; T265-P440 HydrophobicContact CG2-CG 4.08Å; T265-F632 HydrophobicContact CG2-CB 4.29Å
266	N	83.7	Confident	80.4	Confident	15 Å²	15	29.8 Å²	29.8	8%	0.08	17%	0.165	C	C	.	.	S	Bend	trans	-92.1	102.8	177.9	-170.2	40.8	0	0	0	110.8	A262 I263 S281 G627 W628 R629	A262-N266 PolarHBondContact O-N 2.91Å; I263-N266 WeakPolarHBondContact O-CB 3.44Å; I263-N266 PolarHBondContact O-N 3.27Å; N266-S281 PolarHBondContact ND2-OG 2.93Å; N266-G627 PolarHBondContact ND2-O 3.47Å; N266-G627 PolarHBondContact OD1-O 3Å; N266-G627 VanDerWaalsContact OD1-O 3.07Å; N266-W628 HydrophobicContact CB-CE3 4.47Å; N266-W628 HydrophobicContact CB-CZ3 4.37Å; N266-R629 PolarHBondContact OD1-N 3.18Å
267	G	74	Confident	79.7	Confident	44 Å²	44	30.3 Å²	30.3	45%	0.454	17%	0.168	S	C	.	.	S	Bend	trans	74.3	-172	175.4	0	0	0	0	0	115.2	V269 Q436	G267-V269 PolarHBondContact O-N 3.33Å; G267-Q436 PolarHBondContact O-NE2 3.39Å
268	F	65.5	Low	79.3	Confident	165 Å²	165	30.9 Å²	30.9	72%	0.724	17%	0.171	S	C	*	.			trans	-77.1	114.3	-177	-74.7	-80.2	0	0	0	111.8	R270	F268-R270 PolarHBondContact O-N 3.28Å; F268-R270 VanDerWaalsContact O-N 3.16Å
269	V	65.6	Low	78.6	Confident	25 Å²	25	29.5 Å²	29.5	15%	0.152	16%	0.164	C	C	.	.			trans	-79.7	96.4	172.9	-178.2	0	0	0	0	109	A264 G267 L277 P435 Q436	A264-V269 VanDerWaalsContact O-CG2 3.24Å; A264-V269 WeakPolarHBondContact O-CG2 3.41Å; G267-V269 PolarHBondContact O-N 3.33Å; V269-L277 HydrophobicContact CB-CD2 3.89Å; V269-L277 HydrophobicContact CG1-CD1 4.3Å; V269-L277 HydrophobicContact CG1-CD2 3.39Å; V269-L277 HydrophobicContact CG1-CG 4.08Å; V269-L277 HydrophobicContact CG2-CD2 3.46Å; V269-L277 VanDerWaalsContact CG2-CD2 3.46Å; V269-P435 HydrophobicContact CB-CB 4.08Å; V269-P435 HydrophobicContact CB-CG 3.51Å; V269-P435 HydrophobicContact CG1-CB 3.67Å; V269-P435 HydrophobicContact CG1-CG 3.51Å; V269-P435 HydrophobicContact CG2-CG 4.23Å; V269-Q436 HydrophobicContact CG2-CG 4.06Å
270	R	58.7	Low	77.9	Confident	177 Å²	177	34.6 Å²	34.6	67%	0.668	18%	0.183	S	C	*	.			trans	-85.5	156.1	166.2	-69	-173.7	177.5	-178.9	-0.2	110	F268 G272 Y276	F268-R270 PolarHBondContact O-N 3.28Å; F268-R270 VanDerWaalsContact O-N 3.16Å; R270-G272 PolarHBondContact O-N 3.02Å; R270-Y276 HydrophobicContact CB-CE1 4Å; R270-Y276 WeakPolarHBondContact O-CD1 3.4Å; R270-Y276 WeakPolarHBondContact O-CE1 3.45Å
271	G	59.4	Low	77.3	Confident	60 Å²	60	34.8 Å²	34.8	62%	0.619	19%	0.185	S	C	*	.	S	Bend	trans	-64.5	105	-175	0	0	0	0	0	113.1
272	G	64.9	Low	76.7	Confident	5 Å²	5	34.9 Å²	34.9	5%	0.052	19%	0.185	C	C	.	.			trans	-155.8	6.2	-179.6	0	0	0	0	0	115.8	R270 Y276 Q551	R270-G272 PolarHBondContact O-N 3.02Å; G272-Y276 VanDerWaalsContact C-CB 3.42Å; G272-Y276 WeakPolarHBondContact O-CB 3.48Å; G272-Q551 VanDerWaalsContact CA-NE2 3.34Å; G272-Q551 PolarHBondContact O-NE2 3.2Å; G272-Q551 VanDerWaalsContact O-NE2 3.16Å
273	G	75.9	Confident	76.1	Confident	11 Å²	11	35 Å²	35	11%	0.113	19%	0.186	C	C	.	.	H	α-helix	trans	76.7	-169.1	-179.3	0	0	0	0	0	114.1	L277 A426 N427 S429	G273-L277 PolarHBondContact O-N 3.31Å; G273-A426 CarbonylContact C-O 3.28Å; G273-N427 WeakPolarHBondContact CA-O 3.43Å; G273-S429 WeakPolarHBondContact CA-OG 3.45Å; G273-S429 PolarHBondContact N-OG 2.84Å; G273-S429 PolarHBondContact O-OG 3.41Å
274	A	74.9	Confident	75.5	Confident	4 Å²	4	35 Å²	35	3%	0.033	19%	0.186	C	C	.	.	H	α-helix	trans	-70.6	-38.9	-173.5	0	0	0	0	0	112.1	Y276 L277 I278 A426 N427	A274-Y276 PolarHBondContact O-N 3.02Å; A274-L277 WeakPolarHBondContact O-CB 3.48Å; A274-L277 PolarHBondContact O-N 3.04Å; A274-I278 WeakPolarHBondContact O-CD1 3.06Å; A274-I278 WeakPolarHBondContact O-CG1 3.35Å; A274-I278 PolarHBondContact O-N 2.94Å; A274-A426 WeakPolarHBondContact CA-O 3.35Å; A274-A426 HydrophobicContact CB-CB 3.71Å; A274-A426 PolarHBondContact N-O 3.02Å; A274-N427 WeakPolarHBondContact CB-OD1 3.22Å
275	Y	80.6	Confident	75.3	Confident	11 Å²	11	35.3 Å²	35.3	4%	0.043	19%	0.188	C	C	.	.	H	α-helix	trans	-63.6	-43.2	177.5	167	-89.9	0	0	0	112.1	L277 I278 S279 G287 A552 D556 I558	Y275-L277 VanDerWaalsContact C-N 3.25Å; Y275-L277 PolarHBondContact O-N 3.12Å; Y275-I278 PolarHBondContact O-N 3.04Å; Y275-I278 VanDerWaalsContact O-N 3.13Å; Y275-S279 VanDerWaalsContact CE1-OG 3.31Å; Y275-S279 WeakPolarHBondContact CE1-OG 3.33Å; Y275-S279 WeakPolarHBondContact O-CB 3.29Å; Y275-S279 PolarHBondContact O-N 3.33Å; Y275-S279 PolarHBondContact O-OG 3.5Å; Y275-G287 VanDerWaalsContact CE2-C 3.5Å; Y275-G287 VanDerWaalsContact CE2-O 3.25Å; Y275-G287 WeakPolarHBondContact CE2-O 3.38Å; Y275-A552 HydrophobicContact CD1-CB 3.46Å; Y275-A552 VanDerWaalsContact CD1-CB 3.46Å; Y275-A552 HydrophobicContact CD2-CB 3.17Å; Y275-A552 HydrophobicContact CE1-CB 3.77Å; Y275-A552 HydrophobicContact CE2-CB 3.41Å; Y275-A552 VanDerWaalsContact CE2-CB 3.41Å; Y275-A552 HydrophobicContact CG-CB 3.14Å; Y275-A552 VanDerWaalsContact CZ-CA 3.49Å; Y275-A552 PolarHBondContact OH-O 2.85Å; Y275-D556 VanDerWaalsContact CE1-OD2 3.27Å; Y275-D556 WeakPolarHBondContact CE1-OD2 3.48Å; Y275-D556 PolarHBondContact OH-OD2 2.98Å; Y275-I558 VanDerWaalsContact OH-CD1 3.22Å; Y275-I558 WeakPolarHBondContact OH-CD1 3.47Å
276	Y	78.2	Confident	75.1	Confident	45 Å²	45	35 Å²	35	18%	0.176	19%	0.185	C	C	.	.	H	α-helix	trans	-61.1	-39.6	-180	179.6	-95.4	0	0	0	111.3	R270 G272 A274 S279 R280	R270-Y276 HydrophobicContact CB-CE1 4Å; R270-Y276 WeakPolarHBondContact O-CD1 3.4Å; R270-Y276 WeakPolarHBondContact O-CE1 3.45Å; G272-Y276 VanDerWaalsContact C-CB 3.42Å; G272-Y276 WeakPolarHBondContact O-CB 3.48Å; A274-Y276 PolarHBondContact O-N 3.02Å; Y276-S279 PolarHBondContact O-OG 3.4Å; Y276-R280 HydrophobicContact CE1-CG 4.49Å; Y276-R280 HydrophobicContact CE2-CG 4.28Å; Y276-R280 WeakPolarHBondContact O-CB 3.4Å; Y276-R280 PolarHBondContact O-N 3.5Å; Y276-R280 VanDerWaalsContact O-N 3.16Å; Y276-R280 PolarHBondContact OH-NE 3.22Å; Y276-R280 PolarHBondContact OH-NH1 3.21Å; Y276-R280 PolarHBondContact OH-NH2 3.07Å
277	L	78.4	Confident	75.1	Confident	11 Å²	11	34.2 Å²	34.2	6%	0.058	18%	0.181	C	C	.	.	H	α-helix	trans	-59.5	-47.5	172.2	-80.1	172.2	0	0	0	112.4	I263 V269 G273 A274 Y275 S281 A426 I439	I263-L277 HydrophobicContact CG2-CB 4.41Å; I263-L277 WeakPolarHBondContact CG2-O 3.21Å; V269-L277 HydrophobicContact CB-CD2 3.89Å; V269-L277 HydrophobicContact CG1-CD1 4.3Å; V269-L277 HydrophobicContact CG1-CD2 3.39Å; V269-L277 HydrophobicContact CG1-CG 4.08Å; V269-L277 HydrophobicContact CG2-CD2 3.46Å; V269-L277 VanDerWaalsContact CG2-CD2 3.46Å; G273-L277 PolarHBondContact O-N 3.31Å; A274-L277 WeakPolarHBondContact O-CB 3.48Å; A274-L277 PolarHBondContact O-N 3.04Å; Y275-L277 VanDerWaalsContact C-N 3.25Å; Y275-L277 PolarHBondContact O-N 3.12Å; L277-S281 WeakPolarHBondContact O-CB 3.33Å; L277-S281 PolarHBondContact O-N 3.12Å; L277-S281 PolarHBondContact O-OG 3.47Å; L277-A426 HydrophobicContact CD1-CB 4.43Å; L277-I439 HydrophobicContact CD1-CD1 3.93Å
278	I	83.4	Confident	75.5	Confident	12 Å²	12	32.1 Å²	32.1	6%	0.062	16%	0.159	C	C	.	.	H	α-helix	trans	-68.3	-50.7	-177.6	-67.1	166	0	0	0	110.8	I263 A274 Y275 R280 S281 L282 I290	I263-I278 HydrophobicContact CD1-CG1 4.48Å; A274-I278 WeakPolarHBondContact O-CD1 3.06Å; A274-I278 WeakPolarHBondContact O-CG1 3.35Å; A274-I278 PolarHBondContact O-N 2.94Å; Y275-I278 PolarHBondContact O-N 3.04Å; Y275-I278 VanDerWaalsContact O-N 3.13Å; I278-R280 PolarHBondContact O-N 3.02Å; I278-S281 PolarHBondContact O-N 3.45Å; I278-L282 HydrophobicContact CG2-CD1 3.88Å; I278-L282 WeakPolarHBondContact O-CB 3.4Å; I278-L282 PolarHBondContact O-N 3.48Å; I278-I290 HydrophobicContact CD1-CG2 4.15Å; I278-I290 HydrophobicContact CG2-CB 4.4Å; I278-I290 HydrophobicContact CG2-CD1 3.87Å; I278-I290 HydrophobicContact CG2-CG2 4.31Å
279	S	79.6	Confident	76.5	Confident	1 Å²	1	24.4 Å²	24.4	1%	0.007	13%	0.126	C	C	.	.	H	α-helix	trans	-65.7	-36	-175.6	56.1	0	0	0	0	113.5	Y275 Y276 G283	Y275-S279 VanDerWaalsContact CE1-OG 3.31Å; Y275-S279 WeakPolarHBondContact CE1-OG 3.33Å; Y275-S279 WeakPolarHBondContact O-CB 3.29Å; Y275-S279 PolarHBondContact O-N 3.33Å; Y275-S279 PolarHBondContact O-OG 3.5Å; Y276-S279 PolarHBondContact O-OG 3.4Å; S279-G283 CarbonylContact O-C 3.57Å; S279-G283 VanDerWaalsContact O-C 3.26Å; S279-G283 WeakPolarHBondContact O-CA 3.42Å; S279-G283 PolarHBondContact O-N 3.09Å
280	R	77.3	Confident	77.6	Confident	109 Å²	109	23.3 Å²	23.3	41%	0.411	12%	0.119	S	C	.	.	H	α-helix	trans	-74.5	-35.6	176.1	-77.7	-146.1	166.2	-169.1	-2	113.8	Y276 I278 W682	Y276-R280 HydrophobicContact CE1-CG 4.49Å; Y276-R280 HydrophobicContact CE2-CG 4.28Å; Y276-R280 WeakPolarHBondContact O-CB 3.4Å; Y276-R280 PolarHBondContact O-N 3.5Å; Y276-R280 VanDerWaalsContact O-N 3.16Å; Y276-R280 PolarHBondContact OH-NE 3.22Å; Y276-R280 PolarHBondContact OH-NH1 3.21Å; Y276-R280 PolarHBondContact OH-NH2 3.07Å; I278-R280 PolarHBondContact O-N 3.02Å; R280-W682 HydrophobicContact CG-CB 4.47Å; R280-W682 HydrophobicContact CG-CG 4.21Å
281	S	78.8	Confident	78.9	Confident	13 Å²	13	15 Å²	15	9%	0.091	9%	0.089	C	C	.	.	H	α-helix	trans	-79.3	-33.5	-179.4	-72.1	0	0	0	0	113	I263 N266 L277 I278	I263-S281 PolarHBondContact O-OG 2.92Å; N266-S281 PolarHBondContact ND2-OG 2.93Å; L277-S281 WeakPolarHBondContact O-CB 3.33Å; L277-S281 PolarHBondContact O-N 3.12Å; L277-S281 PolarHBondContact O-OG 3.47Å; I278-S281 PolarHBondContact O-N 3.45Å
282	L	77.3	Confident	80.2	Confident	2 Å²	2	14.5 Å²	14.5	1%	0.01	7%	0.072	C	C	.	.	H	α-helix	trans	-111.6	-13.5	-171.3	-59.7	166	0	0	0	113.5	I263 I278 F286 S616 V617 A620 W628 S685	I263-L282 HydrophobicContact CD1-CD1 3.86Å; I263-L282 HydrophobicContact CG1-CD1 4.36Å; I278-L282 HydrophobicContact CG2-CD1 3.88Å; I278-L282 WeakPolarHBondContact O-CB 3.4Å; I278-L282 PolarHBondContact O-N 3.48Å; L282-F286 HydrophobicContact CB-CB 4.11Å; L282-S616 VanDerWaalsContact CD1-OG 3.29Å; L282-S616 WeakPolarHBondContact CD1-OG 3.36Å; L282-V617 HydrophobicContact CD2-CG2 4.17Å; L282-A620 HydrophobicContact CD2-CB 3.97Å; L282-W628 HydrophobicContact CD2-CE3 4.34Å; L282-W628 HydrophobicContact CD2-CZ3 3.96Å; L282-S685 WeakPolarHBondContact O-CB 3.47Å; L282-S685 PolarHBondContact O-OG 3.38Å
283	G	77.1	Confident	81.3	Confident	2 Å²	2	14.7 Å²	14.7	2%	0.021	7%	0.071	C	C	.	.			trans	94.8	168.9	-176.3	0	0	0	0	0	113.6	S279 E285 G287	S279-G283 CarbonylContact O-C 3.57Å; S279-G283 VanDerWaalsContact O-C 3.26Å; S279-G283 WeakPolarHBondContact O-CA 3.42Å; S279-G283 PolarHBondContact O-N 3.09Å; G283-E285 VanDerWaalsContact C-N 3.32Å; G283-E285 PolarHBondContact O-N 3.42Å; G283-G287 PolarHBondContact O-N 2.68Å
284	P	78.2	Confident	81.9	Confident	4 Å²	4	14.7 Å²	14.7	3%	0.026	7%	0.068	C	C	.	.	H	α-helix	trans	-67.3	-28.2	-175.4	26.8	-35.1	0	0	0	113.8	G288 I558 P678 V680	P284-G288 PolarHBondContact O-N 3.3Å; P284-I558 HydrophobicContact CB-CD1 4.44Å; P284-P678 HydrophobicContact CB-CG 4.5Å; P284-V680 HydrophobicContact CB-CG2 4.02Å; P284-V680 HydrophobicContact CG-CG2 3.76Å
285	E	81.5	Confident	82.5	Confident	9 Å²	9	14.8 Å²	14.8	4%	0.042	7%	0.069	C	C	.	.	H	α-helix	trans	-63.6	-52.9	-178.6	-61.6	173.7	-161.3	0	0	112.1	G283 S289 Y670 V673 T686	G283-E285 VanDerWaalsContact C-N 3.32Å; G283-E285 PolarHBondContact O-N 3.42Å; E285-S289 PolarHBondContact O-OG 3.05Å; E285-Y670 HydrophobicContact CB-CD2 4.21Å; E285-Y670 HydrophobicContact CB-CE2 3.78Å; E285-Y670 PolarHBondContact OE2-OH 3.24Å; E285-V673 HydrophobicContact CB-CG1 4.4Å; E285-V673 HydrophobicContact CG-CG1 4.18Å; E285-T686 WeakPolarHBondContact OE1-CG2 3.31Å; E285-T686 PolarHBondContact OE1-OG1 3.05Å; E285-T686 WeakPolarHBondContact OE2-CG2 3.27Å
286	F	83.4	Confident	82.9	Confident	9 Å²	9	17.3 Å²	17.3	4%	0.039	8%	0.08	C	C	.	.	H	α-helix	trans	-74.4	-42.2	175.8	-70	-69.5	0	0	0	111.4	L282 G288 S289 I290 F615 H619 Y670	L282-F286 HydrophobicContact CB-CB 4.11Å; F286-G288 PolarHBondContact O-N 3.23Å; F286-S289 PolarHBondContact O-N 3.3Å; F286-I290 HydrophobicContact CB-CD1 4.24Å; F286-I290 WeakPolarHBondContact O-CB 3.41Å; F286-I290 WeakPolarHBondContact O-CD1 3.44Å; F286-I290 WeakPolarHBondContact O-CG1 3.2Å; F286-I290 PolarHBondContact O-N 3.45Å; F286-F615 HydrophobicContact CE1-CD1 4.16Å; F286-F615 HydrophobicContact CE1-CE1 4.24Å; F286-F615 HydrophobicContact CZ-CE1 4.45Å; F286-H619 AromaticContact CE2-ND1 3.84Å; F286-H619 HydrophobicContact CZ-CB 4.5Å; F286-Y670 HydrophobicContact CD1-CD2 4.48Å; F286-Y670 HydrophobicContact CD1-CE2 4.32Å; F286-Y670 HydrophobicContact CE1-CD2 4.33Å; F286-Y670 AromaticContact CE1-CE2 3.95Å; F286-Y670 HydrophobicContact CE1-CE2 3.95Å; F286-Y670 HydrophobicContact CE2-CE2 4.24Å; F286-Y670 AromaticContact CZ-CE2 3.9Å; F286-Y670 HydrophobicContact CZ-CE2 3.9Å
287	G	83.3	Confident	83.5	Confident	0 Å²	0	15.2 Å²	15.2	0%	0	7%	0.072	C	C	.	.	H	α-helix	trans	-56.9	-49.8	179.8	0	0	0	0	0	112.8	Y275 G283 S289 G291	Y275-G287 VanDerWaalsContact CE2-C 3.5Å; Y275-G287 VanDerWaalsContact CE2-O 3.25Å; Y275-G287 WeakPolarHBondContact CE2-O 3.38Å; G283-G287 PolarHBondContact O-N 2.68Å; G287-S289 PolarHBondContact O-N 3.13Å; G287-G291 PolarHBondContact O-N 2.96Å
288	G	82.7	Confident	83.9	Confident	0 Å²	0	14.8 Å²	14.8	0%	0	7%	0.07	C	C	.	.	H	α-helix	trans	-64.3	-40.5	-179	0	0	0	0	0	113.1	P284 F286 L292 L553	P284-G288 PolarHBondContact O-N 3.3Å; F286-G288 PolarHBondContact O-N 3.23Å; G288-L292 WeakPolarHBondContact O-CB 3.48Å; G288-L292 PolarHBondContact O-N 3.11Å; G288-L292 VanDerWaalsContact O-N 3.16Å; G288-L553 WeakPolarHBondContact O-CD2 3.38Å
289	S	86.6	Confident	84.3	Confident	2 Å²	2	14.3 Å²	14.3	1%	0.014	7%	0.068	C	C	.	.	H	α-helix	trans	-69.1	-47.7	178.8	-54	0	0	0	0	111.6	E285 F286 G287 G291 L292 I293	E285-S289 PolarHBondContact O-OG 3.05Å; F286-S289 PolarHBondContact O-N 3.3Å; G287-S289 PolarHBondContact O-N 3.13Å; S289-G291 PolarHBondContact O-N 3.15Å; S289-L292 PolarHBondContact O-N 3.09Å; S289-I293 WeakPolarHBondContact O-CD1 3.31Å; S289-I293 WeakPolarHBondContact O-CG1 3.26Å; S289-I293 PolarHBondContact O-N 3.45Å
290	I	88.6	Confident	84.8	Confident	2 Å²	2	14.3 Å²	14.3	1%	0.01	7%	0.067	C	C	.	.	H	α-helix	trans	-62.2	-44.8	177.4	-66.5	165.1	0	0	0	110.4	I278 F286 L292 F294 L612 I613	I278-I290 HydrophobicContact CD1-CG2 4.15Å; I278-I290 HydrophobicContact CG2-CB 4.4Å; I278-I290 HydrophobicContact CG2-CD1 3.87Å; I278-I290 HydrophobicContact CG2-CG2 4.31Å; F286-I290 HydrophobicContact CB-CD1 4.24Å; F286-I290 WeakPolarHBondContact O-CB 3.41Å; F286-I290 WeakPolarHBondContact O-CD1 3.44Å; F286-I290 WeakPolarHBondContact O-CG1 3.2Å; F286-I290 PolarHBondContact O-N 3.45Å; I290-L292 PolarHBondContact O-N 2.96Å; I290-F294 WeakPolarHBondContact O-CB 3.47Å; I290-F294 PolarHBondContact O-N 3.46Å; I290-L612 HydrophobicContact CD1-CB 4.25Å; I290-L612 HydrophobicContact CG1-CB 3.71Å; I290-L612 HydrophobicContact CG1-CD1 4.27Å; I290-I613 HydrophobicContact CD1-CG1 4.06Å; I290-I613 HydrophobicContact CG1-CG1 4.49Å; I290-I613 HydrophobicContact CG2-CD1 4.17Å; I290-I613 HydrophobicContact CG2-CG1 3.89Å
291	G	86.3	Confident	85.4	Confident	4 Å²	4	9.1 Å²	9.1	4%	0.041	5%	0.048	C	C	.	.	H	α-helix	trans	-62.1	-41.4	-178.7	0	0	0	0	0	113.5	G287 S289 A295 V548	G287-G291 PolarHBondContact O-N 2.96Å; S289-G291 PolarHBondContact O-N 3.15Å; G291-A295 VanDerWaalsContact O-CB 3.28Å; G291-A295 WeakPolarHBondContact O-CB 3.42Å; G291-A295 PolarHBondContact O-N 3.42Å; G291-V548 WeakPolarHBondContact O-CG1 3.38Å
292	L	86.4	Confident	85.9	Confident	49 Å²	49	8.5 Å²	8.5	26%	0.257	4%	0.044	S	C	.	.	H	α-helix	trans	-67.9	-47.5	179.1	-168.2	155.1	0	0	0	111.9	G288 S289 I290 F294 A295 F296 L553 Y559 L669	G288-L292 WeakPolarHBondContact O-CB 3.48Å; G288-L292 PolarHBondContact O-N 3.11Å; G288-L292 VanDerWaalsContact O-N 3.16Å; S289-L292 PolarHBondContact O-N 3.09Å; I290-L292 PolarHBondContact O-N 2.96Å; L292-F294 VanDerWaalsContact C-N 3.34Å; L292-F294 PolarHBondContact O-N 3.17Å; L292-A295 PolarHBondContact O-N 2.88Å; L292-F296 PolarHBondContact O-N 2.64Å; L292-L553 HydrophobicContact CB-CD1 3.88Å; L292-L553 HydrophobicContact CB-CD2 4.04Å; L292-L553 HydrophobicContact CD1-CD1 4.42Å; L292-L553 HydrophobicContact CG-CD1 4.14Å; L292-Y559 HydrophobicContact CD1-CE2 4.18Å; L292-L669 HydrophobicContact CD1-CD1 4.3Å; L292-L669 HydrophobicContact CD1-CD2 4.3Å; L292-L669 HydrophobicContact CD2-CD1 4.02Å
293	I	89.1	Confident	86.6	Confident	9 Å²	9	8.4 Å²	8.4	5%	0.046	4%	0.043	C	C	.	.	H	α-helix	trans	-64.9	-42.1	179.3	-65.1	163	0	0	0	110.4	S289 F296 A297 F605 L612 V666	S289-I293 WeakPolarHBondContact O-CD1 3.31Å; S289-I293 WeakPolarHBondContact O-CG1 3.26Å; S289-I293 PolarHBondContact O-N 3.45Å; I293-F296 PolarHBondContact O-N 3.44Å; I293-A297 WeakPolarHBondContact O-CB 3.42Å; I293-A297 PolarHBondContact O-N 2.93Å; I293-F605 HydrophobicContact CG2-CD1 4.44Å; I293-L612 HydrophobicContact CD1-CD1 3.57Å; I293-V666 HydrophobicContact CD1-CB 4.23Å; I293-V666 HydrophobicContact CD1-CG1 4.38Å; I293-V666 HydrophobicContact CD1-CG2 3.3Å; I293-V666 HydrophobicContact CG1-CG2 4.47Å
294	F	87.7	Confident	87.1	Confident	11 Å²	11	8.4 Å²	8.4	5%	0.048	4%	0.043	C	C	.	.	H	α-helix	trans	-66.4	-39.7	178.3	-175.6	-109.9	0	0	0	112.4	I290 L292 A297 N298 L423 V548 F606	I290-F294 WeakPolarHBondContact O-CB 3.47Å; I290-F294 PolarHBondContact O-N 3.46Å; L292-F294 VanDerWaalsContact C-N 3.34Å; L292-F294 PolarHBondContact O-N 3.17Å; F294-A297 PolarHBondContact O-N 2.96Å; F294-N298 WeakPolarHBondContact CD1-ND2 3.2Å; F294-N298 WeakPolarHBondContact CE1-ND2 3.43Å; F294-N298 WeakPolarHBondContact CZ-ND2 3.25Å; F294-N298 PolarHBondContact O-N 3.38Å; F294-N298 PolarHBondContact O-ND2 3.43Å; F294-N298 VanDerWaalsContact O-ND2 3.16Å; F294-L423 HydrophobicContact CD2-CD1 3.83Å; F294-L423 HydrophobicContact CE1-CB 4.48Å; F294-L423 HydrophobicContact CE2-CB 4Å; F294-L423 HydrophobicContact CE2-CD1 3.45Å; F294-L423 VanDerWaalsContact CE2-CD1 3.45Å; F294-L423 HydrophobicContact CE2-CG 4.35Å; F294-L423 HydrophobicContact CZ-CB 3.67Å; F294-L423 HydrophobicContact CZ-CD1 3.87Å; F294-L423 HydrophobicContact CZ-CG 4.43Å; F294-V548 HydrophobicContact CD1-CG1 4.31Å; F294-V548 HydrophobicContact CD1-CG2 4.07Å; F294-V548 HydrophobicContact CE1-CG2 4.1Å; F294-F606 HydrophobicContact CD2-CD1 4.48Å; F294-F606 HydrophobicContact CD2-CE1 4.05Å; F294-F606 HydrophobicContact CE2-CD1 4.47Å; F294-F606 AromaticContact CE2-CE1 3.81Å; F294-F606 HydrophobicContact CE2-CE1 3.81Å
295	A	88.1	Confident	87.6	Confident	5 Å²	5	8.4 Å²	8.4	4%	0.041	4%	0.042	C	C	.	.	H	α-helix	trans	-63	-42.3	174.1	0	0	0	0	0	111.7	G291 L292 A299 V548 F549	G291-A295 VanDerWaalsContact O-CB 3.28Å; G291-A295 WeakPolarHBondContact O-CB 3.42Å; G291-A295 PolarHBondContact O-N 3.42Å; L292-A295 PolarHBondContact O-N 2.88Å; A295-A299 PolarHBondContact O-N 3.28Å; A295-V548 HydrophobicContact CB-CB 4.34Å; A295-V548 HydrophobicContact CB-CG1 4.04Å; A295-F549 HydrophobicContact CB-CB 4.34Å; A295-F549 HydrophobicContact CB-CD2 4.35Å
296	F	89.3	Confident	88	Confident	65 Å²	65	8 Å²	8	29%	0.285	4%	0.041	S	C	.	.	H	α-helix	trans	-64.1	-45.9	175.4	-172.3	-96.9	0	0	0	111.8	L292 I293 N298 A299 V300 I585 F589 F605	L292-F296 PolarHBondContact O-N 2.64Å; I293-F296 PolarHBondContact O-N 3.44Å; F296-N298 VanDerWaalsContact C-N 3.34Å; F296-N298 PolarHBondContact O-N 3.19Å; F296-A299 WeakPolarHBondContact O-CB 3.37Å; F296-A299 PolarHBondContact O-N 2.86Å; F296-A299 VanDerWaalsContact O-N 3.1Å; F296-V300 HydrophobicContact CD1-CG2 4.09Å; F296-V300 HydrophobicContact CE1-CG2 3.64Å; F296-V300 HydrophobicContact CE2-CG2 4.48Å; F296-V300 HydrophobicContact CZ-CG2 3.87Å; F296-V300 WeakPolarHBondContact O-CG2 3.41Å; F296-V300 PolarHBondContact O-N 3.2Å; F296-I585 HydrophobicContact CD2-CD1 4.35Å; F296-I585 HydrophobicContact CE2-CD1 4.42Å; F296-I585 HydrophobicContact CE2-CG2 4.23Å; F296-F589 HydrophobicContact CZ-CE2 4.3Å; F296-F589 HydrophobicContact CZ-CZ 4.48Å; F296-F605 AromaticContact CD1-CD1 3.99Å; F296-F605 HydrophobicContact CD1-CD1 3.99Å; F296-F605 HydrophobicContact CD1-CD2 4.02Å; F296-F605 AromaticContact CD1-CE1 3.86Å; F296-F605 HydrophobicContact CD1-CE1 3.86Å; F296-F605 AromaticContact CD1-CE2 3.94Å; F296-F605 HydrophobicContact CD1-CE2 3.94Å; F296-F605 HydrophobicContact CD1-CG 4.08Å; F296-F605 AromaticContact CD1-CZ 3.86Å; F296-F605 HydrophobicContact CD1-CZ 3.86Å; F296-F605 HydrophobicContact CE1-CD1 4.39Å; F296-F605 AromaticContact CE1-CD2 3.89Å; F296-F605 HydrophobicContact CE1-CD2 3.89Å; F296-F605 AromaticContact CE1-CE1 3.93Å; F296-F605 HydrophobicContact CE1-CE1 3.93Å; F296-F605 AromaticContact CE1-CE2 3.41Å; F296-F605 HydrophobicContact CE1-CE2 3.41Å; F296-F605 VanDerWaalsContact CE1-CE2 3.41Å; F296-F605 HydrophobicContact CE1-CG 4.38Å; F296-F605 AromaticContact CE1-CZ 3.43Å; F296-F605 HydrophobicContact CE1-CZ 3.43Å; F296-F605 VanDerWaalsContact CE1-CZ 3.43Å; F296-F605 HydrophobicContact CZ-CZ 4.45Å
297	A	89.7	Confident	88.3	Confident	0 Å²	0	7.6 Å²	7.6	0%	0	4%	0.039	C	C	.	.	H	α-helix	trans	-57.2	-45.8	177.2	0	0	0	0	0	112	I293 F294 A299 V300 A301 F605 F606	I293-A297 WeakPolarHBondContact O-CB 3.42Å; I293-A297 PolarHBondContact O-N 2.93Å; F294-A297 PolarHBondContact O-N 2.96Å; A297-A299 VanDerWaalsContact C-N 3.34Å; A297-A299 PolarHBondContact O-N 2.73Å; A297-V300 PolarHBondContact O-N 2.97Å; A297-A301 WeakPolarHBondContact O-CB 3.36Å; A297-A301 PolarHBondContact O-N 3.25Å; A297-F605 HydrophobicContact CB-CB 3.86Å; A297-F606 HydrophobicContact CB-CD1 4.11Å; A297-F606 HydrophobicContact CB-CD2 4.14Å; A297-F606 HydrophobicContact CB-CE1 3.93Å; A297-F606 HydrophobicContact CB-CE2 3.98Å; A297-F606 HydrophobicContact CB-CG 4.21Å; A297-F606 HydrophobicContact CB-CZ 3.87Å
298	N	88.4	Confident	88.4	Confident	3 Å²	3	7.6 Å²	7.6	2%	0.016	4%	0.039	C	C	.	.	H	α-helix	trans	-65.6	-35.6	176.4	-70.9	-33	0	0	0	112.3	F294 F296 A301 V302 A545 F606	F294-N298 WeakPolarHBondContact CD1-ND2 3.2Å; F294-N298 WeakPolarHBondContact CE1-ND2 3.43Å; F294-N298 WeakPolarHBondContact CZ-ND2 3.25Å; F294-N298 PolarHBondContact O-N 3.38Å; F294-N298 PolarHBondContact O-ND2 3.43Å; F294-N298 VanDerWaalsContact O-ND2 3.16Å; F296-N298 VanDerWaalsContact C-N 3.34Å; F296-N298 PolarHBondContact O-N 3.19Å; N298-A301 PolarHBondContact O-N 3.17Å; N298-V302 WeakPolarHBondContact O-CG2 3.34Å; N298-V302 PolarHBondContact O-N 3.28Å; N298-A545 HydrophobicContact CB-CB 3.83Å; N298-F606 WeakPolarHBondContact OD1-CZ 3.48Å
299	A	90.8	Very high	88.6	Confident	2 Å²	2	8.9 Å²	8.9	2%	0.017	4%	0.044	C	C	.	.	H	α-helix	trans	-65.2	-41.2	176.1	0	0	0	0	0	112.3	A295 F296 A297 A545 T582 I585	A295-A299 PolarHBondContact O-N 3.28Å; F296-A299 WeakPolarHBondContact O-CB 3.37Å; F296-A299 PolarHBondContact O-N 2.86Å; F296-A299 VanDerWaalsContact O-N 3.1Å; A297-A299 VanDerWaalsContact C-N 3.34Å; A297-A299 PolarHBondContact O-N 2.73Å; A299-A545 HydrophobicContact CB-CB 4.38Å; A299-T582 HydrophobicContact CB-CG2 3.87Å; A299-I585 HydrophobicContact CB-CB 4.31Å; A299-I585 HydrophobicContact CB-CD1 4.34Å; A299-I585 HydrophobicContact CB-CG2 4.03Å
300	V	91	Very high	88.8	Confident	0 Å²	0	8.8 Å²	8.8	0%	0	4%	0.044	C	C	.	.	H	α-helix	trans	-70.9	-35.1	174.8	-174.1	0	0	0	0	111.1	F296 A297 V302 A303 M304 I585 F589 I598 I602	F296-V300 HydrophobicContact CD1-CG2 4.09Å; F296-V300 HydrophobicContact CE1-CG2 3.64Å; F296-V300 HydrophobicContact CE2-CG2 4.48Å; F296-V300 HydrophobicContact CZ-CG2 3.87Å; F296-V300 WeakPolarHBondContact O-CG2 3.41Å; F296-V300 PolarHBondContact O-N 3.2Å; A297-V300 PolarHBondContact O-N 2.97Å; V300-V302 VanDerWaalsContact C-N 3.27Å; V300-V302 PolarHBondContact O-N 3.48Å; V300-A303 WeakPolarHBondContact O-CB 3.49Å; V300-A303 PolarHBondContact O-N 3.04Å; V300-M304 PolarHBondContact O-N 2.73Å; V300-I585 HydrophobicContact CG2-CG2 4.24Å; V300-F589 HydrophobicContact CB-CD2 4.48Å; V300-F589 HydrophobicContact CB-CE2 4.49Å; V300-F589 HydrophobicContact CG1-CD1 3.92Å; V300-F589 HydrophobicContact CG1-CD2 4.07Å; V300-F589 HydrophobicContact CG1-CE1 4.02Å; V300-F589 HydrophobicContact CG1-CE2 4.18Å; V300-F589 HydrophobicContact CG1-CG 3.96Å; V300-F589 HydrophobicContact CG1-CZ 4.15Å; V300-F589 HydrophobicContact CG2-CD2 3.94Å; V300-F589 HydrophobicContact CG2-CE2 3.56Å; V300-F589 HydrophobicContact CG2-CZ 3.95Å; V300-I598 HydrophobicContact CG1-CG2 4.45Å; V300-I602 HydrophobicContact CB-CG1 4.1Å; V300-I602 HydrophobicContact CG1-CD1 4.03Å; V300-I602 HydrophobicContact CG1-CG1 3.51Å
301	A	88.6	Confident	88.6	Confident	1 Å²	1	10.8 Å²	10.8	1%	0.008	5%	0.053	C	C	.	.	H	α-helix	trans	-59.8	-35.4	176.6	0	0	0	0	0	113	A297 N298 A303 M304 Y305 F606	A297-A301 WeakPolarHBondContact O-CB 3.36Å; A297-A301 PolarHBondContact O-N 3.25Å; N298-A301 PolarHBondContact O-N 3.17Å; A301-A303 PolarHBondContact O-N 2.78Å; A301-M304 PolarHBondContact O-N 3.03Å; A301-Y305 HydrophobicContact CB-CE2 4.04Å; A301-Y305 WeakPolarHBondContact O-CD2 3.49Å; A301-Y305 VanDerWaalsContact O-CG 3.28Å; A301-Y305 PolarHBondContact O-N 3.22Å; A301-F606 HydrophobicContact CB-CE2 4.27Å
302	V	90.5	Very high	88.6	Confident	0 Å²	0	10.7 Å²	10.7	0%	0	5%	0.052	C	C	.	.	H	α-helix	trans	-54.2	-44.1	172.4	175.3	0	0	0	0	111	N298 V300 Y305 V306 V339 L542 A586	N298-V302 WeakPolarHBondContact O-CG2 3.34Å; N298-V302 PolarHBondContact O-N 3.28Å; V300-V302 VanDerWaalsContact C-N 3.27Å; V300-V302 PolarHBondContact O-N 3.48Å; V302-Y305 PolarHBondContact O-N 3.16Å; V302-V306 HydrophobicContact CG1-CG2 4.39Å; V302-V306 WeakPolarHBondContact O-CB 3.14Å; V302-V306 VanDerWaalsContact O-CG2 3.27Å; V302-V306 WeakPolarHBondContact O-CG2 3.41Å; V302-V306 PolarHBondContact O-N 2.97Å; V302-V339 HydrophobicContact CG1-CG2 4.35Å; V302-L542 HydrophobicContact CG1-CB 4.48Å; V302-L542 HydrophobicContact CG1-CD1 4.11Å; V302-L542 HydrophobicContact CG2-CB 3.85Å; V302-A586 HydrophobicContact CB-CB 4.11Å; V302-A586 HydrophobicContact CG1-CB 3.91Å
303	A	91.1	Very high	88.6	Confident	0 Å²	0	9.5 Å²	9.5	0%	0	5%	0.046	C	C	.	.	H	α-helix	trans	-64	-45.9	179.9	0	0	0	0	0	111.9	V300 A301 Y305 V306 V307 A586 F589 I590	V300-A303 WeakPolarHBondContact O-CB 3.49Å; V300-A303 PolarHBondContact O-N 3.04Å; A301-A303 PolarHBondContact O-N 2.78Å; A303-Y305 VanDerWaalsContact C-N 3.35Å; A303-Y305 PolarHBondContact O-N 3.18Å; A303-V306 PolarHBondContact O-N 3.22Å; A303-V307 WeakPolarHBondContact O-CB 3.5Å; A303-V307 VanDerWaalsContact O-CG2 3.25Å; A303-V307 WeakPolarHBondContact O-CG2 3.48Å; A303-V307 PolarHBondContact O-N 2.87Å; A303-A586 WeakPolarHBondContact CB-O 3.24Å; A303-F589 HydrophobicContact CB-CB 3.43Å; A303-F589 VanDerWaalsContact CB-CB 3.43Å; A303-I590 HydrophobicContact CB-CG1 3.86Å
304	M	88.3	Confident	88.5	Confident	1 Å²	1	9.3 Å²	9.3	1%	0.005	5%	0.046	C	C	.	.	H	α-helix	trans	-59.1	-45.1	177.9	178	-172.3	-177	0	0	112.3	P224 L228 V300 A301 V307 G308 P417 L595 I598 A599 I602	P224-M304 HydrophobicContact CG-CE 4.3Å; L228-M304 HydrophobicContact CD1-CE 4.38Å; L228-M304 HydrophobicContact CD2-CE 3.82Å; V300-M304 PolarHBondContact O-N 2.73Å; A301-M304 PolarHBondContact O-N 3.03Å; M304-V307 PolarHBondContact O-N 2.93Å; M304-G308 PolarHBondContact O-N 3.17Å; M304-P417 HydrophobicContact CE-CB 3.86Å; M304-P417 HydrophobicContact CE-CG 4.03Å; M304-P417 HydrophobicContact SD-CB 3.74Å; M304-P417 HydrophobicContact SD-CG 4.05Å; M304-L595 HydrophobicContact CB-CD1 4.43Å; M304-L595 HydrophobicContact CE-CD1 4.3Å; M304-L595 HydrophobicContact CG-CD1 3.53Å; M304-I598 HydrophobicContact CB-CG2 4.02Å; M304-A599 HydrophobicContact CE-CB 3.88Å; M304-A599 HydrophobicContact SD-CB 4.44Å; M304-I602 HydrophobicContact CB-CD1 3.27Å; M304-I602 HydrophobicContact CG-CD1 3.89Å; M304-I602 HydrophobicContact SD-CD1 3.53Å; M304-I602 VanDerWaalsContact SD-CD1 3.53Å
305	Y	88.6	Confident	88.3	Confident	4 Å²	4	11 Å²	11	2%	0.016	5%	0.054	C	C	.	.	H	α-helix	trans	-67.4	-37.3	-179.4	-60.9	-31.6	0	0	0	112.5	I223 A301 V302 A303 F309 S537 S541	I223-Y305 HydrophobicContact CB-CD1 4.37Å; I223-Y305 HydrophobicContact CD1-CD1 3.08Å; I223-Y305 HydrophobicContact CD1-CD2 4.33Å; I223-Y305 HydrophobicContact CD1-CE1 3.58Å; I223-Y305 HydrophobicContact CD1-CG 3.5Å; I223-Y305 VanDerWaalsContact CD1-CG 3.5Å; I223-Y305 HydrophobicContact CG1-CD1 4.31Å; I223-Y305 HydrophobicContact CG2-CD1 4.5Å; A301-Y305 HydrophobicContact CB-CE2 4.04Å; A301-Y305 WeakPolarHBondContact O-CD2 3.49Å; A301-Y305 VanDerWaalsContact O-CG 3.28Å; A301-Y305 PolarHBondContact O-N 3.22Å; V302-Y305 PolarHBondContact O-N 3.16Å; A303-Y305 VanDerWaalsContact C-N 3.35Å; A303-Y305 PolarHBondContact O-N 3.18Å; Y305-F309 PolarHBondContact O-N 3.47Å; Y305-F309 VanDerWaalsContact O-N 3.09Å; Y305-S537 VanDerWaalsContact CD2-C 3.48Å; Y305-S541 WeakPolarHBondContact CE2-OG 3.41Å
306	V	90.6	Very high	88.1	Confident	2 Å²	2	13.8 Å²	13.8	1%	0.012	7%	0.067	C	C	.	.	H	α-helix	trans	-71.8	-38.4	175.8	172.1	0	0	0	0	111.8	V302 A303 F309 A310 G335 T338 V339 L342 A538 I590	V302-V306 HydrophobicContact CG1-CG2 4.39Å; V302-V306 WeakPolarHBondContact O-CB 3.14Å; V302-V306 VanDerWaalsContact O-CG2 3.27Å; V302-V306 WeakPolarHBondContact O-CG2 3.41Å; V302-V306 PolarHBondContact O-N 2.97Å; A303-V306 PolarHBondContact O-N 3.22Å; V306-F309 WeakPolarHBondContact O-CB 3.27Å; V306-F309 PolarHBondContact O-N 2.77Å; V306-A310 WeakPolarHBondContact O-CB 3.43Å; V306-A310 PolarHBondContact O-N 3.17Å; V306-G335 VanDerWaalsContact CG1-O 3.25Å; V306-G335 WeakPolarHBondContact CG1-O 3.46Å; V306-T338 HydrophobicContact CG1-CG2 4.39Å; V306-V339 HydrophobicContact CG1-CB 4.43Å; V306-V339 HydrophobicContact CG2-CB 4.47Å; V306-L342 HydrophobicContact CG2-CD1 3.86Å; V306-A538 HydrophobicContact CG2-CB 4.08Å; V306-I590 HydrophobicContact CB-CD1 4.15Å; V306-I590 HydrophobicContact CG1-CD1 3.85Å; V306-I590 HydrophobicContact CG1-CG1 4.37Å
307	V	89.1	Confident	87.9	Confident	0 Å²	0	13.2 Å²	13.2	0%	0	7%	0.067	C	C	.	.	H	α-helix	trans	-64.1	-44.7	174.8	169.4	0	0	0	0	110.4	A303 M304 F309 A310 E311 I331 I590 L595 I598	A303-V307 WeakPolarHBondContact O-CB 3.5Å; A303-V307 VanDerWaalsContact O-CG2 3.25Å; A303-V307 WeakPolarHBondContact O-CG2 3.48Å; A303-V307 PolarHBondContact O-N 2.87Å; M304-V307 PolarHBondContact O-N 2.93Å; V307-F309 VanDerWaalsContact C-N 3.3Å; V307-F309 PolarHBondContact O-N 3.45Å; V307-A310 PolarHBondContact O-N 3.29Å; V307-A310 VanDerWaalsContact O-N 3.12Å; V307-E311 WeakPolarHBondContact O-CB 2.94Å; V307-E311 PolarHBondContact O-N 3.48Å; V307-I331 HydrophobicContact CG1-CG2 4.19Å; V307-I590 HydrophobicContact CG2-CB 4.45Å; V307-I590 HydrophobicContact CG2-CG1 4.24Å; V307-I590 HydrophobicContact CG2-CG2 4.49Å; V307-L595 HydrophobicContact CG1-CB 4.33Å; V307-L595 HydrophobicContact CG1-CD1 4.35Å; V307-I598 HydrophobicContact CG2-CD1 4.06Å
308	G	85.4	Confident	87.5	Confident	0 Å²	0	17.3 Å²	17.3	0%	0	9%	0.085	C	C	.	.	H	α-helix	trans	-61.3	-37.1	175	0	0	0	0	0	113.1	L227 M304 T312	L227-G308 WeakPolarHBondContact CD1-O 3.02Å; M304-G308 PolarHBondContact O-N 3.17Å; G308-T312 PolarHBondContact O-N 3.23Å; G308-T312 PolarHBondContact O-OG1 2.8Å
309	F	87.6	Confident	87	Confident	26 Å²	26	20.6 Å²	20.6	11%	0.114	12%	0.119	C	C	.	.	H	α-helix	trans	-61.9	-50.5	170.5	174.4	-103.3	0	0	0	111.6	Y305 V306 V307 E311 T312 V313 I334 T338 F531 T534 L535	Y305-F309 PolarHBondContact O-N 3.47Å; Y305-F309 VanDerWaalsContact O-N 3.09Å; V306-F309 WeakPolarHBondContact O-CB 3.27Å; V306-F309 PolarHBondContact O-N 2.77Å; V307-F309 VanDerWaalsContact C-N 3.3Å; V307-F309 PolarHBondContact O-N 3.45Å; F309-E311 VanDerWaalsContact C-N 3.3Å; F309-E311 PolarHBondContact O-N 3.26Å; F309-T312 PolarHBondContact O-N 3.24Å; F309-T312 PolarHBondContact O-OG1 3.31Å; F309-V313 HydrophobicContact CD1-CG2 4.22Å; F309-V313 HydrophobicContact CD2-CG2 4.31Å; F309-V313 HydrophobicContact CE1-CG2 3.79Å; F309-V313 HydrophobicContact CE2-CG2 3.89Å; F309-V313 HydrophobicContact CG-CG2 4.47Å; F309-V313 HydrophobicContact CZ-CG2 3.61Å; F309-V313 WeakPolarHBondContact O-CG2 3.3Å; F309-V313 PolarHBondContact O-N 2.84Å; F309-I334 HydrophobicContact CE1-CG2 4.37Å; F309-T338 HydrophobicContact CD1-CG2 3.73Å; F309-T338 HydrophobicContact CE1-CG2 3.84Å; F309-T338 WeakPolarHBondContact CE1-OG1 3.29Å; F309-F531 HydrophobicContact CD2-CB 4.37Å; F309-F531 AromaticContact CD2-CD1 3.56Å; F309-F531 HydrophobicContact CD2-CD1 3.56Å; F309-F531 HydrophobicContact CD2-CE1 4.13Å; F309-F531 HydrophobicContact CD2-CG 4.18Å; F309-F531 HydrophobicContact CE2-CB 4.01Å; F309-F531 AromaticContact CE2-CD1 3.36Å; F309-F531 HydrophobicContact CE2-CD1 3.36Å; F309-F531 HydrophobicContact CE2-CD2 4.37Å; F309-F531 AromaticContact CE2-CE1 3.81Å; F309-F531 HydrophobicContact CE2-CE1 3.81Å; F309-F531 AromaticContact CE2-CG 3.67Å; F309-F531 HydrophobicContact CE2-CG 3.67Å; F309-F531 HydrophobicContact CE2-CZ 4.47Å; F309-T534 HydrophobicContact CB-CG2 4.13Å; F309-T534 WeakPolarHBondContact CD2-OG1 3.4Å; F309-L535 HydrophobicContact CD2-CD2 4.32Å; F309-L535 HydrophobicContact CD2-CG 4.22Å; F309-L535 HydrophobicContact CE2-CD1 4.11Å; F309-L535 HydrophobicContact CE2-CD2 4.41Å; F309-L535 HydrophobicContact CE2-CG 4.27Å; F309-L535 HydrophobicContact CG-CD2 4.37Å
310	A	89.3	Confident	86.7	Confident	0 Å²	0	26 Å²	26	0%	0	15%	0.152	C	C	.	.	H	α-helix	trans	-60.9	-39.6	-177.6	0	0	0	0	0	112.1	V306 V307 V313 V314 I331 I334	V306-A310 WeakPolarHBondContact O-CB 3.43Å; V306-A310 PolarHBondContact O-N 3.17Å; V307-A310 PolarHBondContact O-N 3.29Å; V307-A310 VanDerWaalsContact O-N 3.12Å; A310-V313 PolarHBondContact O-N 2.69Å; A310-V314 WeakPolarHBondContact O-CG2 3.37Å; A310-V314 PolarHBondContact O-N 3.42Å; A310-I331 HydrophobicContact CB-CG2 4Å; A310-I331 WeakPolarHBondContact CB-O 3.33Å; A310-I334 HydrophobicContact CB-CB 4.06Å; A310-I334 HydrophobicContact CB-CG2 3.84Å
311	E	85.6	Confident	86	Confident	44 Å²	44	33.1 Å²	33.1	21%	0.206	19%	0.19	C	C	.	.	H	α-helix	trans	-58.4	-49.4	175.2	-171.8	172.2	-175.7	0	0	111.8	V307 F309 V313 V314 E315 I331	V307-E311 WeakPolarHBondContact O-CB 2.94Å; V307-E311 PolarHBondContact O-N 3.48Å; F309-E311 VanDerWaalsContact C-N 3.3Å; F309-E311 PolarHBondContact O-N 3.26Å; E311-V313 VanDerWaalsContact C-N 3.3Å; E311-V313 PolarHBondContact O-N 2.89Å; E311-V314 PolarHBondContact O-N 3.37Å; E311-E315 WeakPolarHBondContact O-CB 3.12Å; E311-E315 PolarHBondContact O-N 3.38Å; E311-I331 HydrophobicContact CB-CD1 4.41Å; E311-I331 HydrophobicContact CG-CD1 4.45Å
312	T	84.6	Confident	85.6	Confident	2 Å²	2	35.6 Å²	35.6	1%	0.012	21%	0.21	C	C	.	.	H	α-helix	trans	-62.5	-36.2	176.2	52.5	0	0	0	0	113.8	L227 G308 F309 L316 I530 F531	L227-T312 HydrophobicContact CD1-CG2 3.73Å; L227-T312 HydrophobicContact CD2-CG2 3.56Å; L227-T312 HydrophobicContact CG-CG2 3.9Å; G308-T312 PolarHBondContact O-N 3.23Å; G308-T312 PolarHBondContact O-OG1 2.8Å; F309-T312 PolarHBondContact O-N 3.24Å; F309-T312 PolarHBondContact O-OG1 3.31Å; T312-L316 VanDerWaalsContact O-CG 3.29Å; T312-L316 WeakPolarHBondContact O-CG 3.41Å; T312-L316 PolarHBondContact O-N 3.37Å; T312-I530 HydrophobicContact CG2-CD1 4.3Å; T312-I530 HydrophobicContact CG2-CG2 3.71Å; T312-F531 WeakPolarHBondContact OG1-CE1 2.96Å
313	V	87.5	Confident	85	Confident	24 Å²	24	39.1 Å²	39.1	15%	0.145	23%	0.229	C	C	.	.	H	α-helix	trans	-67.1	-47.8	178	173.1	0	0	0	0	109.7	F309 A310 E311 E315 L316 L317 I334 F531	F309-V313 HydrophobicContact CD1-CG2 4.22Å; F309-V313 HydrophobicContact CD2-CG2 4.31Å; F309-V313 HydrophobicContact CE1-CG2 3.79Å; F309-V313 HydrophobicContact CE2-CG2 3.89Å; F309-V313 HydrophobicContact CG-CG2 4.47Å; F309-V313 HydrophobicContact CZ-CG2 3.61Å; F309-V313 WeakPolarHBondContact O-CG2 3.3Å; F309-V313 PolarHBondContact O-N 2.84Å; A310-V313 PolarHBondContact O-N 2.69Å; E311-V313 VanDerWaalsContact C-N 3.3Å; E311-V313 PolarHBondContact O-N 2.89Å; V313-E315 VanDerWaalsContact C-N 3.29Å; V313-E315 PolarHBondContact O-N 3.12Å; V313-L316 PolarHBondContact O-N 3.42Å; V313-L317 HydrophobicContact CG1-CD1 3.68Å; V313-L317 WeakPolarHBondContact O-CD1 3.46Å; V313-L317 PolarHBondContact O-N 3.3Å; V313-I334 HydrophobicContact CB-CD1 4.47Å; V313-I334 HydrophobicContact CB-CG2 4.27Å; V313-I334 HydrophobicContact CG1-CD1 3.89Å; V313-I334 HydrophobicContact CG1-CG2 4.19Å; V313-F531 HydrophobicContact CG2-CE1 3.66Å; V313-F531 HydrophobicContact CG2-CZ 3.84Å
314	V	87.2	Confident	84.2	Confident	5 Å²	5	45.8 Å²	45.8	3%	0.03	26%	0.262	C	S	.	.	H	α-helix	trans	-59	-42	177.6	171.7	0	0	0	0	111.2	A310 E311 L316 L317 K318 D330 I331 I334	A310-V314 WeakPolarHBondContact O-CG2 3.37Å; A310-V314 PolarHBondContact O-N 3.42Å; E311-V314 PolarHBondContact O-N 3.37Å; V314-L316 PolarHBondContact O-N 2.84Å; V314-L317 WeakPolarHBondContact O-CB 3.5Å; V314-L317 PolarHBondContact O-N 2.94Å; V314-L317 VanDerWaalsContact O-N 3.15Å; V314-K318 WeakPolarHBondContact O-CG 3.2Å; V314-K318 PolarHBondContact O-N 3.33Å; V314-D330 HydrophobicContact CG1-CB 4.45Å; V314-D330 HydrophobicContact CG2-CB 3.77Å; V314-I331 HydrophobicContact CB-CG1 4.36Å; V314-I331 HydrophobicContact CG2-CG1 3.91Å; V314-I334 HydrophobicContact CG2-CD1 3.46Å; V314-I334 VanDerWaalsContact CG2-CD1 3.46Å
315	E	82.3	Confident	83.9	Confident	48 Å²	48	49.8 Å²	49.8	22%	0.224	29%	0.286	C	S	.	.	H	α-helix	trans	-66.9	-37	179	-166.4	174.1	-165.3	0	0	113	E311 V313 L317 K318 G319 Q514	E311-E315 WeakPolarHBondContact O-CB 3.12Å; E311-E315 PolarHBondContact O-N 3.38Å; V313-E315 VanDerWaalsContact C-N 3.29Å; V313-E315 PolarHBondContact O-N 3.12Å; E315-L317 VanDerWaalsContact C-N 3.34Å; E315-K318 WeakPolarHBondContact O-CB 3.32Å; E315-K318 PolarHBondContact O-N 3.47Å; E315-G319 PolarHBondContact O-N 3.22Å; E315-Q514 VanDerWaalsContact CD-CG 3.43Å; E315-Q514 HydrophobicContact CG-CG 4.41Å; E315-Q514 WeakPolarHBondContact OE2-CG 3.24Å; E315-Q514 PolarHBondContact OE2-NE2 3.31Å
316	L	84.1	Confident	83.7	Confident	62 Å²	62	54.1 Å²	54.1	33%	0.325	31%	0.31	S	S	.	.	H	α-helix	trans	-66.9	-35.1	170.6	-70.4	171.3	0	0	0	112.2	T312 V313 V314 G319 F531	T312-L316 VanDerWaalsContact O-CG 3.29Å; T312-L316 WeakPolarHBondContact O-CG 3.41Å; T312-L316 PolarHBondContact O-N 3.37Å; V313-L316 PolarHBondContact O-N 3.42Å; V314-L316 PolarHBondContact O-N 2.84Å; L316-G319 PolarHBondContact O-N 2.99Å; L316-F531 HydrophobicContact CD1-CE1 4.3Å; L316-F531 HydrophobicContact CD1-CE2 4.49Å; L316-F531 HydrophobicContact CD1-CZ 3.67Å
317	L	85.1	Confident	83.4	Confident	54 Å²	54	57.2 Å²	57.2	28%	0.283	33%	0.326	S	S	.	.	H	α-helix	trans	-66.4	-38.6	174.1	-93.5	73.4	0	0	0	111.8	V313 V314 E315 G319 V320 D321 A322	V313-L317 HydrophobicContact CG1-CD1 3.68Å; V313-L317 WeakPolarHBondContact O-CD1 3.46Å; V313-L317 PolarHBondContact O-N 3.3Å; V314-L317 WeakPolarHBondContact O-CB 3.5Å; V314-L317 PolarHBondContact O-N 2.94Å; V314-L317 VanDerWaalsContact O-N 3.15Å; E315-L317 VanDerWaalsContact C-N 3.34Å; L317-G319 VanDerWaalsContact C-N 3.27Å; L317-G319 PolarHBondContact O-N 3.17Å; L317-V320 CarbonylContact O-C 3.56Å; L317-V320 PolarHBondContact O-N 3.43Å; L317-V320 VanDerWaalsContact O-N 3.09Å; L317-D321 PolarHBondContact O-N 3.24Å; L317-A322 PolarHBondContact O-N 3.09Å; L317-A322 VanDerWaalsContact O-N 3.09Å
318	K	82.4	Confident	83.4	Confident	86 Å²	86	61.8 Å²	61.8	37%	0.374	35%	0.35	S	S	.	.	H	α-helix	trans	-58.9	-39.7	172.5	-73.3	175.1	175.5	-179.4	0	111.7	V314 E315 V320 D321 L323 D327	V314-K318 WeakPolarHBondContact O-CG 3.2Å; V314-K318 PolarHBondContact O-N 3.33Å; E315-K318 WeakPolarHBondContact O-CB 3.32Å; E315-K318 PolarHBondContact O-N 3.47Å; K318-V320 PolarHBondContact O-N 3.21Å; K318-D321 PolarHBondContact O-N 2.71Å; K318-D321 VanDerWaalsContact O-N 3.15Å; K318-L323 HydrophobicContact CG-CD1 3.87Å; K318-L323 HydrophobicContact CG-CG 4.39Å; K318-D327 WeakPolarHBondContact CE-OD1 3.42Å; K318-D327 VanDerWaalsContact CE-OD2 3.26Å; K318-D327 WeakPolarHBondContact CE-OD2 3.25Å; K318-D327 IonicContact NZ-OD1 3.68Å; K318-D327 PolarHBondContact NZ-OD1 3.17Å; K318-D327 IonicContact NZ-OD2 3.45Å; K318-D327 PolarHBondContact NZ-OD2 3.06Å
319	G	78	Confident	83.6	Confident	71 Å²	71	64.4 Å²	64.4	73%	0.732	36%	0.364	S	S	*	.	H	α-helix	trans	-62.1	-21.8	176.2	0	0	0	0	0	114.4	E315 L316 L317	E315-G319 PolarHBondContact O-N 3.22Å; L316-G319 PolarHBondContact O-N 2.99Å; L317-G319 VanDerWaalsContact C-N 3.27Å; L317-G319 PolarHBondContact O-N 3.17Å
320	V	84	Confident	83.7	Confident	117 Å²	117	63.5 Å²	63.5	71%	0.709	36%	0.36	S	S	*	.	T	Hydrogen-bonded Turn	trans	-107	5.9	179.7	-171	0	0	0	0	111.8	L317 K318 A322	L317-V320 CarbonylContact O-C 3.56Å; L317-V320 PolarHBondContact O-N 3.43Å; L317-V320 VanDerWaalsContact O-N 3.09Å; K318-V320 PolarHBondContact O-N 3.21Å; V320-A322 VanDerWaalsContact C-N 3.26Å; V320-A322 PolarHBondContact O-N 3.39Å
321	D	76.9	Confident	83.8	Confident	149 Å²	149	64.3 Å²	64.3	80%	0.797	36%	0.364	S	S	*	.	T	Hydrogen-bonded Turn	trans	56.1	35.9	-177.3	-157	31.3	0	0	0	113.8	L317 K318	L317-D321 PolarHBondContact O-N 3.24Å; K318-D321 PolarHBondContact O-N 2.71Å; K318-D321 VanDerWaalsContact O-N 3.15Å
322	A	80.5	Confident	84.1	Confident	52 Å²	52	66.3 Å²	66.3	43%	0.43	37%	0.37	S	S	.	.			trans	-110.4	44.3	-177	0	0	0	0	0	112.6	L317 V320	L317-A322 PolarHBondContact O-N 3.09Å; L317-A322 VanDerWaalsContact O-N 3.09Å; V320-A322 VanDerWaalsContact C-N 3.26Å; V320-A322 PolarHBondContact O-N 3.39Å
323	L	77.7	Confident	84.5	Confident	75 Å²	75	69.4 Å²	69.4	39%	0.393	39%	0.386	S	S	.	.			trans	-70.1	129.3	178.3	-115.1	149.8	0	0	0	110.7	K318 D330	K318-L323 HydrophobicContact CG-CD1 3.87Å; K318-L323 HydrophobicContact CG-CG 4.39Å; L323-D330 WeakPolarHBondContact CD2-OD2 3.31Å
324	M	73.4	Confident	84.8	Confident	140 Å²	140	69.7 Å²	69.7	69%	0.69	39%	0.386	S	S	*	.			trans	-88.5	-40.9	-177.7	-91.5	177.7	55.8	0	0	112.3	D330	M324-D330 PolarHBondContact N-OD2 3.4Å; M324-D330 VanDerWaalsContact N-OD2 3.1Å
325	T	82.5	Confident	85	Confident	85 Å²	85	69.4 Å²	69.4	52%	0.521	38%	0.384	S	S	.	.	S	Bend	trans	-144.2	-96.6	177.2	-55	0	0	0	0	110.5	D330	T325-D330 WeakPolarHBondContact CB-OD1 3.24Å; T325-D330 PolarHBondContact N-OD1 2.85Å; T325-D330 PolarHBondContact N-OD2 3.46Å
326	D	84.9	Confident	85.6	Confident	95 Å²	95	69 Å²	69	51%	0.508	39%	0.385	S	S	.	.			trans	-128.8	150.1	-179.4	-63	-49.8	0	0	0	108.2	I328 N329 D330	D326-I328 VanDerWaalsContact C-N 3.31Å; D326-I328 PolarHBondContact O-N 3.22Å; D326-I328 VanDerWaalsContact O-N 3.15Å; D326-N329 HydrophobicContact CB-CB 4.31Å; D326-N329 PolarHBondContact O-N 3.47Å; D326-N329 PolarHBondContact OD2-ND2 3.33Å; D326-D330 WeakPolarHBondContact O-CB 3.36Å; D326-D330 PolarHBondContact O-N 2.91Å
327	D	83.9	Confident	86.1	Confident	66 Å²	66	70.8 Å²	70.8	35%	0.353	39%	0.394	S	S	.	.	H	α-helix	trans	-47.5	-49.5	-177.4	-62.8	-11.6	0	0	0	113.9	K318 I331	K318-D327 WeakPolarHBondContact CE-OD1 3.42Å; K318-D327 VanDerWaalsContact CE-OD2 3.26Å; K318-D327 WeakPolarHBondContact CE-OD2 3.25Å; K318-D327 IonicContact NZ-OD1 3.68Å; K318-D327 PolarHBondContact NZ-OD1 3.17Å; K318-D327 IonicContact NZ-OD2 3.45Å; K318-D327 PolarHBondContact NZ-OD2 3.06Å; D327-I331 VanDerWaalsContact O-CG1 3.25Å; D327-I331 WeakPolarHBondContact O-CG1 3.43Å; D327-I331 PolarHBondContact O-N 2.91Å; D327-I331 VanDerWaalsContact O-N 3.14Å
328	I	88.4	Confident	86.5	Confident	97 Å²	97	69 Å²	69	50%	0.497	39%	0.385	S	S	.	.	H	α-helix	trans	-71.4	-38.3	-177.1	-58	172.9	0	0	0	110.9	D326 R332 A593	D326-I328 VanDerWaalsContact C-N 3.31Å; D326-I328 PolarHBondContact O-N 3.22Å; D326-I328 VanDerWaalsContact O-N 3.15Å; I328-R332 WeakPolarHBondContact O-CG 3.41Å; I328-R332 PolarHBondContact O-N 3.48Å; I328-A593 HydrophobicContact CG2-CB 3.85Å
329	N	89.8	Confident	87	Confident	55 Å²	55	64.9 Å²	64.9	29%	0.294	37%	0.367	S	S	.	.	H	α-helix	trans	-73.8	-33.8	-179.6	-71.6	-31.9	0	0	0	111.4	D326 R332 I333	D326-N329 HydrophobicContact CB-CB 4.31Å; D326-N329 PolarHBondContact O-N 3.47Å; D326-N329 PolarHBondContact OD2-ND2 3.33Å; N329-R332 WeakPolarHBondContact O-CB 3.27Å; N329-R332 PolarHBondContact O-N 2.88Å; N329-R332 PolarHBondContact OD1-NH1 3.27Å; N329-R332 VanDerWaalsContact OD1-NH1 3.1Å; N329-I333 VanDerWaalsContact O-CG1 3.31Å; N329-I333 WeakPolarHBondContact O-CG1 3.33Å; N329-I333 PolarHBondContact O-N 2.71Å
330	D	90.5	Very high	87.7	Confident	6 Å²	6	65.9 Å²	65.9	3%	0.032	36%	0.355	C	S	.	.	H	α-helix	trans	-67.6	-39	175.9	-72.3	9.3	0	0	0	110.4	V314 L323 M324 T325 D326 R332 I333 I334	V314-D330 HydrophobicContact CG1-CB 4.45Å; V314-D330 HydrophobicContact CG2-CB 3.77Å; L323-D330 WeakPolarHBondContact CD2-OD2 3.31Å; M324-D330 PolarHBondContact N-OD2 3.4Å; M324-D330 VanDerWaalsContact N-OD2 3.1Å; T325-D330 WeakPolarHBondContact CB-OD1 3.24Å; T325-D330 PolarHBondContact N-OD1 2.85Å; T325-D330 PolarHBondContact N-OD2 3.46Å; D326-D330 WeakPolarHBondContact O-CB 3.36Å; D326-D330 PolarHBondContact O-N 2.91Å; D330-R332 VanDerWaalsContact C-N 3.31Å; D330-R332 PolarHBondContact O-N 3.44Å; D330-I333 PolarHBondContact O-N 3.39Å; D330-I334 WeakPolarHBondContact O-CB 3.42Å; D330-I334 WeakPolarHBondContact O-CG1 3.44Å; D330-I334 PolarHBondContact O-N 3.27Å
331	I	89.8	Confident	88.1	Confident	18 Å²	18	64.2 Å²	64.2	9%	0.092	35%	0.345	C	S	.	.	H	α-helix	trans	-58	-43.4	171	-68.7	167.3	0	0	0	110.9	V307 A310 E311 V314 D327 G335 A593	V307-I331 HydrophobicContact CG1-CG2 4.19Å; A310-I331 HydrophobicContact CB-CG2 4Å; A310-I331 WeakPolarHBondContact CB-O 3.33Å; E311-I331 HydrophobicContact CB-CD1 4.41Å; E311-I331 HydrophobicContact CG-CD1 4.45Å; V314-I331 HydrophobicContact CB-CG1 4.36Å; V314-I331 HydrophobicContact CG2-CG1 3.91Å; D327-I331 VanDerWaalsContact O-CG1 3.25Å; D327-I331 WeakPolarHBondContact O-CG1 3.43Å; D327-I331 PolarHBondContact O-N 2.91Å; D327-I331 VanDerWaalsContact O-N 3.14Å; I331-G335 PolarHBondContact O-N 2.96Å; I331-A593 HydrophobicContact CB-CB 4.42Å; I331-A593 HydrophobicContact CG2-CB 4.02Å
332	R	93.5	Very high	88.7	Confident	85 Å²	85	57.5 Å²	57.5	32%	0.321	31%	0.309	S	S	.	.	H	α-helix	trans	-62.9	-45.7	177.5	-68	171.5	175.3	158.5	-0.3	112.2	I328 N329 D330 T336 L591 A593	I328-R332 WeakPolarHBondContact O-CG 3.41Å; I328-R332 PolarHBondContact O-N 3.48Å; N329-R332 WeakPolarHBondContact O-CB 3.27Å; N329-R332 PolarHBondContact O-N 2.88Å; N329-R332 PolarHBondContact OD1-NH1 3.27Å; N329-R332 VanDerWaalsContact OD1-NH1 3.1Å; D330-R332 VanDerWaalsContact C-N 3.31Å; D330-R332 PolarHBondContact O-N 3.44Å; R332-T336 WeakPolarHBondContact O-CB 3.24Å; R332-T336 PolarHBondContact O-N 2.98Å; R332-T336 PolarHBondContact O-OG1 3.44Å; R332-L591 PolarHBondContact NE-O 2.78Å; R332-L591 PolarHBondContact NH2-O 3.26Å; R332-A593 HydrophobicContact CG-CB 3.44Å; R332-A593 VanDerWaalsContact CG-CB 3.44Å
333	I	92.7	Very high	89.1	Confident	68 Å²	68	56.6 Å²	56.6	35%	0.349	30%	0.297	S	S	.	.	H	α-helix	trans	-65.8	-51.4	-177.3	-67.5	164.6	0	0	0	109.7	N329 D330 G335 T336 I337	N329-I333 VanDerWaalsContact O-CG1 3.31Å; N329-I333 WeakPolarHBondContact O-CG1 3.33Å; N329-I333 PolarHBondContact O-N 2.71Å; D330-I333 PolarHBondContact O-N 3.39Å; I333-G335 VanDerWaalsContact C-N 3.34Å; I333-G335 PolarHBondContact O-N 2.97Å; I333-T336 PolarHBondContact O-N 2.83Å; I333-I337 HydrophobicContact CG2-CD1 3.85Å; I333-I337 WeakPolarHBondContact O-CG1 3.44Å; I333-I337 PolarHBondContact O-N 3.21Å
334	I	92.7	Very high	89.6	Confident	29 Å²	29	55.1 Å²	55.1	15%	0.149	30%	0.299	C	S	.	.	H	α-helix	trans	-63.6	-42.2	179.8	-68.2	160	0	0	0	110.7	F309 A310 V313 V314 D330 T336 I337 T338	F309-I334 HydrophobicContact CE1-CG2 4.37Å; A310-I334 HydrophobicContact CB-CB 4.06Å; A310-I334 HydrophobicContact CB-CG2 3.84Å; V313-I334 HydrophobicContact CB-CD1 4.47Å; V313-I334 HydrophobicContact CB-CG2 4.27Å; V313-I334 HydrophobicContact CG1-CD1 3.89Å; V313-I334 HydrophobicContact CG1-CG2 4.19Å; V314-I334 HydrophobicContact CG2-CD1 3.46Å; V314-I334 VanDerWaalsContact CG2-CD1 3.46Å; D330-I334 WeakPolarHBondContact O-CB 3.42Å; D330-I334 WeakPolarHBondContact O-CG1 3.44Å; D330-I334 PolarHBondContact O-N 3.27Å; I334-T336 PolarHBondContact O-N 3.47Å; I334-I337 PolarHBondContact O-N 3.48Å; I334-T338 WeakPolarHBondContact O-CB 3.25Å; I334-T338 PolarHBondContact O-N 3.09Å; I334-T338 PolarHBondContact O-OG1 3.44Å
335	G	92.5	Very high	90.2	Very high	0 Å²	0	51.5 Å²	51.5	0%	0	28%	0.282	C	S	.	.	H	α-helix	trans	-60.2	-44.3	176	0	0	0	0	0	112.3	V306 I331 I333 T338 V339	V306-G335 VanDerWaalsContact CG1-O 3.25Å; V306-G335 WeakPolarHBondContact CG1-O 3.46Å; I331-G335 PolarHBondContact O-N 2.96Å; I333-G335 VanDerWaalsContact C-N 3.34Å; I333-G335 PolarHBondContact O-N 2.97Å; G335-T338 PolarHBondContact O-N 3.04Å; G335-V339 WeakPolarHBondContact O-CG1 3.45Å; G335-V339 PolarHBondContact O-N 2.96Å
336	T	93.6	Very high	90.2	Very high	40 Å²	40	47.5 Å²	47.5	25%	0.245	26%	0.258	C	S	.	.	H	α-helix	trans	-64.3	-44.4	178.4	-56.6	0	0	0	0	111.9	R332 I333 I334 T338 V339 I340 L587	R332-T336 WeakPolarHBondContact O-CB 3.24Å; R332-T336 PolarHBondContact O-N 2.98Å; R332-T336 PolarHBondContact O-OG1 3.44Å; I333-T336 PolarHBondContact O-N 2.83Å; I334-T336 PolarHBondContact O-N 3.47Å; T336-T338 VanDerWaalsContact C-N 3.33Å; T336-T338 PolarHBondContact O-N 2.94Å; T336-V339 VanDerWaalsContact O-CG1 3.32Å; T336-V339 WeakPolarHBondContact O-CG1 3.38Å; T336-I340 HydrophobicContact CG2-CD1 4.05Å; T336-I340 WeakPolarHBondContact O-CD1 3.32Å; T336-I340 VanDerWaalsContact O-CG1 3.24Å; T336-I340 WeakPolarHBondContact O-CG1 3.35Å; T336-I340 PolarHBondContact O-N 3.19Å; T336-L587 HydrophobicContact CG2-CD1 3.8Å
337	I	94.8	Very high	90.1	Very high	98 Å²	98	46.1 Å²	46.1	50%	0.503	25%	0.253	S	S	.	.	H	α-helix	trans	-62	-45.1	176.4	-66.7	165.9	0	0	0	110.1	I333 I334 I340 V341	I333-I337 HydrophobicContact CG2-CD1 3.85Å; I333-I337 WeakPolarHBondContact O-CG1 3.44Å; I333-I337 PolarHBondContact O-N 3.21Å; I334-I337 PolarHBondContact O-N 3.48Å; I337-I340 PolarHBondContact O-N 2.9Å; I337-V341 WeakPolarHBondContact O-CG2 3.24Å; I337-V341 PolarHBondContact O-N 3.35Å
338	T	93	Very high	89.9	Confident	16 Å²	16	46.6 Å²	46.6	10%	0.098	27%	0.266	C	S	.	.	H	α-helix	trans	-64.5	-44.8	-177.2	-55.7	0	0	0	0	111.9	V306 F309 I334 G335 T336 I340 V341 L342 L535	V306-T338 HydrophobicContact CG1-CG2 4.39Å; F309-T338 HydrophobicContact CD1-CG2 3.73Å; F309-T338 HydrophobicContact CE1-CG2 3.84Å; F309-T338 WeakPolarHBondContact CE1-OG1 3.29Å; I334-T338 WeakPolarHBondContact O-CB 3.25Å; I334-T338 PolarHBondContact O-N 3.09Å; I334-T338 PolarHBondContact O-OG1 3.44Å; G335-T338 PolarHBondContact O-N 3.04Å; T336-T338 VanDerWaalsContact C-N 3.33Å; T336-T338 PolarHBondContact O-N 2.94Å; T338-I340 VanDerWaalsContact C-N 3.31Å; T338-I340 PolarHBondContact O-N 3.37Å; T338-V341 PolarHBondContact O-N 3.4Å; T338-L342 HydrophobicContact CG2-CD1 4.19Å; T338-L342 HydrophobicContact CG2-CG 4.38Å; T338-L342 WeakPolarHBondContact O-CG 3.47Å; T338-L342 PolarHBondContact O-N 3.43Å; T338-L535 HydrophobicContact CG2-CD2 3.69Å
339	V	93.3	Very high	89	Confident	0 Å²	0	42.8 Å²	42.8	0%	0	25%	0.25	C	S	.	.	H	α-helix	trans	-66.7	-32.2	179.1	70.6	0	0	0	0	112.3	V302 V306 G335 T336 L343 F583 A586 L587 I590	V302-V339 HydrophobicContact CG1-CG2 4.35Å; V306-V339 HydrophobicContact CG1-CB 4.43Å; V306-V339 HydrophobicContact CG2-CB 4.47Å; G335-V339 WeakPolarHBondContact O-CG1 3.45Å; G335-V339 PolarHBondContact O-N 2.96Å; T336-V339 VanDerWaalsContact O-CG1 3.32Å; T336-V339 WeakPolarHBondContact O-CG1 3.38Å; V339-L343 WeakPolarHBondContact O-CB 3.37Å; V339-L343 PolarHBondContact O-N 2.76Å; V339-F583 HydrophobicContact CG1-CD2 4.45Å; V339-F583 HydrophobicContact CG1-CE2 3.86Å; V339-F583 HydrophobicContact CG2-CD2 4.04Å; V339-F583 HydrophobicContact CG2-CE2 4.25Å; V339-A586 HydrophobicContact CG2-CB 4.48Å; V339-L587 HydrophobicContact CG1-CD1 4.43Å; V339-I590 HydrophobicContact CB-CD1 3.81Å; V339-I590 HydrophobicContact CG1-CD1 3.76Å; V339-I590 HydrophobicContact CG2-CD1 4.13Å
340	I	93.7	Very high	88.1	Confident	92 Å²	92	43.5 Å²	43.5	47%	0.472	25%	0.253	S	S	.	.	H	α-helix	trans	-65.8	-43.5	172.8	-67.8	165.5	0	0	0	110.6	T336 I337 T338 L343 G344 F583	T336-I340 HydrophobicContact CG2-CD1 4.05Å; T336-I340 WeakPolarHBondContact O-CD1 3.32Å; T336-I340 VanDerWaalsContact O-CG1 3.24Å; T336-I340 WeakPolarHBondContact O-CG1 3.35Å; T336-I340 PolarHBondContact O-N 3.19Å; I337-I340 PolarHBondContact O-N 2.9Å; T338-I340 VanDerWaalsContact C-N 3.31Å; T338-I340 PolarHBondContact O-N 3.37Å; I340-L343 PolarHBondContact O-N 3.22Å; I340-G344 PolarHBondContact O-N 3.33Å; I340-F583 HydrophobicContact CG1-CE2 3.86Å; I340-F583 HydrophobicContact CG1-CZ 3.86Å
341	V	91.9	Very high	87.4	Confident	83 Å²	83	50.3 Å²	50.3	50%	0.503	28%	0.284	S	S	.	.	H	α-helix	trans	-63.8	-45.3	176.5	171.9	0	0	0	0	111	I337 T338 L343 G344 I345	I337-V341 WeakPolarHBondContact O-CG2 3.24Å; I337-V341 PolarHBondContact O-N 3.35Å; T338-V341 PolarHBondContact O-N 3.4Å; V341-L343 VanDerWaalsContact C-N 3.33Å; V341-L343 PolarHBondContact O-N 2.99Å; V341-G344 PolarHBondContact O-N 2.91Å; V341-G344 VanDerWaalsContact O-N 3.14Å; V341-I345 HydrophobicContact CG1-CD1 4.09Å; V341-I345 WeakPolarHBondContact O-CG1 3.41Å; V341-I345 PolarHBondContact O-N 3.44Å
342	L	89.4	Confident	86.7	Confident	7 Å²	7	57.9 Å²	57.9	4%	0.037	31%	0.312	C	S	.	.	H	α-helix	trans	-62.1	-39.9	177.1	-71.9	177.2	0	0	0	112.1	V306 T338 G344 I345 S346 L535 A538 L539 L542	V306-L342 HydrophobicContact CG2-CD1 3.86Å; T338-L342 HydrophobicContact CG2-CD1 4.19Å; T338-L342 HydrophobicContact CG2-CG 4.38Å; T338-L342 WeakPolarHBondContact O-CG 3.47Å; T338-L342 PolarHBondContact O-N 3.43Å; L342-G344 VanDerWaalsContact C-N 3.35Å; L342-I345 PolarHBondContact O-N 3.02Å; L342-S346 PolarHBondContact O-N 2.87Å; L342-L535 HydrophobicContact CD1-CD2 4.25Å; L342-L535 HydrophobicContact CD2-CD2 4.13Å; L342-L535 HydrophobicContact CG-CD2 4.44Å; L342-A538 HydrophobicContact CD1-CB 3.71Å; L342-L539 HydrophobicContact CD2-CB 4.37Å; L342-L539 HydrophobicContact CD2-CD1 4.35Å; L342-L542 HydrophobicContact CB-CD1 4.38Å
343	L	89	Confident	85.9	Confident	34 Å²	34	54.7 Å²	54.7	18%	0.178	30%	0.301	C	S	.	.	H	α-helix	trans	-61	-45.5	172.8	-177.5	67.8	0	0	0	110.8	V339 I340 V341 I345 S346 V347 L542 F583	V339-L343 WeakPolarHBondContact O-CB 3.37Å; V339-L343 PolarHBondContact O-N 2.76Å; I340-L343 PolarHBondContact O-N 3.22Å; V341-L343 VanDerWaalsContact C-N 3.33Å; V341-L343 PolarHBondContact O-N 2.99Å; L343-I345 VanDerWaalsContact C-N 3.32Å; L343-I345 PolarHBondContact O-N 3.44Å; L343-S346 WeakPolarHBondContact CA-OG 3.33Å; L343-S346 PolarHBondContact O-N 3.25Å; L343-S346 VanDerWaalsContact O-N 3.17Å; L343-S346 PolarHBondContact O-OG 2.96Å; L343-V347 HydrophobicContact CD1-CG2 4.39Å; L343-V347 WeakPolarHBondContact O-CG2 3.33Å; L343-V347 PolarHBondContact O-N 3.34Å; L343-L542 HydrophobicContact CD1-CD2 4.46Å; L343-F583 HydrophobicContact CB-CD2 4.31Å; L343-F583 HydrophobicContact CD1-CB 4.49Å; L343-F583 HydrophobicContact CD2-CB 4.23Å; L343-F583 HydrophobicContact CD2-CD2 3.71Å; L343-F583 HydrophobicContact CD2-CE2 4.16Å; L343-F583 HydrophobicContact CD2-CG 3.9Å; L343-F583 HydrophobicContact CG-CD2 4.49Å
344	G	87.8	Confident	85	Confident	43 Å²	43	54 Å²	54	44%	0.443	31%	0.305	S	S	.	.	H	α-helix	trans	-56.4	-44.1	175.5	0	0	0	0	0	112.8	I340 V341 L342 V347 A348	I340-G344 PolarHBondContact O-N 3.33Å; V341-G344 PolarHBondContact O-N 2.91Å; V341-G344 VanDerWaalsContact O-N 3.14Å; L342-G344 VanDerWaalsContact C-N 3.35Å; G344-V347 PolarHBondContact O-N 2.89Å; G344-A348 WeakPolarHBondContact O-CB 3.22Å; G344-A348 PolarHBondContact O-N 3.39Å
345	I	87	Confident	84.3	Confident	65 Å²	65	59.1 Å²	59.1	33%	0.333	33%	0.326	S	S	.	.	H	α-helix	trans	-63.4	-43.4	176.6	-64.9	166.4	0	0	0	110.9	V341 L342 L343 V347 A348 L539	V341-I345 HydrophobicContact CG1-CD1 4.09Å; V341-I345 WeakPolarHBondContact O-CG1 3.41Å; V341-I345 PolarHBondContact O-N 3.44Å; L342-I345 PolarHBondContact O-N 3.02Å; L343-I345 VanDerWaalsContact C-N 3.32Å; L343-I345 PolarHBondContact O-N 3.44Å; I345-V347 VanDerWaalsContact C-N 3.31Å; I345-V347 PolarHBondContact O-N 3Å; I345-A348 PolarHBondContact O-N 3.04Å; I345-L539 HydrophobicContact CG2-CD1 3.87Å
346	S	82.8	Confident	83.7	Confident	1 Å²	1	61 Å²	61	1%	0.007	34%	0.341	C	S	.	.	H	α-helix	trans	-65.8	-31.1	-179.6	71	0	0	0	0	113.7	L342 L343 L542	L342-S346 PolarHBondContact O-N 2.87Å; L343-S346 WeakPolarHBondContact CA-OG 3.33Å; L343-S346 PolarHBondContact O-N 3.25Å; L343-S346 VanDerWaalsContact O-N 3.17Å; L343-S346 PolarHBondContact O-OG 2.96Å; S346-L542 VanDerWaalsContact CB-CD2 3.44Å; S346-L542 WeakPolarHBondContact OG-CD2 3.34Å
347	V	82.6	Confident	82.8	Confident	66 Å²	66	60.2 Å²	60.2	40%	0.4	34%	0.335	S	S	.	.	H	α-helix	trans	-84.8	-26.7	179.4	176.1	0	0	0	0	112.1	L343 G344 I345 G349 L576	L343-V347 HydrophobicContact CD1-CG2 4.39Å; L343-V347 WeakPolarHBondContact O-CG2 3.33Å; L343-V347 PolarHBondContact O-N 3.34Å; G344-V347 PolarHBondContact O-N 2.89Å; I345-V347 VanDerWaalsContact C-N 3.31Å; I345-V347 PolarHBondContact O-N 3Å; V347-G349 PolarHBondContact O-N 3.09Å; V347-L576 HydrophobicContact CG1-CD2 4.08Å; V347-L576 HydrophobicContact CG2-CD2 4.35Å
348	A	79.2	Confident	82.1	Confident	76 Å²	76	59.4 Å²	59.4	63%	0.628	33%	0.331	S	S	*	.	H	α-helix	trans	-71.1	-12.1	179.2	0	0	0	0	0	114.1	G344 I345	G344-A348 WeakPolarHBondContact O-CB 3.22Å; G344-A348 PolarHBondContact O-N 3.39Å; I345-A348 PolarHBondContact O-N 3.04Å
349	G	69.7	Low	81.8	Confident	17 Å²	17	65.1 Å²	65.1	18%	0.175	36%	0.355	C	S	.	.			trans	130.4	143.7	165.6	0	0	0	0	0	114.9	V347 E351 W352	V347-G349 PolarHBondContact O-N 3.09Å; G349-E351 PolarHBondContact O-N 2.9Å; G349-E351 VanDerWaalsContact O-N 3.12Å; G349-W352 PolarHBondContact O-N 2.98Å
350	M	69.8	Low	81.3	Confident	70 Å²	70	66.5 Å²	66.5	35%	0.345	36%	0.362	S	S	.	.	H	α-helix	trans	-62.5	-19.4	-174.8	-58.7	-155	-57.2	0	0	115.3	A354 K547	M350-A354 PolarHBondContact O-N 2.93Å; M350-K547 VanDerWaalsContact SD-CE 3.53Å; M350-K547 PolarHBondContact SD-NZ 3.49Å
351	E	76.1	Confident	80.7	Confident	148 Å²	148	63.1 Å²	63.1	69%	0.692	35%	0.345	S	S	*	.	H	α-helix	trans	-70.5	-38.7	179.9	-66.3	-173.1	-178.9	0	0	112.8	G349 K355	G349-E351 PolarHBondContact O-N 2.9Å; G349-E351 VanDerWaalsContact O-N 3.12Å; E351-K355 WeakPolarHBondContact O-CG 3.39Å; E351-K355 PolarHBondContact O-N 2.97Å
352	W	75.6	Confident	80.4	Confident	177 Å²	177	63.3 Å²	63.3	67%	0.67	35%	0.346	S	S	*	.	H	α-helix	trans	-71.2	-38.2	178.6	-69.1	96.3	0	0	0	111	G349 K355 A356	G349-W352 PolarHBondContact O-N 2.98Å; W352-K355 PolarHBondContact O-N 3.33Å; W352-A356 WeakPolarHBondContact O-CB 3.11Å; W352-A356 PolarHBondContact O-N 2.81Å
353	E	76.3	Confident	80.3	Confident	18 Å²	18	64.7 Å²	64.7	8%	0.084	35%	0.354	C	S	.	.	H	α-helix	trans	-54.7	-53.6	172	159	177.4	-163.8	0	0	111.6	K355 A356 Q357 L539 V543	E353-K355 VanDerWaalsContact C-N 3.25Å; E353-K355 PolarHBondContact O-N 3.04Å; E353-A356 PolarHBondContact O-N 2.92Å; E353-A356 VanDerWaalsContact O-N 3.16Å; E353-Q357 HydrophobicContact CG-CG 4.39Å; E353-Q357 WeakPolarHBondContact O-CG 3.23Å; E353-Q357 PolarHBondContact O-N 3.32Å; E353-Q357 PolarHBondContact OE1-NE2 3.48Å; E353-L539 HydrophobicContact CB-CD2 4Å; E353-L539 HydrophobicContact CG-CD2 3.34Å; E353-L539 WeakPolarHBondContact OE1-CD2 3.41Å; E353-V543 WeakPolarHBondContact OE2-CG2 3.39Å
354	A	73.6	Confident	80.1	Confident	54 Å²	54	63.3 Å²	63.3	45%	0.446	35%	0.347	S	S	.	.	H	α-helix	trans	-62.5	-35.6	-174.5	0	0	0	0	0	112.1	M350 I358	M350-A354 PolarHBondContact O-N 2.93Å; A354-I358 PolarHBondContact O-N 3.18Å
355	K	79.6	Confident	79.9	Confident	137 Å²	137	65 Å²	65	60%	0.596	35%	0.349	S	S	*	.	H	α-helix	trans	-71.8	-41.3	174.7	-70.2	177.1	-177.2	173.2	0	112.4	E351 W352 E353 I358 F359	E351-K355 WeakPolarHBondContact O-CG 3.39Å; E351-K355 PolarHBondContact O-N 2.97Å; W352-K355 PolarHBondContact O-N 3.33Å; E353-K355 VanDerWaalsContact C-N 3.25Å; E353-K355 PolarHBondContact O-N 3.04Å; K355-I358 WeakPolarHBondContact O-CG2 3.26Å; K355-I358 PolarHBondContact O-N 3.22Å; K355-F359 PolarHBondContact O-N 3Å
356	A	79.3	Confident	80	Confident	38 Å²	38	65.3 Å²	65.3	31%	0.314	35%	0.354	S	S	.	.	H	α-helix	trans	-63.8	-44.3	176.7	0	0	0	0	0	111.1	W352 E353 I358 F359 L360	W352-A356 WeakPolarHBondContact O-CB 3.11Å; W352-A356 PolarHBondContact O-N 2.81Å; E353-A356 PolarHBondContact O-N 2.92Å; E353-A356 VanDerWaalsContact O-N 3.16Å; A356-I358 VanDerWaalsContact C-N 3.32Å; A356-I358 PolarHBondContact O-N 2.79Å; A356-F359 WeakPolarHBondContact O-CB 3.22Å; A356-F359 PolarHBondContact O-N 2.65Å; A356-F359 VanDerWaalsContact O-N 3.16Å; A356-L360 WeakPolarHBondContact O-CG 2.73Å; A356-L360 PolarHBondContact O-N 3.18Å
357	Q	75.1	Confident	80.1	Confident	24 Å²	24	65.3 Å²	65.3	11%	0.112	35%	0.354	C	S	.	.	H	α-helix	trans	-63.2	-32.9	-178.6	-72.8	-179.5	1.6	0	0	113.9	K218 E353 L361	K218-Q357 HydrophobicContact CD-CB 4.06Å; K218-Q357 WeakPolarHBondContact CE-O 3.28Å; K218-Q357 VanDerWaalsContact NZ-CB 3.35Å; E353-Q357 HydrophobicContact CG-CG 4.39Å; E353-Q357 WeakPolarHBondContact O-CG 3.23Å; E353-Q357 PolarHBondContact O-N 3.32Å; E353-Q357 PolarHBondContact OE1-NE2 3.48Å; Q357-L361 WeakPolarHBondContact O-CB 3.41Å; Q357-L361 PolarHBondContact O-N 3.26Å
358	I	80.5	Confident	80.2	Confident	81 Å²	81	63.5 Å²	63.5	42%	0.415	34%	0.342	S	S	.	.	H	α-helix	trans	-70.5	-38.2	176.3	-172.6	64.6	0	0	0	111.2	A354 K355 A356 L361 V362	A354-I358 PolarHBondContact O-N 3.18Å; K355-I358 WeakPolarHBondContact O-CG2 3.26Å; K355-I358 PolarHBondContact O-N 3.22Å; A356-I358 VanDerWaalsContact C-N 3.32Å; A356-I358 PolarHBondContact O-N 2.79Å; I358-L361 HydrophobicContact CD1-CD2 4.14Å; I358-L361 PolarHBondContact O-N 3.08Å; I358-V362 WeakPolarHBondContact O-CG2 3.49Å; I358-V362 PolarHBondContact O-N 2.91Å
359	F	85.4	Confident	80.6	Confident	137 Å²	137	63.6 Å²	63.6	60%	0.601	33%	0.334	S	S	*	.	H	α-helix	trans	-62.6	-47.6	173.5	170.6	-100.3	0	0	0	111.2	K355 A356 L361 V362 V363	K355-F359 PolarHBondContact O-N 3Å; A356-F359 WeakPolarHBondContact O-CB 3.22Å; A356-F359 PolarHBondContact O-N 2.65Å; A356-F359 VanDerWaalsContact O-N 3.16Å; F359-L361 VanDerWaalsContact C-N 3.33Å; F359-L361 PolarHBondContact O-N 3.2Å; F359-V362 PolarHBondContact O-N 3.4Å; F359-V362 VanDerWaalsContact O-N 3.16Å; F359-V363 HydrophobicContact CE1-CG2 4.2Å; F359-V363 HydrophobicContact CE2-CG2 4.39Å; F359-V363 HydrophobicContact CZ-CG2 4.06Å; F359-V363 PolarHBondContact O-N 3.44Å
360	L	82.3	Confident	81.5	Confident	29 Å²	29	63.9 Å²	63.9	15%	0.152	33%	0.332	C	S	.	.	H	α-helix	trans	-58.9	-42.7	177.1	-68.2	-176	0	0	0	111.8	A356 V362 V363 L364 S532	A356-L360 WeakPolarHBondContact O-CG 2.73Å; A356-L360 PolarHBondContact O-N 3.18Å; L360-V362 VanDerWaalsContact C-N 3.32Å; L360-V362 PolarHBondContact O-N 3.44Å; L360-V363 PolarHBondContact O-N 3.25Å; L360-L364 PolarHBondContact O-N 2.97Å; L360-S532 WeakPolarHBondContact CA-OG 3.23Å; L360-S532 WeakPolarHBondContact CB-OG 3.04Å; L360-S532 PolarHBondContact O-OG 2.97Å
361	L	80.9	Confident	82.3	Confident	20 Å²	20	60.6 Å²	60.6	11%	0.105	32%	0.316	C	S	.	.	H	α-helix	trans	-58	-42	176	-178	74.3	0	0	0	112.8	V214 F217 K218 Q357 I358 F359 L364 V365	V214-L361 HydrophobicContact CB-CD2 4.37Å; V214-L361 HydrophobicContact CG1-CD2 3.54Å; V214-L361 HydrophobicContact CG2-CD2 4.09Å; F217-L361 HydrophobicContact CB-CD1 4.07Å; K218-L361 HydrophobicContact CG-CD1 4.16Å; Q357-L361 WeakPolarHBondContact O-CB 3.41Å; Q357-L361 PolarHBondContact O-N 3.26Å; I358-L361 HydrophobicContact CD1-CD2 4.14Å; I358-L361 PolarHBondContact O-N 3.08Å; F359-L361 VanDerWaalsContact C-N 3.33Å; F359-L361 PolarHBondContact O-N 3.2Å; L361-L364 WeakPolarHBondContact O-CB 2.85Å; L361-L364 PolarHBondContact O-N 3.38Å; L361-V365 WeakPolarHBondContact O-CG2 3.46Å; L361-V365 PolarHBondContact O-N 2.9Å
362	V	86.4	Confident	82.8	Confident	88 Å²	88	56.5 Å²	56.5	53%	0.533	30%	0.296	S	S	.	.	H	α-helix	trans	-62.6	-45.7	179.2	173.5	0	0	0	0	110.4	I358 F359 L360 L364 V365 T366	I358-V362 WeakPolarHBondContact O-CG2 3.49Å; I358-V362 PolarHBondContact O-N 2.91Å; F359-V362 PolarHBondContact O-N 3.4Å; F359-V362 VanDerWaalsContact O-N 3.16Å; L360-V362 VanDerWaalsContact C-N 3.32Å; L360-V362 PolarHBondContact O-N 3.44Å; V362-L364 VanDerWaalsContact C-N 3.27Å; V362-L364 PolarHBondContact O-N 3.28Å; V362-V365 PolarHBondContact O-N 3Å; V362-T366 PolarHBondContact O-N 2.89Å; V362-T366 PolarHBondContact O-OG1 3.2Å; V362-T366 VanDerWaalsContact O-OG1 3.05Å
363	V	87.9	Confident	83.4	Confident	35 Å²	35	52.6 Å²	52.6	21%	0.212	29%	0.287	C	S	.	.	H	α-helix	trans	-58.6	-40.9	176.6	177	0	0	0	0	111.3	F359 L360 T366 A367 A528	F359-V363 HydrophobicContact CE1-CG2 4.2Å; F359-V363 HydrophobicContact CE2-CG2 4.39Å; F359-V363 HydrophobicContact CZ-CG2 4.06Å; F359-V363 PolarHBondContact O-N 3.44Å; L360-V363 PolarHBondContact O-N 3.25Å; V363-T366 PolarHBondContact O-N 3.35Å; V363-A367 PolarHBondContact O-N 3.02Å; V363-A528 HydrophobicContact CG1-CB 4.21Å
364	L	83.9	Confident	83.9	Confident	5 Å²	5	51.8 Å²	51.8	3%	0.026	28%	0.283	C	S	.	.	H	α-helix	trans	-64.7	-47.4	178.7	179.4	58.5	0	0	0	112.4	L222 Y226 L360 L361 V362 T366 A367 I368 A533	L222-L364 HydrophobicContact CB-CD1 4Å; L222-L364 HydrophobicContact CB-CD2 4.31Å; L222-L364 HydrophobicContact CD1-CD1 4.3Å; L222-L364 HydrophobicContact CD1-CD2 3.75Å; L222-L364 HydrophobicContact CD1-CG 4.18Å; L222-L364 HydrophobicContact CD2-CD1 4.4Å; L222-L364 HydrophobicContact CG-CD1 4.46Å; Y226-L364 HydrophobicContact CE2-CD1 4.21Å; L360-L364 PolarHBondContact O-N 2.97Å; L361-L364 WeakPolarHBondContact O-CB 2.85Å; L361-L364 PolarHBondContact O-N 3.38Å; V362-L364 VanDerWaalsContact C-N 3.27Å; V362-L364 PolarHBondContact O-N 3.28Å; L364-T366 VanDerWaalsContact C-N 3.3Å; L364-T366 PolarHBondContact O-N 2.97Å; L364-A367 WeakPolarHBondContact O-CB 3.28Å; L364-A367 PolarHBondContact O-N 3.24Å; L364-A367 VanDerWaalsContact O-N 3.16Å; L364-I368 HydrophobicContact CG-CD1 4.42Å; L364-I368 WeakPolarHBondContact O-CG1 3.33Å; L364-I368 PolarHBondContact O-N 3.06Å; L364-A533 HydrophobicContact CD1-CB 3.97Å
365	V	84.8	Confident	84.4	Confident	78 Å²	78	49.2 Å²	49.2	47%	0.473	26%	0.262	S	S	.	.	H	α-helix	trans	-62	-41.7	177.5	173.8	0	0	0	0	110.6	L361 V362 A367 I368 V369	L361-V365 WeakPolarHBondContact O-CG2 3.46Å; L361-V365 PolarHBondContact O-N 2.9Å; V362-V365 PolarHBondContact O-N 3Å; V365-A367 VanDerWaalsContact C-N 3.32Å; V365-A367 PolarHBondContact O-N 3.31Å; V365-I368 PolarHBondContact O-N 3.46Å; V365-V369 WeakPolarHBondContact O-CG2 3.35Å; V365-V369 PolarHBondContact O-N 3.05Å; V365-V369 VanDerWaalsContact O-N 3.08Å
366	T	87.9	Confident	84.8	Confident	73 Å²	73	50 Å²	50	45%	0.448	27%	0.265	S	S	.	.	H	α-helix	trans	-61.4	-39.4	175	-58.1	0	0	0	0	112	V362 V363 L364 V369 N370 I525	V362-T366 PolarHBondContact O-N 2.89Å; V362-T366 PolarHBondContact O-OG1 3.2Å; V362-T366 VanDerWaalsContact O-OG1 3.05Å; V363-T366 PolarHBondContact O-N 3.35Å; L364-T366 VanDerWaalsContact C-N 3.3Å; L364-T366 PolarHBondContact O-N 2.97Å; T366-V369 PolarHBondContact O-N 3.07Å; T366-N370 VanDerWaalsContact O-CB 3.3Å; T366-N370 WeakPolarHBondContact O-CB 3Å; T366-N370 PolarHBondContact O-N 2.72Å; T366-I525 HydrophobicContact CG2-CG2 4.43Å
367	A	86.1	Confident	85.1	Confident	0 Å²	0	52.3 Å²	52.3	0%	0	27%	0.272	C	S	.	.	H	α-helix	trans	-65.1	-41.5	176.9	0	0	0	0	0	112.8	V363 L364 V365 N370 Y371 I525 I526	V363-A367 PolarHBondContact O-N 3.02Å; L364-A367 WeakPolarHBondContact O-CB 3.28Å; L364-A367 PolarHBondContact O-N 3.24Å; L364-A367 VanDerWaalsContact O-N 3.16Å; V365-A367 VanDerWaalsContact C-N 3.32Å; V365-A367 PolarHBondContact O-N 3.31Å; A367-N370 PolarHBondContact O-N 3.32Å; A367-Y371 PolarHBondContact O-N 3.36Å; A367-I525 HydrophobicContact CB-CG2 4.37Å; A367-I526 HydrophobicContact CB-CD1 4.13Å; A367-I526 WeakPolarHBondContact O-CD1 3.5Å
368	I	83.5	Confident	85.2	Confident	29 Å²	29	54.9 Å²	54.9	15%	0.149	29%	0.293	C	S	.	.	H	α-helix	trans	-62.7	-46	176.6	-63.8	166.7	0	0	0	110.5	L222 Y226 L364 V365 N370 Y371 F372 V453	L222-I368 HydrophobicContact CD1-CD1 4.07Å; L222-I368 HydrophobicContact CD2-CD1 3.63Å; L222-I368 HydrophobicContact CD2-CG1 4.03Å; Y226-I368 WeakPolarHBondContact OH-CG1 3.34Å; Y226-I368 PolarHBondContact OH-N 3.02Å; L364-I368 HydrophobicContact CG-CD1 4.42Å; L364-I368 WeakPolarHBondContact O-CG1 3.33Å; L364-I368 PolarHBondContact O-N 3.06Å; V365-I368 PolarHBondContact O-N 3.46Å; I368-N370 VanDerWaalsContact C-N 3.34Å; I368-N370 PolarHBondContact O-N 3.31Å; I368-Y371 WeakPolarHBondContact O-CB 3.49Å; I368-Y371 PolarHBondContact O-N 2.9Å; I368-F372 HydrophobicContact CG2-CD2 3.93Å; I368-F372 HydrophobicContact CG2-CE2 3.74Å; I368-F372 VanDerWaalsContact O-CD2 3.3Å; I368-F372 WeakPolarHBondContact O-CD2 3.37Å; I368-F372 PolarHBondContact O-N 3.21Å; I368-F372 VanDerWaalsContact O-N 3.16Å; I368-V453 HydrophobicContact CG2-CG1 4.33Å
369	V	87.8	Confident	85.3	Confident	77 Å²	77	54 Å²	54	47%	0.467	29%	0.29	S	S	.	.	H	α-helix	trans	-63.1	-41.6	177.8	173.5	0	0	0	0	111.1	V365 T366 Y371 F372 I373	V365-V369 WeakPolarHBondContact O-CG2 3.35Å; V365-V369 PolarHBondContact O-N 3.05Å; V365-V369 VanDerWaalsContact O-N 3.08Å; T366-V369 PolarHBondContact O-N 3.07Å; V369-Y371 VanDerWaalsContact C-N 3.33Å; V369-Y371 PolarHBondContact O-N 3.2Å; V369-F372 PolarHBondContact O-N 2.95Å; V369-I373 HydrophobicContact CG1-CD1 3.68Å; V369-I373 HydrophobicContact CG1-CG1 4.34Å; V369-I373 WeakPolarHBondContact O-CG1 3.4Å; V369-I373 PolarHBondContact O-N 2.95Å
370	N	89	Confident	84.9	Confident	23 Å²	23	54.3 Å²	54.3	12%	0.123	29%	0.294	C	S	.	.	H	α-helix	trans	-62.9	-36.4	176.5	179.5	54.3	0	0	0	112.9	T366 A367 I368 G374 F522 I525	T366-N370 VanDerWaalsContact O-CB 3.3Å; T366-N370 WeakPolarHBondContact O-CB 3Å; T366-N370 PolarHBondContact O-N 2.72Å; A367-N370 PolarHBondContact O-N 3.32Å; I368-N370 VanDerWaalsContact C-N 3.34Å; I368-N370 PolarHBondContact O-N 3.31Å; N370-G374 PolarHBondContact O-N 3Å; N370-F522 PolarHBondContact ND2-O 3.32Å; N370-I525 HydrophobicContact CB-CG2 3.96Å
371	Y	85.7	Confident	84.7	Confident	2 Å²	2	60.2 Å²	60.2	1%	0.008	33%	0.325	C	S	.	.	H	α-helix	trans	-62.5	-51.1	173.4	166.8	-96	0	0	0	111.2	A367 I368 V369 I373 G374 S375 V457 S460 T461 M516 V519	A367-Y371 PolarHBondContact O-N 3.36Å; I368-Y371 WeakPolarHBondContact O-CB 3.49Å; I368-Y371 PolarHBondContact O-N 2.9Å; V369-Y371 VanDerWaalsContact C-N 3.33Å; V369-Y371 PolarHBondContact O-N 3.2Å; Y371-I373 PolarHBondContact O-N 2.82Å; Y371-G374 PolarHBondContact O-N 3.43Å; Y371-S375 PolarHBondContact O-N 3.47Å; Y371-V457 HydrophobicContact CD1-CG2 4.3Å; Y371-V457 HydrophobicContact CE1-CB 4.44Å; Y371-V457 HydrophobicContact CE1-CG1 4.16Å; Y371-V457 HydrophobicContact CE1-CG2 3.94Å; Y371-S460 WeakPolarHBondContact CE1-OG 3.45Å; Y371-S460 PolarHBondContact OH-OG 3.39Å; Y371-T461 PolarHBondContact OH-N 3.44Å; Y371-T461 PolarHBondContact OH-OG1 3.32Å; Y371-M516 HydrophobicContact CD2-CB 4.46Å; Y371-M516 HydrophobicContact CE2-CG 4.39Å; Y371-V519 HydrophobicContact CD2-CB 4.4Å; Y371-V519 HydrophobicContact CD2-CG1 4.22Å; Y371-V519 HydrophobicContact CE2-CB 4.06Å; Y371-V519 HydrophobicContact CE2-CG1 3.82Å
372	F	86.8	Confident	84.8	Confident	62 Å²	62	61.1 Å²	61.1	27%	0.272	33%	0.328	S	S	.	.	H	α-helix	trans	-62.7	-43.1	-179.9	-78.5	-67.9	0	0	0	111.9	I368 V369 G374 S375 F376 V457	I368-F372 HydrophobicContact CG2-CD2 3.93Å; I368-F372 HydrophobicContact CG2-CE2 3.74Å; I368-F372 VanDerWaalsContact O-CD2 3.3Å; I368-F372 WeakPolarHBondContact O-CD2 3.37Å; I368-F372 PolarHBondContact O-N 3.21Å; I368-F372 VanDerWaalsContact O-N 3.16Å; V369-F372 PolarHBondContact O-N 2.95Å; F372-G374 VanDerWaalsContact C-N 3.35Å; F372-G374 PolarHBondContact O-N 2.89Å; F372-S375 PolarHBondContact O-N 3.35Å; F372-S375 PolarHBondContact O-OG 3.02Å; F372-F376 WeakPolarHBondContact O-CD2 2.92Å; F372-V457 HydrophobicContact CE2-CG2 4.38Å; F372-V457 HydrophobicContact CZ-CG2 3.89Å
373	I	89.1	Confident	84.6	Confident	95 Å²	95	59.5 Å²	59.5	49%	0.487	31%	0.314	S	S	.	.	H	α-helix	trans	-61.7	-44.1	175	-65.9	169.1	0	0	0	110.9	V369 Y371 S375 F376 I377	V369-I373 HydrophobicContact CG1-CD1 3.68Å; V369-I373 HydrophobicContact CG1-CG1 4.34Å; V369-I373 WeakPolarHBondContact O-CG1 3.4Å; V369-I373 PolarHBondContact O-N 2.95Å; Y371-I373 PolarHBondContact O-N 2.82Å; I373-S375 VanDerWaalsContact C-N 3.31Å; I373-S375 PolarHBondContact O-N 3.26Å; I373-F376 PolarHBondContact O-N 3.49Å; I373-I377 HydrophobicContact CG2-CD1 4.11Å
374	G	86	Confident	84.2	Confident	1 Å²	1	58.2 Å²	58.2	1%	0.01	31%	0.306	C	S	.	.	H	α-helix	trans	-60.5	-37.7	177.7	0	0	0	0	0	113.4	N370 Y371 F372 F376 I377 V519	N370-G374 PolarHBondContact O-N 3Å; Y371-G374 PolarHBondContact O-N 3.43Å; F372-G374 VanDerWaalsContact C-N 3.35Å; F372-G374 PolarHBondContact O-N 2.89Å; G374-F376 PolarHBondContact O-N 3.39Å; G374-I377 PolarHBondContact O-N 3.23Å; G374-V519 CarbonylContact C-O 3.32Å; G374-V519 VanDerWaalsContact C-O 3.27Å
375	S	84.6	Confident	83.9	Confident	0 Å²	0	58.9 Å²	58.9	0%	0	31%	0.311	C	S	.	.	H	α-helix	trans	-59.8	-28.1	178.1	76	0	0	0	0	113.6	Y371 F372 I373 Y390	Y371-S375 PolarHBondContact O-N 3.47Å; F372-S375 PolarHBondContact O-N 3.35Å; F372-S375 PolarHBondContact O-OG 3.02Å; I373-S375 VanDerWaalsContact C-N 3.31Å; I373-S375 PolarHBondContact O-N 3.26Å; S375-Y390 WeakPolarHBondContact CB-OH 3.34Å; S375-Y390 WeakPolarHBondContact O-CE2 3.43Å; S375-Y390 WeakPolarHBondContact OG-CE2 3.5Å; S375-Y390 PolarHBondContact OG-OH 3.22Å
376	F	88	Confident	83.6	Confident	152 Å²	152	55.1 Å²	55.1	67%	0.667	29%	0.289	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.5	-12.9	177.2	-69	-71.2	0	0	0	113.9	F372 I373 G374 Y390	F372-F376 WeakPolarHBondContact O-CD2 2.92Å; I373-F376 PolarHBondContact O-N 3.49Å; G374-F376 PolarHBondContact O-N 3.39Å; F376-Y390 HydrophobicContact CD1-CD2 4Å; F376-Y390 AromaticContact CD1-CE2 3.65Å; F376-Y390 HydrophobicContact CD1-CE2 3.65Å; F376-Y390 HydrophobicContact CE1-CD2 4.19Å; F376-Y390 AromaticContact CE1-CE2 3.69Å; F376-Y390 HydrophobicContact CE1-CE2 3.69Å; F376-Y390 HydrophobicContact CG-CE2 4.17Å; F376-Y390 HydrophobicContact CZ-CE2 4.24Å
377	I	86.4	Confident	83.5	Confident	87 Å²	87	51.7 Å²	51.7	45%	0.446	27%	0.268	S	S	.	.			trans	-104.7	98.7	-175.3	-57.6	170.6	0	0	0	109.1	I373 G374 V379 F387	I373-I377 HydrophobicContact CG2-CD1 4.11Å; G374-I377 PolarHBondContact O-N 3.23Å; I377-V379 HydrophobicContact CG2-CG2 4.03Å; I377-F387 WeakPolarHBondContact O-CE1 3.47Å
378	S	76.6	Confident	83.3	Confident	79 Å²	79	52.4 Å²	52.4	55%	0.552	27%	0.271	S	S	*	.			trans	-78.1	122.6	172.9	57.3	0	0	0	0	111.1
379	V	81.4	Confident	83.3	Confident	61 Å²	61	51.4 Å²	51.4	37%	0.37	27%	0.267	S	S	.	.			trans	-116.5	132.2	178.8	-177.1	0	0	0	0	109.3	I377 L381 K382	I377-V379 HydrophobicContact CG2-CG2 4.03Å; V379-L381 HydrophobicContact CG1-CB 4.17Å; V379-L381 PolarHBondContact O-N 3.47Å; V379-K382 HydrophobicContact CB-CD 4.22Å; V379-K382 HydrophobicContact CB-CG 4.29Å; V379-K382 PolarHBondContact O-N 3.37Å
380	E	76.9	Confident	83.3	Confident	144 Å²	144	52.3 Å²	52.3	67%	0.673	26%	0.263	S	S	*	.	G	3₁₀ helix	trans	-61.4	-33	-175.3	-54	-150.8	119.2	0	0	113.8	K382 K383	E380-K382 PolarHBondContact O-N 2.93Å; E380-K382 VanDerWaalsContact O-N 3.17Å; E380-K383 HydrophobicContact CB-CD 4.36Å; E380-K383 WeakPolarHBondContact O-CB 3.24Å; E380-K383 PolarHBondContact O-N 2.86Å; E380-K383 IonicContact OE1-NZ 3.7Å; E380-K383 PolarHBondContact OE1-NZ 3.41Å
381	L	79.7	Confident	83.1	Confident	154 Å²	154	53.1 Å²	53.1	81%	0.806	27%	0.267	S	S	*	.	G	3₁₀ helix	trans	-63.3	-20.2	178.3	-127.9	125.2	0	0	0	113.5	V379	V379-L381 HydrophobicContact CG1-CB 4.17Å; V379-L381 PolarHBondContact O-N 3.47Å
382	K	82.4	Confident	83	Confident	38 Å²	38	56.2 Å²	56.2	17%	0.165	29%	0.293	C	S	.	.	G	3₁₀ helix	trans	-97.6	-12.1	-177.9	-61.5	-178.9	176.2	-170.4	0	113.6	V379 E380 S385 G386 F387 L518 S520	V379-K382 HydrophobicContact CB-CD 4.22Å; V379-K382 HydrophobicContact CB-CG 4.29Å; V379-K382 PolarHBondContact O-N 3.37Å; E380-K382 PolarHBondContact O-N 2.93Å; E380-K382 VanDerWaalsContact O-N 3.17Å; K382-S385 PolarHBondContact O-N 3.32Å; K382-G386 PolarHBondContact O-N 3.21Å; K382-F387 HydrophobicContact CB-CB 4.2Å; K382-F387 HydrophobicContact CB-CD1 3.87Å; K382-F387 HydrophobicContact CD-CD1 4.02Å; K382-F387 HydrophobicContact CD-CE1 4.39Å; K382-F387 PolarHBondContact O-N 2.87Å; K382-L518 HydrophobicContact CB-CD2 4.37Å; K382-L518 VanDerWaalsContact CD-O 3.32Å; K382-L518 WeakPolarHBondContact CD-O 3.24Å; K382-L518 VanDerWaalsContact CE-O 3.24Å; K382-L518 WeakPolarHBondContact CE-O 3.18Å; K382-L518 PolarHBondContact NZ-O 3.47Å; K382-S520 PolarHBondContact NZ-O 2.89Å
383	K	81.7	Confident	82.8	Confident	54 Å²	54	57.3 Å²	57.3	24%	0.235	30%	0.299	C	S	.	.	G	3₁₀ helix	trans	-56.2	-45.8	176	-65.7	176.7	-179.2	172.7	0	114.1	E380 S385 G386 F387 F388 F494	E380-K383 HydrophobicContact CB-CD 4.36Å; E380-K383 WeakPolarHBondContact O-CB 3.24Å; E380-K383 PolarHBondContact O-N 2.86Å; E380-K383 IonicContact OE1-NZ 3.7Å; E380-K383 PolarHBondContact OE1-NZ 3.41Å; K383-S385 PolarHBondContact O-N 2.93Å; K383-G386 PolarHBondContact O-N 3.04Å; K383-F387 WeakPolarHBondContact CA-O 3.47Å; K383-F388 HydrophobicContact CB-CD1 4.29Å; K383-F388 HydrophobicContact CB-CE1 3.89Å; K383-F388 HydrophobicContact CG-CD1 4.15Å; K383-F388 HydrophobicContact CG-CE1 4.23Å; K383-F388 WeakPolarHBondContact O-CZ 3.48Å; K383-F494 HydrophobicContact CB-CE2 3.8Å; K383-F494 HydrophobicContact CB-CZ 3.95Å; K383-F494 HydrophobicContact CD-CE2 4.35Å
384	P	80.3	Confident	82.4	Confident	8 Å²	8	52.8 Å²	52.8	5%	0.052	28%	0.276	C	S	.	.	G	3₁₀ helix	trans	-65.3	-25	-179.9	26.6	-37	0	0	0	113.2	G386 G471 L473 F494	P384-G386 VanDerWaalsContact C-N 3.26Å; P384-G471 WeakPolarHBondContact O-CA 3.22Å; P384-G471 PolarHBondContact O-N 3.42Å; P384-L473 HydrophobicContact CB-CD2 4.12Å; P384-L473 HydrophobicContact CG-CD2 3.77Å; P384-F494 HydrophobicContact CB-CE1 4.23Å
385	S	77.1	Confident	82.2	Confident	19 Å²	19	56.1 Å²	56.1	13%	0.133	29%	0.292	C	S	.	.	G	3₁₀ helix	trans	-84.2	1.9	175.3	-52	0	0	0	0	113.3	K382 K383	K382-S385 PolarHBondContact O-N 3.32Å; K383-S385 PolarHBondContact O-N 2.93Å
386	G	78.9	Confident	82.2	Confident	0 Å²	0	65.6 Å²	65.6	0%	0	33%	0.328	C	S	.	.	T	Hydrogen-bonded Turn	trans	101.4	7	171.2	0	0	0	0	0	116.1	K382 K383 P384 I465 V466	K382-G386 PolarHBondContact O-N 3.21Å; K383-G386 PolarHBondContact O-N 3.04Å; P384-G386 VanDerWaalsContact C-N 3.26Å; G386-I465 VanDerWaalsContact O-CA 3.32Å; G386-I465 WeakPolarHBondContact O-CA 3.49Å; G386-V466 PolarHBondContact O-N 2.95Å; G386-V466 VanDerWaalsContact O-N 3.1Å
387	F	85.9	Confident	81.8	Confident	1 Å²	1	61.7 Å²	61.7	0%	0.004	31%	0.312	C	S	.	.	B	Isolated β-bridge	trans	-98.2	115.3	177.1	174.5	-110.5	0	0	0	111.9	I377 K382 K383 C464 I465 L518 V519	I377-F387 WeakPolarHBondContact O-CE1 3.47Å; K382-F387 HydrophobicContact CB-CB 4.2Å; K382-F387 HydrophobicContact CB-CD1 3.87Å; K382-F387 HydrophobicContact CD-CD1 4.02Å; K382-F387 HydrophobicContact CD-CE1 4.39Å; K382-F387 PolarHBondContact O-N 2.87Å; K383-F387 WeakPolarHBondContact CA-O 3.47Å; F387-C464 HydrophobicContact CD2-CB 4.08Å; F387-C464 HydrophobicContact CE2-CB 3.86Å; F387-I465 HydrophobicContact CD2-CG1 4.2Å; F387-L518 HydrophobicContact CB-CD2 3.59Å; F387-L518 HydrophobicContact CG-CD2 4.43Å; F387-V519 HydrophobicContact CD2-CG1 4.45Å; F387-V519 HydrophobicContact CD2-CG2 3.88Å; F387-V519 HydrophobicContact CE2-CB 4.42Å; F387-V519 HydrophobicContact CE2-CG1 3.89Å; F387-V519 HydrophobicContact CE2-CG2 4.15Å; F387-V519 HydrophobicContact CZ-CG1 4.41Å
388	F	82	Confident	81.4	Confident	15 Å²	15	57.7 Å²	57.7	7%	0.066	29%	0.291	C	S	.	.			trans	-115.7	-3.4	-176.6	-64.9	-77.5	0	0	0	113.6	K383 I394 C464 V466 F492 F494 F496	K383-F388 HydrophobicContact CB-CD1 4.29Å; K383-F388 HydrophobicContact CB-CE1 3.89Å; K383-F388 HydrophobicContact CG-CD1 4.15Å; K383-F388 HydrophobicContact CG-CE1 4.23Å; K383-F388 WeakPolarHBondContact O-CZ 3.48Å; F388-I394 HydrophobicContact CB-CD1 3.62Å; F388-I394 HydrophobicContact CD2-CD1 4.09Å; F388-I394 HydrophobicContact CG-CD1 4.21Å; F388-C464 PolarHBondContact N-O 3.42Å; F388-V466 HydrophobicContact CD2-CG1 3.92Å; F388-V466 HydrophobicContact CD2-CG2 4.49Å; F388-V466 HydrophobicContact CE2-CG1 3.92Å; F388-V466 HydrophobicContact CE2-CG2 3.94Å; F388-F492 HydrophobicContact CB-CD2 4.27Å; F388-F492 HydrophobicContact CB-CE2 4.24Å; F388-F492 HydrophobicContact CB-CG 4.47Å; F388-F492 HydrophobicContact CB-CZ 4.41Å; F388-F492 HydrophobicContact CD1-CB 3.59Å; F388-F492 HydrophobicContact CD1-CD1 4.17Å; F388-F492 AromaticContact CD1-CD2 3.91Å; F388-F492 HydrophobicContact CD1-CD2 3.91Å; F388-F492 AromaticContact CD1-CG 3.61Å; F388-F492 HydrophobicContact CD1-CG 3.61Å; F388-F492 HydrophobicContact CE1-CB 3.58Å; F388-F492 HydrophobicContact CE1-CD2 4.45Å; F388-F492 HydrophobicContact CE1-CG 4.11Å; F388-F492 HydrophobicContact CG-CD2 4.01Å; F388-F492 HydrophobicContact CG-CE2 4.45Å; F388-F492 HydrophobicContact CG-CG 4.15Å; F388-F492 HydrophobicContact CZ-CB 4.48Å; F388-F494 AromaticContact CE1-CD2 3.61Å; F388-F494 HydrophobicContact CE1-CD2 3.61Å; F388-F494 AromaticContact CE1-CE2 4Å; F388-F494 HydrophobicContact CE1-CE2 4Å; F388-F494 HydrophobicContact CE1-CG 4.41Å; F388-F494 HydrophobicContact CZ-CB 4.37Å; F388-F494 AromaticContact CZ-CD2 3.92Å; F388-F494 HydrophobicContact CZ-CD2 3.92Å; F388-F494 HydrophobicContact CZ-CG 4.28Å; F388-F496 HydrophobicContact CE2-CE2 4.03Å; F388-F496 AromaticContact CZ-CE2 3.88Å; F388-F496 HydrophobicContact CZ-CE2 3.88Å; F388-F496 HydrophobicContact CZ-CZ 4.23Å
389	G	83.9	Confident	81.4	Confident	7 Å²	7	57.8 Å²	57.8	7%	0.072	28%	0.284	C	S	.	.			trans	79.3	178.9	-171.7	0	0	0	0	0	112	D391 C464	G389-D391 PolarHBondContact O-N 3.45Å; G389-D391 VanDerWaalsContact O-N 3.09Å; G389-C464 WeakPolarHBondContact O-CA 3.1Å
390	Y	86.1	Confident	80.8	Confident	96 Å²	96	56.2 Å²	56.2	38%	0.376	28%	0.281	S	S	.	.	S	Bend	trans	-62.6	110.1	-176	-71.8	-81.8	0	0	0	112.1	S375 F376 S460 S463	S375-Y390 WeakPolarHBondContact CB-OH 3.34Å; S375-Y390 WeakPolarHBondContact O-CE2 3.43Å; S375-Y390 WeakPolarHBondContact OG-CE2 3.5Å; S375-Y390 PolarHBondContact OG-OH 3.22Å; F376-Y390 HydrophobicContact CD1-CD2 4Å; F376-Y390 AromaticContact CD1-CE2 3.65Å; F376-Y390 HydrophobicContact CD1-CE2 3.65Å; F376-Y390 HydrophobicContact CE1-CD2 4.19Å; F376-Y390 AromaticContact CE1-CE2 3.69Å; F376-Y390 HydrophobicContact CE1-CE2 3.69Å; F376-Y390 HydrophobicContact CG-CE2 4.17Å; F376-Y390 HydrophobicContact CZ-CE2 4.24Å; Y390-S460 WeakPolarHBondContact OH-CB 3.37Å; Y390-S463 WeakPolarHBondContact CD1-OG 3.46Å; Y390-S463 WeakPolarHBondContact CE1-OG 3.49Å
391	D	85.6	Confident	80.3	Confident	40 Å²	40	54.2 Å²	54.2	21%	0.214	28%	0.28	C	S	.	.			trans	-134.2	142.9	174.1	-169.6	-83.9	0	0	0	111.8	G389 E393 I394 M395 S463 F492	G389-D391 PolarHBondContact O-N 3.45Å; G389-D391 VanDerWaalsContact O-N 3.09Å; D391-E393 WeakPolarHBondContact OD1-CB 3.47Å; D391-E393 PolarHBondContact OD1-N 2.98Å; D391-I394 HydrophobicContact CB-CB 4.47Å; D391-I394 HydrophobicContact CB-CD1 4Å; D391-I394 HydrophobicContact CB-CG1 4.14Å; D391-M395 PolarHBondContact O-N 2.89Å; D391-M395 VanDerWaalsContact O-N 3.17Å; D391-S463 PolarHBondContact N-O 2.95Å; D391-S463 VanDerWaalsContact N-O 3.15Å; D391-F492 HydrophobicContact CB-CE2 4.48Å; D391-F492 HydrophobicContact CB-CZ 3.98Å
392	A	84.4	Confident	79.9	Confident	67 Å²	67	48.6 Å²	48.6	55%	0.554	25%	0.251	S	S	*	.	H	α-helix	trans	-74.1	-29.1	-176.2	0	0	0	0	0	113.2	W396	A392-W396 WeakPolarHBondContact O-CB 3.45Å; A392-W396 PolarHBondContact O-N 3.09Å
393	E	82.3	Confident	79.3	Confident	85 Å²	85	50.8 Å²	50.8	40%	0.397	26%	0.26	S	S	.	.	H	α-helix	trans	-73.6	-39.9	177.8	-67.2	175.6	-165.1	0	0	110.9	D391 M395 W396 E397 A488 K491	D391-E393 WeakPolarHBondContact OD1-CB 3.47Å; D391-E393 PolarHBondContact OD1-N 2.98Å; E393-M395 VanDerWaalsContact C-N 3.32Å; E393-W396 PolarHBondContact O-N 2.92Å; E393-E397 WeakPolarHBondContact O-CB 3.49Å; E393-E397 PolarHBondContact O-N 2.86Å; E393-A488 HydrophobicContact CB-CB 4.06Å; E393-K491 VanDerWaalsContact CD-NZ 3.35Å; E393-K491 IonicContact OE1-NZ 3.49Å; E393-K491 PolarHBondContact OE1-NZ 3.49Å; E393-K491 WeakPolarHBondContact OE2-CD 3.19Å; E393-K491 IonicContact OE2-NZ 2.69Å
394	I	81.3	Confident	78.6	Confident	1 Å²	1	50 Å²	50	1%	0.005	26%	0.256	C	S	.	.	H	α-helix	trans	-61.7	-45.2	173.1	-61.3	176.7	0	0	0	109.8	F388 D391 W396 E397 N398 I465 V466 A488 F492	F388-I394 HydrophobicContact CB-CD1 3.62Å; F388-I394 HydrophobicContact CD2-CD1 4.09Å; F388-I394 HydrophobicContact CG-CD1 4.21Å; D391-I394 HydrophobicContact CB-CB 4.47Å; D391-I394 HydrophobicContact CB-CD1 4Å; D391-I394 HydrophobicContact CB-CG1 4.14Å; I394-W396 VanDerWaalsContact C-N 3.33Å; I394-W396 PolarHBondContact O-N 3.49Å; I394-E397 PolarHBondContact O-N 3.47Å; I394-N398 WeakPolarHBondContact CG2-ND2 3.32Å; I394-N398 VanDerWaalsContact O-CB 3.24Å; I394-N398 WeakPolarHBondContact O-CB 3.34Å; I394-N398 VanDerWaalsContact O-CG 3.29Å; I394-N398 PolarHBondContact O-N 3.44Å; I394-N398 PolarHBondContact O-ND2 3.45Å; I394-I465 WeakPolarHBondContact CG2-O 3.47Å; I394-V466 HydrophobicContact CD1-CG1 4.32Å; I394-V466 HydrophobicContact CG1-CG1 4.32Å; I394-V466 HydrophobicContact CG2-CG1 4.4Å; I394-A488 HydrophobicContact CG1-CB 4.22Å; I394-F492 HydrophobicContact CD1-CE2 3.96Å; I394-F492 HydrophobicContact CG1-CE2 4.34Å
395	M	81.8	Confident	78.1	Confident	70 Å²	70	57.4 Å²	57.4	35%	0.345	30%	0.295	S	S	.	.	H	α-helix	trans	-57.6	-46.8	174.8	-176.4	178.9	65.9	0	0	111.3	D391 E393 N398 M399	D391-M395 PolarHBondContact O-N 2.89Å; D391-M395 VanDerWaalsContact O-N 3.17Å; E393-M395 VanDerWaalsContact C-N 3.32Å; M395-N398 CarbonylContact O-C 3.5Å; M395-N398 PolarHBondContact O-N 3.39Å; M395-M399 VanDerWaalsContact O-CG 3.31Å; M395-M399 WeakPolarHBondContact O-CG 3.3Å; M395-M399 PolarHBondContact O-N 2.84Å; M395-M399 VanDerWaalsContact O-N 3.1Å
396	W	83.1	Confident	77.9	Confident	199 Å²	199	59.6 Å²	59.6	75%	0.754	30%	0.303	S	S	*	.	H	α-helix	trans	-66.8	-42	-179.3	-169.7	-96.1	0	0	0	112.8	A392 E393 I394 N398 M399	A392-W396 WeakPolarHBondContact O-CB 3.45Å; A392-W396 PolarHBondContact O-N 3.09Å; E393-W396 PolarHBondContact O-N 2.92Å; I394-W396 VanDerWaalsContact C-N 3.33Å; I394-W396 PolarHBondContact O-N 3.49Å; W396-N398 VanDerWaalsContact C-N 3.27Å; W396-N398 PolarHBondContact O-N 3.26Å; W396-M399 HydrophobicContact CE3-SD 4.11Å; W396-M399 HydrophobicContact CZ3-SD 4.36Å; W396-M399 PolarHBondContact O-N 2.95Å; W396-M399 VanDerWaalsContact O-N 3.15Å
397	E	79.1	Confident	78.1	Confident	71 Å²	71	63.9 Å²	63.9	33%	0.332	33%	0.33	S	S	.	.	H	α-helix	trans	-59	-44.2	174	-171.9	171.4	177.9	0	0	109.8	E393 I394 M399 R467 A488	E393-E397 WeakPolarHBondContact O-CB 3.49Å; E393-E397 PolarHBondContact O-N 2.86Å; I394-E397 PolarHBondContact O-N 3.47Å; E397-M399 VanDerWaalsContact C-N 3.28Å; E397-M399 PolarHBondContact O-N 3.03Å; E397-R467 PolarHBondContact O-NH2 3.03Å; E397-A488 WeakPolarHBondContact OE2-CB 3.27Å; E397-A488 PolarHBondContact OE2-N 2.75Å
398	N	78.4	Confident	77.8	Confident	3 Å²	3	66 Å²	66	2%	0.016	34%	0.339	C	S	.	.	T	Hydrogen-bonded Turn	trans	-79.9	13.7	176.6	-68.6	-27.3	0	0	0	115.3	G237 H238 S239 I394 M395 W396 G462 I465 R467	G237-N398 CarbonylContact C-O 3.55Å; G237-N398 CarbonylContact O-C 3.51Å; G237-N398 WeakPolarHBondContact O-CA 3.42Å; H238-N398 CarbonylContact C-O 3.49Å; H238-N398 WeakPolarHBondContact CA-O 3.09Å; H238-N398 PolarHBondContact N-O 3.03Å; S239-N398 PolarHBondContact N-O 3.31Å; I394-N398 WeakPolarHBondContact CG2-ND2 3.32Å; I394-N398 VanDerWaalsContact O-CB 3.24Å; I394-N398 WeakPolarHBondContact O-CB 3.34Å; I394-N398 VanDerWaalsContact O-CG 3.29Å; I394-N398 PolarHBondContact O-N 3.44Å; I394-N398 PolarHBondContact O-ND2 3.45Å; M395-N398 CarbonylContact O-C 3.5Å; M395-N398 PolarHBondContact O-N 3.39Å; W396-N398 VanDerWaalsContact C-N 3.27Å; W396-N398 PolarHBondContact O-N 3.26Å; N398-G462 WeakPolarHBondContact CB-O 3.49Å; N398-G462 PolarHBondContact ND2-O 2.97Å; N398-I465 PolarHBondContact ND2-O 3.47Å; N398-R467 WeakPolarHBondContact OD1-CG 3.34Å; N398-R467 PolarHBondContact OD1-NE 2.67Å
399	M	76.1	Confident	77.8	Confident	80 Å²	80	68.9 Å²	68.9	39%	0.394	35%	0.351	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90	-20.6	170.1	-78.9	-168.6	86.4	0	0	112.9	H238 A240 M395 W396 E397	H238-M399 PolarHBondContact CD2-O 3.42Å; H238-M399 VanDerWaalsContact CD2-O 3.32Å; A240-M399 HydrophobicContact CB-CE 4.23Å; M395-M399 VanDerWaalsContact O-CG 3.31Å; M395-M399 WeakPolarHBondContact O-CG 3.3Å; M395-M399 PolarHBondContact O-N 2.84Å; M395-M399 VanDerWaalsContact O-N 3.1Å; W396-M399 HydrophobicContact CE3-SD 4.11Å; W396-M399 HydrophobicContact CZ3-SD 4.36Å; W396-M399 PolarHBondContact O-N 2.95Å; W396-M399 VanDerWaalsContact O-N 3.15Å; E397-M399 VanDerWaalsContact C-N 3.28Å; E397-M399 PolarHBondContact O-N 3.03Å
400	G	70.1	Confident	77.6	Confident	29 Å²	29	70 Å²	70	30%	0.299	36%	0.359	S	S	.	.	S	Bend	trans	-102.1	158.2	-168.1	0	0	0	0	0	117.5	G237 H238 D402 R467	G237-G400 PolarHBondContact O-N 2.88Å; H238-G400 PolarHBondContact CD2-O 2.82Å; G400-D402 PolarHBondContact O-N 3.43Å; G400-R467 PolarHBondContact O-NH2 3.35Å
401	P	66.9	Low	77.2	Confident	101 Å²	101	65.6 Å²	65.6	66%	0.656	34%	0.342	S	S	*	.			trans	-10.2	96.2	159.4	22.2	-9	0	0	0	123.9	H238 F403	H238-P401 WeakPolarHBondContact CD2-CD 3.05Å; H238-P401 WeakPolarHBondContact CE1-CA 3.11Å; H238-P401 WeakPolarHBondContact CE1-CB 3.27Å; H238-P401 WeakPolarHBondContact NE2-CA 3.16Å; H238-P401 WeakPolarHBondContact NE2-CB 3.49Å; H238-P401 WeakPolarHBondContact NE2-CD 3.22Å; H238-P401 WeakPolarHBondContact NE2-CG 3.04Å; P401-F403 HydrophobicContact CB-CD2 4.38Å; P401-F403 HydrophobicContact CB-CE2 4.18Å
402	D	71.2	Confident	77	Confident	36 Å²	36	63.7 Å²	63.7	19%	0.193	33%	0.331	C	S	.	.			trans	-150.1	74.9	158.7	-157.2	9.1	0	0	0	114.9	H238 G400 R404	H238-D402 PolarHBondContact CE1-N 3Å; H238-D402 VanDerWaalsContact CE1-N 3.32Å; G400-D402 PolarHBondContact O-N 3.43Å; D402-R404 IonicContact OD2-NH2 3.62Å
403	F	68.3	Low	76.9	Confident	84 Å²	84	60.6 Å²	60.6	37%	0.368	31%	0.305	S	S	.	.			trans	-78.2	116.6	174.4	-64.3	-79	0	0	0	111	E236 L241 P401 F408	E236-F403 HydrophobicContact CG-CD1 4.23Å; E236-F403 HydrophobicContact CG-CE1 3.7Å; E236-F403 HydrophobicContact CG-CZ 4.42Å; E236-F403 VanDerWaalsContact OE1-CE1 3.3Å; E236-F403 WeakPolarHBondContact OE1-CE1 3.5Å; L241-F403 HydrophobicContact CD1-CZ 4.2Å; P401-F403 HydrophobicContact CB-CD2 4.38Å; P401-F403 HydrophobicContact CB-CE2 4.18Å; F403-F408 HydrophobicContact CE1-CB 4.39Å; F403-F408 HydrophobicContact CZ-CB 4.39Å
404	R	67.6	Low	76.8	Confident	38 Å²	38	56.7 Å²	56.7	14%	0.143	29%	0.287	C	S	.	.	S	Bend	trans	-105.5	113.1	166.2	-55.4	-176.1	-179.3	167	11.9	109.1	Q235 D402 E406 D468 Y511	Q235-R404 PolarHBondContact OE1-O 2.87Å; D402-R404 IonicContact OD2-NH2 3.62Å; R404-E406 PolarHBondContact O-N 3.42Å; R404-D468 IonicContact CZ-OD1 3.3Å; R404-D468 IonicContact CZ-OD2 2.7Å; R404-D468 IonicContact NH1-OD1 2.88Å; R404-D468 PolarHBondContact NH1-OD1 3.44Å; R404-D468 IonicContact NH1-OD2 3.67Å; R404-D468 IonicContact NH2-OD1 3.37Å; R404-D468 PolarHBondContact NH2-OD1 3.27Å; R404-D468 IonicContact NH2-OD2 2.77Å; R404-D468 PolarHBondContact NH2-OD2 3.45Å; R404-Y511 PolarHBondContact NH1-OH 3.16Å
405	D	69.4	Low	76.8	Confident	164 Å²	164	56.8 Å²	56.8	88%	0.877	29%	0.288	S	S	*	.	S	Bend	trans	60.5	-9.1	174.7	-53.9	-41.8	0	0	0	117.6
406	E	74.1	Confident	76.9	Confident	64 Å²	64	53.5 Å²	53.5	30%	0.299	27%	0.271	S	S	.	.			trans	-113.8	159.4	179.8	-69.3	-65.8	169.6	0	0	113.6	R404 S410 V411	R404-E406 PolarHBondContact O-N 3.42Å; E406-S410 WeakPolarHBondContact OE2-CB 3.43Å; E406-S410 PolarHBondContact OE2-OG 2.98Å; E406-V411 HydrophobicContact CB-CG2 4.26Å
407	T	82.4	Confident	76.9	Confident	91 Å²	91	44 Å²	44	56%	0.558	24%	0.236	S	C	*	.			trans	-113.3	156.2	177.7	64.2	0	0	0	0	111.9	F409 S410 V411	T407-F409 PolarHBondContact O-N 3.47Å; T407-F409 VanDerWaalsContact O-N 3.11Å; T407-S410 WeakPolarHBondContact O-CA 3.41Å; T407-S410 VanDerWaalsContact O-CB 3.3Å; T407-S410 WeakPolarHBondContact O-CB 3.35Å; T407-S410 PolarHBondContact O-N 3.36Å; T407-S410 PolarHBondContact OG1-N 2.91Å; T407-V411 WeakPolarHBondContact O-CG2 3.47Å; T407-V411 PolarHBondContact O-N 3.48Å
408	F	79.6	Confident	76.9	Confident	45 Å²	45	40.7 Å²	40.7	20%	0.197	22%	0.22	C	C	.	.	H	α-helix	trans	-46.4	-44.2	178	176.4	-96.5	0	0	0	114.1	E236 L241 V244 I245 F403 V411 F412	E236-F408 WeakPolarHBondContact OE1-CA 3.12Å; L241-F408 HydrophobicContact CD2-CD2 4.45Å; L241-F408 HydrophobicContact CD2-CE2 4.12Å; V244-F408 HydrophobicContact CG1-CZ 4.4Å; I245-F408 HydrophobicContact CD1-CD2 4.03Å; I245-F408 HydrophobicContact CD1-CE2 3.76Å; I245-F408 HydrophobicContact CD1-CZ 4.4Å; I245-F408 HydrophobicContact CG1-CD2 4.21Å; I245-F408 HydrophobicContact CG1-CE2 3.45Å; I245-F408 VanDerWaalsContact CG1-CE2 3.45Å; I245-F408 HydrophobicContact CG1-CZ 3.69Å; F403-F408 HydrophobicContact CE1-CB 4.39Å; F403-F408 HydrophobicContact CZ-CB 4.39Å; F408-V411 PolarHBondContact O-N 3.39Å; F408-F412 PolarHBondContact O-N 3.3Å
409	F	81.5	Confident	77.1	Confident	75 Å²	75	41.1 Å²	41.1	33%	0.329	22%	0.224	S	C	.	.	H	α-helix	trans	-79	-25.8	-179	-69.6	-76	0	0	0	113.6	T407 A413 V653	T407-F409 PolarHBondContact O-N 3.47Å; T407-F409 VanDerWaalsContact O-N 3.11Å; F409-A413 WeakPolarHBondContact O-CB 3.48Å; F409-A413 PolarHBondContact O-N 3.29Å; F409-V653 HydrophobicContact CB-CG1 3.82Å; F409-V653 HydrophobicContact CD1-CB 4.22Å; F409-V653 HydrophobicContact CD1-CG1 3.43Å; F409-V653 VanDerWaalsContact CD1-CG1 3.43Å; F409-V653 HydrophobicContact CD2-CG1 3.28Å; F409-V653 HydrophobicContact CE1-CB 4.38Å; F409-V653 HydrophobicContact CE1-CG1 3.69Å; F409-V653 HydrophobicContact CE2-CG1 3.56Å; F409-V653 HydrophobicContact CG-CB 4.38Å; F409-V653 HydrophobicContact CG-CG1 3.21Å; F409-V653 HydrophobicContact CZ-CG1 3.75Å
410	S	79.5	Confident	77.4	Confident	32 Å²	32	37.3 Å²	37.3	22%	0.224	21%	0.206	C	C	.	.	H	α-helix	trans	-64.2	-46.2	169.2	-169.9	0	0	0	0	110	E406 T407 F412 A413 I414	E406-S410 WeakPolarHBondContact OE2-CB 3.43Å; E406-S410 PolarHBondContact OE2-OG 2.98Å; T407-S410 WeakPolarHBondContact O-CA 3.41Å; T407-S410 VanDerWaalsContact O-CB 3.3Å; T407-S410 WeakPolarHBondContact O-CB 3.35Å; T407-S410 PolarHBondContact O-N 3.36Å; T407-S410 PolarHBondContact OG1-N 2.91Å; S410-F412 PolarHBondContact O-N 3.43Å; S410-A413 WeakPolarHBondContact O-CB 3.39Å; S410-A413 PolarHBondContact O-N 3.46Å; S410-A413 VanDerWaalsContact O-N 3.11Å; S410-I414 WeakPolarHBondContact O-CG1 3.27Å; S410-I414 PolarHBondContact O-N 2.91Å
411	V	78.6	Confident	77.8	Confident	3 Å²	3	36.1 Å²	36.1	2%	0.018	19%	0.193	C	C	.	.	H	α-helix	trans	-64.1	-41.6	176.3	-178.9	0	0	0	0	111.5	L232 E236 I245 E406 T407 F408 A413 I414 F415	L232-V411 HydrophobicContact CB-CG1 4.36Å; L232-V411 HydrophobicContact CD2-CG1 3.34Å; L232-V411 HydrophobicContact CG-CG1 3.59Å; E236-V411 HydrophobicContact CG-CG1 4.34Å; E236-V411 HydrophobicContact CG-CG2 4.27Å; I245-V411 HydrophobicContact CD1-CB 4.49Å; I245-V411 HydrophobicContact CD1-CG1 4.07Å; E406-V411 HydrophobicContact CB-CG2 4.26Å; T407-V411 WeakPolarHBondContact O-CG2 3.47Å; T407-V411 PolarHBondContact O-N 3.48Å; F408-V411 PolarHBondContact O-N 3.39Å; V411-A413 VanDerWaalsContact C-N 3.33Å; V411-A413 PolarHBondContact O-N 3.48Å; V411-I414 PolarHBondContact O-N 3.01Å; V411-F415 PolarHBondContact O-N 3.48Å
412	F	82	Confident	78.7	Confident	0 Å²	0	31.4 Å²	31.4	0%	0	16%	0.162	C	C	.	.	H	α-helix	trans	-58.4	-43.7	171.4	176.4	-84.4	0	0	0	111.9	I245 M248 A249 F408 S410 I414 F415 F416 V650 I654	I245-F412 HydrophobicContact CG2-CB 4.45Å; I245-F412 HydrophobicContact CG2-CD2 3.94Å; M248-F412 HydrophobicContact CB-CE2 4.1Å; M248-F412 HydrophobicContact CG-CE2 3.99Å; M248-F412 HydrophobicContact SD-CD2 4.09Å; M248-F412 HydrophobicContact SD-CE2 3.81Å; M248-F412 HydrophobicContact SD-CZ 4.42Å; A249-F412 HydrophobicContact CB-CE2 4.3Å; F408-F412 PolarHBondContact O-N 3.3Å; S410-F412 PolarHBondContact O-N 3.43Å; F412-I414 VanDerWaalsContact C-N 3.28Å; F412-I414 PolarHBondContact O-N 3.48Å; F412-F415 PolarHBondContact O-N 2.82Å; F412-F416 HydrophobicContact CE1-CB 4.06Å; F412-F416 AromaticContact CE1-CD2 3.93Å; F412-F416 HydrophobicContact CE1-CD2 3.93Å; F412-F416 HydrophobicContact CE1-CG 4.22Å; F412-F416 HydrophobicContact CZ-CB 4.38Å; F412-F416 AromaticContact CZ-CD2 3.62Å; F412-F416 HydrophobicContact CZ-CD2 3.62Å; F412-F416 HydrophobicContact CZ-CE2 4.36Å; F412-F416 HydrophobicContact CZ-CG 4.34Å; F412-F416 WeakPolarHBondContact O-CB 3.18Å; F412-F416 PolarHBondContact O-N 3.02Å; F412-V650 HydrophobicContact CD1-CG1 3.87Å; F412-V650 HydrophobicContact CE1-CG1 3.2Å; F412-V650 HydrophobicContact CZ-CG1 3.81Å; F412-I654 HydrophobicContact CD1-CD1 4.01Å; F412-I654 HydrophobicContact CD1-CG1 4.44Å; F412-I654 HydrophobicContact CE1-CD1 4.15Å
413	A	81.6	Confident	79.1	Confident	1 Å²	1	29.8 Å²	29.8	1%	0.008	15%	0.154	C	C	.	.	H	α-helix	trans	-64.7	-34.4	179.8	0	0	0	0	0	112.6	F409 S410 V411 P600 S603 I654	F409-A413 WeakPolarHBondContact O-CB 3.48Å; F409-A413 PolarHBondContact O-N 3.29Å; S410-A413 WeakPolarHBondContact O-CB 3.39Å; S410-A413 PolarHBondContact O-N 3.46Å; S410-A413 VanDerWaalsContact O-N 3.11Å; V411-A413 VanDerWaalsContact C-N 3.33Å; V411-A413 PolarHBondContact O-N 3.48Å; A413-P600 HydrophobicContact CB-CB 4.13Å; A413-P600 HydrophobicContact CB-CG 4.25Å; A413-S603 WeakPolarHBondContact O-CB 3.48Å; A413-S603 PolarHBondContact O-OG 3.15Å; A413-I654 HydrophobicContact CB-CB 4.28Å; A413-I654 HydrophobicContact CB-CD1 3.84Å; A413-I654 HydrophobicContact CB-CG1 3.85Å; A413-I654 HydrophobicContact CB-CG2 3.46Å; A413-I654 VanDerWaalsContact CB-CG2 3.46Å
414	I	80.3	Confident	79.5	Confident	4 Å²	4	26 Å²	26	2%	0.021	14%	0.138	C	C	.	.	H	α-helix	trans	-68.8	-44.5	174	-69.3	168.8	0	0	0	109.3	L228 S410 V411 F412 P417 N596	L228-I414 HydrophobicContact CB-CG2 4.13Å; L228-I414 HydrophobicContact CD2-CB 4.37Å; L228-I414 HydrophobicContact CD2-CG2 3.27Å; L228-I414 WeakPolarHBondContact CD2-O 3.37Å; L228-I414 HydrophobicContact CG-CG2 3.54Å; S410-I414 WeakPolarHBondContact O-CG1 3.27Å; S410-I414 PolarHBondContact O-N 2.91Å; V411-I414 PolarHBondContact O-N 3.01Å; F412-I414 VanDerWaalsContact C-N 3.28Å; F412-I414 PolarHBondContact O-N 3.48Å; I414-P417 WeakPolarHBondContact O-CD 3.33Å; I414-N596 HydrophobicContact CD1-CB 4.47Å
415	F	81	Confident	79.8	Confident	3 Å²	3	24.2 Å²	24.2	1%	0.013	13%	0.132	C	C	.	.	H	α-helix	trans	-71.1	-37	-179.1	179	-109.6	0	0	0	115	Y229 L232 I245 V246 A249 V411 F412 P417 A418 Y454	Y229-F415 HydrophobicContact CD2-CE2 4.45Å; Y229-F415 HydrophobicContact CE2-CE2 4.35Å; L232-F415 HydrophobicContact CD1-CB 3.6Å; L232-F415 HydrophobicContact CD1-CD2 3.17Å; L232-F415 HydrophobicContact CD1-CE2 3.99Å; L232-F415 HydrophobicContact CD1-CG 3.56Å; L232-F415 HydrophobicContact CG-CB 4.33Å; I245-F415 HydrophobicContact CG2-CB 4.07Å; I245-F415 HydrophobicContact CG2-CD1 3.59Å; I245-F415 HydrophobicContact CG2-CE1 4.34Å; I245-F415 HydrophobicContact CG2-CG 4.02Å; V246-F415 HydrophobicContact CB-CE1 4.39Å; V246-F415 HydrophobicContact CB-CZ 4.35Å; V246-F415 HydrophobicContact CG1-CZ 4.48Å; V246-F415 HydrophobicContact CG2-CE1 3.98Å; V246-F415 HydrophobicContact CG2-CE2 4.26Å; V246-F415 HydrophobicContact CG2-CZ 3.64Å; A249-F415 HydrophobicContact CB-CD1 4.14Å; A249-F415 HydrophobicContact CB-CE1 3.79Å; V411-F415 PolarHBondContact O-N 3.48Å; F412-F415 PolarHBondContact O-N 2.82Å; F415-P417 VanDerWaalsContact C-N 3.34Å; F415-P417 WeakPolarHBondContact O-CD 3.39Å; F415-P417 VanDerWaalsContact O-N 3.12Å; F415-A418 HydrophobicContact CD2-CB 4.13Å; F415-A418 HydrophobicContact CE2-CB 3.96Å; F415-A418 HydrophobicContact CZ-CB 4.4Å; F415-A418 WeakPolarHBondContact O-CB 3.32Å; F415-A418 PolarHBondContact O-N 3.43Å; F415-Y454 HydrophobicContact CE2-CD2 4.4Å; F415-Y454 AromaticContact CZ-CD2 3.86Å; F415-Y454 HydrophobicContact CZ-CD2 3.86Å; F415-Y454 HydrophobicContact CZ-CE2 4.31Å
416	F	83.9	Confident	80.2	Confident	0 Å²	0	16.6 Å²	16.6	0%	0	9%	0.091	C	C	.	.	H	α-helix	trans	-51.9	-37.4	-169.5	-175.4	-97.8	0	0	0	115.7	A249 V252 F412 A418 A419 T420 F606 L607 Y610	A249-F416 HydrophobicContact CB-CD2 4.46Å; V252-F416 HydrophobicContact CB-CE2 4.42Å; V252-F416 HydrophobicContact CG1-CE2 3.89Å; V252-F416 HydrophobicContact CG1-CZ 4.17Å; F412-F416 HydrophobicContact CE1-CB 4.06Å; F412-F416 AromaticContact CE1-CD2 3.93Å; F412-F416 HydrophobicContact CE1-CD2 3.93Å; F412-F416 HydrophobicContact CE1-CG 4.22Å; F412-F416 HydrophobicContact CZ-CB 4.38Å; F412-F416 AromaticContact CZ-CD2 3.62Å; F412-F416 HydrophobicContact CZ-CD2 3.62Å; F412-F416 HydrophobicContact CZ-CE2 4.36Å; F412-F416 HydrophobicContact CZ-CG 4.34Å; F412-F416 WeakPolarHBondContact O-CB 3.18Å; F412-F416 PolarHBondContact O-N 3.02Å; F416-A418 PolarHBondContact O-N 3.33Å; F416-A418 VanDerWaalsContact O-N 3.09Å; F416-A419 PolarHBondContact O-N 2.91Å; F416-T420 HydrophobicContact CD1-CG2 3.93Å; F416-T420 HydrophobicContact CE1-CG2 3.71Å; F416-T420 HydrophobicContact CZ-CG2 4.45Å; F416-T420 WeakPolarHBondContact O-CG2 3.3Å; F416-T420 PolarHBondContact O-N 2.73Å; F416-F606 HydrophobicContact CE1-CB 4.02Å; F416-L607 HydrophobicContact CD1-CG 4.09Å; F416-L607 HydrophobicContact CD2-CD2 4.39Å; F416-L607 HydrophobicContact CE1-CD1 4.44Å; F416-L607 HydrophobicContact CE1-CD2 3.84Å; F416-L607 HydrophobicContact CE1-CG 3.56Å; F416-L607 HydrophobicContact CE2-CD2 3.68Å; F416-L607 HydrophobicContact CE2-CG 4.27Å; F416-L607 HydrophobicContact CZ-CD2 3.35Å; F416-L607 HydrophobicContact CZ-CG 3.66Å; F416-Y610 HydrophobicContact CE1-CE2 4.35Å; F416-Y610 AromaticContact CZ-CD2 3.92Å; F416-Y610 HydrophobicContact CZ-CD2 3.92Å; F416-Y610 AromaticContact CZ-CE2 3.94Å; F416-Y610 HydrophobicContact CZ-CE2 3.94Å
417	P	83.8	Confident	80.5	Confident	1 Å²	1	15.4 Å²	15.4	1%	0.006	9%	0.087	C	C	.	.	H	α-helix	trans	-56.2	-26.2	175.3	-24.1	37.7	0	0	0	113.5	M304 I414 F415 A419 T420 A599 I602 S603	M304-P417 HydrophobicContact CE-CB 3.86Å; M304-P417 HydrophobicContact CE-CG 4.03Å; M304-P417 HydrophobicContact SD-CB 3.74Å; M304-P417 HydrophobicContact SD-CG 4.05Å; I414-P417 WeakPolarHBondContact O-CD 3.33Å; F415-P417 VanDerWaalsContact C-N 3.34Å; F415-P417 WeakPolarHBondContact O-CD 3.39Å; F415-P417 VanDerWaalsContact O-N 3.12Å; P417-A419 VanDerWaalsContact C-N 3.31Å; P417-A419 PolarHBondContact O-N 2.86Å; P417-T420 PolarHBondContact O-N 3.25Å; P417-T420 PolarHBondContact O-OG1 2.98Å; P417-A599 HydrophobicContact CG-CB 4.36Å; P417-I602 HydrophobicContact CB-CG2 4.17Å; P417-I602 HydrophobicContact CG-CB 4.45Å; P417-I602 HydrophobicContact CG-CG2 4.15Å; P417-S603 WeakPolarHBondContact CD-OG 3.43Å; P417-S603 VanDerWaalsContact CG-OG 3.27Å; P417-S603 WeakPolarHBondContact CG-OG 3.04Å
418	A	79.6	Confident	80.1	Confident	0 Å²	0	13.5 Å²	13.5	0%	0	7%	0.073	C	C	.	.	H	α-helix	trans	-62.8	-38.3	175.7	0	0	0	0	0	112.7	P224 F415 F416 T420 Y454	P224-A418 HydrophobicContact CB-CB 3.49Å; P224-A418 VanDerWaalsContact CB-CB 3.49Å; P224-A418 HydrophobicContact CG-CB 3.55Å; F415-A418 HydrophobicContact CD2-CB 4.13Å; F415-A418 HydrophobicContact CE2-CB 3.96Å; F415-A418 HydrophobicContact CZ-CB 4.4Å; F415-A418 WeakPolarHBondContact O-CB 3.32Å; F415-A418 PolarHBondContact O-N 3.43Å; F416-A418 PolarHBondContact O-N 3.33Å; F416-A418 VanDerWaalsContact O-N 3.09Å; A418-T420 VanDerWaalsContact C-N 3.3Å; A418-Y454 HydrophobicContact CB-CE2 4.26Å; A418-Y454 PolarHBondContact O-OH 3.44Å
419	A	80.9	Confident	79.7	Confident	12 Å²	12	11.5 Å²	11.5	10%	0.099	6%	0.064	C	C	.	.	H	α-helix	trans	-84.8	-8.1	-179.3	0	0	0	0	0	112.2	A249 T253 F416 P417	A249-A419 HydrophobicContact CB-CB 3.92Å; T253-A419 HydrophobicContact CG2-CB 3.97Å; T253-A419 WeakPolarHBondContact CG2-O 3.43Å; F416-A419 PolarHBondContact O-N 2.91Å; P417-A419 VanDerWaalsContact C-N 3.31Å; P417-A419 PolarHBondContact O-N 2.86Å
420	T	83.4	Confident	79.1	Confident	1 Å²	1	9.3 Å²	9.3	1%	0.006	6%	0.063	C	C	.	.			trans	-72.7	174.3	176.4	72.2	0	0	0	0	111.6	S220 F416 P417 A418 F606 Y610	S220-T420 WeakPolarHBondContact CA-O 3.3Å; F416-T420 HydrophobicContact CD1-CG2 3.93Å; F416-T420 HydrophobicContact CE1-CG2 3.71Å; F416-T420 HydrophobicContact CZ-CG2 4.45Å; F416-T420 WeakPolarHBondContact O-CG2 3.3Å; F416-T420 PolarHBondContact O-N 2.73Å; P417-T420 PolarHBondContact O-N 3.25Å; P417-T420 PolarHBondContact O-OG1 2.98Å; A418-T420 VanDerWaalsContact C-N 3.3Å; T420-F606 HydrophobicContact CG2-CB 3.76Å; T420-F606 HydrophobicContact CG2-CD1 4.35Å; T420-F606 HydrophobicContact CG2-CD2 3.79Å; T420-F606 HydrophobicContact CG2-CE2 4.46Å; T420-F606 HydrophobicContact CG2-CG 3.72Å; T420-Y610 WeakPolarHBondContact CA-OH 3.41Å; T420-Y610 HydrophobicContact CG2-CE2 4.38Å
421	G	78.6	Confident	78.9	Confident	4 Å²	4	11.6 Å²	11.6	4%	0.041	7%	0.073	C	C	.	.			trans	96.7	7.9	178	0	0	0	0	0	115.6	H216 N219 L423 A424 Y610	H216-G421 PolarHBondContact ND1-O 2.9Å; N219-G421 WeakPolarHBondContact ND2-CA 3.22Å; G421-L423 PolarHBondContact O-N 2.92Å; G421-L423 VanDerWaalsContact O-N 3.12Å; G421-A424 VanDerWaalsContact O-CB 3.32Å; G421-A424 WeakPolarHBondContact O-CB 3.26Å; G421-A424 PolarHBondContact O-N 2.67Å; G421-A424 VanDerWaalsContact O-N 3.1Å; G421-Y610 PolarHBondContact N-OH 3.48Å
422	I	85.3	Confident	79	Confident	1 Å²	1	11.6 Å²	11.6	1%	0.005	7%	0.073	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56.3	-26.9	174.6	62	169.3	0	0	0	114.1	T253 T256 T443 I447 Y610	T253-I422 HydrophobicContact CG2-CG2 4.38Å; T256-I422 HydrophobicContact CG2-CD1 3.59Å; I422-T443 HydrophobicContact CB-CG2 4.13Å; I422-I447 HydrophobicContact CG2-CD1 3.68Å; I422-I447 HydrophobicContact CG2-CG1 3.85Å; I422-Y610 HydrophobicContact CD1-CE1 4.09Å; I422-Y610 HydrophobicContact CG1-CE1 4.06Å
423	L	80.6	Confident	78.8	Confident	2 Å²	2	14.6 Å²	14.6	1%	0.01	10%	0.098	C	C	.	.	T	Hydrogen-bonded Turn	trans	-84.7	-4.4	-178.2	-70.4	165.4	0	0	0	113.8	T260 F294 G421 G425 A426 N427 Y610 I613	T260-L423 HydrophobicContact CG2-CD2 3.81Å; F294-L423 HydrophobicContact CD2-CD1 3.83Å; F294-L423 HydrophobicContact CE1-CB 4.48Å; F294-L423 HydrophobicContact CE2-CB 4Å; F294-L423 HydrophobicContact CE2-CD1 3.45Å; F294-L423 VanDerWaalsContact CE2-CD1 3.45Å; F294-L423 HydrophobicContact CE2-CG 4.35Å; F294-L423 HydrophobicContact CZ-CB 3.67Å; F294-L423 HydrophobicContact CZ-CD1 3.87Å; F294-L423 HydrophobicContact CZ-CG 4.43Å; G421-L423 PolarHBondContact O-N 2.92Å; G421-L423 VanDerWaalsContact O-N 3.12Å; L423-G425 VanDerWaalsContact C-N 3.32Å; L423-G425 PolarHBondContact O-N 3.16Å; L423-A426 HydrophobicContact CD2-CB 4.49Å; L423-A426 PolarHBondContact O-N 3.39Å; L423-A426 VanDerWaalsContact O-N 3.09Å; L423-N427 PolarHBondContact O-N 2.97Å; L423-Y610 HydrophobicContact CD1-CE1 4.21Å; L423-I613 HydrophobicContact CD1-CD1 3.77Å; L423-I613 HydrophobicContact CD2-CD1 4.44Å
424	A	75.3	Confident	78.8	Confident	6 Å²	6	18.3 Å²	18.3	5%	0.05	12%	0.117	C	C	.	.	H	α-helix	trans	-60.4	-41.4	178.5	0	0	0	0	0	112.6	S215 N219 G421 A426 N427	S215-A424 PolarHBondContact OG-O 3.22Å; N219-A424 HydrophobicContact CB-CB 3.39Å; G421-A424 VanDerWaalsContact O-CB 3.32Å; G421-A424 WeakPolarHBondContact O-CB 3.26Å; G421-A424 PolarHBondContact O-N 2.67Å; G421-A424 VanDerWaalsContact O-N 3.1Å; A424-A426 VanDerWaalsContact C-N 3.27Å; A424-A426 PolarHBondContact O-N 3.22Å; A424-N427 WeakPolarHBondContact O-CB 3.46Å; A424-N427 PolarHBondContact O-N 3.31Å; A424-N427 VanDerWaalsContact O-N 3.16Å
425	G	73.6	Confident	78.9	Confident	0 Å²	0	18.9 Å²	18.9	0%	0	12%	0.121	C	C	.	.	H	α-helix	trans	-64.8	-30.6	175.6	0	0	0	0	0	113.3	L423	L423-G425 VanDerWaalsContact C-N 3.32Å; L423-G425 PolarHBondContact O-N 3.16Å
426	A	78.9	Confident	79.1	Confident	3 Å²	3	22.5 Å²	22.5	3%	0.025	14%	0.138	C	C	.	.	H	α-helix	trans	-77.3	-25.8	175.1	0	0	0	0	0	112.5	G273 A274 L277 L423 A424 I428 S429	G273-A426 CarbonylContact C-O 3.28Å; A274-A426 WeakPolarHBondContact CA-O 3.35Å; A274-A426 HydrophobicContact CB-CB 3.71Å; A274-A426 PolarHBondContact N-O 3.02Å; L277-A426 HydrophobicContact CD1-CB 4.43Å; L423-A426 HydrophobicContact CD2-CB 4.49Å; L423-A426 PolarHBondContact O-N 3.39Å; L423-A426 VanDerWaalsContact O-N 3.09Å; A424-A426 VanDerWaalsContact C-N 3.27Å; A424-A426 PolarHBondContact O-N 3.22Å; A426-I428 PolarHBondContact O-N 3.47Å; A426-S429 VanDerWaalsContact O-CB 3.24Å; A426-S429 WeakPolarHBondContact O-CB 3.38Å; A426-S429 PolarHBondContact O-N 3.16Å; A426-S429 PolarHBondContact O-OG 3.33Å
427	N	79.1	Confident	79.2	Confident	39 Å²	39	27 Å²	27	21%	0.209	16%	0.16	C	C	.	.	H	α-helix	trans	-65.3	-25.1	177.3	-77.9	-21.7	0	0	0	113.1	G273 A274 L423 A424	G273-N427 WeakPolarHBondContact CA-O 3.43Å; A274-N427 WeakPolarHBondContact CB-OD1 3.22Å; L423-N427 PolarHBondContact O-N 2.97Å; A424-N427 WeakPolarHBondContact O-CB 3.46Å; A424-N427 PolarHBondContact O-N 3.31Å; A424-N427 VanDerWaalsContact O-N 3.16Å
428	I	74.8	Confident	79.3	Confident	51 Å²	51	27.2 Å²	27.2	26%	0.262	16%	0.162	S	C	.	.	T	Hydrogen-bonded Turn	trans	-100.9	18.1	-179.9	-47.5	172.7	0	0	0	110.8	S215 A426 G430 D431	S215-I428 WeakPolarHBondContact OG-CD1 3.49Å; A426-I428 PolarHBondContact O-N 3.47Å; I428-G430 PolarHBondContact O-N 3.45Å; I428-D431 HydrophobicContact CG2-CB 3.82Å; I428-D431 PolarHBondContact O-N 3.08Å
429	S	71.9	Confident	79.7	Confident	3 Å²	3	27.2 Å²	27.2	2%	0.021	16%	0.162	C	C	.	.	T	Hydrogen-bonded Turn	trans	-54.2	-25.5	-176.4	62.6	0	0	0	0	114.9	G273 A426	G273-S429 WeakPolarHBondContact CA-OG 3.45Å; G273-S429 PolarHBondContact N-OG 2.84Å; G273-S429 PolarHBondContact O-OG 3.41Å; A426-S429 VanDerWaalsContact O-CB 3.24Å; A426-S429 WeakPolarHBondContact O-CB 3.38Å; A426-S429 PolarHBondContact O-N 3.16Å; A426-S429 PolarHBondContact O-OG 3.33Å
430	G	69.1	Low	80.2	Confident	30 Å²	30	27 Å²	27	31%	0.309	16%	0.16	S	C	.	.	T	Hydrogen-bonded Turn	trans	-79.4	-21.8	178.4	0	0	0	0	0	116	I428	I428-G430 PolarHBondContact O-N 3.45Å
431	D	74.9	Confident	80.5	Confident	79 Å²	79	32.2 Å²	32.2	42%	0.422	18%	0.182	S	C	.	.	S	Bend	trans	-99	5	-178	-53.9	-35	0	0	0	112	K205 F206 I428	K205-D431 CarbonylContact C-O 3.55Å; K205-D431 WeakPolarHBondContact CA-O 3.24Å; F206-D431 HydrophobicContact CD2-CB 3.99Å; F206-D431 HydrophobicContact CE2-CB 4.32Å; F206-D431 PolarHBondContact N-O 3Å; I428-D431 HydrophobicContact CG2-CB 3.82Å; I428-D431 PolarHBondContact O-N 3.08Å
432	L	79.7	Confident	81	Confident	4 Å²	4	32 Å²	32	2%	0.021	18%	0.18	C	C	.	.	B	Isolated β-bridge	trans	-89	142.4	179.6	-82.4	148.9	0	0	0	111.7	F206 V212 P435 A438 I439	F206-L432 WeakPolarHBondContact O-CA 3.31Å; V212-L432 HydrophobicContact CG2-CD1 3.65Å; V212-L432 HydrophobicContact CG2-CD2 3.67Å; V212-L432 HydrophobicContact CG2-CG 4.33Å; L432-P435 HydrophobicContact CB-CB 4.48Å; L432-A438 HydrophobicContact CD2-CB 3.82Å; L432-I439 HydrophobicContact CD1-CG1 4.48Å
433	A	78.4	Confident	81.2	Confident	63 Å²	63	32.1 Å²	32.1	52%	0.521	18%	0.181	S	C	.	.	S	Bend	trans	-64.5	-48.5	177.6	0	0	0	0	0	111.8	K205 F206	K205-A433 HydrophobicContact CB-CB 3.99Å; F206-A433 PolarHBondContact O-N 3.38Å
434	D	82.6	Confident	81.6	Confident	78 Å²	78	34.1 Å²	34.1	42%	0.417	19%	0.191	S	C	.	.			trans	-137.4	97.3	174.5	-177.7	-2.3	0	0	0	110.4	Q436 M437 A438	D434-Q436 PolarHBondContact OD1-N 3.49Å; D434-M437 WeakPolarHBondContact OD2-CB 3.43Å; D434-A438 WeakPolarHBondContact O-CB 3.27Å; D434-A438 PolarHBondContact O-N 3.47Å
435	P	81.6	Confident	82.4	Confident	16 Å²	16	37 Å²	37	10%	0.104	21%	0.205	C	C	.	.	H	α-helix	trans	-70.4	-30.3	-177	27.9	-36	0	0	0	113.8	V269 L432 M437 I439	V269-P435 HydrophobicContact CB-CB 4.08Å; V269-P435 HydrophobicContact CB-CG 3.51Å; V269-P435 HydrophobicContact CG1-CB 3.67Å; V269-P435 HydrophobicContact CG1-CG 3.51Å; V269-P435 HydrophobicContact CG2-CG 4.23Å; L432-P435 HydrophobicContact CB-CB 4.48Å; P435-M437 VanDerWaalsContact C-N 3.33Å; P435-M437 PolarHBondContact O-N 3Å; P435-I439 HydrophobicContact CB-CD1 4Å; P435-I439 WeakPolarHBondContact O-CB 3.42Å; P435-I439 WeakPolarHBondContact O-CD1 3.32Å; P435-I439 VanDerWaalsContact O-CG1 3.28Å; P435-I439 WeakPolarHBondContact O-CG1 3.39Å; P435-I439 PolarHBondContact O-N 3.37Å; P435-I439 VanDerWaalsContact O-N 3.11Å
436	Q	84.5	Confident	83.1	Confident	80 Å²	80	37 Å²	37	37%	0.374	21%	0.205	S	C	.	.	H	α-helix	trans	-67.7	-36.7	-176.5	-70.7	-176.7	-8.6	0	0	111.4	G267 V269 D434 P440	G267-Q436 PolarHBondContact O-NE2 3.39Å; V269-Q436 HydrophobicContact CG2-CG 4.06Å; D434-Q436 PolarHBondContact OD1-N 3.49Å; Q436-P440 WeakPolarHBondContact O-CD 3.33Å; Q436-P440 VanDerWaalsContact O-CG 3.32Å; Q436-P440 WeakPolarHBondContact O-CG 3.48Å
437	M	85.4	Confident	83.6	Confident	94 Å²	94	37.1 Å²	37.1	46%	0.463	21%	0.206	S	C	.	.	H	α-helix	trans	-87.1	-38.2	175.5	-172.2	-166.7	176.1	0	0	112.4	D434 P435 K441	D434-M437 WeakPolarHBondContact OD2-CB 3.43Å; P435-M437 VanDerWaalsContact C-N 3.33Å; P435-M437 PolarHBondContact O-N 3Å; M437-K441 HydrophobicContact CE-CD 4.04Å; M437-K441 HydrophobicContact CG-CD 4.29Å
438	A	87.5	Confident	84.1	Confident	5 Å²	5	40.2 Å²	40.2	4%	0.041	22%	0.222	C	C	.	.	H	α-helix	trans	-71.5	-42	-172.5	0	0	0	0	0	113.8	W208 V212 L432 D434 G442	W208-A438 HydrophobicContact CB-CB 3.43Å; W208-A438 VanDerWaalsContact CB-CB 3.43Å; V212-A438 HydrophobicContact CG2-CB 4.06Å; L432-A438 HydrophobicContact CD2-CB 3.82Å; D434-A438 WeakPolarHBondContact O-CB 3.27Å; D434-A438 PolarHBondContact O-N 3.47Å; A438-G442 PolarHBondContact O-N 3.01Å
439	I	88.3	Confident	84.8	Confident	0 Å²	0	40.7 Å²	40.7	0%	0	22%	0.224	C	C	.	.	H	α-helix	trans	-64	-52.6	-175.7	-63.9	167.4	0	0	0	110.5	V212 A264 L277 L432 P435 K441 G442 T443	V212-I439 HydrophobicContact CG2-CG1 4.42Å; A264-I439 HydrophobicContact CB-CB 4.12Å; A264-I439 HydrophobicContact CB-CD1 3.99Å; A264-I439 HydrophobicContact CB-CG2 4Å; L277-I439 HydrophobicContact CD1-CD1 3.93Å; L432-I439 HydrophobicContact CD1-CG1 4.48Å; P435-I439 HydrophobicContact CB-CD1 4Å; P435-I439 WeakPolarHBondContact O-CB 3.42Å; P435-I439 WeakPolarHBondContact O-CD1 3.32Å; P435-I439 VanDerWaalsContact O-CG1 3.28Å; P435-I439 WeakPolarHBondContact O-CG1 3.39Å; P435-I439 PolarHBondContact O-N 3.37Å; P435-I439 VanDerWaalsContact O-N 3.11Å; I439-K441 PolarHBondContact O-N 3.1Å; I439-G442 PolarHBondContact O-N 3.16Å; I439-T443 WeakPolarHBondContact O-CB 3.36Å; I439-T443 PolarHBondContact O-N 2.81Å; I439-T443 PolarHBondContact O-OG1 3.37Å
440	P	90.5	Very high	85.4	Confident	8 Å²	8	41.2 Å²	41.2	5%	0.052	23%	0.227	C	C	.	.	H	α-helix	trans	-62.2	-42.7	-178.3	-24	35.5	0	0	0	113.6	S261 T265 Q436 L444 F632	S261-P440 WeakPolarHBondContact OG-CA 3.3Å; T265-P440 HydrophobicContact CG2-CG 4.08Å; Q436-P440 WeakPolarHBondContact O-CD 3.33Å; Q436-P440 VanDerWaalsContact O-CG 3.32Å; Q436-P440 WeakPolarHBondContact O-CG 3.48Å; P440-L444 WeakPolarHBondContact O-CB 3.24Å; P440-L444 WeakPolarHBondContact O-CG 3.41Å; P440-L444 PolarHBondContact O-N 3.06Å; P440-F632 HydrophobicContact CB-CD2 4.11Å; P440-F632 HydrophobicContact CB-CE2 3.68Å; P440-F632 HydrophobicContact CB-CZ 4.43Å; P440-F632 HydrophobicContact CG-CD2 4.4Å; P440-F632 HydrophobicContact CG-CE2 4.45Å
441	K	89.1	Confident	86.1	Confident	111 Å²	111	40 Å²	40	48%	0.483	22%	0.215	S	C	.	.	H	α-helix	trans	-68.5	-46.1	179.8	-70.4	-169.7	178.2	-162.6	0	111.8	M437 I439 L445	M437-K441 HydrophobicContact CE-CD 4.04Å; M437-K441 HydrophobicContact CG-CD 4.29Å; I439-K441 PolarHBondContact O-N 3.1Å; K441-L445 WeakPolarHBondContact O-CB 3.47Å; K441-L445 PolarHBondContact O-N 3.34Å
442	G	88.9	Confident	86.7	Confident	0 Å²	0	41.2 Å²	41.2	0%	0	22%	0.22	C	C	.	.	H	α-helix	trans	-64.3	-51.8	-179	0	0	0	0	0	111.4	A438 I439 A446	A438-G442 PolarHBondContact O-N 3.01Å; I439-G442 PolarHBondContact O-N 3.16Å; G442-A446 WeakPolarHBondContact O-CB 3.24Å; G442-A446 PolarHBondContact O-N 3.16Å
443	T	89.6	Confident	87	Confident	3 Å²	3	42.6 Å²	42.6	2%	0.018	23%	0.229	C	C	.	.	H	α-helix	trans	-66.6	-45.9	-174.7	-51.3	0	0	0	0	112.5	I422 I439 A446 I447	I422-T443 HydrophobicContact CB-CG2 4.13Å; I439-T443 WeakPolarHBondContact O-CB 3.36Å; I439-T443 PolarHBondContact O-N 2.81Å; I439-T443 PolarHBondContact O-OG1 3.37Å; T443-A446 PolarHBondContact O-N 3.14Å; T443-I447 HydrophobicContact CG2-CD1 4.05Å; T443-I447 VanDerWaalsContact O-CG1 3.29Å; T443-I447 WeakPolarHBondContact O-CG1 3.35Å; T443-I447 PolarHBondContact O-N 2.98Å
444	L	90.8	Very high	87.2	Confident	44 Å²	44	39.9 Å²	39.9	23%	0.23	21%	0.205	C	C	.	.	H	α-helix	trans	-68.4	-40.4	-179	-67.6	174.8	0	0	0	112.6	L258 P440 A446 L448 F632	L258-L444 HydrophobicContact CD2-CD1 4.07Å; L258-L444 HydrophobicContact CD2-CD2 4.16Å; L258-L444 HydrophobicContact CG-CD2 4.41Å; P440-L444 WeakPolarHBondContact O-CB 3.24Å; P440-L444 WeakPolarHBondContact O-CG 3.41Å; P440-L444 PolarHBondContact O-N 3.06Å; L444-A446 VanDerWaalsContact C-N 3.29Å; L444-A446 PolarHBondContact O-N 3.38Å; L444-L448 PolarHBondContact O-N 3.33Å; L444-L448 VanDerWaalsContact O-N 3.12Å; L444-F632 HydrophobicContact CD1-CZ 3.79Å
445	L	90.9	Very high	87.3	Confident	65 Å²	65	39.2 Å²	39.2	34%	0.34	20%	0.201	S	C	.	.	H	α-helix	trans	-65.1	-38.3	175.6	-174.5	70.1	0	0	0	111	W208 L213 K441 L448 I449	W208-L445 HydrophobicContact CH2-CD2 4.1Å; W208-L445 HydrophobicContact CZ3-CD2 3.85Å; L213-L445 HydrophobicContact CD1-CD2 4.39Å; L213-L445 HydrophobicContact CD1-CG 4.5Å; L213-L445 HydrophobicContact CD2-CD2 4.31Å; K441-L445 WeakPolarHBondContact O-CB 3.47Å; K441-L445 PolarHBondContact O-N 3.34Å; L445-L448 PolarHBondContact O-N 3.43Å; L445-I449 HydrophobicContact CD1-CD1 4.29Å; L445-I449 HydrophobicContact CD2-CD1 4.29Å; L445-I449 HydrophobicContact CG-CD1 3.83Å; L445-I449 HydrophobicContact CG-CG1 4.47Å; L445-I449 VanDerWaalsContact O-CG1 3.3Å; L445-I449 WeakPolarHBondContact O-CG1 3.41Å; L445-I449 PolarHBondContact O-N 3.03Å
446	A	87.9	Confident	87.4	Confident	0 Å²	0	39.8 Å²	39.8	0%	0	21%	0.21	C	C	.	.	H	α-helix	trans	-66.3	-45.4	-179.8	0	0	0	0	0	111.9	L213 H216 G442 T443 L444 L448 I449 T450	L213-A446 HydrophobicContact CD1-CB 3.5Å; L213-A446 VanDerWaalsContact CD1-CB 3.5Å; H216-A446 HydrophobicContact CB-CB 3.64Å; H216-A446 WeakPolarHBondContact CD2-CB 2.97Å; H216-A446 VanDerWaalsContact CG-CB 3.44Å; G442-A446 WeakPolarHBondContact O-CB 3.24Å; G442-A446 PolarHBondContact O-N 3.16Å; T443-A446 PolarHBondContact O-N 3.14Å; L444-A446 VanDerWaalsContact C-N 3.29Å; L444-A446 PolarHBondContact O-N 3.38Å; A446-L448 VanDerWaalsContact C-N 3.28Å; A446-L448 PolarHBondContact O-N 3.44Å; A446-I449 PolarHBondContact O-N 2.96Å; A446-T450 WeakPolarHBondContact O-CG2 3.17Å; A446-T450 PolarHBondContact O-N 2.89Å; A446-T450 PolarHBondContact O-OG1 3.27Å
447	I	89.1	Confident	87.2	Confident	7 Å²	7	36 Å²	36	4%	0.036	19%	0.193	C	C	.	.	H	α-helix	trans	-58.5	-41.2	174.1	-66	163.8	0	0	0	111	I422 T443 T450 G451	I422-I447 HydrophobicContact CG2-CD1 3.68Å; I422-I447 HydrophobicContact CG2-CG1 3.85Å; T443-I447 HydrophobicContact CG2-CD1 4.05Å; T443-I447 VanDerWaalsContact O-CG1 3.29Å; T443-I447 WeakPolarHBondContact O-CG1 3.35Å; T443-I447 PolarHBondContact O-N 2.98Å; I447-T450 WeakPolarHBondContact CA-OG1 3.42Å; I447-T450 PolarHBondContact O-OG1 2.89Å; I447-T450 VanDerWaalsContact O-OG1 3.13Å; I447-G451 PolarHBondContact O-N 3.35Å
448	L	90.4	Very high	86.9	Confident	104 Å²	104	31.6 Å²	31.6	55%	0.545	17%	0.171	S	C	.	.	H	α-helix	trans	-64.5	-46.9	178.1	-177.6	67.6	0	0	0	111.5	L444 L445 A446 G451 I452	L444-L448 PolarHBondContact O-N 3.33Å; L444-L448 VanDerWaalsContact O-N 3.12Å; L445-L448 PolarHBondContact O-N 3.43Å; A446-L448 VanDerWaalsContact C-N 3.28Å; A446-L448 PolarHBondContact O-N 3.44Å; L448-G451 PolarHBondContact O-N 2.92Å; L448-I452 HydrophobicContact CD1-CD1 4.16Å; L448-I452 HydrophobicContact CG-CD1 4.01Å; L448-I452 VanDerWaalsContact O-CG1 3.27Å; L448-I452 WeakPolarHBondContact O-CG1 3.23Å; L448-I452 PolarHBondContact O-N 2.96Å
449	I	88.5	Confident	86.6	Confident	61 Å²	61	34.6 Å²	34.6	31%	0.313	19%	0.189	S	C	.	.	H	α-helix	trans	-65.4	-46.1	-179.5	-66.6	166.7	0	0	0	110.6	L213 F217 L445 A446 I452 V453	L213-I449 HydrophobicContact CD1-CD1 4.47Å; F217-I449 HydrophobicContact CE1-CB 3.98Å; F217-I449 HydrophobicContact CE1-CG2 3.71Å; F217-I449 HydrophobicContact CZ-CB 3.81Å; F217-I449 HydrophobicContact CZ-CD1 3.86Å; F217-I449 HydrophobicContact CZ-CG1 4.45Å; F217-I449 HydrophobicContact CZ-CG2 3.59Å; L445-I449 HydrophobicContact CD1-CD1 4.29Å; L445-I449 HydrophobicContact CD2-CD1 4.29Å; L445-I449 HydrophobicContact CG-CD1 3.83Å; L445-I449 HydrophobicContact CG-CG1 4.47Å; L445-I449 VanDerWaalsContact O-CG1 3.3Å; L445-I449 WeakPolarHBondContact O-CG1 3.41Å; L445-I449 PolarHBondContact O-N 3.03Å; A446-I449 PolarHBondContact O-N 2.96Å; I449-I452 PolarHBondContact O-N 3.07Å; I449-V453 HydrophobicContact CG2-CG2 4.46Å; I449-V453 VanDerWaalsContact O-CG2 3.32Å; I449-V453 WeakPolarHBondContact O-CG2 3.31Å; I449-V453 PolarHBondContact O-N 2.79Å
450	T	85.5	Confident	86.4	Confident	13 Å²	13	34.8 Å²	34.8	8%	0.08	19%	0.19	C	C	.	.	H	α-helix	trans	-64	-41.8	178.1	53.1	0	0	0	0	111.5	F217 A446 I447 I452 V453 Y454	F217-T450 HydrophobicContact CD1-CG2 3.71Å; F217-T450 HydrophobicContact CE1-CG2 3.71Å; A446-T450 WeakPolarHBondContact O-CG2 3.17Å; A446-T450 PolarHBondContact O-N 2.89Å; A446-T450 PolarHBondContact O-OG1 3.27Å; I447-T450 WeakPolarHBondContact CA-OG1 3.42Å; I447-T450 PolarHBondContact O-OG1 2.89Å; I447-T450 VanDerWaalsContact O-OG1 3.13Å; T450-I452 PolarHBondContact O-N 3.49Å; T450-V453 PolarHBondContact O-N 3.44Å; T450-Y454 WeakPolarHBondContact O-CB 3.44Å; T450-Y454 WeakPolarHBondContact O-CD1 3.41Å; T450-Y454 PolarHBondContact O-N 3.06Å
451	G	84.8	Confident	85.8	Confident	5 Å²	5	34.5 Å²	34.5	5%	0.052	19%	0.188	C	C	.	.	H	α-helix	trans	-58.9	-43.9	174.9	0	0	0	0	0	113.1	I447 L448 Y454 L455	I447-G451 PolarHBondContact O-N 3.35Å; L448-G451 PolarHBondContact O-N 2.92Å; G451-Y454 PolarHBondContact O-N 3Å; G451-L455 WeakPolarHBondContact O-CG 3.34Å; G451-L455 PolarHBondContact O-N 3.25Å
452	I	87.6	Confident	85.3	Confident	104 Å²	104	29.3 Å²	29.3	53%	0.533	17%	0.165	S	C	.	.	H	α-helix	trans	-64.9	-43.5	176.2	-69.2	166.6	0	0	0	111.1	L448 I449 T450 Y454 L455 G456	L448-I452 HydrophobicContact CD1-CD1 4.16Å; L448-I452 HydrophobicContact CG-CD1 4.01Å; L448-I452 VanDerWaalsContact O-CG1 3.27Å; L448-I452 WeakPolarHBondContact O-CG1 3.23Å; L448-I452 PolarHBondContact O-N 2.96Å; I449-I452 PolarHBondContact O-N 3.07Å; T450-I452 PolarHBondContact O-N 3.49Å; I452-Y454 VanDerWaalsContact C-N 3.33Å; I452-Y454 PolarHBondContact O-N 3.1Å; I452-L455 PolarHBondContact O-N 2.93Å; I452-G456 PolarHBondContact O-N 2.87Å
453	V	85.7	Confident	85.1	Confident	34 Å²	34	29.6 Å²	29.6	21%	0.206	17%	0.168	C	C	.	.	H	α-helix	trans	-62.1	-43.1	177.2	172.3	0	0	0	0	110.5	L225 I368 I449 T450 G456 V457	L225-V453 HydrophobicContact CD1-CG1 4.42Å; I368-V453 HydrophobicContact CG2-CG1 4.33Å; I449-V453 HydrophobicContact CG2-CG2 4.46Å; I449-V453 VanDerWaalsContact O-CG2 3.32Å; I449-V453 WeakPolarHBondContact O-CG2 3.31Å; I449-V453 PolarHBondContact O-N 2.79Å; T450-V453 PolarHBondContact O-N 3.44Å; V453-G456 PolarHBondContact O-N 2.85Å; V453-V457 HydrophobicContact CG1-CG2 4.46Å; V453-V457 WeakPolarHBondContact O-CG2 3.43Å; V453-V457 PolarHBondContact O-N 3.06Å
454	Y	82.1	Confident	84.7	Confident	6 Å²	6	29.5 Å²	29.5	2%	0.024	17%	0.167	C	C	.	.	H	α-helix	trans	-62.5	-46.7	178.2	-67.6	-6.7	0	0	0	111.7	G221 L222 L225 Y229 F415 A418 T450 G451 I452 G456 V457 A458	G221-Y454 PolarHBondContact O-OH 2.58Å; L222-Y454 HydrophobicContact CG-CE1 4.47Å; L225-Y454 HydrophobicContact CB-CE1 4.17Å; L225-Y454 HydrophobicContact CD1-CD1 3.13Å; L225-Y454 HydrophobicContact CD1-CE1 3.33Å; L225-Y454 HydrophobicContact CD1-CG 4.28Å; L225-Y454 HydrophobicContact CG-CD1 4.43Å; L225-Y454 HydrophobicContact CG-CE1 4.38Å; Y229-Y454 PolarHBondContact OH-O 3.01Å; F415-Y454 HydrophobicContact CE2-CD2 4.4Å; F415-Y454 AromaticContact CZ-CD2 3.86Å; F415-Y454 HydrophobicContact CZ-CD2 3.86Å; F415-Y454 HydrophobicContact CZ-CE2 4.31Å; A418-Y454 HydrophobicContact CB-CE2 4.26Å; A418-Y454 PolarHBondContact O-OH 3.44Å; T450-Y454 WeakPolarHBondContact O-CB 3.44Å; T450-Y454 WeakPolarHBondContact O-CD1 3.41Å; T450-Y454 PolarHBondContact O-N 3.06Å; G451-Y454 PolarHBondContact O-N 3Å; I452-Y454 VanDerWaalsContact C-N 3.33Å; I452-Y454 PolarHBondContact O-N 3.1Å; Y454-G456 VanDerWaalsContact C-N 3.35Å; Y454-G456 PolarHBondContact O-N 3.42Å; Y454-V457 PolarHBondContact O-N 2.86Å; Y454-A458 PolarHBondContact O-N 3.48Å
455	L	83.8	Confident	84.3	Confident	64 Å²	64	27.4 Å²	27.4	34%	0.335	16%	0.156	S	C	.	.	H	α-helix	trans	-61.4	-41.9	174.3	-70.6	173.7	0	0	0	112.3	C243 V246 G451 I452 V457 A458 V459	C243-L455 HydrophobicContact CB-CD2 3.87Å; V246-L455 HydrophobicContact CB-CD2 3.93Å; V246-L455 HydrophobicContact CG1-CD2 3.82Å; V246-L455 HydrophobicContact CG1-CG 3.88Å; G451-L455 WeakPolarHBondContact O-CG 3.34Å; G451-L455 PolarHBondContact O-N 3.25Å; I452-L455 PolarHBondContact O-N 2.93Å; L455-V457 VanDerWaalsContact C-N 3.35Å; L455-V457 PolarHBondContact O-N 2.94Å; L455-A458 VanDerWaalsContact O-CB 3.22Å; L455-A458 WeakPolarHBondContact O-CB 3.37Å; L455-A458 PolarHBondContact O-N 3.35Å; L455-V459 WeakPolarHBondContact O-CG2 3.48Å; L455-V459 PolarHBondContact O-N 3.35Å; L455-V459 VanDerWaalsContact O-N 3.09Å
456	G	83.5	Confident	83.9	Confident	28 Å²	28	24.8 Å²	24.8	29%	0.289	14%	0.143	S	C	.	.	H	α-helix	trans	-63.1	-39.5	177.8	0	0	0	0	0	112.8	I452 V453 Y454 S460	I452-G456 PolarHBondContact O-N 2.87Å; V453-G456 PolarHBondContact O-N 2.85Å; Y454-G456 VanDerWaalsContact C-N 3.35Å; Y454-G456 PolarHBondContact O-N 3.42Å; G456-S460 VanDerWaalsContact O-CB 3.28Å; G456-S460 WeakPolarHBondContact O-CB 3.3Å; G456-S460 PolarHBondContact O-N 2.7Å; G456-S460 PolarHBondContact O-OG 2.97Å
457	V	81.1	Confident	83.5	Confident	1 Å²	1	26 Å²	26	1%	0.006	15%	0.147	C	C	.	.	H	α-helix	trans	-67.5	-39	173.6	179.2	0	0	0	0	110.6	L225 Y229 Y371 F372 V453 Y454 L455 V459 S460 T461 M516	L225-V457 HydrophobicContact CD1-CB 4.35Å; L225-V457 HydrophobicContact CD1-CG2 4.1Å; L225-V457 HydrophobicContact CD2-CG1 4.36Å; L225-V457 HydrophobicContact CD2-CG2 4.26Å; L225-V457 HydrophobicContact CG-CG1 4.43Å; Y229-V457 HydrophobicContact CD1-CG1 3.75Å; Y229-V457 HydrophobicContact CE1-CB 4.15Å; Y229-V457 HydrophobicContact CE1-CG1 3.61Å; Y371-V457 HydrophobicContact CD1-CG2 4.3Å; Y371-V457 HydrophobicContact CE1-CB 4.44Å; Y371-V457 HydrophobicContact CE1-CG1 4.16Å; Y371-V457 HydrophobicContact CE1-CG2 3.94Å; F372-V457 HydrophobicContact CE2-CG2 4.38Å; F372-V457 HydrophobicContact CZ-CG2 3.89Å; V453-V457 HydrophobicContact CG1-CG2 4.46Å; V453-V457 WeakPolarHBondContact O-CG2 3.43Å; V453-V457 PolarHBondContact O-N 3.06Å; Y454-V457 PolarHBondContact O-N 2.86Å; L455-V457 VanDerWaalsContact C-N 3.35Å; L455-V457 PolarHBondContact O-N 2.94Å; V457-V459 PolarHBondContact O-N 3.1Å; V457-S460 WeakPolarHBondContact CA-OG 3.5Å; V457-S460 PolarHBondContact O-N 3.17Å; V457-S460 PolarHBondContact O-OG 3.4Å; V457-S460 VanDerWaalsContact O-OG 3.04Å; V457-T461 WeakPolarHBondContact O-CB 3.5Å; V457-T461 PolarHBondContact O-N 2.98Å; V457-T461 PolarHBondContact O-OG1 2.96Å; V457-M516 HydrophobicContact CG1-CE 3.58Å
458	A	78.4	Confident	83	Confident	0 Å²	0	26.2 Å²	26.2	0%	0	15%	0.148	C	C	.	.	H	α-helix	trans	-51.7	-57.4	174.1	0	0	0	0	0	112.8	Y229 Y454 L455 G462	Y229-A458 HydrophobicContact CE1-CB 4.38Å; Y229-A458 WeakPolarHBondContact OH-CA 3.5Å; Y229-A458 WeakPolarHBondContact OH-CB 3.32Å; Y229-A458 PolarHBondContact OH-N 3.48Å; Y454-A458 PolarHBondContact O-N 3.48Å; L455-A458 VanDerWaalsContact O-CB 3.22Å; L455-A458 WeakPolarHBondContact O-CB 3.37Å; L455-A458 PolarHBondContact O-N 3.35Å; A458-G462 PolarHBondContact O-N 3.14Å
459	V	82.1	Confident	82.6	Confident	69 Å²	69	21.2 Å²	21.2	42%	0.418	12%	0.123	S	C	.	.	H	α-helix	trans	-71.5	-38.2	-171.7	177	0	0	0	0	109.7	L455 V457 S463	L455-V459 WeakPolarHBondContact O-CG2 3.48Å; L455-V459 PolarHBondContact O-N 3.35Å; L455-V459 VanDerWaalsContact O-N 3.09Å; V457-V459 PolarHBondContact O-N 3.1Å; V459-S463 WeakPolarHBondContact O-CB 3.41Å; V459-S463 PolarHBondContact O-N 3.15Å; V459-S463 VanDerWaalsContact O-N 3.09Å; V459-S463 PolarHBondContact O-OG 3.05Å
460	S	83.3	Confident	82.2	Confident	4 Å²	4	20.1 Å²	20.1	3%	0.028	12%	0.12	C	C	.	.	H	α-helix	trans	-67.8	-46.3	178.7	57.2	0	0	0	0	113.5	Y371 Y390 G456 V457 S463 C464	Y371-S460 WeakPolarHBondContact CE1-OG 3.45Å; Y371-S460 PolarHBondContact OH-OG 3.39Å; Y390-S460 WeakPolarHBondContact OH-CB 3.37Å; G456-S460 VanDerWaalsContact O-CB 3.28Å; G456-S460 WeakPolarHBondContact O-CB 3.3Å; G456-S460 PolarHBondContact O-N 2.7Å; G456-S460 PolarHBondContact O-OG 2.97Å; V457-S460 WeakPolarHBondContact CA-OG 3.5Å; V457-S460 PolarHBondContact O-N 3.17Å; V457-S460 PolarHBondContact O-OG 3.4Å; V457-S460 VanDerWaalsContact O-OG 3.04Å; S460-S463 PolarHBondContact O-N 3.38Å; S460-S463 PolarHBondContact O-OG 3.22Å; S460-S463 VanDerWaalsContact O-OG 3.13Å; S460-C464 VanDerWaalsContact O-CB 3.29Å; S460-C464 WeakPolarHBondContact O-CB 3.3Å; S460-C464 PolarHBondContact O-N 2.98Å; S460-C464 PolarHBondContact O-SG 2.83Å
461	T	79.3	Confident	81.9	Confident	2 Å²	2	20.8 Å²	20.8	1%	0.012	13%	0.13	C	C	.	.	H	α-helix	trans	-67.9	-41.5	178.8	-48.1	0	0	0	0	110.7	L233 Y371 V457 S463 C464 I465 L509 V515	L233-T461 HydrophobicContact CD1-CG2 3.61Å; Y371-T461 PolarHBondContact OH-N 3.44Å; Y371-T461 PolarHBondContact OH-OG1 3.32Å; V457-T461 WeakPolarHBondContact O-CB 3.5Å; V457-T461 PolarHBondContact O-N 2.98Å; V457-T461 PolarHBondContact O-OG1 2.96Å; T461-S463 VanDerWaalsContact C-N 3.26Å; T461-S463 PolarHBondContact O-N 3.02Å; T461-C464 PolarHBondContact O-N 3.47Å; T461-I465 HydrophobicContact CG2-CD1 3.58Å; T461-I465 PolarHBondContact O-N 3.49Å; T461-L509 HydrophobicContact CG2-CD1 3.51Å; T461-V515 HydrophobicContact CG2-CG1 4.15Å
462	G	78.6	Confident	81.5	Confident	1 Å²	1	24 Å²	24	1%	0.01	15%	0.146	C	C	.	.	H	α-helix	trans	-67.5	-19.3	178.3	0	0	0	0	0	115.1	N398 A458	N398-G462 WeakPolarHBondContact CB-O 3.49Å; N398-G462 PolarHBondContact ND2-O 2.97Å; A458-G462 PolarHBondContact O-N 3.14Å
463	S	83.3	Confident	80.8	Confident	7 Å²	7	24.3 Å²	24.3	5%	0.049	15%	0.148	C	C	.	.	H	α-helix	trans	-96.8	-14	176.1	51.8	0	0	0	0	114.1	Y390 D391 V459 S460 T461	Y390-S463 WeakPolarHBondContact CD1-OG 3.46Å; Y390-S463 WeakPolarHBondContact CE1-OG 3.49Å; D391-S463 PolarHBondContact N-O 2.95Å; D391-S463 VanDerWaalsContact N-O 3.15Å; V459-S463 WeakPolarHBondContact O-CB 3.41Å; V459-S463 PolarHBondContact O-N 3.15Å; V459-S463 VanDerWaalsContact O-N 3.09Å; V459-S463 PolarHBondContact O-OG 3.05Å; S460-S463 PolarHBondContact O-N 3.38Å; S460-S463 PolarHBondContact O-OG 3.22Å; S460-S463 VanDerWaalsContact O-OG 3.13Å; T461-S463 VanDerWaalsContact C-N 3.26Å; T461-S463 PolarHBondContact O-N 3.02Å
464	C	83.2	Confident	80	Confident	0 Å²	0	29 Å²	29	0%	0	17%	0.172	C	C	.	.	H	α-helix	trans	-106.8	-20.8	-173.4	-71.6	0	0	0	0	115	F387 F388 G389 S460 T461	F387-C464 HydrophobicContact CD2-CB 4.08Å; F387-C464 HydrophobicContact CE2-CB 3.86Å; F388-C464 PolarHBondContact N-O 3.42Å; G389-C464 WeakPolarHBondContact O-CA 3.1Å; S460-C464 VanDerWaalsContact O-CB 3.29Å; S460-C464 WeakPolarHBondContact O-CB 3.3Å; S460-C464 PolarHBondContact O-N 2.98Å; S460-C464 PolarHBondContact O-SG 2.83Å; T461-C464 PolarHBondContact O-N 3.47Å
465	I	81.4	Confident	79.3	Confident	0 Å²	0	30.7 Å²	30.7	0%	0	18%	0.181	C	C	.	.	B	Isolated β-bridge	trans	-128	139.6	-169.1	-62.8	161.6	0	0	0	111.2	G386 F387 I394 N398 T461 L509 V515 V519	G386-I465 VanDerWaalsContact O-CA 3.32Å; G386-I465 WeakPolarHBondContact O-CA 3.49Å; F387-I465 HydrophobicContact CD2-CG1 4.2Å; I394-I465 WeakPolarHBondContact CG2-O 3.47Å; N398-I465 PolarHBondContact ND2-O 3.47Å; T461-I465 HydrophobicContact CG2-CD1 3.58Å; T461-I465 PolarHBondContact O-N 3.49Å; I465-L509 HydrophobicContact CB-CD1 4.37Å; I465-L509 HydrophobicContact CD1-CD1 4.43Å; I465-L509 HydrophobicContact CG2-CB 4.38Å; I465-L509 HydrophobicContact CG2-CD1 4.15Å; I465-V515 HydrophobicContact CD1-CB 4.3Å; I465-V515 HydrophobicContact CD1-CG1 3.74Å; I465-V515 HydrophobicContact CD1-CG2 3.64Å; I465-V515 HydrophobicContact CG1-CG2 4.47Å; I465-V515 HydrophobicContact CG2-CG2 4.03Å; I465-V519 HydrophobicContact CD1-CG2 3.26Å; I465-V519 HydrophobicContact CG1-CG2 3.89Å
466	V	82.6	Confident	78.6	Confident	10 Å²	10	31.2 Å²	31.2	6%	0.061	19%	0.187	C	C	.	.			trans	-84.4	154.2	172.5	-62.7	0	0	0	0	112.4	G386 F388 I394 A469 F496 L509	G386-V466 PolarHBondContact O-N 2.95Å; G386-V466 VanDerWaalsContact O-N 3.1Å; F388-V466 HydrophobicContact CD2-CG1 3.92Å; F388-V466 HydrophobicContact CD2-CG2 4.49Å; F388-V466 HydrophobicContact CE2-CG1 3.92Å; F388-V466 HydrophobicContact CE2-CG2 3.94Å; I394-V466 HydrophobicContact CD1-CG1 4.32Å; I394-V466 HydrophobicContact CG1-CG1 4.32Å; I394-V466 HydrophobicContact CG2-CG1 4.4Å; V466-A469 HydrophobicContact CG2-CB 4.42Å; V466-F496 HydrophobicContact CG2-CD2 4.26Å; V466-F496 HydrophobicContact CG2-CE2 4.13Å; V466-L509 PolarHBondContact O-N 2.93Å
467	R	78.6	Confident	77.7	Confident	25 Å²	25	31.5 Å²	31.5	9%	0.094	18%	0.182	C	C	.	.	S	Bend	trans	-60.8	-47.5	-175	-64.6	-168.8	-175.8	150.7	-1.2	114.5	G237 E397 N398 G400 G508 L509 H510	G237-R467 PolarHBondContact O-NH2 3.12Å; E397-R467 PolarHBondContact O-NH2 3.03Å; N398-R467 WeakPolarHBondContact OD1-CG 3.34Å; N398-R467 PolarHBondContact OD1-NE 2.67Å; G400-R467 PolarHBondContact O-NH2 3.35Å; R467-G508 CarbonylContact O-C 3.33Å; R467-L509 PolarHBondContact O-N 3.17Å; R467-H510 PolarHBondContact O-N 2.71Å
468	D	80.2	Confident	76.5	Confident	12 Å²	12	36.3 Å²	36.3	6%	0.064	21%	0.211	C	C	.	.			trans	-124.1	129.2	-175.6	-63.9	-57.2	0	0	0	108.8	R404 Y511	R404-D468 IonicContact CZ-OD1 3.3Å; R404-D468 IonicContact CZ-OD2 2.7Å; R404-D468 IonicContact NH1-OD1 2.88Å; R404-D468 PolarHBondContact NH1-OD1 3.44Å; R404-D468 IonicContact NH1-OD2 3.67Å; R404-D468 IonicContact NH2-OD1 3.37Å; R404-D468 PolarHBondContact NH2-OD1 3.27Å; R404-D468 IonicContact NH2-OD2 2.77Å; R404-D468 PolarHBondContact NH2-OD2 3.45Å; D468-Y511 WeakPolarHBondContact OD1-CE2 3.33Å
469	A	81.1	Confident	75.3	Confident	0 Å²	0	42.4 Å²	42.4	0%	0	25%	0.249	C	C	.	.	B	Isolated β-bridge	trans	-138.9	140.3	174.8	0	0	0	0	0	111.7	V466 F496 Y507	V466-A469 HydrophobicContact CG2-CB 4.42Å; A469-F496 HydrophobicContact CB-CE2 4.49Å; A469-F496 HydrophobicContact CB-CZ 4.4Å; A469-Y507 CarbonylContact C-O 3.21Å; A469-Y507 PolarHBondContact N-O 2.79Å; A469-Y507 CarbonylContact O-C 3.15Å; A469-Y507 WeakPolarHBondContact O-CA 3.38Å; A469-Y507 PolarHBondContact O-N 2.98Å
470	S	80.4	Confident	73.9	Confident	38 Å²	38	47.3 Å²	47.3	27%	0.266	27%	0.267	S	S	.	.			trans	-87.3	-22.5	-178.5	-166.9	0	0	0	0	113.7	N472 D475	S470-N472 PolarHBondContact O-N 3.11Å; S470-D475 WeakPolarHBondContact CB-OD2 3.16Å
471	G	78.1	Confident	72.4	Confident	27 Å²	27	55.1 Å²	55.1	28%	0.278	30%	0.301	S	S	.	.			trans	75.3	4.7	-174.9	0	0	0	0	0	115	P384	P384-G471 WeakPolarHBondContact O-CA 3.22Å; P384-G471 PolarHBondContact O-N 3.42Å
472	N	77.7	Confident	71.2	Confident	72 Å²	72	60 Å²	60	39%	0.385	33%	0.331	S	S	.	.			trans	-97.7	134.1	-178.2	-160.4	-2.7	0	0	0	111.2	S470 N474	S470-N472 PolarHBondContact O-N 3.11Å; N472-N474 PolarHBondContact O-N 3.4Å; N472-N474 PolarHBondContact OD1-N 2.98Å
473	L	72.1	Confident	70	Confident	111 Å²	111	64.4 Å²	64.4	58%	0.581	37%	0.367	S	S	*	.	G	3₁₀ helix	trans	-72.3	-18.4	176.4	-67.3	169	0	0	0	112.3	P384 D475 T476	P384-L473 HydrophobicContact CB-CD2 4.12Å; P384-L473 HydrophobicContact CG-CD2 3.77Å; L473-D475 VanDerWaalsContact C-N 3.26Å; L473-D475 PolarHBondContact O-N 3.32Å; L473-T476 VanDerWaalsContact O-CG2 3.27Å; L473-T476 WeakPolarHBondContact O-CG2 3.15Å; L473-T476 PolarHBondContact O-OG1 3.4Å
474	N	69.4	Low	68.8	Low	133 Å²	133	71.3 Å²	71.3	71%	0.711	40%	0.403	S	S	*	.	G	3₁₀ helix	trans	-76.7	-10.8	-178	-63.7	-14.6	0	0	0	113.5	N472 T476	N472-N474 PolarHBondContact O-N 3.4Å; N472-N474 PolarHBondContact OD1-N 2.98Å; N474-T476 PolarHBondContact O-N 2.77Å; N474-T476 VanDerWaalsContact O-N 3.11Å
475	D	66.9	Low	68	Low	41 Å²	41	72.6 Å²	72.6	22%	0.219	41%	0.412	C	S	.	.	G	3₁₀ helix	trans	-81	21.3	177.3	-61.6	-22.1	0	0	0	112.2	S470 L473 F494 D495	S470-D475 WeakPolarHBondContact CB-OD2 3.16Å; L473-D475 VanDerWaalsContact C-N 3.26Å; L473-D475 PolarHBondContact O-N 3.32Å; D475-F494 WeakPolarHBondContact O-CA 3.18Å; D475-D495 PolarHBondContact O-N 2.84Å
476	T	68.4	Low	67.3	Low	75 Å²	75	79.7 Å²	79.7	46%	0.46	46%	0.455	S	S	.	.	B	Isolated β-bridge	trans	-82.7	122.6	-179.5	42.7	0	0	0	0	110.9	L473 N474 T478 G493 F494	L473-T476 VanDerWaalsContact O-CG2 3.27Å; L473-T476 WeakPolarHBondContact O-CG2 3.15Å; L473-T476 PolarHBondContact O-OG1 3.4Å; N474-T476 PolarHBondContact O-N 2.77Å; N474-T476 VanDerWaalsContact O-N 3.11Å; T476-T478 PolarHBondContact O-N 3.06Å; T476-G493 CarbonylContact C-O 3.26Å; T476-G493 VanDerWaalsContact CA-O 3.28Å; T476-G493 WeakPolarHBondContact CA-O 3.06Å; T476-F494 HydrophobicContact CG2-CD1 4.03Å; T476-F494 HydrophobicContact CG2-CE1 3.56Å; T476-F494 HydrophobicContact CG2-CZ 3.93Å
477	I	65.3	Low	66.7	Low	34 Å²	34	80.4 Å²	80.4	17%	0.174	47%	0.465	C	S	.	.	P	Polyproline II helix	trans	-76.9	116.3	177.8	-51.9	173.4	0	0	0	108.1	F481 C485 C490 G493 D495	I477-F481 HydrophobicContact CG2-CB 4.37Å; I477-C485 HydrophobicContact CD1-CB 3.97Å; I477-C485 VanDerWaalsContact CD1-SG 3.58Å; I477-C490 HydrophobicContact CD1-CB 4.32Å; I477-G493 PolarHBondContact N-O 2.64Å; I477-D495 HydrophobicContact CD1-CB 3.79Å; I477-D495 HydrophobicContact CG1-CB 3.74Å
478	T	56.2	Low	66.2	Low	102 Å²	102	79.6 Å²	79.6	63%	0.626	46%	0.464	S	S	*	.	P	Polyproline II helix	trans	-73.9	135.9	165.3	-49.2	0	0	0	0	108.4	T476 Q480 F481	T476-T478 PolarHBondContact O-N 3.06Å; T478-Q480 PolarHBondContact O-N 3Å; T478-F481 PolarHBondContact O-N 3.35Å
479	T	54.2	Low	65.9	Low	128 Å²	128	79.6 Å²	79.6	79%	0.785	46%	0.464	S	S	*	.	T	Hydrogen-bonded Turn	trans	-49.6	-0.9	-168	49.4	0	0	0	0	118.3
480	Q	51.9	Low	65.5	Low	172 Å²	172	80.7 Å²	80.7	80%	0.804	47%	0.472	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.4	-10.4	176.4	-80.2	176.1	-45	0	0	115.1	T478	T478-Q480 PolarHBondContact O-N 3Å
481	F	52.2	Low	65.2	Low	167 Å²	167	85 Å²	85	73%	0.732	49%	0.486	S	S	*	.			trans	-116.4	32.5	-176.3	-79.8	-80.6	0	0	0	114.7	I477 T478 A483	I477-F481 HydrophobicContact CG2-CB 4.37Å; T478-F481 PolarHBondContact O-N 3.35Å; F481-A483 PolarHBondContact O-N 3.44Å
482	T	53.4	Low	65	Low	106 Å²	106	87 Å²	87	65%	0.65	49%	0.487	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.2	2.2	176.7	39.5	0	0	0	0	115
483	A	52.8	Low	64.8	Low	93 Å²	93	84.7 Å²	84.7	77%	0.769	48%	0.48	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.8	-18.6	-170.2	0	0	0	0	0	115.6	F481	F481-A483 PolarHBondContact O-N 3.44Å
484	N	58.9	Low	65.1	Low	152 Å²	152	80.2 Å²	80.2	81%	0.813	46%	0.456	S	S	*	.	S	Bend	trans	-122.4	9.6	-172.7	-82.2	-2.1	0	0	0	115.1
485	C	65.9	Low	65.6	Low	26 Å²	26	76.1 Å²	76.1	18%	0.176	43%	0.434	C	S	.	.			trans	-107	115.1	-176.7	-162.4	0	0	0	0	109.8	I477 C490	I477-C485 HydrophobicContact CD1-CB 3.97Å; I477-C485 VanDerWaalsContact CD1-SG 3.58Å; C485-C490 VanDerWaalsContact CA-SG 3.59Å; C485-C490 HydrophobicContact CB-CB 3.63Å; C485-C490 WeakPolarHBondContact CB-SG 3.4Å; C485-C490 WeakPolarHBondContact SG-CB 3.46Å; C485-C490 CovalentContact SG-SG 2Å; C485-C490 PolarHBondContact SG-SG 3.26Å
486	T	67	Low	66.1	Low	149 Å²	149	74.7 Å²	74.7	91%	0.914	43%	0.426	S	S	*	.			trans	-105.4	-3.6	-170.9	58.1	0	0	0	0	114.7
487	G	69.3	Low	66.5	Low	25 Å²	25	74.1 Å²	74.1	26%	0.258	43%	0.425	S	S	.	.	S	Bend	trans	-90.7	161.9	-178.5	0	0	0	0	0	113.8	S489 C490	G487-S489 PolarHBondContact O-N 3.27Å; G487-C490 PolarHBondContact N-SG 3.47Å; G487-C490 VanDerWaalsContact O-CB 3.29Å; G487-C490 WeakPolarHBondContact O-CB 3.19Å; G487-C490 PolarHBondContact O-N 2.98Å; G487-C490 PolarHBondContact O-SG 3.39Å
488	A	68.9	Low	67	Low	9 Å²	9	76.1 Å²	76.1	7%	0.074	44%	0.442	C	S	.	.	G	3₁₀ helix	trans	-64.3	-24.2	177.1	0	0	0	0	0	112.7	E393 I394 E397 C490 K491	E393-A488 HydrophobicContact CB-CB 4.06Å; I394-A488 HydrophobicContact CG1-CB 4.22Å; E397-A488 WeakPolarHBondContact OE2-CB 3.27Å; E397-A488 PolarHBondContact OE2-N 2.75Å; A488-C490 PolarHBondContact O-N 3.02Å; A488-K491 PolarHBondContact O-N 3.49Å
489	S	72.8	Confident	68	Low	11 Å²	11	71.7 Å²	71.7	8%	0.077	42%	0.415	C	S	.	.	G	3₁₀ helix	trans	-62.7	-25.2	175.8	66.5	0	0	0	0	113.4	G487 K491 F492 G493 F494	G487-S489 PolarHBondContact O-N 3.27Å; S489-K491 VanDerWaalsContact C-N 3.29Å; S489-K491 PolarHBondContact O-N 3.34Å; S489-F492 PolarHBondContact O-N 3.39Å; S489-F492 VanDerWaalsContact O-N 3.12Å; S489-G493 PolarHBondContact O-N 2.92Å; S489-F494 CarbonylContact C-O 3.51Å; S489-F494 WeakPolarHBondContact CB-O 3.44Å; S489-F494 PolarHBondContact O-N 3.17Å; S489-F494 VanDerWaalsContact O-O 3.12Å; S489-F494 PolarHBondContact OG-O 3.13Å
490	C	74.3	Confident	69	Low	23 Å²	23	70.3 Å²	70.3	16%	0.155	40%	0.398	C	S	.	.	G	3₁₀ helix	trans	-66.6	-31.3	-175.8	-50	0	0	0	0	112.2	I477 C485 G487 A488 F492 G493 F494	I477-C490 HydrophobicContact CD1-CB 4.32Å; C485-C490 VanDerWaalsContact CA-SG 3.59Å; C485-C490 HydrophobicContact CB-CB 3.63Å; C485-C490 WeakPolarHBondContact CB-SG 3.4Å; C485-C490 WeakPolarHBondContact SG-CB 3.46Å; C485-C490 CovalentContact SG-SG 2Å; C485-C490 PolarHBondContact SG-SG 3.26Å; G487-C490 PolarHBondContact N-SG 3.47Å; G487-C490 VanDerWaalsContact O-CB 3.29Å; G487-C490 WeakPolarHBondContact O-CB 3.19Å; G487-C490 PolarHBondContact O-N 2.98Å; G487-C490 PolarHBondContact O-SG 3.39Å; A488-C490 PolarHBondContact O-N 3.02Å; C490-F492 PolarHBondContact O-N 2.91Å; C490-G493 PolarHBondContact O-N 3.03Å; C490-F494 WeakPolarHBondContact CA-O 3.19Å; C490-F494 PolarHBondContact N-O 3.48Å
491	K	74.1	Confident	70	Confident	130 Å²	130	66.7 Å²	66.7	57%	0.565	39%	0.392	S	S	*	.	G	3₁₀ helix	trans	-66.6	-26.7	176.2	-172.1	176.2	176.3	-172.5	0	112.5	E393 A488 S489 G493	E393-K491 VanDerWaalsContact CD-NZ 3.35Å; E393-K491 IonicContact OE1-NZ 3.49Å; E393-K491 PolarHBondContact OE1-NZ 3.49Å; E393-K491 WeakPolarHBondContact OE2-CD 3.19Å; E393-K491 IonicContact OE2-NZ 2.69Å; A488-K491 PolarHBondContact O-N 3.49Å; S489-K491 VanDerWaalsContact C-N 3.29Å; S489-K491 PolarHBondContact O-N 3.34Å; K491-G493 VanDerWaalsContact C-N 3.31Å
492	F	73.8	Confident	71	Confident	67 Å²	67	65.6 Å²	65.6	29%	0.294	39%	0.389	S	S	.	.	G	3₁₀ helix	trans	-90.5	6.1	175	-59.2	-74.1	0	0	0	113	F388 D391 I394 S489 C490 F494	F388-F492 HydrophobicContact CB-CD2 4.27Å; F388-F492 HydrophobicContact CB-CE2 4.24Å; F388-F492 HydrophobicContact CB-CG 4.47Å; F388-F492 HydrophobicContact CB-CZ 4.41Å; F388-F492 HydrophobicContact CD1-CB 3.59Å; F388-F492 HydrophobicContact CD1-CD1 4.17Å; F388-F492 AromaticContact CD1-CD2 3.91Å; F388-F492 HydrophobicContact CD1-CD2 3.91Å; F388-F492 AromaticContact CD1-CG 3.61Å; F388-F492 HydrophobicContact CD1-CG 3.61Å; F388-F492 HydrophobicContact CE1-CB 3.58Å; F388-F492 HydrophobicContact CE1-CD2 4.45Å; F388-F492 HydrophobicContact CE1-CG 4.11Å; F388-F492 HydrophobicContact CG-CD2 4.01Å; F388-F492 HydrophobicContact CG-CE2 4.45Å; F388-F492 HydrophobicContact CG-CG 4.15Å; F388-F492 HydrophobicContact CZ-CB 4.48Å; D391-F492 HydrophobicContact CB-CE2 4.48Å; D391-F492 HydrophobicContact CB-CZ 3.98Å; I394-F492 HydrophobicContact CD1-CE2 3.96Å; I394-F492 HydrophobicContact CG1-CE2 4.34Å; S489-F492 PolarHBondContact O-N 3.39Å; S489-F492 VanDerWaalsContact O-N 3.12Å; C490-F492 PolarHBondContact O-N 2.91Å; F492-F494 HydrophobicContact CB-CD2 4.45Å; F492-F494 WeakPolarHBondContact O-CD2 3.36Å
493	G	73.8	Confident	72	Confident	24 Å²	24	67.3 Å²	67.3	25%	0.247	39%	0.388	C	S	.	.	T	Hydrogen-bonded Turn	trans	80.7	21.3	177.6	0	0	0	0	0	114.5	T476 I477 S489 C490 K491	T476-G493 CarbonylContact C-O 3.26Å; T476-G493 VanDerWaalsContact CA-O 3.28Å; T476-G493 WeakPolarHBondContact CA-O 3.06Å; I477-G493 PolarHBondContact N-O 2.64Å; S489-G493 PolarHBondContact O-N 2.92Å; C490-G493 PolarHBondContact O-N 3.03Å; K491-G493 VanDerWaalsContact C-N 3.31Å
494	F	76.9	Confident	73.2	Confident	17 Å²	17	68.4 Å²	68.4	8%	0.075	38%	0.38	C	S	.	.	B	Isolated β-bridge	trans	-121	132.1	178.4	-70.6	-88.9	0	0	0	112.3	K383 P384 F388 D475 T476 S489 C490 F492 F496	K383-F494 HydrophobicContact CB-CE2 3.8Å; K383-F494 HydrophobicContact CB-CZ 3.95Å; K383-F494 HydrophobicContact CD-CE2 4.35Å; P384-F494 HydrophobicContact CB-CE1 4.23Å; F388-F494 AromaticContact CE1-CD2 3.61Å; F388-F494 HydrophobicContact CE1-CD2 3.61Å; F388-F494 AromaticContact CE1-CE2 4Å; F388-F494 HydrophobicContact CE1-CE2 4Å; F388-F494 HydrophobicContact CE1-CG 4.41Å; F388-F494 HydrophobicContact CZ-CB 4.37Å; F388-F494 AromaticContact CZ-CD2 3.92Å; F388-F494 HydrophobicContact CZ-CD2 3.92Å; F388-F494 HydrophobicContact CZ-CG 4.28Å; D475-F494 WeakPolarHBondContact O-CA 3.18Å; T476-F494 HydrophobicContact CG2-CD1 4.03Å; T476-F494 HydrophobicContact CG2-CE1 3.56Å; T476-F494 HydrophobicContact CG2-CZ 3.93Å; S489-F494 CarbonylContact C-O 3.51Å; S489-F494 WeakPolarHBondContact CB-O 3.44Å; S489-F494 PolarHBondContact O-N 3.17Å; S489-F494 VanDerWaalsContact O-O 3.12Å; S489-F494 PolarHBondContact OG-O 3.13Å; C490-F494 WeakPolarHBondContact CA-O 3.19Å; C490-F494 PolarHBondContact N-O 3.48Å; F492-F494 HydrophobicContact CB-CD2 4.45Å; F492-F494 WeakPolarHBondContact O-CD2 3.36Å; F494-F496 HydrophobicContact CB-CE1 4.26Å; F494-F496 HydrophobicContact CB-CE2 3.88Å; F494-F496 HydrophobicContact CB-CZ 3.72Å; F494-F496 HydrophobicContact CD1-CE1 4.3Å; F494-F496 HydrophobicContact CD1-CZ 4.04Å; F494-F496 HydrophobicContact CG-CZ 4.04Å
495	D	80.6	Confident	74.1	Confident	47 Å²	47	61.5 Å²	61.5	25%	0.251	34%	0.344	S	S	.	.			trans	-109.6	102.6	174.3	-170.4	1.3	0	0	0	111.7	D475 I477 S497	D475-D495 PolarHBondContact O-N 2.84Å; I477-D495 HydrophobicContact CD1-CB 3.79Å; I477-D495 HydrophobicContact CG1-CB 3.74Å; D495-S497 WeakPolarHBondContact OD1-CB 3.27Å; D495-S497 PolarHBondContact OD1-N 3.43Å; D495-S497 PolarHBondContact OD1-OG 2.95Å; D495-S497 PolarHBondContact OD2-OG 2.97Å
496	F	78.1	Confident	74.8	Confident	12 Å²	12	69.6 Å²	69.6	5%	0.053	37%	0.371	C	S	.	.			trans	-95.6	10.3	176.2	-56.4	-54.3	0	0	0	113.6	F388 V466 A469 F494 S498 C499 K500	F388-F496 HydrophobicContact CE2-CE2 4.03Å; F388-F496 AromaticContact CZ-CE2 3.88Å; F388-F496 HydrophobicContact CZ-CE2 3.88Å; F388-F496 HydrophobicContact CZ-CZ 4.23Å; V466-F496 HydrophobicContact CG2-CD2 4.26Å; V466-F496 HydrophobicContact CG2-CE2 4.13Å; A469-F496 HydrophobicContact CB-CE2 4.49Å; A469-F496 HydrophobicContact CB-CZ 4.4Å; F494-F496 HydrophobicContact CB-CE1 4.26Å; F494-F496 HydrophobicContact CB-CE2 3.88Å; F494-F496 HydrophobicContact CB-CZ 3.72Å; F494-F496 HydrophobicContact CD1-CE1 4.3Å; F494-F496 HydrophobicContact CD1-CZ 4.04Å; F494-F496 HydrophobicContact CG-CZ 4.04Å; F496-S498 VanDerWaalsContact C-N 3.32Å; F496-S498 PolarHBondContact O-N 2.94Å; F496-C499 VanDerWaalsContact O-CB 3.29Å; F496-C499 WeakPolarHBondContact O-CB 3.37Å; F496-C499 PolarHBondContact O-N 3.25Å; F496-K500 PolarHBondContact O-N 3.38Å
497	S	75.5	Confident	75.4	Confident	63 Å²	63	66.8 Å²	66.8	44%	0.441	34%	0.344	S	S	.	.	H	α-helix	trans	-62.4	-35.7	-176.9	61.4	0	0	0	0	113.6	D495 C499 K500 S501	D495-S497 WeakPolarHBondContact OD1-CB 3.27Å; D495-S497 PolarHBondContact OD1-N 3.43Å; D495-S497 PolarHBondContact OD1-OG 2.95Å; D495-S497 PolarHBondContact OD2-OG 2.97Å; S497-C499 VanDerWaalsContact C-N 3.31Å; S497-C499 PolarHBondContact O-N 3.36Å; S497-K500 PolarHBondContact O-N 3.34Å; S497-S501 PolarHBondContact O-N 2.97Å; S497-S501 VanDerWaalsContact O-N 3.1Å
498	S	75.3	Confident	75.7	Confident	75 Å²	75	65.6 Å²	65.6	52%	0.524	33%	0.332	S	S	.	.	H	α-helix	trans	-59.8	-43.1	176.7	-65.8	0	0	0	0	111.8	F496 S501 Q502	F496-S498 VanDerWaalsContact C-N 3.32Å; F496-S498 PolarHBondContact O-N 2.94Å; S498-S501 PolarHBondContact O-N 3.49Å; S498-S501 PolarHBondContact O-OG 2.91Å; S498-S501 VanDerWaalsContact O-OG 3.04Å; S498-Q502 PolarHBondContact O-N 3.48Å
499	C	77.2	Confident	76	Confident	9 Å²	9	65.3 Å²	65.3	6%	0.061	33%	0.329	C	S	.	.	H	α-helix	trans	-63	-44.7	179.5	-166.1	0	0	0	0	111.7	F496 S497 S501 Q502 K503 N504 C505	F496-C499 VanDerWaalsContact O-CB 3.29Å; F496-C499 WeakPolarHBondContact O-CB 3.37Å; F496-C499 PolarHBondContact O-N 3.25Å; S497-C499 VanDerWaalsContact C-N 3.31Å; S497-C499 PolarHBondContact O-N 3.36Å; C499-S501 PolarHBondContact O-N 2.86Å; C499-Q502 PolarHBondContact O-N 3.36Å; C499-K503 PolarHBondContact O-N 3.12Å; C499-K503 VanDerWaalsContact O-N 3.11Å; C499-N504 PolarHBondContact O-N 3.5Å; C499-C505 HydrophobicContact CB-CB 4.48Å; C499-C505 WeakPolarHBondContact CB-SG 3.39Å; C499-C505 PolarHBondContact O-SG 3.49Å; C499-C505 VanDerWaalsContact O-SG 3.4Å; C499-C505 WeakPolarHBondContact SG-CA 3.49Å; C499-C505 WeakPolarHBondContact SG-CB 3.41Å; C499-C505 CovalentContact SG-SG 2.02Å; C499-C505 PolarHBondContact SG-SG 3.1Å
500	K	75.2	Confident	76	Confident	99 Å²	99	65.3 Å²	65.3	43%	0.43	33%	0.328	S	S	.	.	H	α-helix	trans	-63.5	-40.4	177.6	-172	172.1	-176.3	170.5	0	112.6	F496 S497	F496-K500 PolarHBondContact O-N 3.38Å; S497-K500 PolarHBondContact O-N 3.34Å
501	S	74.8	Confident	76	Confident	96 Å²	96	67.9 Å²	67.9	67%	0.671	34%	0.335	S	S	*	.	H	α-helix	trans	-68.5	-35.1	-179.7	83.5	0	0	0	0	113.2	S497 S498 C499	S497-S501 PolarHBondContact O-N 2.97Å; S497-S501 VanDerWaalsContact O-N 3.1Å; S498-S501 PolarHBondContact O-N 3.49Å; S498-S501 PolarHBondContact O-OG 2.91Å; S498-S501 VanDerWaalsContact O-OG 3.04Å; C499-S501 PolarHBondContact O-N 2.86Å
502	Q	72.8	Confident	75.9	Confident	145 Å²	145	62.5 Å²	62.5	68%	0.678	31%	0.313	S	S	*	.	H	α-helix	trans	-91.1	-5	-177.3	-67.7	-177.5	-8	0	0	113.4	S498 C499 N504	S498-Q502 PolarHBondContact O-N 3.48Å; C499-Q502 PolarHBondContact O-N 3.36Å; Q502-N504 HydrophobicContact CB-CB 4.42Å; Q502-N504 PolarHBondContact O-N 3.49Å; Q502-N504 VanDerWaalsContact O-N 3.13Å
503	K	72.8	Confident	75.7	Confident	142 Å²	142	62.5 Å²	62.5	62%	0.617	31%	0.313	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.4	29.3	-173.6	-63.6	-170.7	176.3	-170.7	0	114	C499	C499-K503 PolarHBondContact O-N 3.12Å; C499-K503 VanDerWaalsContact O-N 3.11Å
504	N	79.1	Confident	75.8	Confident	115 Å²	115	63 Å²	63	62%	0.615	31%	0.308	S	S	*	.			trans	-112.3	35.3	-175.5	-167	26.3	0	0	0	112.3	C499 Q502	C499-N504 PolarHBondContact O-N 3.5Å; Q502-N504 HydrophobicContact CB-CB 4.42Å; Q502-N504 PolarHBondContact O-N 3.49Å; Q502-N504 VanDerWaalsContact O-N 3.13Å
505	C	78.3	Confident	75.7	Confident	8 Å²	8	62.1 Å²	62.1	5%	0.054	31%	0.305	C	S	.	.			trans	-77.6	135.4	178	-60	0	0	0	0	111.3	C499 Y511	C499-C505 HydrophobicContact CB-CB 4.48Å; C499-C505 WeakPolarHBondContact CB-SG 3.39Å; C499-C505 PolarHBondContact O-SG 3.49Å; C499-C505 VanDerWaalsContact O-SG 3.4Å; C499-C505 WeakPolarHBondContact SG-CA 3.49Å; C499-C505 WeakPolarHBondContact SG-CB 3.41Å; C499-C505 CovalentContact SG-SG 2.02Å; C499-C505 PolarHBondContact SG-SG 3.1Å; C505-Y511 HydrophobicContact CB-CD2 3.57Å; C505-Y511 HydrophobicContact CB-CE2 3.67Å; C505-Y511 HydrophobicContact CB-CG 4.26Å; C505-Y511 WeakPolarHBondContact O-CD1 3.33Å; C505-Y511 VanDerWaalsContact O-CG 3.27Å
506	R	79.1	Confident	75.6	Confident	195 Å²	195	60 Å²	60	74%	0.736	29%	0.293	S	S	*	.			trans	-97.9	-25.5	177.8	-70.6	-167.5	175.6	-166.3	-1.7	113
507	Y	79.8	Confident	75.8	Confident	91 Å²	91	60 Å²	60	36%	0.357	30%	0.295	S	S	.	.	B	Isolated β-bridge	trans	-125.7	172.3	-176.4	-63.9	-76.3	0	0	0	110.9	A469 D512	A469-Y507 CarbonylContact C-O 3.21Å; A469-Y507 PolarHBondContact N-O 2.79Å; A469-Y507 CarbonylContact O-C 3.15Å; A469-Y507 WeakPolarHBondContact O-CA 3.38Å; A469-Y507 PolarHBondContact O-N 2.98Å; Y507-D512 HydrophobicContact CD1-CB 4.31Å; Y507-D512 WeakPolarHBondContact CD1-OD2 3.46Å
508	G	75.8	Confident	76.1	Confident	0 Å²	0	58.4 Å²	58.4	0%	0	28%	0.281	C	S	.	.	S	Bend	trans	100.1	171.8	-175.9	0	0	0	0	0	111.9	R467 H510 Y511 D512	R467-G508 CarbonylContact O-C 3.33Å; G508-H510 PolarHBondContact O-N 3.22Å; G508-Y511 PolarHBondContact O-N 3.31Å; G508-D512 PolarHBondContact O-N 2.94Å; G508-D512 VanDerWaalsContact O-N 3.15Å
509	L	75.1	Confident	76.4	Confident	3 Å²	3	54.8 Å²	54.8	2%	0.016	26%	0.256	C	S	.	.	T	Hydrogen-bonded Turn	trans	-58.5	-32.6	-168.3	-150.8	61.7	0	0	0	113.4	Q230 L233 G234 T461 I465 V466 R467 V515	Q230-L509 VanDerWaalsContact O-O 3.11Å; L233-L509 HydrophobicContact CB-CD1 3.98Å; L233-L509 HydrophobicContact CB-CD2 3.87Å; L233-L509 HydrophobicContact CB-CG 3.84Å; L233-L509 WeakPolarHBondContact O-CD2 3.49Å; L233-L509 WeakPolarHBondContact O-CG 3.4Å; G234-L509 WeakPolarHBondContact CA-O 3.46Å; T461-L509 HydrophobicContact CG2-CD1 3.51Å; I465-L509 HydrophobicContact CB-CD1 4.37Å; I465-L509 HydrophobicContact CD1-CD1 4.43Å; I465-L509 HydrophobicContact CG2-CB 4.38Å; I465-L509 HydrophobicContact CG2-CD1 4.15Å; V466-L509 PolarHBondContact O-N 2.93Å; R467-L509 PolarHBondContact O-N 3.17Å; L509-V515 HydrophobicContact CD1-CG1 4.18Å
510	H	73.4	Confident	76.8	Confident	10 Å²	10	54.4 Å²	54.4	5%	0.046	25%	0.253	C	S	.	.	T	Hydrogen-bonded Turn	trans	-81.4	-30.8	-178.9	-79.6	-90.6	0	0	0	115.5	G234 Q235 R467 G508	G234-H510 PolarHBondContact O-CD2 3.43Å; G234-H510 PolarHBondContact O-CE1 2.78Å; G234-H510 PolarHBondContact O-ND1 2.94Å; G234-H510 PolarHBondContact O-NE2 3.24Å; Q235-H510 PolarHBondContact OE1-ND1 3.1Å; R467-H510 PolarHBondContact O-N 2.71Å; G508-H510 PolarHBondContact O-N 3.22Å
511	Y	73.6	Confident	77.1	Confident	77 Å²	77	51.9 Å²	51.9	30%	0.302	26%	0.256	S	S	.	.	T	Hydrogen-bonded Turn	trans	-114.4	-28.8	-162.9	-71.7	-80.1	0	0	0	113.9	R404 D468 C505 G508	R404-Y511 PolarHBondContact NH1-OH 3.16Å; D468-Y511 WeakPolarHBondContact OD1-CE2 3.33Å; C505-Y511 HydrophobicContact CB-CD2 3.57Å; C505-Y511 HydrophobicContact CB-CE2 3.67Å; C505-Y511 HydrophobicContact CB-CG 4.26Å; C505-Y511 WeakPolarHBondContact O-CD1 3.33Å; C505-Y511 VanDerWaalsContact O-CG 3.27Å; G508-Y511 PolarHBondContact O-N 3.31Å
512	D	73.3	Confident	77.7	Confident	18 Å²	18	52.8 Å²	52.8	10%	0.096	25%	0.247	C	C	.	.			trans	-98.9	117.2	177.9	-178.6	6.3	0	0	0	109	Q230 Y507 G508 Q514	Q230-D512 PolarHBondContact OE1-O 3.03Å; Y507-D512 HydrophobicContact CD1-CB 4.31Å; Y507-D512 WeakPolarHBondContact CD1-OD2 3.46Å; G508-D512 PolarHBondContact O-N 2.94Å; G508-D512 VanDerWaalsContact O-N 3.15Å; D512-Q514 PolarHBondContact O-N 3.1Å; D512-Q514 WeakPolarHBondContact OD1-CA 3.2Å; D512-Q514 PolarHBondContact OD1-N 3.34Å
513	F	70.1	Confident	78.2	Confident	67 Å²	67	48 Å²	48	29%	0.294	23%	0.23	S	C	.	.	T	Hydrogen-bonded Turn	trans	-82.3	2.4	175.8	-63.5	-73.6	0	0	0	112.5	Q230	Q230-F513 VanDerWaalsContact NE2-C 3.32Å; Q230-F513 PolarHBondContact NE2-O 3.17Å; Q230-F513 VanDerWaalsContact OE1-CA 3.28Å; Q230-F513 PolarHBondContact OE1-O 3.41Å; Q230-F513 VanDerWaalsContact OE1-O 3.14Å
514	Q	74.9	Confident	78.9	Confident	33 Å²	33	44.8 Å²	44.8	15%	0.154	22%	0.224	C	C	.	.	T	Hydrogen-bonded Turn	trans	-115.4	21	175.6	-64.7	-168.5	-0.3	0	0	114.5	E315 D512 M516 S517 L518	E315-Q514 VanDerWaalsContact CD-CG 3.43Å; E315-Q514 HydrophobicContact CG-CG 4.41Å; E315-Q514 WeakPolarHBondContact OE2-CG 3.24Å; E315-Q514 PolarHBondContact OE2-NE2 3.31Å; D512-Q514 PolarHBondContact O-N 3.1Å; D512-Q514 WeakPolarHBondContact OD1-CA 3.2Å; D512-Q514 PolarHBondContact OD1-N 3.34Å; Q514-M516 PolarHBondContact O-N 2.86Å; Q514-S517 WeakPolarHBondContact O-CA 3.37Å; Q514-S517 WeakPolarHBondContact O-CB 3.41Å; Q514-S517 PolarHBondContact O-N 3Å; Q514-L518 PolarHBondContact O-N 3.43Å; Q514-L518 VanDerWaalsContact O-N 3.08Å
515	V	76.1	Confident	79.3	Confident	0 Å²	0	42 Å²	42	0%	0	21%	0.209	C	C	.	.	H	α-helix	trans	-53.8	-31	176.9	102.7	0	0	0	0	112.8	Q230 T461 I465 L509 L518 V519	Q230-V515 HydrophobicContact CG-CG1 4.04Å; T461-V515 HydrophobicContact CG2-CG1 4.15Å; I465-V515 HydrophobicContact CD1-CB 4.3Å; I465-V515 HydrophobicContact CD1-CG1 3.74Å; I465-V515 HydrophobicContact CD1-CG2 3.64Å; I465-V515 HydrophobicContact CG1-CG2 4.47Å; I465-V515 HydrophobicContact CG2-CG2 4.03Å; L509-V515 HydrophobicContact CD1-CG1 4.18Å; V515-L518 WeakPolarHBondContact O-CA 3.45Å; V515-L518 VanDerWaalsContact O-CB 3.3Å; V515-L518 WeakPolarHBondContact O-CB 3.5Å; V515-L518 PolarHBondContact O-N 2.99Å; V515-V519 WeakPolarHBondContact O-CG2 3.19Å; V515-V519 PolarHBondContact O-N 3.42Å
516	M	78.1	Confident	79.6	Confident	2 Å²	2	41.7 Å²	41.7	1%	0.01	21%	0.206	C	C	.	.	H	α-helix	trans	-72.7	-31.8	177.8	-65.3	169.7	84.1	0	0	112.7	L225 Y226 Q230 Y371 V457 Q514 L518 S520	L225-M516 HydrophobicContact CD2-CE 3.43Å; L225-M516 VanDerWaalsContact CD2-CE 3.43Å; L225-M516 HydrophobicContact CG-CE 4.15Å; L225-M516 WeakPolarHBondContact O-CE 3.27Å; Y226-M516 HydrophobicContact CD1-CB 4.18Å; Y226-M516 HydrophobicContact CD1-CE 3.83Å; Y226-M516 HydrophobicContact CD1-SD 4.14Å; Y226-M516 HydrophobicContact CE1-CE 4.09Å; Y226-M516 HydrophobicContact CG-CE 4.48Å; Q230-M516 HydrophobicContact CG-CG 4.4Å; Q230-M516 HydrophobicContact CG-SD 4.19Å; Y371-M516 HydrophobicContact CD2-CB 4.46Å; Y371-M516 HydrophobicContact CE2-CG 4.39Å; V457-M516 HydrophobicContact CG1-CE 3.58Å; Q514-M516 PolarHBondContact O-N 2.86Å; M516-L518 VanDerWaalsContact C-N 3.29Å; M516-S520 PolarHBondContact O-N 3.02Å
517	S	81.9	Confident	79.9	Confident	12 Å²	12	33 Å²	33	8%	0.084	18%	0.175	C	C	.	.	H	α-helix	trans	-66.3	-36.7	168.9	-169.5	0	0	0	0	110.5	Q514 S520 S523	Q514-S517 WeakPolarHBondContact O-CA 3.37Å; Q514-S517 WeakPolarHBondContact O-CB 3.41Å; Q514-S517 PolarHBondContact O-N 3Å; S517-S520 PolarHBondContact O-OG 2.97Å; S517-S523 PolarHBondContact O-OG 3.3Å; S517-S523 WeakPolarHBondContact OG-CB 3.3Å
518	L	81.1	Confident	80.2	Confident	29 Å²	29	30.6 Å²	30.6	15%	0.152	17%	0.174	C	C	.	.	H	α-helix	trans	-66.9	-44.1	177.7	-168.3	138.7	0	0	0	112.8	K382 F387 Q514 V515 M516 S520	K382-L518 HydrophobicContact CB-CD2 4.37Å; K382-L518 VanDerWaalsContact CD-O 3.32Å; K382-L518 WeakPolarHBondContact CD-O 3.24Å; K382-L518 VanDerWaalsContact CE-O 3.24Å; K382-L518 WeakPolarHBondContact CE-O 3.18Å; K382-L518 PolarHBondContact NZ-O 3.47Å; F387-L518 HydrophobicContact CB-CD2 3.59Å; F387-L518 HydrophobicContact CG-CD2 4.43Å; Q514-L518 PolarHBondContact O-N 3.43Å; Q514-L518 VanDerWaalsContact O-N 3.08Å; V515-L518 WeakPolarHBondContact O-CA 3.45Å; V515-L518 VanDerWaalsContact O-CB 3.3Å; V515-L518 WeakPolarHBondContact O-CB 3.5Å; V515-L518 PolarHBondContact O-N 2.99Å; M516-L518 VanDerWaalsContact C-N 3.29Å; L518-S520 VanDerWaalsContact C-N 3.32Å; L518-S520 PolarHBondContact O-N 3.34Å
519	V	82.8	Confident	80.6	Confident	0 Å²	0	30.6 Å²	30.6	0%	0	17%	0.174	C	C	.	.	H	α-helix	trans	-66.5	-34.4	178.5	173.9	0	0	0	0	112.1	Y371 G374 F387 I465 V515	Y371-V519 HydrophobicContact CD2-CB 4.4Å; Y371-V519 HydrophobicContact CD2-CG1 4.22Å; Y371-V519 HydrophobicContact CE2-CB 4.06Å; Y371-V519 HydrophobicContact CE2-CG1 3.82Å; G374-V519 CarbonylContact C-O 3.32Å; G374-V519 VanDerWaalsContact C-O 3.27Å; F387-V519 HydrophobicContact CD2-CG1 4.45Å; F387-V519 HydrophobicContact CD2-CG2 3.88Å; F387-V519 HydrophobicContact CE2-CB 4.42Å; F387-V519 HydrophobicContact CE2-CG1 3.89Å; F387-V519 HydrophobicContact CE2-CG2 4.15Å; F387-V519 HydrophobicContact CZ-CG1 4.41Å; I465-V519 HydrophobicContact CD1-CG2 3.26Å; I465-V519 HydrophobicContact CG1-CG2 3.89Å; V515-V519 WeakPolarHBondContact O-CG2 3.19Å; V515-V519 PolarHBondContact O-N 3.42Å
520	S	84.4	Confident	81.1	Confident	0 Å²	0	31 Å²	31	0%	0	18%	0.176	C	C	.	.	S	Bend	trans	-62.6	152.3	-172.9	76	0	0	0	0	114.2	K382 M516 S517 L518 F522 S523 I526	K382-S520 PolarHBondContact NZ-O 2.89Å; M516-S520 PolarHBondContact O-N 3.02Å; S517-S520 PolarHBondContact O-OG 2.97Å; L518-S520 VanDerWaalsContact C-N 3.32Å; L518-S520 PolarHBondContact O-N 3.34Å; S520-F522 VanDerWaalsContact C-N 3.33Å; S520-F522 PolarHBondContact O-N 3.15Å; S520-S523 WeakPolarHBondContact OG-CA 3.29Å; S520-S523 PolarHBondContact OG-N 3.38Å; S520-I526 VanDerWaalsContact OG-CG1 3.31Å; S520-I526 WeakPolarHBondContact OG-CG1 3.49Å
521	G	82.3	Confident	81.7	Confident	47 Å²	47	33.3 Å²	33.3	49%	0.485	19%	0.186	S	C	.	.	S	Bend	trans	-63.4	-41.4	177.8	0	0	0	0	0	111.9
522	F	87.1	Confident	82.3	Confident	114 Å²	114	29.7 Å²	29.7	50%	0.5	17%	0.172	S	C	.	.	S	Bend	trans	-130.5	104.9	176.2	-171.3	-101.3	0	0	0	111.1	N370 S520 P524 I525	N370-F522 PolarHBondContact ND2-O 3.32Å; S520-F522 VanDerWaalsContact C-N 3.33Å; S520-F522 PolarHBondContact O-N 3.15Å; F522-P524 HydrophobicContact CD1-CB 4.22Å; F522-P524 HydrophobicContact CD1-CG 4.22Å; F522-P524 HydrophobicContact CE1-CB 3.65Å; F522-P524 HydrophobicContact CE1-CG 3.7Å; F522-P524 HydrophobicContact CE2-CG 4.4Å; F522-P524 HydrophobicContact CZ-CB 4.18Å; F522-P524 HydrophobicContact CZ-CG 3.8Å; F522-I525 HydrophobicContact CB-CD1 4.19Å; F522-I525 HydrophobicContact CD1-CB 3.96Å; F522-I525 HydrophobicContact CD1-CD1 3.5Å; F522-I525 VanDerWaalsContact CD1-CD1 3.5Å; F522-I525 HydrophobicContact CD1-CG1 3.5Å; F522-I525 VanDerWaalsContact CD1-CG1 3.5Å; F522-I525 HydrophobicContact CE1-CD1 4.24Å; F522-I525 HydrophobicContact CE1-CG1 4.03Å; F522-I525 HydrophobicContact CG-CD1 4.2Å; F522-I525 PolarHBondContact O-N 2.97Å
523	S	83	Confident	82.8	Confident	44 Å²	44	28.9 Å²	28.9	31%	0.308	17%	0.168	S	C	.	.	H	α-helix	trans	-56.8	-43.4	-173.8	-56.3	0	0	0	0	114.7	S517 S520 I525 I526 S527	S517-S523 PolarHBondContact O-OG 3.3Å; S517-S523 WeakPolarHBondContact OG-CB 3.3Å; S520-S523 WeakPolarHBondContact OG-CA 3.29Å; S520-S523 PolarHBondContact OG-N 3.38Å; S523-I525 PolarHBondContact O-N 2.98Å; S523-I525 VanDerWaalsContact O-N 3.17Å; S523-I526 WeakPolarHBondContact O-CB 3.32Å; S523-I526 PolarHBondContact O-N 3.4Å; S523-S527 PolarHBondContact O-N 3.39Å
524	P	87.9	Confident	83.6	Confident	76 Å²	76	25.7 Å²	25.7	49%	0.494	15%	0.154	S	C	.	.	H	α-helix	trans	-63.6	-25.1	-179.3	-22.7	32.7	0	0	0	114.6	F522 I526 S527 A528	F522-P524 HydrophobicContact CD1-CB 4.22Å; F522-P524 HydrophobicContact CD1-CG 4.22Å; F522-P524 HydrophobicContact CE1-CB 3.65Å; F522-P524 HydrophobicContact CE1-CG 3.7Å; F522-P524 HydrophobicContact CE2-CG 4.4Å; F522-P524 HydrophobicContact CZ-CB 4.18Å; F522-P524 HydrophobicContact CZ-CG 3.8Å; P524-I526 VanDerWaalsContact C-N 3.32Å; P524-S527 PolarHBondContact O-N 3.47Å; P524-A528 WeakPolarHBondContact O-CB 3.46Å; P524-A528 PolarHBondContact O-N 3.31Å
525	I	87.8	Confident	84.2	Confident	57 Å²	57	26.2 Å²	26.2	29%	0.292	16%	0.158	S	C	.	.	H	α-helix	trans	-67.9	-35.6	174.3	-79.9	163.5	0	0	0	110.6	T366 A367 N370 F522 S523 G529	T366-I525 HydrophobicContact CG2-CG2 4.43Å; A367-I525 HydrophobicContact CB-CG2 4.37Å; N370-I525 HydrophobicContact CB-CG2 3.96Å; F522-I525 HydrophobicContact CB-CD1 4.19Å; F522-I525 HydrophobicContact CD1-CB 3.96Å; F522-I525 HydrophobicContact CD1-CD1 3.5Å; F522-I525 VanDerWaalsContact CD1-CD1 3.5Å; F522-I525 HydrophobicContact CD1-CG1 3.5Å; F522-I525 VanDerWaalsContact CD1-CG1 3.5Å; F522-I525 HydrophobicContact CE1-CD1 4.24Å; F522-I525 HydrophobicContact CE1-CG1 4.03Å; F522-I525 HydrophobicContact CG-CD1 4.2Å; F522-I525 PolarHBondContact O-N 2.97Å; S523-I525 PolarHBondContact O-N 2.98Å; S523-I525 VanDerWaalsContact O-N 3.17Å; I525-G529 PolarHBondContact O-N 3.16Å
526	I	84.6	Confident	84.6	Confident	0 Å²	0	26.3 Å²	26.3	0%	0	16%	0.159	C	C	.	.	H	α-helix	trans	-68.2	-46.3	175.2	-62.2	-55.5	0	0	0	110.2	Y226 A367 S520 S523 P524 A528 G529 I530	Y226-I526 HydrophobicContact CD1-CG2 3.82Å; Y226-I526 HydrophobicContact CE1-CD1 4.25Å; Y226-I526 HydrophobicContact CE1-CG2 3.78Å; A367-I526 HydrophobicContact CB-CD1 4.13Å; A367-I526 WeakPolarHBondContact O-CD1 3.5Å; S520-I526 VanDerWaalsContact OG-CG1 3.31Å; S520-I526 WeakPolarHBondContact OG-CG1 3.49Å; S523-I526 WeakPolarHBondContact O-CB 3.32Å; S523-I526 PolarHBondContact O-N 3.4Å; P524-I526 VanDerWaalsContact C-N 3.32Å; I526-A528 VanDerWaalsContact C-N 3.3Å; I526-A528 PolarHBondContact O-N 3.26Å; I526-G529 CarbonylContact O-C 3.5Å; I526-G529 VanDerWaalsContact O-CA 3.3Å; I526-G529 WeakPolarHBondContact O-CA 3.37Å; I526-G529 PolarHBondContact O-N 3.26Å; I526-I530 HydrophobicContact CG2-CD1 4.08Å; I526-I530 HydrophobicContact CG2-CG1 4.34Å; I526-I530 WeakPolarHBondContact O-CG1 3.13Å; I526-I530 PolarHBondContact O-N 3.43Å
527	S	84.3	Confident	85	Confident	13 Å²	13	26.3 Å²	26.3	9%	0.091	16%	0.158	C	C	.	.	H	α-helix	trans	-56.9	-43.7	175.3	-54.5	0	0	0	0	112	S523 P524 G529 I530 F531	S523-S527 PolarHBondContact O-N 3.39Å; P524-S527 PolarHBondContact O-N 3.47Å; S527-G529 VanDerWaalsContact C-N 3.3Å; S527-G529 PolarHBondContact O-N 3.03Å; S527-I530 PolarHBondContact O-N 3.39Å; S527-F531 VanDerWaalsContact O-CG 3.32Å; S527-F531 WeakPolarHBondContact O-CG 3.2Å; S527-F531 PolarHBondContact O-N 3.34Å
528	A	86.6	Confident	85.3	Confident	41 Å²	41	25.7 Å²	25.7	34%	0.339	15%	0.154	S	C	.	.	H	α-helix	trans	-62.7	-36.4	172.9	0	0	0	0	0	112.6	V363 P524 I526 S532	V363-A528 HydrophobicContact CG1-CB 4.21Å; P524-A528 WeakPolarHBondContact O-CB 3.46Å; P524-A528 PolarHBondContact O-N 3.31Å; I526-A528 VanDerWaalsContact C-N 3.3Å; I526-A528 PolarHBondContact O-N 3.26Å; A528-S532 VanDerWaalsContact O-CB 3.27Å; A528-S532 WeakPolarHBondContact O-CB 3.34Å; A528-S532 PolarHBondContact O-N 3.23Å
529	G	85.1	Confident	85.6	Confident	0 Å²	0	24.7 Å²	24.7	0%	0	15%	0.149	C	C	.	.	H	α-helix	trans	-62.3	-41.9	171.7	0	0	0	0	0	113.2	I525 I526 S527 S532 A533	I525-G529 PolarHBondContact O-N 3.16Å; I526-G529 CarbonylContact O-C 3.5Å; I526-G529 VanDerWaalsContact O-CA 3.3Å; I526-G529 WeakPolarHBondContact O-CA 3.37Å; I526-G529 PolarHBondContact O-N 3.26Å; S527-G529 VanDerWaalsContact C-N 3.3Å; S527-G529 PolarHBondContact O-N 3.03Å; G529-S532 WeakPolarHBondContact O-CB 3.43Å; G529-S532 PolarHBondContact O-N 3.05Å; G529-A533 WeakPolarHBondContact O-CB 3.4Å; G529-A533 PolarHBondContact O-N 2.97Å
530	I	84.1	Confident	85.7	Confident	10 Å²	10	25.5 Å²	25.5	5%	0.051	16%	0.156	C	C	.	.	H	α-helix	trans	-66.6	-44.1	177.6	-58.9	165.7	0	0	0	110.6	Y226 L227 T312 I526 S527 S532 A533 T534	Y226-I530 HydrophobicContact CD1-CG1 4.14Å; Y226-I530 HydrophobicContact CD2-CG1 4.19Å; Y226-I530 HydrophobicContact CG-CD1 4.36Å; Y226-I530 HydrophobicContact CG-CG1 3.71Å; L227-I530 HydrophobicContact CD1-CG2 4.26Å; T312-I530 HydrophobicContact CG2-CD1 4.3Å; T312-I530 HydrophobicContact CG2-CG2 3.71Å; I526-I530 HydrophobicContact CG2-CD1 4.08Å; I526-I530 HydrophobicContact CG2-CG1 4.34Å; I526-I530 WeakPolarHBondContact O-CG1 3.13Å; I526-I530 PolarHBondContact O-N 3.43Å; S527-I530 PolarHBondContact O-N 3.39Å; I530-S532 PolarHBondContact O-N 3.01Å; I530-A533 PolarHBondContact O-N 2.98Å; I530-T534 HydrophobicContact CG2-CG2 4.13Å; I530-T534 WeakPolarHBondContact O-CB 3.05Å; I530-T534 WeakPolarHBondContact O-CG2 3.39Å; I530-T534 PolarHBondContact O-N 3.21Å; I530-T534 PolarHBondContact O-OG1 3.05Å
531	F	87.1	Confident	85.8	Confident	59 Å²	59	25.5 Å²	25.5	26%	0.259	16%	0.156	S	C	.	.	H	α-helix	trans	-59.3	-40.4	173.3	-64.2	-13.8	0	0	0	111.5	F309 T312 V313 L316 S527 T534 L535	F309-F531 HydrophobicContact CD2-CB 4.37Å; F309-F531 AromaticContact CD2-CD1 3.56Å; F309-F531 HydrophobicContact CD2-CD1 3.56Å; F309-F531 HydrophobicContact CD2-CE1 4.13Å; F309-F531 HydrophobicContact CD2-CG 4.18Å; F309-F531 HydrophobicContact CE2-CB 4.01Å; F309-F531 AromaticContact CE2-CD1 3.36Å; F309-F531 HydrophobicContact CE2-CD1 3.36Å; F309-F531 HydrophobicContact CE2-CD2 4.37Å; F309-F531 AromaticContact CE2-CE1 3.81Å; F309-F531 HydrophobicContact CE2-CE1 3.81Å; F309-F531 AromaticContact CE2-CG 3.67Å; F309-F531 HydrophobicContact CE2-CG 3.67Å; F309-F531 HydrophobicContact CE2-CZ 4.47Å; T312-F531 WeakPolarHBondContact OG1-CE1 2.96Å; V313-F531 HydrophobicContact CG2-CE1 3.66Å; V313-F531 HydrophobicContact CG2-CZ 3.84Å; L316-F531 HydrophobicContact CD1-CE1 4.3Å; L316-F531 HydrophobicContact CD1-CE2 4.49Å; L316-F531 HydrophobicContact CD1-CZ 3.67Å; S527-F531 VanDerWaalsContact O-CG 3.32Å; S527-F531 WeakPolarHBondContact O-CG 3.2Å; S527-F531 PolarHBondContact O-N 3.34Å; F531-T534 WeakPolarHBondContact CA-OG1 3.47Å; F531-T534 PolarHBondContact O-OG1 2.93Å; F531-T534 VanDerWaalsContact O-OG1 3.07Å; F531-L535 VanDerWaalsContact O-CB 3.27Å; F531-L535 WeakPolarHBondContact O-CB 3.46Å; F531-L535 VanDerWaalsContact O-CG 3.22Å; F531-L535 WeakPolarHBondContact O-CG 3.24Å; F531-L535 PolarHBondContact O-N 3.16Å
532	S	86.6	Confident	86	Confident	2 Å²	2	23.4 Å²	23.4	1%	0.014	13%	0.134	C	C	.	.	H	α-helix	trans	-65.6	-45.9	178.3	-174.8	0	0	0	0	113	L360 A528 G529 I530 S536	L360-S532 WeakPolarHBondContact CA-OG 3.23Å; L360-S532 WeakPolarHBondContact CB-OG 3.04Å; L360-S532 PolarHBondContact O-OG 2.97Å; A528-S532 VanDerWaalsContact O-CB 3.27Å; A528-S532 WeakPolarHBondContact O-CB 3.34Å; A528-S532 PolarHBondContact O-N 3.23Å; G529-S532 WeakPolarHBondContact O-CB 3.43Å; G529-S532 PolarHBondContact O-N 3.05Å; I530-S532 PolarHBondContact O-N 3.01Å; S532-S536 WeakPolarHBondContact O-CB 3.32Å; S532-S536 PolarHBondContact O-N 3.3Å; S532-S536 PolarHBondContact O-OG 3.36Å
533	A	83.6	Confident	85.9	Confident	1 Å²	1	18.3 Å²	18.3	1%	0.008	11%	0.111	C	C	.	.	H	α-helix	trans	-62.1	-51.4	176.7	0	0	0	0	0	111	L222 I223 L364 G529 I530 S536 S537	L222-A533 HydrophobicContact CB-CB 4.25Å; I223-A533 HydrophobicContact CG1-CB 3.86Å; L364-A533 HydrophobicContact CD1-CB 3.97Å; G529-A533 WeakPolarHBondContact O-CB 3.4Å; G529-A533 PolarHBondContact O-N 2.97Å; I530-A533 PolarHBondContact O-N 2.98Å; A533-S536 PolarHBondContact O-N 2.82Å; A533-S536 PolarHBondContact O-OG 2.96Å; A533-S536 VanDerWaalsContact O-OG 3.1Å; A533-S537 PolarHBondContact O-N 3.46Å; A533-S537 VanDerWaalsContact O-N 3.07Å; A533-S537 PolarHBondContact O-OG 3.04Å; A533-S537 VanDerWaalsContact O-OG 3.14Å
534	T	86.4	Confident	85.8	Confident	0 Å²	0	16.7 Å²	16.7	0%	0	10%	0.1	C	C	.	.	H	α-helix	trans	-60.5	-52.4	-177.1	49.6	0	0	0	0	112.7	I223 F309 I530 F531 S536 A538	I223-T534 HydrophobicContact CB-CG2 4.18Å; I223-T534 VanDerWaalsContact CD1-CA 3.4Å; I223-T534 HydrophobicContact CD1-CG2 4.15Å; I223-T534 HydrophobicContact CG1-CG2 3.64Å; I223-T534 HydrophobicContact CG2-CG2 3.58Å; F309-T534 HydrophobicContact CB-CG2 4.13Å; F309-T534 WeakPolarHBondContact CD2-OG1 3.4Å; I530-T534 HydrophobicContact CG2-CG2 4.13Å; I530-T534 WeakPolarHBondContact O-CB 3.05Å; I530-T534 WeakPolarHBondContact O-CG2 3.39Å; I530-T534 PolarHBondContact O-N 3.21Å; I530-T534 PolarHBondContact O-OG1 3.05Å; F531-T534 WeakPolarHBondContact CA-OG1 3.47Å; F531-T534 PolarHBondContact O-OG1 2.93Å; F531-T534 VanDerWaalsContact O-OG1 3.07Å; T534-S536 PolarHBondContact O-N 3.36Å; T534-A538 WeakPolarHBondContact O-CB 3.42Å; T534-A538 PolarHBondContact O-N 3.4Å
535	L	86.9	Confident	85.7	Confident	44 Å²	44	13.2 Å²	13.2	23%	0.23	8%	0.078	C	C	.	.	H	α-helix	trans	-68.6	-37	-178.5	-63.6	172.2	0	0	0	112	F309 T338 L342 F531 L539	F309-L535 HydrophobicContact CD2-CD2 4.32Å; F309-L535 HydrophobicContact CD2-CG 4.22Å; F309-L535 HydrophobicContact CE2-CD1 4.11Å; F309-L535 HydrophobicContact CE2-CD2 4.41Å; F309-L535 HydrophobicContact CE2-CG 4.27Å; F309-L535 HydrophobicContact CG-CD2 4.37Å; T338-L535 HydrophobicContact CG2-CD2 3.69Å; L342-L535 HydrophobicContact CD1-CD2 4.25Å; L342-L535 HydrophobicContact CD2-CD2 4.13Å; L342-L535 HydrophobicContact CG-CD2 4.44Å; F531-L535 VanDerWaalsContact O-CB 3.27Å; F531-L535 WeakPolarHBondContact O-CB 3.46Å; F531-L535 VanDerWaalsContact O-CG 3.22Å; F531-L535 WeakPolarHBondContact O-CG 3.24Å; F531-L535 PolarHBondContact O-N 3.16Å; L535-L539 WeakPolarHBondContact O-CB 3.28Å; L535-L539 PolarHBondContact O-N 3.39Å
536	S	85.6	Confident	85.6	Confident	2 Å²	2	10.5 Å²	10.5	1%	0.014	6%	0.064	C	C	.	.	H	α-helix	trans	-68.6	-44.1	179.7	67	0	0	0	0	112.9	S532 A533 T534 L539 A540	S532-S536 WeakPolarHBondContact O-CB 3.32Å; S532-S536 PolarHBondContact O-N 3.3Å; S532-S536 PolarHBondContact O-OG 3.36Å; A533-S536 PolarHBondContact O-N 2.82Å; A533-S536 PolarHBondContact O-OG 2.96Å; A533-S536 VanDerWaalsContact O-OG 3.1Å; T534-S536 PolarHBondContact O-N 3.36Å; S536-L539 PolarHBondContact O-N 3.26Å; S536-A540 WeakPolarHBondContact O-CB 3.43Å; S536-A540 PolarHBondContact O-N 3.04Å
537	S	86.5	Confident	85.4	Confident	1 Å²	1	13.9 Å²	13.9	1%	0.007	8%	0.079	C	C	.	.	H	α-helix	trans	-72.8	-34.8	178.2	-48.1	0	0	0	0	112.2	K218 G221 Y305 A533 S541	K218-S537 PolarHBondContact O-OG 3.2Å; G221-S537 WeakPolarHBondContact CA-OG 3.07Å; Y305-S537 VanDerWaalsContact CD2-C 3.48Å; A533-S537 PolarHBondContact O-N 3.46Å; A533-S537 VanDerWaalsContact O-N 3.07Å; A533-S537 PolarHBondContact O-OG 3.04Å; A533-S537 VanDerWaalsContact O-OG 3.14Å; S537-S541 WeakPolarHBondContact O-CB 3.44Å; S537-S541 PolarHBondContact O-N 2.99Å; S537-S541 PolarHBondContact O-OG 3.37Å
538	A	88.5	Confident	85.1	Confident	0 Å²	0	13.6 Å²	13.6	0%	0	8%	0.076	C	C	.	.	H	α-helix	trans	-60.1	-48	171.7	0	0	0	0	0	111.1	V306 L342 T534 S541 L542	V306-A538 HydrophobicContact CG2-CB 4.08Å; L342-A538 HydrophobicContact CD1-CB 3.71Å; T534-A538 WeakPolarHBondContact O-CB 3.42Å; T534-A538 PolarHBondContact O-N 3.4Å; A538-S541 PolarHBondContact O-N 3.39Å; A538-L542 VanDerWaalsContact O-CB 3.22Å; A538-L542 WeakPolarHBondContact O-CB 3.36Å; A538-L542 PolarHBondContact O-N 2.92Å
539	L	86.4	Confident	84.6	Confident	8 Å²	8	13.1 Å²	13.1	4%	0.042	7%	0.067	C	C	.	.	H	α-helix	trans	-64.9	-44.5	179.6	-163.2	161.1	0	0	0	111.3	L342 I345 E353 L535 S536 S541 L542 V543	L342-L539 HydrophobicContact CD2-CB 4.37Å; L342-L539 HydrophobicContact CD2-CD1 4.35Å; I345-L539 HydrophobicContact CG2-CD1 3.87Å; E353-L539 HydrophobicContact CB-CD2 4Å; E353-L539 HydrophobicContact CG-CD2 3.34Å; E353-L539 WeakPolarHBondContact OE1-CD2 3.41Å; L535-L539 WeakPolarHBondContact O-CB 3.28Å; L535-L539 PolarHBondContact O-N 3.39Å; S536-L539 PolarHBondContact O-N 3.26Å; L539-S541 VanDerWaalsContact C-N 3.32Å; L539-S541 PolarHBondContact O-N 3.14Å; L539-L542 PolarHBondContact O-N 3.33Å; L539-V543 HydrophobicContact CD2-CG2 4.18Å; L539-V543 WeakPolarHBondContact O-CG2 3.3Å; L539-V543 PolarHBondContact O-N 3.36Å
540	A	84.5	Confident	84	Confident	16 Å²	16	13.7 Å²	13.7	13%	0.132	7%	0.069	C	C	.	.	H	α-helix	trans	-61.2	-39	176.5	0	0	0	0	0	112.9	N219 S536 S544	N219-A540 WeakPolarHBondContact OD1-CB 2.93Å; S536-A540 WeakPolarHBondContact O-CB 3.43Å; S536-A540 PolarHBondContact O-N 3.04Å; A540-S544 VanDerWaalsContact O-CB 3.3Å; A540-S544 WeakPolarHBondContact O-CB 3.36Å; A540-S544 PolarHBondContact O-N 2.83Å; A540-S544 PolarHBondContact O-OG 3.24Å
541	S	86.6	Confident	83	Confident	1 Å²	1	16.6 Å²	16.6	1%	0.007	8%	0.083	C	C	.	.	H	α-helix	trans	-71.8	-37.8	177.2	-59.4	0	0	0	0	112	Y305 S537 A538 L539 V543 S544 A545	Y305-S541 WeakPolarHBondContact CE2-OG 3.41Å; S537-S541 WeakPolarHBondContact O-CB 3.44Å; S537-S541 PolarHBondContact O-N 2.99Å; S537-S541 PolarHBondContact O-OG 3.37Å; A538-S541 PolarHBondContact O-N 3.39Å; L539-S541 VanDerWaalsContact C-N 3.32Å; L539-S541 PolarHBondContact O-N 3.14Å; S541-V543 VanDerWaalsContact C-N 3.29Å; S541-V543 PolarHBondContact O-N 3.34Å; S541-S544 WeakPolarHBondContact CA-OG 3.25Å; S541-S544 PolarHBondContact O-N 2.84Å; S541-S544 PolarHBondContact O-OG 3.38Å; S541-A545 WeakPolarHBondContact O-CB 2.95Å; S541-A545 PolarHBondContact O-N 2.86Å
542	L	87.1	Confident	81.5	Confident	3 Å²	3	13.8 Å²	13.8	2%	0.016	7%	0.07	C	C	.	.	H	α-helix	trans	-67	-29.7	178.3	-169.8	146.4	0	0	0	112.3	V302 L342 L343 S346 A538 L539 P546 Y579	V302-L542 HydrophobicContact CG1-CB 4.48Å; V302-L542 HydrophobicContact CG1-CD1 4.11Å; V302-L542 HydrophobicContact CG2-CB 3.85Å; L342-L542 HydrophobicContact CB-CD1 4.38Å; L343-L542 HydrophobicContact CD1-CD2 4.46Å; S346-L542 VanDerWaalsContact CB-CD2 3.44Å; S346-L542 WeakPolarHBondContact OG-CD2 3.34Å; A538-L542 VanDerWaalsContact O-CB 3.22Å; A538-L542 WeakPolarHBondContact O-CB 3.36Å; A538-L542 PolarHBondContact O-N 2.92Å; L539-L542 PolarHBondContact O-N 3.33Å; L542-P546 WeakPolarHBondContact O-CD 3.27Å; L542-P546 VanDerWaalsContact O-CG 3.27Å; L542-P546 WeakPolarHBondContact O-CG 3.45Å; L542-Y579 HydrophobicContact CD2-CD1 3.87Å; L542-Y579 HydrophobicContact CD2-CE1 3.97Å; L542-Y579 WeakPolarHBondContact O-CE1 3.45Å
543	V	84.5	Confident	80.4	Confident	6 Å²	6	13.7 Å²	13.7	4%	0.036	7%	0.07	C	C	.	.	H	α-helix	trans	-86.9	-34.3	175.9	173.4	0	0	0	0	112.2	E353 L539 S541 K547 Y579	E353-V543 WeakPolarHBondContact OE2-CG2 3.39Å; L539-V543 HydrophobicContact CD2-CG2 4.18Å; L539-V543 WeakPolarHBondContact O-CG2 3.3Å; L539-V543 PolarHBondContact O-N 3.36Å; S541-V543 VanDerWaalsContact C-N 3.29Å; S541-V543 PolarHBondContact O-N 3.34Å; V543-K547 HydrophobicContact CG1-CD 3.94Å; V543-K547 WeakPolarHBondContact O-CB 3.41Å; V543-K547 WeakPolarHBondContact O-CD 3.3Å; V543-K547 VanDerWaalsContact O-CG 3.27Å; V543-K547 WeakPolarHBondContact O-CG 3.48Å; V543-Y579 HydrophobicContact CG2-CE1 4.34Å
544	S	81.3	Confident	79.5	Confident	11 Å²	11	13.7 Å²	13.7	8%	0.077	7%	0.07	C	C	.	.	H	α-helix	trans	-73.4	-41.4	179.8	61.6	0	0	0	0	113.1	A540 S541 K547 V548	A540-S544 VanDerWaalsContact O-CB 3.3Å; A540-S544 WeakPolarHBondContact O-CB 3.36Å; A540-S544 PolarHBondContact O-N 2.83Å; A540-S544 PolarHBondContact O-OG 3.24Å; S541-S544 WeakPolarHBondContact CA-OG 3.25Å; S541-S544 PolarHBondContact O-N 2.84Å; S541-S544 PolarHBondContact O-OG 3.38Å; S544-K547 PolarHBondContact O-N 3.26Å; S544-V548 WeakPolarHBondContact O-CB 3.19Å; S544-V548 VanDerWaalsContact O-CG2 3.28Å; S544-V548 WeakPolarHBondContact O-CG2 3.34Å; S544-V548 PolarHBondContact O-N 3.48Å
545	A	85.6	Confident	78.6	Confident	2 Å²	2	19 Å²	19	2%	0.017	9%	0.093	C	C	.	.	H	α-helix	trans	-58	-51.2	-177.7	0	0	0	0	0	113.5	N298 A299 S541 V548 F549 T582	N298-A545 HydrophobicContact CB-CB 3.83Å; A299-A545 HydrophobicContact CB-CB 4.38Å; S541-A545 WeakPolarHBondContact O-CB 2.95Å; S541-A545 PolarHBondContact O-N 2.86Å; A545-V548 PolarHBondContact O-N 2.85Å; A545-F549 WeakPolarHBondContact O-CB 3.45Å; A545-F549 PolarHBondContact O-N 3.37Å; A545-T582 HydrophobicContact CB-CG2 3.9Å
546	P	85.3	Confident	77.7	Confident	0 Å²	0	18.3 Å²	18.3	0%	0	9%	0.089	C	C	.	.	H	α-helix	trans	-65.5	-38.6	177.1	-24.1	35.3	0	0	0	113.7	L542 F549 Q550 P575 Y579 T582	L542-P546 WeakPolarHBondContact O-CD 3.27Å; L542-P546 VanDerWaalsContact O-CG 3.27Å; L542-P546 WeakPolarHBondContact O-CG 3.45Å; P546-F549 PolarHBondContact O-N 3.03Å; P546-Q550 VanDerWaalsContact O-CB 3.3Å; P546-Q550 WeakPolarHBondContact O-CB 3.27Å; P546-Q550 PolarHBondContact O-N 3.16Å; P546-P575 HydrophobicContact CB-CB 4.3Å; P546-P575 HydrophobicContact CB-CG 3.68Å; P546-Y579 HydrophobicContact CB-CD1 4.23Å; P546-Y579 HydrophobicContact CB-CE1 4.33Å; P546-Y579 HydrophobicContact CB-CG 4.34Å; P546-Y579 HydrophobicContact CG-CD1 3.54Å; P546-Y579 HydrophobicContact CG-CE1 3.8Å; P546-Y579 HydrophobicContact CG-CG 4.02Å; P546-T582 WeakPolarHBondContact CG-OG1 3.12Å
547	K	79.9	Confident	77.1	Confident	71 Å²	71	22.9 Å²	22.9	31%	0.309	11%	0.114	S	C	.	.	H	α-helix	trans	-63.8	-46.3	177.9	-76.7	178.7	-179.8	170.6	0	110.8	M350 V543 S544 Q551	M350-K547 VanDerWaalsContact SD-CE 3.53Å; M350-K547 PolarHBondContact SD-NZ 3.49Å; V543-K547 HydrophobicContact CG1-CD 3.94Å; V543-K547 WeakPolarHBondContact O-CB 3.41Å; V543-K547 WeakPolarHBondContact O-CD 3.3Å; V543-K547 VanDerWaalsContact O-CG 3.27Å; V543-K547 WeakPolarHBondContact O-CG 3.48Å; S544-K547 PolarHBondContact O-N 3.26Å; K547-Q551 WeakPolarHBondContact O-CB 3.45Å; K547-Q551 PolarHBondContact O-N 2.88Å
548	V	78.5	Confident	76.5	Confident	8 Å²	8	22.9 Å²	22.9	5%	0.048	11%	0.114	C	C	.	.	H	α-helix	trans	-58.7	-54	171.4	176.4	0	0	0	0	108.7	G291 F294 A295 S544 A545 Q550 Q551 A552	G291-V548 WeakPolarHBondContact O-CG1 3.38Å; F294-V548 HydrophobicContact CD1-CG1 4.31Å; F294-V548 HydrophobicContact CD1-CG2 4.07Å; F294-V548 HydrophobicContact CE1-CG2 4.1Å; A295-V548 HydrophobicContact CB-CB 4.34Å; A295-V548 HydrophobicContact CB-CG1 4.04Å; S544-V548 WeakPolarHBondContact O-CB 3.19Å; S544-V548 VanDerWaalsContact O-CG2 3.28Å; S544-V548 WeakPolarHBondContact O-CG2 3.34Å; S544-V548 PolarHBondContact O-N 3.48Å; A545-V548 PolarHBondContact O-N 2.85Å; V548-Q550 PolarHBondContact O-N 2.91Å; V548-Q551 PolarHBondContact O-N 3.28Å; V548-A552 HydrophobicContact CG1-CB 4.19Å; V548-A552 WeakPolarHBondContact O-CA 3.37Å; V548-A552 WeakPolarHBondContact O-CB 3.18Å; V548-A552 PolarHBondContact O-N 3.39Å
549	F	76.1	Confident	75.8	Confident	30 Å²	30	23.9 Å²	23.9	13%	0.132	12%	0.118	C	C	.	.	I	π-helix	trans	-57.6	-45.3	-175.8	-165.6	-96.8	0	0	0	114.1	A295 A545 P546 L553 C554 I562 F565 L581	A295-F549 HydrophobicContact CB-CB 4.34Å; A295-F549 HydrophobicContact CB-CD2 4.35Å; A545-F549 WeakPolarHBondContact O-CB 3.45Å; A545-F549 PolarHBondContact O-N 3.37Å; P546-F549 PolarHBondContact O-N 3.03Å; F549-L553 HydrophobicContact CD2-CD1 3.57Å; F549-L553 HydrophobicContact CE2-CD1 3.84Å; F549-L553 HydrophobicContact CG-CD1 4.29Å; F549-L553 WeakPolarHBondContact O-CB 3.36Å; F549-L553 PolarHBondContact O-N 3.02Å; F549-L553 VanDerWaalsContact O-N 3.14Å; F549-C554 PolarHBondContact O-SG 3.5Å; F549-I562 HydrophobicContact CZ-CG2 4.37Å; F549-F565 HydrophobicContact CD1-CB 4.12Å; F549-F565 HydrophobicContact CD1-CG 4.42Å; F549-F565 HydrophobicContact CE1-CB 3.75Å; F549-F565 HydrophobicContact CE1-CD1 4.34Å; F549-F565 AromaticContact CE1-CD2 3.8Å; F549-F565 HydrophobicContact CE1-CD2 3.8Å; F549-F565 HydrophobicContact CE1-CE2 4.49Å; F549-F565 AromaticContact CE1-CG 3.72Å; F549-F565 HydrophobicContact CE1-CG 3.72Å; F549-F565 HydrophobicContact CZ-CD2 4.42Å; F549-L581 HydrophobicContact CD1-CD2 4.41Å; F549-L581 HydrophobicContact CE1-CD2 3.94Å; F549-L581 HydrophobicContact CE2-CD2 4.27Å; F549-L581 HydrophobicContact CZ-CD2 3.86Å
550	Q	73.6	Confident	74.8	Confident	12 Å²	12	26.7 Å²	26.7	6%	0.056	14%	0.136	C	C	.	.	I	π-helix	trans	-71.6	-50.4	-179.9	-175.4	-164.3	13.6	0	0	112	P546 V548 A552 K555 A566 N573 P575	P546-Q550 VanDerWaalsContact O-CB 3.3Å; P546-Q550 WeakPolarHBondContact O-CB 3.27Å; P546-Q550 PolarHBondContact O-N 3.16Å; V548-Q550 PolarHBondContact O-N 2.91Å; Q550-A552 VanDerWaalsContact C-N 3.34Å; Q550-K555 PolarHBondContact O-N 3.22Å; Q550-A566 PolarHBondContact NE2-O 3.25Å; Q550-A566 VanDerWaalsContact NE2-O 3.13Å; Q550-N573 PolarHBondContact NE2-O 2.92Å; Q550-P575 HydrophobicContact CB-CB 3.79Å; Q550-P575 HydrophobicContact CB-CG 4.25Å; Q550-P575 HydrophobicContact CG-CB 4.04Å
551	Q	62.7	Low	74	Confident	71 Å²	71	35.7 Å²	35.7	33%	0.332	17%	0.168	S	C	.	.	I	π-helix	trans	-71.8	-33.7	-175.5	-166.1	157.6	3.5	0	0	111.4	G272 K547 V548	G272-Q551 VanDerWaalsContact CA-NE2 3.34Å; G272-Q551 PolarHBondContact O-NE2 3.2Å; G272-Q551 VanDerWaalsContact O-NE2 3.16Å; K547-Q551 WeakPolarHBondContact O-CB 3.45Å; K547-Q551 PolarHBondContact O-N 2.88Å; V548-Q551 PolarHBondContact O-N 3.28Å
552	A	56.1	Low	73.5	Confident	0 Å²	0	37.1 Å²	37.1	0%	0	18%	0.175	C	C	.	.	I	π-helix	trans	-83.2	-50	-176	0	0	0	0	0	114.9	Y275 V548 Q550	Y275-A552 HydrophobicContact CD1-CB 3.46Å; Y275-A552 VanDerWaalsContact CD1-CB 3.46Å; Y275-A552 HydrophobicContact CD2-CB 3.17Å; Y275-A552 HydrophobicContact CE1-CB 3.77Å; Y275-A552 HydrophobicContact CE2-CB 3.41Å; Y275-A552 VanDerWaalsContact CE2-CB 3.41Å; Y275-A552 HydrophobicContact CG-CB 3.14Å; Y275-A552 VanDerWaalsContact CZ-CA 3.49Å; Y275-A552 PolarHBondContact OH-O 2.85Å; V548-A552 HydrophobicContact CG1-CB 4.19Å; V548-A552 WeakPolarHBondContact O-CA 3.37Å; V548-A552 WeakPolarHBondContact O-CB 3.18Å; V548-A552 PolarHBondContact O-N 3.39Å; Q550-A552 VanDerWaalsContact C-N 3.34Å
553	L	62.4	Low	72.5	Confident	0 Å²	0	38.3 Å²	38.3	0%	0	19%	0.188	C	C	.	.	I	π-helix	trans	-107.3	-28.8	-161.2	-60.3	161.5	0	0	0	111.3	G288 L292 F549 Y559 I562	G288-L553 WeakPolarHBondContact O-CD2 3.38Å; L292-L553 HydrophobicContact CB-CD1 3.88Å; L292-L553 HydrophobicContact CB-CD2 4.04Å; L292-L553 HydrophobicContact CD1-CD1 4.42Å; L292-L553 HydrophobicContact CG-CD1 4.14Å; F549-L553 HydrophobicContact CD2-CD1 3.57Å; F549-L553 HydrophobicContact CE2-CD1 3.84Å; F549-L553 HydrophobicContact CG-CD1 4.29Å; F549-L553 WeakPolarHBondContact O-CB 3.36Å; F549-L553 PolarHBondContact O-N 3.02Å; F549-L553 VanDerWaalsContact O-N 3.14Å; L553-Y559 HydrophobicContact CD2-CD2 3.92Å; L553-Y559 HydrophobicContact CD2-CE2 3.61Å; L553-I562 HydrophobicContact CB-CD1 3.38Å; L553-I562 HydrophobicContact CG-CD1 4.5Å
554	C	63.9	Low	72.2	Confident	1 Å²	1	43 Å²	43	1%	0.007	21%	0.212	C	C	.	.	I	π-helix	trans	-102.8	-32.9	-167.3	-51.5	0	0	0	0	113	F549 N557 I562 A566	F549-C554 PolarHBondContact O-SG 3.5Å; C554-N557 PolarHBondContact O-OD1 3.16Å; C554-I562 PolarHBondContact SG-O 2.99Å; C554-I562 VanDerWaalsContact SG-O 3.36Å; C554-A566 VanDerWaalsContact CB-CA 3.5Å; C554-A566 HydrophobicContact CB-CB 3.58Å; C554-A566 VanDerWaalsContact O-CB 3.29Å; C554-A566 WeakPolarHBondContact O-CB 3.43Å
555	K	68.8	Low	71.9	Confident	112 Å²	112	45 Å²	45	49%	0.487	22%	0.22	S	C	.	.	T	Hydrogen-bonded Turn	trans	-74	-34.6	172.1	-77.3	-173.6	178.4	178.1	0	112.6	Q550 N557	Q550-K555 PolarHBondContact O-N 3.22Å; K555-N557 VanDerWaalsContact C-N 3.27Å; K555-N557 PolarHBondContact O-N 2.89Å
556	D	68.8	Low	70.8	Confident	30 Å²	30	46 Å²	46	16%	0.16	23%	0.228	C	C	.	.	T	Hydrogen-bonded Turn	trans	-84.5	-0.8	-178.4	-63.5	-7.4	0	0	0	112.8	Y275 I558 W682	Y275-D556 VanDerWaalsContact CE1-OD2 3.27Å; Y275-D556 WeakPolarHBondContact CE1-OD2 3.48Å; Y275-D556 PolarHBondContact OH-OD2 2.98Å; D556-I558 HydrophobicContact CB-CD1 3.97Å; D556-I558 HydrophobicContact CB-CG1 3.82Å; D556-I558 PolarHBondContact O-N 3.12Å; D556-W682 HydrophobicContact CB-CH2 4.47Å; D556-W682 HydrophobicContact CB-CZ2 4.41Å; D556-W682 WeakPolarHBondContact OD1-CH2 3.32Å; D556-W682 WeakPolarHBondContact OD2-CZ2 2.98Å
557	N	71.4	Confident	70.3	Confident	98 Å²	98	52.4 Å²	52.4	52%	0.524	26%	0.256	S	S	.	.	T	Hydrogen-bonded Turn	trans	45.7	29.9	179.9	-75	-37	0	0	0	114.9	C554 K555 Y559 K676	C554-N557 PolarHBondContact O-OD1 3.16Å; K555-N557 VanDerWaalsContact C-N 3.27Å; K555-N557 PolarHBondContact O-N 2.89Å; N557-Y559 VanDerWaalsContact C-N 3.32Å; N557-Y559 PolarHBondContact O-N 3.44Å; N557-K676 PolarHBondContact O-NZ 3.02Å
558	I	74	Confident	70.1	Confident	1 Å²	1	50 Å²	50	1%	0.005	25%	0.251	C	S	.	.	S	Bend	trans	-60.3	-46.9	-179	-63	174.1	0	0	0	109.1	Y275 P284 D556 V673 K676	Y275-I558 VanDerWaalsContact OH-CD1 3.22Å; Y275-I558 WeakPolarHBondContact OH-CD1 3.47Å; P284-I558 HydrophobicContact CB-CD1 4.44Å; D556-I558 HydrophobicContact CB-CD1 3.97Å; D556-I558 HydrophobicContact CB-CG1 3.82Å; D556-I558 PolarHBondContact O-N 3.12Å; I558-V673 HydrophobicContact CG2-CB 4.45Å; I558-V673 HydrophobicContact CG2-CG1 3.91Å; I558-V673 HydrophobicContact CG2-CG2 3.64Å; I558-K676 PolarHBondContact O-NZ 3.49Å
559	Y	73.4	Confident	69.9	Low	21 Å²	21	53.5 Å²	53.5	8%	0.082	26%	0.264	C	S	.	.	S	Bend	trans	-104.7	125.5	173.5	-55.7	-86.8	0	0	0	110.2	L292 L553 N557 Y561 I562 L669 Y672 V673	L292-Y559 HydrophobicContact CD1-CE2 4.18Å; L553-Y559 HydrophobicContact CD2-CD2 3.92Å; L553-Y559 HydrophobicContact CD2-CE2 3.61Å; N557-Y559 VanDerWaalsContact C-N 3.32Å; N557-Y559 PolarHBondContact O-N 3.44Å; Y559-Y561 PolarHBondContact O-N 2.85Å; Y559-I562 HydrophobicContact CD2-CD1 3.85Å; Y559-I562 HydrophobicContact CG-CD1 4.13Å; Y559-I562 VanDerWaalsContact O-CG1 3.25Å; Y559-I562 WeakPolarHBondContact O-CG1 3.38Å; Y559-L669 HydrophobicContact CE1-CD2 3.75Å; Y559-Y672 AromaticContact CD1-CD1 3.68Å; Y559-Y672 HydrophobicContact CD1-CD1 3.68Å; Y559-Y672 AromaticContact CD1-CE1 3.5Å; Y559-Y672 HydrophobicContact CD1-CE1 3.5Å; Y559-Y672 VanDerWaalsContact CD1-CE1 3.5Å; Y559-Y672 AromaticContact CE1-CD1 3.57Å; Y559-Y672 HydrophobicContact CE1-CD1 3.57Å; Y559-Y672 AromaticContact CE1-CE1 3.92Å; Y559-Y672 HydrophobicContact CE1-CE1 3.92Å; Y559-Y672 HydrophobicContact CG-CE1 4.49Å; Y559-V673 HydrophobicContact CE1-CG2 4.03Å; Y559-V673 HydrophobicContact CE2-CG2 4.46Å; Y559-V673 WeakPolarHBondContact OH-CG2 3.47Å
560	P	65.5	Low	69.7	Low	66 Å²	66	55.3 Å²	55.3	43%	0.429	29%	0.29	S	S	.	.	G	3₁₀ helix	trans	-72.9	-27.8	-168.3	28	-30.1	0	0	0	113.5	Y672	P560-Y672 WeakPolarHBondContact CD-OH 3.45Å; P560-Y672 WeakPolarHBondContact CG-OH 3.49Å
561	Y	69	Low	69.6	Low	205 Å²	205	64.8 Å²	64.8	80%	0.804	33%	0.331	S	S	*	.	G	3₁₀ helix	trans	-85.2	-14	-175.1	-68.5	-72.6	0	0	0	114.5	Y559	Y559-Y561 PolarHBondContact O-N 2.85Å
562	I	74.9	Confident	69.8	Low	32 Å²	32	66.2 Å²	66.2	16%	0.164	34%	0.342	C	S	.	.	G	3₁₀ helix	trans	-95.7	0.3	-177.3	60.9	173.4	0	0	0	113.8	F549 L553 C554 Y559 I564 F565	F549-I562 HydrophobicContact CZ-CG2 4.37Å; L553-I562 HydrophobicContact CB-CD1 3.38Å; L553-I562 HydrophobicContact CG-CD1 4.5Å; C554-I562 PolarHBondContact SG-O 2.99Å; C554-I562 VanDerWaalsContact SG-O 3.36Å; Y559-I562 HydrophobicContact CD2-CD1 3.85Å; Y559-I562 HydrophobicContact CG-CD1 4.13Å; Y559-I562 VanDerWaalsContact O-CG1 3.25Å; Y559-I562 WeakPolarHBondContact O-CG1 3.38Å; I562-I564 PolarHBondContact O-N 2.78Å; I562-F565 HydrophobicContact CB-CD2 4.41Å; I562-F565 PolarHBondContact O-N 3.48Å
563	G	67.2	Low	70.6	Confident	28 Å²	28	71 Å²	71	29%	0.289	37%	0.367	S	S	.	.	G	3₁₀ helix	trans	-57.8	-18.5	179.2	0	0	0	0	0	114.3	F565 A566	G563-F565 PolarHBondContact O-N 2.85Å; G563-A566 VanDerWaalsContact O-CB 3.23Å; G563-A566 WeakPolarHBondContact O-CB 3.46Å; G563-A566 PolarHBondContact O-N 2.89Å; G563-A566 VanDerWaalsContact O-N 3.1Å
564	I	78.1	Confident	71.2	Confident	104 Å²	104	72.3 Å²	72.3	53%	0.533	37%	0.373	S	S	.	.	G	3₁₀ helix	trans	-59.4	-30.8	173.7	-58.6	176.1	0	0	0	111.8	I562 R577	I562-I564 PolarHBondContact O-N 2.78Å; I564-R577 WeakPolarHBondContact O-CD 3.46Å; I564-R577 PolarHBondContact O-NH1 3.43Å
565	F	74.4	Confident	72.1	Confident	54 Å²	54	72.5 Å²	72.5	24%	0.237	37%	0.374	C	S	.	.	G	3₁₀ helix	trans	-86.9	-4.6	-180	-62.2	-82.4	0	0	0	113.5	F549 I562 G563 K567 R577 L581	F549-F565 HydrophobicContact CD1-CB 4.12Å; F549-F565 HydrophobicContact CD1-CG 4.42Å; F549-F565 HydrophobicContact CE1-CB 3.75Å; F549-F565 HydrophobicContact CE1-CD1 4.34Å; F549-F565 AromaticContact CE1-CD2 3.8Å; F549-F565 HydrophobicContact CE1-CD2 3.8Å; F549-F565 HydrophobicContact CE1-CE2 4.49Å; F549-F565 AromaticContact CE1-CG 3.72Å; F549-F565 HydrophobicContact CE1-CG 3.72Å; F549-F565 HydrophobicContact CZ-CD2 4.42Å; I562-F565 HydrophobicContact CB-CD2 4.41Å; I562-F565 PolarHBondContact O-N 3.48Å; G563-F565 PolarHBondContact O-N 2.85Å; F565-K567 VanDerWaalsContact C-N 3.34Å; F565-K567 PolarHBondContact O-N 2.72Å; F565-R577 HydrophobicContact CD1-CB 3.62Å; F565-R577 HydrophobicContact CE1-CB 4.12Å; F565-L581 HydrophobicContact CE1-CB 4.21Å; F565-L581 HydrophobicContact CE1-CD2 4.31Å; F565-L581 HydrophobicContact CZ-CD2 4.36Å
566	A	63.8	Low	72.7	Confident	23 Å²	23	70.1 Å²	70.1	19%	0.19	37%	0.367	C	S	.	.			trans	-71.3	-28	-179.4	0	0	0	0	0	113.3	Q550 C554 G563 G568	Q550-A566 PolarHBondContact NE2-O 3.25Å; Q550-A566 VanDerWaalsContact NE2-O 3.13Å; C554-A566 VanDerWaalsContact CB-CA 3.5Å; C554-A566 HydrophobicContact CB-CB 3.58Å; C554-A566 VanDerWaalsContact O-CB 3.29Å; C554-A566 WeakPolarHBondContact O-CB 3.43Å; G563-A566 VanDerWaalsContact O-CB 3.23Å; G563-A566 WeakPolarHBondContact O-CB 3.46Å; G563-A566 PolarHBondContact O-N 2.89Å; G563-A566 VanDerWaalsContact O-N 3.1Å; A566-G568 PolarHBondContact O-N 3.03Å; A566-G568 VanDerWaalsContact O-N 3.07Å
567	K	74.9	Confident	73.5	Confident	133 Å²	133	73.2 Å²	73.2	58%	0.578	38%	0.376	S	S	*	.			trans	-70	106.5	-172.9	-165.5	172	-174.9	176.6	0	110.5	F565 Y569	F565-K567 VanDerWaalsContact C-N 3.34Å; F565-K567 PolarHBondContact O-N 2.72Å; K567-Y569 HydrophobicContact CB-CE2 4.34Å; K567-Y569 HydrophobicContact CG-CE2 4.28Å; K567-Y569 VanDerWaalsContact O-CD2 3.3Å; K567-Y569 WeakPolarHBondContact O-CD2 3.33Å; K567-Y569 WeakPolarHBondContact O-CE2 3.32Å
568	G	75.6	Confident	74.2	Confident	20 Å²	20	68.6 Å²	68.6	21%	0.206	35%	0.352	C	S	.	.			trans	-72.5	143.1	169.2	0	0	0	0	0	110.6	A566	A566-G568 PolarHBondContact O-N 3.03Å; A566-G568 VanDerWaalsContact O-N 3.07Å
569	Y	73.1	Confident	74.9	Confident	83 Å²	83	68.7 Å²	68.7	33%	0.325	35%	0.352	S	S	.	.	B	Isolated β-bridge	trans	-115	148.1	175.9	-69.7	-97.2	0	0	0	109.5	K567 E574 L576 R577	K567-Y569 HydrophobicContact CB-CE2 4.34Å; K567-Y569 HydrophobicContact CG-CE2 4.28Å; K567-Y569 VanDerWaalsContact O-CD2 3.3Å; K567-Y569 WeakPolarHBondContact O-CD2 3.33Å; K567-Y569 WeakPolarHBondContact O-CE2 3.32Å; Y569-E574 PolarHBondContact N-O 3.21Å; Y569-E574 PolarHBondContact O-N 3.36Å; Y569-L576 HydrophobicContact CD2-CB 4.25Å; Y569-L576 HydrophobicContact CD2-CD1 4.35Å; Y569-L576 HydrophobicContact CG-CD1 3.96Å; Y569-R577 HydrophobicContact CE2-CG 4.47Å
570	G	73.1	Confident	75.6	Confident	67 Å²	67	73.1 Å²	73.1	69%	0.691	38%	0.376	S	S	*	.	T	Hydrogen-bonded Turn	trans	82	176.8	179.1	0	0	0	0	0	115	N572 N573	G570-N572 PolarHBondContact O-N 3.34Å; G570-N573 PolarHBondContact O-N 2.96Å
571	K	70.2	Confident	76.8	Confident	211 Å²	211	72.8 Å²	72.8	92%	0.917	37%	0.37	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65	-23.2	-175.5	-164.9	174.1	-179.9	180	0	113.2
572	N	67.3	Low	77.8	Confident	102 Å²	102	63.4 Å²	63.4	55%	0.545	34%	0.335	S	S	.	.	T	Hydrogen-bonded Turn	trans	-101.4	7.7	-177.8	-63.8	-13.7	0	0	0	114	G570 E574	G570-N572 PolarHBondContact O-N 3.34Å; N572-E574 HydrophobicContact CB-CG 4Å; N572-E574 PolarHBondContact O-N 2.98Å
573	N	72.8	Confident	78.6	Confident	101 Å²	101	64 Å²	64	54%	0.54	34%	0.336	S	S	.	.	T	Hydrogen-bonded Turn	trans	55.7	41.8	-176.8	-70.1	-48.4	0	0	0	114.6	Q550 G570	Q550-N573 PolarHBondContact NE2-O 2.92Å; G570-N573 PolarHBondContact O-N 2.96Å
574	E	75.6	Confident	79.9	Confident	26 Å²	26	64.5 Å²	64.5	12%	0.121	34%	0.341	C	S	.	.	B	Isolated β-bridge	trans	-77	139	-174.5	-68.7	176	-173.6	0	0	112.5	Y569 N572 L576	Y569-E574 PolarHBondContact N-O 3.21Å; Y569-E574 PolarHBondContact O-N 3.36Å; N572-E574 HydrophobicContact CB-CG 4Å; N572-E574 PolarHBondContact O-N 2.98Å; E574-L576 PolarHBondContact O-N 3.44Å
575	P	81.9	Confident	80.6	Confident	5 Å²	5	61.3 Å²	61.3	3%	0.032	33%	0.325	C	S	.	.			trans	-81.3	74.8	-178.2	27.8	-29.7	0	0	0	113	P546 Q550 R577 G578 Y579	P546-P575 HydrophobicContact CB-CB 4.3Å; P546-P575 HydrophobicContact CB-CG 3.68Å; Q550-P575 HydrophobicContact CB-CB 3.79Å; Q550-P575 HydrophobicContact CB-CG 4.25Å; Q550-P575 HydrophobicContact CG-CB 4.04Å; P575-R577 PolarHBondContact O-N 3.33Å; P575-G578 PolarHBondContact O-N 3.38Å; P575-Y579 HydrophobicContact CG-CD2 4.46Å; P575-Y579 HydrophobicContact CG-CE2 4.22Å; P575-Y579 WeakPolarHBondContact O-CD2 3.28Å; P575-Y579 PolarHBondContact O-N 2.9Å
576	L	82.7	Confident	81.5	Confident	63 Å²	63	58.8 Å²	58.8	33%	0.33	31%	0.314	S	S	.	.	H	α-helix	trans	-53.6	-41.6	176.8	-70.8	177.8	0	0	0	112.8	V347 Y569 E574 G578 Y579 I580	V347-L576 HydrophobicContact CG1-CD2 4.08Å; V347-L576 HydrophobicContact CG2-CD2 4.35Å; Y569-L576 HydrophobicContact CD2-CB 4.25Å; Y569-L576 HydrophobicContact CD2-CD1 4.35Å; Y569-L576 HydrophobicContact CG-CD1 3.96Å; E574-L576 PolarHBondContact O-N 3.44Å; L576-G578 VanDerWaalsContact C-N 3.34Å; L576-G578 PolarHBondContact O-N 2.9Å; L576-Y579 PolarHBondContact O-N 3.29Å; L576-I580 WeakPolarHBondContact O-CG1 3.36Å; L576-I580 PolarHBondContact O-N 3.05Å; L576-I580 VanDerWaalsContact O-N 3.1Å
577	R	84.6	Confident	82.9	Confident	94 Å²	94	59.9 Å²	59.9	36%	0.355	32%	0.316	S	S	.	.	H	α-helix	trans	-67.2	-33.8	177.5	-66.4	-179.4	171.6	176.6	-8.1	112.9	I564 F565 Y569 P575 I580 L581	I564-R577 WeakPolarHBondContact O-CD 3.46Å; I564-R577 PolarHBondContact O-NH1 3.43Å; F565-R577 HydrophobicContact CD1-CB 3.62Å; F565-R577 HydrophobicContact CE1-CB 4.12Å; Y569-R577 HydrophobicContact CE2-CG 4.47Å; P575-R577 PolarHBondContact O-N 3.33Å; R577-I580 PolarHBondContact O-N 3.34Å; R577-L581 PolarHBondContact O-N 3.49Å
578	G	86.1	Confident	83.8	Confident	1 Å²	1	56.3 Å²	56.3	1%	0.01	31%	0.311	C	S	.	.	H	α-helix	trans	-69.9	-38.6	175.9	0	0	0	0	0	112.1	P575 L576 L581 T582	P575-G578 PolarHBondContact O-N 3.38Å; L576-G578 VanDerWaalsContact C-N 3.34Å; L576-G578 PolarHBondContact O-N 2.9Å; G578-L581 PolarHBondContact O-N 3.45Å; G578-T582 WeakPolarHBondContact O-CB 3.35Å; G578-T582 PolarHBondContact O-N 2.83Å; G578-T582 PolarHBondContact O-OG1 3Å
579	Y	88.1	Confident	84.6	Confident	3 Å²	3	57.1 Å²	57.1	1%	0.012	31%	0.309	C	S	.	.	H	α-helix	trans	-60.8	-44.3	172.2	-76.3	-65.3	0	0	0	111.7	L542 V543 P546 P575 L576 L581 T582 F583	L542-Y579 HydrophobicContact CD2-CD1 3.87Å; L542-Y579 HydrophobicContact CD2-CE1 3.97Å; L542-Y579 WeakPolarHBondContact O-CE1 3.45Å; V543-Y579 HydrophobicContact CG2-CE1 4.34Å; P546-Y579 HydrophobicContact CB-CD1 4.23Å; P546-Y579 HydrophobicContact CB-CE1 4.33Å; P546-Y579 HydrophobicContact CB-CG 4.34Å; P546-Y579 HydrophobicContact CG-CD1 3.54Å; P546-Y579 HydrophobicContact CG-CE1 3.8Å; P546-Y579 HydrophobicContact CG-CG 4.02Å; P575-Y579 HydrophobicContact CG-CD2 4.46Å; P575-Y579 HydrophobicContact CG-CE2 4.22Å; P575-Y579 WeakPolarHBondContact O-CD2 3.28Å; P575-Y579 PolarHBondContact O-N 2.9Å; L576-Y579 PolarHBondContact O-N 3.29Å; Y579-L581 PolarHBondContact O-N 3.26Å; Y579-T582 PolarHBondContact O-N 2.89Å; Y579-F583 VanDerWaalsContact O-CB 3.26Å; Y579-F583 WeakPolarHBondContact O-CB 3.49Å; Y579-F583 PolarHBondContact O-N 3.16Å
580	I	89.7	Confident	85.5	Confident	114 Å²	114	53.1 Å²	53.1	59%	0.585	29%	0.294	S	S	*	.	H	α-helix	trans	-62.9	-42.1	176.8	-65.4	165.6	0	0	0	111.5	L576 R577 F583 G584	L576-I580 WeakPolarHBondContact O-CG1 3.36Å; L576-I580 PolarHBondContact O-N 3.05Å; L576-I580 VanDerWaalsContact O-N 3.1Å; R577-I580 PolarHBondContact O-N 3.34Å; I580-F583 PolarHBondContact O-N 3.02Å; I580-G584 PolarHBondContact O-N 3.4Å
581	L	89.4	Confident	86.4	Confident	60 Å²	60	54.3 Å²	54.3	31%	0.314	28%	0.284	S	S	.	.	H	α-helix	trans	-62.5	-47	176.7	-179.2	67.3	0	0	0	111.4	F549 F565 R577 G578 Y579 F583 G584 I585	F549-L581 HydrophobicContact CD1-CD2 4.41Å; F549-L581 HydrophobicContact CE1-CD2 3.94Å; F549-L581 HydrophobicContact CE2-CD2 4.27Å; F549-L581 HydrophobicContact CZ-CD2 3.86Å; F565-L581 HydrophobicContact CE1-CB 4.21Å; F565-L581 HydrophobicContact CE1-CD2 4.31Å; F565-L581 HydrophobicContact CZ-CD2 4.36Å; R577-L581 PolarHBondContact O-N 3.49Å; G578-L581 PolarHBondContact O-N 3.45Å; Y579-L581 PolarHBondContact O-N 3.26Å; L581-F583 VanDerWaalsContact C-N 3.32Å; L581-F583 PolarHBondContact O-N 2.86Å; L581-G584 PolarHBondContact O-N 3.47Å; L581-I585 HydrophobicContact CD1-CD1 4.43Å; L581-I585 HydrophobicContact CG-CD1 4.18Å; L581-I585 WeakPolarHBondContact O-CG1 3.29Å; L581-I585 PolarHBondContact O-N 2.98Å
582	T	90.7	Very high	87.3	Confident	8 Å²	8	47.5 Å²	47.5	5%	0.049	26%	0.257	C	S	.	.	H	α-helix	trans	-62.7	-41.6	178.7	-56.2	0	0	0	0	110.9	A299 A545 P546 G578 Y579 I585 A586	A299-T582 HydrophobicContact CB-CG2 3.87Å; A545-T582 HydrophobicContact CB-CG2 3.9Å; P546-T582 WeakPolarHBondContact CG-OG1 3.12Å; G578-T582 WeakPolarHBondContact O-CB 3.35Å; G578-T582 PolarHBondContact O-N 2.83Å; G578-T582 PolarHBondContact O-OG1 3Å; Y579-T582 PolarHBondContact O-N 2.89Å; T582-I585 PolarHBondContact O-N 3.05Å; T582-A586 VanDerWaalsContact O-CB 3.3Å; T582-A586 WeakPolarHBondContact O-CB 3.42Å; T582-A586 PolarHBondContact O-N 3.3Å
583	F	91.8	Very high	88.2	Confident	43 Å²	43	43 Å²	43	19%	0.189	23%	0.233	C	C	.	.	H	α-helix	trans	-60.5	-44.9	174	174.8	-96.8	0	0	0	112.2	V339 I340 L343 Y579 I580 L581 I585 A586 L587	V339-F583 HydrophobicContact CG1-CD2 4.45Å; V339-F583 HydrophobicContact CG1-CE2 3.86Å; V339-F583 HydrophobicContact CG2-CD2 4.04Å; V339-F583 HydrophobicContact CG2-CE2 4.25Å; I340-F583 HydrophobicContact CG1-CE2 3.86Å; I340-F583 HydrophobicContact CG1-CZ 3.86Å; L343-F583 HydrophobicContact CB-CD2 4.31Å; L343-F583 HydrophobicContact CD1-CB 4.49Å; L343-F583 HydrophobicContact CD2-CB 4.23Å; L343-F583 HydrophobicContact CD2-CD2 3.71Å; L343-F583 HydrophobicContact CD2-CE2 4.16Å; L343-F583 HydrophobicContact CD2-CG 3.9Å; L343-F583 HydrophobicContact CG-CD2 4.49Å; Y579-F583 VanDerWaalsContact O-CB 3.26Å; Y579-F583 WeakPolarHBondContact O-CB 3.49Å; Y579-F583 PolarHBondContact O-N 3.16Å; I580-F583 PolarHBondContact O-N 3.02Å; L581-F583 VanDerWaalsContact C-N 3.32Å; L581-F583 PolarHBondContact O-N 2.86Å; F583-I585 PolarHBondContact O-N 3.26Å; F583-A586 PolarHBondContact O-N 3.41Å; F583-L587 HydrophobicContact CE1-CD2 4.25Å; F583-L587 HydrophobicContact CZ-CD2 4.44Å; F583-L587 VanDerWaalsContact O-CB 3.27Å; F583-L587 WeakPolarHBondContact O-CB 3.36Å; F583-L587 PolarHBondContact O-N 2.93Å
584	G	93.8	Very high	88.6	Confident	39 Å²	39	43.2 Å²	43.2	40%	0.402	23%	0.231	S	C	.	.	H	α-helix	trans	-62.2	-42.3	177.5	0	0	0	0	0	112.8	I580 L581 A588	I580-G584 PolarHBondContact O-N 3.4Å; L581-G584 PolarHBondContact O-N 3.47Å; G584-A588 PolarHBondContact O-N 3.46Å; G584-A588 VanDerWaalsContact O-N 3.17Å
585	I	93.2	Very high	88.8	Confident	38 Å²	38	42.5 Å²	42.5	20%	0.195	23%	0.228	C	C	.	.	H	α-helix	trans	-65	-49.7	175.3	-64.2	167.3	0	0	0	110	F296 A299 V300 L581 T582 F583 L587 A588 F589	F296-I585 HydrophobicContact CD2-CD1 4.35Å; F296-I585 HydrophobicContact CE2-CD1 4.42Å; F296-I585 HydrophobicContact CE2-CG2 4.23Å; A299-I585 HydrophobicContact CB-CB 4.31Å; A299-I585 HydrophobicContact CB-CD1 4.34Å; A299-I585 HydrophobicContact CB-CG2 4.03Å; V300-I585 HydrophobicContact CG2-CG2 4.24Å; L581-I585 HydrophobicContact CD1-CD1 4.43Å; L581-I585 HydrophobicContact CG-CD1 4.18Å; L581-I585 WeakPolarHBondContact O-CG1 3.29Å; L581-I585 PolarHBondContact O-N 2.98Å; T582-I585 PolarHBondContact O-N 3.05Å; F583-I585 PolarHBondContact O-N 3.26Å; I585-L587 VanDerWaalsContact C-N 3.33Å; I585-L587 PolarHBondContact O-N 3.44Å; I585-A588 PolarHBondContact O-N 3.14Å; I585-F589 HydrophobicContact CG2-CD2 4.03Å; I585-F589 HydrophobicContact CG2-CE2 4.05Å; I585-F589 WeakPolarHBondContact O-CD2 3.38Å; I585-F589 PolarHBondContact O-N 3.29Å
586	A	92.6	Very high	88.6	Confident	0 Å²	0	44.7 Å²	44.7	0%	0	24%	0.239	C	C	.	.	H	α-helix	trans	-59.5	-43.7	-179.6	0	0	0	0	0	111.7	V302 A303 V339 T582 F583 A588 F589 I590	V302-A586 HydrophobicContact CB-CB 4.11Å; V302-A586 HydrophobicContact CG1-CB 3.91Å; A303-A586 WeakPolarHBondContact CB-O 3.24Å; V339-A586 HydrophobicContact CG2-CB 4.48Å; T582-A586 VanDerWaalsContact O-CB 3.3Å; T582-A586 WeakPolarHBondContact O-CB 3.42Å; T582-A586 PolarHBondContact O-N 3.3Å; F583-A586 PolarHBondContact O-N 3.41Å; A586-A588 VanDerWaalsContact C-N 3.34Å; A586-A588 PolarHBondContact O-N 2.75Å; A586-F589 PolarHBondContact O-N 3.43Å; A586-I590 VanDerWaalsContact O-CG1 3.24Å; A586-I590 WeakPolarHBondContact O-CG1 3.39Å; A586-I590 PolarHBondContact O-N 2.83Å
587	L	94.2	Very high	88.7	Confident	46 Å²	46	44.5 Å²	44.5	24%	0.241	24%	0.241	C	C	.	.	H	α-helix	trans	-61.1	-41.9	178.1	-172.4	67.4	0	0	0	111.8	T336 V339 F583 I585 F589 I590 L591	T336-L587 HydrophobicContact CG2-CD1 3.8Å; V339-L587 HydrophobicContact CG1-CD1 4.43Å; F583-L587 HydrophobicContact CE1-CD2 4.25Å; F583-L587 HydrophobicContact CZ-CD2 4.44Å; F583-L587 VanDerWaalsContact O-CB 3.27Å; F583-L587 WeakPolarHBondContact O-CB 3.36Å; F583-L587 PolarHBondContact O-N 2.93Å; I585-L587 VanDerWaalsContact C-N 3.33Å; I585-L587 PolarHBondContact O-N 3.44Å; L587-F589 VanDerWaalsContact C-N 3.31Å; L587-F589 PolarHBondContact O-N 2.93Å; L587-I590 PolarHBondContact O-N 3.3Å; L587-L591 WeakPolarHBondContact O-CG 3.25Å; L587-L591 PolarHBondContact O-N 3.1Å
588	A	94.3	Very high	88.7	Confident	58 Å²	58	40 Å²	40	48%	0.479	22%	0.224	S	C	.	.	H	α-helix	trans	-60.2	-40	177.4	0	0	0	0	0	112.4	G584 I585 A586	G584-A588 PolarHBondContact O-N 3.46Å; G584-A588 VanDerWaalsContact O-N 3.17Å; I585-A588 PolarHBondContact O-N 3.14Å; A586-A588 VanDerWaalsContact C-N 3.34Å; A586-A588 PolarHBondContact O-N 2.75Å
589	F	92.3	Very high	88.5	Confident	37 Å²	37	40 Å²	40	16%	0.162	22%	0.224	C	C	.	.	H	α-helix	trans	-76.9	-31.3	176.8	-79.3	-82.5	0	0	0	113.2	F296 V300 A303 I585 A586 L587 L591 I592 I598 I601	F296-F589 HydrophobicContact CZ-CE2 4.3Å; F296-F589 HydrophobicContact CZ-CZ 4.48Å; V300-F589 HydrophobicContact CB-CD2 4.48Å; V300-F589 HydrophobicContact CB-CE2 4.49Å; V300-F589 HydrophobicContact CG1-CD1 3.92Å; V300-F589 HydrophobicContact CG1-CD2 4.07Å; V300-F589 HydrophobicContact CG1-CE1 4.02Å; V300-F589 HydrophobicContact CG1-CE2 4.18Å; V300-F589 HydrophobicContact CG1-CG 3.96Å; V300-F589 HydrophobicContact CG1-CZ 4.15Å; V300-F589 HydrophobicContact CG2-CD2 3.94Å; V300-F589 HydrophobicContact CG2-CE2 3.56Å; V300-F589 HydrophobicContact CG2-CZ 3.95Å; A303-F589 HydrophobicContact CB-CB 3.43Å; A303-F589 VanDerWaalsContact CB-CB 3.43Å; I585-F589 HydrophobicContact CG2-CD2 4.03Å; I585-F589 HydrophobicContact CG2-CE2 4.05Å; I585-F589 WeakPolarHBondContact O-CD2 3.38Å; I585-F589 PolarHBondContact O-N 3.29Å; A586-F589 PolarHBondContact O-N 3.43Å; L587-F589 VanDerWaalsContact C-N 3.31Å; L587-F589 PolarHBondContact O-N 2.93Å; F589-L591 PolarHBondContact O-N 3.3Å; F589-I592 HydrophobicContact CD1-CD1 3.87Å; F589-I592 HydrophobicContact CE1-CD1 4.46Å; F589-I592 WeakPolarHBondContact O-CB 3.44Å; F589-I592 PolarHBondContact O-N 3.49Å; F589-I598 WeakPolarHBondContact O-CD1 3.3Å; F589-I601 HydrophobicContact CE1-CD1 4.08Å; F589-I601 HydrophobicContact CE1-CG2 4.21Å
590	I	92.5	Very high	88.4	Confident	0 Å²	0	41.3 Å²	41.3	0%	0	23%	0.233	C	C	.	.	H	α-helix	trans	-61.9	-34.2	174	-71.9	163.8	0	0	0	111.2	A303 V306 V307 V339 A586 L587 I592 A593	A303-I590 HydrophobicContact CB-CG1 3.86Å; V306-I590 HydrophobicContact CB-CD1 4.15Å; V306-I590 HydrophobicContact CG1-CD1 3.85Å; V306-I590 HydrophobicContact CG1-CG1 4.37Å; V307-I590 HydrophobicContact CG2-CB 4.45Å; V307-I590 HydrophobicContact CG2-CG1 4.24Å; V307-I590 HydrophobicContact CG2-CG2 4.49Å; V339-I590 HydrophobicContact CB-CD1 3.81Å; V339-I590 HydrophobicContact CG1-CD1 3.76Å; V339-I590 HydrophobicContact CG2-CD1 4.13Å; A586-I590 VanDerWaalsContact O-CG1 3.24Å; A586-I590 WeakPolarHBondContact O-CG1 3.39Å; A586-I590 PolarHBondContact O-N 2.83Å; L587-I590 PolarHBondContact O-N 3.3Å; I590-I592 PolarHBondContact O-N 3.17Å; I590-A593 PolarHBondContact O-N 3.21Å
591	L	91.7	Very high	88.3	Confident	92 Å²	92	38.8 Å²	38.8	48%	0.482	22%	0.22	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.5	-19.8	179.1	-68.9	174.3	0	0	0	113.9	R332 L587 F589 A593	R332-L591 PolarHBondContact NE-O 2.78Å; R332-L591 PolarHBondContact NH2-O 3.26Å; L587-L591 WeakPolarHBondContact O-CG 3.25Å; L587-L591 PolarHBondContact O-N 3.1Å; F589-L591 PolarHBondContact O-N 3.3Å; L591-A593 VanDerWaalsContact C-N 3.28Å
592	I	89.4	Confident	88.2	Confident	68 Å²	68	36 Å²	36	35%	0.349	21%	0.205	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.5	-39.1	173.1	-57.8	174.1	0	0	0	109.7	F589 I590 E594 I598	F589-I592 HydrophobicContact CD1-CD1 3.87Å; F589-I592 HydrophobicContact CE1-CD1 4.46Å; F589-I592 WeakPolarHBondContact O-CB 3.44Å; F589-I592 PolarHBondContact O-N 3.49Å; I590-I592 PolarHBondContact O-N 3.17Å; I592-E594 PolarHBondContact O-N 3.02Å; I592-I598 HydrophobicContact CB-CD1 4.36Å; I592-I598 HydrophobicContact CB-CG1 4.39Å; I592-I598 HydrophobicContact CD1-CG1 4.39Å; I592-I598 HydrophobicContact CG2-CG1 4.42Å
593	A	84.8	Confident	88.1	Confident	6 Å²	6	35.6 Å²	35.6	5%	0.05	20%	0.203	C	C	.	.			trans	61.3	18.7	174	0	0	0	0	0	116.4	I328 I331 R332 I590 L591	I328-A593 HydrophobicContact CG2-CB 3.85Å; I331-A593 HydrophobicContact CB-CB 4.42Å; I331-A593 HydrophobicContact CG2-CB 4.02Å; R332-A593 HydrophobicContact CG-CB 3.44Å; R332-A593 VanDerWaalsContact CG-CB 3.44Å; I590-A593 PolarHBondContact O-N 3.21Å; L591-A593 VanDerWaalsContact C-N 3.28Å
594	E	82.2	Confident	88.1	Confident	106 Å²	106	34 Å²	34	50%	0.495	20%	0.196	S	C	.	.			trans	-129	120.2	176.9	-174	175.2	-157.5	0	0	109.7	I592 T597 I598	I592-E594 PolarHBondContact O-N 3.02Å; E594-T597 HydrophobicContact CG-CG2 4.44Å; E594-T597 PolarHBondContact O-OG1 3.5Å; E594-T597 VanDerWaalsContact O-OG1 3.05Å; E594-T597 WeakPolarHBondContact OE2-CG2 3.22Å; E594-I598 WeakPolarHBondContact O-CD1 3.48Å; E594-I598 VanDerWaalsContact O-CG1 3.3Å; E594-I598 WeakPolarHBondContact O-CG1 3.2Å; E594-I598 PolarHBondContact O-N 2.9Å
595	L	78.3	Confident	87.9	Confident	11 Å²	11	34 Å²	34	6%	0.058	19%	0.185	C	C	.	.	H	α-helix	trans	-70.9	-37.6	-171.5	-170.5	59.2	0	0	0	112.3	L228 M304 V307 T597 I598 A599	L228-L595 HydrophobicContact CD1-CD2 3.25Å; L228-L595 HydrophobicContact CD1-CG 3.84Å; M304-L595 HydrophobicContact CB-CD1 4.43Å; M304-L595 HydrophobicContact CE-CD1 4.3Å; M304-L595 HydrophobicContact CG-CD1 3.53Å; V307-L595 HydrophobicContact CG1-CB 4.33Å; V307-L595 HydrophobicContact CG1-CD1 4.35Å; L595-T597 VanDerWaalsContact C-N 3.29Å; L595-T597 PolarHBondContact O-N 3.47Å; L595-I598 PolarHBondContact O-N 3.16Å; L595-A599 PolarHBondContact O-N 2.88Å
596	N	79.3	Confident	87.7	Confident	51 Å²	51	32.2 Å²	32.2	27%	0.273	18%	0.176	S	C	.	.	H	α-helix	trans	-67.4	-25.6	-176.9	-65.5	-26.8	0	0	0	113.2	I414 P600	I414-N596 HydrophobicContact CD1-CB 4.47Å; N596-P600 WeakPolarHBondContact O-CD 3.3Å; N596-P600 WeakPolarHBondContact O-CG 2.83Å
597	T	83.9	Confident	87.7	Confident	60 Å²	60	32.2 Å²	32.2	37%	0.368	18%	0.176	S	C	.	.	H	α-helix	trans	-86.3	-29.4	175.3	48.8	0	0	0	0	112.7	E594 L595	E594-T597 HydrophobicContact CG-CG2 4.44Å; E594-T597 PolarHBondContact O-OG1 3.5Å; E594-T597 VanDerWaalsContact O-OG1 3.05Å; E594-T597 WeakPolarHBondContact OE2-CG2 3.22Å; L595-T597 VanDerWaalsContact C-N 3.29Å; L595-T597 PolarHBondContact O-N 3.47Å
598	I	84.7	Confident	87.5	Confident	0 Å²	0	30.1 Å²	30.1	0%	0	17%	0.165	C	C	.	.	H	α-helix	trans	-76.4	-38.6	178.8	-61.6	166.6	0	0	0	111.2	V300 M304 V307 F589 I592 E594 L595 I601 I602	V300-I598 HydrophobicContact CG1-CG2 4.45Å; M304-I598 HydrophobicContact CB-CG2 4.02Å; V307-I598 HydrophobicContact CG2-CD1 4.06Å; F589-I598 WeakPolarHBondContact O-CD1 3.3Å; I592-I598 HydrophobicContact CB-CD1 4.36Å; I592-I598 HydrophobicContact CB-CG1 4.39Å; I592-I598 HydrophobicContact CD1-CG1 4.39Å; I592-I598 HydrophobicContact CG2-CG1 4.42Å; E594-I598 WeakPolarHBondContact O-CD1 3.48Å; E594-I598 VanDerWaalsContact O-CG1 3.3Å; E594-I598 WeakPolarHBondContact O-CG1 3.2Å; E594-I598 PolarHBondContact O-N 2.9Å; L595-I598 PolarHBondContact O-N 3.16Å; I598-I601 WeakPolarHBondContact O-CB 3.28Å; I598-I601 PolarHBondContact O-N 3.43Å; I598-I602 HydrophobicContact CG2-CD1 3.73Å; I598-I602 HydrophobicContact CG2-CG1 4.39Å; I598-I602 PolarHBondContact O-N 3.13Å
599	A	82.7	Confident	87.3	Confident	0 Å²	0	27.4 Å²	27.4	0%	0	14%	0.143	C	C	.	.	H	α-helix	trans	-59.7	-45.7	-174.3	0	0	0	0	0	114.3	M304 P417 L595 I601 I602 S603	M304-A599 HydrophobicContact CE-CB 3.88Å; M304-A599 HydrophobicContact SD-CB 4.44Å; P417-A599 HydrophobicContact CG-CB 4.36Å; L595-A599 PolarHBondContact O-N 2.88Å; A599-I601 VanDerWaalsContact C-N 3.27Å; A599-I601 PolarHBondContact O-N 3.07Å; A599-I602 PolarHBondContact O-N 2.91Å; A599-S603 PolarHBondContact O-N 3.27Å; A599-S603 PolarHBondContact O-OG 3.41Å
600	P	84.4	Confident	87.3	Confident	31 Å²	31	25.6 Å²	25.6	20%	0.201	14%	0.135	C	C	.	.	H	α-helix	trans	-61.8	-32.4	177.2	-25.1	35.3	0	0	0	113.8	A413 N596 S603 N604 I654	A413-P600 HydrophobicContact CB-CB 4.13Å; A413-P600 HydrophobicContact CB-CG 4.25Å; N596-P600 WeakPolarHBondContact O-CD 3.3Å; N596-P600 WeakPolarHBondContact O-CG 2.83Å; P600-S603 PolarHBondContact O-N 3.37Å; P600-N604 WeakPolarHBondContact O-CB 3.49Å; P600-N604 PolarHBondContact O-N 3Å; P600-I654 HydrophobicContact CB-CG2 4.34Å
601	I	87.8	Confident	87.3	Confident	60 Å²	60	26.3 Å²	26.3	31%	0.308	14%	0.141	S	C	.	.	H	α-helix	trans	-64.5	-47	176.6	-60.4	175.3	0	0	0	109.7	F589 I598 A599 N604 F605	F589-I601 HydrophobicContact CE1-CD1 4.08Å; F589-I601 HydrophobicContact CE1-CG2 4.21Å; I598-I601 WeakPolarHBondContact O-CB 3.28Å; I598-I601 PolarHBondContact O-N 3.43Å; A599-I601 VanDerWaalsContact C-N 3.27Å; A599-I601 PolarHBondContact O-N 3.07Å; I601-N604 WeakPolarHBondContact O-CB 3.04Å; I601-N604 PolarHBondContact O-N 3.33Å; I601-F605 HydrophobicContact CG2-CD2 3.96Å; I601-F605 HydrophobicContact CG2-CE2 3.59Å; I601-F605 WeakPolarHBondContact O-CD2 3.02Å; I601-F605 PolarHBondContact O-N 2.89Å
602	I	88.4	Confident	87.3	Confident	1 Å²	1	23.1 Å²	23.1	1%	0.005	12%	0.124	C	C	.	.	H	α-helix	trans	-62.5	-45.7	178.1	-69.6	167.3	0	0	0	110.9	V300 M304 P417 I598 A599 N604 F605 F606	V300-I602 HydrophobicContact CB-CG1 4.1Å; V300-I602 HydrophobicContact CG1-CD1 4.03Å; V300-I602 HydrophobicContact CG1-CG1 3.51Å; M304-I602 HydrophobicContact CB-CD1 3.27Å; M304-I602 HydrophobicContact CG-CD1 3.89Å; M304-I602 HydrophobicContact SD-CD1 3.53Å; M304-I602 VanDerWaalsContact SD-CD1 3.53Å; P417-I602 HydrophobicContact CB-CG2 4.17Å; P417-I602 HydrophobicContact CG-CB 4.45Å; P417-I602 HydrophobicContact CG-CG2 4.15Å; I598-I602 HydrophobicContact CG2-CD1 3.73Å; I598-I602 HydrophobicContact CG2-CG1 4.39Å; I598-I602 PolarHBondContact O-N 3.13Å; A599-I602 PolarHBondContact O-N 2.91Å; I602-N604 VanDerWaalsContact C-N 3.28Å; I602-N604 PolarHBondContact O-N 3.12Å; I602-F605 PolarHBondContact O-N 3.36Å; I602-F606 HydrophobicContact CG2-CD2 3.48Å; I602-F606 VanDerWaalsContact CG2-CD2 3.48Å; I602-F606 HydrophobicContact CG2-CE2 3.59Å; I602-F606 PolarHBondContact O-N 3.45Å
603	S	88.7	Confident	87.4	Confident	0 Å²	0	19.9 Å²	19.9	0%	0	11%	0.107	C	C	.	.	H	α-helix	trans	-57.4	-41.9	178.1	-65.7	0	0	0	0	112.2	A413 P417 A599 P600 L607	A413-S603 WeakPolarHBondContact O-CB 3.48Å; A413-S603 PolarHBondContact O-OG 3.15Å; P417-S603 WeakPolarHBondContact CD-OG 3.43Å; P417-S603 VanDerWaalsContact CG-OG 3.27Å; P417-S603 WeakPolarHBondContact CG-OG 3.04Å; A599-S603 PolarHBondContact O-N 3.27Å; A599-S603 PolarHBondContact O-OG 3.41Å; P600-S603 PolarHBondContact O-N 3.37Å; S603-L607 VanDerWaalsContact O-CB 3.24Å; S603-L607 WeakPolarHBondContact O-CB 3.48Å; S603-L607 WeakPolarHBondContact O-CD1 3.45Å; S603-L607 VanDerWaalsContact O-CG 3.24Å; S603-L607 WeakPolarHBondContact O-CG 3.33Å; S603-L607 PolarHBondContact O-N 3.44Å
604	N	90.2	Very high	87.9	Confident	9 Å²	9	19.6 Å²	19.6	5%	0.048	11%	0.105	C	C	.	.	H	α-helix	trans	-60.5	-47.4	176.3	-173.5	29	0	0	0	112	P600 I601 I602 A608 M651 A658 T662	P600-N604 WeakPolarHBondContact O-CB 3.49Å; P600-N604 PolarHBondContact O-N 3Å; I601-N604 WeakPolarHBondContact O-CB 3.04Å; I601-N604 PolarHBondContact O-N 3.33Å; I602-N604 VanDerWaalsContact C-N 3.28Å; I602-N604 PolarHBondContact O-N 3.12Å; N604-A608 WeakPolarHBondContact O-CB 3.26Å; N604-A608 PolarHBondContact O-N 3.3Å; N604-M651 WeakPolarHBondContact OD1-CG 3.41Å; N604-M651 PolarHBondContact OD1-SD 2.97Å; N604-A658 WeakPolarHBondContact ND2-CB 3.49Å; N604-A658 PolarHBondContact ND2-O 3.03Å; N604-A658 VanDerWaalsContact ND2-O 3.17Å; N604-T662 WeakPolarHBondContact ND2-CG2 3.34Å; N604-T662 PolarHBondContact OD1-OG1 3.02Å
605	F	90.7	Very high	88.4	Confident	39 Å²	39	18.9 Å²	18.9	17%	0.171	10%	0.1	C	C	.	.	H	α-helix	trans	-69	-39.1	-179.9	-71.4	-68	0	0	0	113.4	I293 F296 A297 I601 I602 A608 S609 T662	I293-F605 HydrophobicContact CG2-CD1 4.44Å; F296-F605 AromaticContact CD1-CD1 3.99Å; F296-F605 HydrophobicContact CD1-CD1 3.99Å; F296-F605 HydrophobicContact CD1-CD2 4.02Å; F296-F605 AromaticContact CD1-CE1 3.86Å; F296-F605 HydrophobicContact CD1-CE1 3.86Å; F296-F605 AromaticContact CD1-CE2 3.94Å; F296-F605 HydrophobicContact CD1-CE2 3.94Å; F296-F605 HydrophobicContact CD1-CG 4.08Å; F296-F605 AromaticContact CD1-CZ 3.86Å; F296-F605 HydrophobicContact CD1-CZ 3.86Å; F296-F605 HydrophobicContact CE1-CD1 4.39Å; F296-F605 AromaticContact CE1-CD2 3.89Å; F296-F605 HydrophobicContact CE1-CD2 3.89Å; F296-F605 AromaticContact CE1-CE1 3.93Å; F296-F605 HydrophobicContact CE1-CE1 3.93Å; F296-F605 AromaticContact CE1-CE2 3.41Å; F296-F605 HydrophobicContact CE1-CE2 3.41Å; F296-F605 VanDerWaalsContact CE1-CE2 3.41Å; F296-F605 HydrophobicContact CE1-CG 4.38Å; F296-F605 AromaticContact CE1-CZ 3.43Å; F296-F605 HydrophobicContact CE1-CZ 3.43Å; F296-F605 VanDerWaalsContact CE1-CZ 3.43Å; F296-F605 HydrophobicContact CZ-CZ 4.45Å; A297-F605 HydrophobicContact CB-CB 3.86Å; I601-F605 HydrophobicContact CG2-CD2 3.96Å; I601-F605 HydrophobicContact CG2-CE2 3.59Å; I601-F605 WeakPolarHBondContact O-CD2 3.02Å; I601-F605 PolarHBondContact O-N 2.89Å; I602-F605 PolarHBondContact O-N 3.36Å; F605-A608 PolarHBondContact O-N 3.05Å; F605-S609 PolarHBondContact O-N 3.4Å; F605-T662 HydrophobicContact CD1-CG2 4.01Å; F605-T662 HydrophobicContact CE1-CG2 3.62Å; F605-T662 HydrophobicContact CZ-CG2 4.13Å
606	F	89.8	Confident	88.9	Confident	2 Å²	2	18.3 Å²	18.3	1%	0.009	10%	0.098	C	C	.	.	H	α-helix	trans	-69.3	-42	175.5	-82.8	-66.5	0	0	0	112.2	F294 A297 N298 A301 F416 T420 I602 A608 S609 Y610	F294-F606 HydrophobicContact CD2-CD1 4.48Å; F294-F606 HydrophobicContact CD2-CE1 4.05Å; F294-F606 HydrophobicContact CE2-CD1 4.47Å; F294-F606 AromaticContact CE2-CE1 3.81Å; F294-F606 HydrophobicContact CE2-CE1 3.81Å; A297-F606 HydrophobicContact CB-CD1 4.11Å; A297-F606 HydrophobicContact CB-CD2 4.14Å; A297-F606 HydrophobicContact CB-CE1 3.93Å; A297-F606 HydrophobicContact CB-CE2 3.98Å; A297-F606 HydrophobicContact CB-CG 4.21Å; A297-F606 HydrophobicContact CB-CZ 3.87Å; N298-F606 WeakPolarHBondContact OD1-CZ 3.48Å; A301-F606 HydrophobicContact CB-CE2 4.27Å; F416-F606 HydrophobicContact CE1-CB 4.02Å; T420-F606 HydrophobicContact CG2-CB 3.76Å; T420-F606 HydrophobicContact CG2-CD1 4.35Å; T420-F606 HydrophobicContact CG2-CD2 3.79Å; T420-F606 HydrophobicContact CG2-CE2 4.46Å; T420-F606 HydrophobicContact CG2-CG 3.72Å; I602-F606 HydrophobicContact CG2-CD2 3.48Å; I602-F606 VanDerWaalsContact CG2-CD2 3.48Å; I602-F606 HydrophobicContact CG2-CE2 3.59Å; I602-F606 PolarHBondContact O-N 3.45Å; F606-A608 VanDerWaalsContact C-N 3.31Å; F606-A608 PolarHBondContact O-N 3.34Å; F606-S609 PolarHBondContact O-N 2.86Å; F606-S609 VanDerWaalsContact O-N 3.15Å; F606-S609 PolarHBondContact O-OG 3.3Å; F606-Y610 HydrophobicContact CB-CE2 4.48Å; F606-Y610 HydrophobicContact CD1-CE1 4.4Å; F606-Y610 VanDerWaalsContact O-CG 3.3Å; F606-Y610 PolarHBondContact O-N 3.35Å
607	L	91.1	Very high	89.4	Confident	0 Å²	0	15.9 Å²	15.9	0%	0	9%	0.085	C	C	.	.	H	α-helix	trans	-59.1	-42.4	173.6	-77.8	167.5	0	0	0	111.4	V252 F416 S603 S609 Y610 A611 C647 V650 M651 I654	V252-L607 HydrophobicContact CG1-CD2 4.32Å; F416-L607 HydrophobicContact CD1-CG 4.09Å; F416-L607 HydrophobicContact CD2-CD2 4.39Å; F416-L607 HydrophobicContact CE1-CD1 4.44Å; F416-L607 HydrophobicContact CE1-CD2 3.84Å; F416-L607 HydrophobicContact CE1-CG 3.56Å; F416-L607 HydrophobicContact CE2-CD2 3.68Å; F416-L607 HydrophobicContact CE2-CG 4.27Å; F416-L607 HydrophobicContact CZ-CD2 3.35Å; F416-L607 HydrophobicContact CZ-CG 3.66Å; S603-L607 VanDerWaalsContact O-CB 3.24Å; S603-L607 WeakPolarHBondContact O-CB 3.48Å; S603-L607 WeakPolarHBondContact O-CD1 3.45Å; S603-L607 VanDerWaalsContact O-CG 3.24Å; S603-L607 WeakPolarHBondContact O-CG 3.33Å; S603-L607 PolarHBondContact O-N 3.44Å; L607-S609 PolarHBondContact O-N 3.39Å; L607-Y610 PolarHBondContact O-N 3.45Å; L607-A611 VanDerWaalsContact O-CB 3.27Å; L607-A611 WeakPolarHBondContact O-CB 3.29Å; L607-A611 PolarHBondContact O-N 2.93Å; L607-C647 HydrophobicContact CD2-CB 4.25Å; L607-V650 HydrophobicContact CD1-CB 4.46Å; L607-V650 HydrophobicContact CD1-CG1 3.72Å; L607-V650 HydrophobicContact CD2-CG1 4.35Å; L607-M651 HydrophobicContact CB-CB 4.42Å; L607-M651 HydrophobicContact CB-CG 4.48Å; L607-M651 HydrophobicContact CD1-CB 4.43Å; L607-I654 HydrophobicContact CD1-CD1 3.69Å
608	A	90.8	Very high	89.8	Confident	2 Å²	2	14.1 Å²	14.1	2%	0.017	7%	0.072	C	C	.	.	H	α-helix	trans	-60.5	-44.3	174.4	0	0	0	0	0	111.9	N604 F605 F606 Y610 A611 L612 M651	N604-A608 WeakPolarHBondContact O-CB 3.26Å; N604-A608 PolarHBondContact O-N 3.3Å; F605-A608 PolarHBondContact O-N 3.05Å; F606-A608 VanDerWaalsContact C-N 3.31Å; F606-A608 PolarHBondContact O-N 3.34Å; A608-Y610 PolarHBondContact O-N 3.36Å; A608-A611 PolarHBondContact O-N 3.44Å; A608-L612 WeakPolarHBondContact O-CG 3.49Å; A608-L612 PolarHBondContact O-N 2.81Å; A608-M651 HydrophobicContact CB-SD 3.89Å
609	S	90.6	Very high	89.9	Confident	0 Å²	0	17 Å²	17	0%	0	9%	0.085	C	C	.	.	H	α-helix	trans	-63.4	-40.6	177.3	77.9	0	0	0	0	112.6	F605 F606 L607 L612 I613	F605-S609 PolarHBondContact O-N 3.4Å; F606-S609 PolarHBondContact O-N 2.86Å; F606-S609 VanDerWaalsContact O-N 3.15Å; F606-S609 PolarHBondContact O-OG 3.3Å; L607-S609 PolarHBondContact O-N 3.39Å; S609-L612 PolarHBondContact O-N 3.21Å; S609-I613 VanDerWaalsContact O-CG1 3.3Å; S609-I613 WeakPolarHBondContact O-CG1 3.07Å; S609-I613 PolarHBondContact O-N 3.02Å
610	Y	92	Very high	90	Very high	0 Å²	0	17.1 Å²	17.1	0%	0	9%	0.086	C	C	.	.	H	α-helix	trans	-72	-38.3	178.5	-64.2	-13.6	0	0	0	111.7	T256 F416 T420 G421 I422 L423 F606 L607 A608 L612 I613 N614	T256-Y610 HydrophobicContact CG2-CD1 3.8Å; T256-Y610 HydrophobicContact CG2-CG 3.85Å; F416-Y610 HydrophobicContact CE1-CE2 4.35Å; F416-Y610 AromaticContact CZ-CD2 3.92Å; F416-Y610 HydrophobicContact CZ-CD2 3.92Å; F416-Y610 AromaticContact CZ-CE2 3.94Å; F416-Y610 HydrophobicContact CZ-CE2 3.94Å; T420-Y610 WeakPolarHBondContact CA-OH 3.41Å; T420-Y610 HydrophobicContact CG2-CE2 4.38Å; G421-Y610 PolarHBondContact N-OH 3.48Å; I422-Y610 HydrophobicContact CD1-CE1 4.09Å; I422-Y610 HydrophobicContact CG1-CE1 4.06Å; L423-Y610 HydrophobicContact CD1-CE1 4.21Å; F606-Y610 HydrophobicContact CB-CE2 4.48Å; F606-Y610 HydrophobicContact CD1-CE1 4.4Å; F606-Y610 VanDerWaalsContact O-CG 3.3Å; F606-Y610 PolarHBondContact O-N 3.35Å; L607-Y610 PolarHBondContact O-N 3.45Å; A608-Y610 PolarHBondContact O-N 3.36Å; Y610-L612 VanDerWaalsContact C-N 3.3Å; Y610-L612 PolarHBondContact O-N 2.9Å; Y610-I613 HydrophobicContact CD1-CD1 4.43Å; Y610-I613 PolarHBondContact O-N 3.36Å; Y610-N614 WeakPolarHBondContact O-CB 3.3Å; Y610-N614 VanDerWaalsContact O-CG 3.29Å; Y610-N614 PolarHBondContact O-N 3.25Å; Y610-N614 PolarHBondContact O-ND2 3.25Å; Y610-N614 VanDerWaalsContact O-ND2 3.12Å
611	A	92.8	Very high	90.2	Very high	15 Å²	15	16.2 Å²	16.2	12%	0.124	8%	0.081	C	C	.	.	H	α-helix	trans	-57.8	-44.5	171.8	0	0	0	0	0	111	L607 A608 N614 F615 C647	L607-A611 VanDerWaalsContact O-CB 3.27Å; L607-A611 WeakPolarHBondContact O-CB 3.29Å; L607-A611 PolarHBondContact O-N 2.93Å; A608-A611 PolarHBondContact O-N 3.44Å; A611-N614 PolarHBondContact O-N 3.5Å; A611-F615 WeakPolarHBondContact O-CB 3.15Å; A611-F615 PolarHBondContact O-N 2.94Å; A611-C647 HydrophobicContact CB-CB 3.74Å
612	L	91	Very high	90.1	Very high	24 Å²	24	18.2 Å²	18.2	13%	0.126	9%	0.092	C	C	.	.	H	α-helix	trans	-68.2	-40.5	177.6	-74.6	169.7	0	0	0	113.6	I290 I293 A608 S609 Y610 N614 F615 S616 V666	I290-L612 HydrophobicContact CD1-CB 4.25Å; I290-L612 HydrophobicContact CG1-CB 3.71Å; I290-L612 HydrophobicContact CG1-CD1 4.27Å; I293-L612 HydrophobicContact CD1-CD1 3.57Å; A608-L612 WeakPolarHBondContact O-CG 3.49Å; A608-L612 PolarHBondContact O-N 2.81Å; S609-L612 PolarHBondContact O-N 3.21Å; Y610-L612 VanDerWaalsContact C-N 3.3Å; Y610-L612 PolarHBondContact O-N 2.9Å; L612-N614 VanDerWaalsContact C-N 3.34Å; L612-F615 PolarHBondContact O-N 2.95Å; L612-S616 WeakPolarHBondContact O-CB 3.23Å; L612-S616 PolarHBondContact O-N 3.4Å; L612-S616 PolarHBondContact O-OG 2.93Å; L612-V666 HydrophobicContact CD1-CG1 3.6Å; L612-V666 HydrophobicContact CD1-CG2 4.24Å; L612-V666 HydrophobicContact CD2-CG1 3.57Å; L612-V666 HydrophobicContact CG-CG1 4Å
613	I	92.3	Very high	89.6	Confident	0 Å²	0	19.2 Å²	19.2	0%	0	10%	0.1	C	C	.	.	H	α-helix	trans	-60.9	-47.1	175.3	-71.5	164.8	0	0	0	109.9	T256 I263 I290 L423 S609 Y610 S616 V617	T256-I613 HydrophobicContact CG2-CG2 4.25Å; I263-I613 HydrophobicContact CD1-CG2 4.04Å; I290-I613 HydrophobicContact CD1-CG1 4.06Å; I290-I613 HydrophobicContact CG1-CG1 4.49Å; I290-I613 HydrophobicContact CG2-CD1 4.17Å; I290-I613 HydrophobicContact CG2-CG1 3.89Å; L423-I613 HydrophobicContact CD1-CD1 3.77Å; L423-I613 HydrophobicContact CD2-CD1 4.44Å; S609-I613 VanDerWaalsContact O-CG1 3.3Å; S609-I613 WeakPolarHBondContact O-CG1 3.07Å; S609-I613 PolarHBondContact O-N 3.02Å; Y610-I613 HydrophobicContact CD1-CD1 4.43Å; Y610-I613 PolarHBondContact O-N 3.36Å; I613-S616 PolarHBondContact O-OG 3.44Å; I613-V617 WeakPolarHBondContact O-CB 3.49Å; I613-V617 VanDerWaalsContact O-CG2 3.28Å; I613-V617 WeakPolarHBondContact O-CG2 3.44Å; I613-V617 PolarHBondContact O-N 3.43Å; I613-V617 VanDerWaalsContact O-N 3.16Å
614	N	94.4	Very high	89	Confident	0 Å²	0	24.5 Å²	24.5	0%	0	13%	0.128	C	C	.	.	H	α-helix	trans	-66.4	-44.7	179	-70.7	-32	0	0	0	111.9	T256 S259 Y610 A611 L612 S616 V617 F618 S640 A644	T256-N614 WeakPolarHBondContact CA-OD1 3.47Å; T256-N614 PolarHBondContact OG1-ND2 3.28Å; S259-N614 VanDerWaalsContact CB-OD1 3.24Å; S259-N614 WeakPolarHBondContact CB-OD1 3.22Å; S259-N614 PolarHBondContact OG-OD1 2.79Å; Y610-N614 WeakPolarHBondContact O-CB 3.3Å; Y610-N614 VanDerWaalsContact O-CG 3.29Å; Y610-N614 PolarHBondContact O-N 3.25Å; Y610-N614 PolarHBondContact O-ND2 3.25Å; Y610-N614 VanDerWaalsContact O-ND2 3.12Å; A611-N614 PolarHBondContact O-N 3.5Å; L612-N614 VanDerWaalsContact C-N 3.34Å; N614-S616 PolarHBondContact O-N 3.3Å; N614-V617 PolarHBondContact O-N 2.89Å; N614-F618 WeakPolarHBondContact O-CB 3.41Å; N614-F618 PolarHBondContact O-N 3.39Å; N614-S640 WeakPolarHBondContact CA-OG 3.41Å; N614-S640 WeakPolarHBondContact CB-O 3.42Å; N614-S640 PolarHBondContact O-OG 2.73Å; N614-A644 HydrophobicContact CB-CB 3.89Å
615	F	92.1	Very high	87.8	Confident	91 Å²	91	24.4 Å²	24.4	40%	0.399	13%	0.128	S	C	.	.	H	α-helix	trans	-64.7	-41.5	178.4	179.1	-104.6	0	0	0	112.7	F286 A611 L612 F618 H619 A644	F286-F615 HydrophobicContact CE1-CD1 4.16Å; F286-F615 HydrophobicContact CE1-CE1 4.24Å; F286-F615 HydrophobicContact CZ-CE1 4.45Å; A611-F615 WeakPolarHBondContact O-CB 3.15Å; A611-F615 PolarHBondContact O-N 2.94Å; L612-F615 PolarHBondContact O-N 2.95Å; F615-F618 PolarHBondContact O-N 2.9Å; F615-H619 WeakPolarHBondContact O-CB 3.32Å; F615-H619 PolarHBondContact O-N 2.8Å; F615-A644 HydrophobicContact CB-CB 4.14Å
616	S	89.2	Confident	86.5	Confident	0 Å²	0	25.3 Å²	25.3	0%	0	14%	0.138	C	C	.	.	H	α-helix	trans	-66.5	-40.2	179.9	57.7	0	0	0	0	112.4	L282 L612 I613 N614 H619 A620	L282-S616 VanDerWaalsContact CD1-OG 3.29Å; L282-S616 WeakPolarHBondContact CD1-OG 3.36Å; L612-S616 WeakPolarHBondContact O-CB 3.23Å; L612-S616 PolarHBondContact O-N 3.4Å; L612-S616 PolarHBondContact O-OG 2.93Å; I613-S616 PolarHBondContact O-OG 3.44Å; N614-S616 PolarHBondContact O-N 3.3Å; S616-H619 PolarHBondContact O-N 3.38Å; S616-A620 WeakPolarHBondContact O-CB 3.43Å; S616-A620 PolarHBondContact O-N 2.92Å
617	V	90.8	Very high	85.5	Confident	0 Å²	0	28 Å²	28	0%	0	17%	0.166	C	C	.	.	H	α-helix	trans	-64.8	-43.3	174.6	167.1	0	0	0	0	111.2	I263 L282 I613 N614 S621 W628 Y635	I263-V617 HydrophobicContact CD1-CG2 3.61Å; I263-V617 HydrophobicContact CG1-CG2 3.59Å; L282-V617 HydrophobicContact CD2-CG2 4.17Å; I613-V617 WeakPolarHBondContact O-CB 3.49Å; I613-V617 VanDerWaalsContact O-CG2 3.28Å; I613-V617 WeakPolarHBondContact O-CG2 3.44Å; I613-V617 PolarHBondContact O-N 3.43Å; I613-V617 VanDerWaalsContact O-N 3.16Å; N614-V617 PolarHBondContact O-N 2.89Å; V617-S621 WeakPolarHBondContact O-CB 3.37Å; V617-S621 PolarHBondContact O-N 3.3Å; V617-W628 HydrophobicContact CB-CH2 4.29Å; V617-W628 HydrophobicContact CB-CZ2 4.43Å; V617-W628 HydrophobicContact CG1-CH2 3.85Å; V617-W628 HydrophobicContact CG1-CZ2 3.65Å; V617-W628 HydrophobicContact CG2-CH2 3.87Å; V617-W628 HydrophobicContact CG2-CZ2 4.48Å; V617-Y635 HydrophobicContact CG1-CD2 4.47Å; V617-Y635 HydrophobicContact CG1-CE2 3.35Å; V617-Y635 WeakPolarHBondContact CG1-OH 3.36Å; V617-Y635 PolarHBondContact O-OH 2.82Å
618	F	92.1	Very high	85	Confident	22 Å²	22	28.9 Å²	28.9	10%	0.096	17%	0.17	C	C	.	.	H	α-helix	trans	-59.3	-48.7	171.8	168.4	-103.7	0	0	0	112	N614 F615 A620 S621 L622 M637 W638 L641	N614-F618 WeakPolarHBondContact O-CB 3.41Å; N614-F618 PolarHBondContact O-N 3.39Å; F615-F618 PolarHBondContact O-N 2.9Å; F618-A620 PolarHBondContact O-N 2.97Å; F618-S621 WeakPolarHBondContact O-CB 3.38Å; F618-S621 PolarHBondContact O-N 3.46Å; F618-L622 HydrophobicContact CE1-CD2 4.16Å; F618-L622 HydrophobicContact CZ-CD2 4.08Å; F618-L622 WeakPolarHBondContact O-CB 3.46Å; F618-L622 PolarHBondContact O-N 3.16Å; F618-M637 HydrophobicContact CD2-CB 4.22Å; F618-M637 WeakPolarHBondContact CD2-O 3.49Å; F618-W638 HydrophobicContact CE2-CZ3 4.49Å; F618-L641 HydrophobicContact CD1-CD1 3.91Å; F618-L641 HydrophobicContact CD2-CB 3.77Å; F618-L641 HydrophobicContact CE1-CD1 3.86Å; F618-L641 HydrophobicContact CE1-CD2 4.43Å; F618-L641 HydrophobicContact CE2-CB 4.01Å; F618-L641 HydrophobicContact CE2-CD1 4.49Å; F618-L641 HydrophobicContact CE2-CD2 3.97Å; F618-L641 HydrophobicContact CE2-CG 4.38Å; F618-L641 HydrophobicContact CG-CB 4.06Å; F618-L641 HydrophobicContact CG-CD1 4.25Å; F618-L641 HydrophobicContact CZ-CD1 4.16Å; F618-L641 HydrophobicContact CZ-CD2 3.89Å; F618-L641 HydrophobicContact CZ-CG 4.41Å
619	H	86.6	Confident	84.7	Confident	60 Å²	60	38.4 Å²	38.4	28%	0.278	21%	0.205	S	C	.	.	H	α-helix	trans	-62.6	-42.9	-179.8	-179.9	-91.8	0	0	0	112	F286 F615 S616 S621 L622 A623	F286-H619 AromaticContact CE2-ND1 3.84Å; F286-H619 HydrophobicContact CZ-CB 4.5Å; F615-H619 WeakPolarHBondContact O-CB 3.32Å; F615-H619 PolarHBondContact O-N 2.8Å; S616-H619 PolarHBondContact O-N 3.38Å; H619-S621 VanDerWaalsContact C-N 3.33Å; H619-S621 PolarHBondContact O-N 3.37Å; H619-L622 PolarHBondContact O-N 3.3Å; H619-A623 VanDerWaalsContact O-CB 3.22Å; H619-A623 WeakPolarHBondContact O-CB 3.38Å; H619-A623 PolarHBondContact O-N 3.37Å
620	A	85.1	Confident	84.4	Confident	4 Å²	4	40.1 Å²	40.1	3%	0.033	22%	0.216	C	C	.	.	H	α-helix	trans	-63.1	-38.7	176.7	0	0	0	0	0	112.4	L282 S616 F618 N624 S625 W628	L282-A620 HydrophobicContact CD2-CB 3.97Å; S616-A620 WeakPolarHBondContact O-CB 3.43Å; S616-A620 PolarHBondContact O-N 2.92Å; F618-A620 PolarHBondContact O-N 2.97Å; A620-N624 PolarHBondContact O-N 3.02Å; A620-S625 PolarHBondContact O-N 3.13Å; A620-W628 HydrophobicContact CB-CD2 3.92Å; A620-W628 HydrophobicContact CB-CE3 4.17Å; A620-W628 HydrophobicContact CB-CG 4.06Å
621	S	87.2	Confident	83.9	Confident	12 Å²	12	45 Å²	45	8%	0.084	25%	0.251	C	S	.	.	H	α-helix	trans	-67.4	-43	173	-97	0	0	0	0	112.8	V617 F618 H619 N624 W628 Y635	V617-S621 WeakPolarHBondContact O-CB 3.37Å; V617-S621 PolarHBondContact O-N 3.3Å; F618-S621 WeakPolarHBondContact O-CB 3.38Å; F618-S621 PolarHBondContact O-N 3.46Å; H619-S621 VanDerWaalsContact C-N 3.33Å; H619-S621 PolarHBondContact O-N 3.37Å; S621-N624 PolarHBondContact O-N 3.36Å; S621-W628 PolarHBondContact OG-NE1 3.34Å; S621-Y635 PolarHBondContact OG-OH 3.16Å
622	L	85.9	Confident	83.6	Confident	102 Å²	102	46.1 Å²	46.1	53%	0.534	25%	0.253	S	S	.	.	H	α-helix	trans	-66.9	-39	179.1	-177.3	65.3	0	0	0	111.6	F618 H619 N624	F618-L622 HydrophobicContact CE1-CD2 4.16Å; F618-L622 HydrophobicContact CZ-CD2 4.08Å; F618-L622 WeakPolarHBondContact O-CB 3.46Å; F618-L622 PolarHBondContact O-N 3.16Å; H619-L622 PolarHBondContact O-N 3.3Å; L622-N624 PolarHBondContact O-N 3.5Å
623	A	77.3	Confident	83.3	Confident	22 Å²	22	53.8 Å²	53.8	18%	0.182	29%	0.285	C	S	.	.	T	Hydrogen-bonded Turn	trans	-76.9	-5	179.7	0	0	0	0	0	113.8	H619 S625 L689 Q692	H619-A623 VanDerWaalsContact O-CB 3.22Å; H619-A623 WeakPolarHBondContact O-CB 3.38Å; H619-A623 PolarHBondContact O-N 3.37Å; A623-S625 PolarHBondContact O-N 3.09Å; A623-S625 VanDerWaalsContact O-N 3.14Å; A623-L689 HydrophobicContact CB-CD1 4.44Å; A623-Q692 PolarHBondContact O-OE1 2.85Å
624	N	76.1	Confident	83.1	Confident	110 Å²	110	62.1 Å²	62.1	59%	0.588	32%	0.318	S	S	*	.	T	Hydrogen-bonded Turn	trans	47.5	39.5	-175.2	-70.5	-53.9	0	0	0	113.3	A620 S621 L622 P626 Q692	A620-N624 PolarHBondContact O-N 3.02Å; S621-N624 PolarHBondContact O-N 3.36Å; L622-N624 PolarHBondContact O-N 3.5Å; N624-P626 WeakPolarHBondContact O-CD 3.47Å; N624-Q692 PolarHBondContact O-OE1 2.87Å
625	S	66.4	Low	82.9	Confident	7 Å²	7	63.8 Å²	63.8	5%	0.049	32%	0.324	C	S	.	.			trans	-56.2	130.3	-173.2	61	0	0	0	0	110.9	A620 A623 G627 W628	A620-S625 PolarHBondContact O-N 3.13Å; A623-S625 PolarHBondContact O-N 3.09Å; A623-S625 VanDerWaalsContact O-N 3.14Å; S625-G627 PolarHBondContact O-N 3.05Å; S625-W628 WeakPolarHBondContact O-CB 3.36Å; S625-W628 PolarHBondContact O-N 3.06Å; S625-W628 WeakPolarHBondContact OG-CB 3.33Å
626	P	63.2	Low	82.9	Confident	59 Å²	59	63.2 Å²	63.2	38%	0.383	33%	0.325	S	S	.	.	T	Hydrogen-bonded Turn	trans	-48	-32.3	-175	-33.5	27	0	0	0	116.5	N624 A688	N624-P626 WeakPolarHBondContact O-CD 3.47Å; P626-A688 HydrophobicContact CB-CB 4.34Å; P626-A688 VanDerWaalsContact CD-CB 3.5Å; P626-A688 HydrophobicContact CG-CB 3.82Å
627	G	69.4	Low	83	Confident	58 Å²	58	66 Å²	66	60%	0.598	34%	0.339	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.1	1.2	178.6	0	0	0	0	0	115.4	N266 S625	N266-G627 PolarHBondContact ND2-O 3.47Å; N266-G627 PolarHBondContact OD1-O 3Å; N266-G627 VanDerWaalsContact OD1-O 3.07Å; S625-G627 PolarHBondContact O-N 3.05Å
628	W	80.2	Confident	83.2	Confident	19 Å²	19	73.5 Å²	73.5	7%	0.072	37%	0.367	C	S	.	.			trans	-106.2	102.2	-177.5	-176.5	-101.8	0	0	0	111.3	A262 I263 N266 L282 V617 A620 S621 S625 P630 Y635	A262-W628 HydrophobicContact CB-CH2 4.21Å; A262-W628 HydrophobicContact CB-CZ2 4.27Å; I263-W628 HydrophobicContact CG1-CH2 4.08Å; I263-W628 HydrophobicContact CG1-CZ3 4.19Å; N266-W628 HydrophobicContact CB-CE3 4.47Å; N266-W628 HydrophobicContact CB-CZ3 4.37Å; L282-W628 HydrophobicContact CD2-CE3 4.34Å; L282-W628 HydrophobicContact CD2-CZ3 3.96Å; V617-W628 HydrophobicContact CB-CH2 4.29Å; V617-W628 HydrophobicContact CB-CZ2 4.43Å; V617-W628 HydrophobicContact CG1-CH2 3.85Å; V617-W628 HydrophobicContact CG1-CZ2 3.65Å; V617-W628 HydrophobicContact CG2-CH2 3.87Å; V617-W628 HydrophobicContact CG2-CZ2 4.48Å; A620-W628 HydrophobicContact CB-CD2 3.92Å; A620-W628 HydrophobicContact CB-CE3 4.17Å; A620-W628 HydrophobicContact CB-CG 4.06Å; S621-W628 PolarHBondContact OG-NE1 3.34Å; S625-W628 WeakPolarHBondContact O-CB 3.36Å; S625-W628 PolarHBondContact O-N 3.06Å; S625-W628 WeakPolarHBondContact OG-CB 3.33Å; W628-P630 HydrophobicContact CZ2-CB 4.26Å; W628-P630 HydrophobicContact CZ2-CG 3.99Å; W628-Y635 HydrophobicContact CZ2-CE1 4.34Å
629	R	84	Confident	83.2	Confident	201 Å²	201	75.2 Å²	75.2	76%	0.758	38%	0.379	S	S	*	.			trans	-140.5	71.1	177.6	-61.5	-177.1	-172.1	-170.5	-0.6	110.3	N266 S631	N266-R629 PolarHBondContact OD1-N 3.18Å; R629-S631 PolarHBondContact O-N 3.38Å
630	P	84.3	Confident	83.6	Confident	36 Å²	36	72.4 Å²	72.4	23%	0.234	37%	0.367	C	S	.	.			trans	-63.7	123.6	-178.2	26.3	-33.5	0	0	0	110.3	A262 W628 F632 Y635	A262-P630 HydrophobicContact CB-CB 3.97Å; W628-P630 HydrophobicContact CZ2-CB 4.26Å; W628-P630 HydrophobicContact CZ2-CG 3.99Å; P630-F632 VanDerWaalsContact C-N 3.28Å; P630-Y635 HydrophobicContact CB-CD1 4.11Å; P630-Y635 HydrophobicContact CB-CE1 4.44Å; P630-Y635 HydrophobicContact CG-CD1 3.67Å; P630-Y635 HydrophobicContact CG-CE1 3.68Å
631	S	82.5	Confident	84	Confident	104 Å²	104	74.5 Å²	74.5	73%	0.727	38%	0.377	S	S	*	.			trans	-85.5	0.4	178.3	-174.2	0	0	0	0	113.1	R629	R629-S631 PolarHBondContact O-N 3.38Å
632	F	85.1	Confident	84.4	Confident	37 Å²	37	76.6 Å²	76.6	16%	0.162	40%	0.395	C	S	.	.			trans	-78.5	125.2	-173.3	-171.2	-110	0	0	0	112.7	L258 T265 P440 L444 P630 Y634 Y635	L258-F632 HydrophobicContact CD2-CE1 3.64Å; L258-F632 HydrophobicContact CD2-CZ 4.27Å; T265-F632 HydrophobicContact CG2-CB 4.29Å; P440-F632 HydrophobicContact CB-CD2 4.11Å; P440-F632 HydrophobicContact CB-CE2 3.68Å; P440-F632 HydrophobicContact CB-CZ 4.43Å; P440-F632 HydrophobicContact CG-CD2 4.4Å; P440-F632 HydrophobicContact CG-CE2 4.45Å; L444-F632 HydrophobicContact CD1-CZ 3.79Å; P630-F632 VanDerWaalsContact C-N 3.28Å; F632-Y634 HydrophobicContact CE1-CD2 4.24Å; F632-Y634 HydrophobicContact CE1-CG 4.47Å; F632-Y634 AromaticContact CZ-CD2 3.91Å; F632-Y634 HydrophobicContact CZ-CD2 3.91Å; F632-Y634 PolarHBondContact O-N 3.28Å; F632-Y635 PolarHBondContact O-N 2.79Å
633	K	85	Confident	84.7	Confident	185 Å²	185	71.7 Å²	71.7	80%	0.804	37%	0.37	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67	-32.6	-170	-168.1	172.4	-176.4	179	0	115.1
634	Y	88.1	Confident	85.5	Confident	175 Å²	175	71.1 Å²	71.1	69%	0.686	36%	0.364	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.3	9.8	-177	-57.4	-72.2	0	0	0	113.5	F632	F632-Y634 HydrophobicContact CE1-CD2 4.24Å; F632-Y634 HydrophobicContact CE1-CG 4.47Å; F632-Y634 AromaticContact CZ-CD2 3.91Å; F632-Y634 HydrophobicContact CZ-CD2 3.91Å; F632-Y634 PolarHBondContact O-N 3.28Å
635	Y	90.9	Very high	86.4	Confident	36 Å²	36	69.8 Å²	69.8	14%	0.141	36%	0.36	C	S	.	.			trans	-82.7	133.5	177.9	171.2	-107.8	0	0	0	111.2	A262 V617 S621 W628 P630 F632	A262-Y635 HydrophobicContact CB-CD1 4.28Å; A262-Y635 HydrophobicContact CB-CD2 3.53Å; A262-Y635 HydrophobicContact CB-CE2 3.97Å; A262-Y635 HydrophobicContact CB-CG 3.72Å; V617-Y635 HydrophobicContact CG1-CD2 4.47Å; V617-Y635 HydrophobicContact CG1-CE2 3.35Å; V617-Y635 WeakPolarHBondContact CG1-OH 3.36Å; V617-Y635 PolarHBondContact O-OH 2.82Å; S621-Y635 PolarHBondContact OG-OH 3.16Å; W628-Y635 HydrophobicContact CZ2-CE1 4.34Å; P630-Y635 HydrophobicContact CB-CD1 4.11Å; P630-Y635 HydrophobicContact CB-CE1 4.44Å; P630-Y635 HydrophobicContact CG-CD1 3.67Å; P630-Y635 HydrophobicContact CG-CE1 3.68Å; F632-Y635 PolarHBondContact O-N 2.79Å
636	N	92.4	Very high	87.7	Confident	79 Å²	79	71.8 Å²	71.8	42%	0.422	37%	0.37	S	S	.	.			trans	-139.2	137.1	169.5	-175.1	-17.7	0	0	0	109.2	W638 V639 S640	N636-W638 VanDerWaalsContact C-N 3.29Å; N636-W638 PolarHBondContact O-N 3.2Å; N636-W638 PolarHBondContact OD1-N 3.05Å; N636-W638 VanDerWaalsContact OD1-N 3.14Å; N636-V639 HydrophobicContact CB-CB 4.46Å; N636-V639 HydrophobicContact CB-CG2 4.02Å; N636-V639 PolarHBondContact O-N 3.32Å; N636-S640 PolarHBondContact O-N 2.98Å
637	M	90.4	Very high	89	Confident	58 Å²	58	69 Å²	69	29%	0.286	35%	0.352	S	S	.	.	H	α-helix	trans	-60.5	-36.8	-179.4	71.5	175.2	73.7	0	0	112.7	F618 S640 L641	F618-M637 HydrophobicContact CD2-CB 4.22Å; F618-M637 WeakPolarHBondContact CD2-O 3.49Å; M637-S640 WeakPolarHBondContact O-CB 3.5Å; M637-S640 PolarHBondContact O-N 3.24Å; M637-L641 PolarHBondContact O-N 2.84Å
638	W	94.4	Very high	90.1	Very high	157 Å²	157	68.2 Å²	68.2	60%	0.595	34%	0.337	S	S	*	.	H	α-helix	trans	-72.1	-33	-176.4	-63.7	108.3	0	0	0	112.8	F618 N636 S640 L641 A642	F618-W638 HydrophobicContact CE2-CZ3 4.49Å; N636-W638 VanDerWaalsContact C-N 3.29Å; N636-W638 PolarHBondContact O-N 3.2Å; N636-W638 PolarHBondContact OD1-N 3.05Å; N636-W638 VanDerWaalsContact OD1-N 3.14Å; W638-S640 VanDerWaalsContact C-N 3.28Å; W638-L641 HydrophobicContact CE3-CD2 3.94Å; W638-L641 HydrophobicContact CZ3-CD2 3.93Å; W638-L641 PolarHBondContact O-N 3.02Å; W638-A642 WeakPolarHBondContact O-CB 3.16Å; W638-A642 PolarHBondContact O-N 3.21Å
639	V	93.5	Very high	90.7	Very high	58 Å²	58	71.2 Å²	71.2	35%	0.352	36%	0.357	S	S	.	.	H	α-helix	trans	-64.8	-39.2	173.6	176.8	0	0	0	0	109.8	I255 L258 N636 A642 G643	I255-V639 HydrophobicContact CG1-CG1 4.05Å; I255-V639 HydrophobicContact CG2-CG1 4.13Å; I255-V639 WeakPolarHBondContact CG2-O 3.43Å; L258-V639 HydrophobicContact CD1-CG1 4.46Å; N636-V639 HydrophobicContact CB-CB 4.46Å; N636-V639 HydrophobicContact CB-CG2 4.02Å; N636-V639 PolarHBondContact O-N 3.32Å; V639-A642 PolarHBondContact O-N 3.25Å; V639-G643 PolarHBondContact O-N 2.86Å
640	S	94	Very high	91	Very high	2 Å²	2	61.8 Å²	61.8	1%	0.014	32%	0.322	C	S	.	.	H	α-helix	trans	-64.8	-43.6	174.8	-154.1	0	0	0	0	111.8	S259 N614 N636 M637 W638 A642 G643 A644	S259-S640 PolarHBondContact OG-OG 3.02Å; N614-S640 WeakPolarHBondContact CA-OG 3.41Å; N614-S640 WeakPolarHBondContact CB-O 3.42Å; N614-S640 PolarHBondContact O-OG 2.73Å; N636-S640 PolarHBondContact O-N 2.98Å; M637-S640 WeakPolarHBondContact O-CB 3.5Å; M637-S640 PolarHBondContact O-N 3.24Å; W638-S640 VanDerWaalsContact C-N 3.28Å; S640-A642 PolarHBondContact O-N 2.96Å; S640-G643 PolarHBondContact O-N 3.3Å; S640-A644 PolarHBondContact O-N 2.82Å
641	L	94.7	Very high	91.2	Very high	48 Å²	48	60.2 Å²	60.2	25%	0.251	31%	0.311	S	S	.	.	H	α-helix	trans	-60.3	-46.1	174.2	-178.3	64.2	0	0	0	112.2	F618 M637 W638 G643 A644 V645	F618-L641 HydrophobicContact CD1-CD1 3.91Å; F618-L641 HydrophobicContact CD2-CB 3.77Å; F618-L641 HydrophobicContact CE1-CD1 3.86Å; F618-L641 HydrophobicContact CE1-CD2 4.43Å; F618-L641 HydrophobicContact CE2-CB 4.01Å; F618-L641 HydrophobicContact CE2-CD1 4.49Å; F618-L641 HydrophobicContact CE2-CD2 3.97Å; F618-L641 HydrophobicContact CE2-CG 4.38Å; F618-L641 HydrophobicContact CG-CB 4.06Å; F618-L641 HydrophobicContact CG-CD1 4.25Å; F618-L641 HydrophobicContact CZ-CD1 4.16Å; F618-L641 HydrophobicContact CZ-CD2 3.89Å; F618-L641 HydrophobicContact CZ-CG 4.41Å; M637-L641 PolarHBondContact O-N 2.84Å; W638-L641 HydrophobicContact CE3-CD2 3.94Å; W638-L641 HydrophobicContact CZ3-CD2 3.93Å; W638-L641 PolarHBondContact O-N 3.02Å; L641-G643 VanDerWaalsContact C-N 3.27Å; L641-G643 PolarHBondContact O-N 3.44Å; L641-A644 PolarHBondContact O-N 3.3Å; L641-A644 VanDerWaalsContact O-N 3.15Å; L641-V645 HydrophobicContact CD1-CG2 4.46Å; L641-V645 WeakPolarHBondContact O-CG2 3.15Å; L641-V645 PolarHBondContact O-N 3.25Å
642	A	94.7	Very high	91.6	Very high	55 Å²	55	59.2 Å²	59.2	46%	0.455	29%	0.294	S	S	.	.	H	α-helix	trans	-58.8	-41.1	176.8	0	0	0	0	0	111.4	W638 V639 S640 V645 L646	W638-A642 WeakPolarHBondContact O-CB 3.16Å; W638-A642 PolarHBondContact O-N 3.21Å; V639-A642 PolarHBondContact O-N 3.25Å; S640-A642 PolarHBondContact O-N 2.96Å; A642-V645 PolarHBondContact O-N 3.14Å; A642-L646 VanDerWaalsContact O-CB 3.22Å; A642-L646 WeakPolarHBondContact O-CB 3.38Å; A642-L646 PolarHBondContact O-N 3.09Å
643	G	93	Very high	91.8	Very high	0 Å²	0	60.7 Å²	60.7	0%	0	31%	0.306	C	S	.	.	H	α-helix	trans	-62.7	-41.8	173.7	0	0	0	0	0	113.6	V639 S640 L641 L646 C647	V639-G643 PolarHBondContact O-N 2.86Å; S640-G643 PolarHBondContact O-N 3.3Å; L641-G643 VanDerWaalsContact C-N 3.27Å; L641-G643 PolarHBondContact O-N 3.44Å; G643-L646 PolarHBondContact O-N 2.94Å; G643-C647 WeakPolarHBondContact O-CB 3.15Å; G643-C647 PolarHBondContact O-N 3.41Å; G643-C647 PolarHBondContact O-SG 3.41Å
644	A	93.9	Very high	91.9	Very high	9 Å²	9	53.4 Å²	53.4	7%	0.074	28%	0.275	C	S	.	.	H	α-helix	trans	-64.2	-45.2	177.5	0	0	0	0	0	112	N614 F615 S640 L641 C647 C648	N614-A644 HydrophobicContact CB-CB 3.89Å; F615-A644 HydrophobicContact CB-CB 4.14Å; S640-A644 PolarHBondContact O-N 2.82Å; L641-A644 PolarHBondContact O-N 3.3Å; L641-A644 VanDerWaalsContact O-N 3.15Å; A644-C647 PolarHBondContact O-N 3.03Å; A644-C648 WeakPolarHBondContact O-CB 3.49Å; A644-C648 PolarHBondContact O-N 3.29Å
645	V	94.3	Very high	91.9	Very high	83 Å²	83	48.6 Å²	48.6	50%	0.503	26%	0.262	S	S	.	.	H	α-helix	trans	-63.5	-45.5	176	174.8	0	0	0	0	110.6	L641 A642 C647 C648 V649	L641-V645 HydrophobicContact CD1-CG2 4.46Å; L641-V645 WeakPolarHBondContact O-CG2 3.15Å; L641-V645 PolarHBondContact O-N 3.25Å; A642-V645 PolarHBondContact O-N 3.14Å; V645-C647 PolarHBondContact O-N 3.4Å; V645-C648 PolarHBondContact O-N 3Å; V645-V649 HydrophobicContact CG1-CG2 4.2Å; V645-V649 WeakPolarHBondContact O-CG2 3.28Å; V645-V649 PolarHBondContact O-N 3.39Å
646	L	92.8	Very high	91.8	Very high	49 Å²	49	55.4 Å²	55.4	26%	0.257	29%	0.287	S	S	.	.	H	α-helix	trans	-58.3	-47.2	177.3	-177	67.4	0	0	0	111.5	M248 V251 V252 A642 G643 C648 V649 V650	M248-L646 HydrophobicContact CE-CD1 3.96Å; V251-L646 HydrophobicContact CG1-CD2 4.2Å; V252-L646 HydrophobicContact CG2-CD2 3.57Å; V252-L646 HydrophobicContact CG2-CG 4.04Å; A642-L646 VanDerWaalsContact O-CB 3.22Å; A642-L646 WeakPolarHBondContact O-CB 3.38Å; A642-L646 PolarHBondContact O-N 3.09Å; G643-L646 PolarHBondContact O-N 2.94Å; L646-C648 VanDerWaalsContact C-N 3.34Å; L646-C648 PolarHBondContact O-N 2.87Å; L646-V649 PolarHBondContact O-N 2.67Å; L646-V650 HydrophobicContact CD1-CG2 4.4Å; L646-V650 WeakPolarHBondContact O-CB 3.39Å; L646-V650 WeakPolarHBondContact O-CG2 3.4Å; L646-V650 PolarHBondContact O-N 3.19Å
647	C	92.4	Very high	91.7	Very high	0 Å²	0	53.8 Å²	53.8	0%	0	29%	0.285	C	S	.	.	H	α-helix	trans	-60.8	-43.2	177.4	-66.6	0	0	0	0	111.6	L607 A611 G643 A644 V645 M651	L607-C647 HydrophobicContact CD2-CB 4.25Å; A611-C647 HydrophobicContact CB-CB 3.74Å; G643-C647 WeakPolarHBondContact O-CB 3.15Å; G643-C647 PolarHBondContact O-N 3.41Å; G643-C647 PolarHBondContact O-SG 3.41Å; A644-C647 PolarHBondContact O-N 3.03Å; V645-C647 PolarHBondContact O-N 3.4Å; C647-M651 VanDerWaalsContact O-CB 3.23Å; C647-M651 WeakPolarHBondContact O-CB 3.41Å; C647-M651 PolarHBondContact O-N 3.24Å
648	C	91.6	Very high	91.5	Very high	41 Å²	41	52.5 Å²	52.5	28%	0.277	28%	0.284	S	S	.	.	H	α-helix	trans	-66	-45.5	179.8	-167	0	0	0	0	111.9	A644 V645 L646 M651 F652	A644-C648 WeakPolarHBondContact O-CB 3.49Å; A644-C648 PolarHBondContact O-N 3.29Å; V645-C648 PolarHBondContact O-N 3Å; L646-C648 VanDerWaalsContact C-N 3.34Å; L646-C648 PolarHBondContact O-N 2.87Å; C648-M651 WeakPolarHBondContact O-CB 3.36Å; C648-M651 PolarHBondContact O-N 3.4Å; C648-F652 VanDerWaalsContact O-CD2 3.28Å; C648-F652 WeakPolarHBondContact O-CD2 3.48Å; C648-F652 PolarHBondContact O-N 2.88Å
649	V	91.8	Very high	91.1	Very high	83 Å²	83	45 Å²	45	50%	0.503	26%	0.255	S	S	.	.	H	α-helix	trans	-60.7	-49.9	177.2	171.2	0	0	0	0	110.6	V645 L646 M651 F652 V653	V645-V649 HydrophobicContact CG1-CG2 4.2Å; V645-V649 WeakPolarHBondContact O-CG2 3.28Å; V645-V649 PolarHBondContact O-N 3.39Å; L646-V649 PolarHBondContact O-N 2.67Å; V649-M651 VanDerWaalsContact C-N 3.26Å; V649-M651 PolarHBondContact O-N 3.36Å; V649-F652 PolarHBondContact O-N 3.38Å; V649-V653 HydrophobicContact CG1-CG2 4.34Å; V649-V653 VanDerWaalsContact O-CG2 3.27Å; V649-V653 WeakPolarHBondContact O-CG2 3.49Å; V649-V653 PolarHBondContact O-N 2.96Å
650	V	90.3	Very high	91	Very high	3 Å²	3	46.6 Å²	46.6	2%	0.018	26%	0.261	C	S	.	.	H	α-helix	trans	-57.8	-42.7	177.7	171.2	0	0	0	0	111	M248 F412 L607 L646 F652 V653 I654	M248-V650 HydrophobicContact CE-CG2 3.34Å; M248-V650 HydrophobicContact SD-CG2 4.41Å; F412-V650 HydrophobicContact CD1-CG1 3.87Å; F412-V650 HydrophobicContact CE1-CG1 3.2Å; F412-V650 HydrophobicContact CZ-CG1 3.81Å; L607-V650 HydrophobicContact CD1-CB 4.46Å; L607-V650 HydrophobicContact CD1-CG1 3.72Å; L607-V650 HydrophobicContact CD2-CG1 4.35Å; L646-V650 HydrophobicContact CD1-CG2 4.4Å; L646-V650 WeakPolarHBondContact O-CB 3.39Å; L646-V650 WeakPolarHBondContact O-CG2 3.4Å; L646-V650 PolarHBondContact O-N 3.19Å; V650-F652 PolarHBondContact O-N 3.24Å; V650-V653 PolarHBondContact O-N 3.17Å; V650-I654 HydrophobicContact CG1-CD1 3.92Å; V650-I654 HydrophobicContact CG1-CG1 4.42Å; V650-I654 VanDerWaalsContact O-CG1 3.31Å; V650-I654 WeakPolarHBondContact O-CG1 3.27Å; V650-I654 PolarHBondContact O-N 2.88Å
651	M	90.1	Very high	90.8	Very high	2 Å²	2	51.6 Å²	51.6	1%	0.01	29%	0.287	C	S	.	.	H	α-helix	trans	-59.7	-44.9	178.2	-165.7	176.3	75.7	0	0	112.5	N604 L607 A608 C647 C648 V649 V653 I654 N655 A659 N663	N604-M651 WeakPolarHBondContact OD1-CG 3.41Å; N604-M651 PolarHBondContact OD1-SD 2.97Å; L607-M651 HydrophobicContact CB-CB 4.42Å; L607-M651 HydrophobicContact CB-CG 4.48Å; L607-M651 HydrophobicContact CD1-CB 4.43Å; A608-M651 HydrophobicContact CB-SD 3.89Å; C647-M651 VanDerWaalsContact O-CB 3.23Å; C647-M651 WeakPolarHBondContact O-CB 3.41Å; C647-M651 PolarHBondContact O-N 3.24Å; C648-M651 WeakPolarHBondContact O-CB 3.36Å; C648-M651 PolarHBondContact O-N 3.4Å; V649-M651 VanDerWaalsContact C-N 3.26Å; V649-M651 PolarHBondContact O-N 3.36Å; M651-V653 VanDerWaalsContact C-N 3.34Å; M651-V653 PolarHBondContact O-N 3.47Å; M651-I654 PolarHBondContact O-N 3.05Å; M651-N655 PolarHBondContact O-N 2.84Å; M651-A659 HydrophobicContact CB-CB 4.45Å; M651-A659 HydrophobicContact CE-CB 3.96Å; M651-A659 HydrophobicContact CG-CB 3.78Å; M651-N663 VanDerWaalsContact CE-CG 3.49Å; M651-N663 WeakPolarHBondContact CE-ND2 3.08Å; M651-N663 WeakPolarHBondContact CE-OD1 3.34Å
652	F	90.9	Very high	90.4	Very high	83 Å²	83	49.6 Å²	49.6	36%	0.364	28%	0.277	S	S	.	.	H	α-helix	trans	-66.4	-34.3	176.3	-86.7	-74.1	0	0	0	113.5	C648 V649 V650 W656 A659 L660	C648-F652 VanDerWaalsContact O-CD2 3.28Å; C648-F652 WeakPolarHBondContact O-CD2 3.48Å; C648-F652 PolarHBondContact O-N 2.88Å; V649-F652 PolarHBondContact O-N 3.38Å; V650-F652 PolarHBondContact O-N 3.24Å; F652-W656 HydrophobicContact CD1-CB 4.37Å; F652-W656 WeakPolarHBondContact O-CA 3.31Å; F652-W656 PolarHBondContact O-N 3.42Å; F652-A659 HydrophobicContact CD1-CB 4.04Å; F652-A659 HydrophobicContact CE1-CB 4.3Å; F652-A659 HydrophobicContact CG-CB 4.25Å; F652-L660 HydrophobicContact CE1-CB 4.47Å
653	V	89.5	Confident	90.1	Very high	68 Å²	68	49.4 Å²	49.4	41%	0.412	27%	0.268	S	S	.	.	H	α-helix	trans	-72.8	-35.7	-179.9	178.5	0	0	0	0	111.6	F409 V649 V650 M651	F409-V653 HydrophobicContact CB-CG1 3.82Å; F409-V653 HydrophobicContact CD1-CB 4.22Å; F409-V653 HydrophobicContact CD1-CG1 3.43Å; F409-V653 VanDerWaalsContact CD1-CG1 3.43Å; F409-V653 HydrophobicContact CD2-CG1 3.28Å; F409-V653 HydrophobicContact CE1-CB 4.38Å; F409-V653 HydrophobicContact CE1-CG1 3.69Å; F409-V653 HydrophobicContact CE2-CG1 3.56Å; F409-V653 HydrophobicContact CG-CB 4.38Å; F409-V653 HydrophobicContact CG-CG1 3.21Å; F409-V653 HydrophobicContact CZ-CG1 3.75Å; V649-V653 HydrophobicContact CG1-CG2 4.34Å; V649-V653 VanDerWaalsContact O-CG2 3.27Å; V649-V653 WeakPolarHBondContact O-CG2 3.49Å; V649-V653 PolarHBondContact O-N 2.96Å; V650-V653 PolarHBondContact O-N 3.17Å; M651-V653 VanDerWaalsContact C-N 3.34Å; M651-V653 PolarHBondContact O-N 3.47Å
654	I	86.3	Confident	90	Very high	32 Å²	32	53.4 Å²	53.4	16%	0.164	29%	0.293	C	S	.	.	H	α-helix	trans	-63.8	-57.2	175.9	-67.2	169.5	0	0	0	110.6	F412 A413 P600 L607 V650 M651	F412-I654 HydrophobicContact CD1-CD1 4.01Å; F412-I654 HydrophobicContact CD1-CG1 4.44Å; F412-I654 HydrophobicContact CE1-CD1 4.15Å; A413-I654 HydrophobicContact CB-CB 4.28Å; A413-I654 HydrophobicContact CB-CD1 3.84Å; A413-I654 HydrophobicContact CB-CG1 3.85Å; A413-I654 HydrophobicContact CB-CG2 3.46Å; A413-I654 VanDerWaalsContact CB-CG2 3.46Å; P600-I654 HydrophobicContact CB-CG2 4.34Å; L607-I654 HydrophobicContact CD1-CD1 3.69Å; V650-I654 HydrophobicContact CG1-CD1 3.92Å; V650-I654 HydrophobicContact CG1-CG1 4.42Å; V650-I654 VanDerWaalsContact O-CG1 3.31Å; V650-I654 WeakPolarHBondContact O-CG1 3.27Å; V650-I654 PolarHBondContact O-N 2.88Å; M651-I654 PolarHBondContact O-N 3.05Å
655	N	87.5	Confident	89.8	Confident	74 Å²	74	56.7 Å²	56.7	40%	0.396	31%	0.308	S	S	.	.			trans	-155.1	103.2	178.1	-176.8	-25	0	0	0	110	M651 A657 A658 A659	M651-N655 PolarHBondContact O-N 2.84Å; N655-A657 VanDerWaalsContact C-N 3.3Å; N655-A657 PolarHBondContact O-N 3.08Å; N655-A657 PolarHBondContact OD1-N 3.4Å; N655-A658 HydrophobicContact CB-CB 4.03Å; N655-A658 PolarHBondContact O-N 2.94Å; N655-A658 PolarHBondContact OD1-N 3.28Å; N655-A659 WeakPolarHBondContact O-CB 3.46Å; N655-A659 PolarHBondContact O-N 3.47Å
656	W	90.3	Very high	89.4	Confident	180 Å²	180	53.4 Å²	53.4	68%	0.682	29%	0.288	S	S	*	.	H	α-helix	trans	-61.1	-36	-177.3	72.5	-89.5	0	0	0	113.3	F652 L660	F652-W656 HydrophobicContact CD1-CB 4.37Å; F652-W656 WeakPolarHBondContact O-CA 3.31Å; F652-W656 PolarHBondContact O-N 3.42Å; W656-L660 VanDerWaalsContact O-CB 3.26Å; W656-L660 WeakPolarHBondContact O-CB 3.12Å; W656-L660 PolarHBondContact O-N 2.77Å
657	A	88.7	Confident	89.1	Confident	45 Å²	45	56.5 Å²	56.5	37%	0.372	30%	0.302	S	S	.	.	H	α-helix	trans	-72.8	-45.8	-177.2	0	0	0	0	0	110.9	N655 L660 L661	N655-A657 VanDerWaalsContact C-N 3.3Å; N655-A657 PolarHBondContact O-N 3.08Å; N655-A657 PolarHBondContact OD1-N 3.4Å; A657-L660 PolarHBondContact O-N 3.47Å; A657-L661 WeakPolarHBondContact O-CB 3.17Å; A657-L661 PolarHBondContact O-N 3.05Å
658	A	86.1	Confident	88.9	Confident	31 Å²	31	59.2 Å²	59.2	26%	0.256	33%	0.325	S	S	.	.	H	α-helix	trans	-66.9	-37.2	175.6	0	0	0	0	0	111.8	N604 N655 L661 T662	N604-A658 WeakPolarHBondContact ND2-CB 3.49Å; N604-A658 PolarHBondContact ND2-O 3.03Å; N604-A658 VanDerWaalsContact ND2-O 3.17Å; N655-A658 HydrophobicContact CB-CB 4.03Å; N655-A658 PolarHBondContact O-N 2.94Å; N655-A658 PolarHBondContact OD1-N 3.28Å; A658-L661 PolarHBondContact O-N 3.22Å; A658-T662 WeakPolarHBondContact O-CG2 3.24Å; A658-T662 PolarHBondContact O-N 3.07Å; A658-T662 PolarHBondContact O-OG1 2.91Å; A658-T662 VanDerWaalsContact O-OG1 3.11Å
659	A	87.4	Confident	88.6	Confident	0 Å²	0	58.6 Å²	58.6	0%	0	32%	0.319	C	S	.	.	H	α-helix	trans	-66.3	-39.9	176.3	0	0	0	0	0	112.6	M651 F652 N655 T662 N663	M651-A659 HydrophobicContact CB-CB 4.45Å; M651-A659 HydrophobicContact CE-CB 3.96Å; M651-A659 HydrophobicContact CG-CB 3.78Å; F652-A659 HydrophobicContact CD1-CB 4.04Å; F652-A659 HydrophobicContact CE1-CB 4.3Å; F652-A659 HydrophobicContact CG-CB 4.25Å; N655-A659 WeakPolarHBondContact O-CB 3.46Å; N655-A659 PolarHBondContact O-N 3.47Å; A659-T662 WeakPolarHBondContact CA-OG1 3.39Å; A659-T662 PolarHBondContact O-OG1 3.25Å; A659-N663 WeakPolarHBondContact O-CB 3.31Å; A659-N663 PolarHBondContact O-N 3.37Å; A659-N663 PolarHBondContact O-ND2 3.5Å
660	L	90	Very high	88.2	Confident	91 Å²	91	57.6 Å²	57.6	48%	0.476	31%	0.306	S	S	.	.	H	α-helix	trans	-66.3	-44	175.7	-172.4	146	0	0	0	110.4	F652 W656 A657 N663 V664	F652-L660 HydrophobicContact CE1-CB 4.47Å; W656-L660 VanDerWaalsContact O-CB 3.26Å; W656-L660 WeakPolarHBondContact O-CB 3.12Å; W656-L660 PolarHBondContact O-N 2.77Å; A657-L660 PolarHBondContact O-N 3.47Å; L660-N663 PolarHBondContact O-N 3.18Å; L660-V664 HydrophobicContact CD2-CG2 4.13Å; L660-V664 WeakPolarHBondContact O-CB 3.37Å; L660-V664 VanDerWaalsContact O-CG2 3.25Å; L660-V664 WeakPolarHBondContact O-CG2 3.19Å; L660-V664 PolarHBondContact O-N 3.36Å
661	L	90.3	Very high	88	Confident	106 Å²	106	61.2 Å²	61.2	56%	0.555	33%	0.325	S	S	*	.	H	α-helix	trans	-60	-47.2	176.3	-177.3	67.1	0	0	0	111.9	A657 A658 V664 I665	A657-L661 WeakPolarHBondContact O-CB 3.17Å; A657-L661 PolarHBondContact O-N 3.05Å; A658-L661 PolarHBondContact O-N 3.22Å; L661-V664 PolarHBondContact O-N 3.2Å; L661-I665 HydrophobicContact CD1-CD1 4.3Å; L661-I665 HydrophobicContact CG-CD1 4.02Å; L661-I665 VanDerWaalsContact O-CG1 3.3Å; L661-I665 WeakPolarHBondContact O-CG1 3.12Å; L661-I665 PolarHBondContact O-N 3.06Å
662	T	87.3	Confident	87.8	Confident	7 Å²	7	65.6 Å²	65.6	4%	0.043	34%	0.342	C	S	.	.	H	α-helix	trans	-63.8	-45.5	179.2	50.2	0	0	0	0	111.7	N604 F605 A658 A659 V664 I665 V666	N604-T662 WeakPolarHBondContact ND2-CG2 3.34Å; N604-T662 PolarHBondContact OD1-OG1 3.02Å; F605-T662 HydrophobicContact CD1-CG2 4.01Å; F605-T662 HydrophobicContact CE1-CG2 3.62Å; F605-T662 HydrophobicContact CZ-CG2 4.13Å; A658-T662 WeakPolarHBondContact O-CG2 3.24Å; A658-T662 PolarHBondContact O-N 3.07Å; A658-T662 PolarHBondContact O-OG1 2.91Å; A658-T662 VanDerWaalsContact O-OG1 3.11Å; A659-T662 WeakPolarHBondContact CA-OG1 3.39Å; A659-T662 PolarHBondContact O-OG1 3.25Å; T662-V664 VanDerWaalsContact C-N 3.33Å; T662-V664 PolarHBondContact O-N 3.11Å; T662-I665 PolarHBondContact O-N 3.34Å; T662-V666 WeakPolarHBondContact O-CB 3.5Å; T662-V666 WeakPolarHBondContact O-CG2 3.37Å; T662-V666 PolarHBondContact O-N 3.08Å
663	N	87.1	Confident	87.2	Confident	51 Å²	51	61.7 Å²	61.7	27%	0.273	33%	0.325	S	S	.	.	H	α-helix	trans	-60.8	-39.1	176.3	-81.1	-35	0	0	0	113	M651 A659 L660 V666 M667	M651-N663 VanDerWaalsContact CE-CG 3.49Å; M651-N663 WeakPolarHBondContact CE-ND2 3.08Å; M651-N663 WeakPolarHBondContact CE-OD1 3.34Å; A659-N663 WeakPolarHBondContact O-CB 3.31Å; A659-N663 PolarHBondContact O-N 3.37Å; A659-N663 PolarHBondContact O-ND2 3.5Å; L660-N663 PolarHBondContact O-N 3.18Å; N663-V666 PolarHBondContact O-N 3.5Å; N663-M667 WeakPolarHBondContact O-CB 3.46Å; N663-M667 PolarHBondContact O-N 3.25Å
664	V	91	Very high	86.5	Confident	84 Å²	84	60.3 Å²	60.3	51%	0.509	32%	0.318	S	S	.	.	H	α-helix	trans	-64.6	-44.3	175.3	169	0	0	0	0	110.9	L660 L661 T662 M667 A668	L660-V664 HydrophobicContact CD2-CG2 4.13Å; L660-V664 WeakPolarHBondContact O-CB 3.37Å; L660-V664 VanDerWaalsContact O-CG2 3.25Å; L660-V664 WeakPolarHBondContact O-CG2 3.19Å; L660-V664 PolarHBondContact O-N 3.36Å; L661-V664 PolarHBondContact O-N 3.2Å; T662-V664 VanDerWaalsContact C-N 3.33Å; T662-V664 PolarHBondContact O-N 3.11Å; V664-M667 PolarHBondContact O-N 2.99Å; V664-A668 WeakPolarHBondContact O-CB 3.21Å; V664-A668 PolarHBondContact O-N 3.25Å
665	I	89.4	Confident	86.2	Confident	78 Å²	78	66.3 Å²	66.3	40%	0.4	35%	0.345	S	S	.	.	H	α-helix	trans	-61.1	-46.5	176.2	-68.4	166	0	0	0	110.5	L661 T662 M667 A668 L669	L661-I665 HydrophobicContact CD1-CD1 4.3Å; L661-I665 HydrophobicContact CG-CD1 4.02Å; L661-I665 VanDerWaalsContact O-CG1 3.3Å; L661-I665 WeakPolarHBondContact O-CG1 3.12Å; L661-I665 PolarHBondContact O-N 3.06Å; T662-I665 PolarHBondContact O-N 3.34Å; I665-M667 PolarHBondContact O-N 3.22Å; I665-A668 PolarHBondContact O-N 3.22Å; I665-L669 HydrophobicContact CG2-CD1 4.03Å; I665-L669 HydrophobicContact CG2-CG 4.41Å; I665-L669 VanDerWaalsContact O-CG 3.31Å; I665-L669 WeakPolarHBondContact O-CG 3.39Å; I665-L669 PolarHBondContact O-N 2.8Å
666	V	86.3	Confident	85.6	Confident	14 Å²	14	66.8 Å²	66.8	9%	0.085	34%	0.344	C	S	.	.	H	α-helix	trans	-57.4	-49.1	177.2	173.2	0	0	0	0	111.2	I293 L612 T662 N663 A668 L669 Y670	I293-V666 HydrophobicContact CD1-CB 4.23Å; I293-V666 HydrophobicContact CD1-CG1 4.38Å; I293-V666 HydrophobicContact CD1-CG2 3.3Å; I293-V666 HydrophobicContact CG1-CG2 4.47Å; L612-V666 HydrophobicContact CD1-CG1 3.6Å; L612-V666 HydrophobicContact CD1-CG2 4.24Å; L612-V666 HydrophobicContact CD2-CG1 3.57Å; L612-V666 HydrophobicContact CG-CG1 4Å; T662-V666 WeakPolarHBondContact O-CB 3.5Å; T662-V666 WeakPolarHBondContact O-CG2 3.37Å; T662-V666 PolarHBondContact O-N 3.08Å; N663-V666 PolarHBondContact O-N 3.5Å; V666-A668 VanDerWaalsContact C-N 3.33Å; V666-A668 PolarHBondContact O-N 3Å; V666-L669 PolarHBondContact O-N 2.93Å; V666-Y670 WeakPolarHBondContact O-CB 3.44Å; V666-Y670 PolarHBondContact O-N 3.17Å
667	M	86.8	Confident	84.4	Confident	113 Å²	113	66 Å²	66	56%	0.557	35%	0.346	S	S	*	.	H	α-helix	trans	-63.5	-41.3	-179.5	-166.6	68.1	71.7	0	0	111.1	N663 V664 I665 Y670 I671	N663-M667 WeakPolarHBondContact O-CB 3.46Å; N663-M667 PolarHBondContact O-N 3.25Å; V664-M667 PolarHBondContact O-N 2.99Å; I665-M667 PolarHBondContact O-N 3.22Å; M667-Y670 PolarHBondContact O-N 3.19Å; M667-I671 HydrophobicContact CG-CD1 3.91Å; M667-I671 WeakPolarHBondContact O-CB 3.36Å; M667-I671 VanDerWaalsContact O-CG1 3.24Å; M667-I671 WeakPolarHBondContact O-CG1 3.48Å; M667-I671 PolarHBondContact O-N 3.5Å
668	A	89.2	Confident	83.1	Confident	57 Å²	57	65 Å²	65	47%	0.471	34%	0.335	S	S	.	.	H	α-helix	trans	-63.2	-42.5	176.2	0	0	0	0	0	112.1	V664 I665 V666 Y672	V664-A668 WeakPolarHBondContact O-CB 3.21Å; V664-A668 PolarHBondContact O-N 3.25Å; I665-A668 PolarHBondContact O-N 3.22Å; V666-A668 VanDerWaalsContact C-N 3.33Å; V666-A668 PolarHBondContact O-N 3Å; A668-Y672 VanDerWaalsContact O-CB 3.23Å; A668-Y672 WeakPolarHBondContact O-CB 3.45Å; A668-Y672 PolarHBondContact O-N 3.02Å
669	L	85.2	Confident	81.6	Confident	29 Å²	29	71.4 Å²	71.4	15%	0.152	37%	0.365	C	S	.	.	H	α-helix	trans	-64.2	-43.4	175.3	-69.2	173.7	0	0	0	111.5	L292 Y559 I665 V666 Y672 V673	L292-L669 HydrophobicContact CD1-CD1 4.3Å; L292-L669 HydrophobicContact CD1-CD2 4.3Å; L292-L669 HydrophobicContact CD2-CD1 4.02Å; Y559-L669 HydrophobicContact CE1-CD2 3.75Å; I665-L669 HydrophobicContact CG2-CD1 4.03Å; I665-L669 HydrophobicContact CG2-CG 4.41Å; I665-L669 VanDerWaalsContact O-CG 3.31Å; I665-L669 WeakPolarHBondContact O-CG 3.39Å; I665-L669 PolarHBondContact O-N 2.8Å; V666-L669 PolarHBondContact O-N 2.93Å; L669-Y672 PolarHBondContact O-N 3.21Å; L669-V673 WeakPolarHBondContact O-CG2 3.24Å; L669-V673 PolarHBondContact O-N 3.27Å
670	Y	83.4	Confident	80.3	Confident	61 Å²	61	72.4 Å²	72.4	24%	0.239	37%	0.371	C	S	.	.	H	α-helix	trans	-60.5	-50.4	176.7	179	-100	0	0	0	111.8	E285 F286 V666 M667 Y672 V673 S674	E285-Y670 HydrophobicContact CB-CD2 4.21Å; E285-Y670 HydrophobicContact CB-CE2 3.78Å; E285-Y670 PolarHBondContact OE2-OH 3.24Å; F286-Y670 HydrophobicContact CD1-CD2 4.48Å; F286-Y670 HydrophobicContact CD1-CE2 4.32Å; F286-Y670 HydrophobicContact CE1-CD2 4.33Å; F286-Y670 AromaticContact CE1-CE2 3.95Å; F286-Y670 HydrophobicContact CE1-CE2 3.95Å; F286-Y670 HydrophobicContact CE2-CE2 4.24Å; F286-Y670 AromaticContact CZ-CE2 3.9Å; F286-Y670 HydrophobicContact CZ-CE2 3.9Å; V666-Y670 WeakPolarHBondContact O-CB 3.44Å; V666-Y670 PolarHBondContact O-N 3.17Å; M667-Y670 PolarHBondContact O-N 3.19Å; Y670-Y672 VanDerWaalsContact C-N 3.33Å; Y670-Y672 PolarHBondContact O-N 3.25Å; Y670-V673 PolarHBondContact O-N 3.33Å; Y670-S674 WeakPolarHBondContact O-CB 3.37Å; Y670-S674 PolarHBondContact O-N 3.5Å
671	I	85.7	Confident	78.6	Confident	80 Å²	80	74.9 Å²	74.9	41%	0.41	39%	0.385	S	S	.	.	H	α-helix	trans	-60.5	-43.1	177.7	-69.8	169	0	0	0	110.6	M667 V673 S674 H675	M667-I671 HydrophobicContact CG-CD1 3.91Å; M667-I671 WeakPolarHBondContact O-CB 3.36Å; M667-I671 VanDerWaalsContact O-CG1 3.24Å; M667-I671 WeakPolarHBondContact O-CG1 3.48Å; M667-I671 PolarHBondContact O-N 3.5Å; I671-V673 PolarHBondContact O-N 3.49Å; I671-S674 PolarHBondContact O-N 3.17Å; I671-H675 PolarHBondContact O-CD2 3.34Å; I671-H675 VanDerWaalsContact O-CD2 3.27Å; I671-H675 PolarHBondContact O-N 2.98Å
672	Y	85	Confident	77	Confident	93 Å²	93	73 Å²	73	37%	0.365	37%	0.37	S	S	.	.	H	α-helix	trans	-59	-48.2	178.3	179.3	-92.6	0	0	0	112.3	Y559 P560 A668 L669 Y670 H675 K676	Y559-Y672 AromaticContact CD1-CD1 3.68Å; Y559-Y672 HydrophobicContact CD1-CD1 3.68Å; Y559-Y672 AromaticContact CD1-CE1 3.5Å; Y559-Y672 HydrophobicContact CD1-CE1 3.5Å; Y559-Y672 VanDerWaalsContact CD1-CE1 3.5Å; Y559-Y672 AromaticContact CE1-CD1 3.57Å; Y559-Y672 HydrophobicContact CE1-CD1 3.57Å; Y559-Y672 AromaticContact CE1-CE1 3.92Å; Y559-Y672 HydrophobicContact CE1-CE1 3.92Å; Y559-Y672 HydrophobicContact CG-CE1 4.49Å; P560-Y672 WeakPolarHBondContact CD-OH 3.45Å; P560-Y672 WeakPolarHBondContact CG-OH 3.49Å; A668-Y672 VanDerWaalsContact O-CB 3.23Å; A668-Y672 WeakPolarHBondContact O-CB 3.45Å; A668-Y672 PolarHBondContact O-N 3.02Å; L669-Y672 PolarHBondContact O-N 3.21Å; Y670-Y672 VanDerWaalsContact C-N 3.33Å; Y670-Y672 PolarHBondContact O-N 3.25Å; Y672-H675 PolarHBondContact O-N 2.82Å; Y672-K676 HydrophobicContact CE1-CD 4.22Å; Y672-K676 PolarHBondContact O-N 3.13Å
673	V	79.2	Confident	75.3	Confident	1 Å²	1	74.1 Å²	74.1	1%	0.006	38%	0.383	C	S	.	.	H	α-helix	trans	-68.5	-37.9	179.9	-179.7	0	0	0	0	111.2	E285 I558 Y559 L669 Y670 I671 K676 K677	E285-V673 HydrophobicContact CB-CG1 4.4Å; E285-V673 HydrophobicContact CG-CG1 4.18Å; I558-V673 HydrophobicContact CG2-CB 4.45Å; I558-V673 HydrophobicContact CG2-CG1 3.91Å; I558-V673 HydrophobicContact CG2-CG2 3.64Å; Y559-V673 HydrophobicContact CE1-CG2 4.03Å; Y559-V673 HydrophobicContact CE2-CG2 4.46Å; Y559-V673 WeakPolarHBondContact OH-CG2 3.47Å; L669-V673 WeakPolarHBondContact O-CG2 3.24Å; L669-V673 PolarHBondContact O-N 3.27Å; Y670-V673 PolarHBondContact O-N 3.33Å; I671-V673 PolarHBondContact O-N 3.49Å; V673-K676 PolarHBondContact O-N 2.99Å; V673-K677 PolarHBondContact O-N 2.82Å
674	S	75.5	Confident	74	Confident	39 Å²	39	72.3 Å²	72.3	27%	0.273	38%	0.375	S	S	.	.	H	α-helix	trans	-63.2	-41	177.5	-168.2	0	0	0	0	112.4	Y670 I671 K677	Y670-S674 WeakPolarHBondContact O-CB 3.37Å; Y670-S674 PolarHBondContact O-N 3.5Å; I671-S674 PolarHBondContact O-N 3.17Å; S674-K677 WeakPolarHBondContact O-CG 3.14Å
675	H	79.3	Confident	72.4	Confident	158 Å²	158	69.1 Å²	69.1	73%	0.731	36%	0.356	S	S	*	.	H	α-helix	trans	-70.2	-38.4	177.4	-85.8	-68.7	0	0	0	113.5	I671 Y672 K677	I671-H675 PolarHBondContact O-CD2 3.34Å; I671-H675 VanDerWaalsContact O-CD2 3.27Å; I671-H675 PolarHBondContact O-N 2.98Å; Y672-H675 PolarHBondContact O-N 2.82Å; H675-K677 VanDerWaalsContact C-N 3.31Å; H675-K677 PolarHBondContact O-N 3.14Å
676	K	74.1	Confident	71	Confident	84 Å²	84	67.6 Å²	67.6	37%	0.365	35%	0.351	S	S	.	.	H	α-helix	trans	-72.8	-23.5	-174.9	-167.2	178.7	168.1	-158.2	0	112.9	N557 I558 Y672 V673	N557-K676 PolarHBondContact O-NZ 3.02Å; I558-K676 PolarHBondContact O-NZ 3.49Å; Y672-K676 HydrophobicContact CE1-CD 4.22Å; Y672-K676 PolarHBondContact O-N 3.13Å; V673-K676 PolarHBondContact O-N 2.99Å
677	K	65.8	Low	70	Confident	165 Å²	165	71.7 Å²	71.7	72%	0.717	37%	0.369	S	S	*	.			trans	39.2	64.5	-177.5	-64.7	-173.6	-179.8	179.4	0	112.3	V673 S674 H675 D679	V673-K677 PolarHBondContact O-N 2.82Å; S674-K677 WeakPolarHBondContact O-CG 3.14Å; H675-K677 VanDerWaalsContact C-N 3.31Å; H675-K677 PolarHBondContact O-N 3.14Å; K677-D679 PolarHBondContact O-N 3.29Å
678	P	61.3	Low	68.8	Low	24 Å²	24	67.4 Å²	67.4	16%	0.156	35%	0.351	C	S	.	.			trans	-58.8	130.7	179.1	25.3	-32.8	0	0	0	110.1	P284 V680	P284-P678 HydrophobicContact CB-CG 4.5Å; P678-V680 HydrophobicContact CB-CG1 4.47Å; P678-V680 PolarHBondContact O-N 3.24Å
679	D	55	Low	67.5	Low	164 Å²	164	67 Å²	67	88%	0.877	34%	0.341	S	S	*	.			trans	-72.3	67	178.1	-72.9	-36.5	0	0	0	110.7	K677	K677-D679 PolarHBondContact O-N 3.29Å
680	V	59	Low	66.9	Low	22 Å²	22	69.5 Å²	69.5	13%	0.133	36%	0.357	C	S	.	.			trans	-86.8	133.4	173.4	-69.9	0	0	0	0	110.3	P284 P678 W682	P284-V680 HydrophobicContact CB-CG2 4.02Å; P284-V680 HydrophobicContact CG-CG2 3.76Å; P678-V680 HydrophobicContact CB-CG1 4.47Å; P678-V680 PolarHBondContact O-N 3.24Å; V680-W682 VanDerWaalsContact C-N 3.27Å; V680-W682 HydrophobicContact CB-CD2 4.36Å; V680-W682 HydrophobicContact CB-CH2 4.41Å; V680-W682 HydrophobicContact CB-CZ2 4Å; V680-W682 HydrophobicContact CG1-CH2 4.31Å; V680-W682 HydrophobicContact CG1-CZ2 4Å; V680-W682 PolarHBondContact O-N 3.14Å
681	N	56	Low	66.7	Low	143 Å²	143	73.9 Å²	73.9	77%	0.765	38%	0.375	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.4	-1.7	-169.7	58.6	-5.5	0	0	0	115.4
682	W	56.6	Low	66.1	Low	65 Å²	65	72.7 Å²	72.7	25%	0.246	37%	0.368	C	S	.	.	T	Hydrogen-bonded Turn	trans	-96.4	12.6	177.3	48.3	83.1	0	0	0	115.2	R280 D556 V680	R280-W682 HydrophobicContact CG-CB 4.47Å; R280-W682 HydrophobicContact CG-CG 4.21Å; D556-W682 HydrophobicContact CB-CH2 4.47Å; D556-W682 HydrophobicContact CB-CZ2 4.41Å; D556-W682 WeakPolarHBondContact OD1-CH2 3.32Å; D556-W682 WeakPolarHBondContact OD2-CZ2 2.98Å; V680-W682 VanDerWaalsContact C-N 3.27Å; V680-W682 HydrophobicContact CB-CD2 4.36Å; V680-W682 HydrophobicContact CB-CH2 4.41Å; V680-W682 HydrophobicContact CB-CZ2 4Å; V680-W682 HydrophobicContact CG1-CH2 4.31Å; V680-W682 HydrophobicContact CG1-CZ2 4Å; V680-W682 PolarHBondContact O-N 3.14Å
683	G	51.5	Low	65.9	Low	31 Å²	31	72.5 Å²	72.5	32%	0.32	37%	0.37	S	S	.	.			trans	74	142.2	176.4	0	0	0	0	0	112.3
684	S	59.2	Low	66.2	Low	13 Å²	13	74.9 Å²	74.9	9%	0.091	39%	0.39	C	S	.	.			trans	-96.4	148.1	172.9	-174.9	0	0	0	0	110.5	T686 Q687 A688	S684-T686 WeakPolarHBondContact CB-OG1 3.36Å; S684-T686 PolarHBondContact O-N 3.48Å; S684-T686 PolarHBondContact OG-N 2.84Å; S684-T686 PolarHBondContact OG-OG1 2.91Å; S684-Q687 VanDerWaalsContact N-OE1 3.1Å; S684-Q687 WeakPolarHBondContact O-CB 3.42Å; S684-Q687 PolarHBondContact O-N 3.43Å; S684-A688 PolarHBondContact O-N 2.79Å
685	S	57.1	Low	66.7	Low	18 Å²	18	76.5 Å²	76.5	13%	0.126	40%	0.395	C	S	.	.	H	α-helix	trans	-56.1	-33.1	167.3	47.4	0	0	0	0	111.4	L282 A688 L689	L282-S685 WeakPolarHBondContact O-CB 3.47Å; L282-S685 PolarHBondContact O-OG 3.38Å; S685-A688 PolarHBondContact O-N 3.35Å; S685-L689 WeakPolarHBondContact O-CB 3.44Å; S685-L689 PolarHBondContact O-N 2.9Å
686	T	60.3	Low	66.9	Low	46 Å²	46	71.7 Å²	71.7	28%	0.282	38%	0.377	S	S	.	.	H	α-helix	trans	-68.5	-38.8	172.8	48.8	0	0	0	0	113	E285 S684 A688 L689 T690	E285-T686 WeakPolarHBondContact OE1-CG2 3.31Å; E285-T686 PolarHBondContact OE1-OG1 3.05Å; E285-T686 WeakPolarHBondContact OE2-CG2 3.27Å; S684-T686 WeakPolarHBondContact CB-OG1 3.36Å; S684-T686 PolarHBondContact O-N 3.48Å; S684-T686 PolarHBondContact OG-N 2.84Å; S684-T686 PolarHBondContact OG-OG1 2.91Å; T686-A688 VanDerWaalsContact C-N 3.35Å; T686-L689 WeakPolarHBondContact O-CB 3.48Å; T686-L689 PolarHBondContact O-N 3.37Å; T686-T690 WeakPolarHBondContact O-CG2 3.49Å; T686-T690 PolarHBondContact O-N 2.86Å; T686-T690 PolarHBondContact O-OG1 3.17Å
687	Q	65.6	Low	67.5	Low	100 Å²	100	73.4 Å²	73.4	47%	0.467	39%	0.386	S	S	.	.	H	α-helix	trans	-65.1	-41.4	173.5	-72.6	172.6	-10.4	0	0	111.4	S684 L689 T690 Y691	S684-Q687 VanDerWaalsContact N-OE1 3.1Å; S684-Q687 WeakPolarHBondContact O-CB 3.42Å; S684-Q687 PolarHBondContact O-N 3.43Å; Q687-L689 VanDerWaalsContact C-N 3.32Å; Q687-L689 PolarHBondContact O-N 3.16Å; Q687-T690 WeakPolarHBondContact CA-OG1 3.46Å; Q687-T690 PolarHBondContact O-N 2.82Å; Q687-T690 PolarHBondContact O-OG1 2.88Å; Q687-Y691 PolarHBondContact O-N 3.3Å
688	A	60.4	Low	68.6	Low	22 Å²	22	66.8 Å²	66.8	18%	0.182	36%	0.359	C	S	.	.	H	α-helix	trans	-63.5	-40.3	177.4	0	0	0	0	0	111.1	P626 S684 S685 T686 Y691 Q692	P626-A688 HydrophobicContact CB-CB 4.34Å; P626-A688 VanDerWaalsContact CD-CB 3.5Å; P626-A688 HydrophobicContact CG-CB 3.82Å; S684-A688 PolarHBondContact O-N 2.79Å; S685-A688 PolarHBondContact O-N 3.35Å; T686-A688 VanDerWaalsContact C-N 3.35Å; A688-Y691 PolarHBondContact O-N 2.94Å; A688-Q692 PolarHBondContact O-N 3.07Å
689	L	62.4	Low	69.8	Low	48 Å²	48	70.6 Å²	70.6	25%	0.251	38%	0.377	S	S	.	.	H	α-helix	trans	-62.2	-45.1	171.2	179.8	64.6	0	0	0	111.7	A623 S685 T686 Q687 Y691 Q692 Q693	A623-L689 HydrophobicContact CB-CD1 4.44Å; S685-L689 WeakPolarHBondContact O-CB 3.44Å; S685-L689 PolarHBondContact O-N 2.9Å; T686-L689 WeakPolarHBondContact O-CB 3.48Å; T686-L689 PolarHBondContact O-N 3.37Å; Q687-L689 VanDerWaalsContact C-N 3.32Å; Q687-L689 PolarHBondContact O-N 3.16Å; L689-Y691 VanDerWaalsContact C-N 3.28Å; L689-Y691 PolarHBondContact O-N 3.21Å; L689-Q692 PolarHBondContact O-N 2.68Å; L689-Q693 HydrophobicContact CD1-CG 4.12Å; L689-Q693 HydrophobicContact CG-CG 4.27Å; L689-Q693 WeakPolarHBondContact O-CB 3.5Å; L689-Q693 VanDerWaalsContact O-CG 3.31Å; L689-Q693 WeakPolarHBondContact O-CG 3.32Å; L689-Q693 PolarHBondContact O-N 3.5Å
690	T	73.4	Confident	71.3	Confident	82 Å²	82	68.8 Å²	68.8	50%	0.503	36%	0.363	S	S	.	.	H	α-helix	trans	-62.3	-36.2	178.1	56.9	0	0	0	0	112.4	T686 Q687 A694	T686-T690 WeakPolarHBondContact O-CG2 3.49Å; T686-T690 PolarHBondContact O-N 2.86Å; T686-T690 PolarHBondContact O-OG1 3.17Å; Q687-T690 WeakPolarHBondContact CA-OG1 3.46Å; Q687-T690 PolarHBondContact O-N 2.82Å; Q687-T690 PolarHBondContact O-OG1 2.88Å; T690-A694 WeakPolarHBondContact O-CB 3.33Å; T690-A694 PolarHBondContact O-N 2.83Å
691	Y	78.8	Confident	72.5	Confident	154 Å²	154	70.3 Å²	70.3	60%	0.604	37%	0.371	S	S	*	.	H	α-helix	trans	-65.5	-47.4	175	178.5	-92.9	0	0	0	111.4	Q687 A688 L689 A694 L695	Q687-Y691 PolarHBondContact O-N 3.3Å; A688-Y691 PolarHBondContact O-N 2.94Å; L689-Y691 VanDerWaalsContact C-N 3.28Å; L689-Y691 PolarHBondContact O-N 3.21Å; Y691-A694 PolarHBondContact O-N 3.24Å; Y691-L695 WeakPolarHBondContact O-CB 3.38Å; Y691-L695 PolarHBondContact O-N 2.9Å
692	Q	73.1	Confident	73.8	Confident	55 Å²	55	66.2 Å²	66.2	26%	0.257	35%	0.354	S	S	.	.	H	α-helix	trans	-63.6	-44.3	178.1	-175.7	176.9	-6.6	0	0	111.6	A623 N624 A688 L689 L695 T696	A623-Q692 PolarHBondContact O-OE1 2.85Å; N624-Q692 PolarHBondContact O-OE1 2.87Å; A688-Q692 PolarHBondContact O-N 3.07Å; L689-Q692 PolarHBondContact O-N 2.68Å; Q692-L695 PolarHBondContact O-N 3.25Å; Q692-T696 WeakPolarHBondContact O-CB 3.31Å; Q692-T696 PolarHBondContact O-N 3.34Å; Q692-T696 PolarHBondContact O-OG1 3.21Å; Q692-T696 VanDerWaalsContact O-OG1 3.07Å
693	Q	81.2	Confident	75.2	Confident	88 Å²	88	67.1 Å²	67.1	41%	0.411	37%	0.374	S	S	.	.	H	α-helix	trans	-59.4	-47.2	173.9	-74.2	175.2	-20.2	0	0	110.9	L689 L695 T696 H697	L689-Q693 HydrophobicContact CD1-CG 4.12Å; L689-Q693 HydrophobicContact CG-CG 4.27Å; L689-Q693 WeakPolarHBondContact O-CB 3.5Å; L689-Q693 VanDerWaalsContact O-CG 3.31Å; L689-Q693 WeakPolarHBondContact O-CG 3.32Å; L689-Q693 PolarHBondContact O-N 3.5Å; Q693-L695 VanDerWaalsContact C-N 3.34Å; Q693-L695 PolarHBondContact O-N 3.45Å; Q693-T696 PolarHBondContact O-N 2.87Å; Q693-H697 WeakPolarHBondContact O-CB 3.42Å; Q693-H697 PolarHBondContact O-CD2 2.9Å; Q693-H697 PolarHBondContact O-N 3.47Å
694	A	85.2	Confident	76.7	Confident	51 Å²	51	69 Å²	69	42%	0.421	38%	0.38	S	S	.	.	H	α-helix	trans	-59.5	-43.5	177.1	0	0	0	0	0	112	T690 Y691 T698	T690-A694 WeakPolarHBondContact O-CB 3.33Å; T690-A694 PolarHBondContact O-N 2.83Å; Y691-A694 PolarHBondContact O-N 3.24Å; A694-T698 VanDerWaalsContact O-CB 3.31Å; A694-T698 WeakPolarHBondContact O-CB 3.47Å; A694-T698 PolarHBondContact O-N 3.03Å; A694-T698 PolarHBondContact O-OG1 3.46Å
695	L	84.9	Confident	77.5	Confident	73 Å²	73	75.6 Å²	75.6	38%	0.382	41%	0.409	S	S	.	.	H	α-helix	trans	-64.2	-52.5	176.9	-178.5	68.1	0	0	0	111.5	Y691 Q692 Q693 H697 T698 L699	Y691-L695 WeakPolarHBondContact O-CB 3.38Å; Y691-L695 PolarHBondContact O-N 2.9Å; Q692-L695 PolarHBondContact O-N 3.25Å; Q693-L695 VanDerWaalsContact C-N 3.34Å; Q693-L695 PolarHBondContact O-N 3.45Å; L695-H697 VanDerWaalsContact C-N 3.34Å; L695-H697 PolarHBondContact O-N 3.46Å; L695-T698 PolarHBondContact O-N 2.76Å; L695-T698 VanDerWaalsContact O-N 3.17Å; L695-L699 HydrophobicContact CD1-CD1 4.43Å; L695-L699 HydrophobicContact CG-CD1 4.15Å; L695-L699 WeakPolarHBondContact O-CB 3.5Å; L695-L699 WeakPolarHBondContact O-CG 3.32Å; L695-L699 PolarHBondContact O-N 2.86Å
696	T	84.6	Confident	77.9	Confident	57 Å²	57	79.4 Å²	79.4	35%	0.35	43%	0.428	S	S	.	.	H	α-helix	trans	-60.1	-43.3	179.2	-64.5	0	0	0	0	111.1	Q692 Q693 L699 H700	Q692-T696 WeakPolarHBondContact O-CB 3.31Å; Q692-T696 PolarHBondContact O-N 3.34Å; Q692-T696 PolarHBondContact O-OG1 3.21Å; Q692-T696 VanDerWaalsContact O-OG1 3.07Å; Q693-T696 PolarHBondContact O-N 2.87Å; T696-L699 PolarHBondContact O-N 3.23Å; T696-H700 WeakPolarHBondContact O-CB 3.4Å; T696-H700 PolarHBondContact O-CD2 3.38Å; T696-H700 VanDerWaalsContact O-CD2 3.24Å; T696-H700 PolarHBondContact O-N 2.81Å
697	H	87.2	Confident	78.2	Confident	121 Å²	121	82.6 Å²	82.6	56%	0.56	44%	0.44	S	S	*	.	H	α-helix	trans	-66.1	-37.8	175.8	-67.4	-38.9	0	0	0	112.3	Q693 L695 H700 L701	Q693-H697 WeakPolarHBondContact O-CB 3.42Å; Q693-H697 PolarHBondContact O-CD2 2.9Å; Q693-H697 PolarHBondContact O-N 3.47Å; L695-H697 VanDerWaalsContact C-N 3.34Å; L695-H697 PolarHBondContact O-N 3.46Å; H697-H700 PolarHBondContact O-N 2.83Å; H697-L701 WeakPolarHBondContact O-CB 3.48Å; H697-L701 PolarHBondContact O-N 3.39Å
698	T	87.3	Confident	77.8	Confident	25 Å²	25	84.1 Å²	84.1	15%	0.153	46%	0.455	C	S	.	.	H	α-helix	trans	-68.4	-38.4	175.9	-54.5	0	0	0	0	111.7	A694 L695 L701 S702 L801 L804	A694-T698 VanDerWaalsContact O-CB 3.31Å; A694-T698 WeakPolarHBondContact O-CB 3.47Å; A694-T698 PolarHBondContact O-N 3.03Å; A694-T698 PolarHBondContact O-OG1 3.46Å; L695-T698 PolarHBondContact O-N 2.76Å; L695-T698 VanDerWaalsContact O-N 3.17Å; T698-L701 PolarHBondContact O-N 3.45Å; T698-S702 PolarHBondContact O-N 3.16Å; T698-S702 VanDerWaalsContact O-N 3.13Å; T698-L801 HydrophobicContact CG2-CB 4.5Å; T698-L801 HydrophobicContact CG2-CD2 3.89Å; T698-L801 HydrophobicContact CG2-CG 3.97Å; T698-L804 HydrophobicContact CG2-CD1 4.31Å
699	L	87.4	Confident	77.7	Confident	104 Å²	104	92.3 Å²	92.3	55%	0.545	49%	0.487	S	S	.	.	H	α-helix	trans	-66.3	-45.1	173.6	-72.6	172.3	0	0	0	111.5	L695 T696 L701 S702 A703	L695-L699 HydrophobicContact CD1-CD1 4.43Å; L695-L699 HydrophobicContact CG-CD1 4.15Å; L695-L699 WeakPolarHBondContact O-CB 3.5Å; L695-L699 WeakPolarHBondContact O-CG 3.32Å; L695-L699 PolarHBondContact O-N 2.86Å; T696-L699 PolarHBondContact O-N 3.23Å; L699-L701 VanDerWaalsContact C-N 3.27Å; L699-L701 PolarHBondContact O-N 3.08Å; L699-S702 WeakPolarHBondContact O-CB 3.49Å; L699-S702 PolarHBondContact O-N 3.35Å; L699-S702 PolarHBondContact O-OG 2.91Å; L699-A703 PolarHBondContact O-N 3.24Å
700	H	86.6	Confident	77.7	Confident	126 Å²	126	93.4 Å²	93.4	58%	0.583	49%	0.493	S	S	*	.	H	α-helix	trans	-59.3	-40.4	173.3	-89	-72.2	0	0	0	111.8	T696 H697 S702 A703	T696-H700 WeakPolarHBondContact O-CB 3.4Å; T696-H700 PolarHBondContact O-CD2 3.38Å; T696-H700 VanDerWaalsContact O-CD2 3.24Å; T696-H700 PolarHBondContact O-N 2.81Å; H697-H700 PolarHBondContact O-N 2.83Å; H700-S702 PolarHBondContact O-N 3.4Å; H700-A703 PolarHBondContact O-N 3.08Å; H700-A703 VanDerWaalsContact O-N 3.14Å
701	L	84.4	Confident	77.1	Confident	54 Å²	54	97.2 Å²	97.2	28%	0.283	50%	0.503	S	S	.	.	H	α-helix	trans	-63.1	-28.5	176.3	-171.9	65	0	0	0	112.3	H697 T698 L699 A703 R803 L804	H697-L701 WeakPolarHBondContact O-CB 3.48Å; H697-L701 PolarHBondContact O-N 3.39Å; T698-L701 PolarHBondContact O-N 3.45Å; L699-L701 VanDerWaalsContact C-N 3.27Å; L699-L701 PolarHBondContact O-N 3.08Å; L701-A703 VanDerWaalsContact C-N 3.32Å; L701-R803 HydrophobicContact CD2-CB 4.43Å; L701-R803 HydrophobicContact CG-CB 4.21Å; L701-L804 HydrophobicContact CD2-CD2 3.73Å; L701-L804 HydrophobicContact CD2-CG 3.92Å
702	S	83.6	Confident	76.2	Confident	58 Å²	58	100.7 Å²	100.7	41%	0.406	52%	0.515	S	S	.	.	H	α-helix	trans	-70.4	-27	176	76.6	0	0	0	0	114	T698 L699 H700	T698-S702 PolarHBondContact O-N 3.16Å; T698-S702 VanDerWaalsContact O-N 3.13Å; L699-S702 WeakPolarHBondContact O-CB 3.49Å; L699-S702 PolarHBondContact O-N 3.35Å; L699-S702 PolarHBondContact O-OG 2.91Å; H700-S702 PolarHBondContact O-N 3.4Å
703	A	84	Confident	75.9	Confident	83 Å²	83	103.9 Å²	103.9	69%	0.686	53%	0.525	S	S	*	.	H	α-helix	trans	-85	-12.6	-179.9	0	0	0	0	0	113.7	L699 H700 L701	L699-A703 PolarHBondContact O-N 3.24Å; H700-A703 PolarHBondContact O-N 3.08Å; H700-A703 VanDerWaalsContact O-N 3.14Å; L701-A703 VanDerWaalsContact C-N 3.32Å
704	V	83	Confident	75.6	Confident	72 Å²	72	101.1 Å²	101.1	44%	0.436	51%	0.514	S	S	.	.	S	Bend	trans	-81.7	132.3	179.4	179.1	0	0	0	0	110.1
705	E	76.7	Confident	75.7	Confident	150 Å²	150	100.9 Å²	100.9	70%	0.701	51%	0.505	S	S	*	.	P	Polyproline II helix	trans	-70.4	150.7	175.5	-66.9	-177.3	173.4	0	0	112.2	H707	E705-H707 PolarHBondContact O-CE1 2.82Å; E705-H707 PolarHBondContact O-N 3.17Å; E705-H707 PolarHBondContact O-ND1 2.97Å
706	D	65.4	Low	75.9	Confident	99 Å²	99	97.4 Å²	97.4	53%	0.529	49%	0.486	S	S	.	.	P	Polyproline II helix	trans	-67.7	126.7	-179.1	-65.1	-50	0	0	0	110.6	R803	D706-R803 VanDerWaalsContact CG-NH1 3.27Å; D706-R803 IonicContact OD1-CZ 3.12Å; D706-R803 IonicContact OD1-NH1 3.74Å; D706-R803 PolarHBondContact OD1-NH1 3.01Å; D706-R803 VanDerWaalsContact OD1-NH1 3.12Å; D706-R803 IonicContact OD2-CZ 3.67Å; D706-R803 IonicContact OD2-NH1 2.68Å; D706-R803 PolarHBondContact OD2-NH1 3.47Å; D706-R803 IonicContact OD2-NH2 3.12Å; D706-R803 PolarHBondContact OD2-NH2 3.3Å
707	H	66.9	Low	76.3	Confident	113 Å²	113	94.7 Å²	94.7	52%	0.523	47%	0.47	S	S	.	.			trans	-118.5	150.3	175.4	-62.2	-8.9	0	0	0	109.7	E705 K709 N710 F711	E705-H707 PolarHBondContact O-CE1 2.82Å; E705-H707 PolarHBondContact O-N 3.17Å; E705-H707 PolarHBondContact O-ND1 2.97Å; H707-K709 PolarHBondContact O-N 3.49Å; H707-N710 WeakPolarHBondContact O-CA 3.28Å; H707-N710 PolarHBondContact O-N 2.86Å; H707-F711 PolarHBondContact O-N 3.33Å
708	V	56.5	Low	76.6	Confident	131 Å²	131	89 Å²	89	79%	0.794	44%	0.443	S	S	*	.	H	α-helix	trans	-54.6	-27.9	-179.8	-176.4	0	0	0	0	112.7
709	K	58.8	Low	76.8	Confident	194 Å²	194	88.5 Å²	88.5	84%	0.843	44%	0.439	S	S	*	.	H	α-helix	trans	-75.3	-24.1	176.1	-66.1	-178	-179.8	176.8	0	114.1	H707	H707-K709 PolarHBondContact O-N 3.49Å
710	N	62	Low	76.7	Confident	71 Å²	71	83.6 Å²	83.6	38%	0.38	41%	0.414	S	S	.	.	H	α-helix	trans	-90.8	-35.9	176.9	-145.3	25	0	0	0	111	H707 R712 R713	H707-N710 WeakPolarHBondContact O-CA 3.28Å; H707-N710 PolarHBondContact O-N 2.86Å; N710-R712 VanDerWaalsContact C-N 3.31Å; N710-R712 PolarHBondContact O-N 3.43Å; N710-R713 PolarHBondContact O-N 2.96Å
711	F	61.4	Low	76.7	Confident	163 Å²	163	78.6 Å²	78.6	72%	0.715	40%	0.397	S	S	*	.	H	α-helix	trans	-63.2	-30.6	-179.8	-170.6	-98.3	0	0	0	114.1	H707 R713	H707-F711 PolarHBondContact O-N 3.33Å; F711-R713 PolarHBondContact O-N 2.93Å; F711-R713 VanDerWaalsContact O-N 3.14Å
712	R	60.1	Low	76.7	Confident	226 Å²	226	79.7 Å²	79.7	85%	0.853	40%	0.397	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.7	-0.6	-178.1	-158.5	173	179.9	168.5	1.9	114.1	N710 P714	N710-R712 VanDerWaalsContact C-N 3.31Å; N710-R712 PolarHBondContact O-N 3.43Å; R712-P714 WeakPolarHBondContact O-CD 3.29Å
713	R	67.4	Low	76.7	Confident	122 Å²	122	76.9 Å²	76.9	46%	0.46	38%	0.378	S	S	.	.	S	Bend	trans	-88.1	120.8	179.9	-63.1	-173.3	-171.7	-163.9	5.9	109.8	N710 F711 Q715	N710-R713 PolarHBondContact O-N 2.96Å; F711-R713 PolarHBondContact O-N 2.93Å; F711-R713 VanDerWaalsContact O-N 3.14Å; R713-Q715 PolarHBondContact O-N 3.32Å
714	P	73.9	Confident	76.7	Confident	30 Å²	30	75 Å²	75	20%	0.195	36%	0.357	C	S	.	.			trans	-70.2	126.2	175.1	28.3	-32.5	0	0	0	109.8	R712 F736	R712-P714 WeakPolarHBondContact O-CD 3.29Å; P714-F736 HydrophobicContact CB-CD1 4.02Å; P714-F736 HydrophobicContact CB-CE1 3.2Å; P714-F736 HydrophobicContact CB-CZ 3.76Å; P714-F736 HydrophobicContact CG-CD1 3.83Å; P714-F736 HydrophobicContact CG-CE1 3.31Å; P714-F736 HydrophobicContact CG-CZ 3.69Å
715	Q	86.4	Confident	76.7	Confident	47 Å²	47	72.3 Å²	72.3	22%	0.22	34%	0.341	C	S	.	.			trans	-108.8	100.4	171.1	-63	172.8	-46	0	0	106.2	R713 L742 R803 R805 P806 N807 T808	R713-Q715 PolarHBondContact O-N 3.32Å; Q715-L742 CarbonylContact C-O 3.51Å; Q715-L742 WeakPolarHBondContact CA-O 3.49Å; Q715-L742 HydrophobicContact CB-CB 4.19Å; Q715-L742 HydrophobicContact CG-CB 4.06Å; Q715-R803 PolarHBondContact NE2-O 3.22Å; Q715-R805 VanDerWaalsContact CB-O 3.23Å; Q715-R805 WeakPolarHBondContact CB-O 3.4Å; Q715-R805 PolarHBondContact OE1-O 3.44Å; Q715-P806 CarbonylContact O-C 3.44Å; Q715-P806 VanDerWaalsContact O-CA 3.32Å; Q715-P806 WeakPolarHBondContact O-CA 3.35Å; Q715-N807 PolarHBondContact N-OD1 3.31Å; Q715-N807 PolarHBondContact O-N 3.09Å; Q715-N807 PolarHBondContact O-OD1 2.97Å; Q715-T808 PolarHBondContact O-N 3.21Å
716	C	90.1	Very high	77	Confident	0 Å²	0	68.3 Å²	68.3	0%	0	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.4	126.1	-167.7	-63.2	0	0	0	0	111.4	V718 V733 L742 I744 T808 V810	C716-V718 HydrophobicContact CB-CG2 4.06Å; C716-V733 HydrophobicContact CB-CG1 3.78Å; C716-L742 PolarHBondContact N-O 3.07Å; C716-I744 PolarHBondContact O-N 3.12Å; C716-T808 CarbonylContact C-O 3.41Å; C716-T808 WeakPolarHBondContact CA-O 3.22Å; C716-V810 HydrophobicContact CB-CG2 4.06Å
717	L	92.9	Very high	78	Confident	0 Å²	0	65.8 Å²	65.8	0%	0	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.8	120	159.8	176.6	63.9	0	0	0	108.2	I744 L795 L796 P806 T808 L809 V810	L717-I744 CarbonylContact C-O 3.59Å; L717-I744 WeakPolarHBondContact CA-O 3.34Å; L717-I744 HydrophobicContact CD1-CB 4.06Å; L717-I744 HydrophobicContact CD1-CG2 3.82Å; L717-L795 HydrophobicContact CD2-CB 3.89Å; L717-L796 HydrophobicContact CD2-CD2 4.11Å; L717-P806 HydrophobicContact CB-CB 3.6Å; L717-P806 HydrophobicContact CB-CG 3.95Å; L717-T808 PolarHBondContact N-O 3.26Å; L717-L809 HydrophobicContact CB-CD1 4.42Å; L717-L809 HydrophobicContact CD2-CD1 3.97Å; L717-L809 HydrophobicContact CG-CD1 4.11Å; L717-L809 CarbonylContact O-C 3.59Å; L717-L809 WeakPolarHBondContact O-CA 3.49Å; L717-V810 PolarHBondContact O-N 3.47Å
718	V	92.8	Very high	78.8	Confident	0 Å²	0	62.3 Å²	62.3	0%	0	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	114.6	-169.2	-176	0	0	0	0	108.9	C716 T720 L729 V733 M743 I744 G746 V810	C716-V718 HydrophobicContact CB-CG2 4.06Å; V718-T720 VanDerWaalsContact C-N 3.27Å; V718-T720 HydrophobicContact CG1-CG2 4.4Å; V718-T720 PolarHBondContact O-N 3.07Å; V718-L729 HydrophobicContact CG1-CD2 3.06Å; V718-L729 HydrophobicContact CG1-CG 4.34Å; V718-V733 HydrophobicContact CG1-CG2 4.35Å; V718-V733 HydrophobicContact CG2-CB 4.13Å; V718-V733 HydrophobicContact CG2-CG1 3.65Å; V718-V733 HydrophobicContact CG2-CG2 4.02Å; V718-M743 HydrophobicContact CG2-CE 4.08Å; V718-M743 HydrophobicContact CG2-CG 4.14Å; V718-I744 PolarHBondContact N-O 2.97Å; V718-G746 PolarHBondContact O-N 3.37Å; V718-V810 HydrophobicContact CG2-CB 4.37Å; V718-V810 HydrophobicContact CG2-CG2 4.46Å
719	M	91.6	Very high	80.3	Confident	15 Å²	15	56.1 Å²	56.1	7%	0.074	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.1	73.8	179.2	-60.7	-60.2	-74.4	0	0	110.5	V748 L788 L795 L809 V810 L811	M719-V748 HydrophobicContact CE-CG2 3.81Å; M719-L788 HydrophobicContact CE-CD1 4.31Å; M719-L795 HydrophobicContact CE-CD1 4.15Å; M719-L795 HydrophobicContact SD-CD1 3.98Å; M719-L809 HydrophobicContact CG-CD1 3.71Å; M719-L809 HydrophobicContact SD-CD1 4.33Å; M719-V810 PolarHBondContact N-O 2.71Å; M719-L811 HydrophobicContact CB-CD2 3.64Å; M719-L811 HydrophobicContact CG-CD2 3.41Å; M719-L811 VanDerWaalsContact CG-CD2 3.41Å
720	T	86.3	Confident	81.7	Confident	1 Å²	1	47 Å²	47	1%	0.006	22%	0.222	C	C	.	.			trans	-86.5	-17.7	-177.2	163.4	0	0	0	0	113	V718 Y722 P723 C745 G746	V718-T720 VanDerWaalsContact C-N 3.27Å; V718-T720 HydrophobicContact CG1-CG2 4.4Å; V718-T720 PolarHBondContact O-N 3.07Å; T720-Y722 PolarHBondContact O-N 3.05Å; T720-P723 WeakPolarHBondContact OG1-CA 3.39Å; T720-C745 HydrophobicContact CG2-CB 3.56Å; T720-G746 PolarHBondContact N-O 3.49Å
721	G	86.1	Confident	83	Confident	22 Å²	22	47.8 Å²	47.8	23%	0.227	23%	0.226	C	C	.	.	S	Bend	trans	64.8	-131	-167.2	0	0	0	0	0	109.7	P723 G746 H747	G721-P723 WeakPolarHBondContact O-CD 3.12Å; G721-G746 PolarHBondContact N-O 2.9Å; G721-H747 VanDerWaalsContact CA-CD2 3.49Å; G721-H747 WeakPolarHBondContact CA-CD2 3.24Å; G721-H747 WeakPolarHBondContact O-CB 3.37Å
722	Y	85	Confident	84.3	Confident	76 Å²	76	44.1 Å²	44.1	30%	0.298	21%	0.214	S	C	.	.	S	Bend	trans	-66.1	123.6	167.1	-64	-72.6	0	0	0	110.1	T720 N724 S725 H747 Y767	T720-Y722 PolarHBondContact O-N 3.05Å; Y722-N724 PolarHBondContact O-N 3.16Å; Y722-N724 VanDerWaalsContact O-N 3.07Å; Y722-S725 WeakPolarHBondContact CB-OG 3.39Å; Y722-S725 WeakPolarHBondContact O-CB 3.35Å; Y722-S725 PolarHBondContact O-N 3.49Å; Y722-H747 AromaticContact CD1-CE1 3.7Å; Y722-H747 AromaticContact CE1-CE1 3.37Å; Y722-H747 WeakPolarHBondContact CE1-CE1 3.5Å; Y722-H747 AromaticContact CE2-CE1 3.86Å; Y722-H747 AromaticContact CE2-NE2 3.93Å; Y722-H747 AromaticContact CZ-CE1 3.44Å; Y722-H747 VanDerWaalsContact CZ-CE1 3.44Å; Y722-H747 AromaticContact CZ-NE2 3.95Å; Y722-Y767 HydrophobicContact CD1-CE1 4.34Å; Y722-Y767 AromaticContact CD1-CE2 3.7Å; Y722-Y767 HydrophobicContact CD1-CE2 3.7Å; Y722-Y767 AromaticContact CD1-CZ 3.52Å; Y722-Y767 VanDerWaalsContact CD1-OH 3.24Å; Y722-Y767 WeakPolarHBondContact CD1-OH 3.37Å; Y722-Y767 HydrophobicContact CE1-CE2 4.02Å
723	P	84.3	Confident	85.6	Confident	0 Å²	0	33.7 Å²	33.7	0%	0	18%	0.175	C	C	.	.	T	Hydrogen-bonded Turn	trans	-54.2	-33.1	-179.3	-29.3	37.8	0	0	0	113.6	T720 G721 S725 Y767 W770 L771 Y780	T720-P723 WeakPolarHBondContact OG1-CA 3.39Å; G721-P723 WeakPolarHBondContact O-CD 3.12Å; P723-S725 VanDerWaalsContact C-N 3.29Å; P723-S725 PolarHBondContact O-N 2.69Å; P723-Y767 HydrophobicContact CG-CD1 4.4Å; P723-Y767 HydrophobicContact CG-CG 4.46Å; P723-W770 HydrophobicContact CB-CE3 3.93Å; P723-W770 HydrophobicContact CB-CZ3 3.66Å; P723-L771 HydrophobicContact CB-CD2 4.37Å; P723-Y780 HydrophobicContact CG-CD2 3.76Å; P723-Y780 HydrophobicContact CG-CE2 3.81Å
724	N	82.6	Confident	86.6	Confident	44 Å²	44	29.8 Å²	29.8	24%	0.235	16%	0.162	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72.4	-21.4	-179.6	-54.8	22.1	0	0	0	113.1	Y722 W770	Y722-N724 PolarHBondContact O-N 3.16Å; Y722-N724 VanDerWaalsContact O-N 3.07Å; N724-W770 HydrophobicContact CB-CZ2 4.36Å; N724-W770 VanDerWaalsContact OD1-CE2 3.28Å
725	S	83.8	Confident	87.1	Confident	14 Å²	14	32.7 Å²	32.7	10%	0.098	18%	0.179	C	C	.	.	T	Hydrogen-bonded Turn	trans	-85.2	-25.9	-173.8	-59.4	0	0	0	0	113	Y722 P723 V853	Y722-S725 WeakPolarHBondContact CB-OG 3.39Å; Y722-S725 WeakPolarHBondContact O-CB 3.35Å; Y722-S725 PolarHBondContact O-N 3.49Å; P723-S725 VanDerWaalsContact C-N 3.29Å; P723-S725 PolarHBondContact O-N 2.69Å; S725-V853 PolarHBondContact O-N 3.12Å
726	R	83.7	Confident	86.9	Confident	66 Å²	66	36.4 Å²	36.4	25%	0.249	20%	0.195	C	C	.	.			trans	-130.6	61	-177	-61.4	-175	175.1	172	-3.1	112.6	A728 L729 L730 D852	R726-A728 VanDerWaalsContact C-N 3.33Å; R726-A728 PolarHBondContact O-N 3.04Å; R726-L729 HydrophobicContact CB-CB 4.46Å; R726-L729 PolarHBondContact O-N 2.61Å; R726-L730 PolarHBondContact O-N 3.37Å; R726-D852 WeakPolarHBondContact CG-OD1 3.43Å; R726-D852 IonicContact CZ-OD1 2.68Å; R726-D852 IonicContact CZ-OD2 2.89Å; R726-D852 IonicContact NE-OD1 3.2Å; R726-D852 PolarHBondContact NE-OD1 3.31Å; R726-D852 IonicContact NE-OD2 3.52Å; R726-D852 IonicContact NH2-OD1 3.73Å; R726-D852 PolarHBondContact NH2-OD1 3.26Å; R726-D852 VanDerWaalsContact NH2-OD1 3.12Å; R726-D852 IonicContact NH2-OD2 2.85Å; R726-D852 PolarHBondContact NH2-OD2 2.88Å
727	P	84.5	Confident	86.5	Confident	46 Å²	46	36.8 Å²	36.8	30%	0.299	20%	0.197	S	C	.	.	H	α-helix	trans	-63.7	-35.1	-176.4	25.8	-34.3	0	0	0	113	L729 L730 D731 V853	P727-L729 VanDerWaalsContact C-N 3.26Å; P727-L729 PolarHBondContact O-N 3.45Å; P727-L730 WeakPolarHBondContact O-CB 3.44Å; P727-L730 PolarHBondContact O-N 3.13Å; P727-L730 VanDerWaalsContact O-N 3.08Å; P727-D731 PolarHBondContact O-N 3.36Å; P727-V853 HydrophobicContact CG-CG2 4.41Å
728	A	85.4	Confident	85.8	Confident	41 Å²	41	44.3 Å²	44.3	34%	0.339	23%	0.23	S	C	.	.	H	α-helix	trans	-61.3	-33.9	-178.6	0	0	0	0	0	113.5	R726 L732 L847 L851	R726-A728 VanDerWaalsContact C-N 3.33Å; R726-A728 PolarHBondContact O-N 3.04Å; A728-L732 WeakPolarHBondContact O-CB 3.26Å; A728-L732 PolarHBondContact O-N 2.93Å; A728-L847 HydrophobicContact CB-CD1 3.86Å; A728-L851 HydrophobicContact CB-CD2 4.35Å
729	L	87.1	Confident	85	Confident	1 Å²	1	47.7 Å²	47.7	1%	0.005	25%	0.248	C	C	.	.	H	α-helix	trans	-74.1	-39.1	176.7	-173.5	135.7	0	0	0	111	V718 R726 P727 V733 L845 L851	V718-L729 HydrophobicContact CG1-CD2 3.06Å; V718-L729 HydrophobicContact CG1-CG 4.34Å; R726-L729 HydrophobicContact CB-CB 4.46Å; R726-L729 PolarHBondContact O-N 2.61Å; P727-L729 VanDerWaalsContact C-N 3.26Å; P727-L729 PolarHBondContact O-N 3.45Å; L729-V733 WeakPolarHBondContact O-CG2 3.43Å; L729-V733 PolarHBondContact O-N 3.42Å; L729-L845 HydrophobicContact CB-CD2 4.16Å; L729-L845 HydrophobicContact CD1-CB 4.38Å; L729-L845 HydrophobicContact CD1-CD2 4.36Å; L729-L845 HydrophobicContact CG-CD2 4.33Å; L729-L851 HydrophobicContact CB-CD2 4.25Å; L729-L851 HydrophobicContact CD1-CD1 4.46Å
730	L	88.8	Confident	84.5	Confident	2 Å²	2	51.4 Å²	51.4	1%	0.01	27%	0.271	C	S	.	.	H	α-helix	trans	-62.1	-48	174.4	-168	78.3	0	0	0	111.2	R726 P727 L732 V733 H734 M743 C745 W770 L771 T776	R726-L730 PolarHBondContact O-N 3.37Å; P727-L730 WeakPolarHBondContact O-CB 3.44Å; P727-L730 PolarHBondContact O-N 3.13Å; P727-L730 VanDerWaalsContact O-N 3.08Å; L730-L732 PolarHBondContact O-N 3.11Å; L730-V733 PolarHBondContact O-N 3.19Å; L730-H734 VanDerWaalsContact O-CB 3.28Å; L730-H734 WeakPolarHBondContact O-CB 3.5Å; L730-H734 PolarHBondContact O-N 2.95Å; L730-M743 HydrophobicContact CD1-CE 3.3Å; L730-M743 HydrophobicContact CG-CE 3.99Å; L730-C745 WeakPolarHBondContact CD1-SG 3.41Å; L730-W770 HydrophobicContact CD2-CH2 4.28Å; L730-W770 HydrophobicContact CD2-CZ3 3.88Å; L730-L771 HydrophobicContact CD1-CD2 4.05Å; L730-L771 HydrophobicContact CD2-CD2 3.92Å; L730-T776 HydrophobicContact CD2-CG2 4.05Å; L730-T776 HydrophobicContact CG-CG2 4.49Å
731	D	88.3	Confident	84.3	Confident	88 Å²	88	52.1 Å²	52.1	47%	0.471	28%	0.279	S	S	.	.	H	α-helix	trans	-65.4	-38.9	-177.6	-73.2	-17.8	0	0	0	112.7	P727 H734 T735	P727-D731 PolarHBondContact O-N 3.36Å; D731-H734 PolarHBondContact O-N 2.71Å; D731-T735 WeakPolarHBondContact O-CB 3.41Å; D731-T735 PolarHBondContact O-N 3.27Å; D731-T735 PolarHBondContact O-OG1 2.89Å
732	L	88.4	Confident	84.4	Confident	86 Å²	86	52.2 Å²	52.2	45%	0.45	27%	0.274	S	S	.	.	H	α-helix	trans	-63.5	-48.1	176.1	-177	70.8	0	0	0	111.1	A728 L730 H734 T735 F736 L845	A728-L732 WeakPolarHBondContact O-CB 3.26Å; A728-L732 PolarHBondContact O-N 2.93Å; L730-L732 PolarHBondContact O-N 3.11Å; L732-H734 VanDerWaalsContact C-N 3.32Å; L732-T735 WeakPolarHBondContact O-CB 3.23Å; L732-T735 PolarHBondContact O-N 2.89Å; L732-F736 PolarHBondContact O-N 2.75Å; L732-L845 HydrophobicContact CB-CD2 4.46Å; L732-L845 HydrophobicContact CD2-CD1 3.53Å; L732-L845 HydrophobicContact CD2-CD2 3.7Å; L732-L845 HydrophobicContact CD2-CG 4.1Å
733	V	88.4	Confident	84.6	Confident	6 Å²	6	48.7 Å²	48.7	4%	0.036	26%	0.261	C	S	.	.	H	α-helix	trans	-69.3	-34.3	179.9	-179.5	0	0	0	0	111.1	C716 V718 L729 L730 T735 F736 T737 M743 V810	C716-V733 HydrophobicContact CB-CG1 3.78Å; V718-V733 HydrophobicContact CG1-CG2 4.35Å; V718-V733 HydrophobicContact CG2-CB 4.13Å; V718-V733 HydrophobicContact CG2-CG1 3.65Å; V718-V733 HydrophobicContact CG2-CG2 4.02Å; L729-V733 WeakPolarHBondContact O-CG2 3.43Å; L729-V733 PolarHBondContact O-N 3.42Å; L730-V733 PolarHBondContact O-N 3.19Å; V733-T735 VanDerWaalsContact C-N 3.33Å; V733-T735 PolarHBondContact O-N 2.91Å; V733-F736 WeakPolarHBondContact O-CB 3.38Å; V733-F736 PolarHBondContact O-N 2.96Å; V733-T737 HydrophobicContact CG1-CG2 4.11Å; V733-T737 WeakPolarHBondContact O-CB 3.41Å; V733-T737 WeakPolarHBondContact O-CG2 3.04Å; V733-T737 PolarHBondContact O-N 3.36Å; V733-T737 PolarHBondContact O-OG1 3.45Å; V733-M743 HydrophobicContact CB-CE 3.88Å; V733-M743 HydrophobicContact CB-SD 4.37Å; V733-M743 HydrophobicContact CG1-CE 3.94Å; V733-M743 HydrophobicContact CG1-CG 4.13Å; V733-M743 HydrophobicContact CG1-SD 3.95Å; V733-V810 HydrophobicContact CG2-CB 4.22Å; V733-V810 HydrophobicContact CG2-CG1 3.76Å; V733-V810 HydrophobicContact CG2-CG2 4.11Å
734	H	87.5	Confident	85	Confident	41 Å²	41	49 Å²	49	19%	0.19	26%	0.262	C	S	.	.	H	α-helix	trans	-61.4	-43.6	172.2	-175.7	70.4	0	0	0	111.4	L730 D731 L732 F736 T737 K738 N739	L730-H734 VanDerWaalsContact O-CB 3.28Å; L730-H734 WeakPolarHBondContact O-CB 3.5Å; L730-H734 PolarHBondContact O-N 2.95Å; D731-H734 PolarHBondContact O-N 2.71Å; L732-H734 VanDerWaalsContact C-N 3.32Å; H734-F736 VanDerWaalsContact C-N 3.28Å; H734-F736 PolarHBondContact O-N 2.81Å; H734-T737 PolarHBondContact O-N 3.06Å; H734-T737 PolarHBondContact O-OG1 3.03Å; H734-K738 PolarHBondContact O-N 3.46Å; H734-N739 PolarHBondContact CE1-OD1 3.37Å
735	T	86.1	Confident	85.5	Confident	91 Å²	91	46.9 Å²	46.9	56%	0.558	25%	0.251	S	S	*	.	H	α-helix	trans	-63.7	-34.6	175	-56.8	0	0	0	0	112.1	D731 L732 V733 K738	D731-T735 WeakPolarHBondContact O-CB 3.41Å; D731-T735 PolarHBondContact O-N 3.27Å; D731-T735 PolarHBondContact O-OG1 2.89Å; L732-T735 WeakPolarHBondContact O-CB 3.23Å; L732-T735 PolarHBondContact O-N 2.89Å; V733-T735 VanDerWaalsContact C-N 3.33Å; V733-T735 PolarHBondContact O-N 2.91Å; T735-K738 WeakPolarHBondContact O-CG 3.32Å
736	F	81.4	Confident	85.9	Confident	125 Å²	125	46.2 Å²	46.2	55%	0.548	25%	0.246	S	C	.	.	H	α-helix	trans	-71.5	-43.1	177.7	-178.6	-119.6	0	0	0	112.7	P714 L732 V733 H734	P714-F736 HydrophobicContact CB-CD1 4.02Å; P714-F736 HydrophobicContact CB-CE1 3.2Å; P714-F736 HydrophobicContact CB-CZ 3.76Å; P714-F736 HydrophobicContact CG-CD1 3.83Å; P714-F736 HydrophobicContact CG-CE1 3.31Å; P714-F736 HydrophobicContact CG-CZ 3.69Å; L732-F736 PolarHBondContact O-N 2.75Å; V733-F736 WeakPolarHBondContact O-CB 3.38Å; V733-F736 PolarHBondContact O-N 2.96Å; H734-F736 VanDerWaalsContact C-N 3.28Å; H734-F736 PolarHBondContact O-N 2.81Å
737	T	81.8	Confident	86.3	Confident	8 Å²	8	43.7 Å²	43.7	5%	0.049	24%	0.237	C	C	.	.	H	α-helix	trans	-81.6	-19.7	-177.2	54.2	0	0	0	0	113.2	V733 H734 N739 V740 G741	V733-T737 HydrophobicContact CG1-CG2 4.11Å; V733-T737 WeakPolarHBondContact O-CB 3.41Å; V733-T737 WeakPolarHBondContact O-CG2 3.04Å; V733-T737 PolarHBondContact O-N 3.36Å; V733-T737 PolarHBondContact O-OG1 3.45Å; H734-T737 PolarHBondContact O-N 3.06Å; H734-T737 PolarHBondContact O-OG1 3.03Å; T737-N739 PolarHBondContact O-N 3.41Å; T737-V740 PolarHBondContact O-N 3.36Å; T737-G741 PolarHBondContact O-N 2.91Å; T737-G741 VanDerWaalsContact O-N 3.16Å
738	K	78.9	Confident	86.6	Confident	158 Å²	158	42.1 Å²	42.1	69%	0.687	23%	0.227	S	C	*	.	T	Hydrogen-bonded Turn	trans	42.1	38.5	177.5	-64.7	-165.4	176.8	-179.7	0	114.1	H734 T735 V740	H734-K738 PolarHBondContact O-N 3.46Å; T735-K738 WeakPolarHBondContact O-CG 3.32Å; K738-V740 WeakPolarHBondContact O-CG2 3.37Å; K738-V740 PolarHBondContact O-N 3Å; K738-V740 VanDerWaalsContact O-N 3.09Å
739	N	74.5	Confident	86.6	Confident	71 Å²	71	43.8 Å²	43.8	38%	0.38	22%	0.224	S	C	.	.	T	Hydrogen-bonded Turn	trans	60.1	14.7	-177.5	-64.4	-38.9	0	0	0	115.8	H734 T737 K777	H734-N739 PolarHBondContact CE1-OD1 3.37Å; T737-N739 PolarHBondContact O-N 3.41Å; N739-K777 HydrophobicContact CB-CD 3.9Å; N739-K777 WeakPolarHBondContact OD1-CB 3.32Å; N739-K777 WeakPolarHBondContact OD1-CD 3.38Å; N739-K777 WeakPolarHBondContact OD1-CG 3.47Å
740	V	81.3	Confident	86.5	Confident	92 Å²	92	49.5 Å²	49.5	56%	0.558	25%	0.252	S	S	*	.	T	Hydrogen-bonded Turn	trans	-107.6	-32.5	178.9	179.1	0	0	0	0	111.7	T737 K738	T737-V740 PolarHBondContact O-N 3.36Å; K738-V740 WeakPolarHBondContact O-CG2 3.37Å; K738-V740 PolarHBondContact O-N 3Å; K738-V740 VanDerWaalsContact O-N 3.09Å
741	G	82	Confident	85.9	Confident	17 Å²	17	50.3 Å²	50.3	18%	0.175	26%	0.261	C	S	.	.	S	Bend	trans	-89.4	162.3	176.4	0	0	0	0	0	113.4	T737	T737-G741 PolarHBondContact O-N 2.91Å; T737-G741 VanDerWaalsContact O-N 3.16Å
742	L	88	Confident	84.8	Confident	24 Å²	24	55 Å²	55	13%	0.126	27%	0.273	C	S	.	.			trans	-78.9	130	170.4	177.5	66.2	0	0	0	109.1	Q715 C716 I744 F779 L804	Q715-L742 CarbonylContact C-O 3.51Å; Q715-L742 WeakPolarHBondContact CA-O 3.49Å; Q715-L742 HydrophobicContact CB-CB 4.19Å; Q715-L742 HydrophobicContact CG-CB 4.06Å; C716-L742 PolarHBondContact N-O 3.07Å; L742-I744 HydrophobicContact CD1-CG1 4.31Å; L742-I744 HydrophobicContact CD2-CD1 4.08Å; L742-I744 HydrophobicContact CD2-CG1 4.38Å; L742-I744 HydrophobicContact CG-CD1 4.38Å; L742-I744 HydrophobicContact CG-CG1 4.12Å; L742-F779 HydrophobicContact CD1-CD2 3.63Å; L742-F779 HydrophobicContact CD1-CE2 3.6Å; L742-L804 HydrophobicContact CD2-CB 4.08Å; L742-L804 WeakPolarHBondContact CD2-O 3.3Å
743	M	90.9	Very high	83.5	Confident	2 Å²	2	62 Å²	62	1%	0.01	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	123.2	174.2	-175	177.2	173.3	0	0	109.2	V718 L730 V733 A778 F779	V718-M743 HydrophobicContact CG2-CE 4.08Å; V718-M743 HydrophobicContact CG2-CG 4.14Å; L730-M743 HydrophobicContact CD1-CE 3.3Å; L730-M743 HydrophobicContact CG-CE 3.99Å; V733-M743 HydrophobicContact CB-CE 3.88Å; V733-M743 HydrophobicContact CB-SD 4.37Å; V733-M743 HydrophobicContact CG1-CE 3.94Å; V733-M743 HydrophobicContact CG1-CG 4.13Å; V733-M743 HydrophobicContact CG1-SD 3.95Å; M743-A778 HydrophobicContact CB-CB 4Å; M743-A778 HydrophobicContact CE-CB 4.44Å; M743-A778 HydrophobicContact CG-CB 3.79Å; M743-A778 VanDerWaalsContact O-CA 3.29Å; M743-A778 WeakPolarHBondContact O-CA 3.24Å; M743-A778 HydrophobicContact SD-CB 3.97Å; M743-F779 PolarHBondContact O-N 2.87Å
744	I	92.8	Very high	82.6	Confident	5 Å²	5	71.2 Å²	71.2	3%	0.026	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	122.4	176.8	-57.8	178.7	0	0	0	108.3	C716 L717 V718 L742 F779 T781 A799 P806	C716-I744 PolarHBondContact O-N 3.12Å; L717-I744 CarbonylContact C-O 3.59Å; L717-I744 WeakPolarHBondContact CA-O 3.34Å; L717-I744 HydrophobicContact CD1-CB 4.06Å; L717-I744 HydrophobicContact CD1-CG2 3.82Å; V718-I744 PolarHBondContact N-O 2.97Å; L742-I744 HydrophobicContact CD1-CG1 4.31Å; L742-I744 HydrophobicContact CD2-CD1 4.08Å; L742-I744 HydrophobicContact CD2-CG1 4.38Å; L742-I744 HydrophobicContact CG-CD1 4.38Å; L742-I744 HydrophobicContact CG-CG1 4.12Å; I744-F779 CarbonylContact C-O 3.57Å; I744-F779 WeakPolarHBondContact CA-O 3.35Å; I744-T781 HydrophobicContact CG2-CG2 3.78Å; I744-T781 VanDerWaalsContact CG2-OG1 3.24Å; I744-T781 WeakPolarHBondContact CG2-OG1 3.44Å; I744-A799 HydrophobicContact CD1-CB 4.16Å; I744-P806 HydrophobicContact CD1-CG 4.38Å
745	C	92.4	Very high	81.9	Confident	0 Å²	0	71.4 Å²	71.4	0%	0	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.9	104.2	174.7	-66.9	0	0	0	0	109.2	T720 L730 F779 Y780 T781	T720-C745 HydrophobicContact CG2-CB 3.56Å; L730-C745 WeakPolarHBondContact CD1-SG 3.41Å; C745-F779 PolarHBondContact N-O 3.03Å; C745-Y780 HydrophobicContact CB-CD2 4.15Å; C745-T781 PolarHBondContact O-N 2.79Å; C745-T781 PolarHBondContact O-OG1 3.06Å
746	G	92.4	Very high	81.5	Confident	0 Å²	0	70.8 Å²	70.8	0%	0	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.7	131	176	0	0	0	0	0	111.8	V718 T720 G721	V718-G746 PolarHBondContact O-N 3.37Å; T720-G746 PolarHBondContact N-O 3.49Å; G721-G746 PolarHBondContact N-O 2.9Å
747	H	91.1	Very high	81.5	Confident	13 Å²	13	71.4 Å²	71.4	6%	0.06	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	123.2	170.1	179.2	-157.8	0	0	0	109.6	G721 Y722 Y780 T781 P782 V783	G721-H747 VanDerWaalsContact CA-CD2 3.49Å; G721-H747 WeakPolarHBondContact CA-CD2 3.24Å; G721-H747 WeakPolarHBondContact O-CB 3.37Å; Y722-H747 AromaticContact CD1-CE1 3.7Å; Y722-H747 AromaticContact CE1-CE1 3.37Å; Y722-H747 WeakPolarHBondContact CE1-CE1 3.5Å; Y722-H747 AromaticContact CE2-CE1 3.86Å; Y722-H747 AromaticContact CE2-NE2 3.93Å; Y722-H747 AromaticContact CZ-CE1 3.44Å; Y722-H747 VanDerWaalsContact CZ-CE1 3.44Å; Y722-H747 AromaticContact CZ-NE2 3.95Å; H747-Y780 HydrophobicContact CB-CE2 3.73Å; H747-Y780 AromaticContact ND1-CZ 3.96Å; H747-Y780 PolarHBondContact ND1-OH 3.21Å; H747-T781 PolarHBondContact N-O 3.39Å; H747-T781 VanDerWaalsContact N-O 3.17Å; H747-P782 HydrophobicContact CB-CB 4.49Å; H747-P782 CarbonylContact O-C 3.5Å; H747-P782 VanDerWaalsContact O-CA 3.31Å; H747-P782 WeakPolarHBondContact O-CA 3.37Å; H747-V783 PolarHBondContact O-N 3.42Å
748	V	90.6	Very high	81.6	Confident	13 Å²	13	79.3 Å²	79.3	8%	0.079	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103	114.6	172.4	-179	0	0	0	0	108.4	M719 V783 A785 L788 L795	M719-V748 HydrophobicContact CE-CG2 3.81Å; V748-V783 CarbonylContact C-O 3.59Å; V748-V783 WeakPolarHBondContact CA-O 3.22Å; V748-A785 HydrophobicContact CG1-CB 4.09Å; V748-L788 HydrophobicContact CB-CD1 3.83Å; V748-L788 HydrophobicContact CG1-CD1 4.31Å; V748-L788 HydrophobicContact CG2-CD1 4.11Å; V748-L795 HydrophobicContact CG2-CD1 3.98Å
749	R	86.3	Confident	81.8	Confident	77 Å²	77	75.1 Å²	75.1	29%	0.291	35%	0.353	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.1	116.2	173.9	-165.4	173.8	-175	161.4	0.1	108.2	D763 V783 F784 A785	R749-D763 IonicContact NH1-OD2 3.33Å; R749-D763 PolarHBondContact NH1-OD2 2.74Å; R749-V783 PolarHBondContact N-O 3.04Å; R749-F784 HydrophobicContact CB-CD2 4.48Å; R749-A785 PolarHBondContact O-N 2.95Å
750	M	84.6	Confident	82.3	Confident	120 Å²	120	72.9 Å²	72.9	59%	0.591	34%	0.341	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-83.6	134.1	178.5	-60.4	-177.6	-70.8	0	0	109.9	A785 L788	M750-A785 WeakPolarHBondContact CA-O 3.42Å; M750-L788 HydrophobicContact SD-CB 4.24Å
751	G	76.1	Confident	82.5	Confident	19 Å²	19	71.2 Å²	71.2	20%	0.196	34%	0.337	C	S	.	.			trans	-171.2	139.2	176.7	0	0	0	0	0	113.7	F784	G751-F784 VanDerWaalsContact O-CZ 3.24Å; G751-F784 WeakPolarHBondContact O-CZ 3.37Å
752	Y	64.4	Low	82.7	Confident	186 Å²	186	73 Å²	73	73%	0.729	35%	0.35	S	S	*	.	S	Bend	trans	-96.8	-11.1	-171.6	-72.1	-82.5	0	0	0	115.1
753	R	62.3	Low	82.6	Confident	234 Å²	234	73.2 Å²	73.2	88%	0.883	35%	0.351	S	S	*	.	S	Bend	trans	-147.7	135.3	-179.1	-102.9	178.9	176.1	150.2	-0.6	112.8
754	K	69.7	Low	82.5	Confident	199 Å²	199	77.5 Å²	77.5	87%	0.865	37%	0.371	S	S	*	.			trans	37.1	90.7	177.4	-71.5	-169.7	178	-176.8	0	114.1	N756	K754-N756 PolarHBondContact O-N 3.27Å
755	P	71.6	Confident	82.2	Confident	45 Å²	45	79.9 Å²	79.9	29%	0.292	39%	0.389	S	S	.	.			trans	-57.1	125.2	175.3	20.8	-32.1	0	0	0	111.6	F757 F784	P755-F757 VanDerWaalsContact C-N 3.33Å; P755-F757 HydrophobicContact CB-CD1 4.46Å; P755-F757 HydrophobicContact CB-CD2 4.31Å; P755-F757 HydrophobicContact CB-CE1 4.07Å; P755-F757 HydrophobicContact CB-CE2 3.94Å; P755-F757 HydrophobicContact CB-CZ 3.8Å; P755-F757 HydrophobicContact CG-CD2 4.15Å; P755-F757 HydrophobicContact CG-CE1 4.18Å; P755-F757 HydrophobicContact CG-CE2 3.4Å; P755-F757 HydrophobicContact CG-CZ 3.4Å; P755-F757 VanDerWaalsContact CG-CZ 3.4Å; P755-F757 PolarHBondContact O-N 3Å; P755-F784 HydrophobicContact CB-CD1 3.71Å; P755-F784 HydrophobicContact CB-CD2 3.86Å; P755-F784 HydrophobicContact CB-CE1 3.71Å; P755-F784 HydrophobicContact CB-CE2 3.85Å; P755-F784 HydrophobicContact CB-CG 3.77Å; P755-F784 HydrophobicContact CB-CZ 3.77Å; P755-F784 HydrophobicContact CG-CD1 4.23Å; P755-F784 HydrophobicContact CG-CE1 4.12Å; P755-F784 HydrophobicContact CG-CZ 4.5Å
756	N	78.3	Confident	82	Confident	79 Å²	79	86.6 Å²	86.6	42%	0.422	41%	0.414	S	S	.	.			trans	-80.2	84.1	170.6	-166	-7.2	0	0	0	110	K754 K758 D759 L760	K754-N756 PolarHBondContact O-N 3.27Å; N756-K758 PolarHBondContact O-N 3.21Å; N756-K758 WeakPolarHBondContact OD1-CB 3.14Å; N756-K758 PolarHBondContact OD1-N 3.17Å; N756-D759 HydrophobicContact CB-CB 4.24Å; N756-D759 VanDerWaalsContact CG-CG 3.47Å; N756-D759 PolarHBondContact ND2-OD1 3.15Å; N756-D759 VanDerWaalsContact ND2-OD1 3.07Å; N756-D759 PolarHBondContact ND2-OD2 2.68Å; N756-D759 PolarHBondContact O-N 3.47Å; N756-D759 PolarHBondContact OD1-N 3.17Å; N756-L760 PolarHBondContact O-N 2.74Å
757	F	82.1	Confident	81.8	Confident	138 Å²	138	87.3 Å²	87.3	61%	0.605	42%	0.416	S	S	*	.	H	α-helix	trans	-63.5	-26.6	178.5	-65.9	-68.7	0	0	0	113.1	P755 L760 A761	P755-F757 VanDerWaalsContact C-N 3.33Å; P755-F757 HydrophobicContact CB-CD1 4.46Å; P755-F757 HydrophobicContact CB-CD2 4.31Å; P755-F757 HydrophobicContact CB-CE1 4.07Å; P755-F757 HydrophobicContact CB-CE2 3.94Å; P755-F757 HydrophobicContact CB-CZ 3.8Å; P755-F757 HydrophobicContact CG-CD2 4.15Å; P755-F757 HydrophobicContact CG-CE1 4.18Å; P755-F757 HydrophobicContact CG-CE2 3.4Å; P755-F757 HydrophobicContact CG-CZ 3.4Å; P755-F757 VanDerWaalsContact CG-CZ 3.4Å; P755-F757 PolarHBondContact O-N 3Å; F757-L760 PolarHBondContact O-N 2.98Å; F757-A761 PolarHBondContact O-N 3.39Å; F757-A761 VanDerWaalsContact O-N 3.09Å
758	K	84.2	Confident	81.8	Confident	173 Å²	173	89 Å²	89	75%	0.752	42%	0.424	S	S	*	.	H	α-helix	trans	-67.1	-45.3	177.9	-175	176.9	179.5	-179.3	0	111	N756 L760 A761 A762	N756-K758 PolarHBondContact O-N 3.21Å; N756-K758 WeakPolarHBondContact OD1-CB 3.14Å; N756-K758 PolarHBondContact OD1-N 3.17Å; K758-L760 VanDerWaalsContact C-N 3.33Å; K758-A761 PolarHBondContact O-N 3.39Å; K758-A762 PolarHBondContact O-N 3.11Å; K758-A762 VanDerWaalsContact O-N 3.09Å
759	D	83.1	Confident	81.7	Confident	70 Å²	70	95.8 Å²	95.8	37%	0.374	45%	0.449	S	S	.	.	H	α-helix	trans	-65.8	-38.6	175.5	-70.9	3.1	0	0	0	111.3	N756 A761 A762 D763	N756-D759 HydrophobicContact CB-CB 4.24Å; N756-D759 VanDerWaalsContact CG-CG 3.47Å; N756-D759 PolarHBondContact ND2-OD1 3.15Å; N756-D759 VanDerWaalsContact ND2-OD1 3.07Å; N756-D759 PolarHBondContact ND2-OD2 2.68Å; N756-D759 PolarHBondContact O-N 3.47Å; N756-D759 PolarHBondContact OD1-N 3.17Å; D759-A761 VanDerWaalsContact C-N 3.35Å; D759-A761 PolarHBondContact O-N 3.19Å; D759-A762 PolarHBondContact O-N 3.22Å; D759-D763 VanDerWaalsContact O-CB 3.31Å; D759-D763 WeakPolarHBondContact O-CB 3.43Å; D759-D763 VanDerWaalsContact O-CG 3.31Å; D759-D763 PolarHBondContact O-N 3.4Å
760	L	84.6	Confident	81.8	Confident	24 Å²	24	95.2 Å²	95.2	13%	0.126	45%	0.447	C	S	.	.	H	α-helix	trans	-60.4	-43.3	178.4	-162.3	69.4	0	0	0	112.2	N756 F757 K758 Q764 P782	N756-L760 PolarHBondContact O-N 2.74Å; F757-L760 PolarHBondContact O-N 2.98Å; K758-L760 VanDerWaalsContact C-N 3.33Å; L760-Q764 WeakPolarHBondContact O-CB 3.44Å; L760-Q764 PolarHBondContact O-N 2.95Å; L760-P782 HydrophobicContact CD1-CB 3.7Å; L760-P782 HydrophobicContact CD1-CG 4.12Å; L760-P782 HydrophobicContact CG-CB 4.16Å; L760-P782 HydrophobicContact CG-CG 4.05Å
761	A	85.1	Confident	82	Confident	58 Å²	58	89.5 Å²	89.5	48%	0.479	42%	0.418	S	S	.	.	H	α-helix	trans	-67.5	-40.3	176.3	0	0	0	0	0	112.1	F757 K758 D759 Q764 S765	F757-A761 PolarHBondContact O-N 3.39Å; F757-A761 VanDerWaalsContact O-N 3.09Å; K758-A761 PolarHBondContact O-N 3.39Å; D759-A761 VanDerWaalsContact C-N 3.35Å; D759-A761 PolarHBondContact O-N 3.19Å; A761-Q764 PolarHBondContact O-N 2.9Å; A761-S765 PolarHBondContact O-N 2.79Å
762	A	86.6	Confident	82.5	Confident	53 Å²	53	94.6 Å²	94.6	44%	0.438	44%	0.439	S	S	.	.	H	α-helix	trans	-62.5	-47.3	175.5	0	0	0	0	0	111.3	K758 D759 Q764 S765 R766	K758-A762 PolarHBondContact O-N 3.11Å; K758-A762 VanDerWaalsContact O-N 3.09Å; D759-A762 PolarHBondContact O-N 3.22Å; A762-Q764 VanDerWaalsContact C-N 3.35Å; A762-Q764 PolarHBondContact O-N 3.41Å; A762-S765 PolarHBondContact O-N 2.82Å; A762-S765 PolarHBondContact O-OG 2.8Å; A762-R766 PolarHBondContact O-N 2.94Å
763	D	85.1	Confident	83.6	Confident	30 Å²	30	95.1 Å²	95.1	16%	0.16	44%	0.439	C	S	.	.	H	α-helix	trans	-60.4	-42.4	176	-77.6	-24.8	0	0	0	111.4	R749 D759 S765 R766 Y767	R749-D763 IonicContact NH1-OD2 3.33Å; R749-D763 PolarHBondContact NH1-OD2 2.74Å; D759-D763 VanDerWaalsContact O-CB 3.31Å; D759-D763 WeakPolarHBondContact O-CB 3.43Å; D759-D763 VanDerWaalsContact O-CG 3.31Å; D759-D763 PolarHBondContact O-N 3.4Å; D763-S765 VanDerWaalsContact C-N 3.32Å; D763-S765 PolarHBondContact O-N 3.06Å; D763-R766 PolarHBondContact O-N 2.77Å; D763-R766 VanDerWaalsContact O-N 3.12Å; D763-Y767 HydrophobicContact CB-CD2 4.08Å; D763-Y767 HydrophobicContact CB-CE2 3.99Å; D763-Y767 WeakPolarHBondContact O-CD2 3.47Å; D763-Y767 PolarHBondContact O-N 2.81Å
764	Q	88.4	Confident	84.6	Confident	92 Å²	92	87.8 Å²	87.8	43%	0.43	42%	0.418	S	S	.	.	H	α-helix	trans	-55.8	-48.3	176.7	-172.8	-180	-12.9	0	0	111.5	L760 A761 A762 R766 Q768 Y780 P782	L760-Q764 WeakPolarHBondContact O-CB 3.44Å; L760-Q764 PolarHBondContact O-N 2.95Å; A761-Q764 PolarHBondContact O-N 2.9Å; A762-Q764 VanDerWaalsContact C-N 3.35Å; A762-Q764 PolarHBondContact O-N 3.41Å; Q764-R766 VanDerWaalsContact C-N 3.33Å; Q764-R766 PolarHBondContact O-N 2.82Å; Q764-Q768 VanDerWaalsContact O-CB 3.22Å; Q764-Q768 WeakPolarHBondContact O-CB 3.36Å; Q764-Q768 PolarHBondContact O-N 2.84Å; Q764-Y780 HydrophobicContact CB-CD1 4.34Å; Q764-Y780 HydrophobicContact CB-CE1 4.46Å; Q764-Y780 HydrophobicContact CG-CD1 4.11Å; Q764-P782 HydrophobicContact CB-CG 4.01Å; Q764-P782 HydrophobicContact CG-CG 4.23Å
765	S	86.4	Confident	85.3	Confident	55 Å²	55	86 Å²	86	39%	0.385	41%	0.412	S	S	.	.	H	α-helix	trans	-65.7	-35.6	177.9	81.2	0	0	0	0	112.7	A761 A762 D763 R769	A761-S765 PolarHBondContact O-N 2.79Å; A762-S765 PolarHBondContact O-N 2.82Å; A762-S765 PolarHBondContact O-OG 2.8Å; D763-S765 VanDerWaalsContact C-N 3.32Å; D763-S765 PolarHBondContact O-N 3.06Å; S765-R769 WeakPolarHBondContact O-CB 3.23Å; S765-R769 WeakPolarHBondContact O-CG 3.34Å; S765-R769 PolarHBondContact O-N 2.93Å; S765-R769 VanDerWaalsContact O-N 3.17Å; S765-R769 PolarHBondContact O-NE 3.13Å; S765-R769 PolarHBondContact OG-NH2 2.9Å
766	R	88.6	Confident	85.9	Confident	140 Å²	140	84.1 Å²	84.1	53%	0.528	40%	0.4	S	S	.	.	H	α-helix	trans	-69.3	-50.3	-178.7	-178.1	-176	177.1	-147.1	0.6	111	A762 D763 Q764 R769 W770	A762-R766 PolarHBondContact O-N 2.94Å; D763-R766 PolarHBondContact O-N 2.77Å; D763-R766 VanDerWaalsContact O-N 3.12Å; Q764-R766 VanDerWaalsContact C-N 3.33Å; Q764-R766 PolarHBondContact O-N 2.82Å; R766-R769 PolarHBondContact O-N 2.99Å; R766-W770 PolarHBondContact O-N 3.47Å
767	Y	89.1	Confident	86.2	Confident	15 Å²	15	86.9 Å²	86.9	6%	0.059	41%	0.408	C	S	.	.	H	α-helix	trans	-72.8	-32.2	-179.4	-68.6	-62.7	0	0	0	112.4	Y722 P723 D763 R769 W770 L771 Y780	Y722-Y767 HydrophobicContact CD1-CE1 4.34Å; Y722-Y767 AromaticContact CD1-CE2 3.7Å; Y722-Y767 HydrophobicContact CD1-CE2 3.7Å; Y722-Y767 AromaticContact CD1-CZ 3.52Å; Y722-Y767 VanDerWaalsContact CD1-OH 3.24Å; Y722-Y767 WeakPolarHBondContact CD1-OH 3.37Å; Y722-Y767 HydrophobicContact CE1-CE2 4.02Å; P723-Y767 HydrophobicContact CG-CD1 4.4Å; P723-Y767 HydrophobicContact CG-CG 4.46Å; D763-Y767 HydrophobicContact CB-CD2 4.08Å; D763-Y767 HydrophobicContact CB-CE2 3.99Å; D763-Y767 WeakPolarHBondContact O-CD2 3.47Å; D763-Y767 PolarHBondContact O-N 2.81Å; Y767-R769 VanDerWaalsContact C-N 3.32Å; Y767-R769 PolarHBondContact O-N 3.17Å; Y767-W770 PolarHBondContact O-N 3.48Å; Y767-L771 WeakPolarHBondContact O-CG 3Å; Y767-L771 PolarHBondContact O-N 3.34Å; Y767-Y780 AromaticContact CD2-CE1 3.95Å; Y767-Y780 HydrophobicContact CD2-CE1 3.95Å; Y767-Y780 AromaticContact CD2-CZ 3.89Å; Y767-Y780 HydrophobicContact CG-CE1 4.37Å
768	Q	90	Very high	86.5	Confident	48 Å²	48	80.5 Å²	80.5	22%	0.224	38%	0.381	C	S	.	.	H	α-helix	trans	-61.8	-41.5	170.4	-170.3	64.9	42.7	0	0	111.4	Q764 L771 M772 A778	Q764-Q768 VanDerWaalsContact O-CB 3.22Å; Q764-Q768 WeakPolarHBondContact O-CB 3.36Å; Q764-Q768 PolarHBondContact O-N 2.84Å; Q768-L771 PolarHBondContact O-N 3.43Å; Q768-M772 VanDerWaalsContact O-CG 3.24Å; Q768-M772 WeakPolarHBondContact O-CG 3.18Å; Q768-M772 PolarHBondContact O-N 3.38Å; Q768-M772 VanDerWaalsContact O-N 3.08Å; Q768-A778 PolarHBondContact NE2-O 3.21Å
769	R	88.6	Confident	86.8	Confident	157 Å²	157	78.2 Å²	78.2	59%	0.592	37%	0.371	S	S	*	.	H	α-helix	trans	-64.2	-39.5	173.8	-79.7	177.4	-79.1	140.9	-9.7	112.4	S765 R766 Y767 M772 R773	S765-R769 WeakPolarHBondContact O-CB 3.23Å; S765-R769 WeakPolarHBondContact O-CG 3.34Å; S765-R769 PolarHBondContact O-N 2.93Å; S765-R769 VanDerWaalsContact O-N 3.17Å; S765-R769 PolarHBondContact O-NE 3.13Å; S765-R769 PolarHBondContact OG-NH2 2.9Å; R766-R769 PolarHBondContact O-N 2.99Å; Y767-R769 VanDerWaalsContact C-N 3.32Å; Y767-R769 PolarHBondContact O-N 3.17Å; R769-M772 PolarHBondContact O-N 3.47Å; R769-R773 WeakPolarHBondContact O-CB 3.4Å; R769-R773 PolarHBondContact O-N 2.95Å
770	W	89.6	Confident	87.3	Confident	65 Å²	65	75.1 Å²	75.1	25%	0.246	35%	0.354	C	S	.	.	H	α-helix	trans	-62.6	-45.6	175.8	-176.7	90.8	0	0	0	112	P723 N724 L730 R766 Y767 M772 R773 N774	P723-W770 HydrophobicContact CB-CE3 3.93Å; P723-W770 HydrophobicContact CB-CZ3 3.66Å; N724-W770 HydrophobicContact CB-CZ2 4.36Å; N724-W770 VanDerWaalsContact OD1-CE2 3.28Å; L730-W770 HydrophobicContact CD2-CH2 4.28Å; L730-W770 HydrophobicContact CD2-CZ3 3.88Å; R766-W770 PolarHBondContact O-N 3.47Å; Y767-W770 PolarHBondContact O-N 3.48Å; W770-M772 VanDerWaalsContact C-N 3.31Å; W770-M772 PolarHBondContact O-N 2.68Å; W770-R773 PolarHBondContact O-N 2.84Å; W770-R773 VanDerWaalsContact O-N 3.17Å; W770-N774 WeakPolarHBondContact CH2-ND2 3.36Å; W770-N774 WeakPolarHBondContact CZ2-ND2 3.49Å; W770-N774 PolarHBondContact O-N 3.4Å
771	L	88.4	Confident	87.6	Confident	0 Å²	0	75.8 Å²	75.8	0%	0	36%	0.36	C	S	.	.	H	α-helix	trans	-59.1	-42.1	175.6	-74.7	158.2	0	0	0	112	P723 L730 Y767 Q768 N774 E775 T776 A778	P723-L771 HydrophobicContact CB-CD2 4.37Å; L730-L771 HydrophobicContact CD1-CD2 4.05Å; L730-L771 HydrophobicContact CD2-CD2 3.92Å; Y767-L771 WeakPolarHBondContact O-CG 3Å; Y767-L771 PolarHBondContact O-N 3.34Å; Q768-L771 PolarHBondContact O-N 3.43Å; L771-N774 PolarHBondContact O-N 3.48Å; L771-E775 PolarHBondContact O-N 2.91Å; L771-T776 WeakPolarHBondContact CA-OG1 3.48Å; L771-T776 WeakPolarHBondContact CD2-OG1 2.97Å; L771-T776 PolarHBondContact O-N 3.45Å; L771-T776 PolarHBondContact O-OG1 3.24Å; L771-A778 HydrophobicContact CD2-CB 4.39Å
772	M	85.6	Confident	87.9	Confident	126 Å²	126	73.9 Å²	73.9	62%	0.621	34%	0.342	S	S	*	.	H	α-helix	trans	-67.4	-36.8	176.8	-67.7	-66.9	-71.7	0	0	112.4	Q768 R769 W770 N774 E775	Q768-M772 VanDerWaalsContact O-CG 3.24Å; Q768-M772 WeakPolarHBondContact O-CG 3.18Å; Q768-M772 PolarHBondContact O-N 3.38Å; Q768-M772 VanDerWaalsContact O-N 3.08Å; R769-M772 PolarHBondContact O-N 3.47Å; W770-M772 VanDerWaalsContact C-N 3.31Å; W770-M772 PolarHBondContact O-N 2.68Å; M772-N774 VanDerWaalsContact C-N 3.31Å; M772-N774 PolarHBondContact O-N 3.12Å; M772-E775 PolarHBondContact O-N 2.81Å
773	R	87.4	Confident	88.1	Confident	196 Å²	196	72.7 Å²	72.7	74%	0.74	33%	0.33	S	S	*	.	H	α-helix	trans	-67	-32.5	176.5	-174.7	170.3	-179.3	158.6	-4.1	112.4	R769 W770 E775	R769-R773 WeakPolarHBondContact O-CB 3.4Å; R769-R773 PolarHBondContact O-N 2.95Å; W770-R773 PolarHBondContact O-N 2.84Å; W770-R773 VanDerWaalsContact O-N 3.17Å; R773-E775 VanDerWaalsContact C-N 3.28Å; R773-E775 PolarHBondContact O-N 3.42Å
774	N	85.1	Confident	88.2	Confident	80 Å²	80	73.9 Å²	73.9	43%	0.428	33%	0.334	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88	10.3	176.8	-71.3	11.1	0	0	0	113.3	W770 L771 M772 T776	W770-N774 WeakPolarHBondContact CH2-ND2 3.36Å; W770-N774 WeakPolarHBondContact CZ2-ND2 3.49Å; W770-N774 PolarHBondContact O-N 3.4Å; L771-N774 PolarHBondContact O-N 3.48Å; M772-N774 VanDerWaalsContact C-N 3.31Å; M772-N774 PolarHBondContact O-N 3.12Å; N774-T776 PolarHBondContact O-N 3.09Å; N774-T776 VanDerWaalsContact O-N 3.08Å
775	E	83.7	Confident	88.3	Confident	162 Å²	162	69.7 Å²	69.7	76%	0.757	32%	0.315	S	S	*	.	T	Hydrogen-bonded Turn	trans	59	17.5	-179	-55.5	-169.7	151.4	0	0	115.2	L771 M772 R773 K777	L771-E775 PolarHBondContact O-N 2.91Å; M772-E775 PolarHBondContact O-N 2.81Å; R773-E775 VanDerWaalsContact C-N 3.28Å; R773-E775 PolarHBondContact O-N 3.42Å; E775-K777 PolarHBondContact O-N 3.09Å
776	T	82.9	Confident	88.2	Confident	5 Å²	5	72.4 Å²	72.4	3%	0.031	32%	0.321	C	S	.	.			trans	-83.6	110.3	175.8	55.2	0	0	0	0	110.5	L730 L771 N774 A778	L730-T776 HydrophobicContact CD2-CG2 4.05Å; L730-T776 HydrophobicContact CG-CG2 4.49Å; L771-T776 WeakPolarHBondContact CA-OG1 3.48Å; L771-T776 WeakPolarHBondContact CD2-OG1 2.97Å; L771-T776 PolarHBondContact O-N 3.45Å; L771-T776 PolarHBondContact O-OG1 3.24Å; N774-T776 PolarHBondContact O-N 3.09Å; N774-T776 VanDerWaalsContact O-N 3.08Å; T776-A778 VanDerWaalsContact C-N 3.26Å; T776-A778 PolarHBondContact O-N 3.2Å
777	K	84.6	Confident	88.2	Confident	138 Å²	138	69.3 Å²	69.3	60%	0.6	32%	0.315	S	S	*	.			trans	-76.6	73.8	177.2	-62.5	-169.9	-170.5	179.9	0	111.6	N739 E775	N739-K777 HydrophobicContact CB-CD 3.9Å; N739-K777 WeakPolarHBondContact OD1-CB 3.32Å; N739-K777 WeakPolarHBondContact OD1-CD 3.38Å; N739-K777 WeakPolarHBondContact OD1-CG 3.47Å; E775-K777 PolarHBondContact O-N 3.09Å
778	A	89.1	Confident	88.1	Confident	4 Å²	4	71.4 Å²	71.4	3%	0.033	33%	0.327	C	S	.	.			trans	-131.3	152	177.4	0	0	0	0	0	112.1	M743 Q768 L771 T776	M743-A778 HydrophobicContact CB-CB 4Å; M743-A778 HydrophobicContact CE-CB 4.44Å; M743-A778 HydrophobicContact CG-CB 3.79Å; M743-A778 VanDerWaalsContact O-CA 3.29Å; M743-A778 WeakPolarHBondContact O-CA 3.24Å; M743-A778 HydrophobicContact SD-CB 3.97Å; Q768-A778 PolarHBondContact NE2-O 3.21Å; L771-A778 HydrophobicContact CD2-CB 4.39Å; T776-A778 VanDerWaalsContact C-N 3.26Å; T776-A778 PolarHBondContact O-N 3.2Å
779	F	91.4	Very high	88.2	Confident	125 Å²	125	73.3 Å²	73.3	55%	0.548	33%	0.332	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.4	132.6	171.7	-63.2	-75.2	0	0	0	110	L742 M743 I744 C745	L742-F779 HydrophobicContact CD1-CD2 3.63Å; L742-F779 HydrophobicContact CD1-CE2 3.6Å; M743-F779 PolarHBondContact O-N 2.87Å; I744-F779 CarbonylContact C-O 3.57Å; I744-F779 WeakPolarHBondContact CA-O 3.35Å; C745-F779 PolarHBondContact N-O 3.03Å
780	Y	92.4	Very high	88.3	Confident	4 Å²	4	69 Å²	69	2%	0.016	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.1	123.4	175.9	179.1	-108.4	0	0	0	111.4	P723 C745 H747 Q764 Y767 P782	P723-Y780 HydrophobicContact CG-CD2 3.76Å; P723-Y780 HydrophobicContact CG-CE2 3.81Å; C745-Y780 HydrophobicContact CB-CD2 4.15Å; H747-Y780 HydrophobicContact CB-CE2 3.73Å; H747-Y780 AromaticContact ND1-CZ 3.96Å; H747-Y780 PolarHBondContact ND1-OH 3.21Å; Q764-Y780 HydrophobicContact CB-CD1 4.34Å; Q764-Y780 HydrophobicContact CB-CE1 4.46Å; Q764-Y780 HydrophobicContact CG-CD1 4.11Å; Y767-Y780 AromaticContact CD2-CE1 3.95Å; Y767-Y780 HydrophobicContact CD2-CE1 3.95Å; Y767-Y780 AromaticContact CD2-CZ 3.89Å; Y767-Y780 HydrophobicContact CG-CE1 4.37Å; Y780-P782 HydrophobicContact CD1-CG 4.24Å; Y780-P782 HydrophobicContact CE1-CB 3.83Å; Y780-P782 HydrophobicContact CE1-CG 3.72Å
781	T	91.9	Very high	88.3	Confident	39 Å²	39	65.9 Å²	65.9	24%	0.239	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	97.7	-179.3	54.5	0	0	0	0	110.2	I744 C745 H747	I744-T781 HydrophobicContact CG2-CG2 3.78Å; I744-T781 VanDerWaalsContact CG2-OG1 3.24Å; I744-T781 WeakPolarHBondContact CG2-OG1 3.44Å; C745-T781 PolarHBondContact O-N 2.79Å; C745-T781 PolarHBondContact O-OG1 3.06Å; H747-T781 PolarHBondContact N-O 3.39Å; H747-T781 VanDerWaalsContact N-O 3.17Å
782	P	90.8	Very high	88.4	Confident	17 Å²	17	66 Å²	66	11%	0.11	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.7	138.8	174.3	35.4	-33.5	0	0	0	111.1	H747 L760 Q764 Y780	H747-P782 HydrophobicContact CB-CB 4.49Å; H747-P782 CarbonylContact O-C 3.5Å; H747-P782 VanDerWaalsContact O-CA 3.31Å; H747-P782 WeakPolarHBondContact O-CA 3.37Å; L760-P782 HydrophobicContact CD1-CB 3.7Å; L760-P782 HydrophobicContact CD1-CG 4.12Å; L760-P782 HydrophobicContact CG-CB 4.16Å; L760-P782 HydrophobicContact CG-CG 4.05Å; Q764-P782 HydrophobicContact CB-CG 4.01Å; Q764-P782 HydrophobicContact CG-CG 4.23Å; Y780-P782 HydrophobicContact CD1-CG 4.24Å; Y780-P782 HydrophobicContact CE1-CB 3.83Å; Y780-P782 HydrophobicContact CE1-CG 3.72Å
783	V	89.9	Confident	88.7	Confident	29 Å²	29	62.4 Å²	62.4	18%	0.176	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	142.4	179.2	172.4	0	0	0	0	109.1	H747 V748 R749 Y794 L795	H747-V783 PolarHBondContact O-N 3.42Å; V748-V783 CarbonylContact C-O 3.59Å; V748-V783 WeakPolarHBondContact CA-O 3.22Å; R749-V783 PolarHBondContact N-O 3.04Å; V783-Y794 HydrophobicContact CG1-CD2 3.74Å; V783-Y794 HydrophobicContact CG1-CG 4.45Å; V783-L795 HydrophobicContact CB-CD2 4.5Å; V783-L795 HydrophobicContact CB-CG 4.41Å; V783-L795 HydrophobicContact CG2-CD1 4.47Å; V783-L795 HydrophobicContact CG2-CD2 3.47Å; V783-L795 VanDerWaalsContact CG2-CD2 3.47Å; V783-L795 HydrophobicContact CG2-CG 3.78Å
784	F	88.9	Confident	89	Confident	55 Å²	55	58 Å²	58	24%	0.241	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100	128	172.6	-171.4	-89.7	0	0	0	109.4	R749 G751 P755	R749-F784 HydrophobicContact CB-CD2 4.48Å; G751-F784 VanDerWaalsContact O-CZ 3.24Å; G751-F784 WeakPolarHBondContact O-CZ 3.37Å; P755-F784 HydrophobicContact CB-CD1 3.71Å; P755-F784 HydrophobicContact CB-CD2 3.86Å; P755-F784 HydrophobicContact CB-CE1 3.71Å; P755-F784 HydrophobicContact CB-CE2 3.85Å; P755-F784 HydrophobicContact CB-CG 3.77Å; P755-F784 HydrophobicContact CB-CZ 3.77Å; P755-F784 HydrophobicContact CG-CD1 4.23Å; P755-F784 HydrophobicContact CG-CE1 4.12Å; P755-F784 HydrophobicContact CG-CZ 4.5Å
785	A	88.9	Confident	89.3	Confident	4 Å²	4	54.5 Å²	54.5	3%	0.033	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.5	159.3	174.9	0	0	0	0	0	109.8	V748 R749 M750 D787 Q790 G791 Y794	V748-A785 HydrophobicContact CG1-CB 4.09Å; R749-A785 PolarHBondContact O-N 2.95Å; M750-A785 WeakPolarHBondContact CA-O 3.42Å; A785-D787 WeakPolarHBondContact CB-O 3.49Å; A785-Q790 HydrophobicContact CB-CB 4.43Å; A785-G791 VanDerWaalsContact CB-N 3.33Å; A785-Y794 HydrophobicContact CB-CE2 4.4Å
786	E	86.2	Confident	89.7	Confident	111 Å²	111	46.9 Å²	46.9	52%	0.519	22%	0.219	S	C	.	.	S	Bend	trans	-70.5	-43.7	176.5	-63.6	-179.3	177.7	0	0	110.1
787	D	87.1	Confident	90	Very high	75 Å²	75	52.1 Å²	52.1	40%	0.401	24%	0.243	S	C	.	.	S	Bend	trans	-115.4	149.8	178.3	-64.3	-37.7	0	0	0	112.6	A785 R789 Q790 G791	A785-D787 WeakPolarHBondContact CB-O 3.49Å; D787-R789 PolarHBondContact O-N 3.47Å; D787-Q790 PolarHBondContact O-N 3.39Å; D787-G791 PolarHBondContact O-N 2.94Å
788	L	88.1	Confident	90.2	Very high	60 Å²	60	49.4 Å²	49.4	31%	0.314	25%	0.247	S	C	.	.	H	α-helix	trans	-57	-38.2	173.7	-179.1	61.4	0	0	0	112	M719 V748 M750 S792	M719-L788 HydrophobicContact CE-CD1 4.31Å; V748-L788 HydrophobicContact CB-CD1 3.83Å; V748-L788 HydrophobicContact CG1-CD1 4.31Å; V748-L788 HydrophobicContact CG2-CD1 4.11Å; M750-L788 HydrophobicContact SD-CB 4.24Å; L788-S792 VanDerWaalsContact O-CB 3.31Å; L788-S792 WeakPolarHBondContact O-CB 3.29Å; L788-S792 PolarHBondContact O-N 3.05Å; L788-S792 PolarHBondContact O-OG 3.3Å
789	R	90.8	Very high	90.3	Very high	87 Å²	87	49.7 Å²	49.7	33%	0.328	25%	0.249	S	C	.	.	H	α-helix	trans	-61.4	-55	178.2	-175.8	-173.4	177.7	-168.2	1.5	111.1	D787 G791 S792 Q793 T827 D834	D787-R789 PolarHBondContact O-N 3.47Å; R789-G791 VanDerWaalsContact C-N 3.33Å; R789-G791 PolarHBondContact O-N 3.43Å; R789-S792 PolarHBondContact O-N 3Å; R789-S792 VanDerWaalsContact O-N 3.12Å; R789-S792 PolarHBondContact O-OG 3.07Å; R789-Q793 WeakPolarHBondContact O-CG 3.49Å; R789-Q793 PolarHBondContact O-N 2.98Å; R789-T827 HydrophobicContact CB-CG2 4.46Å; R789-D834 VanDerWaalsContact CG-OD2 3.31Å; R789-D834 WeakPolarHBondContact CG-OD2 3.45Å; R789-D834 IonicContact CZ-OD1 3.66Å; R789-D834 IonicContact CZ-OD2 3.67Å; R789-D834 IonicContact NE-OD1 3.57Å; R789-D834 IonicContact NE-OD2 2.84Å; R789-D834 PolarHBondContact NE-OD2 2.91Å; R789-D834 IonicContact NH2-OD1 2.86Å; R789-D834 PolarHBondContact NH2-OD1 3.12Å; R789-D834 IonicContact NH2-OD2 3.6Å
790	Q	90.3	Very high	90.1	Very high	67 Å²	67	45.7 Å²	45.7	31%	0.313	24%	0.243	S	C	.	.	H	α-helix	trans	-60.9	-42.9	-179.1	-171.6	-174.3	37.5	0	0	111.6	A785 D787 S792 Q793 Y794	A785-Q790 HydrophobicContact CB-CB 4.43Å; D787-Q790 PolarHBondContact O-N 3.39Å; Q790-S792 VanDerWaalsContact C-N 3.31Å; Q790-S792 PolarHBondContact O-N 3.46Å; Q790-Q793 WeakPolarHBondContact O-CB 3.44Å; Q790-Q793 PolarHBondContact O-N 3.42Å; Q790-Y794 HydrophobicContact CG-CE1 4.22Å; Q790-Y794 HydrophobicContact CG-CE2 4.03Å; Q790-Y794 PolarHBondContact NE2-OH 3.22Å; Q790-Y794 VanDerWaalsContact NE2-OH 3.07Å; Q790-Y794 PolarHBondContact O-N 3.22Å; Q790-Y794 VanDerWaalsContact O-N 3.13Å
791	G	90.8	Very high	89.8	Confident	0 Å²	0	50.6 Å²	50.6	0%	0	27%	0.269	C	S	.	.	H	α-helix	trans	-63.7	-36.4	175.8	0	0	0	0	0	113.1	A785 D787 R789 Y794 L795	A785-G791 VanDerWaalsContact CB-N 3.33Å; D787-G791 PolarHBondContact O-N 2.94Å; R789-G791 VanDerWaalsContact C-N 3.33Å; R789-G791 PolarHBondContact O-N 3.43Å; G791-Y794 PolarHBondContact O-N 3.22Å; G791-L795 PolarHBondContact O-N 3.25Å
792	S	90.5	Very high	89.4	Confident	1 Å²	1	50.5 Å²	50.5	1%	0.007	28%	0.275	C	S	.	.	H	α-helix	trans	-67.2	-36.2	174.3	74.8	0	0	0	0	112.3	L788 R789 Q790 Y794 L795 L796 M831	L788-S792 VanDerWaalsContact O-CB 3.31Å; L788-S792 WeakPolarHBondContact O-CB 3.29Å; L788-S792 PolarHBondContact O-N 3.05Å; L788-S792 PolarHBondContact O-OG 3.3Å; R789-S792 PolarHBondContact O-N 3Å; R789-S792 VanDerWaalsContact O-N 3.12Å; R789-S792 PolarHBondContact O-OG 3.07Å; Q790-S792 VanDerWaalsContact C-N 3.31Å; Q790-S792 PolarHBondContact O-N 3.46Å; S792-Y794 PolarHBondContact O-N 2.85Å; S792-L795 PolarHBondContact O-N 2.81Å; S792-L796 WeakPolarHBondContact O-CB 3.24Å; S792-L796 VanDerWaalsContact O-CG 3.29Å; S792-L796 WeakPolarHBondContact O-CG 3.48Å; S792-L796 PolarHBondContact O-N 3.27Å; S792-M831 WeakPolarHBondContact OG-CG 3.43Å
793	Q	92	Very high	89	Confident	51 Å²	51	54.9 Å²	54.9	24%	0.238	29%	0.29	C	S	.	.	H	α-helix	trans	-62.7	-41.8	174.6	-70	173.7	-9.4	0	0	111.6	R789 Q790 L795 L796 Q797 D834	R789-Q793 WeakPolarHBondContact O-CG 3.49Å; R789-Q793 PolarHBondContact O-N 2.98Å; Q790-Q793 WeakPolarHBondContact O-CB 3.44Å; Q790-Q793 PolarHBondContact O-N 3.42Å; Q793-L795 VanDerWaalsContact C-N 3.31Å; Q793-L795 PolarHBondContact O-N 2.83Å; Q793-L796 PolarHBondContact O-N 2.78Å; Q793-Q797 WeakPolarHBondContact O-CB 3.31Å; Q793-Q797 WeakPolarHBondContact O-CG 3.49Å; Q793-Q797 PolarHBondContact O-N 3.18Å; Q793-D834 HydrophobicContact CG-CB 4.5Å; Q793-D834 PolarHBondContact NE2-OD2 3.39Å
794	Y	92.9	Very high	88.8	Confident	105 Å²	105	56.4 Å²	56.4	41%	0.412	30%	0.297	S	S	.	.	H	α-helix	trans	-59.5	-42.8	174.1	-61.9	-25.9	0	0	0	112	V783 A785 Q790 G791 S792 A798	V783-Y794 HydrophobicContact CG1-CD2 3.74Å; V783-Y794 HydrophobicContact CG1-CG 4.45Å; A785-Y794 HydrophobicContact CB-CE2 4.4Å; Q790-Y794 HydrophobicContact CG-CE1 4.22Å; Q790-Y794 HydrophobicContact CG-CE2 4.03Å; Q790-Y794 PolarHBondContact NE2-OH 3.22Å; Q790-Y794 VanDerWaalsContact NE2-OH 3.07Å; Q790-Y794 PolarHBondContact O-N 3.22Å; Q790-Y794 VanDerWaalsContact O-N 3.13Å; G791-Y794 PolarHBondContact O-N 3.22Å; S792-Y794 PolarHBondContact O-N 2.85Å; Y794-A798 VanDerWaalsContact O-CB 3.29Å; Y794-A798 WeakPolarHBondContact O-CB 3.37Å; Y794-A798 PolarHBondContact O-N 2.91Å
795	L	92.4	Very high	88.8	Confident	6 Å²	6	60.2 Å²	60.2	3%	0.031	31%	0.309	C	S	.	.	H	α-helix	trans	-67.9	-41.1	177.1	-71.4	171.5	0	0	0	112.3	L717 M719 V748 V783 G791 S792 Q793 Q797 A799	L717-L795 HydrophobicContact CD2-CB 3.89Å; M719-L795 HydrophobicContact CE-CD1 4.15Å; M719-L795 HydrophobicContact SD-CD1 3.98Å; V748-L795 HydrophobicContact CG2-CD1 3.98Å; V783-L795 HydrophobicContact CB-CD2 4.5Å; V783-L795 HydrophobicContact CB-CG 4.41Å; V783-L795 HydrophobicContact CG2-CD1 4.47Å; V783-L795 HydrophobicContact CG2-CD2 3.47Å; V783-L795 VanDerWaalsContact CG2-CD2 3.47Å; V783-L795 HydrophobicContact CG2-CG 3.78Å; G791-L795 PolarHBondContact O-N 3.25Å; S792-L795 PolarHBondContact O-N 2.81Å; Q793-L795 VanDerWaalsContact C-N 3.31Å; Q793-L795 PolarHBondContact O-N 2.83Å; L795-Q797 VanDerWaalsContact C-N 3.34Å; L795-Q797 PolarHBondContact O-N 3.43Å; L795-A799 WeakPolarHBondContact O-CB 3.24Å; L795-A799 PolarHBondContact O-N 3.13Å
796	L	91.3	Very high	88.9	Confident	2 Å²	2	60.2 Å²	60.2	1%	0.01	31%	0.309	C	S	.	.	H	α-helix	trans	-63.2	-40	178.5	-73.2	168.5	0	0	0	111.8	L717 S792 Q793 L809 A835 F838 Y840	L717-L796 HydrophobicContact CD2-CD2 4.11Å; S792-L796 WeakPolarHBondContact O-CB 3.24Å; S792-L796 VanDerWaalsContact O-CG 3.29Å; S792-L796 WeakPolarHBondContact O-CG 3.48Å; S792-L796 PolarHBondContact O-N 3.27Å; Q793-L796 PolarHBondContact O-N 2.78Å; L796-L809 HydrophobicContact CD2-CB 4.4Å; L796-L809 HydrophobicContact CD2-CD1 4.24Å; L796-L809 HydrophobicContact CD2-CD2 4.35Å; L796-A835 HydrophobicContact CD1-CB 4.45Å; L796-F838 HydrophobicContact CB-CD2 4.1Å; L796-F838 HydrophobicContact CD1-CD2 4.12Å; L796-Y840 HydrophobicContact CD2-CD1 3.79Å; L796-Y840 HydrophobicContact CD2-CE1 3.95Å; L796-Y840 HydrophobicContact CD2-CG 4.15Å; L796-Y840 PolarHBondContact O-OH 3.24Å; L796-Y840 VanDerWaalsContact O-OH 3.05Å
797	Q	89.6	Confident	88.9	Confident	114 Å²	114	57.3 Å²	57.3	53%	0.533	30%	0.297	S	S	.	.	H	α-helix	trans	-83.1	-36.7	-176.9	-67.3	178.1	-9.2	0	0	113.8	Q793 L795 F838	Q793-Q797 WeakPolarHBondContact O-CB 3.31Å; Q793-Q797 WeakPolarHBondContact O-CG 3.49Å; Q793-Q797 PolarHBondContact O-N 3.18Å; L795-Q797 VanDerWaalsContact C-N 3.34Å; L795-Q797 PolarHBondContact O-N 3.43Å; Q797-F838 HydrophobicContact CG-CE1 3.87Å; Q797-F838 HydrophobicContact CG-CE2 4.35Å; Q797-F838 HydrophobicContact CG-CZ 3.82Å
798	A	89.3	Confident	89	Confident	82 Å²	82	54.8 Å²	54.8	68%	0.678	28%	0.284	S	S	*	.	H	α-helix	trans	-114	-4.5	-166.5	0	0	0	0	0	114.9	Y794	Y794-A798 VanDerWaalsContact O-CB 3.29Å; Y794-A798 WeakPolarHBondContact O-CB 3.37Å; Y794-A798 PolarHBondContact O-N 2.91Å
799	A	90.2	Very high	89.2	Confident	9 Å²	9	52 Å²	52	7%	0.074	27%	0.269	C	S	.	.			trans	-72	134.5	178.8	0	0	0	0	0	112.3	I744 L795 P806	I744-A799 HydrophobicContact CD1-CB 4.16Å; L795-A799 WeakPolarHBondContact O-CB 3.24Å; L795-A799 PolarHBondContact O-N 3.13Å; A799-P806 HydrophobicContact CB-CG 3.93Å; A799-P806 WeakPolarHBondContact O-CD 3.46Å
800	G	87	Confident	89.3	Confident	41 Å²	41	48 Å²	48	42%	0.423	26%	0.255	S	S	.	.	S	Bend	trans	101	178.1	175.3	0	0	0	0	0	115	L804	G800-L804 CarbonylContact C-O 3.27Å; G800-L804 WeakPolarHBondContact CA-O 3.48Å
801	L	86.9	Confident	89.3	Confident	107 Å²	107	45 Å²	45	56%	0.56	24%	0.241	S	C	*	.	B	Isolated β-bridge	trans	-135	124.3	-178.9	-177.4	66.3	0	0	0	110.9	T698 R803 L804	T698-L801 HydrophobicContact CG2-CB 4.5Å; T698-L801 HydrophobicContact CG2-CD2 3.89Å; T698-L801 HydrophobicContact CG2-CG 3.97Å; L801-R803 PolarHBondContact O-N 2.99Å; L801-L804 PolarHBondContact N-O 3.42Å; L801-L804 WeakPolarHBondContact O-CB 3.47Å; L801-L804 PolarHBondContact O-N 3.19Å
802	G	83.6	Confident	89.3	Confident	37 Å²	37	45.3 Å²	45.3	38%	0.381	25%	0.245	S	C	.	.	T	Hydrogen-bonded Turn	trans	57.8	-119.6	-178.4	0	0	0	0	0	111.7	R805	G802-R805 WeakPolarHBondContact O-CG 3.42Å; G802-R805 PolarHBondContact O-NE 3.36Å
803	R	83.1	Confident	89.2	Confident	110 Å²	110	48.3 Å²	48.3	42%	0.415	26%	0.258	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85	-8.2	175.9	-68.7	-71.8	-168.2	163.6	5.4	114.1	L701 D706 Q715 L801 R805	L701-R803 HydrophobicContact CD2-CB 4.43Å; L701-R803 HydrophobicContact CG-CB 4.21Å; D706-R803 VanDerWaalsContact CG-NH1 3.27Å; D706-R803 IonicContact OD1-CZ 3.12Å; D706-R803 IonicContact OD1-NH1 3.74Å; D706-R803 PolarHBondContact OD1-NH1 3.01Å; D706-R803 VanDerWaalsContact OD1-NH1 3.12Å; D706-R803 IonicContact OD2-CZ 3.67Å; D706-R803 IonicContact OD2-NH1 2.68Å; D706-R803 PolarHBondContact OD2-NH1 3.47Å; D706-R803 IonicContact OD2-NH2 3.12Å; D706-R803 PolarHBondContact OD2-NH2 3.3Å; Q715-R803 PolarHBondContact NE2-O 3.22Å; L801-R803 PolarHBondContact O-N 2.99Å; R803-R805 VanDerWaalsContact C-N 3.25Å; R803-R805 PolarHBondContact O-N 2.85Å; R803-R805 VanDerWaalsContact O-N 3.11Å
804	L	85.9	Confident	88.9	Confident	60 Å²	60	47.8 Å²	47.8	31%	0.314	26%	0.255	S	S	.	.	B	Isolated β-bridge	trans	-85.1	66.9	173.3	-63.6	175.3	0	0	0	109.7	T698 L701 L742 G800 L801	T698-L804 HydrophobicContact CG2-CD1 4.31Å; L701-L804 HydrophobicContact CD2-CD2 3.73Å; L701-L804 HydrophobicContact CD2-CG 3.92Å; L742-L804 HydrophobicContact CD2-CB 4.08Å; L742-L804 WeakPolarHBondContact CD2-O 3.3Å; G800-L804 CarbonylContact C-O 3.27Å; G800-L804 WeakPolarHBondContact CA-O 3.48Å; L801-L804 PolarHBondContact N-O 3.42Å; L801-L804 WeakPolarHBondContact O-CB 3.47Å; L801-L804 PolarHBondContact O-N 3.19Å
805	R	87.8	Confident	88.4	Confident	136 Å²	136	45.7 Å²	45.7	51%	0.513	25%	0.251	S	S	.	.			trans	-113.7	150.9	177	-68.9	-176.8	-177.4	-162.4	-4.8	110.2	Q715 G802 R803	Q715-R805 VanDerWaalsContact CB-O 3.23Å; Q715-R805 WeakPolarHBondContact CB-O 3.4Å; Q715-R805 PolarHBondContact OE1-O 3.44Å; G802-R805 WeakPolarHBondContact O-CG 3.42Å; G802-R805 PolarHBondContact O-NE 3.36Å; R803-R805 VanDerWaalsContact C-N 3.25Å; R803-R805 PolarHBondContact O-N 2.85Å; R803-R805 VanDerWaalsContact O-N 3.11Å
806	P	90.3	Very high	87.9	Confident	4 Å²	4	49.1 Å²	49.1	3%	0.026	27%	0.269	C	S	.	.			trans	-67.9	147.5	171.7	27.3	-28.8	0	0	0	110.4	Q715 L717 I744 A799 Y840	Q715-P806 CarbonylContact O-C 3.44Å; Q715-P806 VanDerWaalsContact O-CA 3.32Å; Q715-P806 WeakPolarHBondContact O-CA 3.35Å; L717-P806 HydrophobicContact CB-CB 3.6Å; L717-P806 HydrophobicContact CB-CG 3.95Å; I744-P806 HydrophobicContact CD1-CG 4.38Å; A799-P806 HydrophobicContact CB-CG 3.93Å; A799-P806 WeakPolarHBondContact O-CD 3.46Å; P806-Y840 HydrophobicContact CB-CE1 4.12Å; P806-Y840 HydrophobicContact CG-CE1 4.08Å; P806-Y840 WeakPolarHBondContact O-CE1 3.49Å; P806-Y840 PolarHBondContact O-OH 3.32Å
807	N	87.6	Confident	87.4	Confident	50 Å²	50	54.7 Å²	54.7	27%	0.267	29%	0.29	S	S	.	.			trans	-121.3	-12	173.1	66.5	-0.1	0	0	0	112.7	Q715 Y840 G841	Q715-N807 PolarHBondContact N-OD1 3.31Å; Q715-N807 PolarHBondContact O-N 3.09Å; Q715-N807 PolarHBondContact O-OD1 2.97Å; N807-Y840 WeakPolarHBondContact O-CA 3.29Å; N807-G841 PolarHBondContact O-N 3.04Å
808	T	89.6	Confident	87	Confident	21 Å²	21	58.4 Å²	58.4	13%	0.129	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	124.4	-177.9	-51.6	0	0	0	0	109.4	Q715 C716 L717 V810 G841 V843	Q715-T808 PolarHBondContact O-N 3.21Å; C716-T808 CarbonylContact C-O 3.41Å; C716-T808 WeakPolarHBondContact CA-O 3.22Å; L717-T808 PolarHBondContact N-O 3.26Å; T808-V810 HydrophobicContact CG2-CG2 4.44Å; T808-G841 CarbonylContact C-O 3.59Å; T808-G841 VanDerWaalsContact CA-O 3.23Å; T808-G841 WeakPolarHBondContact CA-O 3.1Å; T808-G841 WeakPolarHBondContact CG2-O 3.49Å; T808-V843 HydrophobicContact CG2-CG2 3.69Å
809	L	92.5	Very high	86.5	Confident	1 Å²	1	61.8 Å²	61.8	1%	0.005	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.3	123.7	171.5	-178.4	66.5	0	0	0	109.8	L717 M719 L796 L811 M831 A835 G841 A842 V843	L717-L809 HydrophobicContact CB-CD1 4.42Å; L717-L809 HydrophobicContact CD2-CD1 3.97Å; L717-L809 HydrophobicContact CG-CD1 4.11Å; L717-L809 CarbonylContact O-C 3.59Å; L717-L809 WeakPolarHBondContact O-CA 3.49Å; M719-L809 HydrophobicContact CG-CD1 3.71Å; M719-L809 HydrophobicContact SD-CD1 4.33Å; L796-L809 HydrophobicContact CD2-CB 4.4Å; L796-L809 HydrophobicContact CD2-CD1 4.24Å; L796-L809 HydrophobicContact CD2-CD2 4.35Å; L809-L811 HydrophobicContact CD1-CD2 4.13Å; L809-L811 HydrophobicContact CD2-CD1 4.05Å; L809-L811 HydrophobicContact CD2-CD2 4.02Å; L809-L811 HydrophobicContact CD2-CG 4.1Å; L809-L811 HydrophobicContact CG-CD1 4.47Å; L809-L811 HydrophobicContact CG-CD2 3.94Å; L809-L811 HydrophobicContact CG-CG 4.01Å; L809-M831 HydrophobicContact CD2-CG 4.39Å; L809-A835 HydrophobicContact CB-CB 4.4Å; L809-A835 HydrophobicContact CD2-CB 3.61Å; L809-G841 PolarHBondContact N-O 3.33Å; L809-A842 WeakPolarHBondContact O-CA 3.42Å; L809-V843 PolarHBondContact O-N 3.45Å
810	V	92.4	Very high	85.6	Confident	5 Å²	5	62.7 Å²	62.7	3%	0.03	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110	122.3	176.5	-171.2	0	0	0	0	109.8	C716 L717 V718 M719 V733 T808 V843	C716-V810 HydrophobicContact CB-CG2 4.06Å; L717-V810 PolarHBondContact O-N 3.47Å; V718-V810 HydrophobicContact CG2-CB 4.37Å; V718-V810 HydrophobicContact CG2-CG2 4.46Å; M719-V810 PolarHBondContact N-O 2.71Å; V733-V810 HydrophobicContact CG2-CB 4.22Å; V733-V810 HydrophobicContact CG2-CG1 3.76Å; V733-V810 HydrophobicContact CG2-CG2 4.11Å; T808-V810 HydrophobicContact CG2-CG2 4.44Å; V810-V843 CarbonylContact C-O 3.48Å; V810-V843 WeakPolarHBondContact CA-O 3.33Å; V810-V843 HydrophobicContact CG1-CB 4.29Å; V810-V843 HydrophobicContact CG1-CG1 4.26Å; V810-V843 HydrophobicContact CG2-CB 4.19Å
811	L	90.7	Very high	85.3	Confident	2 Å²	2	65.8 Å²	65.8	1%	0.01	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	146.9	-176.4	-59.4	175.4	0	0	0	111.3	M719 L809 Y828 M831 I832 V843 I844 L845	M719-L811 HydrophobicContact CB-CD2 3.64Å; M719-L811 HydrophobicContact CG-CD2 3.41Å; M719-L811 VanDerWaalsContact CG-CD2 3.41Å; L809-L811 HydrophobicContact CD1-CD2 4.13Å; L809-L811 HydrophobicContact CD2-CD1 4.05Å; L809-L811 HydrophobicContact CD2-CD2 4.02Å; L809-L811 HydrophobicContact CD2-CG 4.1Å; L809-L811 HydrophobicContact CG-CD1 4.47Å; L809-L811 HydrophobicContact CG-CD2 3.94Å; L809-L811 HydrophobicContact CG-CG 4.01Å; L811-Y828 HydrophobicContact CB-CE2 4.49Å; L811-Y828 HydrophobicContact CD1-CE2 4.4Å; L811-M831 HydrophobicContact CD1-CE 3.55Å; L811-M831 HydrophobicContact CD2-CE 3.46Å; L811-M831 VanDerWaalsContact CD2-CE 3.46Å; L811-M831 HydrophobicContact CD2-SD 3.9Å; L811-M831 HydrophobicContact CG-CE 4.1Å; L811-I832 HydrophobicContact CD1-CG1 3.8Å; L811-V843 PolarHBondContact N-O 3.13Å; L811-I844 WeakPolarHBondContact O-CA 3.36Å; L811-L845 PolarHBondContact O-N 3.36Å
812	G	89.1	Confident	85.1	Confident	8 Å²	8	68.3 Å²	68.3	8%	0.082	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.7	141.7	162.7	0	0	0	0	0	110.5	Y828 L851	G812-Y828 WeakPolarHBondContact O-CE2 3.23Å; G812-Y828 PolarHBondContact O-OH 3.25Å; G812-L851 VanDerWaalsContact CA-CD1 3.49Å
813	F	88.3	Confident	85.1	Confident	63 Å²	63	71.7 Å²	71.7	28%	0.276	34%	0.341	S	S	.	.			trans	-71.3	127.9	172.1	-174.5	-91.1	0	0	0	110	N815 I844 L845 R846	F813-N815 WeakPolarHBondContact CD1-OD1 3.39Å; F813-N815 PolarHBondContact O-N 3.07Å; F813-I844 HydrophobicContact CB-CG2 3.83Å; F813-I844 HydrophobicContact CD2-CG2 3.96Å; F813-I844 HydrophobicContact CG-CG2 4.4Å; F813-L845 VanDerWaalsContact CB-O 3.32Å; F813-L845 WeakPolarHBondContact CB-O 3.23Å; F813-L845 PolarHBondContact N-O 3.12Å; F813-R846 HydrophobicContact CB-CB 3.71Å; F813-R846 HydrophobicContact CB-CG 3.94Å; F813-R846 HydrophobicContact CD1-CG 3.86Å; F813-R846 HydrophobicContact CG-CB 4.07Å; F813-R846 HydrophobicContact CG-CG 3.93Å
814	K	85.8	Confident	85.1	Confident	40 Å²	40	69.8 Å²	69.8	17%	0.174	34%	0.339	C	S	.	.			trans	-78.6	102.9	176.6	-170.2	175.9	179.2	176.2	0	110.2	D816	K814-D816 WeakPolarHBondContact CE-OD1 3.42Å; K814-D816 WeakPolarHBondContact CE-OD2 3.15Å; K814-D816 WeakPolarHBondContact CG-OD1 3.29Å; K814-D816 IonicContact NZ-OD2 3.58Å
815	N	83.1	Confident	85.2	Confident	62 Å²	62	68.8 Å²	68.8	33%	0.332	34%	0.335	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.2	-30.4	-177.8	-80.2	-26.8	0	0	0	112.9	F813 W817 G850	F813-N815 WeakPolarHBondContact CD1-OD1 3.39Å; F813-N815 PolarHBondContact O-N 3.07Å; N815-W817 PolarHBondContact O-N 3.37Å; N815-G850 VanDerWaalsContact ND2-CA 3.29Å; N815-G850 WeakPolarHBondContact ND2-CA 3.43Å; N815-G850 PolarHBondContact ND2-N 2.91Å
816	D	81.4	Confident	85.3	Confident	77 Å²	77	67.7 Å²	67.7	41%	0.412	34%	0.336	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.6	22.4	-177.7	62.7	-49.9	0	0	0	113.6	K814 R818 D819 G820	K814-D816 WeakPolarHBondContact CE-OD1 3.42Å; K814-D816 WeakPolarHBondContact CE-OD2 3.15Å; K814-D816 WeakPolarHBondContact CG-OD1 3.29Å; K814-D816 IonicContact NZ-OD2 3.58Å; D816-R818 PolarHBondContact O-N 3.05Å; D816-D819 PolarHBondContact O-N 3.3Å; D816-G820 PolarHBondContact O-N 2.98Å
817	W	80.9	Confident	85.2	Confident	120 Å²	120	68.3 Å²	68.3	46%	0.455	34%	0.34	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.1	-19.1	-175.9	69.1	-88.8	0	0	0	114.3	N815 V825	N815-W817 PolarHBondContact O-N 3.37Å; W817-V825 HydrophobicContact CB-CG2 3.97Å
818	R	81.7	Confident	85.3	Confident	192 Å²	192	67.2 Å²	67.2	73%	0.725	33%	0.332	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.5	-28.2	177	-66.1	-173.9	176.3	-178.1	-2	113.6	D816	D816-R818 PolarHBondContact O-N 3.05Å
819	D	78.3	Confident	85.4	Confident	153 Å²	153	69.8 Å²	69.8	82%	0.818	34%	0.344	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100	-23.7	-172.1	-57.7	-38.5	0	0	0	112	D816	D816-D819 PolarHBondContact O-N 3.3Å
820	G	72.4	Confident	85.4	Confident	28 Å²	28	71.6 Å²	71.6	29%	0.289	35%	0.354	S	S	.	.	S	Bend	trans	-86.5	173.1	179.7	0	0	0	0	0	114.5	D816 M822	D816-G820 PolarHBondContact O-N 2.98Å; G820-M822 PolarHBondContact O-N 3.49Å
821	D	79.9	Confident	85.3	Confident	105 Å²	105	71.6 Å²	71.6	56%	0.561	35%	0.353	S	S	*	.			trans	-59.6	132.2	175.3	-172.4	7.4	0	0	0	111.8	M823 N824	D821-M823 PolarHBondContact O-N 2.95Å; D821-M823 PolarHBondContact OD1-N 3.05Å; D821-N824 WeakPolarHBondContact O-CB 3.31Å; D821-N824 PolarHBondContact O-N 3.44Å
822	M	83	Confident	85.4	Confident	160 Å²	160	72.5 Å²	72.5	79%	0.788	36%	0.358	S	S	*	.	H	α-helix	trans	-60.3	-31.2	-178.2	-71.3	-174	71.1	0	0	111.9	G820 N824 V825 E826	G820-M822 PolarHBondContact O-N 3.49Å; M822-N824 PolarHBondContact O-N 3.38Å; M822-V825 WeakPolarHBondContact O-CB 3.49Å; M822-V825 PolarHBondContact O-N 3.16Å; M822-E826 PolarHBondContact O-N 3.13Å; M822-E826 VanDerWaalsContact O-N 3.07Å
823	M	83.4	Confident	85.6	Confident	108 Å²	108	76.9 Å²	76.9	53%	0.532	38%	0.376	S	S	.	.	H	α-helix	trans	-57.3	-35.6	175.5	-173	60.1	68.5	0	0	112.2	D821 V825 E826 T827	D821-M823 PolarHBondContact O-N 2.95Å; D821-M823 PolarHBondContact OD1-N 3.05Å; M823-V825 VanDerWaalsContact C-N 3.31Å; M823-V825 PolarHBondContact O-N 3.4Å; M823-E826 PolarHBondContact O-N 3.3Å; M823-T827 WeakPolarHBondContact O-CG2 3.47Å; M823-T827 PolarHBondContact O-N 3.35Å; M823-T827 PolarHBondContact O-OG1 3.04Å
824	N	83.7	Confident	85.8	Confident	71 Å²	71	74.4 Å²	74.4	38%	0.38	37%	0.366	S	S	.	.	H	α-helix	trans	-74.1	-23.1	178.8	-67.7	-44.9	0	0	0	113.1	D821 M822 T827 Y828	D821-N824 WeakPolarHBondContact O-CB 3.31Å; D821-N824 PolarHBondContact O-N 3.44Å; M822-N824 PolarHBondContact O-N 3.38Å; N824-T827 VanDerWaalsContact C-OG1 3.32Å; N824-T827 VanDerWaalsContact CA-OG1 3.25Å; N824-T827 WeakPolarHBondContact CA-OG1 3.41Å; N824-T827 PolarHBondContact O-OG1 3.24Å; N824-T827 VanDerWaalsContact O-OG1 3.05Å; N824-Y828 WeakPolarHBondContact O-CB 3.41Å; N824-Y828 PolarHBondContact O-N 3.08Å
825	V	87.4	Confident	86.1	Confident	39 Å²	39	72.5 Å²	72.5	24%	0.236	36%	0.358	C	S	.	.	H	α-helix	trans	-78.6	-43.2	174.8	-179.4	0	0	0	0	109.5	W817 M822 M823 T827 Y828 I829	W817-V825 HydrophobicContact CB-CG2 3.97Å; M822-V825 WeakPolarHBondContact O-CB 3.49Å; M822-V825 PolarHBondContact O-N 3.16Å; M823-V825 VanDerWaalsContact C-N 3.31Å; M823-V825 PolarHBondContact O-N 3.4Å; V825-T827 PolarHBondContact O-N 2.91Å; V825-Y828 PolarHBondContact O-N 2.83Å; V825-I829 WeakPolarHBondContact O-CG1 2.97Å; V825-I829 PolarHBondContact O-N 3.05Å
826	E	88.9	Confident	86.6	Confident	112 Å²	112	75.1 Å²	75.1	52%	0.523	37%	0.366	S	S	.	.	H	α-helix	trans	-58.7	-46.4	174.8	-177.2	173.1	-177.5	0	0	111.4	M822 M823 Y828 I829 N830	M822-E826 PolarHBondContact O-N 3.13Å; M822-E826 VanDerWaalsContact O-N 3.07Å; M823-E826 PolarHBondContact O-N 3.3Å; E826-Y828 VanDerWaalsContact C-N 3.33Å; E826-Y828 PolarHBondContact O-N 3.03Å; E826-I829 PolarHBondContact O-N 3.32Å; E826-N830 WeakPolarHBondContact CG-ND2 3.49Å; E826-N830 VanDerWaalsContact O-CB 3.23Å; E826-N830 WeakPolarHBondContact O-CB 3.38Å; E826-N830 PolarHBondContact O-N 3.4Å; E826-N830 PolarHBondContact O-ND2 3.38Å
827	T	89.5	Confident	87.2	Confident	17 Å²	17	77.3 Å²	77.3	10%	0.104	38%	0.378	C	S	.	.	H	α-helix	trans	-62.6	-36.2	175.6	49.7	0	0	0	0	113.3	R789 M823 N824 V825 M831	R789-T827 HydrophobicContact CB-CG2 4.46Å; M823-T827 WeakPolarHBondContact O-CG2 3.47Å; M823-T827 PolarHBondContact O-N 3.35Å; M823-T827 PolarHBondContact O-OG1 3.04Å; N824-T827 VanDerWaalsContact C-OG1 3.32Å; N824-T827 VanDerWaalsContact CA-OG1 3.25Å; N824-T827 WeakPolarHBondContact CA-OG1 3.41Å; N824-T827 PolarHBondContact O-OG1 3.24Å; N824-T827 VanDerWaalsContact O-OG1 3.05Å; V825-T827 PolarHBondContact O-N 2.91Å; T827-M831 WeakPolarHBondContact O-CB 3.41Å; T827-M831 PolarHBondContact O-N 2.94Å
828	Y	89.8	Confident	87.6	Confident	28 Å²	28	75.3 Å²	75.3	11%	0.11	37%	0.373	C	S	.	.	H	α-helix	trans	-67.9	-44.2	176.9	-178.4	-98.5	0	0	0	112.7	L811 G812 N824 V825 E826 M831 I832	L811-Y828 HydrophobicContact CB-CE2 4.49Å; L811-Y828 HydrophobicContact CD1-CE2 4.4Å; G812-Y828 WeakPolarHBondContact O-CE2 3.23Å; G812-Y828 PolarHBondContact O-OH 3.25Å; N824-Y828 WeakPolarHBondContact O-CB 3.41Å; N824-Y828 PolarHBondContact O-N 3.08Å; V825-Y828 PolarHBondContact O-N 2.83Å; E826-Y828 VanDerWaalsContact C-N 3.33Å; E826-Y828 PolarHBondContact O-N 3.03Å; Y828-M831 HydrophobicContact CD2-CE 3.71Å; Y828-M831 HydrophobicContact CE2-CE 4.01Å; Y828-M831 PolarHBondContact O-N 3.4Å; Y828-I832 HydrophobicContact CD1-CD1 4.12Å; Y828-I832 HydrophobicContact CE1-CD1 3.73Å; Y828-I832 PolarHBondContact O-N 2.96Å
829	I	91.4	Very high	87.9	Confident	75 Å²	75	74.9 Å²	74.9	39%	0.385	38%	0.379	S	S	.	.	H	α-helix	trans	-66.9	-42.5	176.4	-64.8	-61.6	0	0	0	110.5	V825 E826 M831 I832 H833	V825-I829 WeakPolarHBondContact O-CG1 2.97Å; V825-I829 PolarHBondContact O-N 3.05Å; E826-I829 PolarHBondContact O-N 3.32Å; I829-M831 VanDerWaalsContact C-N 3.3Å; I829-M831 PolarHBondContact O-N 3.2Å; I829-I832 WeakPolarHBondContact O-CB 3.44Å; I829-I832 PolarHBondContact O-N 3.49Å; I829-H833 PolarHBondContact O-CD2 3.36Å; I829-H833 VanDerWaalsContact O-CD2 3.26Å; I829-H833 PolarHBondContact O-N 3.07Å
830	N	91.8	Very high	88.5	Confident	39 Å²	39	69.1 Å²	69.1	21%	0.209	35%	0.346	C	S	.	.	H	α-helix	trans	-63.8	-34.5	176.7	-71.5	-22.2	0	0	0	112.3	E826 I832 H833 D834	E826-N830 WeakPolarHBondContact CG-ND2 3.49Å; E826-N830 VanDerWaalsContact O-CB 3.23Å; E826-N830 WeakPolarHBondContact O-CB 3.38Å; E826-N830 PolarHBondContact O-N 3.4Å; E826-N830 PolarHBondContact O-ND2 3.38Å; N830-I832 VanDerWaalsContact C-N 3.28Å; N830-I832 PolarHBondContact O-N 3.42Å; N830-H833 PolarHBondContact O-N 2.64Å; N830-D834 WeakPolarHBondContact O-CB 3.27Å; N830-D834 PolarHBondContact O-N 3.41Å
831	M	91.4	Very high	89.3	Confident	4 Å²	4	69.4 Å²	69.4	2%	0.02	35%	0.349	C	S	.	.	H	α-helix	trans	-62.5	-34.6	172.3	177.4	179.9	59.6	0	0	112.3	S792 L809 L811 T827 Y828 I829 A835	S792-M831 WeakPolarHBondContact OG-CG 3.43Å; L809-M831 HydrophobicContact CD2-CG 4.39Å; L811-M831 HydrophobicContact CD1-CE 3.55Å; L811-M831 HydrophobicContact CD2-CE 3.46Å; L811-M831 VanDerWaalsContact CD2-CE 3.46Å; L811-M831 HydrophobicContact CD2-SD 3.9Å; L811-M831 HydrophobicContact CG-CE 4.1Å; T827-M831 WeakPolarHBondContact O-CB 3.41Å; T827-M831 PolarHBondContact O-N 2.94Å; Y828-M831 HydrophobicContact CD2-CE 3.71Å; Y828-M831 HydrophobicContact CE2-CE 4.01Å; Y828-M831 PolarHBondContact O-N 3.4Å; I829-M831 VanDerWaalsContact C-N 3.3Å; I829-M831 PolarHBondContact O-N 3.2Å; M831-A835 WeakPolarHBondContact O-CB 3.43Å; M831-A835 PolarHBondContact O-N 3.05Å; M831-A835 VanDerWaalsContact O-N 3.08Å
832	I	92.8	Very high	89.8	Confident	22 Å²	22	66 Å²	66	11%	0.113	34%	0.335	C	S	.	.	H	α-helix	trans	-70.3	-41.7	175.1	-64.5	165.1	0	0	0	110.5	L811 Y828 I829 N830 A835 F836 I844	L811-I832 HydrophobicContact CD1-CG1 3.8Å; Y828-I832 HydrophobicContact CD1-CD1 4.12Å; Y828-I832 HydrophobicContact CE1-CD1 3.73Å; Y828-I832 PolarHBondContact O-N 2.96Å; I829-I832 WeakPolarHBondContact O-CB 3.44Å; I829-I832 PolarHBondContact O-N 3.49Å; N830-I832 VanDerWaalsContact C-N 3.28Å; N830-I832 PolarHBondContact O-N 3.42Å; I832-A835 WeakPolarHBondContact O-CB 3.38Å; I832-A835 PolarHBondContact O-N 3.13Å; I832-F836 HydrophobicContact CG2-CD2 3.9Å; I832-F836 HydrophobicContact CG2-CE2 3.46Å; I832-F836 VanDerWaalsContact CG2-CE2 3.46Å; I832-F836 HydrophobicContact CG2-CZ 4.34Å; I832-F836 VanDerWaalsContact O-CD2 3.23Å; I832-F836 WeakPolarHBondContact O-CD2 3.31Å; I832-F836 PolarHBondContact O-N 3.12Å; I832-F836 VanDerWaalsContact O-N 3.13Å; I832-I844 HydrophobicContact CD1-CD1 3.8Å
833	H	93.3	Very high	90.2	Very high	100 Å²	100	61.5 Å²	61.5	46%	0.463	32%	0.317	S	S	.	.	H	α-helix	trans	-61.6	-47.8	174.2	-73.3	-61.3	0	0	0	111.9	I829 N830 A835 F836 D837	I829-H833 PolarHBondContact O-CD2 3.36Å; I829-H833 VanDerWaalsContact O-CD2 3.26Å; I829-H833 PolarHBondContact O-N 3.07Å; N830-H833 PolarHBondContact O-N 2.64Å; H833-A835 PolarHBondContact O-N 3.02Å; H833-F836 PolarHBondContact O-N 3.22Å; H833-D837 PolarHBondContact O-N 3.1Å
834	D	92.9	Very high	90.6	Very high	11 Å²	11	60 Å²	60	6%	0.059	31%	0.31	C	S	.	.	H	α-helix	trans	-57.2	-38.9	176.8	-64.8	-20.5	0	0	0	110.5	R789 Q793 N830 D837 F838	R789-D834 VanDerWaalsContact CG-OD2 3.31Å; R789-D834 WeakPolarHBondContact CG-OD2 3.45Å; R789-D834 IonicContact CZ-OD1 3.66Å; R789-D834 IonicContact CZ-OD2 3.67Å; R789-D834 IonicContact NE-OD1 3.57Å; R789-D834 IonicContact NE-OD2 2.84Å; R789-D834 PolarHBondContact NE-OD2 2.91Å; R789-D834 IonicContact NH2-OD1 2.86Å; R789-D834 PolarHBondContact NH2-OD1 3.12Å; R789-D834 IonicContact NH2-OD2 3.6Å; Q793-D834 HydrophobicContact CG-CB 4.5Å; Q793-D834 PolarHBondContact NE2-OD2 3.39Å; N830-D834 WeakPolarHBondContact O-CB 3.27Å; N830-D834 PolarHBondContact O-N 3.41Å; D834-D837 PolarHBondContact O-N 3.29Å; D834-F838 WeakPolarHBondContact O-CD2 3.38Å; D834-F838 PolarHBondContact O-N 3.26Å; D834-F838 VanDerWaalsContact O-N 3.16Å
835	A	92	Very high	90.9	Very high	0 Å²	0	58 Å²	58	0%	0	30%	0.299	C	S	.	.	H	α-helix	trans	-63.5	-41.7	175.8	0	0	0	0	0	113	L796 L809 M831 I832 H833 F838 Q839 Y840	L796-A835 HydrophobicContact CD1-CB 4.45Å; L809-A835 HydrophobicContact CB-CB 4.4Å; L809-A835 HydrophobicContact CD2-CB 3.61Å; M831-A835 WeakPolarHBondContact O-CB 3.43Å; M831-A835 PolarHBondContact O-N 3.05Å; M831-A835 VanDerWaalsContact O-N 3.08Å; I832-A835 WeakPolarHBondContact O-CB 3.38Å; I832-A835 PolarHBondContact O-N 3.13Å; H833-A835 PolarHBondContact O-N 3.02Å; A835-F838 PolarHBondContact O-N 2.84Å; A835-Q839 PolarHBondContact O-N 3.49Å; A835-Y840 WeakPolarHBondContact O-CB 2.99Å; A835-Y840 PolarHBondContact O-N 3.27Å
836	F	93.2	Very high	91	Very high	117 Å²	117	64.2 Å²	64.2	51%	0.513	32%	0.319	S	S	.	.	H	α-helix	trans	-68.5	-35.6	175.7	-71.5	-53	0	0	0	112.5	I832 H833 F838 Q839 A842	I832-F836 HydrophobicContact CG2-CD2 3.9Å; I832-F836 HydrophobicContact CG2-CE2 3.46Å; I832-F836 VanDerWaalsContact CG2-CE2 3.46Å; I832-F836 HydrophobicContact CG2-CZ 4.34Å; I832-F836 VanDerWaalsContact O-CD2 3.23Å; I832-F836 WeakPolarHBondContact O-CD2 3.31Å; I832-F836 PolarHBondContact O-N 3.12Å; I832-F836 VanDerWaalsContact O-N 3.13Å; H833-F836 PolarHBondContact O-N 3.22Å; F836-F838 VanDerWaalsContact C-N 3.26Å; F836-F838 PolarHBondContact O-N 3.19Å; F836-Q839 WeakPolarHBondContact O-CA 2.96Å; F836-Q839 PolarHBondContact O-N 3.18Å; F836-A842 HydrophobicContact CE1-CB 4.06Å; F836-A842 HydrophobicContact CZ-CB 3.9Å
837	D	93.2	Very high	90.9	Very high	123 Å²	123	62.3 Å²	62.3	66%	0.658	31%	0.311	S	S	*	.	H	α-helix	trans	-62.3	-35.2	175.9	-69.9	-16.8	0	0	0	111.6	H833 D834 Q839	H833-D837 PolarHBondContact O-N 3.1Å; D834-D837 PolarHBondContact O-N 3.29Å; D837-Q839 PolarHBondContact O-N 2.97Å
838	F	88.8	Confident	90.4	Very high	78 Å²	78	70.3 Å²	70.3	34%	0.342	35%	0.348	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.7	4.2	172.8	-66.5	-61.5	0	0	0	114.3	L796 Q797 D834 A835 F836 Y840	L796-F838 HydrophobicContact CB-CD2 4.1Å; L796-F838 HydrophobicContact CD1-CD2 4.12Å; Q797-F838 HydrophobicContact CG-CE1 3.87Å; Q797-F838 HydrophobicContact CG-CE2 4.35Å; Q797-F838 HydrophobicContact CG-CZ 3.82Å; D834-F838 WeakPolarHBondContact O-CD2 3.38Å; D834-F838 PolarHBondContact O-N 3.26Å; D834-F838 VanDerWaalsContact O-N 3.16Å; A835-F838 PolarHBondContact O-N 2.84Å; F836-F838 VanDerWaalsContact C-N 3.26Å; F836-F838 PolarHBondContact O-N 3.19Å; F838-Y840 VanDerWaalsContact C-N 3.32Å; F838-Y840 HydrophobicContact CB-CD2 3.58Å; F838-Y840 HydrophobicContact CB-CE2 3.81Å; F838-Y840 VanDerWaalsContact O-CD2 3.3Å; F838-Y840 WeakPolarHBondContact O-CD2 3.34Å; F838-Y840 PolarHBondContact O-N 3.19Å
839	Q	89.8	Confident	89.7	Confident	182 Å²	182	78.3 Å²	78.3	85%	0.85	39%	0.386	S	S	*	.	T	Hydrogen-bonded Turn	trans	62.4	32.4	-176.4	-51.3	-175.6	-40.1	0	0	114.1	A835 F836 D837	A835-Q839 PolarHBondContact O-N 3.49Å; F836-Q839 WeakPolarHBondContact O-CA 2.96Å; F836-Q839 PolarHBondContact O-N 3.18Å; D837-Q839 PolarHBondContact O-N 2.97Å
840	Y	89.9	Confident	88.9	Confident	32 Å²	32	75.9 Å²	75.9	13%	0.125	38%	0.379	C	S	.	.			trans	-86	145.9	174.7	-78.7	-124	0	0	0	110.5	L796 P806 N807 A835 F838	L796-Y840 HydrophobicContact CD2-CD1 3.79Å; L796-Y840 HydrophobicContact CD2-CE1 3.95Å; L796-Y840 HydrophobicContact CD2-CG 4.15Å; L796-Y840 PolarHBondContact O-OH 3.24Å; L796-Y840 VanDerWaalsContact O-OH 3.05Å; P806-Y840 HydrophobicContact CB-CE1 4.12Å; P806-Y840 HydrophobicContact CG-CE1 4.08Å; P806-Y840 WeakPolarHBondContact O-CE1 3.49Å; P806-Y840 PolarHBondContact O-OH 3.32Å; N807-Y840 WeakPolarHBondContact O-CA 3.29Å; A835-Y840 WeakPolarHBondContact O-CB 2.99Å; A835-Y840 PolarHBondContact O-N 3.27Å; F838-Y840 VanDerWaalsContact C-N 3.32Å; F838-Y840 HydrophobicContact CB-CD2 3.58Å; F838-Y840 HydrophobicContact CB-CE2 3.81Å; F838-Y840 VanDerWaalsContact O-CD2 3.3Å; F838-Y840 WeakPolarHBondContact O-CD2 3.34Å; F838-Y840 PolarHBondContact O-N 3.19Å
841	G	89.4	Confident	88	Confident	35 Å²	35	74.7 Å²	74.7	36%	0.361	37%	0.373	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.4	133.9	164.5	0	0	0	0	0	110.2	N807 T808 L809	N807-G841 PolarHBondContact O-N 3.04Å; T808-G841 CarbonylContact C-O 3.59Å; T808-G841 VanDerWaalsContact CA-O 3.23Å; T808-G841 WeakPolarHBondContact CA-O 3.1Å; T808-G841 WeakPolarHBondContact CG2-O 3.49Å; L809-G841 PolarHBondContact N-O 3.33Å
842	A	90.8	Very high	87	Confident	33 Å²	33	78.8 Å²	78.8	27%	0.273	40%	0.395	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	128.5	176.4	0	0	0	0	0	110.9	L809 F836	L809-A842 WeakPolarHBondContact O-CA 3.42Å; F836-A842 HydrophobicContact CE1-CB 4.06Å; F836-A842 HydrophobicContact CZ-CB 3.9Å
843	V	91.3	Very high	85.8	Confident	65 Å²	65	80.5 Å²	80.5	39%	0.394	41%	0.406	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	123.6	175.7	178.9	0	0	0	0	108.8	T808 L809 V810 L811	T808-V843 HydrophobicContact CG2-CG2 3.69Å; L809-V843 PolarHBondContact O-N 3.45Å; V810-V843 CarbonylContact C-O 3.48Å; V810-V843 WeakPolarHBondContact CA-O 3.33Å; V810-V843 HydrophobicContact CG1-CB 4.29Å; V810-V843 HydrophobicContact CG1-CG1 4.26Å; V810-V843 HydrophobicContact CG2-CB 4.19Å; L811-V843 PolarHBondContact N-O 3.13Å
844	I	92.2	Very high	84.2	Confident	78 Å²	78	78.8 Å²	78.8	40%	0.4	41%	0.405	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	120	179.7	-57.1	173.9	0	0	0	109	L811 F813 I832	L811-I844 WeakPolarHBondContact O-CA 3.36Å; F813-I844 HydrophobicContact CB-CG2 3.83Å; F813-I844 HydrophobicContact CD2-CG2 3.96Å; F813-I844 HydrophobicContact CG-CG2 4.4Å; I832-I844 HydrophobicContact CD1-CD1 3.8Å
845	L	89.7	Confident	82.4	Confident	28 Å²	28	87.1 Å²	87.1	15%	0.147	44%	0.443	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.6	126.2	176.1	178.9	60	0	0	0	110.5	L729 L732 L811 F813 L851	L729-L845 HydrophobicContact CB-CD2 4.16Å; L729-L845 HydrophobicContact CD1-CB 4.38Å; L729-L845 HydrophobicContact CD1-CD2 4.36Å; L729-L845 HydrophobicContact CG-CD2 4.33Å; L732-L845 HydrophobicContact CB-CD2 4.46Å; L732-L845 HydrophobicContact CD2-CD1 3.53Å; L732-L845 HydrophobicContact CD2-CD2 3.7Å; L732-L845 HydrophobicContact CD2-CG 4.1Å; L811-L845 PolarHBondContact O-N 3.36Å; F813-L845 VanDerWaalsContact CB-O 3.32Å; F813-L845 WeakPolarHBondContact CB-O 3.23Å; F813-L845 PolarHBondContact N-O 3.12Å; L845-L851 HydrophobicContact CD2-CD2 3.78Å; L845-L851 HydrophobicContact CG-CD2 4.22Å; L845-L851 WeakPolarHBondContact O-CD1 3.31Å
846	R	89.3	Confident	80.6	Confident	170 Å²	170	92.1 Å²	92.1	64%	0.642	47%	0.469	S	S	*	.			trans	-122.6	125.3	173.1	-172.8	177.4	178	-162.9	-3.2	110.5	F813	F813-R846 HydrophobicContact CB-CB 3.71Å; F813-R846 HydrophobicContact CB-CG 3.94Å; F813-R846 HydrophobicContact CD1-CG 3.86Å; F813-R846 HydrophobicContact CG-CB 4.07Å; F813-R846 HydrophobicContact CG-CG 3.93Å
847	L	85.9	Confident	78.6	Confident	71 Å²	71	90.7 Å²	90.7	37%	0.372	46%	0.464	S	S	.	.			trans	-108.5	156.7	169.2	-64.5	175.3	0	0	0	109.7	A728 E849 L851	A728-L847 HydrophobicContact CB-CD1 3.86Å; L847-E849 VanDerWaalsContact C-N 3.33Å; L847-E849 PolarHBondContact O-N 3Å; L847-L851 HydrophobicContact CD1-CD2 3.54Å; L847-L851 HydrophobicContact CD1-CG 4.27Å; L847-L851 HydrophobicContact CG-CD2 4.03Å
848	Q	79.4	Confident	76.1	Confident	186 Å²	186	87.5 Å²	87.5	87%	0.869	46%	0.46	S	S	*	.	S	Bend	trans	-65.1	-36.6	-178.6	-68.9	-176	-10.6	0	0	112.4
849	E	74.6	Confident	73.6	Confident	196 Å²	196	90 Å²	90	92%	0.916	47%	0.473	S	S	*	.	S	Bend	trans	-97.6	1.2	-176	-65.6	-177.7	163.5	0	0	113.8	L847	L847-E849 VanDerWaalsContact C-N 3.33Å; L847-E849 PolarHBondContact O-N 3Å
850	G	74.7	Confident	71.4	Confident	23 Å²	23	86.3 Å²	86.3	24%	0.237	46%	0.459	C	S	.	.			trans	87.8	-179.9	-170.7	0	0	0	0	0	113.4	N815	N815-G850 VanDerWaalsContact ND2-CA 3.29Å; N815-G850 WeakPolarHBondContact ND2-CA 3.43Å; N815-G850 PolarHBondContact ND2-N 2.91Å
851	L	73.6	Confident	69.2	Low	15 Å²	15	92 Å²	92	8%	0.079	49%	0.486	C	S	.	.	S	Bend	trans	-117.8	-14.7	-172.3	-71	151.9	0	0	0	113	A728 L729 G812 L845 L847	A728-L851 HydrophobicContact CB-CD2 4.35Å; L729-L851 HydrophobicContact CB-CD2 4.25Å; L729-L851 HydrophobicContact CD1-CD1 4.46Å; G812-L851 VanDerWaalsContact CA-CD1 3.49Å; L845-L851 HydrophobicContact CD2-CD2 3.78Å; L845-L851 HydrophobicContact CG-CD2 4.22Å; L845-L851 WeakPolarHBondContact O-CD1 3.31Å; L847-L851 HydrophobicContact CD1-CD2 3.54Å; L847-L851 HydrophobicContact CD1-CG 4.27Å; L847-L851 HydrophobicContact CG-CD2 4.03Å
852	D	69.6	Low	66.6	Low	90 Å²	90	95.6 Å²	95.6	48%	0.481	50%	0.497	S	S	.	.			trans	-88.5	119.3	-174.8	-78.2	-40.9	0	0	0	111.2	R726	R726-D852 WeakPolarHBondContact CG-OD1 3.43Å; R726-D852 IonicContact CZ-OD1 2.68Å; R726-D852 IonicContact CZ-OD2 2.89Å; R726-D852 IonicContact NE-OD1 3.2Å; R726-D852 PolarHBondContact NE-OD1 3.31Å; R726-D852 IonicContact NE-OD2 3.52Å; R726-D852 IonicContact NH2-OD1 3.73Å; R726-D852 PolarHBondContact NH2-OD1 3.26Å; R726-D852 VanDerWaalsContact NH2-OD1 3.12Å; R726-D852 IonicContact NH2-OD2 2.85Å; R726-D852 PolarHBondContact NH2-OD2 2.88Å
853	V	69.2	Low	63.9	Low	57 Å²	57	98.6 Å²	98.6	35%	0.345	51%	0.508	S	S	.	.			trans	-106.8	26.5	-178.4	-162.6	0	0	0	0	111.4	S725 P727 H855 I856	S725-V853 PolarHBondContact O-N 3.12Å; P727-V853 HydrophobicContact CG-CG2 4.41Å; V853-H855 PolarHBondContact O-N 2.84Å; V853-I856 HydrophobicContact CG1-CB 4.09Å; V853-I856 HydrophobicContact CG1-CD1 3.48Å; V853-I856 VanDerWaalsContact CG1-CD1 3.48Å; V853-I856 HydrophobicContact CG1-CG1 3.78Å; V853-I856 PolarHBondContact O-N 2.77Å
854	S	59.9	Low	61.5	Low	64 Å²	64	98.8 Å²	98.8	45%	0.448	51%	0.512	S	S	.	.	G	3₁₀ helix	trans	-57.4	-21.3	-175.3	49.8	0	0	0	0	114.5	Q857	S854-Q857 WeakPolarHBondContact O-CB 3.38Å
855	H	54.8	Low	58.9	Low	186 Å²	186	98.2 Å²	98.2	86%	0.861	52%	0.515	S	S	*	.	G	3₁₀ helix	trans	-75.1	-18.6	179.4	-73.1	-75.7	0	0	0	115.4	V853	V853-H855 PolarHBondContact O-N 2.84Å
856	I	54.6	Low	56.2	Low	106 Å²	106	103.3 Å²	103.3	54%	0.544	54%	0.538	S	S	.	.	G	3₁₀ helix	trans	-88.7	-10.6	-178.9	-56.7	-175.1	0	0	0	111.7	V853 G858 Q859	V853-I856 HydrophobicContact CG1-CB 4.09Å; V853-I856 HydrophobicContact CG1-CD1 3.48Å; V853-I856 VanDerWaalsContact CG1-CD1 3.48Å; V853-I856 HydrophobicContact CG1-CG1 3.78Å; V853-I856 PolarHBondContact O-N 2.77Å; I856-G858 VanDerWaalsContact C-N 3.26Å; I856-G858 PolarHBondContact O-N 2.98Å; I856-Q859 PolarHBondContact O-N 2.86Å; I856-Q859 VanDerWaalsContact O-N 3.15Å
857	Q	49.5	Very low	53.4	Low	87 Å²	87	101.9 Å²	101.9	41%	0.407	54%	0.539	S	S	.	.	H	α-helix	trans	-65.1	-23.7	-171.6	-135.5	161.4	33.3	0	0	114.3	S854 Q859	S854-Q857 WeakPolarHBondContact O-CB 3.38Å; Q857-Q859 PolarHBondContact O-N 3.39Å
858	G	40.7	Very low	51	Low	55 Å²	55	107.6 Å²	107.6	57%	0.567	56%	0.561	S	S	*	*	H	α-helix	trans	-68.2	-11.7	176.2	0	0	0	0	0	114.8	I856	I856-G858 VanDerWaalsContact C-N 3.26Å; I856-G858 PolarHBondContact O-N 2.98Å
859	Q	36.6	Very low	48.8	Very low	132 Å²	132	103.5 Å²	103.5	62%	0.617	55%	0.552	S	S	*	*	H	α-helix	trans	-97.6	-26.4	-176.3	-143.1	147.7	19.5	0	0	113.1	I856 Q857 L862 L863	I856-Q859 PolarHBondContact O-N 2.86Å; I856-Q859 VanDerWaalsContact O-N 3.15Å; Q857-Q859 PolarHBondContact O-N 3.39Å; Q859-L862 WeakPolarHBondContact O-CB 3.47Å; Q859-L862 PolarHBondContact O-N 3.4Å; Q859-L863 PolarHBondContact O-N 3.2Å; Q859-L863 VanDerWaalsContact O-N 3.09Å
860	D	44.6	Very low	46.7	Very low	103 Å²	103	98.7 Å²	98.7	55%	0.551	54%	0.54	S	S	*	.	H	α-helix	trans	-74.3	-28.8	173	-85.3	-18.6	0	0	0	112.5	L862 L863 S864	D860-L862 VanDerWaalsContact C-N 3.28Å; D860-L862 PolarHBondContact O-N 3.3Å; D860-L863 PolarHBondContact O-N 3.47Å; D860-S864 WeakPolarHBondContact O-CB 3.25Å; D860-S864 PolarHBondContact O-N 3.01Å; D860-S864 PolarHBondContact O-OG 3.47Å
861	E	42.8	Very low	45	Very low	151 Å²	151	101.6 Å²	101.6	71%	0.706	57%	0.571	S	S	*	*	H	α-helix	trans	-65.2	-34.3	169.6	-73.8	-163.2	156.4	0	0	111.7	S864 S865	E861-S864 WeakPolarHBondContact CA-OG 3.41Å; E861-S864 PolarHBondContact O-OG 3.04Å; E861-S865 WeakPolarHBondContact O-CB 3.43Å; E861-S865 PolarHBondContact O-N 3.45Å; E861-S865 PolarHBondContact O-OG 3.07Å
862	L	34.7	Very low	42.7	Very low	112 Å²	112	105.2 Å²	105.2	59%	0.586	60%	0.603	S	S	*	*	H	α-helix	trans	-69.5	-36.6	172.9	-85.6	161.6	0	0	0	112.7	Q859 D860 S865 Q866	Q859-L862 WeakPolarHBondContact O-CB 3.47Å; Q859-L862 PolarHBondContact O-N 3.4Å; D860-L862 VanDerWaalsContact C-N 3.28Å; D860-L862 PolarHBondContact O-N 3.3Å; L862-S865 VanDerWaalsContact CA-OG 3.26Å; L862-S865 WeakPolarHBondContact CA-OG 3.39Å; L862-S865 PolarHBondContact O-N 3.28Å; L862-S865 PolarHBondContact O-OG 3.32Å; L862-Q866 WeakPolarHBondContact O-CB 3.24Å; L862-Q866 PolarHBondContact O-N 3.07Å; L862-Q866 VanDerWaalsContact O-N 3.07Å
863	L	35.3	Very low	40.9	Very low	95 Å²	95	110.8 Å²	110.8	50%	0.497	62%	0.623	S	S	.	*	H	α-helix	trans	-73.5	-35.9	174.9	-70.9	167.2	0	0	0	112.3	Q859 D860 S865 Q866 E867	Q859-L863 PolarHBondContact O-N 3.2Å; Q859-L863 VanDerWaalsContact O-N 3.09Å; D860-L863 PolarHBondContact O-N 3.47Å; L863-S865 VanDerWaalsContact C-N 3.29Å; L863-S865 PolarHBondContact O-N 3.4Å; L863-Q866 PolarHBondContact O-N 3.05Å; L863-E867 PolarHBondContact O-N 3.02Å
864	S	39.9	Very low	38.8	Very low	69 Å²	69	115 Å²	115	48%	0.483	64%	0.643	S	S	.	*	H	α-helix	trans	-68.7	-27.3	174.2	78.8	0	0	0	0	113.3	D860 E861	D860-S864 WeakPolarHBondContact O-CB 3.25Å; D860-S864 PolarHBondContact O-N 3.01Å; D860-S864 PolarHBondContact O-OG 3.47Å; E861-S864 WeakPolarHBondContact CA-OG 3.41Å; E861-S864 PolarHBondContact O-OG 3.04Å
865	S	37.4	Very low	37.3	Very low	67 Å²	67	118.2 Å²	118.2	47%	0.469	66%	0.66	S	S	.	*	H	α-helix	trans	-82.4	-23.3	173.1	44.7	0	0	0	0	112.4	E861 L862 L863	E861-S865 WeakPolarHBondContact O-CB 3.43Å; E861-S865 PolarHBondContact O-N 3.45Å; E861-S865 PolarHBondContact O-OG 3.07Å; L862-S865 VanDerWaalsContact CA-OG 3.26Å; L862-S865 WeakPolarHBondContact CA-OG 3.39Å; L862-S865 PolarHBondContact O-N 3.28Å; L862-S865 PolarHBondContact O-OG 3.32Å; L863-S865 VanDerWaalsContact C-N 3.29Å; L863-S865 PolarHBondContact O-N 3.4Å
866	Q	32.3	Very low	36	Very low	135 Å²	135	116.4 Å²	116.4	63%	0.631	66%	0.655	S	S	*	*	H	α-helix	trans	-82.4	-31.6	174.8	-153.4	168	8.3	0	0	113.1	L862 L863 K868 S869	L862-Q866 WeakPolarHBondContact O-CB 3.24Å; L862-Q866 PolarHBondContact O-N 3.07Å; L862-Q866 VanDerWaalsContact O-N 3.07Å; L863-Q866 PolarHBondContact O-N 3.05Å; Q866-K868 PolarHBondContact O-N 3.25Å; Q866-S869 PolarHBondContact O-N 3.46Å; Q866-S869 VanDerWaalsContact O-N 3.13Å; Q866-S869 PolarHBondContact O-OG 3.15Å
867	E	31.8	Very low	34.6	Very low	139 Å²	139	117.1 Å²	117.1	65%	0.65	66%	0.664	S	S	*	*	G	3₁₀ helix	trans	-64.1	-17.9	171	-89.2	-171.7	153.4	0	0	113.4	L863 S869	L863-E867 PolarHBondContact O-N 3.02Å; E867-S869 PolarHBondContact O-N 3.03Å
868	K	36	Very low	33.5	Very low	192 Å²	192	117.1 Å²	117.1	84%	0.835	67%	0.674	S	S	*	*	G	3₁₀ helix	trans	-70.4	-1.1	171.4	-90.1	-178.4	176.9	176.7	0	114.4	Q866	Q866-K868 PolarHBondContact O-N 3.25Å
869	S	32	Very low	32.8	Very low	99 Å²	99	121.4 Å²	121.4	69%	0.692	68%	0.682	S	S	*	*	G	3₁₀ helix	trans	-108.9	2.5	-177.7	71.7	0	0	0	0	116.1	Q866 E867	Q866-S869 PolarHBondContact O-N 3.46Å; Q866-S869 VanDerWaalsContact O-N 3.13Å; Q866-S869 PolarHBondContact O-OG 3.15Å; E867-S869 PolarHBondContact O-N 3.03Å
870	S	29.9	Very low	32.2	Very low	95 Å²	95	121.8 Å²	121.8	66%	0.664	69%	0.689	S	S	*	*	S	Bend	trans	-130.6	90.4	177.8	61.4	0	0	0	0	113.7
871	G	39.5	Very low	31.3	Very low	85 Å²	85	123.2 Å²	123.2	88%	0.876	70%	0.701	S	S	*	*	S	Bend	trans	75.2	52	136.7	0	0	0	0	0	119.6
872	A	26.4	Very low	30.5	Very low	91 Å²	91	121 Å²	121	75%	0.752	70%	0.702	S	S	*	*			trans	-152.6	119.1	151.7	0	0	0	0	0	109.7	D874	A872-D874 PolarHBondContact O-N 3.46Å
873	K	30.7	Very low	30.1	Very low	207 Å²	207	125.3 Å²	125.3	90%	0.9	72%	0.716	S	S	*	*			trans	-81.8	92.5	176.8	-79.6	-178.9	174.3	178.3	0	109.5
874	D	25.8	Very low	29.6	Very low	145 Å²	145	127.6 Å²	127.6	78%	0.775	73%	0.729	S	S	*	*			trans	-87.7	115	158.5	-80.8	-26.1	0	0	0	109.2	A872 I876	A872-D874 PolarHBondContact O-N 3.46Å; D874-I876 PolarHBondContact O-N 3.45Å
875	V	28.5	Very low	28.9	Very low	132 Å²	132	129.8 Å²	129.8	80%	0.8	74%	0.744	S	S	*	*			trans	-81.1	95.1	170.3	177.1	0	0	0	0	107.1	V877	V875-V877 HydrophobicContact CG1-CG2 4.35Å
876	I	27	Very low	28.3	Very low	148 Å²	148	134.3 Å²	134.3	76%	0.759	76%	0.763	S	S	*	*			trans	-90.3	115.5	160.8	-64.1	173.2	0	0	0	106.4	D874 S878	D874-I876 PolarHBondContact O-N 3.45Å; I876-S878 PolarHBondContact O-N 3.11Å; I876-S878 VanDerWaalsContact O-N 3.16Å
877	V	25.9	Very low	28	Very low	120 Å²	120	133.1 Å²	133.1	73%	0.727	77%	0.769	S	S	*	*			trans	-71.2	102.1	169.7	177.1	0	0	0	0	107.2	V875	V875-V877 HydrophobicContact CG1-CG2 4.35Å
878	S	24.9	Very low	27.5	Very low	87 Å²	87	133.5 Å²	133.5	61%	0.608	78%	0.775	S	S	*	*			trans	-74.6	120.9	162.9	47.3	0	0	0	0	108.4	I876 D880	I876-S878 PolarHBondContact O-N 3.11Å; I876-S878 VanDerWaalsContact O-N 3.16Å; S878-D880 PolarHBondContact O-N 3.5Å
879	I	27.4	Very low	27.1	Very low	146 Å²	146	129.5 Å²	129.5	75%	0.749	77%	0.771	S	S	*	*			trans	-77.2	109.2	164.7	-68.3	166.4	0	0	0	105.7	T881	I879-T881 HydrophobicContact CG2-CG2 4.33Å; I879-T881 PolarHBondContact O-N 3.29Å
880	D	23.4	Very low	26.8	Very low	140 Å²	140	130.1 Å²	130.1	75%	0.749	78%	0.776	S	S	*	*			trans	-70.7	105.6	171.2	-77.8	-36.3	0	0	0	109.1	S878	S878-D880 PolarHBondContact O-N 3.5Å
881	T	25.4	Very low	26.4	Very low	133 Å²	133	135 Å²	135	82%	0.816	79%	0.785	S	S	*	*			trans	-107.6	82.1	156.6	50.4	0	0	0	0	108.2	I879	I879-T881 HydrophobicContact CG2-CG2 4.33Å; I879-T881 PolarHBondContact O-N 3.29Å
882	S	25.8	Very low	26	Very low	104 Å²	104	136.6 Å²	136.6	73%	0.727	78%	0.78	S	S	*	*			trans	-113.9	98.6	159.3	59	0	0	0	0	107.5
883	K	26.3	Very low	25.8	Very low	203 Å²	203	137.2 Å²	137.2	88%	0.883	78%	0.779	S	S	*	*			trans	-125.3	127.8	159.2	-157	173.9	-174.4	176.9	0	107.4
884	D	26	Very low	25.5	Very low	142 Å²	142	132 Å²	132	76%	0.759	77%	0.768	S	S	*	*			trans	-63.2	144	-161.8	-53.9	-65.2	0	0	0	114
885	S	24.6	Very low	25.5	Very low	116 Å²	116	133.8 Å²	133.8	81%	0.811	77%	0.769	S	S	*	*			trans	-105.4	99.6	158.6	56.3	0	0	0	0	107.7
886	D	24.9	Very low	25.3	Very low	161 Å²	161	132.9 Å²	132.9	86%	0.861	76%	0.764	S	S	*	*			trans	-124.3	126.3	164.2	-83.6	-25.5	0	0	0	109.1
887	C	25.2	Very low	25.1	Very low	111 Å²	111	131.5 Å²	131.5	75%	0.75	76%	0.762	S	S	*	*			trans	-116.2	130.3	164.5	-150	0	0	0	0	108.5
888	D	22.5	Very low	25	Very low	146 Å²	146	130.3 Å²	130.3	78%	0.781	76%	0.76	S	S	*	*			trans	67.4	103	157.9	-58.9	-33	0	0	0	121.1
889	S	27	Very low	25	Very low	108 Å²	108	133.2 Å²	133.2	76%	0.755	77%	0.768	S	S	*	*				169.1	137.7	84.6	62.9	0	0	0	0	113.6
890	S	25	Very low	24.9	Very low	112 Å²	112	133.7 Å²	133.7	78%	0.783	77%	0.767	S	S	*	*			trans	39.4	109.1	152.4	54.7	0	0	0	0	122.3
891	K	22.2	Very low	24.9	Very low	199 Å²	199	134.2 Å²	134.2	87%	0.865	77%	0.769	S	S	*	*			trans	-42.3	177.1	147	-87.4	178.5	-177	172.9	0	115.1
892	P	31.6	Very low	24.9	Very low	117 Å²	117	133.1 Å²	133.1	76%	0.76	77%	0.767	S	S	*	*			cis	-139	173.7	-5.4	23.8	0.6	0	0	0	115.2
893	S	22.4	Very low	25.7	Very low	105 Å²	105	134 Å²	134	73%	0.734	77%	0.77	S	S	*	*			trans	154.9	92.6	131.7	-174	0	0	0	0	108.8
894	S	24.9	Very low	25.6	Very low	96 Å²	96	128.7 Å²	128.7	67%	0.671	76%	0.764	S	S	*	*				96	132.9	84.5	81.1	0	0	0	0	113.2
895	K	24.9	Very low	25.6	Very low	184 Å²	184	128.4 Å²	128.4	80%	0.8	77%	0.767	S	S	*	*			trans	92.2	104.9	141.7	-91.4	179.3	-177.7	-179.5	0	120.3
896	T	24.6	Very low	25.6	Very low	112 Å²	112	131 Å²	131	69%	0.687	77%	0.767	S	S	*	*				92.2	109.5	117.6	29.1	0	0	0	0	121.3
897	T	23	Very low	25.6	Very low	119 Å²	119	133.2 Å²	133.2	73%	0.73	77%	0.769	S	S	*	*				67.5	128.5	122.3	45.3	0	0	0	0	122.9
898	S	24	Very low	25.4	Very low	96 Å²	96	131.2 Å²	131.2	67%	0.671	77%	0.766	S	S	*	*				95.3	114.2	122.4	66.5	0	0	0	0	121.1
899	L	24.7	Very low	25.6	Very low	148 Å²	148	134 Å²	134	78%	0.775	78%	0.775	S	S	*	*				71.3	118.3	122.1	-70.7	162.9	0	0	0	120.9
900	Q	25.4	Very low	25.4	Very low	156 Å²	156	134.3 Å²	134.3	73%	0.729	78%	0.777	S	S	*	*				47.4	113.5	127.1	-87	176	-23.3	0	0	120.1
901	N	23.1	Very low	25.4	Very low	150 Å²	150	132.9 Å²	132.9	80%	0.802	77%	0.772	S	S	*	*				152.8	138.6	110.3	-82.5	-24.6	0	0	0	112.9
902	S	24.4	Very low	25.6	Very low	111 Å²	111	131.8 Å²	131.8	78%	0.776	77%	0.769	S	S	*	*			trans	-65.5	-171.2	169.5	-46.2	0	0	0	0	112.9
903	P	44.2	Very low	25.2	Very low	122 Å²	122	133.1 Å²	133.1	79%	0.792	76%	0.763	S	S	*	*			cis	-130.7	-170.8	-47.3	28.9	-7.6	0	0	0	112.8
904	A	23.2	Very low	25.3	Very low	91 Å²	91	136 Å²	136	75%	0.752	77%	0.769	S	S	*	*			trans	99.4	131.9	157	0	0	0	0	0	118.5
905	V	25	Very low	25.3	Very low	136 Å²	136	138.2 Å²	138.2	82%	0.824	77%	0.769	S	S	*	*				177.3	145.5	113.4	156.4	0	0	0	0	111.5
906	Q	24.7	Very low	25.3	Very low	172 Å²	172	136.8 Å²	136.8	80%	0.804	77%	0.77	S	S	*	*			trans	-51	155.3	179.2	-64.4	159.1	-42.3	0	0	117
907	K	25.3	Very low	25.3	Very low	207 Å²	207	136.4 Å²	136.4	90%	0.9	77%	0.767	S	S	*	*				-175.9	133.9	111.3	-105.5	175.1	178.3	177.2	0	111.5
908	G	22.4	Very low	25.5	Very low	68 Å²	68	137.7 Å²	137.7	70%	0.701	77%	0.765	S	S	*	*			trans	-90.3	169.7	172.4	0	0	0	0	0	113.2
909	Q	24.8	Very low	25.5	Very low	206 Å²	206	140.9 Å²	140.9	96%	0.963	77%	0.77	S	S	*	*			trans	-173.9	149.3	132.8	-106.5	173.4	-9.4	0	0	110.4
910	S	23.1	Very low	25.6	Very low	114 Å²	114	138.5 Å²	138.5	80%	0.797	77%	0.771	S	S	*	*			trans	-114.4	154.2	-169	40.7	0	0	0	0	111.4
911	A	26.6	Very low	25.6	Very low	81 Å²	81	136.1 Å²	136.1	67%	0.669	78%	0.778	S	S	*	*			trans	108.1	144.4	134.7	0	0	0	0	0	121.1
912	H	24.5	Very low	25.7	Very low	177 Å²	177	136.3 Å²	136.3	82%	0.819	78%	0.779	S	S	*	*			trans	81.6	147.3	157.7	-72.4	-83.6	0	0	0	118.8
913	F	23.7	Very low	25.7	Very low	144 Å²	144	137 Å²	137	63%	0.632	78%	0.779	S	S	*	*			cis	170.6	130.4	-18.4	-175.8	-94.6	0	0	0	103
914	L	25.1	Very low	24.8	Very low	165 Å²	165	138.5 Å²	138.5	86%	0.864	78%	0.78	S	S	*	*			trans	-178.9	146.5	138.2	-101.6	160.7	0	0	0	111.2
915	Q	24.7	Very low	24.8	Very low	143 Å²	143	142.8 Å²	142.8	67%	0.668	79%	0.787	S	S	*	*			trans	-134	145.8	-157	-176.1	180	8.1	0	0	105.6
916	L	24.7	Very low	24.9	Very low	154 Å²	154	140.4 Å²	140.4	81%	0.806	78%	0.781	S	S	*	*			trans	-170.3	101.9	155.8	-96.3	148	0	0	0	105.6
917	T	25.3	Very low	25.1	Very low	104 Å²	104	139.3 Å²	139.3	64%	0.638	78%	0.781	S	S	*	*				65.5	139.2	98.5	54.7	0	0	0	0	113.9
918	Q	26.1	Very low	25.1	Very low	147 Å²	147	133.2 Å²	133.2	69%	0.687	78%	0.777	S	S	*	*			cis	177.1	154.2	-1.3	173.5	164.9	-30.5	0	0	107.6
919	E	25.3	Very low	25.3	Very low	163 Å²	163	138.3 Å²	138.3	76%	0.762	78%	0.78	S	S	*	*			trans	63.9	123.9	159.8	-80	165.5	140.3	0	0	119.9
920	A	25.6	Very low	25.5	Very low	97 Å²	97	139.6 Å²	139.6	80%	0.802	78%	0.778	S	S	*	*			cis	100.1	117	47	0	0	0	0	0	112.4
921	A	25.6	Very low	25.6	Very low	106 Å²	106	145.3 Å²	145.3	88%	0.876	78%	0.783	S	S	*	*			trans	-171.2	119	148.4	0	0	0	0	0	111
922	D	24.5	Very low	25.7	Very low	154 Å²	154	150.8 Å²	150.8	82%	0.824	79%	0.792	S	S	*	*			trans	-64.5	148.8	165	-77.4	-50.3	0	0	0	112.4
923	T	25.8	Very low	25.8	Very low	126 Å²	126	145.9 Å²	145.9	77%	0.773	78%	0.782	S	S	*	*				165.4	132.6	114.9	28.1	0	0	0	0	113.9
924	D	24.3	Very low	26	Very low	153 Å²	153	145.9 Å²	145.9	82%	0.818	79%	0.789	S	S	*	*			trans	66	142.5	140.9	-71.1	-28.2	0	0	0	125.5
925	M	24.5	Very low	26	Very low	182 Å²	182	147.4 Å²	147.4	90%	0.897	78%	0.784	S	S	*	*			trans	95.5	102.5	148.1	-96.1	-179.4	175.4	0	0	121.3
926	A	26.6	Very low	26.3	Very low	85 Å²	85	151.3 Å²	151.3	70%	0.702	80%	0.795	S	S	*	*				41.4	135.2	117.3	0	0	0	0	0	122
927	D	29.2	Very low	26.4	Very low	149 Å²	149	149 Å²	149	80%	0.797	79%	0.787	S	S	*	*			trans	63.8	105.9	152.4	-70.5	-14.3	0	0	0	120.2
928	G	25.4	Very low	26.7	Very low	80 Å²	80	156 Å²	156	83%	0.825	80%	0.802	S	S	*	*			trans	-124	83.6	167.6	0	0	0	0	0	112.4
929	K	26.2	Very low	26.7	Very low	174 Å²	174	152.8 Å²	152.8	76%	0.757	80%	0.795	S	S	*	*			trans	-58.1	139.9	175.4	-71.2	167.2	178.6	167.3	0	112.3	Y931	K929-Y931 PolarHBondContact O-N 3.41Å
930	Y	28.4	Very low	26.6	Very low	234 Å²	234	150.8 Å²	150.8	92%	0.918	80%	0.799	S	S	*	*			trans	-58.4	117.6	163.1	-76.2	-90.4	0	0	0	110.2	K932	Y930-K932 PolarHBondContact O-N 3.19Å
931	Y	26	Very low	26.8	Very low	233 Å²	233	153.2 Å²	153.2	91%	0.914	80%	0.798	S	S	*	*			trans	-70.5	98.4	173	-84.8	-92.2	0	0	0	110	K929 A933	K929-Y931 PolarHBondContact O-N 3.41Å; Y931-A933 PolarHBondContact O-N 3.43Å
932	K	28	Very low	26.8	Very low	197 Å²	197	153.7 Å²	153.7	86%	0.857	79%	0.789	S	S	*	*			trans	-82.4	94.5	158.1	-143.2	175.3	-170.1	176.5	0	106.6	Y930 N934	Y930-K932 PolarHBondContact O-N 3.19Å; K932-N934 PolarHBondContact O-N 3.29Å
933	A	26.2	Very low	26.8	Very low	74 Å²	74	150.7 Å²	150.7	61%	0.612	78%	0.78	S	S	*	*			trans	-70.4	101.7	175.1	0	0	0	0	0	109.3	Y931 Y935	Y931-A933 PolarHBondContact O-N 3.43Å; A933-Y935 HydrophobicContact CB-CD2 4.2Å; A933-Y935 HydrophobicContact CB-CE2 4.05Å; A933-Y935 PolarHBondContact O-N 3.24Å
934	N	27.6	Very low	26.8	Very low	143 Å²	143	154.3 Å²	154.3	77%	0.765	78%	0.781	S	S	*	*			trans	-69.3	98.9	162.6	-87.3	-24	0	0	0	108.6	K932 Y936	K932-N934 PolarHBondContact O-N 3.29Å; N934-Y936 PolarHBondContact O-N 3.32Å
935	Y	27	Very low	26.9	Very low	198 Å²	198	152 Å²	152	78%	0.776	77%	0.772	S	S	*	*			trans	-84.5	94.7	160.1	-81.1	-81.8	0	0	0	108.9	A933 T937	A933-Y935 HydrophobicContact CB-CD2 4.2Å; A933-Y935 HydrophobicContact CB-CE2 4.05Å; A933-Y935 PolarHBondContact O-N 3.24Å; Y935-T937 VanDerWaalsContact C-N 3.32Å; Y935-T937 PolarHBondContact O-N 3.4Å
936	Y	29.9	Very low	27.1	Very low	225 Å²	225	149 Å²	149	88%	0.882	77%	0.767	S	S	*	*			trans	-76.6	88.3	157	-106.4	-88.4	0	0	0	107.6	N934	N934-Y936 PolarHBondContact O-N 3.32Å
937	T	27.5	Very low	27.3	Very low	105 Å²	105	155.9 Å²	155.9	64%	0.644	79%	0.791	S	S	*	*			trans	-105.8	116.3	162.4	12.4	0	0	0	0	108.1	Y935 S939	Y935-T937 VanDerWaalsContact C-N 3.32Å; Y935-T937 PolarHBondContact O-N 3.4Å; T937-S939 PolarHBondContact O-N 3.18Å
938	R	30.2	Very low	27.2	Very low	252 Å²	252	156.2 Å²	156.2	95%	0.951	79%	0.791	S	S	*	*			trans	-69.6	77.7	178.2	-152.6	-179.5	-165.7	-171.9	3.9	108.2	S940	R938-S940 PolarHBondContact O-N 3.36Å
939	S	26	Very low	27.3	Very low	78 Å²	78	160.2 Å²	160.2	55%	0.545	79%	0.789	S	S	.	*			trans	-80.4	112.9	175	-64.2	0	0	0	0	108.6	T937 L941	T937-S939 PolarHBondContact O-N 3.18Å; S939-L941 VanDerWaalsContact C-N 3.34Å; S939-L941 PolarHBondContact O-N 3.17Å
940	S	25.1	Very low	27.3	Very low	121 Å²	121	159.4 Å²	159.4	85%	0.846	79%	0.791	S	S	*	*			trans	-60	96.1	169.3	-60.4	0	0	0	0	109.1	R938 V942	R938-S940 PolarHBondContact O-N 3.36Å; S940-V942 PolarHBondContact O-N 3.14Å
941	L	29.6	Very low	27.3	Very low	148 Å²	148	155.1 Å²	155.1	78%	0.775	78%	0.783	S	S	*	*			trans	-82	103.4	179.4	-149.8	96	0	0	0	108.2	S939 C943	S939-L941 VanDerWaalsContact C-N 3.34Å; S939-L941 PolarHBondContact O-N 3.17Å; L941-C943 HydrophobicContact CD2-CB 4.48Å; L941-C943 PolarHBondContact O-N 2.99Å
942	V	25.7	Very low	27.4	Very low	116 Å²	116	150.2 Å²	150.2	70%	0.703	78%	0.775	S	S	*	*			trans	-84.9	94.2	167	-177.7	0	0	0	0	107	S940 Y944	S940-V942 PolarHBondContact O-N 3.14Å; V942-Y944 HydrophobicContact CG1-CD2 3.72Å; V942-Y944 HydrophobicContact CG1-CE2 3.63Å; V942-Y944 PolarHBondContact O-N 2.95Å
943	C	24.1	Very low	27.3	Very low	92 Å²	92	147.1 Å²	147.1	62%	0.622	77%	0.77	S	S	*	*			trans	-84	98.6	173.3	-152.1	0	0	0	0	107.8	L941 V945	L941-C943 HydrophobicContact CD2-CB 4.48Å; L941-C943 PolarHBondContact O-N 2.99Å; C943-V945 VanDerWaalsContact C-N 3.29Å; C943-V945 PolarHBondContact O-N 3.05Å; C943-V945 VanDerWaalsContact O-N 3.11Å
944	Y	26	Very low	27.4	Very low	202 Å²	202	152.3 Å²	152.3	79%	0.792	78%	0.781	S	S	*	*			trans	-77.5	89.3	163	-88.2	-83.8	0	0	0	107.7	V942 C946	V942-Y944 HydrophobicContact CG1-CD2 3.72Å; V942-Y944 HydrophobicContact CG1-CE2 3.63Å; V942-Y944 PolarHBondContact O-N 2.95Å; Y944-C946 PolarHBondContact O-N 3.35Å
945	V	26.4	Very low	27.4	Very low	105 Å²	105	153 Å²	153	64%	0.636	78%	0.782	S	S	*	*			trans	-84.3	91.9	158.7	-178.4	0	0	0	0	105.5	C943 L947	C943-V945 VanDerWaalsContact C-N 3.29Å; C943-V945 PolarHBondContact O-N 3.05Å; C943-V945 VanDerWaalsContact O-N 3.11Å; V945-L947 HydrophobicContact CG1-CG 4.19Å; V945-L947 PolarHBondContact O-N 3.16Å
946	C	27.3	Very low	27.4	Very low	118 Å²	118	149.3 Å²	149.3	80%	0.797	78%	0.783	S	S	*	*			trans	-78	107.4	157.8	-83.3	0	0	0	0	106.4	Y944	Y944-C946 PolarHBondContact O-N 3.35Å
947	L	31.3	Very low	27.2	Very low	229 Å²	229	142.4 Å²	142.4	100%	1.199	77%	0.774	S	S	*	*			trans	-72.8	0	165.7	-93.4	160.2	0	0	0	110.4	V945	V945-L947 HydrophobicContact CG1-CG 4.19Å; V945-L947 PolarHBondContact O-N 3.16Å

Retrieved 947 of 947 residues in 319.5 ms (Link to these results)

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