A0A096N845_PAPAN Loading...

Voltage-dependent calcium channel protein TPC1

Intracellular channel initially characterized as a non-selective Ca(2+)-permeable channel activated by NAADP (nicotinic acid adenine dinucleotide phosphate), it is also a voltage-gated highly-selective Na(+) channel activated directly by PI(3,5)P2 (phosphatidylinositol 3,5-bisphosphate) that senses pH changes and confers electrical excitability to organelles. Localizes to the early and recycling endosomes membranes where it plays a role in the uptake and processing of proteins and regulates organellar membrane excitability, membrane trafficking and pH homeostasis. Ion selectivity is not fixed but rather agonist-dependent and under defined ionic conditions, can be readily activated by both NAADP and PI(3,5)P2. Required for mTOR-dependent nutrient sensing.

AlphaFold DB , UniProt , Accession A0A096N845, Species PAPAN (Papio anubis, Olive baboon), Gene TPCN1, Length 888 aa.

						>A0A096N845_PAPAN|A0A096N845|TPCN1
MESCYLAQAGLELLGSSSSPTLTSQSAGITKDASNGGISEQHPWPSGFERELKPETISSPGHHILRATGEENMAVSLDDDVPLILTLDEGGSAPLAPSNGLGQEELPSKNGGSYAIHDSQAPSLSSEGGSSPSSPAHNWEMNYQEAAIYLQEGENNDKFFTHPKDAKALAAYLFAHNHLFYLMELATALLLLLLSLCEAPAVPALRLGIYVHATLELFALMVVVFELCMKLRWLGLHTFIRHKRTMVKTSVLVVQFVEAIVVLVRQMSHVRVTRALRCIFLVDCRYCGGVRRNLRQIFQSLPPFMDILLLLLFFMIIFAILGFYLFSPNPSDPYFSTLENSIVSLFVLLTTANFPDVMMPSYSRNPWSCVFFIVYLSIELYFIMNLLLAVVFDTFNDIEKRKFKSLLLHKRTAIQHAYRLLVSQRRPAGISYRQFEGLMRFYKPRMSARERYLTFKALNQNDTPLLSLKDFYDIYEVAALKWKAKKNREHWFDELPRTALLIFKGINILVKSKAFQYFMYLVVAVNGVWILVETFMLKGGNFFSKHVPWSYLVFLTIYGVELFLKVAGLGPVEYLSSGWNLFDFSVTVFAFLGLLALALNMEPFYFIVVLRPLQLLRLFKLKERYRNVLDTMFELLPRMASLGLTLLIFYYSFAIVGMEFFCGIVFPNCCNTSTVADAYRWRNHTVGNRTVVEEGYYYLNNFDNILNSFVTLFELTVVNNWYIIMEGVTSQTSHWSRLYFMTFYIVTMVVMTIIVAFILEAFVFRMNYSRKNQDSEVDGGITLEKEISKEELVAVLELYREAQGASSDVTRLLETLSQMERYQQRSMVFLGRRSRTKSDLSLKMYQEEIQEWYEEHAREQEQQRQLSSSAAPATQQPPSSRQRSQTVT
					

Structure Viewer

Loading PAE data...

(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	32.8	Very low	28.4	Very low	234 Å²	234	147.9 Å²	147.9	100%	1.153	84%	0.841	S	S	*	*				0	70.9	0	-67.6	179.2	-156.5	0	0	106
2	E	29.8	Very low	28.2	Very low	181 Å²	181	150.4 Å²	150.4	85%	0.846	84%	0.84	S	S	*	*				70.9	94.2	97.3	-76.3	-171.8	149.3	0	0	111.2
3	S	27.3	Very low	28.1	Very low	111 Å²	111	150.2 Å²	150.2	78%	0.776	84%	0.835	S	S	*	*				86.8	103.8	96.1	-64.4	0	0	0	0	110.4
4	C	28.4	Very low	28.1	Very low	106 Å²	106	151.6 Å²	151.6	72%	0.716	84%	0.839	S	S	*	*				55	106.6	59.6	-141.1	0	0	0	0	113.8
5	Y	30.2	Very low	27.8	Very low	217 Å²	217	145.5 Å²	145.5	85%	0.851	82%	0.823	S	S	*	*				169.5	144.7	113.3	-104.1	-85.2	0	0	0	115.1
6	L	31.9	Very low	27.6	Very low	159 Å²	159	143.5 Å²	143.5	83%	0.832	82%	0.822	S	S	*	*			trans	-60.8	155.2	161.3	-87.1	139	0	0	0	114.7
7	A	25.3	Very low	27.5	Very low	90 Å²	90	141.3 Å²	141.3	74%	0.744	82%	0.817	S	S	*	*			trans	167.6	133.5	138.3	0	0	0	0	0	108.2
8	Q	26.4	Very low	27.4	Very low	191 Å²	191	139.4 Å²	139.4	89%	0.893	81%	0.813	S	S	*	*			cis	75.9	131.9	40.5	-148.8	174.8	10.2	0	0	115.3
9	A	27.3	Very low	27.3	Very low	106 Å²	106	137.8 Å²	137.8	88%	0.876	81%	0.811	S	S	*	*			trans	82.2	148.4	169.3	0	0	0	0	0	117.3
10	G	25.1	Very low	27.8	Very low	68 Å²	68	136.7 Å²	136.7	70%	0.701	81%	0.807	S	S	*	*			cis	-168.8	144.4	6	0	0	0	0	0	108.6
11	L	27.6	Very low	27.8	Very low	164 Å²	164	135.8 Å²	135.8	86%	0.859	80%	0.803	S	S	*	*				38.2	118	101.6	-115.6	103.4	0	0	0	118.2
12	E	26.5	Very low	27.5	Very low	178 Å²	178	131.6 Å²	131.6	83%	0.832	79%	0.785	S	S	*	*			trans	156.3	117.5	133.9	-87	-178.7	177.8	0	0	109.3
13	L	27.3	Very low	27.4	Very low	148 Å²	148	128.3 Å²	128.3	78%	0.775	78%	0.778	S	S	*	*				76.2	135.1	68.6	-93.4	165.9	0	0	0	116.1
14	L	27	Very low	27.3	Very low	170 Å²	170	128 Å²	128	89%	0.89	78%	0.775	S	S	*	*			trans	78.9	136.8	169.5	-59.7	154.1	0	0	0	115.3
15	G	24.4	Very low	27.4	Very low	59 Å²	59	131.4 Å²	131.4	61%	0.608	78%	0.781	S	S	*	*			cis	141.3	131.3	12.1	0	0	0	0	0	109
16	S	24.8	Very low	27.2	Very low	114 Å²	114	126 Å²	126	80%	0.797	78%	0.775	S	S	*	*			trans	77.3	130.2	152.8	79.6	0	0	0	0	121.4
17	S	25.7	Very low	27.1	Very low	106 Å²	106	123.6 Å²	123.6	74%	0.741	78%	0.778	S	S	*	*				109.4	135.9	122.2	76.4	0	0	0	0	119.8
18	S	25.6	Very low	27.2	Very low	107 Å²	107	122.3 Å²	122.3	75%	0.748	77%	0.773	S	S	*	*			trans	82.1	104	152.2	64.3	0	0	0	0	119.7
19	S	25.6	Very low	27.4	Very low	110 Å²	110	120.8 Å²	120.8	77%	0.769	77%	0.77	S	S	*	*			trans	-50.3	161.4	143.6	36	0	0	0	0	112.8
20	P	37.7	Very low	27.4	Very low	114 Å²	114	121.5 Å²	121.5	74%	0.74	76%	0.763	S	S	*	*				-142	130.7	114.8	28	-8.5	0	0	0	115.2
21	T	26.9	Very low	27.6	Very low	118 Å²	118	127.1 Å²	127.1	72%	0.724	77%	0.768	S	S	*	*			trans	47	140.9	133.5	47.3	0	0	0	0	125.8
22	L	27.1	Very low	27.6	Very low	146 Å²	146	126.1 Å²	126.1	76%	0.764	76%	0.764	S	S	*	*			trans	83.6	131.9	148	-68.9	145.1	0	0	0	116.2
23	T	26.2	Very low	27.7	Very low	113 Å²	113	121.8 Å²	121.8	69%	0.693	76%	0.759	S	S	*	*			cis	-170.4	145.9	28.5	-2.6	0	0	0	0	111.6
24	S	26.6	Very low	27.7	Very low	104 Å²	104	119.9 Å²	119.9	73%	0.727	76%	0.757	S	S	*	*			trans	71.5	143	141.1	95.5	0	0	0	0	118.5
25	Q	29.2	Very low	27.7	Very low	177 Å²	177	119.4 Å²	119.4	83%	0.827	76%	0.756	S	S	*	*			cis	-155.5	149.3	24.5	-97.6	173.3	-16.6	0	0	112.1
26	S	27	Very low	27.8	Very low	104 Å²	104	120.6 Å²	120.6	73%	0.727	77%	0.768	S	S	*	*			trans	6	129.5	153.6	70.3	0	0	0	0	122.7
27	A	29	Very low	27.9	Very low	108 Å²	108	119 Å²	119	89%	0.893	77%	0.77	S	S	*	*				83.9	139.3	97.9	0	0	0	0	0	113.7
28	G	28.3	Very low	28	Very low	63 Å²	63	122 Å²	122	65%	0.649	78%	0.776	S	S	*	*			cis	164.9	139.4	3.8	0	0	0	0	0	107.2
29	I	29.8	Very low	28	Very low	160 Å²	160	121.3 Å²	121.3	82%	0.821	77%	0.771	S	S	*	*				106.5	119.4	122.6	-69.4	172.5	0	0	0	117.7
30	T	28.6	Very low	28.1	Very low	121 Å²	121	123.8 Å²	123.8	74%	0.742	77%	0.77	S	S	*	*			trans	62.8	117.9	146.2	59.1	0	0	0	0	125.5
31	K	28.8	Very low	27.6	Very low	185 Å²	185	126 Å²	126	80%	0.804	77%	0.771	S	S	*	*				27.7	122.1	108.3	-88.6	-172.3	177.3	-177.1	0	120.4
32	D	27.6	Very low	27.6	Very low	144 Å²	144	129.2 Å²	129.2	77%	0.77	78%	0.777	S	S	*	*				144.2	138	108.8	-84.7	-19.4	0	0	0	115.4
33	A	27.9	Very low	27.7	Very low	87 Å²	87	127.6 Å²	127.6	72%	0.719	78%	0.776	S	S	*	*			trans	70.3	116.4	141.9	0	0	0	0	0	123.9
34	S	26.9	Very low	28.1	Very low	107 Å²	107	134.6 Å²	134.6	75%	0.748	79%	0.79	S	S	*	*				85.9	139.1	121.6	72.4	0	0	0	0	122.9
35	N	28.5	Very low	28.3	Very low	160 Å²	160	134.7 Å²	134.7	86%	0.856	79%	0.788	S	S	*	*			trans	82.3	100.3	156	-74.1	-5.1	0	0	0	121.2
36	G	26.5	Very low	28.5	Very low	85 Å²	85	132 Å²	132	88%	0.876	79%	0.789	S	S	*	*				83.6	116.3	101.6	0	0	0	0	0	118.1
37	G	25.9	Very low	28.4	Very low	81 Å²	81	130.2 Å²	130.2	84%	0.835	79%	0.787	S	S	*	*			trans	168.9	89.6	167.4	0	0	0	0	0	115.2
38	I	27.7	Very low	28.3	Very low	169 Å²	169	133.7 Å²	133.7	87%	0.867	78%	0.782	S	S	*	*			trans	-31.3	132.3	167.5	-64.4	155.2	0	0	0	115.5
39	S	25.8	Very low	28.5	Very low	92 Å²	92	138 Å²	138	64%	0.643	79%	0.786	S	S	*	*				149.2	131.7	118.6	-164.2	0	0	0	0	113.8
40	E	28.1	Very low	28.3	Very low	161 Å²	161	140.7 Å²	140.7	75%	0.752	79%	0.785	S	S	*	*			trans	88	119	150.9	-87.1	178.9	-156.7	0	0	122.9
41	Q	26.8	Very low	28.3	Very low	160 Å²	160	143.2 Å²	143.2	75%	0.748	79%	0.789	S	S	*	*			trans	90.4	97.1	146	-64	178.4	22.7	0	0	119.5
42	H	27.5	Very low	28.2	Very low	186 Å²	186	143 Å²	143	86%	0.861	80%	0.795	S	S	*	*			trans	38.1	114.3	145	-70.4	-71.4	0	0	0	120.2
43	P	29.9	Very low	28.1	Very low	113 Å²	113	145.2 Å²	145.2	73%	0.734	80%	0.798	S	S	*	*			trans	-106	146.2	143.3	34.7	-23.8	0	0	0	110.7	P45	P43-P45 WeakPolarHBondContact O-CD 3.48Å
44	W	32.9	Very low	28.3	Very low	259 Å²	259	146.8 Å²	146.8	98%	0.981	80%	0.801	S	S	*	*			trans	-63.8	139.2	155.4	-77.2	82.6	0	0	0	109.4
45	P	31.6	Very low	28.3	Very low	106 Å²	106	150.8 Å²	150.8	69%	0.688	81%	0.808	S	S	*	*			trans	-128	144.3	159	33.3	-16.9	0	0	0	113.7	P43	P43-P45 WeakPolarHBondContact O-CD 3.48Å
46	S	32.4	Very low	28.4	Very low	121 Å²	121	149.6 Å²	149.6	85%	0.846	81%	0.806	S	S	*	*			trans	-45.5	147.4	149.8	50.7	0	0	0	0	113.5
47	G	26.7	Very low	28.4	Very low	67 Å²	67	153.4 Å²	153.4	69%	0.691	81%	0.805	S	S	*	*			trans	131.6	122	141.3	0	0	0	0	0	117.5
48	F	26.2	Very low	28.4	Very low	180 Å²	180	154.3 Å²	154.3	79%	0.789	80%	0.799	S	S	*	*			trans	82.2	122.6	135.1	-100.8	-104.4	0	0	0	121.9
49	E	32	Very low	28.4	Very low	155 Å²	155	151.6 Å²	151.6	72%	0.724	79%	0.794	S	S	*	*			trans	40.8	119	138.8	-71.1	178.9	163.6	0	0	120.6
50	R	25.6	Very low	28.9	Very low	216 Å²	216	152.9 Å²	152.9	82%	0.815	80%	0.801	S	S	*	*				-175.1	143.5	109.2	-111.5	177.4	-104.7	174.1	-6	114.6
51	E	29.8	Very low	28.9	Very low	174 Å²	174	148.4 Å²	148.4	81%	0.813	80%	0.797	S	S	*	*			trans	25.6	125	139.9	-66.9	176.6	138.2	0	0	119.7
52	L	26.1	Very low	28.9	Very low	179 Å²	179	149.7 Å²	149.7	94%	0.937	80%	0.803	S	S	*	*			trans	-126	110.6	156.6	-96.4	140.5	0	0	0	109.8
53	K	26.1	Very low	28.9	Very low	191 Å²	191	148.5 Å²	148.5	83%	0.83	80%	0.798	S	S	*	*			trans	-81.9	157	161.1	-102.8	179.2	177.9	173.6	0	109.6
54	P	30.9	Very low	28.8	Very low	121 Å²	121	150.6 Å²	150.6	79%	0.786	80%	0.801	S	S	*	*			trans	-89.4	137.9	-172.2	34.9	-30.1	0	0	0	111.6
55	E	26.8	Very low	28.5	Very low	191 Å²	191	146.2 Å²	146.2	89%	0.893	80%	0.796	S	S	*	*			trans	-113.1	121.6	160.7	-82.4	-170.1	161.2	0	0	110.1
56	T	31.2	Very low	28.2	Very low	134 Å²	134	153 Å²	153	82%	0.822	81%	0.808	S	S	*	*			trans	-58.3	138.4	158.9	24.6	0	0	0	0	111.7
57	I	27	Very low	27.9	Very low	166 Å²	166	151.9 Å²	151.9	85%	0.851	81%	0.805	S	S	*	*			trans	-159.8	144.2	135.1	-90.8	143	0	0	0	109.7
58	S	24.6	Very low	28	Very low	100 Å²	100	155.5 Å²	155.5	70%	0.699	82%	0.815	S	S	*	*			trans	-69.2	147.4	-169.6	52.2	0	0	0	0	118.6
59	S	28.6	Very low	28.1	Very low	111 Å²	111	150.6 Å²	150.6	78%	0.776	82%	0.815	S	S	*	*				53.5	152.5	129	-166.5	0	0	0	0	119.9
60	P	36.3	Very low	27.8	Very low	120 Å²	120	152 Å²	152	78%	0.779	82%	0.821	S	S	*	*			cis	-135.3	171.6	18	27.2	-2.2	0	0	0	116.1
61	G	28.1	Very low	27.9	Very low	66 Å²	66	151.3 Å²	151.3	68%	0.68	83%	0.827	S	S	*	*			trans	-87.2	160.2	177.9	0	0	0	0	0	115.3
62	H	27.6	Very low	27.6	Very low	187 Å²	187	150.6 Å²	150.6	87%	0.866	83%	0.829	S	S	*	*			trans	-165.6	152.4	134.9	-113.9	44	0	0	0	111.8
63	H	27.2	Very low	27.6	Very low	162 Å²	162	150.6 Å²	150.6	75%	0.75	83%	0.826	S	S	*	*			trans	-41	150.5	179.7	-68.3	-95.8	0	0	0	116.9
64	I	27.1	Very low	27.5	Very low	157 Å²	157	146 Å²	146	81%	0.805	82%	0.824	S	S	*	*				-172	119.5	123.7	-90	150.8	0	0	0	110.8
65	L	26	Very low	27.3	Very low	166 Å²	166	146.4 Å²	146.4	87%	0.869	82%	0.824	S	S	*	*			trans	29.5	112.4	146.1	-63.4	150.9	0	0	0	119.7
66	R	25.4	Very low	27.1	Very low	250 Å²	250	142 Å²	142	94%	0.943	82%	0.815	S	S	*	*	P	Polyproline II helix	trans	-99	118.4	160.2	-153.7	175	-166.1	170.6	1.7	109.2
67	A	26.5	Very low	26.9	Very low	96 Å²	96	143.2 Å²	143.2	79%	0.793	82%	0.815	S	S	*	*	P	Polyproline II helix	trans	-68.3	139	173.8	0	0	0	0	0	110.9
68	T	28.6	Very low	26.9	Very low	144 Å²	144	140.9 Å²	140.9	88%	0.883	80%	0.804	S	S	*	*	P	Polyproline II helix	trans	-72.9	135.1	175.8	45.4	0	0	0	0	111.6
69	G	28.3	Very low	27	Very low	77 Å²	77	142.9 Å²	142.9	79%	0.794	81%	0.807	S	S	*	*			trans	169.9	56.9	170.4	0	0	0	0	0	113.4
70	E	26.8	Very low	27	Very low	185 Å²	185	143.8 Å²	143.8	86%	0.864	80%	0.803	S	S	*	*			trans	-130.2	117	161.4	-85.2	-179.8	160.8	0	0	108.2	N72	E70-N72 PolarHBondContact O-N 3.01Å
71	E	26.6	Very low	26.7	Very low	201 Å²	201	142.7 Å²	142.7	94%	0.939	79%	0.794	S	S	*	*			trans	-65.8	107.1	172.6	-75.9	176.1	138.7	0	0	109.1	M73	E71-M73 PolarHBondContact O-N 3.03Å; E71-M73 VanDerWaalsContact O-N 3.08Å
72	N	24.8	Very low	26.7	Very low	158 Å²	158	143.5 Å²	143.5	85%	0.845	79%	0.788	S	S	*	*			trans	-68	99.9	168.1	-80.4	-30.2	0	0	0	109.8	E70 A74	E70-N72 PolarHBondContact O-N 3.01Å; N72-A74 VanDerWaalsContact C-N 3.27Å; N72-A74 PolarHBondContact O-N 3.14Å; N72-A74 VanDerWaalsContact O-N 3.11Å
73	M	25.6	Very low	26.5	Very low	179 Å²	179	140.1 Å²	140.1	88%	0.882	78%	0.775	S	S	*	*			trans	-76.7	86.5	155.8	-131.9	-171.1	-77.5	0	0	107.6	E71 V75	E71-M73 PolarHBondContact O-N 3.03Å; E71-M73 VanDerWaalsContact O-N 3.08Å; M73-V75 PolarHBondContact O-N 3Å
74	A	24.1	Very low	26.4	Very low	95 Å²	95	138.9 Å²	138.9	79%	0.785	77%	0.773	S	S	*	*			trans	-68.7	95	174.7	0	0	0	0	0	109.8	N72 S76	N72-A74 VanDerWaalsContact C-N 3.27Å; N72-A74 PolarHBondContact O-N 3.14Å; N72-A74 VanDerWaalsContact O-N 3.11Å; A74-S76 PolarHBondContact O-N 3.45Å
75	V	25.8	Very low	26.4	Very low	130 Å²	130	137.9 Å²	137.9	79%	0.788	77%	0.768	S	S	*	*			trans	-75.4	119	163.7	177.8	0	0	0	0	107.4	M73 L77	M73-V75 PolarHBondContact O-N 3Å; V75-L77 PolarHBondContact O-N 3.41Å
76	S	23.3	Very low	26.5	Very low	99 Å²	99	136 Å²	136	69%	0.692	76%	0.764	S	S	*	*			trans	-58.2	128.5	-171.8	60.6	0	0	0	0	113.2	A74 D78	A74-S76 PolarHBondContact O-N 3.45Å; S76-D78 PolarHBondContact O-N 2.93Å
77	L	27.8	Very low	26.5	Very low	158 Å²	158	132 Å²	132	83%	0.827	76%	0.76	S	S	*	*			trans	-81.1	10	172	-96.6	154.5	0	0	0	114.2	V75	V75-L77 PolarHBondContact O-N 3.41Å
78	D	26.5	Very low	26.5	Very low	117 Å²	117	134.7 Å²	134.7	63%	0.626	76%	0.761	S	S	*	*			trans	-112.1	75.7	-171.5	-81.8	-33.7	0	0	0	113.7	S76	S76-D78 PolarHBondContact O-N 2.93Å
79	D	26.2	Very low	26.4	Very low	142 Å²	142	136.7 Å²	136.7	76%	0.759	76%	0.761	S	S	*	*	S	Bend	trans	-133.7	11.4	164.6	-125.8	-11.2	0	0	0	114.4
80	D	29.3	Very low	26.3	Very low	131 Å²	131	136.9 Å²	136.9	70%	0.701	76%	0.763	S	S	*	*	S	Bend	trans	-116	16.2	174.2	-95.8	-22.9	0	0	0	114.1
81	V	29.6	Very low	26.1	Very low	97 Å²	97	131.8 Å²	131.8	59%	0.588	76%	0.76	S	S	*	*	S	Bend	trans	-138.1	118.7	171.5	-175.5	0	0	0	0	109.7	L83	V81-L83 PolarHBondContact O-N 3.17Å; V81-L83 VanDerWaalsContact O-N 3.13Å
82	P	27.2	Very low	26.1	Very low	83 Å²	83	127.8 Å²	127.8	54%	0.539	75%	0.754	S	S	.	*			trans	-82.2	98.5	169.3	35.2	-32.9	0	0	0	108.3	I84 R241	P82-I84 PolarHBondContact O-N 3.4Å; P82-R241 VanDerWaalsContact CG-CZ 3.44Å; P82-R241 VanDerWaalsContact CG-NH2 3.34Å; P82-R241 PolarHBondContact O-NH2 3.27Å
83	L	23.8	Very low	26	Very low	116 Å²	116	124.9 Å²	124.9	61%	0.607	75%	0.752	S	S	*	*			trans	-51	124.3	170.4	-126.3	82.4	0	0	0	110	V81 L85	V81-L83 PolarHBondContact O-N 3.17Å; V81-L83 VanDerWaalsContact O-N 3.13Å; L83-L85 HydrophobicContact CD2-CD1 3.75Å; L83-L85 HydrophobicContact CD2-CG 3.76Å
84	I	25.7	Very low	26.4	Very low	136 Å²	136	122.3 Å²	122.3	70%	0.697	75%	0.749	S	S	*	*			trans	-97.3	108.8	153.1	-68.9	170.9	0	0	0	103.6	P82	P82-I84 PolarHBondContact O-N 3.4Å
85	L	25.9	Very low	26.5	Very low	135 Å²	135	125.9 Å²	125.9	71%	0.707	75%	0.754	S	S	*	*			trans	-87.2	124.6	161.4	-90	164.8	0	0	0	108.2	L83 L87	L83-L85 HydrophobicContact CD2-CD1 3.75Å; L83-L85 HydrophobicContact CD2-CG 3.76Å; L85-L87 PolarHBondContact O-N 3.47Å
86	T	28.1	Very low	26.5	Very low	127 Å²	127	123.9 Å²	123.9	78%	0.779	75%	0.751	S	S	*	*			trans	-43	122.7	159.7	46	0	0	0	0	111.1
87	L	25.8	Very low	27.1	Very low	166 Å²	166	125 Å²	125	87%	0.869	76%	0.756	S	S	*	*			trans	-112.2	109.1	157	-114.4	153.7	0	0	0	106.5	L85	L85-L87 PolarHBondContact O-N 3.47Å
88	D	27.1	Very low	27.1	Very low	153 Å²	153	122 Å²	122	82%	0.818	75%	0.748	S	S	*	*			trans	-84.2	117	171.3	-154.7	14.7	0	0	0	106.3
89	E	27.1	Very low	27.1	Very low	185 Å²	185	124.3 Å²	124.3	86%	0.864	76%	0.761	S	S	*	*			trans	-126.9	105.8	160.6	-95.8	-168.6	163.3	0	0	107.7
90	G	25.5	Very low	27.1	Very low	82 Å²	82	120.6 Å²	120.6	85%	0.845	76%	0.755	S	S	*	*			trans	-75.2	131.4	165	0	0	0	0	0	110.4
91	G	23.4	Very low	26.9	Very low	78 Å²	78	123 Å²	123	80%	0.804	77%	0.768	S	S	*	*			trans	-165.6	111.2	173.3	0	0	0	0	0	111.1
92	S	24.9	Very low	26.7	Very low	117 Å²	117	122.4 Å²	122.4	82%	0.818	78%	0.78	S	S	*	*			trans	-76.5	135.9	-175.3	41.2	0	0	0	0	115.3
93	A	23.9	Very low	26.7	Very low	96 Å²	96	127 Å²	127	79%	0.793	80%	0.795	S	S	*	*			trans	68.5	162.3	151.7	0	0	0	0	0	119.1
94	P	33.3	Very low	26.8	Very low	125 Å²	125	129.8 Å²	129.8	81%	0.812	81%	0.805	S	S	*	*			cis	-133.9	-176.9	5.8	37.9	-16.7	0	0	0	116.9
95	L	26.1	Very low	26.7	Very low	170 Å²	170	131.5 Å²	131.5	89%	0.89	81%	0.81	S	S	*	*			trans	-53	155.2	-179.8	-75.4	127.5	0	0	0	119.1
96	A	26.6	Very low	26.7	Very low	89 Å²	89	132.6 Å²	132.6	74%	0.736	82%	0.815	S	S	*	*			trans	84.4	159.9	142	0	0	0	0	0	119.9
97	P	34.3	Very low	27	Very low	121 Å²	121	132.2 Å²	132.2	79%	0.786	82%	0.815	S	S	*	*			cis	-134.4	176.9	-23	26	-2.9	0	0	0	115.3
98	S	28.6	Very low	27.1	Very low	97 Å²	97	129.1 Å²	129.1	68%	0.678	81%	0.807	S	S	*	*			trans	-45.7	151.5	162.3	51.6	0	0	0	0	117.5
99	N	26.5	Very low	27.1	Very low	165 Å²	165	132 Å²	132	88%	0.882	81%	0.812	S	S	*	*			trans	155.6	140.3	139.7	-80.3	-12.6	0	0	0	108.1
100	G	25.7	Very low	27.1	Very low	63 Å²	63	131.2 Å²	131.2	65%	0.649	81%	0.814	S	S	*	*			cis	177.2	157	2.6	0	0	0	0	0	108.8
101	L	26.3	Very low	27.1	Very low	183 Å²	183	131.1 Å²	131.1	96%	0.958	81%	0.814	S	S	*	*			trans	42.9	131.7	141.1	-72.9	147.3	0	0	0	121.2
102	G	25.3	Very low	27.2	Very low	83 Å²	83	131.2 Å²	131.2	86%	0.856	81%	0.814	S	S	*	*			trans	172	102.1	157.5	0	0	0	0	0	113.7
103	Q	26	Very low	27.2	Very low	180 Å²	180	130.8 Å²	130.8	84%	0.841	81%	0.812	S	S	*	*			trans	-95.2	168.6	-173.6	-158.2	170.9	-0.5	0	0	110.9
104	E	25.9	Very low	27.4	Very low	175 Å²	175	137.3 Å²	137.3	82%	0.818	82%	0.817	S	S	*	*			trans	132.9	106.1	154.1	-75.9	177.2	178.2	0	0	112.5
105	E	24.3	Very low	27	Very low	172 Å²	172	136 Å²	136	80%	0.804	82%	0.817	S	S	*	*				97.6	109.4	74.5	-85.9	-167.4	173.9	0	0	113.6
106	L	26.4	Very low	27	Very low	157 Å²	157	135.7 Å²	135.7	82%	0.822	81%	0.814	S	S	*	*			trans	14.4	157.3	138.5	-77.5	146.4	0	0	0	120.5
107	P	34.6	Very low	27	Very low	120 Å²	120	140.2 Å²	140.2	78%	0.779	82%	0.82	S	S	*	*			cis	-149.5	174.2	41.1	37.2	-13.4	0	0	0	119.3
108	S	27.2	Very low	26.6	Very low	100 Å²	100	142.2 Å²	142.2	70%	0.699	82%	0.824	S	S	*	*			trans	-58.2	152.9	172.7	57.7	0	0	0	0	116.7
109	K	27.7	Very low	26.5	Very low	213 Å²	213	143.2 Å²	143.2	93%	0.926	83%	0.831	S	S	*	*			trans	-145.6	124.6	147.5	-122.2	176.5	-176.9	177	0	112.2
110	N	27.7	Very low	26.5	Very low	169 Å²	169	145 Å²	145	90%	0.904	83%	0.834	S	S	*	*			trans	-70.7	154.3	172.4	-87.3	-22.1	0	0	0	112.6
111	G	25.4	Very low	26.4	Very low	81 Å²	81	146 Å²	146	84%	0.835	84%	0.837	S	S	*	*			trans	132.4	115.3	139.7	0	0	0	0	0	115.8
112	G	24.9	Very low	26.7	Very low	79 Å²	79	143.5 Å²	143.5	81%	0.814	83%	0.831	S	S	*	*			trans	147.4	87.1	158.5	0	0	0	0	0	115.1
113	S	24.6	Very low	26.7	Very low	109 Å²	109	145 Å²	145	76%	0.762	83%	0.828	S	S	*	*			trans	-79.1	128.4	167.8	177.4	0	0	0	0	110.5
114	Y	28	Very low	26.7	Very low	233 Å²	233	144.9 Å²	144.9	91%	0.914	83%	0.833	S	S	*	*			trans	-147.5	124	150.5	-80.5	-73.8	0	0	0	109.5
115	A	25.1	Very low	26.8	Very low	97 Å²	97	142 Å²	142	80%	0.802	83%	0.832	S	S	*	*			trans	-83.3	136.1	-178.1	0	0	0	0	0	111.6
116	I	26.9	Very low	27.1	Very low	163 Å²	163	139.5 Å²	139.5	84%	0.836	83%	0.833	S	S	*	*			trans	-134	130.1	156.8	-62.5	-173.7	0	0	0	107.6	D118	I116-D118 PolarHBondContact O-N 3.34Å
117	H	25.6	Very low	27.2	Very low	185 Å²	185	141 Å²	141	86%	0.856	84%	0.836	S	S	*	*			trans	-53.4	121.3	-178.5	-96.4	-94.7	0	0	0	112.9
118	D	25.2	Very low	27	Very low	163 Å²	163	139.5 Å²	139.5	87%	0.872	84%	0.842	S	S	*	*			trans	-113	134.8	161.9	-100	-29.8	0	0	0	111.4	I116	I116-D118 PolarHBondContact O-N 3.34Å
119	S	27.9	Very low	26.9	Very low	117 Å²	117	137.6 Å²	137.6	82%	0.818	84%	0.838	S	S	*	*			trans	-76.3	138.9	177.8	-58.3	0	0	0	0	109.8	A121	S119-A121 PolarHBondContact O-N 3.39Å
120	Q	25.5	Very low	27.6	Very low	203 Å²	203	133.7 Å²	133.7	95%	0.949	84%	0.838	S	S	*	*			trans	-51.5	117.9	-169.1	-70.2	167.6	-26.9	0	0	114.9
121	A	24.8	Very low	27.6	Very low	85 Å²	85	130.5 Å²	130.5	70%	0.702	83%	0.829	S	S	*	*			trans	-108.3	133.9	148	0	0	0	0	0	107.7	S119 S123	S119-A121 PolarHBondContact O-N 3.39Å; A121-S123 PolarHBondContact O-N 3.22Å
122	P	30.6	Very low	28.3	Very low	130 Å²	130	132.7 Å²	132.7	84%	0.844	83%	0.828	S	S	*	*			trans	-73.8	119.2	179	22	-19.8	0	0	0	110.2
123	S	25.4	Very low	28.8	Very low	114 Å²	114	133 Å²	133	80%	0.797	82%	0.818	S	S	*	*			trans	-73.8	127.4	172.3	41.8	0	0	0	0	110.9	A121 S125	A121-S123 PolarHBondContact O-N 3.22Å; S123-S125 PolarHBondContact O-N 2.87Å
124	L	27.8	Very low	29.9	Very low	178 Å²	178	131 Å²	131	93%	0.932	80%	0.804	S	S	*	*			trans	-79	110.7	161.3	-95.9	114.6	0	0	0	108.5
125	S	26.7	Very low	31.4	Very low	114 Å²	114	124.8 Å²	124.8	80%	0.797	79%	0.792	S	S	*	*			trans	-73.1	126.1	164.9	45.3	0	0	0	0	110.1	S123	S123-S125 PolarHBondContact O-N 2.87Å
126	S	31.8	Very low	33.1	Very low	119 Å²	119	123.4 Å²	123.4	83%	0.832	78%	0.78	S	S	*	*			trans	-82.9	107.8	168	163.5	0	0	0	0	108.9
127	E	26.8	Very low	35	Very low	190 Å²	190	120.6 Å²	120.6	89%	0.888	76%	0.764	S	S	*	*			trans	-138.5	138.9	152.3	-83.5	-166.3	155.5	0	0	109.8
128	G	31.3	Very low	37.7	Very low	87 Å²	87	116.3 Å²	116.3	90%	0.897	75%	0.747	S	S	*	*			trans	-66.8	147.7	-165.5	0	0	0	0	0	114.7
129	G	25	Very low	40.6	Very low	61 Å²	61	112.8 Å²	112.8	63%	0.629	72%	0.722	S	S	*	*			trans	165.4	94	171.6	0	0	0	0	0	109.2	S131	G129-S131 PolarHBondContact O-N 2.97Å; G129-S131 PolarHBondContact O-OG 3Å
130	S	41.7	Very low	43.4	Very low	131 Å²	131	112.2 Å²	112.2	92%	0.916	71%	0.706	S	S	*	*			trans	-50	97.6	167.6	52.7	0	0	0	0	110
131	S	29.1	Very low	46.4	Very low	102 Å²	102	106.8 Å²	106.8	71%	0.713	68%	0.682	S	S	*	*			trans	-89	140.5	168.1	-6.9	0	0	0	0	107.6	G129 S133	G129-S131 PolarHBondContact O-N 2.97Å; G129-S131 PolarHBondContact O-OG 3Å; S131-S133 PolarHBondContact O-N 2.65Å
132	P	38.7	Very low	49.6	Very low	127 Å²	127	104.2 Å²	104.2	83%	0.825	66%	0.656	S	S	*	*			trans	-64.3	115	178.4	26.7	-31.1	0	0	0	108	S134	P132-S134 PolarHBondContact O-N 3.24Å; P132-S134 VanDerWaalsContact O-N 3.14Å
133	S	37.4	Very low	52.5	Low	85 Å²	85	99.2 Å²	99.2	59%	0.594	62%	0.621	S	S	*	*			trans	-49.7	121.5	174.9	54	0	0	0	0	109	S131	S131-S133 PolarHBondContact O-N 2.65Å
134	S	47.6	Very low	55.7	Low	66 Å²	66	95.1 Å²	95.1	46%	0.462	59%	0.589	S	S	.	*			trans	-55.7	142.9	177.2	65.3	0	0	0	0	109.8	P132 A136 H137 N138	P132-S134 PolarHBondContact O-N 3.24Å; P132-S134 VanDerWaalsContact O-N 3.14Å; S134-A136 PolarHBondContact O-N 3.15Å; S134-H137 PolarHBondContact O-N 3.48Å; S134-N138 PolarHBondContact O-N 3.15Å
135	P	59.3	Low	58.8	Low	104 Å²	104	89.7 Å²	89.7	68%	0.675	56%	0.559	S	S	*	*	H	α-helix	trans	-57.3	-24.3	179.2	19.4	-30.4	0	0	0	112.6	W139	P135-W139 PolarHBondContact O-N 3.44Å
136	A	59.9	Low	62	Low	67 Å²	67	84.3 Å²	84.3	55%	0.554	52%	0.521	S	S	*	.	H	α-helix	trans	-65.7	-41.1	174	0	0	0	0	0	113.2	S134 N138 W139 E140	S134-A136 PolarHBondContact O-N 3.15Å; A136-N138 VanDerWaalsContact C-N 3.3Å; A136-N138 PolarHBondContact O-N 3.41Å; A136-W139 PolarHBondContact O-N 3.3Å; A136-E140 PolarHBondContact O-N 3.32Å
137	H	66.9	Low	65	Low	104 Å²	104	78.7 Å²	78.7	48%	0.481	48%	0.482	S	S	.	.	H	α-helix	trans	-66.9	-33.7	179.4	-170.6	53.6	0	0	0	112.1	S134 E140 M141	S134-H137 PolarHBondContact O-N 3.48Å; H137-E140 PolarHBondContact O-N 3.03Å; H137-M141 PolarHBondContact O-N 3.45Å
138	N	81.6	Confident	68.3	Low	95 Å²	95	69.8 Å²	69.8	51%	0.508	44%	0.44	S	S	.	.	H	α-helix	trans	-66.3	-39.7	176.8	-163.8	5.7	0	0	0	112.2	S134 A136 N142	S134-N138 PolarHBondContact O-N 3.15Å; A136-N138 VanDerWaalsContact C-N 3.3Å; A136-N138 PolarHBondContact O-N 3.41Å; N138-N142 PolarHBondContact O-N 2.85Å; N138-N142 PolarHBondContact O-ND2 2.87Å
139	W	86.1	Confident	71.3	Confident	90 Å²	90	67.1 Å²	67.1	34%	0.341	40%	0.403	S	S	.	.	H	α-helix	trans	-70.4	-35.4	177.5	-80.5	107.5	0	0	0	113.4	P135 A136 M141 N142 Y143 Q434	P135-W139 PolarHBondContact O-N 3.44Å; A136-W139 PolarHBondContact O-N 3.3Å; W139-M141 VanDerWaalsContact C-N 3.33Å; W139-M141 PolarHBondContact O-N 2.95Å; W139-N142 HydrophobicContact CE3-CB 4.45Å; W139-N142 PolarHBondContact O-N 3.42Å; W139-Y143 HydrophobicContact CB-CE2 4.05Å; W139-Y143 AromaticContact CE3-CE1 3.9Å; W139-Y143 HydrophobicContact CE3-CE1 3.9Å; W139-Y143 WeakPolarHBondContact O-CD2 3.37Å; W139-Y143 PolarHBondContact O-N 2.98Å; W139-Q434 HydrophobicContact CE3-CG 4.34Å; W139-Q434 HydrophobicContact CH2-CG 4.39Å; W139-Q434 HydrophobicContact CZ3-CG 3.9Å
140	E	88.6	Confident	74.7	Confident	104 Å²	104	64.2 Å²	64.2	49%	0.486	37%	0.373	S	S	.	.	H	α-helix	trans	-63	-41.5	177.8	-169.3	171.3	-165	0	0	111.9	A136 H137 Y143 Q144 F441	A136-E140 PolarHBondContact O-N 3.32Å; H137-E140 PolarHBondContact O-N 3.03Å; E140-Y143 PolarHBondContact O-N 3.29Å; E140-Q144 PolarHBondContact O-N 3.34Å; E140-F441 HydrophobicContact CG-CE2 3.95Å; E140-F441 HydrophobicContact CG-CZ 3.71Å
141	M	87.8	Confident	77.1	Confident	89 Å²	89	60.5 Å²	60.5	44%	0.438	34%	0.342	S	S	.	.	H	α-helix	trans	-61.9	-43.6	173.1	-69.7	-60.6	-61.6	0	0	111.9	H137 W139 Y143 Q144 E145 L169	H137-M141 PolarHBondContact O-N 3.45Å; W139-M141 VanDerWaalsContact C-N 3.33Å; W139-M141 PolarHBondContact O-N 2.95Å; M141-Y143 VanDerWaalsContact C-N 3.3Å; M141-Y143 PolarHBondContact O-N 3.22Å; M141-Q144 PolarHBondContact O-N 3.1Å; M141-E145 WeakPolarHBondContact O-CB 3.18Å; M141-E145 PolarHBondContact O-N 3.15Å; M141-L169 HydrophobicContact CE-CD2 4.34Å
142	N	91.1	Very high	80.2	Confident	32 Å²	32	55.7 Å²	55.7	17%	0.171	31%	0.308	C	S	.	.	H	α-helix	trans	-61.3	-37.5	175.6	-69.2	-17.5	0	0	0	112.3	N138 W139 A146 L420	N138-N142 PolarHBondContact O-N 2.85Å; N138-N142 PolarHBondContact O-ND2 2.87Å; W139-N142 HydrophobicContact CE3-CB 4.45Å; W139-N142 PolarHBondContact O-N 3.42Å; N142-A146 VanDerWaalsContact O-CB 3.25Å; N142-A146 WeakPolarHBondContact O-CB 3.39Å; N142-A146 PolarHBondContact O-N 3.49Å; N142-L420 HydrophobicContact CB-CD1 4.46Å; N142-L420 HydrophobicContact CB-CD2 4.33Å; N142-L420 HydrophobicContact CB-CG 4.07Å; N142-L420 VanDerWaalsContact O-CD2 3.26Å; N142-L420 WeakPolarHBondContact O-CD2 3.48Å
143	Y	92.9	Very high	82.9	Confident	25 Å²	25	49.7 Å²	49.7	10%	0.098	27%	0.269	C	S	.	.	H	α-helix	trans	-67.6	-42.5	176.6	-58.9	-33.6	0	0	0	112.1	W139 E140 M141 A147 L421 Q434	W139-Y143 HydrophobicContact CB-CE2 4.05Å; W139-Y143 AromaticContact CE3-CE1 3.9Å; W139-Y143 HydrophobicContact CE3-CE1 3.9Å; W139-Y143 WeakPolarHBondContact O-CD2 3.37Å; W139-Y143 PolarHBondContact O-N 2.98Å; E140-Y143 PolarHBondContact O-N 3.29Å; M141-Y143 VanDerWaalsContact C-N 3.3Å; M141-Y143 PolarHBondContact O-N 3.22Å; Y143-A147 WeakPolarHBondContact O-CB 3.28Å; Y143-A147 PolarHBondContact O-N 3.04Å; Y143-L421 HydrophobicContact CD1-CD2 3.63Å; Y143-L421 HydrophobicContact CE1-CD2 4.02Å; Y143-Q434 HydrophobicContact CE1-CB 4.04Å; Y143-Q434 HydrophobicContact CE1-CG 4.11Å
144	Q	92.1	Very high	85.4	Confident	28 Å²	28	49.6 Å²	49.6	13%	0.131	26%	0.26	C	S	.	.	H	α-helix	trans	-63.1	-46.1	176.3	179.9	65.1	4.5	0	0	111.1	E140 M141 A147 I148 L169 F441	E140-Q144 PolarHBondContact O-N 3.34Å; M141-Q144 PolarHBondContact O-N 3.1Å; Q144-A147 WeakPolarHBondContact O-CB 3.3Å; Q144-A147 PolarHBondContact O-N 3.31Å; Q144-I148 HydrophobicContact CG-CD1 4.21Å; Q144-I148 VanDerWaalsContact O-CG1 3.31Å; Q144-I148 WeakPolarHBondContact O-CG1 3.29Å; Q144-I148 PolarHBondContact O-N 2.93Å; Q144-L169 HydrophobicContact CG-CD1 4.39Å; Q144-F441 HydrophobicContact CB-CD2 4.41Å; Q144-F441 HydrophobicContact CB-CG 4.44Å
145	E	93.3	Very high	87.4	Confident	64 Å²	64	48.3 Å²	48.3	30%	0.299	25%	0.247	S	C	.	.	H	α-helix	trans	-64.5	-44.5	178.7	-170.1	-172.5	164.9	0	0	111.6	M141 A147 I148 Y149 H162 L420	M141-E145 WeakPolarHBondContact O-CB 3.18Å; M141-E145 PolarHBondContact O-N 3.15Å; E145-A147 VanDerWaalsContact C-N 3.3Å; E145-A147 PolarHBondContact O-N 3.25Å; E145-I148 WeakPolarHBondContact O-CB 3.49Å; E145-I148 PolarHBondContact O-N 3.27Å; E145-I148 VanDerWaalsContact O-N 3.12Å; E145-Y149 HydrophobicContact CG-CD2 4.23Å; E145-Y149 HydrophobicContact CG-CE2 3.78Å; E145-Y149 VanDerWaalsContact O-CD2 3.27Å; E145-Y149 WeakPolarHBondContact O-CD2 3.27Å; E145-Y149 PolarHBondContact O-N 3.42Å; E145-Y149 WeakPolarHBondContact OE1-CE2 3.48Å; E145-H162 VanDerWaalsContact CG-NE2 3.26Å; E145-H162 WeakPolarHBondContact CG-NE2 3.21Å; E145-H162 IonicContact OE1-NE2 3.6Å; E145-L420 HydrophobicContact CB-CD2 3.69Å; E145-L420 HydrophobicContact CG-CD2 3.87Å
146	A	94.2	Very high	88.8	Confident	0 Å²	0	45.2 Å²	45.2	0%	0	23%	0.225	C	C	.	.	H	α-helix	trans	-60.7	-39.3	174.8	0	0	0	0	0	112.2	N142 I148 Y149 L150 A417 L420 L421 L438	N142-A146 VanDerWaalsContact O-CB 3.25Å; N142-A146 WeakPolarHBondContact O-CB 3.39Å; N142-A146 PolarHBondContact O-N 3.49Å; A146-I148 VanDerWaalsContact C-N 3.33Å; A146-Y149 PolarHBondContact O-N 2.91Å; A146-L150 WeakPolarHBondContact O-CD1 3.31Å; A146-L150 PolarHBondContact O-N 3.37Å; A146-A417 HydrophobicContact CB-CB 4.15Å; A146-L420 HydrophobicContact CB-CD2 4.12Å; A146-L421 HydrophobicContact CB-CD1 3.94Å; A146-L421 HydrophobicContact CB-CD2 3.95Å; A146-L421 HydrophobicContact CB-CG 3.87Å; A146-L438 HydrophobicContact CB-CD1 3.81Å
147	A	94.6	Very high	90.2	Very high	1 Å²	1	43.9 Å²	43.9	1%	0.008	21%	0.209	C	C	.	.	H	α-helix	trans	-64.2	-38.6	175.2	0	0	0	0	0	111.9	Y143 Q144 E145 L150 Q151 L438 F441	Y143-A147 WeakPolarHBondContact O-CB 3.28Å; Y143-A147 PolarHBondContact O-N 3.04Å; Q144-A147 WeakPolarHBondContact O-CB 3.3Å; Q144-A147 PolarHBondContact O-N 3.31Å; E145-A147 VanDerWaalsContact C-N 3.3Å; E145-A147 PolarHBondContact O-N 3.25Å; A147-L150 PolarHBondContact O-N 3.48Å; A147-Q151 VanDerWaalsContact O-CG 3.31Å; A147-Q151 WeakPolarHBondContact O-CG 3.46Å; A147-Q151 PolarHBondContact O-N 3.44Å; A147-L438 HydrophobicContact CB-CD1 4.06Å; A147-F441 HydrophobicContact CB-CB 3.64Å
148	I	94.7	Very high	91.3	Very high	3 Å²	3	45.4 Å²	45.4	2%	0.015	21%	0.214	C	C	.	.	H	α-helix	trans	-64.4	-44.7	175.8	-69.1	165.5	0	0	0	110.7	Q144 E145 A146 L150 Q151 E152 P163 L169 Y172	Q144-I148 HydrophobicContact CG-CD1 4.21Å; Q144-I148 VanDerWaalsContact O-CG1 3.31Å; Q144-I148 WeakPolarHBondContact O-CG1 3.29Å; Q144-I148 PolarHBondContact O-N 2.93Å; E145-I148 WeakPolarHBondContact O-CB 3.49Å; E145-I148 PolarHBondContact O-N 3.27Å; E145-I148 VanDerWaalsContact O-N 3.12Å; A146-I148 VanDerWaalsContact C-N 3.33Å; I148-L150 VanDerWaalsContact C-N 3.3Å; I148-L150 PolarHBondContact O-N 3.24Å; I148-Q151 CarbonylContact O-C 3.55Å; I148-Q151 WeakPolarHBondContact O-CB 3.35Å; I148-Q151 PolarHBondContact O-N 2.89Å; I148-E152 HydrophobicContact CG2-CG 4.09Å; I148-E152 WeakPolarHBondContact O-CG 3.39Å; I148-E152 PolarHBondContact O-N 3.44Å; I148-P163 HydrophobicContact CD1-CG 4.18Å; I148-P163 HydrophobicContact CG2-CG 4.2Å; I148-L169 HydrophobicContact CD1-CD1 3.31Å; I148-Y172 HydrophobicContact CD1-CD1 4.42Å; I148-Y172 HydrophobicContact CG1-CD1 4.4Å; I148-Y172 HydrophobicContact CG1-CE1 4.02Å; I148-Y172 HydrophobicContact CG2-CD1 4.44Å; I148-Y172 HydrophobicContact CG2-CE1 3.87Å; I148-Y172 HydrophobicContact CG2-CE2 4.27Å
149	Y	95.4	Very high	91.6	Very high	32 Å²	32	43.2 Å²	43.2	13%	0.125	20%	0.2	C	C	.	.	H	α-helix	trans	-56	-44.8	174.9	-80.2	-67.1	0	0	0	112.1	E145 A146 Q151 E152 G153 F159 H162 A413 H416	E145-Y149 HydrophobicContact CG-CD2 4.23Å; E145-Y149 HydrophobicContact CG-CE2 3.78Å; E145-Y149 VanDerWaalsContact O-CD2 3.27Å; E145-Y149 WeakPolarHBondContact O-CD2 3.27Å; E145-Y149 PolarHBondContact O-N 3.42Å; E145-Y149 WeakPolarHBondContact OE1-CE2 3.48Å; A146-Y149 PolarHBondContact O-N 2.91Å; Y149-Q151 VanDerWaalsContact C-N 3.32Å; Y149-Q151 PolarHBondContact O-N 3.46Å; Y149-E152 PolarHBondContact O-N 3.31Å; Y149-G153 PolarHBondContact O-N 2.94Å; Y149-F159 HydrophobicContact CD1-CD1 4.02Å; Y149-F159 HydrophobicContact CD1-CE1 4.31Å; Y149-F159 HydrophobicContact CE1-CD1 4.33Å; Y149-H162 AromaticContact CD1-CE1 3.87Å; Y149-H162 AromaticContact CD1-ND1 3.85Å; Y149-H162 AromaticContact CD2-CE1 3.71Å; Y149-H162 AromaticContact CE1-CE1 3.67Å; Y149-H162 AromaticContact CE1-CG 3.93Å; Y149-H162 AromaticContact CE1-ND1 3.54Å; Y149-H162 AromaticContact CE2-CE1 3.49Å; Y149-H162 VanDerWaalsContact CE2-CE1 3.49Å; Y149-H162 WeakPolarHBondContact CE2-CE1 3.32Å; Y149-H162 AromaticContact CE2-NE2 3.52Å; Y149-H162 AromaticContact CG-CE1 3.89Å; Y149-H162 AromaticContact CZ-CD2 3.76Å; Y149-H162 AromaticContact CZ-CE1 3.45Å; Y149-H162 VanDerWaalsContact CZ-CE1 3.45Å; Y149-H162 AromaticContact CZ-CG 3.89Å; Y149-H162 AromaticContact CZ-ND1 3.71Å; Y149-H162 AromaticContact CZ-NE2 3.49Å; Y149-H162 PolarHBondContact OH-CD2 3.03Å; Y149-A413 VanDerWaalsContact O-CB 3.3Å; Y149-A413 WeakPolarHBondContact O-CB 3.24Å; Y149-H416 HydrophobicContact CD1-CB 3.83Å; Y149-H416 HydrophobicContact CD2-CB 4.33Å; Y149-H416 HydrophobicContact CE1-CB 4.03Å; Y149-H416 HydrophobicContact CG-CB 4Å
150	L	95.3	Very high	91.6	Very high	0 Å²	0	47.3 Å²	47.3	0%	0	22%	0.221	C	C	.	.	H	α-helix	trans	-62.6	-39.4	176.5	-96.2	69.4	0	0	0	112.2	A146 A147 I148 E154 A417 L438 Y442 I474 Y475	A146-L150 WeakPolarHBondContact O-CD1 3.31Å; A146-L150 PolarHBondContact O-N 3.37Å; A147-L150 PolarHBondContact O-N 3.48Å; I148-L150 VanDerWaalsContact C-N 3.3Å; I148-L150 PolarHBondContact O-N 3.24Å; L150-E154 PolarHBondContact O-N 3.41Å; L150-A417 HydrophobicContact CD1-CB 3.16Å; L150-L438 HydrophobicContact CD2-CD2 4.33Å; L150-Y442 HydrophobicContact CB-CD2 3.7Å; L150-Y442 HydrophobicContact CB-CE2 3.55Å; L150-Y442 HydrophobicContact CD2-CD1 4.19Å; L150-Y442 HydrophobicContact CD2-CD2 4.08Å; L150-Y442 HydrophobicContact CD2-CE1 4.17Å; L150-Y442 HydrophobicContact CD2-CE2 4.08Å; L150-Y442 HydrophobicContact CD2-CG 4.16Å; L150-Y442 HydrophobicContact CG-CE2 4.41Å; L150-I474 HydrophobicContact CD2-CD1 3.63Å; L150-I474 HydrophobicContact CD2-CG1 4.1Å; L150-I474 HydrophobicContact CD2-CG2 4.35Å; L150-Y475 WeakPolarHBondContact CA-OH 3.26Å; L150-Y475 HydrophobicContact CG-CE1 4.49Å; L150-Y475 WeakPolarHBondContact O-CE1 3.47Å; L150-Y475 PolarHBondContact O-OH 3.5Å
151	Q	93.8	Very high	91.5	Very high	53 Å²	53	43.4 Å²	43.4	25%	0.248	20%	0.204	C	C	.	.	H	α-helix	trans	-67.2	-45.9	176.4	-71	173.9	7.7	0	0	111.7	A147 I148 Y149 G153 E154 N155 Y442	A147-Q151 VanDerWaalsContact O-CG 3.31Å; A147-Q151 WeakPolarHBondContact O-CG 3.46Å; A147-Q151 PolarHBondContact O-N 3.44Å; I148-Q151 CarbonylContact O-C 3.55Å; I148-Q151 WeakPolarHBondContact O-CB 3.35Å; I148-Q151 PolarHBondContact O-N 2.89Å; Y149-Q151 VanDerWaalsContact C-N 3.32Å; Y149-Q151 PolarHBondContact O-N 3.46Å; Q151-G153 VanDerWaalsContact C-N 3.3Å; Q151-G153 PolarHBondContact O-N 3.39Å; Q151-E154 PolarHBondContact O-N 3.2Å; Q151-N155 WeakPolarHBondContact O-CB 3.09Å; Q151-N155 PolarHBondContact O-N 3.02Å; Q151-N155 PolarHBondContact O-ND2 3.34Å; Q151-Y442 HydrophobicContact CG-CD2 4.05Å; Q151-Y442 HydrophobicContact CG-CE2 4.12Å
152	E	94.2	Very high	91.5	Very high	0 Å²	0	39.9 Å²	39.9	0%	0	19%	0.186	C	C	.	.	H	α-helix	trans	-60.4	-39.7	175.2	-72.2	-178.7	161.1	0	0	111.7	I148 Y149 N155 N156 D157 F159 H162 Y172	I148-E152 HydrophobicContact CG2-CG 4.09Å; I148-E152 WeakPolarHBondContact O-CG 3.39Å; I148-E152 PolarHBondContact O-N 3.44Å; Y149-E152 PolarHBondContact O-N 3.31Å; E152-N155 PolarHBondContact O-N 3.15Å; E152-N156 PolarHBondContact O-N 2.87Å; E152-D157 HydrophobicContact CB-CB 4.29Å; E152-D157 HydrophobicContact CG-CB 4.33Å; E152-D157 PolarHBondContact O-N 3.47Å; E152-F159 HydrophobicContact CB-CD1 4.46Å; E152-F159 HydrophobicContact CB-CE1 4.25Å; E152-H162 IonicContact OE1-ND1 3.68Å; E152-H162 IonicContact OE2-CE1 3.81Å; E152-H162 IonicContact OE2-CG 2.75Å; E152-H162 IonicContact OE2-ND1 3.4Å; E152-H162 PolarHBondContact OE2-ND1 3.38Å; E152-Y172 HydrophobicContact CG-CE2 4.12Å
153	G	93.3	Very high	91.4	Very high	2 Å²	2	39 Å²	39	2%	0.021	18%	0.182	C	C	.	.	H	α-helix	trans	-61.9	-45.5	173	0	0	0	0	0	112.9	Y149 Q151 N156 K410	Y149-G153 PolarHBondContact O-N 2.94Å; Q151-G153 VanDerWaalsContact C-N 3.3Å; Q151-G153 PolarHBondContact O-N 3.39Å; G153-N156 PolarHBondContact O-N 3.49Å; G153-K410 WeakPolarHBondContact O-CG 3.37Å
154	E	90.5	Very high	91	Very high	83 Å²	83	46.7 Å²	46.7	39%	0.388	22%	0.216	S	C	.	.	H	α-helix	trans	-65.6	-39.6	177.9	-172.1	59.1	-135.8	0	0	111.9	L150 Q151 N156 K410 Y475	L150-E154 PolarHBondContact O-N 3.41Å; Q151-E154 PolarHBondContact O-N 3.2Å; E154-N156 VanDerWaalsContact C-N 3.31Å; E154-N156 PolarHBondContact O-N 3.43Å; E154-K410 IonicContact OE1-NZ 3.28Å; E154-K410 PolarHBondContact OE1-NZ 2.85Å; E154-K410 WeakPolarHBondContact OE2-CE 3.28Å; E154-K410 IonicContact OE2-NZ 2.81Å; E154-K410 PolarHBondContact OE2-NZ 3.17Å; E154-Y475 HydrophobicContact CB-CE1 4Å; E154-Y475 WeakPolarHBondContact OE2-CD1 3.42Å; E154-Y475 WeakPolarHBondContact OE2-CE1 3.39Å
155	N	89	Confident	90.8	Very high	38 Å²	38	50.9 Å²	50.9	20%	0.203	24%	0.239	C	C	.	.	H	α-helix	trans	-81.5	-11.7	-176.3	-60.6	-34.3	0	0	0	113.3	Q151 E152 D157 R285	Q151-N155 WeakPolarHBondContact O-CB 3.09Å; Q151-N155 PolarHBondContact O-N 3.02Å; Q151-N155 PolarHBondContact O-ND2 3.34Å; E152-N155 PolarHBondContact O-N 3.15Å; N155-D157 VanDerWaalsContact C-N 3.33Å; N155-D157 VanDerWaalsContact CB-OD2 3.29Å; N155-D157 WeakPolarHBondContact CB-OD2 3.32Å; N155-R285 VanDerWaalsContact CG-CZ 3.41Å; N155-R285 PolarHBondContact ND2-NH2 3.08Å; N155-R285 PolarHBondContact OD1-NH1 3.31Å; N155-R285 PolarHBondContact OD1-NH2 2.82Å
156	N	90.7	Very high	90.4	Very high	40 Å²	40	51.8 Å²	51.8	21%	0.214	26%	0.257	C	S	.	.	T	Hydrogen-bonded Turn	trans	58.7	44.2	-171.5	-176.8	76.1	0	0	0	112	E152 G153 E154 L406	E152-N156 PolarHBondContact O-N 2.87Å; G153-N156 PolarHBondContact O-N 3.49Å; E154-N156 VanDerWaalsContact C-N 3.31Å; E154-N156 PolarHBondContact O-N 3.43Å; N156-L406 HydrophobicContact CB-CD2 3.69Å; N156-L406 VanDerWaalsContact CG-CD2 3.49Å; N156-L406 WeakPolarHBondContact OD1-CD2 3.47Å
157	D	88.3	Confident	90.1	Very high	39 Å²	39	59.1 Å²	59.1	21%	0.209	29%	0.29	C	S	.	.			trans	-88.4	145.5	169.9	-69	-44.5	0	0	0	110.2	E152 N155 H176 H409	E152-D157 HydrophobicContact CB-CB 4.29Å; E152-D157 HydrophobicContact CG-CB 4.33Å; E152-D157 PolarHBondContact O-N 3.47Å; N155-D157 VanDerWaalsContact C-N 3.33Å; N155-D157 VanDerWaalsContact CB-OD2 3.29Å; N155-D157 WeakPolarHBondContact CB-OD2 3.32Å; D157-H176 IonicContact OD2-NE2 2.77Å; D157-H409 PolarHBondContact O-CE1 3.21Å; D157-H409 PolarHBondContact O-NE2 3.31Å
158	K	89.1	Confident	89.7	Confident	135 Å²	135	60.4 Å²	60.4	59%	0.587	30%	0.3	S	S	*	.			trans	-76.5	133.8	-176	-64.6	-69.1	-172.8	172.9	0	110.3	F160 T161	K158-F160 PolarHBondContact O-N 3.11Å; K158-F160 VanDerWaalsContact O-N 3.12Å; K158-T161 PolarHBondContact O-N 3.48Å; K158-T161 PolarHBondContact O-OG1 3.26Å
159	F	89.2	Confident	89.5	Confident	49 Å²	49	61.7 Å²	61.7	22%	0.215	31%	0.307	C	S	.	.	G	3₁₀ helix	trans	-67.9	-11.8	-178.2	-54.4	-61.5	0	0	0	114.9	Y149 E152 T161 H162 H409 T412 A413	Y149-F159 HydrophobicContact CD1-CD1 4.02Å; Y149-F159 HydrophobicContact CD1-CE1 4.31Å; Y149-F159 HydrophobicContact CE1-CD1 4.33Å; E152-F159 HydrophobicContact CB-CD1 4.46Å; E152-F159 HydrophobicContact CB-CE1 4.25Å; F159-T161 PolarHBondContact O-N 2.94Å; F159-H162 VanDerWaalsContact O-CB 3.27Å; F159-H162 WeakPolarHBondContact O-CB 3.4Å; F159-H162 PolarHBondContact O-N 3.49Å; F159-H409 AromaticContact CD2-CE1 3.79Å; F159-H409 AromaticContact CE2-CE1 3.16Å; F159-H409 WeakPolarHBondContact CE2-CE1 3.47Å; F159-H409 AromaticContact CE2-ND1 3.46Å; F159-H409 WeakPolarHBondContact CE2-ND1 3.46Å; F159-H409 AromaticContact CE2-NE2 3.89Å; F159-H409 AromaticContact CZ-CE1 3.28Å; F159-H409 WeakPolarHBondContact CZ-CE1 3Å; F159-H409 AromaticContact CZ-ND1 3.82Å; F159-H409 AromaticContact CZ-NE2 3.52Å; F159-T412 VanDerWaalsContact CE2-OG1 3.26Å; F159-T412 WeakPolarHBondContact CE2-OG1 3.48Å; F159-A413 HydrophobicContact CE1-CB 3.92Å; F159-A413 HydrophobicContact CZ-CB 3.77Å
160	F	85.5	Confident	89.2	Confident	177 Å²	177	62.9 Å²	62.9	78%	0.776	32%	0.323	S	S	*	.	G	3₁₀ helix	trans	-65	-26.9	176	-178.5	-99.8	0	0	0	112.6	K158 H162	K158-F160 PolarHBondContact O-N 3.11Å; K158-F160 VanDerWaalsContact O-N 3.12Å; F160-H162 VanDerWaalsContact C-N 3.3Å
161	T	86.4	Confident	89	Confident	22 Å²	22	63.2 Å²	63.2	14%	0.135	33%	0.326	C	S	.	.	G	3₁₀ helix	trans	-94.2	17.2	-180	53.8	0	0	0	0	113.2	K158 F159 L234 T238	K158-T161 PolarHBondContact O-N 3.48Å; K158-T161 PolarHBondContact O-OG1 3.26Å; F159-T161 PolarHBondContact O-N 2.94Å; T161-L234 HydrophobicContact CG2-CD2 3.8Å; T161-T238 HydrophobicContact CG2-CG2 3.84Å
162	H	88.6	Confident	88.9	Confident	15 Å²	15	60.7 Å²	60.7	7%	0.069	31%	0.314	C	S	.	.			trans	-62.6	130.3	-178.6	-170.3	80.7	0	0	0	110.9	E145 Y149 E152 F159 F160 K164	E145-H162 VanDerWaalsContact CG-NE2 3.26Å; E145-H162 WeakPolarHBondContact CG-NE2 3.21Å; E145-H162 IonicContact OE1-NE2 3.6Å; Y149-H162 AromaticContact CD1-CE1 3.87Å; Y149-H162 AromaticContact CD1-ND1 3.85Å; Y149-H162 AromaticContact CD2-CE1 3.71Å; Y149-H162 AromaticContact CE1-CE1 3.67Å; Y149-H162 AromaticContact CE1-CG 3.93Å; Y149-H162 AromaticContact CE1-ND1 3.54Å; Y149-H162 AromaticContact CE2-CE1 3.49Å; Y149-H162 VanDerWaalsContact CE2-CE1 3.49Å; Y149-H162 WeakPolarHBondContact CE2-CE1 3.32Å; Y149-H162 AromaticContact CE2-NE2 3.52Å; Y149-H162 AromaticContact CG-CE1 3.89Å; Y149-H162 AromaticContact CZ-CD2 3.76Å; Y149-H162 AromaticContact CZ-CE1 3.45Å; Y149-H162 VanDerWaalsContact CZ-CE1 3.45Å; Y149-H162 AromaticContact CZ-CG 3.89Å; Y149-H162 AromaticContact CZ-ND1 3.71Å; Y149-H162 AromaticContact CZ-NE2 3.49Å; Y149-H162 PolarHBondContact OH-CD2 3.03Å; E152-H162 IonicContact OE1-ND1 3.68Å; E152-H162 IonicContact OE2-CE1 3.81Å; E152-H162 IonicContact OE2-CG 2.75Å; E152-H162 IonicContact OE2-ND1 3.4Å; E152-H162 PolarHBondContact OE2-ND1 3.38Å; F159-H162 VanDerWaalsContact O-CB 3.27Å; F159-H162 WeakPolarHBondContact O-CB 3.4Å; F159-H162 PolarHBondContact O-N 3.49Å; F160-H162 VanDerWaalsContact C-N 3.3Å; H162-K164 PolarHBondContact O-N 3.28Å
163	P	88.6	Confident	88.7	Confident	12 Å²	12	63.8 Å²	63.8	8%	0.078	33%	0.33	C	S	.	.			trans	-72.8	113.4	-175.2	28.5	-33.9	0	0	0	111.6	I148 A168 L169 Y172	I148-P163 HydrophobicContact CD1-CG 4.18Å; I148-P163 HydrophobicContact CG2-CG 4.2Å; P163-A168 HydrophobicContact CB-CB 3.97Å; P163-L169 HydrophobicContact CB-CB 4.38Å; P163-L169 HydrophobicContact CG-CD1 4.46Å; P163-Y172 HydrophobicContact CG-CD2 4.36Å; P163-Y172 HydrophobicContact CG-CG 4.13Å
164	K	84.9	Confident	88.7	Confident	188 Å²	188	67.6 Å²	67.6	82%	0.817	35%	0.346	S	S	*	.			trans	-94.5	-33.3	175.4	-62.5	-177.3	-178.9	-179.8	0	113.6	H162	H162-K164 PolarHBondContact O-N 3.28Å
165	D	86.5	Confident	88.6	Confident	116 Å²	116	63.9 Å²	63.9	62%	0.62	33%	0.33	S	S	*	.	S	Bend	trans	-97.4	151.9	-177.2	-57	-36.8	0	0	0	111.7	K167 A168 L169	D165-K167 PolarHBondContact O-N 3.25Å; D165-K167 VanDerWaalsContact O-N 3.16Å; D165-A168 HydrophobicContact CB-CB 4.38Å; D165-A168 WeakPolarHBondContact O-CB 3.36Å; D165-A168 PolarHBondContact O-N 3.47Å; D165-L169 PolarHBondContact O-N 3.42Å
166	A	85.7	Confident	88.7	Confident	82 Å²	82	63.6 Å²	63.6	68%	0.678	33%	0.327	S	S	*	.	H	α-helix	trans	-56.1	-34.7	176	0	0	0	0	0	113.1	L169 A170	A166-L169 PolarHBondContact O-N 2.91Å; A166-A170 WeakPolarHBondContact O-CB 3.4Å; A166-A170 PolarHBondContact O-N 2.9Å
167	K	87.9	Confident	88.7	Confident	155 Å²	155	65.5 Å²	65.5	67%	0.674	34%	0.338	S	S	*	.	H	α-helix	trans	-68	-40.2	175.9	-173	178.6	179.1	-179	0	112.2	D165 A171	D165-K167 PolarHBondContact O-N 3.25Å; D165-K167 VanDerWaalsContact O-N 3.16Å; K167-A171 PolarHBondContact O-N 3.36Å
168	A	86.9	Confident	88.8	Confident	27 Å²	27	69.6 Å²	69.6	22%	0.223	36%	0.355	C	S	.	.	H	α-helix	trans	-70.2	-38.5	176.6	0	0	0	0	0	110.9	P163 D165 A171 Y172	P163-A168 HydrophobicContact CB-CB 3.97Å; D165-A168 HydrophobicContact CB-CB 4.38Å; D165-A168 WeakPolarHBondContact O-CB 3.36Å; D165-A168 PolarHBondContact O-N 3.47Å; A168-A171 PolarHBondContact O-N 2.92Å; A168-Y172 WeakPolarHBondContact O-CB 3.46Å; A168-Y172 PolarHBondContact O-N 2.83Å
169	L	89.7	Confident	89.1	Confident	31 Å²	31	69.8 Å²	69.8	16%	0.162	36%	0.362	C	S	.	.	H	α-helix	trans	-60.6	-47.6	174.2	178.2	62.6	0	0	0	111.7	M141 Q144 I148 P163 D165 A166 A171 Y172 L173	M141-L169 HydrophobicContact CE-CD2 4.34Å; Q144-L169 HydrophobicContact CG-CD1 4.39Å; I148-L169 HydrophobicContact CD1-CD1 3.31Å; P163-L169 HydrophobicContact CB-CB 4.38Å; P163-L169 HydrophobicContact CG-CD1 4.46Å; D165-L169 PolarHBondContact O-N 3.42Å; A166-L169 PolarHBondContact O-N 2.91Å; L169-A171 VanDerWaalsContact C-N 3.3Å; L169-A171 PolarHBondContact O-N 3.3Å; L169-Y172 PolarHBondContact O-N 3.45Å; L169-L173 HydrophobicContact CD1-CD1 4.13Å; L169-L173 HydrophobicContact CD1-CG 4.21Å; L169-L173 HydrophobicContact CG-CD1 4.12Å; L169-L173 WeakPolarHBondContact O-CB 3.36Å; L169-L173 WeakPolarHBondContact O-CG 3.32Å; L169-L173 PolarHBondContact O-N 2.99Å
170	A	89.9	Confident	89.3	Confident	56 Å²	56	68 Å²	68	46%	0.463	35%	0.354	S	S	.	.	H	α-helix	trans	-60.5	-39.9	176.5	0	0	0	0	0	112.1	A166 F174	A166-A170 WeakPolarHBondContact O-CB 3.4Å; A166-A170 PolarHBondContact O-N 2.9Å; A170-F174 WeakPolarHBondContact O-CB 3.18Å; A170-F174 PolarHBondContact O-N 2.92Å
171	A	90.6	Very high	89.7	Confident	7 Å²	7	60.6 Å²	60.6	6%	0.058	32%	0.321	C	S	.	.	H	α-helix	trans	-67.2	-42.3	175.9	0	0	0	0	0	112.2	K167 A168 L169 F174 A175 R232 W233	K167-A171 PolarHBondContact O-N 3.36Å; A168-A171 PolarHBondContact O-N 2.92Å; L169-A171 VanDerWaalsContact C-N 3.3Å; L169-A171 PolarHBondContact O-N 3.3Å; A171-F174 PolarHBondContact O-N 3.48Å; A171-A175 WeakPolarHBondContact O-CB 3.47Å; A171-A175 PolarHBondContact O-N 2.96Å; A171-R232 HydrophobicContact CB-CG 4.22Å; A171-W233 HydrophobicContact CB-CB 4.16Å
172	Y	90.9	Very high	90.1	Very high	0 Å²	0	63.9 Å²	63.9	0%	0	34%	0.337	C	S	.	.	H	α-helix	trans	-59.3	-51.2	175.9	178.2	-88.7	0	0	0	111.1	I148 E152 P163 A168 L169 F174 A175 H176 W233	I148-Y172 HydrophobicContact CD1-CD1 4.42Å; I148-Y172 HydrophobicContact CG1-CD1 4.4Å; I148-Y172 HydrophobicContact CG1-CE1 4.02Å; I148-Y172 HydrophobicContact CG2-CD1 4.44Å; I148-Y172 HydrophobicContact CG2-CE1 3.87Å; I148-Y172 HydrophobicContact CG2-CE2 4.27Å; E152-Y172 HydrophobicContact CG-CE2 4.12Å; P163-Y172 HydrophobicContact CG-CD2 4.36Å; P163-Y172 HydrophobicContact CG-CG 4.13Å; A168-Y172 WeakPolarHBondContact O-CB 3.46Å; A168-Y172 PolarHBondContact O-N 2.83Å; L169-Y172 PolarHBondContact O-N 3.45Å; Y172-F174 VanDerWaalsContact C-N 3.31Å; Y172-F174 PolarHBondContact O-N 3.35Å; Y172-A175 PolarHBondContact O-N 3.5Å; Y172-H176 AromaticContact CD2-CE1 3.54Å; Y172-H176 AromaticContact CD2-ND1 3.58Å; Y172-H176 HydrophobicContact CE1-CB 4.31Å; Y172-H176 AromaticContact CE1-CG 3.99Å; Y172-H176 AromaticContact CE1-ND1 4Å; Y172-H176 AromaticContact CE2-CE1 3.29Å; Y172-H176 WeakPolarHBondContact CE2-CE1 3.35Å; Y172-H176 AromaticContact CE2-ND1 3.55Å; Y172-H176 AromaticContact CE2-NE2 3.72Å; Y172-H176 AromaticContact CG-ND1 3.84Å; Y172-H176 AromaticContact CZ-CD2 3.9Å; Y172-H176 AromaticContact CZ-CE1 3.82Å; Y172-H176 AromaticContact CZ-CG 3.82Å; Y172-H176 AromaticContact CZ-ND1 3.75Å; Y172-H176 AromaticContact CZ-NE2 3.96Å; Y172-H176 WeakPolarHBondContact O-CB 3.29Å; Y172-H176 PolarHBondContact O-N 3.19Å; Y172-H176 PolarHBondContact O-ND1 3Å; Y172-W233 AromaticContact CD2-CE2 3.79Å; Y172-W233 AromaticContact CD2-CZ2 3.96Å; Y172-W233 HydrophobicContact CD2-CZ2 3.96Å; Y172-W233 AromaticContact CD2-NE1 3.56Å; Y172-W233 HydrophobicContact CE2-CZ2 4.11Å
173	L	90.6	Very high	90.4	Very high	66 Å²	66	65.8 Å²	65.8	35%	0.346	35%	0.347	S	S	.	.	H	α-helix	trans	-61.7	-39.4	179.7	-69.5	173.8	0	0	0	111.7	L169 H176 N177	L169-L173 HydrophobicContact CD1-CD1 4.13Å; L169-L173 HydrophobicContact CD1-CG 4.21Å; L169-L173 HydrophobicContact CG-CD1 4.12Å; L169-L173 WeakPolarHBondContact O-CB 3.36Å; L169-L173 WeakPolarHBondContact O-CG 3.32Å; L169-L173 PolarHBondContact O-N 2.99Å; L173-H176 PolarHBondContact O-N 3.28Å; L173-N177 PolarHBondContact O-N 3.28Å; L173-N177 PolarHBondContact O-ND2 3.42Å; L173-N177 VanDerWaalsContact O-ND2 3.11Å; L173-N177 PolarHBondContact O-OD1 2.85Å
174	F	92.4	Very high	90.7	Very high	82 Å²	82	65.4 Å²	65.4	36%	0.36	34%	0.344	S	S	.	.	H	α-helix	trans	-61.5	-49	175	-176.3	-89.8	0	0	0	111.9	A170 A171 Y172 H176 N177 F180 F225 M229	A170-F174 WeakPolarHBondContact O-CB 3.18Å; A170-F174 PolarHBondContact O-N 2.92Å; A171-F174 PolarHBondContact O-N 3.48Å; Y172-F174 VanDerWaalsContact C-N 3.31Å; Y172-F174 PolarHBondContact O-N 3.35Å; F174-H176 VanDerWaalsContact C-N 3.31Å; F174-H176 PolarHBondContact O-N 3.09Å; F174-N177 PolarHBondContact O-N 3.48Å; F174-N177 PolarHBondContact O-ND2 3.06Å; F174-F180 AromaticContact CE1-CD2 3.98Å; F174-F180 HydrophobicContact CE1-CD2 3.98Å; F174-F180 HydrophobicContact CE1-CE2 4.2Å; F174-F225 HydrophobicContact CE1-CE1 4.48Å; F174-F225 HydrophobicContact CE1-CZ 4.29Å; F174-F225 HydrophobicContact CZ-CE1 4.4Å; F174-F225 HydrophobicContact CZ-CZ 4.04Å; F174-M229 HydrophobicContact CD1-CB 4.48Å; F174-M229 HydrophobicContact CD1-CE 4.01Å; F174-M229 HydrophobicContact CD1-CG 4.18Å; F174-M229 HydrophobicContact CD1-SD 3.86Å; F174-M229 HydrophobicContact CE1-CB 4.34Å; F174-M229 HydrophobicContact CE1-CE 3.47Å; F174-M229 VanDerWaalsContact CE1-CE 3.47Å; F174-M229 HydrophobicContact CE1-CG 3.73Å; F174-M229 HydrophobicContact CE1-SD 3.75Å; F174-M229 HydrophobicContact CE2-CE 4.38Å; F174-M229 HydrophobicContact CZ-CE 3.68Å
175	A	89.9	Confident	91.3	Very high	5 Å²	5	58.8 Å²	58.8	4%	0.041	32%	0.317	C	S	.	.	H	α-helix	trans	-69.8	-25.5	-178.1	0	0	0	0	0	113.5	A171 Y172 F180 Y181 W233	A171-A175 WeakPolarHBondContact O-CB 3.47Å; A171-A175 PolarHBondContact O-N 2.96Å; Y172-A175 PolarHBondContact O-N 3.5Å; A175-F180 VanDerWaalsContact O-CD1 3.3Å; A175-F180 WeakPolarHBondContact O-CD1 3.45Å; A175-Y181 VanDerWaalsContact O-CE1 3.31Å; A175-Y181 WeakPolarHBondContact O-CE1 3.09Å; A175-W233 HydrophobicContact CB-CE3 4.45Å
176	H	90.3	Very high	91.7	Very high	31 Å²	31	55.9 Å²	55.9	14%	0.144	31%	0.31	C	S	.	.	T	Hydrogen-bonded Turn	trans	-95	12.7	-178.1	-70.1	75.9	0	0	0	114.5	D157 Y172 L173 F174 Y181 W233	D157-H176 IonicContact OD2-NE2 2.77Å; Y172-H176 AromaticContact CD2-CE1 3.54Å; Y172-H176 AromaticContact CD2-ND1 3.58Å; Y172-H176 HydrophobicContact CE1-CB 4.31Å; Y172-H176 AromaticContact CE1-CG 3.99Å; Y172-H176 AromaticContact CE1-ND1 4Å; Y172-H176 AromaticContact CE2-CE1 3.29Å; Y172-H176 WeakPolarHBondContact CE2-CE1 3.35Å; Y172-H176 AromaticContact CE2-ND1 3.55Å; Y172-H176 AromaticContact CE2-NE2 3.72Å; Y172-H176 AromaticContact CG-ND1 3.84Å; Y172-H176 AromaticContact CZ-CD2 3.9Å; Y172-H176 AromaticContact CZ-CE1 3.82Å; Y172-H176 AromaticContact CZ-CG 3.82Å; Y172-H176 AromaticContact CZ-ND1 3.75Å; Y172-H176 AromaticContact CZ-NE2 3.96Å; Y172-H176 WeakPolarHBondContact O-CB 3.29Å; Y172-H176 PolarHBondContact O-N 3.19Å; Y172-H176 PolarHBondContact O-ND1 3Å; L173-H176 PolarHBondContact O-N 3.28Å; F174-H176 VanDerWaalsContact C-N 3.31Å; F174-H176 PolarHBondContact O-N 3.09Å; H176-Y181 WeakPolarHBondContact CA-OH 3.42Å; H176-Y181 PolarHBondContact CD2-OH 3.23Å; H176-W233 AromaticContact CE1-CH2 3.49Å; H176-W233 VanDerWaalsContact CE1-CH2 3.49Å; H176-W233 WeakPolarHBondContact CE1-CH2 3.39Å; H176-W233 AromaticContact CE1-CZ2 3.67Å; H176-W233 AromaticContact CE1-CZ3 3.79Å; H176-W233 AromaticContact NE2-CH2 3.95Å
177	N	91.4	Very high	92.2	Very high	81 Å²	81	52.6 Å²	52.6	43%	0.433	28%	0.281	S	S	.	.			trans	-77.3	143.5	175.5	-76.5	-34.2	0	0	0	112.5	L173 F174 L179 F180 Y181	L173-N177 PolarHBondContact O-N 3.28Å; L173-N177 PolarHBondContact O-ND2 3.42Å; L173-N177 VanDerWaalsContact O-ND2 3.11Å; L173-N177 PolarHBondContact O-OD1 2.85Å; F174-N177 PolarHBondContact O-N 3.48Å; F174-N177 PolarHBondContact O-ND2 3.06Å; N177-L179 PolarHBondContact O-N 3.28Å; N177-F180 HydrophobicContact CB-CB 4.5Å; N177-F180 WeakPolarHBondContact O-CB 3.44Å; N177-F180 PolarHBondContact O-N 3.37Å; N177-Y181 PolarHBondContact O-N 2.86Å; N177-Y181 VanDerWaalsContact O-N 3.16Å
178	H	90.9	Very high	92.6	Very high	124 Å²	124	45.4 Å²	45.4	57%	0.574	25%	0.25	S	S	*	.	H	α-helix	trans	-60.4	-30.8	176.2	-171.1	-68.8	0	0	0	112.7	Y181 L182 Y286	H178-Y181 PolarHBondContact O-N 3.12Å; H178-L182 WeakPolarHBondContact O-CB 3.46Å; H178-L182 PolarHBondContact O-N 2.92Å; H178-Y286 PolarHBondContact CD2-OH 3.33Å; H178-Y286 PolarHBondContact CE1-OH 3.34Å; H178-Y286 PolarHBondContact ND1-OH 3.03Å; H178-Y286 PolarHBondContact NE2-OH 3.5Å
179	L	93.4	Very high	93	Very high	139 Å²	139	48.2 Å²	48.2	73%	0.728	26%	0.261	S	S	*	.	H	α-helix	trans	-65.2	-40.3	174.5	-67.9	176.2	0	0	0	111.7	N177 L182 M183	N177-L179 PolarHBondContact O-N 3.28Å; L179-L182 PolarHBondContact O-N 3.36Å; L179-M183 WeakPolarHBondContact O-CB 3.1Å; L179-M183 PolarHBondContact O-N 3.49Å
180	F	94.3	Very high	93.3	Very high	11 Å²	11	50.5 Å²	50.5	5%	0.048	27%	0.273	C	S	.	.	H	α-helix	trans	-64.1	-43.6	176.2	-171	-95.3	0	0	0	110.6	F174 A175 N177 L182 M183 E184 E226 M229	F174-F180 AromaticContact CE1-CD2 3.98Å; F174-F180 HydrophobicContact CE1-CD2 3.98Å; F174-F180 HydrophobicContact CE1-CE2 4.2Å; A175-F180 VanDerWaalsContact O-CD1 3.3Å; A175-F180 WeakPolarHBondContact O-CD1 3.45Å; N177-F180 HydrophobicContact CB-CB 4.5Å; N177-F180 WeakPolarHBondContact O-CB 3.44Å; N177-F180 PolarHBondContact O-N 3.37Å; F180-L182 VanDerWaalsContact C-N 3.35Å; F180-L182 PolarHBondContact O-N 3.45Å; F180-M183 HydrophobicContact CD2-CE 3.68Å; F180-M183 HydrophobicContact CE2-CE 3.71Å; F180-M183 HydrophobicContact CG-CE 4.5Å; F180-M183 WeakPolarHBondContact O-CB 3.47Å; F180-M183 PolarHBondContact O-N 2.88Å; F180-E184 HydrophobicContact CD1-CG 4.31Å; F180-E184 HydrophobicContact CE1-CG 4.08Å; F180-E184 WeakPolarHBondContact CE1-OE1 3.2Å; F180-E184 WeakPolarHBondContact O-CG 3.37Å; F180-E184 PolarHBondContact O-N 3.17Å; F180-E226 HydrophobicContact CE2-CG 4.25Å; F180-E226 HydrophobicContact CZ-CB 4.01Å; F180-E226 HydrophobicContact CZ-CG 4.02Å; F180-M229 HydrophobicContact CE2-CB 4.18Å; F180-M229 HydrophobicContact CZ-CB 4.37Å
181	Y	93.8	Very high	93.5	Very high	23 Å²	23	47.8 Å²	47.8	9%	0.09	25%	0.251	C	S	.	.	H	α-helix	trans	-64.9	-35.5	175.7	-58.7	-26	0	0	0	113.9	A175 H176 N177 H178 L185 R285	A175-Y181 VanDerWaalsContact O-CE1 3.31Å; A175-Y181 WeakPolarHBondContact O-CE1 3.09Å; H176-Y181 WeakPolarHBondContact CA-OH 3.42Å; H176-Y181 PolarHBondContact CD2-OH 3.23Å; N177-Y181 PolarHBondContact O-N 2.86Å; N177-Y181 VanDerWaalsContact O-N 3.16Å; H178-Y181 PolarHBondContact O-N 3.12Å; Y181-L185 PolarHBondContact O-N 3.41Å; Y181-R285 HydrophobicContact CD1-CB 3.66Å; Y181-R285 HydrophobicContact CD1-CG 3.9Å; Y181-R285 HydrophobicContact CD2-CB 4.4Å; Y181-R285 HydrophobicContact CD2-CG 3.92Å; Y181-R285 HydrophobicContact CE1-CB 4.01Å; Y181-R285 HydrophobicContact CE1-CG 3.9Å; Y181-R285 HydrophobicContact CE2-CG 3.89Å; Y181-R285 HydrophobicContact CG-CB 3.88Å; Y181-R285 HydrophobicContact CG-CG 3.92Å; Y181-R285 PolarHBondContact OH-NE 3.4Å; Y181-R285 PolarHBondContact OH-NH2 2.89Å
182	L	95.3	Very high	93.8	Very high	90 Å²	90	48.6 Å²	48.6	47%	0.471	25%	0.254	S	S	.	.	H	α-helix	trans	-69.7	-39	175.9	-175.1	64.5	0	0	0	111.1	H178 L179 F180 L185 A186	H178-L182 WeakPolarHBondContact O-CB 3.46Å; H178-L182 PolarHBondContact O-N 2.92Å; L179-L182 PolarHBondContact O-N 3.36Å; F180-L182 VanDerWaalsContact C-N 3.35Å; F180-L182 PolarHBondContact O-N 3.45Å; L182-L185 PolarHBondContact O-N 3.44Å; L182-A186 VanDerWaalsContact O-CB 3.26Å; L182-A186 WeakPolarHBondContact O-CB 3.23Å; L182-A186 PolarHBondContact O-N 2.98Å
183	M	95.5	Very high	94	Very high	55 Å²	55	53 Å²	53	27%	0.271	28%	0.277	S	S	.	.	H	α-helix	trans	-60.7	-47.6	174.2	-175.1	-176.4	72.6	0	0	111.2	L179 F180 L185 A186 T187 V222 F225 E226	L179-M183 WeakPolarHBondContact O-CB 3.1Å; L179-M183 PolarHBondContact O-N 3.49Å; F180-M183 HydrophobicContact CD2-CE 3.68Å; F180-M183 HydrophobicContact CE2-CE 3.71Å; F180-M183 HydrophobicContact CG-CE 4.5Å; F180-M183 WeakPolarHBondContact O-CB 3.47Å; F180-M183 PolarHBondContact O-N 2.88Å; M183-L185 VanDerWaalsContact C-N 3.33Å; M183-L185 PolarHBondContact O-N 2.88Å; M183-A186 PolarHBondContact O-N 3.19Å; M183-T187 WeakPolarHBondContact O-CB 3.28Å; M183-T187 PolarHBondContact O-N 2.93Å; M183-T187 PolarHBondContact O-OG1 2.91Å; M183-V222 HydrophobicContact CE-CG1 4.48Å; M183-V222 HydrophobicContact CG-CG1 3.99Å; M183-V222 HydrophobicContact SD-CG1 4.1Å; M183-F225 HydrophobicContact CE-CD1 3.98Å; M183-F225 HydrophobicContact CE-CE1 4.02Å; M183-F225 HydrophobicContact SD-CE1 4.48Å; M183-E226 HydrophobicContact CE-CG 3.65Å
184	E	94.8	Very high	94.1	Very high	5 Å²	5	50.4 Å²	50.4	2%	0.023	26%	0.264	C	S	.	.	H	α-helix	trans	-55.2	-48.4	175.8	-70.1	-172.8	152.2	0	0	111.9	F180 A188 E226 K230 R285	F180-E184 HydrophobicContact CD1-CG 4.31Å; F180-E184 HydrophobicContact CE1-CG 4.08Å; F180-E184 WeakPolarHBondContact CE1-OE1 3.2Å; F180-E184 WeakPolarHBondContact O-CG 3.37Å; F180-E184 PolarHBondContact O-N 3.17Å; E184-A188 WeakPolarHBondContact O-CB 3.49Å; E184-A188 PolarHBondContact O-N 3.43Å; E184-E226 VanDerWaalsContact CA-OE1 3.3Å; E184-E226 WeakPolarHBondContact CA-OE1 3.44Å; E184-E226 HydrophobicContact CG-CG 4.27Å; E184-K230 WeakPolarHBondContact OE1-CE 3.38Å; E184-K230 IonicContact OE1-NZ 2.91Å; E184-K230 PolarHBondContact OE1-NZ 2.78Å; E184-R285 PolarHBondContact OE2-N 3.47Å
185	L	95.9	Very high	94.1	Very high	48 Å²	48	46.6 Å²	46.6	25%	0.251	25%	0.247	S	C	.	.	H	α-helix	trans	-66.8	-43.1	-178.4	179.8	63.6	0	0	0	111.8	Y181 L182 M183 A188 L189 L281 Y286	Y181-L185 PolarHBondContact O-N 3.41Å; L182-L185 PolarHBondContact O-N 3.44Å; M183-L185 VanDerWaalsContact C-N 3.33Å; M183-L185 PolarHBondContact O-N 2.88Å; L185-A188 PolarHBondContact O-N 3.19Å; L185-L189 VanDerWaalsContact O-CB 3.28Å; L185-L189 WeakPolarHBondContact O-CB 3.19Å; L185-L189 PolarHBondContact O-N 3.03Å; L185-L281 HydrophobicContact CD1-CD1 3.77Å; L185-Y286 HydrophobicContact CB-CD2 4.27Å; L185-Y286 HydrophobicContact CD2-CD2 3.93Å
186	A	95.8	Very high	94.3	Very high	56 Å²	56	48.2 Å²	48.2	46%	0.463	26%	0.255	S	S	.	.	H	α-helix	trans	-64.9	-44.1	179.9	0	0	0	0	0	111.5	L182 M183 L189 L190	L182-A186 VanDerWaalsContact O-CB 3.26Å; L182-A186 WeakPolarHBondContact O-CB 3.23Å; L182-A186 PolarHBondContact O-N 2.98Å; M183-A186 PolarHBondContact O-N 3.19Å; A186-L189 PolarHBondContact O-N 3.34Å; A186-L190 VanDerWaalsContact O-CB 3.24Å; A186-L190 WeakPolarHBondContact O-CB 3.36Å; A186-L190 PolarHBondContact O-N 3.02Å
187	T	96.4	Very high	94.5	Very high	13 Å²	13	47.9 Å²	47.9	8%	0.08	26%	0.256	C	S	.	.	H	α-helix	trans	-63.3	-45.4	177.2	-54.4	0	0	0	0	111.3	M183 L190 L191 A219 V222 V223	M183-T187 WeakPolarHBondContact O-CB 3.28Å; M183-T187 PolarHBondContact O-N 2.93Å; M183-T187 PolarHBondContact O-OG1 2.91Å; T187-L190 PolarHBondContact O-N 3.03Å; T187-L191 HydrophobicContact CG2-CD1 4.47Å; T187-L191 PolarHBondContact O-N 2.65Å; T187-A219 HydrophobicContact CG2-CB 4.17Å; T187-A219 WeakPolarHBondContact CG2-O 3.49Å; T187-V222 HydrophobicContact CG2-CB 4.04Å; T187-V222 HydrophobicContact CG2-CG1 4.13Å; T187-V222 WeakPolarHBondContact OG1-CG1 3.46Å; T187-V223 HydrophobicContact CG2-CG2 3.76Å
188	A	96	Very high	94.3	Very high	3 Å²	3	44 Å²	44	3%	0.025	24%	0.235	C	C	.	.	H	α-helix	trans	-63.4	-44.3	177.3	0	0	0	0	0	112	E184 L185 L190 L191 L192 F280 L281	E184-A188 WeakPolarHBondContact O-CB 3.49Å; E184-A188 PolarHBondContact O-N 3.43Å; L185-A188 PolarHBondContact O-N 3.19Å; A188-L190 VanDerWaalsContact C-N 3.35Å; A188-L191 PolarHBondContact O-N 3.32Å; A188-L192 VanDerWaalsContact O-CD1 3.25Å; A188-L192 WeakPolarHBondContact O-CD1 3.49Å; A188-L192 PolarHBondContact O-N 2.95Å; A188-L192 VanDerWaalsContact O-N 3.12Å; A188-F280 HydrophobicContact CB-CB 4.09Å; A188-L281 HydrophobicContact CB-CB 4.25Å; A188-L281 HydrophobicContact CB-CD1 4.32Å
189	L	95.9	Very high	94	Very high	86 Å²	86	39.9 Å²	39.9	45%	0.45	22%	0.222	S	C	.	.	H	α-helix	trans	-65.7	-39.5	178.5	-167.9	69.7	0	0	0	111.4	L185 A186 L192 L193	L185-L189 VanDerWaalsContact O-CB 3.28Å; L185-L189 WeakPolarHBondContact O-CB 3.19Å; L185-L189 PolarHBondContact O-N 3.03Å; A186-L189 PolarHBondContact O-N 3.34Å; L189-L192 PolarHBondContact O-N 3.04Å; L189-L193 HydrophobicContact CD2-CD1 4.36Å; L189-L193 HydrophobicContact CG-CD1 3.94Å; L189-L193 HydrophobicContact CG-CG 4.35Å; L189-L193 WeakPolarHBondContact O-CB 3.36Å; L189-L193 VanDerWaalsContact O-CG 3.29Å; L189-L193 WeakPolarHBondContact O-CG 3.36Å; L189-L193 PolarHBondContact O-N 3.22Å
190	L	95.1	Very high	93.8	Very high	79 Å²	79	34.4 Å²	34.4	41%	0.414	20%	0.195	S	C	.	.	H	α-helix	trans	-59.8	-46	174.3	-178.5	67.4	0	0	0	111.4	A186 T187 A188 L192 L193 L194 A219	A186-L190 VanDerWaalsContact O-CB 3.24Å; A186-L190 WeakPolarHBondContact O-CB 3.36Å; A186-L190 PolarHBondContact O-N 3.02Å; T187-L190 PolarHBondContact O-N 3.03Å; A188-L190 VanDerWaalsContact C-N 3.35Å; L190-L192 VanDerWaalsContact C-N 3.34Å; L190-L192 PolarHBondContact O-N 2.91Å; L190-L193 PolarHBondContact O-N 3.01Å; L190-L194 WeakPolarHBondContact O-CB 3.38Å; L190-L194 PolarHBondContact O-N 3.22Å; L190-A219 HydrophobicContact CD2-CB 4.33Å
191	L	95.3	Very high	93.5	Very high	0 Å²	0	34.7 Å²	34.7	0%	0	20%	0.2	C	C	.	.	H	α-helix	trans	-61.7	-37.7	177.7	-80.4	168.7	0	0	0	113.2	T187 A188 E216 A219 L220 V223 R277 F280	T187-L191 HydrophobicContact CG2-CD1 4.47Å; T187-L191 PolarHBondContact O-N 2.65Å; A188-L191 PolarHBondContact O-N 3.32Å; L191-E216 HydrophobicContact CD2-CG 4.44Å; L191-A219 HydrophobicContact CD1-CB 4.35Å; L191-A219 HydrophobicContact CD2-CB 3.71Å; L191-A219 HydrophobicContact CG-CB 3.78Å; L191-L220 HydrophobicContact CD1-CD2 4.27Å; L191-L220 HydrophobicContact CD2-CD2 4.22Å; L191-V223 HydrophobicContact CD1-CG2 4.22Å; L191-R277 WeakPolarHBondContact O-CD 3.3Å; L191-R277 PolarHBondContact O-NH1 3.08Å; L191-R277 VanDerWaalsContact O-NH1 3.07Å; L191-F280 HydrophobicContact CD1-CD2 3.81Å; L191-F280 HydrophobicContact CD1-CE2 4.16Å; L191-F280 HydrophobicContact CD1-CG 4.31Å
192	L	95.1	Very high	93.4	Very high	23 Å²	23	34.6 Å²	34.6	12%	0.12	20%	0.201	C	C	.	.	H	α-helix	trans	-71.5	-45.5	175.5	-91.7	70.7	0	0	0	111.3	A188 L189 L190 L194 S195 R277 L281 Y651	A188-L192 VanDerWaalsContact O-CD1 3.25Å; A188-L192 WeakPolarHBondContact O-CD1 3.49Å; A188-L192 PolarHBondContact O-N 2.95Å; A188-L192 VanDerWaalsContact O-N 3.12Å; L189-L192 PolarHBondContact O-N 3.04Å; L190-L192 VanDerWaalsContact C-N 3.34Å; L190-L192 PolarHBondContact O-N 2.91Å; L192-L194 PolarHBondContact O-N 3.5Å; L192-S195 VanDerWaalsContact O-CB 3.27Å; L192-S195 WeakPolarHBondContact O-CB 3.3Å; L192-S195 PolarHBondContact O-N 3.01Å; L192-R277 HydrophobicContact CD1-CB 4.13Å; L192-L281 HydrophobicContact CD2-CD2 3.97Å; L192-Y651 HydrophobicContact CB-CE2 4.23Å; L192-Y651 HydrophobicContact CG-CD2 4.41Å; L192-Y651 HydrophobicContact CG-CE2 4.01Å
193	L	94.9	Very high	93.1	Very high	94 Å²	94	35.6 Å²	35.6	49%	0.492	21%	0.213	S	C	.	.	H	α-helix	trans	-68.5	-23.4	179.9	-70.7	175.6	0	0	0	112.9	L189 L190 S195 L196	L189-L193 HydrophobicContact CD2-CD1 4.36Å; L189-L193 HydrophobicContact CG-CD1 3.94Å; L189-L193 HydrophobicContact CG-CG 4.35Å; L189-L193 WeakPolarHBondContact O-CB 3.36Å; L189-L193 VanDerWaalsContact O-CG 3.29Å; L189-L193 WeakPolarHBondContact O-CG 3.36Å; L189-L193 PolarHBondContact O-N 3.22Å; L190-L193 PolarHBondContact O-N 3.01Å; L193-S195 PolarHBondContact O-N 2.91Å; L193-S195 VanDerWaalsContact O-N 3.15Å; L193-L196 HydrophobicContact CB-CD1 4.32Å; L193-L196 HydrophobicContact CD2-CD1 3.77Å; L193-L196 WeakPolarHBondContact O-CB 3.2Å; L193-L196 WeakPolarHBondContact O-CD1 3.47Å; L193-L196 PolarHBondContact O-N 3.44Å
194	L	94.6	Very high	92.8	Very high	11 Å²	11	37.6 Å²	37.6	6%	0.058	24%	0.239	C	C	.	.	G	3₁₀ helix	trans	-58.5	-27.1	174.2	-164	64.1	0	0	0	111.9	L190 L192 L196 C197 E198 H212 L215 E216	L190-L194 WeakPolarHBondContact O-CB 3.38Å; L190-L194 PolarHBondContact O-N 3.22Å; L192-L194 PolarHBondContact O-N 3.5Å; L194-L196 PolarHBondContact O-N 2.86Å; L194-L196 VanDerWaalsContact O-N 3.11Å; L194-C197 PolarHBondContact O-N 3.38Å; L194-E198 WeakPolarHBondContact CD2-OE1 3.33Å; L194-E198 HydrophobicContact CG-CG 4.13Å; L194-E198 VanDerWaalsContact CG-OE1 3.24Å; L194-E198 WeakPolarHBondContact CG-OE1 3.11Å; L194-E198 WeakPolarHBondContact O-CG 3.33Å; L194-E198 PolarHBondContact O-N 2.98Å; L194-E198 VanDerWaalsContact O-N 3.16Å; L194-H212 HydrophobicContact CD1-CB 4.16Å; L194-L215 HydrophobicContact CD1-CB 4.14Å; L194-L215 HydrophobicContact CD1-CD1 4.18Å; L194-E216 HydrophobicContact CD2-CB 3.68Å; L194-E216 HydrophobicContact CD2-CG 4.37Å
195	S	92.3	Very high	92.7	Very high	1 Å²	1	41.4 Å²	41.4	1%	0.007	26%	0.258	C	S	.	.	G	3₁₀ helix	trans	-59.9	-18.8	173.2	-172.7	0	0	0	0	114.1	L192 L193 C197 I655	L192-S195 VanDerWaalsContact O-CB 3.27Å; L192-S195 WeakPolarHBondContact O-CB 3.3Å; L192-S195 PolarHBondContact O-N 3.01Å; L193-S195 PolarHBondContact O-N 2.91Å; L193-S195 VanDerWaalsContact O-N 3.15Å; S195-C197 VanDerWaalsContact C-N 3.34Å; S195-I655 VanDerWaalsContact OG-CD1 3.25Å; S195-I655 WeakPolarHBondContact OG-CD1 3.49Å
196	L	93.8	Very high	92.5	Very high	40 Å²	40	48.2 Å²	48.2	21%	0.209	28%	0.281	C	S	.	.	G	3₁₀ helix	trans	-72.5	-30.5	174.5	-77.3	87.1	0	0	0	112.4	L193 L194 V202 L205 I705 L706	L193-L196 HydrophobicContact CB-CD1 4.32Å; L193-L196 HydrophobicContact CD2-CD1 3.77Å; L193-L196 WeakPolarHBondContact O-CB 3.2Å; L193-L196 WeakPolarHBondContact O-CD1 3.47Å; L193-L196 PolarHBondContact O-N 3.44Å; L194-L196 PolarHBondContact O-N 2.86Å; L194-L196 VanDerWaalsContact O-N 3.11Å; L196-V202 PolarHBondContact O-N 2.95Å; L196-V202 VanDerWaalsContact O-N 3.09Å; L196-L205 HydrophobicContact CB-CD1 4.48Å; L196-L205 HydrophobicContact CD2-CD1 4.17Å; L196-I705 HydrophobicContact CD1-CG2 4.38Å; L196-I705 HydrophobicContact CG-CG2 3.85Å; L196-L706 HydrophobicContact CD2-CD2 4.49Å
197	C	93.3	Very high	92.3	Very high	24 Å²	24	48.7 Å²	48.7	16%	0.162	28%	0.275	C	S	.	.	T	Hydrogen-bonded Turn	trans	-97.5	-22	-173.4	-55.8	0	0	0	0	112.9	L194 S195 A201 L205 L207	L194-C197 PolarHBondContact O-N 3.38Å; S195-C197 VanDerWaalsContact C-N 3.34Å; C197-A201 WeakPolarHBondContact O-CB 3.05Å; C197-L205 WeakPolarHBondContact CA-O 3.29Å; C197-L205 WeakPolarHBondContact CB-O 3.45Å; C197-L205 PolarHBondContact SG-O 3.2Å; C197-L207 HydrophobicContact CB-CB 4.36Å; C197-L207 HydrophobicContact CB-CD1 3.75Å; C197-L207 HydrophobicContact CB-CG 3.94Å; C197-L207 PolarHBondContact O-N 2.98Å
198	E	88.7	Confident	92	Very high	0 Å²	0	49.6 Å²	49.6	0%	0	29%	0.287	C	S	.	.	S	Bend	trans	-79.9	146.4	-179.6	-72.5	-179.6	-134.5	0	0	112.1	L194 P200 A201 H212 R271 R274 R277	L194-E198 WeakPolarHBondContact CD2-OE1 3.33Å; L194-E198 HydrophobicContact CG-CG 4.13Å; L194-E198 VanDerWaalsContact CG-OE1 3.24Å; L194-E198 WeakPolarHBondContact CG-OE1 3.11Å; L194-E198 WeakPolarHBondContact O-CG 3.33Å; L194-E198 PolarHBondContact O-N 2.98Å; L194-E198 VanDerWaalsContact O-N 3.16Å; E198-P200 CarbonylContact O-C 3.14Å; E198-A201 WeakPolarHBondContact O-CA 3.23Å; E198-A201 WeakPolarHBondContact O-CB 3.32Å; E198-A201 PolarHBondContact O-N 3.39Å; E198-A201 VanDerWaalsContact O-N 3.15Å; E198-H212 HydrophobicContact CG-CB 4.08Å; E198-R271 IonicContact OE2-CZ 3.31Å; E198-R271 IonicContact OE2-NH1 2.95Å; E198-R271 PolarHBondContact OE2-NH1 3.46Å; E198-R271 IonicContact OE2-NH2 2.61Å; E198-R271 PolarHBondContact OE2-NH2 2.95Å; E198-R274 VanDerWaalsContact OE2-CD 3.28Å; E198-R274 WeakPolarHBondContact OE2-CD 3.35Å; E198-R274 IonicContact OE2-CZ 2.94Å; E198-R274 IonicContact OE2-NE 3.16Å; E198-R274 IonicContact OE2-NH1 2.67Å; E198-R274 PolarHBondContact OE2-NH1 2.93Å; E198-R274 VanDerWaalsContact OE2-NH1 3.12Å; E198-R277 IonicContact OE1-CZ 2.69Å; E198-R277 VanDerWaalsContact OE1-CZ 3.31Å; E198-R277 IonicContact OE1-NH1 3.62Å; E198-R277 PolarHBondContact OE1-NH1 2.97Å; E198-R277 IonicContact OE1-NH2 3.3Å; E198-R277 PolarHBondContact OE1-NH2 2.92Å; E198-R277 IonicContact OE2-NH1 3.93Å; E198-R277 IonicContact OE2-NH2 2.68Å; E198-R277 PolarHBondContact OE2-NH2 3.14Å
199	A	84.9	Confident	91.8	Very high	37 Å²	37	52 Å²	52	31%	0.306	30%	0.299	S	S	.	.	S	Bend	trans	-61	134.5	174.8	0	0	0	0	0	111.3	R274	A199-R274 VanDerWaalsContact O-CZ 3.29Å; A199-R274 PolarHBondContact O-NH1 2.75Å; A199-R274 PolarHBondContact O-NH2 2.99Å
200	P	88.8	Confident	91.6	Very high	23 Å²	23	54.7 Å²	54.7	15%	0.149	30%	0.304	C	S	.	.	S	Bend	cis	-75.7	117.9	-6.3	32.5	-33.5	0	0	0	111.8	E198 M658 C662 D703	E198-P200 CarbonylContact O-C 3.14Å; P200-M658 HydrophobicContact CG-CB 3.74Å; P200-M658 HydrophobicContact CG-CG 4.21Å; P200-M658 HydrophobicContact CG-SD 4.03Å; P200-C662 HydrophobicContact CB-CB 4.43Å; P200-C662 HydrophobicContact CG-CB 4.37Å; P200-D703 WeakPolarHBondContact CB-O 3.45Å
201	A	87.7	Confident	91.6	Very high	18 Å²	18	52.9 Å²	52.9	15%	0.149	30%	0.296	C	S	.	.	P	Polyproline II helix	trans	-99.3	156.1	-165.4	0	0	0	0	0	111.7	C197 E198 P203 R206	C197-A201 WeakPolarHBondContact O-CB 3.05Å; E198-A201 WeakPolarHBondContact O-CA 3.23Å; E198-A201 WeakPolarHBondContact O-CB 3.32Å; E198-A201 PolarHBondContact O-N 3.39Å; E198-A201 VanDerWaalsContact O-N 3.15Å; A201-P203 WeakPolarHBondContact O-CD 3.28Å; A201-R206 HydrophobicContact CB-CB 4.09Å; A201-R206 HydrophobicContact CB-CG 4.1Å
202	V	91.7	Very high	91.5	Very high	21 Å²	21	53 Å²	53	13%	0.127	30%	0.297	C	S	.	.	P	Polyproline II helix	trans	-64.7	124.8	164.9	179.6	0	0	0	0	108	L196 A204 L205 R206 N704 L706	L196-V202 PolarHBondContact O-N 2.95Å; L196-V202 VanDerWaalsContact O-N 3.09Å; V202-A204 PolarHBondContact O-N 3.45Å; V202-L205 HydrophobicContact CB-CB 4.35Å; V202-L205 HydrophobicContact CB-CD1 4.25Å; V202-L205 HydrophobicContact CG1-CD1 4.31Å; V202-L205 CarbonylContact O-C 3.24Å; V202-L205 PolarHBondContact O-N 2.91Å; V202-R206 PolarHBondContact O-N 3.4Å; V202-N704 HydrophobicContact CG2-CB 4.12Å; V202-L706 HydrophobicContact CG2-CD1 3.92Å; V202-L706 HydrophobicContact CG2-CG 4.14Å
203	P	88.9	Confident	91.4	Very high	110 Å²	110	51.9 Å²	51.9	71%	0.714	29%	0.291	S	S	*	.	G	3₁₀ helix	trans	-53.8	-36.5	-170.7	-30.6	35.5	0	0	0	114.8	A201 L205	A201-P203 WeakPolarHBondContact O-CD 3.28Å; P203-L205 VanDerWaalsContact C-N 3.33Å; P203-L205 PolarHBondContact O-N 3.25Å
204	A	89.8	Confident	91.4	Very high	98 Å²	98	50.8 Å²	50.8	81%	0.81	29%	0.288	S	S	*	.	G	3₁₀ helix	trans	-72.5	-21.1	178.9	0	0	0	0	0	114.4	V202	V202-A204 PolarHBondContact O-N 3.45Å
205	L	91.7	Very high	91.4	Very high	84 Å²	84	53.6 Å²	53.6	44%	0.44	30%	0.303	S	S	.	.	G	3₁₀ helix	trans	-112.8	8.9	-174.3	-68.3	161.6	0	0	0	112.4	L196 C197 V202 P203 L207	L196-L205 HydrophobicContact CB-CD1 4.48Å; L196-L205 HydrophobicContact CD2-CD1 4.17Å; C197-L205 WeakPolarHBondContact CA-O 3.29Å; C197-L205 WeakPolarHBondContact CB-O 3.45Å; C197-L205 PolarHBondContact SG-O 3.2Å; V202-L205 HydrophobicContact CB-CB 4.35Å; V202-L205 HydrophobicContact CB-CD1 4.25Å; V202-L205 HydrophobicContact CG1-CD1 4.31Å; V202-L205 CarbonylContact O-C 3.24Å; V202-L205 PolarHBondContact O-N 2.91Å; P203-L205 VanDerWaalsContact C-N 3.33Å; P203-L205 PolarHBondContact O-N 3.25Å; L205-L207 PolarHBondContact O-N 3.42Å
206	R	91.4	Very high	91.6	Very high	191 Å²	191	53.8 Å²	53.8	72%	0.721	30%	0.304	S	S	*	.	P	Polyproline II helix	trans	-65.6	120.3	-176.6	-174.5	176.9	-179.6	174.9	1	110.6	A201 V202	A201-R206 HydrophobicContact CB-CB 4.09Å; A201-R206 HydrophobicContact CB-CG 4.1Å; V202-R206 PolarHBondContact O-N 3.4Å
207	L	91.3	Very high	91.7	Very high	67 Å²	67	53.3 Å²	53.3	35%	0.351	30%	0.301	S	S	.	.	P	Polyproline II helix	trans	-99.2	159.1	175.5	-67.5	175.8	0	0	0	111.4	C197 L205 V211 L215	C197-L207 HydrophobicContact CB-CB 4.36Å; C197-L207 HydrophobicContact CB-CD1 3.75Å; C197-L207 HydrophobicContact CB-CG 3.94Å; C197-L207 PolarHBondContact O-N 2.98Å; L205-L207 PolarHBondContact O-N 3.42Å; L207-V211 HydrophobicContact CB-CB 4.36Å; L207-V211 HydrophobicContact CB-CG1 4.49Å; L207-V211 HydrophobicContact CD1-CG1 4.2Å; L207-V211 HydrophobicContact CD2-CG1 4.49Å; L207-L215 HydrophobicContact CD1-CD1 4.3Å
208	G	91.1	Very high	91.9	Very high	32 Å²	32	58.5 Å²	58.5	33%	0.33	32%	0.321	S	S	.	.	P	Polyproline II helix	trans	-62.3	149.4	169.5	0	0	0	0	0	111.4	Y210 V211 H212	G208-Y210 VanDerWaalsContact C-N 3.32Å; G208-Y210 PolarHBondContact O-N 2.99Å; G208-V211 WeakPolarHBondContact O-CB 3.26Å; G208-V211 PolarHBondContact O-N 3.44Å; G208-H212 PolarHBondContact O-CD2 3.17Å; G208-H212 PolarHBondContact O-N 3.36Å
209	I	91.3	Very high	92.2	Very high	53 Å²	53	58.6 Å²	58.6	27%	0.272	32%	0.322	S	S	.	.	H	α-helix	trans	-59	-44.8	-172	-61.8	170.3	0	0	0	111.7	V211 H212 A213 V262 Q266	I209-V211 VanDerWaalsContact C-N 3.3Å; I209-V211 PolarHBondContact O-N 2.86Å; I209-H212 WeakPolarHBondContact CA-NE2 3.49Å; I209-A213 VanDerWaalsContact O-CB 3.26Å; I209-A213 WeakPolarHBondContact O-CB 3.18Å; I209-A213 PolarHBondContact O-N 2.89Å; I209-A213 VanDerWaalsContact O-N 3.07Å; I209-V262 HydrophobicContact CG2-CG1 3.89Å; I209-Q266 WeakPolarHBondContact CD1-O 3.14Å
210	Y	92.3	Very high	92.8	Very high	142 Å²	142	56.8 Å²	56.8	56%	0.557	31%	0.308	S	S	*	.	H	α-helix	trans	-63.4	-33.6	176.4	66.1	-87.5	0	0	0	113	G208 T214	G208-Y210 VanDerWaalsContact C-N 3.32Å; G208-Y210 PolarHBondContact O-N 2.99Å; Y210-T214 WeakPolarHBondContact O-CB 3.47Å; Y210-T214 VanDerWaalsContact O-CG2 3.24Å; Y210-T214 WeakPolarHBondContact O-CG2 3.4Å; Y210-T214 PolarHBondContact O-N 2.94Å; Y210-T214 PolarHBondContact O-OG1 3.48Å
211	V	94.3	Very high	93.2	Very high	41 Å²	41	60.5 Å²	60.5	25%	0.248	32%	0.324	C	S	.	.	H	α-helix	trans	-67.4	-52.9	-179.2	-176.3	0	0	0	0	110.3	L207 G208 I209 A213 T214 L215	L207-V211 HydrophobicContact CB-CB 4.36Å; L207-V211 HydrophobicContact CB-CG1 4.49Å; L207-V211 HydrophobicContact CD1-CG1 4.2Å; L207-V211 HydrophobicContact CD2-CG1 4.49Å; G208-V211 WeakPolarHBondContact O-CB 3.26Å; G208-V211 PolarHBondContact O-N 3.44Å; I209-V211 VanDerWaalsContact C-N 3.3Å; I209-V211 PolarHBondContact O-N 2.86Å; V211-A213 VanDerWaalsContact C-N 3.33Å; V211-A213 PolarHBondContact O-N 3.27Å; V211-T214 PolarHBondContact O-N 3.27Å; V211-T214 PolarHBondContact O-OG1 2.96Å; V211-L215 HydrophobicContact CG1-CD1 4.21Å; V211-L215 VanDerWaalsContact O-CG 3.31Å; V211-L215 WeakPolarHBondContact O-CG 3.27Å; V211-L215 PolarHBondContact O-N 3.45Å
212	H	93.3	Very high	93.7	Very high	3 Å²	3	61 Å²	61	1%	0.014	33%	0.325	C	S	.	.	H	α-helix	trans	-69.4	-34.4	-179.2	70	72.4	0	0	0	111.5	L194 E198 G208 I209 L215 E216	L194-H212 HydrophobicContact CD1-CB 4.16Å; E198-H212 HydrophobicContact CG-CB 4.08Å; G208-H212 PolarHBondContact O-CD2 3.17Å; G208-H212 PolarHBondContact O-N 3.36Å; I209-H212 WeakPolarHBondContact CA-NE2 3.49Å; H212-L215 PolarHBondContact O-N 3.06Å; H212-E216 WeakPolarHBondContact O-CB 3.24Å; H212-E216 PolarHBondContact O-N 3.25Å
213	A	93.2	Very high	93.9	Very high	0 Å²	0	60 Å²	60	0%	0	32%	0.319	C	S	.	.	H	α-helix	trans	-65.2	-39.4	176.1	0	0	0	0	0	112.6	I209 V211 E216 L217 V262 L263	I209-A213 VanDerWaalsContact O-CB 3.26Å; I209-A213 WeakPolarHBondContact O-CB 3.18Å; I209-A213 PolarHBondContact O-N 2.89Å; I209-A213 VanDerWaalsContact O-N 3.07Å; V211-A213 VanDerWaalsContact C-N 3.33Å; V211-A213 PolarHBondContact O-N 3.27Å; A213-E216 PolarHBondContact O-N 2.84Å; A213-L217 WeakPolarHBondContact O-CG 3.49Å; A213-L217 PolarHBondContact O-N 3.43Å; A213-V262 HydrophobicContact CB-CG1 4.43Å; A213-L263 HydrophobicContact CB-CB 4.23Å; A213-L263 HydrophobicContact CB-CD1 4.06Å
214	T	94.9	Very high	94.3	Very high	70 Å²	70	57.1 Å²	57.1	43%	0.429	30%	0.299	S	S	.	.	H	α-helix	trans	-70.6	-36.8	175.6	49.2	0	0	0	0	112.5	Y210 V211 E216 L217 F218 L263	Y210-T214 WeakPolarHBondContact O-CB 3.47Å; Y210-T214 VanDerWaalsContact O-CG2 3.24Å; Y210-T214 WeakPolarHBondContact O-CG2 3.4Å; Y210-T214 PolarHBondContact O-N 2.94Å; Y210-T214 PolarHBondContact O-OG1 3.48Å; V211-T214 PolarHBondContact O-N 3.27Å; V211-T214 PolarHBondContact O-OG1 2.96Å; T214-E216 VanDerWaalsContact C-N 3.35Å; T214-L217 PolarHBondContact O-N 3.28Å; T214-F218 WeakPolarHBondContact O-CB 3.29Å; T214-F218 PolarHBondContact O-N 2.89Å; T214-L263 HydrophobicContact CG2-CD1 4.3Å
215	L	95.3	Very high	94.6	Very high	70 Å²	70	56.7 Å²	56.7	37%	0.366	28%	0.279	S	S	.	.	H	α-helix	trans	-63.2	-40.9	171.9	-71.2	173.7	0	0	0	112	L194 L207 V211 H212 F218 A219	L194-L215 HydrophobicContact CD1-CB 4.14Å; L194-L215 HydrophobicContact CD1-CD1 4.18Å; L207-L215 HydrophobicContact CD1-CD1 4.3Å; V211-L215 HydrophobicContact CG1-CD1 4.21Å; V211-L215 VanDerWaalsContact O-CG 3.31Å; V211-L215 WeakPolarHBondContact O-CG 3.27Å; V211-L215 PolarHBondContact O-N 3.45Å; H212-L215 PolarHBondContact O-N 3.06Å; L215-F218 PolarHBondContact O-N 3.22Å; L215-A219 WeakPolarHBondContact O-CB 3.27Å; L215-A219 PolarHBondContact O-N 3.45Å
216	E	95.8	Very high	94.8	Very high	6 Å²	6	52.9 Å²	52.9	3%	0.028	26%	0.259	C	S	.	.	H	α-helix	trans	-60.6	-51.6	174.5	-174.3	167	-167.5	0	0	110.9	L191 L194 H212 A213 T214 F218 A219 L220 A259 R271 R277	L191-E216 HydrophobicContact CD2-CG 4.44Å; L194-E216 HydrophobicContact CD2-CB 3.68Å; L194-E216 HydrophobicContact CD2-CG 4.37Å; H212-E216 WeakPolarHBondContact O-CB 3.24Å; H212-E216 PolarHBondContact O-N 3.25Å; A213-E216 PolarHBondContact O-N 2.84Å; T214-E216 VanDerWaalsContact C-N 3.35Å; E216-F218 VanDerWaalsContact C-N 3.32Å; E216-F218 PolarHBondContact O-N 2.87Å; E216-A219 PolarHBondContact O-N 3.1Å; E216-L220 HydrophobicContact CG-CD1 4.09Å; E216-L220 HydrophobicContact CG-CG 4.41Å; E216-L220 VanDerWaalsContact O-CG 3.29Å; E216-L220 WeakPolarHBondContact O-CG 3.41Å; E216-L220 PolarHBondContact O-N 2.86Å; E216-A259 HydrophobicContact CG-CB 4.09Å; E216-R271 IonicContact OE2-NH1 2.69Å; E216-R277 IonicContact OE1-CZ 3.07Å; E216-R277 IonicContact OE1-NE 2.74Å; E216-R277 IonicContact OE1-NH2 3.15Å; E216-R277 PolarHBondContact OE1-NH2 3.17Å; E216-R277 IonicContact OE2-NH2 3.16Å; E216-R277 PolarHBondContact OE2-NH2 3.26Å
217	L	96.1	Very high	94.9	Very high	29 Å²	29	44.3 Å²	44.3	15%	0.152	23%	0.228	C	C	.	.	H	α-helix	trans	-58.9	-42.4	177.3	-72.6	173.9	0	0	0	112.4	A213 T214 A219 L220 M221 F256 A259 I260 L263	A213-L217 WeakPolarHBondContact O-CG 3.49Å; A213-L217 PolarHBondContact O-N 3.43Å; T214-L217 PolarHBondContact O-N 3.28Å; L217-A219 PolarHBondContact O-N 3.36Å; L217-L220 PolarHBondContact O-N 3.49Å; L217-M221 VanDerWaalsContact O-CG 3.27Å; L217-M221 WeakPolarHBondContact O-CG 3.25Å; L217-M221 PolarHBondContact O-N 3.27Å; L217-F256 HydrophobicContact CD2-CD2 3.95Å; L217-F256 HydrophobicContact CD2-CE2 3.82Å; L217-F256 HydrophobicContact CD2-CZ 4.36Å; L217-A259 HydrophobicContact CD2-CB 3.71Å; L217-A259 HydrophobicContact CG-CB 4.07Å; L217-I260 HydrophobicContact CD2-CG1 4.02Å; L217-L263 HydrophobicContact CD1-CD2 3.76Å
218	F	96.6	Very high	95.1	Very high	133 Å²	133	44.4 Å²	44.4	58%	0.583	23%	0.233	S	C	*	.	H	α-helix	trans	-59.1	-48.3	175.9	174.1	-101.9	0	0	0	111.6	T214 L215 E216 L220 M221 V222	T214-F218 WeakPolarHBondContact O-CB 3.29Å; T214-F218 PolarHBondContact O-N 2.89Å; L215-F218 PolarHBondContact O-N 3.22Å; E216-F218 VanDerWaalsContact C-N 3.32Å; E216-F218 PolarHBondContact O-N 2.87Å; F218-L220 PolarHBondContact O-N 2.95Å; F218-M221 PolarHBondContact O-N 2.82Å; F218-V222 HydrophobicContact CE1-CG2 4.38Å; F218-V222 HydrophobicContact CZ-CG2 4.29Å; F218-V222 PolarHBondContact O-N 3.41Å; F218-V222 VanDerWaalsContact O-N 3.15Å
219	A	97	Very high	95.1	Very high	2 Å²	2	44.6 Å²	44.6	2%	0.017	23%	0.226	C	C	.	.	H	α-helix	trans	-63.5	-41.6	178.4	0	0	0	0	0	112.1	T187 L190 L191 L215 E216 L217 M221 V222 V223	T187-A219 HydrophobicContact CG2-CB 4.17Å; T187-A219 WeakPolarHBondContact CG2-O 3.49Å; L190-A219 HydrophobicContact CD2-CB 4.33Å; L191-A219 HydrophobicContact CD1-CB 4.35Å; L191-A219 HydrophobicContact CD2-CB 3.71Å; L191-A219 HydrophobicContact CG-CB 3.78Å; L215-A219 WeakPolarHBondContact O-CB 3.27Å; L215-A219 PolarHBondContact O-N 3.45Å; E216-A219 PolarHBondContact O-N 3.1Å; L217-A219 PolarHBondContact O-N 3.36Å; A219-M221 VanDerWaalsContact C-N 3.32Å; A219-M221 PolarHBondContact O-N 3.26Å; A219-V222 WeakPolarHBondContact O-CB 3.44Å; A219-V222 PolarHBondContact O-N 3.03Å; A219-V223 PolarHBondContact O-N 3.46Å; A219-V223 VanDerWaalsContact O-N 3.1Å
220	L	97.1	Very high	95.1	Very high	0 Å²	0	43.3 Å²	43.3	0%	0	22%	0.219	C	C	.	.	H	α-helix	trans	-63.7	-35.7	175.9	-65	177.2	0	0	0	112	L191 E216 L217 F218 V222 V223 V224 L252 Q255 F256 A259 F280	L191-L220 HydrophobicContact CD1-CD2 4.27Å; L191-L220 HydrophobicContact CD2-CD2 4.22Å; E216-L220 HydrophobicContact CG-CD1 4.09Å; E216-L220 HydrophobicContact CG-CG 4.41Å; E216-L220 VanDerWaalsContact O-CG 3.29Å; E216-L220 WeakPolarHBondContact O-CG 3.41Å; E216-L220 PolarHBondContact O-N 2.86Å; L217-L220 PolarHBondContact O-N 3.49Å; F218-L220 PolarHBondContact O-N 2.95Å; L220-V222 VanDerWaalsContact C-N 3.33Å; L220-V222 PolarHBondContact O-N 2.93Å; L220-V223 WeakPolarHBondContact O-CB 3.37Å; L220-V223 PolarHBondContact O-N 2.9Å; L220-V223 VanDerWaalsContact O-N 3.15Å; L220-V224 WeakPolarHBondContact O-CG2 3.31Å; L220-V224 PolarHBondContact O-N 2.68Å; L220-L252 HydrophobicContact CB-CD1 3.98Å; L220-L252 HydrophobicContact CD2-CD1 3.79Å; L220-L252 HydrophobicContact CG-CD1 4.39Å; L220-Q255 HydrophobicContact CD1-CB 4.1Å; L220-Q255 HydrophobicContact CD2-CB 4.29Å; L220-F256 HydrophobicContact CB-CD2 4.12Å; L220-F256 HydrophobicContact CD1-CB 4.23Å; L220-F256 HydrophobicContact CD1-CD2 4.21Å; L220-A259 HydrophobicContact CD1-CB 4.38Å; L220-F280 HydrophobicContact CD2-CE2 4.39Å; L220-F280 HydrophobicContact CD2-CZ 4.34Å
221	M	97.3	Very high	95.1	Very high	100 Å²	100	39.5 Å²	39.5	49%	0.493	21%	0.207	S	C	.	.	H	α-helix	trans	-65.5	-34.4	174.1	-72.3	-57.6	-63.9	0	0	112.7	L217 F218 A219 V223 V224 F225 F256	L217-M221 VanDerWaalsContact O-CG 3.27Å; L217-M221 WeakPolarHBondContact O-CG 3.25Å; L217-M221 PolarHBondContact O-N 3.27Å; F218-M221 PolarHBondContact O-N 2.82Å; A219-M221 VanDerWaalsContact C-N 3.32Å; A219-M221 PolarHBondContact O-N 3.26Å; M221-V223 VanDerWaalsContact C-N 3.34Å; M221-V224 WeakPolarHBondContact O-CB 3.41Å; M221-V224 PolarHBondContact O-N 2.68Å; M221-F225 PolarHBondContact O-N 3.47Å; M221-F256 HydrophobicContact CG-CE2 4.39Å; M221-F256 HydrophobicContact SD-CE2 3.77Å; M221-F256 HydrophobicContact SD-CZ 4.16Å
222	V	97.1	Very high	95	Very high	28 Å²	28	44.7 Å²	44.7	17%	0.17	22%	0.222	C	C	.	.	H	α-helix	trans	-65.1	-40.4	171.3	178.8	0	0	0	0	110.6	M183 T187 F218 A219 L220 V224 F225 E226	M183-V222 HydrophobicContact CE-CG1 4.48Å; M183-V222 HydrophobicContact CG-CG1 3.99Å; M183-V222 HydrophobicContact SD-CG1 4.1Å; T187-V222 HydrophobicContact CG2-CB 4.04Å; T187-V222 HydrophobicContact CG2-CG1 4.13Å; T187-V222 WeakPolarHBondContact OG1-CG1 3.46Å; F218-V222 HydrophobicContact CE1-CG2 4.38Å; F218-V222 HydrophobicContact CZ-CG2 4.29Å; F218-V222 PolarHBondContact O-N 3.41Å; F218-V222 VanDerWaalsContact O-N 3.15Å; A219-V222 WeakPolarHBondContact O-CB 3.44Å; A219-V222 PolarHBondContact O-N 3.03Å; L220-V222 VanDerWaalsContact C-N 3.33Å; L220-V222 PolarHBondContact O-N 2.93Å; V222-V224 VanDerWaalsContact C-N 3.34Å; V222-V224 PolarHBondContact O-N 2.86Å; V222-F225 WeakPolarHBondContact O-CB 3.28Å; V222-F225 PolarHBondContact O-N 2.84Å; V222-E226 WeakPolarHBondContact O-CG 3.45Å; V222-E226 PolarHBondContact O-N 2.77Å
223	V	96.9	Very high	94.8	Very high	2 Å²	2	46.1 Å²	46.1	1%	0.012	23%	0.228	C	C	.	.	H	α-helix	trans	-63.5	-38.4	174.2	-178.9	0	0	0	0	111.9	T187 L191 A219 L220 M221 F225 E226 L227 L252 F280	T187-V223 HydrophobicContact CG2-CG2 3.76Å; L191-V223 HydrophobicContact CD1-CG2 4.22Å; A219-V223 PolarHBondContact O-N 3.46Å; A219-V223 VanDerWaalsContact O-N 3.1Å; L220-V223 WeakPolarHBondContact O-CB 3.37Å; L220-V223 PolarHBondContact O-N 2.9Å; L220-V223 VanDerWaalsContact O-N 3.15Å; M221-V223 VanDerWaalsContact C-N 3.34Å; V223-F225 VanDerWaalsContact C-N 3.34Å; V223-F225 PolarHBondContact O-N 2.77Å; V223-E226 WeakPolarHBondContact O-CB 3.38Å; V223-E226 PolarHBondContact O-N 3.28Å; V223-L227 HydrophobicContact CG1-CD1 4.49Å; V223-L227 WeakPolarHBondContact O-CG 3.23Å; V223-L227 PolarHBondContact O-N 3.3Å; V223-L252 HydrophobicContact CB-CD1 4.28Å; V223-L252 HydrophobicContact CG1-CD1 4.26Å; V223-L252 HydrophobicContact CG1-CD2 4.2Å; V223-F280 HydrophobicContact CG1-CD1 4.06Å; V223-F280 HydrophobicContact CG1-CE1 3.88Å; V223-F280 HydrophobicContact CG2-CD1 4.46Å
224	V	97.4	Very high	94.5	Very high	49 Å²	49	47.8 Å²	47.8	30%	0.297	24%	0.236	S	C	.	.	H	α-helix	trans	-57.9	-48.5	172.4	172.5	0	0	0	0	110.1	L220 M221 V222 E226 L227 C228 L252	L220-V224 WeakPolarHBondContact O-CG2 3.31Å; L220-V224 PolarHBondContact O-N 2.68Å; M221-V224 WeakPolarHBondContact O-CB 3.41Å; M221-V224 PolarHBondContact O-N 2.68Å; V222-V224 VanDerWaalsContact C-N 3.34Å; V222-V224 PolarHBondContact O-N 2.86Å; V224-E226 VanDerWaalsContact C-N 3.33Å; V224-E226 PolarHBondContact O-N 3.5Å; V224-L227 PolarHBondContact O-N 2.62Å; V224-C228 PolarHBondContact O-N 2.96Å; V224-C228 PolarHBondContact O-SG 3.11Å; V224-L252 HydrophobicContact CG2-CD1 4.39Å; V224-L252 HydrophobicContact CG2-CD2 3.82Å; V224-L252 HydrophobicContact CG2-CG 4.46Å
225	F	96.1	Very high	94.2	Very high	88 Å²	88	46 Å²	46	39%	0.386	23%	0.232	S	C	.	.	H	α-helix	trans	-58.1	-43.1	177.7	172.9	-100	0	0	0	112.5	F174 M183 M221 V222 V223 L227 C228 M229	F174-F225 HydrophobicContact CE1-CE1 4.48Å; F174-F225 HydrophobicContact CE1-CZ 4.29Å; F174-F225 HydrophobicContact CZ-CE1 4.4Å; F174-F225 HydrophobicContact CZ-CZ 4.04Å; M183-F225 HydrophobicContact CE-CD1 3.98Å; M183-F225 HydrophobicContact CE-CE1 4.02Å; M183-F225 HydrophobicContact SD-CE1 4.48Å; M221-F225 PolarHBondContact O-N 3.47Å; V222-F225 WeakPolarHBondContact O-CB 3.28Å; V222-F225 PolarHBondContact O-N 2.84Å; V223-F225 VanDerWaalsContact C-N 3.34Å; V223-F225 PolarHBondContact O-N 2.77Å; F225-L227 PolarHBondContact O-N 3.25Å; F225-C228 PolarHBondContact O-N 2.8Å; F225-M229 HydrophobicContact CE1-CG 4.26Å; F225-M229 HydrophobicContact CE2-CE 3.58Å; F225-M229 HydrophobicContact CE2-CG 4.17Å; F225-M229 HydrophobicContact CZ-CE 3.5Å; F225-M229 VanDerWaalsContact CZ-CE 3.5Å; F225-M229 HydrophobicContact CZ-CG 4.01Å; F225-M229 WeakPolarHBondContact O-CG 3.21Å; F225-M229 PolarHBondContact O-N 3.09Å
226	E	94.3	Very high	94	Very high	4 Å²	4	48.2 Å²	48.2	2%	0.019	24%	0.244	C	C	.	.	H	α-helix	trans	-59.5	-46	175.4	-69.7	169	-169.3	0	0	112.4	F180 M183 E184 V222 V223 V224 M229 K230 K248	F180-E226 HydrophobicContact CE2-CG 4.25Å; F180-E226 HydrophobicContact CZ-CB 4.01Å; F180-E226 HydrophobicContact CZ-CG 4.02Å; M183-E226 HydrophobicContact CE-CG 3.65Å; E184-E226 VanDerWaalsContact CA-OE1 3.3Å; E184-E226 WeakPolarHBondContact CA-OE1 3.44Å; E184-E226 HydrophobicContact CG-CG 4.27Å; V222-E226 WeakPolarHBondContact O-CG 3.45Å; V222-E226 PolarHBondContact O-N 2.77Å; V223-E226 WeakPolarHBondContact O-CB 3.38Å; V223-E226 PolarHBondContact O-N 3.28Å; V224-E226 VanDerWaalsContact C-N 3.33Å; V224-E226 PolarHBondContact O-N 3.5Å; E226-M229 PolarHBondContact O-N 3.45Å; E226-K230 PolarHBondContact O-N 3.41Å; E226-K248 IonicContact OE2-NZ 3.7Å
227	L	94.6	Very high	93.8	Very high	11 Å²	11	54.1 Å²	54.1	6%	0.058	27%	0.271	C	S	.	.	H	α-helix	trans	-66.2	-40	179	-70.6	178.7	0	0	0	111.8	V223 V224 F225 M229 K230 L231 F239 K248 L252	V223-L227 HydrophobicContact CG1-CD1 4.49Å; V223-L227 WeakPolarHBondContact O-CG 3.23Å; V223-L227 PolarHBondContact O-N 3.3Å; V224-L227 PolarHBondContact O-N 2.62Å; F225-L227 PolarHBondContact O-N 3.25Å; L227-M229 VanDerWaalsContact C-N 3.31Å; L227-M229 PolarHBondContact O-N 3.18Å; L227-K230 PolarHBondContact O-N 3.36Å; L227-L231 WeakPolarHBondContact O-CB 3.16Å; L227-L231 PolarHBondContact O-N 3.32Å; L227-F239 HydrophobicContact CD2-CE2 4.35Å; L227-F239 HydrophobicContact CD2-CZ 4.29Å; L227-K248 HydrophobicContact CD2-CD 4.11Å; L227-L252 HydrophobicContact CD1-CD2 3.58Å
228	C	94.8	Very high	93.5	Very high	69 Å²	69	54.6 Å²	54.6	47%	0.466	28%	0.275	S	S	.	.	H	α-helix	trans	-59.9	-41.5	174.2	-70.6	0	0	0	0	111.8	V224 F225 L231 R232	V224-C228 PolarHBondContact O-N 2.96Å; V224-C228 PolarHBondContact O-SG 3.11Å; F225-C228 PolarHBondContact O-N 2.8Å; C228-L231 PolarHBondContact O-N 2.64Å; C228-R232 WeakPolarHBondContact O-CB 3.32Å; C228-R232 PolarHBondContact O-N 2.95Å
229	M	92.6	Very high	93.3	Very high	36 Å²	36	49.1 Å²	49.1	18%	0.177	25%	0.251	C	S	.	.	H	α-helix	trans	-68.4	-39.2	177	-73.4	-65	-161.5	0	0	112.4	F174 F180 F225 E226 L227 R232 W233	F174-M229 HydrophobicContact CD1-CB 4.48Å; F174-M229 HydrophobicContact CD1-CE 4.01Å; F174-M229 HydrophobicContact CD1-CG 4.18Å; F174-M229 HydrophobicContact CD1-SD 3.86Å; F174-M229 HydrophobicContact CE1-CB 4.34Å; F174-M229 HydrophobicContact CE1-CE 3.47Å; F174-M229 VanDerWaalsContact CE1-CE 3.47Å; F174-M229 HydrophobicContact CE1-CG 3.73Å; F174-M229 HydrophobicContact CE1-SD 3.75Å; F174-M229 HydrophobicContact CE2-CE 4.38Å; F174-M229 HydrophobicContact CZ-CE 3.68Å; F180-M229 HydrophobicContact CE2-CB 4.18Å; F180-M229 HydrophobicContact CZ-CB 4.37Å; F225-M229 HydrophobicContact CE1-CG 4.26Å; F225-M229 HydrophobicContact CE2-CE 3.58Å; F225-M229 HydrophobicContact CE2-CG 4.17Å; F225-M229 HydrophobicContact CZ-CE 3.5Å; F225-M229 VanDerWaalsContact CZ-CE 3.5Å; F225-M229 HydrophobicContact CZ-CG 4.01Å; F225-M229 WeakPolarHBondContact O-CG 3.21Å; F225-M229 PolarHBondContact O-N 3.09Å; E226-M229 PolarHBondContact O-N 3.45Å; L227-M229 VanDerWaalsContact C-N 3.31Å; L227-M229 PolarHBondContact O-N 3.18Å; M229-R232 PolarHBondContact O-N 3.21Å; M229-W233 PolarHBondContact O-N 3.06Å
230	K	90.3	Very high	93.1	Very high	27 Å²	27	53.5 Å²	53.5	12%	0.117	27%	0.273	C	S	.	.	H	α-helix	trans	-65.6	-39.6	172.8	-73.4	-178.2	-177.8	175.3	0	112.3	E184 E226 L227 R232 W233 L234 D283	E184-K230 WeakPolarHBondContact OE1-CE 3.38Å; E184-K230 IonicContact OE1-NZ 2.91Å; E184-K230 PolarHBondContact OE1-NZ 2.78Å; E226-K230 PolarHBondContact O-N 3.41Å; L227-K230 PolarHBondContact O-N 3.36Å; K230-R232 VanDerWaalsContact C-N 3.33Å; K230-W233 PolarHBondContact O-N 3.12Å; K230-L234 WeakPolarHBondContact O-CB 3.27Å; K230-L234 WeakPolarHBondContact O-CG 3.24Å; K230-L234 PolarHBondContact O-N 3.02Å; K230-D283 IonicContact NZ-OD2 3.76Å
231	L	92.9	Very high	92.9	Very high	61 Å²	61	58.7 Å²	58.7	32%	0.319	29%	0.293	S	S	.	.	H	α-helix	trans	-62.1	-41.2	174.8	177.3	63.7	0	0	0	111.4	L227 C228 W233 G235 L236 F239	L227-L231 WeakPolarHBondContact O-CB 3.16Å; L227-L231 PolarHBondContact O-N 3.32Å; C228-L231 PolarHBondContact O-N 2.64Å; L231-W233 VanDerWaalsContact C-N 3.29Å; L231-W233 PolarHBondContact O-N 3.46Å; L231-G235 WeakPolarHBondContact O-CA 3.39Å; L231-G235 PolarHBondContact O-N 3.32Å; L231-L236 HydrophobicContact CD1-CB 4.23Å; L231-F239 HydrophobicContact CB-CD2 4.13Å; L231-F239 HydrophobicContact CB-CE2 4.33Å; L231-F239 HydrophobicContact CB-CG 4.47Å; L231-F239 HydrophobicContact CD1-CB 3.64Å; L231-F239 HydrophobicContact CD1-CD1 4Å; L231-F239 HydrophobicContact CD1-CD2 4.18Å; L231-F239 HydrophobicContact CD1-CG 3.68Å
232	R	91.8	Very high	92.6	Very high	150 Å²	150	57.2 Å²	57.2	57%	0.566	28%	0.284	S	S	*	.	H	α-helix	trans	-61.9	-34.8	176	-179.3	176.9	175.4	170.2	-0	112.8	A171 C228 M229 K230	A171-R232 HydrophobicContact CB-CG 4.22Å; C228-R232 WeakPolarHBondContact O-CB 3.32Å; C228-R232 PolarHBondContact O-N 2.95Å; M229-R232 PolarHBondContact O-N 3.21Å; K230-R232 VanDerWaalsContact C-N 3.33Å
233	W	89.1	Confident	92.4	Very high	34 Å²	34	63.8 Å²	63.8	13%	0.129	31%	0.311	C	S	.	.	H	α-helix	trans	-79.6	-52.7	176.9	164	42.2	0	0	0	112.6	A171 Y172 A175 H176 M229 K230 L231	A171-W233 HydrophobicContact CB-CB 4.16Å; Y172-W233 AromaticContact CD2-CE2 3.79Å; Y172-W233 AromaticContact CD2-CZ2 3.96Å; Y172-W233 HydrophobicContact CD2-CZ2 3.96Å; Y172-W233 AromaticContact CD2-NE1 3.56Å; Y172-W233 HydrophobicContact CE2-CZ2 4.11Å; A175-W233 HydrophobicContact CB-CE3 4.45Å; H176-W233 AromaticContact CE1-CH2 3.49Å; H176-W233 VanDerWaalsContact CE1-CH2 3.49Å; H176-W233 WeakPolarHBondContact CE1-CH2 3.39Å; H176-W233 AromaticContact CE1-CZ2 3.67Å; H176-W233 AromaticContact CE1-CZ3 3.79Å; H176-W233 AromaticContact NE2-CH2 3.95Å; M229-W233 PolarHBondContact O-N 3.06Å; K230-W233 PolarHBondContact O-N 3.12Å; L231-W233 VanDerWaalsContact C-N 3.29Å; L231-W233 PolarHBondContact O-N 3.46Å
234	L	87.1	Confident	92.1	Very high	34 Å²	34	67.3 Å²	67.3	18%	0.178	32%	0.324	C	S	.	.	H	α-helix	trans	-77.3	-24.7	-171.3	-65.6	169.8	0	0	0	113.9	T161 K230 T238	T161-L234 HydrophobicContact CG2-CD2 3.8Å; K230-L234 WeakPolarHBondContact O-CB 3.27Å; K230-L234 WeakPolarHBondContact O-CG 3.24Å; K230-L234 PolarHBondContact O-N 3.02Å; L234-T238 WeakPolarHBondContact O-CB 3.42Å; L234-T238 PolarHBondContact O-OG1 2.9Å
235	G	88.1	Confident	91.8	Very high	33 Å²	33	65.1 Å²	65.1	34%	0.34	31%	0.311	S	S	.	.			trans	79.8	157.6	-169.5	0	0	0	0	0	113.1	L231 F239	L231-G235 WeakPolarHBondContact O-CA 3.39Å; L231-G235 PolarHBondContact O-N 3.32Å; G235-F239 WeakPolarHBondContact O-CB 3.35Å; G235-F239 PolarHBondContact O-N 3.43Å
236	L	90.9	Very high	91.7	Very high	117 Å²	117	64.2 Å²	64.2	61%	0.613	31%	0.308	S	S	*	.	H	α-helix	trans	-65.3	-44.2	-170.3	-173.5	135.9	0	0	0	113.5	L231 F239 I240	L231-L236 HydrophobicContact CD1-CB 4.23Å; L236-F239 PolarHBondContact O-N 3.39Å; L236-I240 HydrophobicContact CD2-CD1 3.57Å; L236-I240 HydrophobicContact CG-CD1 3.88Å; L236-I240 WeakPolarHBondContact O-CG1 3.25Å; L236-I240 PolarHBondContact O-N 2.91Å
237	H	91.2	Very high	91.7	Very high	129 Å²	129	67.7 Å²	67.7	60%	0.597	33%	0.33	S	S	*	.	H	α-helix	trans	-62.1	-47.5	-179.8	178.9	-95.2	0	0	0	112.2	R241	H237-R241 WeakPolarHBondContact O-CB 3.49Å; H237-R241 PolarHBondContact O-N 3.03Å; H237-R241 VanDerWaalsContact O-N 3.15Å
238	T	90.9	Very high	91.7	Very high	39 Å²	39	67.3 Å²	67.3	24%	0.239	33%	0.328	C	S	.	.	H	α-helix	trans	-66.5	-39.4	178.1	-47	0	0	0	0	111.6	T161 L234 R241 H242	T161-T238 HydrophobicContact CG2-CG2 3.84Å; L234-T238 WeakPolarHBondContact O-CB 3.42Å; L234-T238 PolarHBondContact O-OG1 2.9Å; T238-R241 PolarHBondContact O-N 3.35Å; T238-H242 WeakPolarHBondContact O-CB 3.44Å; T238-H242 PolarHBondContact O-N 3.32Å
239	F	92.1	Very high	91.7	Very high	19 Å²	19	65.8 Å²	65.8	8%	0.083	32%	0.317	C	S	.	.	H	α-helix	trans	-62.3	-45.2	179.5	-177.3	-87.9	0	0	0	112.4	L227 L231 G235 L236 H242 T245	L227-F239 HydrophobicContact CD2-CE2 4.35Å; L227-F239 HydrophobicContact CD2-CZ 4.29Å; L231-F239 HydrophobicContact CB-CD2 4.13Å; L231-F239 HydrophobicContact CB-CE2 4.33Å; L231-F239 HydrophobicContact CB-CG 4.47Å; L231-F239 HydrophobicContact CD1-CB 3.64Å; L231-F239 HydrophobicContact CD1-CD1 4Å; L231-F239 HydrophobicContact CD1-CD2 4.18Å; L231-F239 HydrophobicContact CD1-CG 3.68Å; G235-F239 WeakPolarHBondContact O-CB 3.35Å; G235-F239 PolarHBondContact O-N 3.43Å; L236-F239 PolarHBondContact O-N 3.39Å; F239-H242 PolarHBondContact O-N 3.31Å; F239-T245 HydrophobicContact CE2-CG2 4.23Å; F239-T245 PolarHBondContact O-OG1 3.46Å
240	I	92.8	Very high	91.9	Very high	93 Å²	93	67.5 Å²	67.5	48%	0.477	33%	0.332	S	S	.	.	H	α-helix	trans	-69.9	-38.3	-180	-66.8	171.9	0	0	0	111.3	L236 H242 M246	L236-I240 HydrophobicContact CD2-CD1 3.57Å; L236-I240 HydrophobicContact CG-CD1 3.88Å; L236-I240 WeakPolarHBondContact O-CG1 3.25Å; L236-I240 PolarHBondContact O-N 2.91Å; I240-H242 PolarHBondContact O-N 3Å; I240-M246 HydrophobicContact CB-SD 4.47Å; I240-M246 HydrophobicContact CG1-SD 4.49Å; I240-M246 HydrophobicContact CG2-SD 4.47Å; I240-M246 WeakPolarHBondContact O-CG 3.29Å
241	R	92.9	Very high	92.2	Very high	109 Å²	109	66.9 Å²	66.9	41%	0.411	33%	0.33	S	S	.	.	H	α-helix	trans	-69.1	-22.3	179.3	-160.3	174.4	-172.4	-179.4	4.7	112.7	P82 H237 T238 K243	P82-R241 VanDerWaalsContact CG-CZ 3.44Å; P82-R241 VanDerWaalsContact CG-NH2 3.34Å; P82-R241 PolarHBondContact O-NH2 3.27Å; H237-R241 WeakPolarHBondContact O-CB 3.49Å; H237-R241 PolarHBondContact O-N 3.03Å; H237-R241 VanDerWaalsContact O-N 3.15Å; T238-R241 PolarHBondContact O-N 3.35Å; R241-K243 PolarHBondContact O-N 3.48Å
242	H	91.2	Very high	92.4	Very high	69 Å²	69	64.5 Å²	64.5	32%	0.319	32%	0.318	S	S	.	.			trans	-79.9	100.8	-178.8	-177.6	-101.3	0	0	0	111.5	T238 F239 I240 R244 T245 M246	T238-H242 WeakPolarHBondContact O-CB 3.44Å; T238-H242 PolarHBondContact O-N 3.32Å; F239-H242 PolarHBondContact O-N 3.31Å; I240-H242 PolarHBondContact O-N 3Å; H242-R244 VanDerWaalsContact C-N 3.25Å; H242-R244 PolarHBondContact O-N 3.41Å; H242-T245 WeakPolarHBondContact CB-OG1 3.35Å; H242-T245 WeakPolarHBondContact ND1-CG2 3.31Å; H242-T245 PolarHBondContact ND1-N 2.96Å; H242-T245 PolarHBondContact ND1-OG1 2.9Å; H242-T245 PolarHBondContact O-N 3.36Å; H242-T245 PolarHBondContact O-OG1 3.3Å; H242-M246 PolarHBondContact O-N 2.89Å
243	K	91.6	Very high	92.6	Very high	166 Å²	166	61.4 Å²	61.4	72%	0.722	32%	0.316	S	S	*	.	H	α-helix	trans	-47.1	-41.7	-175.6	-63.7	-178.8	-179.7	176.3	0	113.9	R241 M246 V247	R241-K243 PolarHBondContact O-N 3.48Å; K243-M246 PolarHBondContact O-N 3.47Å; K243-V247 WeakPolarHBondContact O-CG2 3.3Å; K243-V247 PolarHBondContact O-N 2.93Å
244	R	91.2	Very high	92.9	Very high	76 Å²	76	62.9 Å²	62.9	29%	0.287	33%	0.328	S	S	.	.	H	α-helix	trans	-69.2	-42.3	-174.8	-176.6	178.8	79.4	-134.4	3.9	113.1	H242 M246 V247 K248 D283	H242-R244 VanDerWaalsContact C-N 3.25Å; H242-R244 PolarHBondContact O-N 3.41Å; R244-M246 VanDerWaalsContact C-N 3.29Å; R244-V247 PolarHBondContact O-N 3.34Å; R244-K248 PolarHBondContact O-N 3.49Å; R244-D283 WeakPolarHBondContact CD-OD1 3.31Å; R244-D283 IonicContact CZ-OD1 3.75Å; R244-D283 IonicContact NE-OD1 2.72Å; R244-D283 PolarHBondContact NE-OD1 3.06Å; R244-D283 IonicContact NH2-OD1 3.11Å; R244-D283 PolarHBondContact NH2-OD1 3.46Å
245	T	91.3	Very high	93.3	Very high	4 Å²	4	61.3 Å²	61.3	3%	0.025	32%	0.32	C	S	.	.	H	α-helix	trans	-68.7	-34	177.5	37.7	0	0	0	0	110.6	F239 H242 K248 T249	F239-T245 HydrophobicContact CE2-CG2 4.23Å; F239-T245 PolarHBondContact O-OG1 3.46Å; H242-T245 WeakPolarHBondContact CB-OG1 3.35Å; H242-T245 WeakPolarHBondContact ND1-CG2 3.31Å; H242-T245 PolarHBondContact ND1-N 2.96Å; H242-T245 PolarHBondContact ND1-OG1 2.9Å; H242-T245 PolarHBondContact O-N 3.36Å; H242-T245 PolarHBondContact O-OG1 3.3Å; T245-K248 PolarHBondContact O-N 3.1Å; T245-T249 WeakPolarHBondContact O-CB 3.5Å; T245-T249 PolarHBondContact O-N 3.3Å; T245-T249 PolarHBondContact O-OG1 2.99Å
246	M	93.8	Very high	93.7	Very high	68 Å²	68	62.9 Å²	62.9	34%	0.335	32%	0.317	S	S	.	.	H	α-helix	trans	-63.1	-49.3	173.1	-69.7	-54.8	-63.2	0	0	112	I240 H242 K243 R244 K248 T249 S250	I240-M246 HydrophobicContact CB-SD 4.47Å; I240-M246 HydrophobicContact CG1-SD 4.49Å; I240-M246 HydrophobicContact CG2-SD 4.47Å; I240-M246 WeakPolarHBondContact O-CG 3.29Å; H242-M246 PolarHBondContact O-N 2.89Å; K243-M246 PolarHBondContact O-N 3.47Å; R244-M246 VanDerWaalsContact C-N 3.29Å; M246-K248 VanDerWaalsContact C-N 3.33Å; M246-K248 PolarHBondContact O-N 3.36Å; M246-T249 WeakPolarHBondContact O-CB 3.23Å; M246-T249 PolarHBondContact O-N 3.47Å; M246-T249 VanDerWaalsContact O-N 3.07Å; M246-S250 PolarHBondContact O-N 2.91Å; M246-S250 PolarHBondContact O-OG 2.95Å
247	V	94.6	Very high	93.9	Very high	78 Å²	78	61.2 Å²	61.2	47%	0.473	31%	0.312	S	S	.	.	H	α-helix	trans	-58.1	-44.7	175.5	173.2	0	0	0	0	111.4	K243 R244 T249 S250 V251	K243-V247 WeakPolarHBondContact O-CG2 3.3Å; K243-V247 PolarHBondContact O-N 2.93Å; R244-V247 PolarHBondContact O-N 3.34Å; V247-T249 VanDerWaalsContact C-N 3.29Å; V247-T249 PolarHBondContact O-N 3.07Å; V247-S250 PolarHBondContact O-N 3.18Å; V247-V251 HydrophobicContact CG1-CG2 4.46Å; V247-V251 WeakPolarHBondContact O-CG2 3.26Å; V247-V251 PolarHBondContact O-N 3.46Å
248	K	95.1	Very high	94	Very high	3 Å²	3	57 Å²	57	1%	0.013	29%	0.292	C	S	.	.	H	α-helix	trans	-59.1	-39.7	175.6	-176.7	175	-178.9	-173.1	0	112.2	E226 L227 R244 T245 M246 L252 F280 D283	E226-K248 IonicContact OE2-NZ 3.7Å; L227-K248 HydrophobicContact CD2-CD 4.11Å; R244-K248 PolarHBondContact O-N 3.49Å; T245-K248 PolarHBondContact O-N 3.1Å; M246-K248 VanDerWaalsContact C-N 3.33Å; M246-K248 PolarHBondContact O-N 3.36Å; K248-L252 VanDerWaalsContact O-CB 3.29Å; K248-L252 WeakPolarHBondContact O-CB 3.42Å; K248-L252 PolarHBondContact O-N 3.48Å; K248-F280 HydrophobicContact CD-CD1 4.43Å; K248-F280 HydrophobicContact CG-CD1 4.06Å; K248-F280 HydrophobicContact CG-CE1 3.98Å; K248-D283 HydrophobicContact CD-CB 4.06Å; K248-D283 WeakPolarHBondContact CD-OD2 3.48Å; K248-D283 IonicContact NZ-OD2 2.79Å; K248-D283 PolarHBondContact NZ-OD2 3Å
249	T	95.3	Very high	94.2	Very high	37 Å²	37	55.1 Å²	55.1	23%	0.227	28%	0.281	C	S	.	.	H	α-helix	trans	-69.5	-42.4	178.9	-52.7	0	0	0	0	111.2	T245 M246 V247 L252 V253	T245-T249 WeakPolarHBondContact O-CB 3.5Å; T245-T249 PolarHBondContact O-N 3.3Å; T245-T249 PolarHBondContact O-OG1 2.99Å; M246-T249 WeakPolarHBondContact O-CB 3.23Å; M246-T249 PolarHBondContact O-N 3.47Å; M246-T249 VanDerWaalsContact O-N 3.07Å; V247-T249 VanDerWaalsContact C-N 3.29Å; V247-T249 PolarHBondContact O-N 3.07Å; T249-L252 WeakPolarHBondContact O-CB 3.41Å; T249-L252 PolarHBondContact O-N 2.84Å; T249-V253 WeakPolarHBondContact O-CG2 3.45Å; T249-V253 PolarHBondContact O-N 3.39Å
250	S	95.7	Very high	94.3	Very high	71 Å²	71	57.6 Å²	57.6	50%	0.497	30%	0.295	S	S	.	.	H	α-helix	trans	-61.5	-45.2	174.9	-58.1	0	0	0	0	112	M246 V247 L252 V253 V254	M246-S250 PolarHBondContact O-N 2.91Å; M246-S250 PolarHBondContact O-OG 2.95Å; V247-S250 PolarHBondContact O-N 3.18Å; S250-L252 VanDerWaalsContact C-N 3.34Å; S250-L252 PolarHBondContact O-N 3.35Å; S250-V253 PolarHBondContact O-N 2.89Å; S250-V254 WeakPolarHBondContact O-CG2 3.5Å; S250-V254 PolarHBondContact O-N 3.43Å; S250-V254 VanDerWaalsContact O-N 3.1Å
251	V	96.4	Very high	94.4	Very high	14 Å²	14	55.8 Å²	55.8	9%	0.085	29%	0.287	C	S	.	.	H	α-helix	trans	-63.4	-41	176.5	173.9	0	0	0	0	111.3	V247 V253 V254 Q255 L276 I279 F280	V247-V251 HydrophobicContact CG1-CG2 4.46Å; V247-V251 WeakPolarHBondContact O-CG2 3.26Å; V247-V251 PolarHBondContact O-N 3.46Å; V251-V253 VanDerWaalsContact C-N 3.35Å; V251-V253 PolarHBondContact O-N 3.36Å; V251-V254 PolarHBondContact O-N 3.25Å; V251-Q255 HydrophobicContact CG1-CG 4.35Å; V251-Q255 VanDerWaalsContact CG1-NE2 3.25Å; V251-Q255 WeakPolarHBondContact O-CG 3.37Å; V251-Q255 PolarHBondContact O-N 3.37Å; V251-L276 HydrophobicContact CG1-CB 3.81Å; V251-L276 HydrophobicContact CG2-CB 4.31Å; V251-L276 HydrophobicContact CG2-CD1 4.29Å; V251-I279 HydrophobicContact CB-CG2 4.22Å; V251-I279 HydrophobicContact CG1-CG2 3.95Å; V251-I279 HydrophobicContact CG2-CG2 4.38Å; V251-F280 HydrophobicContact CG1-CE2 4.4Å; V251-F280 HydrophobicContact CG1-CZ 4.12Å
252	L	96.9	Very high	94.4	Very high	12 Å²	12	50.6 Å²	50.6	6%	0.063	27%	0.268	C	S	.	.	H	α-helix	trans	-58.2	-45.6	175.1	173.6	63.1	0	0	0	111.7	L220 V223 V224 L227 K248 T249 S250 Q255 F256 F280	L220-L252 HydrophobicContact CB-CD1 3.98Å; L220-L252 HydrophobicContact CD2-CD1 3.79Å; L220-L252 HydrophobicContact CG-CD1 4.39Å; V223-L252 HydrophobicContact CB-CD1 4.28Å; V223-L252 HydrophobicContact CG1-CD1 4.26Å; V223-L252 HydrophobicContact CG1-CD2 4.2Å; V224-L252 HydrophobicContact CG2-CD1 4.39Å; V224-L252 HydrophobicContact CG2-CD2 3.82Å; V224-L252 HydrophobicContact CG2-CG 4.46Å; L227-L252 HydrophobicContact CD1-CD2 3.58Å; K248-L252 VanDerWaalsContact O-CB 3.29Å; K248-L252 WeakPolarHBondContact O-CB 3.42Å; K248-L252 PolarHBondContact O-N 3.48Å; T249-L252 WeakPolarHBondContact O-CB 3.41Å; T249-L252 PolarHBondContact O-N 2.84Å; S250-L252 VanDerWaalsContact C-N 3.34Å; S250-L252 PolarHBondContact O-N 3.35Å; L252-Q255 PolarHBondContact O-N 2.99Å; L252-F256 WeakPolarHBondContact O-CB 3.39Å; L252-F256 PolarHBondContact O-N 3.01Å; L252-F280 HydrophobicContact CB-CE1 4.43Å; L252-F280 HydrophobicContact CB-CZ 4.41Å
253	V	96.7	Very high	94.5	Very high	85 Å²	85	49.8 Å²	49.8	52%	0.515	27%	0.266	S	S	.	.	H	α-helix	trans	-62.1	-47.1	178.4	171.4	0	0	0	0	111.1	T249 S250 V251 Q255 F256 V257	T249-V253 WeakPolarHBondContact O-CG2 3.45Å; T249-V253 PolarHBondContact O-N 3.39Å; S250-V253 PolarHBondContact O-N 2.89Å; V251-V253 VanDerWaalsContact C-N 3.35Å; V251-V253 PolarHBondContact O-N 3.36Å; V253-Q255 PolarHBondContact O-N 3.36Å; V253-F256 PolarHBondContact O-N 3.23Å; V253-V257 VanDerWaalsContact O-CG2 3.32Å; V253-V257 WeakPolarHBondContact O-CG2 3.45Å; V253-V257 PolarHBondContact O-N 3.46Å
254	V	96	Very high	94.7	Very high	64 Å²	64	47.3 Å²	47.3	39%	0.388	26%	0.264	S	S	.	.	H	α-helix	trans	-59.2	-49.6	178.6	173.2	0	0	0	0	110.9	S250 V251 F256 V257 E258 T273	S250-V254 WeakPolarHBondContact O-CG2 3.5Å; S250-V254 PolarHBondContact O-N 3.43Å; S250-V254 VanDerWaalsContact O-N 3.1Å; V251-V254 PolarHBondContact O-N 3.25Å; V254-F256 VanDerWaalsContact C-N 3.34Å; V254-F256 PolarHBondContact O-N 3.44Å; V254-V257 PolarHBondContact O-N 2.96Å; V254-E258 WeakPolarHBondContact O-CG 3.34Å; V254-E258 PolarHBondContact O-N 3.21Å; V254-T273 HydrophobicContact CG1-CG2 3.97Å
255	Q	95.1	Very high	94.8	Very high	2 Å²	2	50.7 Å²	50.7	1%	0.009	28%	0.277	C	S	.	.	H	α-helix	trans	-66.1	-35.9	-179.8	-69.9	-171.7	30.8	0	0	112.8	L220 V251 L252 V253 E258 A259 R277	L220-Q255 HydrophobicContact CD1-CB 4.1Å; L220-Q255 HydrophobicContact CD2-CB 4.29Å; V251-Q255 HydrophobicContact CG1-CG 4.35Å; V251-Q255 VanDerWaalsContact CG1-NE2 3.25Å; V251-Q255 WeakPolarHBondContact O-CG 3.37Å; V251-Q255 PolarHBondContact O-N 3.37Å; L252-Q255 PolarHBondContact O-N 2.99Å; V253-Q255 PolarHBondContact O-N 3.36Å; Q255-E258 PolarHBondContact O-N 3.33Å; Q255-A259 VanDerWaalsContact O-CB 3.28Å; Q255-A259 WeakPolarHBondContact O-CB 3.43Å; Q255-A259 PolarHBondContact O-N 3.24Å; Q255-R277 VanDerWaalsContact OE1-CG 3.26Å
256	F	96.1	Very high	94.8	Very high	65 Å²	65	54.7 Å²	54.7	29%	0.285	30%	0.295	S	S	.	.	H	α-helix	trans	-65.9	-43.8	177.6	-167.8	-96.7	0	0	0	111.6	L217 L220 M221 L252 V253 V254 A259 I260	L217-F256 HydrophobicContact CD2-CD2 3.95Å; L217-F256 HydrophobicContact CD2-CE2 3.82Å; L217-F256 HydrophobicContact CD2-CZ 4.36Å; L220-F256 HydrophobicContact CB-CD2 4.12Å; L220-F256 HydrophobicContact CD1-CB 4.23Å; L220-F256 HydrophobicContact CD1-CD2 4.21Å; M221-F256 HydrophobicContact CG-CE2 4.39Å; M221-F256 HydrophobicContact SD-CE2 3.77Å; M221-F256 HydrophobicContact SD-CZ 4.16Å; L252-F256 WeakPolarHBondContact O-CB 3.39Å; L252-F256 PolarHBondContact O-N 3.01Å; V253-F256 PolarHBondContact O-N 3.23Å; V254-F256 VanDerWaalsContact C-N 3.34Å; V254-F256 PolarHBondContact O-N 3.44Å; F256-A259 PolarHBondContact O-N 3.48Å; F256-I260 HydrophobicContact CD1-CD1 3.74Å; F256-I260 HydrophobicContact CE1-CD1 3.44Å; F256-I260 VanDerWaalsContact CE1-CD1 3.44Å; F256-I260 HydrophobicContact CE1-CG1 4.44Å; F256-I260 HydrophobicContact CZ-CD1 4.16Å; F256-I260 WeakPolarHBondContact O-CG1 3.47Å; F256-I260 PolarHBondContact O-N 3.17Å; F256-I260 VanDerWaalsContact O-N 3.14Å
257	V	95.4	Very high	94.4	Very high	82 Å²	82	57.3 Å²	57.3	50%	0.497	31%	0.308	S	S	.	.	H	α-helix	trans	-61.1	-47.4	175.3	171.2	0	0	0	0	110.5	V253 V254 I260 V261	V253-V257 VanDerWaalsContact O-CG2 3.32Å; V253-V257 WeakPolarHBondContact O-CG2 3.45Å; V253-V257 PolarHBondContact O-N 3.46Å; V254-V257 PolarHBondContact O-N 2.96Å; V257-I260 PolarHBondContact O-N 3.27Å; V257-V261 HydrophobicContact CG1-CG2 4.42Å; V257-V261 VanDerWaalsContact O-CG2 3.3Å; V257-V261 WeakPolarHBondContact O-CG2 3.37Å; V257-V261 PolarHBondContact O-N 3.34Å
258	E	93.9	Very high	93.8	Very high	40 Å²	40	55.6 Å²	55.6	19%	0.187	30%	0.3	C	S	.	.	H	α-helix	trans	-65.3	-40.6	-179.8	-73	173.8	161.7	0	0	113.1	V254 Q255 I260 V261 V262 T273	V254-E258 WeakPolarHBondContact O-CG 3.34Å; V254-E258 PolarHBondContact O-N 3.21Å; Q255-E258 PolarHBondContact O-N 3.33Å; E258-I260 VanDerWaalsContact C-N 3.3Å; E258-I260 PolarHBondContact O-N 2.81Å; E258-V261 PolarHBondContact O-N 2.96Å; E258-V261 VanDerWaalsContact O-N 3.13Å; E258-V262 WeakPolarHBondContact O-CG2 3.33Å; E258-V262 PolarHBondContact O-N 3.28Å; E258-T273 WeakPolarHBondContact OE1-CG2 3.4Å; E258-T273 PolarHBondContact OE1-OG1 2.74Å; E258-T273 WeakPolarHBondContact OE2-CB 3.37Å; E258-T273 PolarHBondContact OE2-OG1 2.88Å
259	A	93.4	Very high	93.4	Very high	1 Å²	1	58 Å²	58	1%	0.008	31%	0.311	C	S	.	.	H	α-helix	trans	-60.2	-40.9	175.9	0	0	0	0	0	111.5	E216 L217 L220 Q255 F256 V262 L263	E216-A259 HydrophobicContact CG-CB 4.09Å; L217-A259 HydrophobicContact CD2-CB 3.71Å; L217-A259 HydrophobicContact CG-CB 4.07Å; L220-A259 HydrophobicContact CD1-CB 4.38Å; Q255-A259 VanDerWaalsContact O-CB 3.28Å; Q255-A259 WeakPolarHBondContact O-CB 3.43Å; Q255-A259 PolarHBondContact O-N 3.24Å; F256-A259 PolarHBondContact O-N 3.48Å; A259-V262 PolarHBondContact O-N 3.16Å; A259-L263 WeakPolarHBondContact O-CB 3.49Å; A259-L263 PolarHBondContact O-N 2.94Å
260	I	94.6	Very high	92.9	Very high	71 Å²	71	60.6 Å²	60.6	36%	0.364	33%	0.327	S	S	.	.	H	α-helix	trans	-64.2	-45	172.7	-67.3	171.4	0	0	0	110.7	L217 F256 V257 E258 V262 L263 V264	L217-I260 HydrophobicContact CD2-CG1 4.02Å; F256-I260 HydrophobicContact CD1-CD1 3.74Å; F256-I260 HydrophobicContact CE1-CD1 3.44Å; F256-I260 VanDerWaalsContact CE1-CD1 3.44Å; F256-I260 HydrophobicContact CE1-CG1 4.44Å; F256-I260 HydrophobicContact CZ-CD1 4.16Å; F256-I260 WeakPolarHBondContact O-CG1 3.47Å; F256-I260 PolarHBondContact O-N 3.17Å; F256-I260 VanDerWaalsContact O-N 3.14Å; V257-I260 PolarHBondContact O-N 3.27Å; E258-I260 VanDerWaalsContact C-N 3.3Å; E258-I260 PolarHBondContact O-N 2.81Å; I260-V262 VanDerWaalsContact C-N 3.33Å; I260-V262 PolarHBondContact O-N 2.98Å; I260-L263 PolarHBondContact O-N 3.32Å; I260-L263 VanDerWaalsContact O-N 3.16Å; I260-V264 HydrophobicContact CG2-CG2 4.16Å; I260-V264 WeakPolarHBondContact O-CG2 3.39Å; I260-V264 PolarHBondContact O-N 3.31Å
261	V	94.5	Very high	92.6	Very high	54 Å²	54	57.4 Å²	57.4	33%	0.327	30%	0.304	S	S	.	.	H	α-helix	trans	-60.4	-42.2	179	170.2	0	0	0	0	111.3	V257 E258 V264 R265	V257-V261 HydrophobicContact CG1-CG2 4.42Å; V257-V261 VanDerWaalsContact O-CG2 3.3Å; V257-V261 WeakPolarHBondContact O-CG2 3.37Å; V257-V261 PolarHBondContact O-N 3.34Å; E258-V261 PolarHBondContact O-N 2.96Å; E258-V261 VanDerWaalsContact O-N 3.13Å; V261-V264 PolarHBondContact O-N 3.1Å; V261-R265 HydrophobicContact CG1-CG 4.32Å; V261-R265 VanDerWaalsContact O-CB 3.28Å; V261-R265 WeakPolarHBondContact O-CB 3.44Å; V261-R265 WeakPolarHBondContact O-CG 3.49Å; V261-R265 PolarHBondContact O-N 3.48Å
262	V	93.8	Very high	92.4	Very high	0 Å²	0	59.1 Å²	59.1	0%	0	31%	0.314	C	S	.	.	H	α-helix	trans	-63.3	-44.1	174.7	173.7	0	0	0	0	110.9	I209 A213 E258 A259 I260 V264 Q266	I209-V262 HydrophobicContact CG2-CG1 3.89Å; A213-V262 HydrophobicContact CB-CG1 4.43Å; E258-V262 WeakPolarHBondContact O-CG2 3.33Å; E258-V262 PolarHBondContact O-N 3.28Å; A259-V262 PolarHBondContact O-N 3.16Å; I260-V262 VanDerWaalsContact C-N 3.33Å; I260-V262 PolarHBondContact O-N 2.98Å; V262-V264 PolarHBondContact O-N 3.38Å; V262-Q266 WeakPolarHBondContact O-CA 3.46Å; V262-Q266 PolarHBondContact O-N 3.43Å
263	L	93.4	Very high	92.2	Very high	53 Å²	53	60 Å²	60	28%	0.277	32%	0.32	S	S	.	.	H	α-helix	trans	-64.4	-38.5	179.3	-174.1	66	0	0	0	112.2	A213 T214 L217 A259 I260 Q266	A213-L263 HydrophobicContact CB-CB 4.23Å; A213-L263 HydrophobicContact CB-CD1 4.06Å; T214-L263 HydrophobicContact CG2-CD1 4.3Å; L217-L263 HydrophobicContact CD1-CD2 3.76Å; A259-L263 WeakPolarHBondContact O-CB 3.49Å; A259-L263 PolarHBondContact O-N 2.94Å; I260-L263 PolarHBondContact O-N 3.32Å; I260-L263 VanDerWaalsContact O-N 3.16Å; L263-Q266 PolarHBondContact O-NE2 3.09Å
264	V	94.9	Very high	92.1	Very high	114 Å²	114	56.2 Å²	56.2	69%	0.691	30%	0.297	S	S	*	.	H	α-helix	trans	-74.7	-45	178.7	172.7	0	0	0	0	111.1	I260 V261 V262 Q266	I260-V264 HydrophobicContact CG2-CG2 4.16Å; I260-V264 WeakPolarHBondContact O-CG2 3.39Å; I260-V264 PolarHBondContact O-N 3.31Å; V261-V264 PolarHBondContact O-N 3.1Å; V262-V264 PolarHBondContact O-N 3.38Å; V264-Q266 VanDerWaalsContact C-N 3.3Å; V264-Q266 PolarHBondContact O-N 3.27Å
265	R	93.1	Very high	92.1	Very high	147 Å²	147	53.9 Å²	53.9	56%	0.555	28%	0.284	S	S	*	.	H	α-helix	trans	-75.6	-18	-177	-68.9	-179.8	65.8	-163	-1.1	113.5	V261 M267	V261-R265 HydrophobicContact CG1-CG 4.32Å; V261-R265 VanDerWaalsContact O-CB 3.28Å; V261-R265 WeakPolarHBondContact O-CB 3.44Å; V261-R265 WeakPolarHBondContact O-CG 3.49Å; V261-R265 PolarHBondContact O-N 3.48Å; R265-M267 PolarHBondContact O-N 3.05Å
266	Q	91.1	Very high	92	Very high	87 Å²	87	58 Å²	58	41%	0.407	31%	0.306	S	S	.	.			trans	52.3	23.3	-173.1	-66.7	-66.8	-45.1	0	0	113.6	I209 V262 L263 V264	I209-Q266 WeakPolarHBondContact CD1-O 3.14Å; V262-Q266 WeakPolarHBondContact O-CA 3.46Å; V262-Q266 PolarHBondContact O-N 3.43Å; L263-Q266 PolarHBondContact O-NE2 3.09Å; V264-Q266 VanDerWaalsContact C-N 3.3Å; V264-Q266 PolarHBondContact O-N 3.27Å
267	M	87.1	Confident	92	Very high	124 Å²	124	55 Å²	55	61%	0.611	29%	0.292	S	S	*	.	S	Bend	trans	-137.3	131.2	-179.2	-67	-65	-73.3	0	0	108.5	R265 H269	R265-M267 PolarHBondContact O-N 3.05Å; M267-H269 PolarHBondContact O-N 3.35Å
268	S	80.9	Confident	92	Very high	41 Å²	41	51.6 Å²	51.6	29%	0.287	27%	0.272	S	S	.	.			trans	-75.2	119.3	171.5	-66.1	0	0	0	0	108.8
269	H	87.5	Confident	92	Very high	54 Å²	54	51.6 Å²	51.6	25%	0.25	27%	0.273	C	S	.	.			trans	-87.8	-179.7	166.6	59	-81.7	0	0	0	109.5	M267 R271	M267-H269 PolarHBondContact O-N 3.35Å; H269-R271 WeakPolarHBondContact O-CG 3.46Å; H269-R271 PolarHBondContact O-N 3.17Å; H269-R271 VanDerWaalsContact O-N 3.17Å
270	V	85.1	Confident	92.1	Very high	92 Å²	92	51.8 Å²	51.8	56%	0.558	27%	0.274	S	S	*	.			trans	-63.5	114.5	174.7	175.5	0	0	0	0	109.1	V272 E659	V270-V272 HydrophobicContact CG1-CG2 3.81Å; V270-E659 WeakPolarHBondContact CA-OE2 3.18Å; V270-E659 HydrophobicContact CG1-CB 4.33Å
271	R	88.2	Confident	92.2	Very high	4 Å²	4	48.8 Å²	48.8	2%	0.015	26%	0.258	C	S	.	.			trans	-117.5	60.7	-170.7	-75	-171.7	-64.6	159.1	6	112	E198 E216 H269 T273 R274 E659	E198-R271 IonicContact OE2-CZ 3.31Å; E198-R271 IonicContact OE2-NH1 2.95Å; E198-R271 PolarHBondContact OE2-NH1 3.46Å; E198-R271 IonicContact OE2-NH2 2.61Å; E198-R271 PolarHBondContact OE2-NH2 2.95Å; E216-R271 IonicContact OE2-NH1 2.69Å; H269-R271 WeakPolarHBondContact O-CG 3.46Å; H269-R271 PolarHBondContact O-N 3.17Å; H269-R271 VanDerWaalsContact O-N 3.17Å; R271-T273 PolarHBondContact O-N 2.74Å; R271-R274 HydrophobicContact CB-CG 4.14Å; R271-R274 VanDerWaalsContact NE-NH2 3.1Å; R271-R274 VanDerWaalsContact NH2-NH2 3.14Å; R271-R274 WeakPolarHBondContact O-CB 3.29Å; R271-R274 VanDerWaalsContact O-CG 3.32Å; R271-R274 WeakPolarHBondContact O-CG 3.3Å; R271-R274 PolarHBondContact O-N 2.77Å; R271-R274 PolarHBondContact O-NE 3.43Å; R271-E659 PolarHBondContact N-OE2 2.87Å
272	V	92.2	Very high	92.2	Very high	50 Å²	50	46.8 Å²	46.8	30%	0.303	25%	0.246	S	C	.	.	G	3₁₀ helix	trans	-63	-28.5	178.1	174.8	0	0	0	0	112.4	V270 R274 A275 V656 E659 F660	V270-V272 HydrophobicContact CG1-CG2 3.81Å; V272-R274 PolarHBondContact O-N 2.74Å; V272-A275 VanDerWaalsContact O-CB 3.29Å; V272-A275 WeakPolarHBondContact O-CB 3.44Å; V272-A275 PolarHBondContact O-N 2.79Å; V272-V656 HydrophobicContact CG1-CG2 4.16Å; V272-E659 HydrophobicContact CG2-CB 4.11Å; V272-E659 HydrophobicContact CG2-CG 4.25Å; V272-F660 HydrophobicContact CG2-CE2 4.05Å; V272-F660 HydrophobicContact CG2-CZ 4.11Å
273	T	93.4	Very high	92.2	Very high	31 Å²	31	47 Å²	47	19%	0.19	25%	0.247	C	C	.	.	G	3₁₀ helix	trans	-56.8	-20.3	176.2	51.1	0	0	0	0	114.4	V254 E258 R271 A275 L276	V254-T273 HydrophobicContact CG1-CG2 3.97Å; E258-T273 WeakPolarHBondContact OE1-CG2 3.4Å; E258-T273 PolarHBondContact OE1-OG1 2.74Å; E258-T273 WeakPolarHBondContact OE2-CB 3.37Å; E258-T273 PolarHBondContact OE2-OG1 2.88Å; R271-T273 PolarHBondContact O-N 2.74Å; T273-A275 PolarHBondContact O-N 2.82Å; T273-A275 VanDerWaalsContact O-N 3.16Å; T273-L276 WeakPolarHBondContact O-CB 3.34Å; T273-L276 PolarHBondContact O-N 3.36Å
274	R	94.5	Very high	92.1	Very high	5 Å²	5	44.5 Å²	44.5	2%	0.019	23%	0.234	C	C	.	.	G	3₁₀ helix	trans	-55.5	-29	171	-69.9	-172.9	-103.9	-176.6	-8.2	112.7	E198 A199 R271 V272 L276 R277 Y651 I655 E659	E198-R274 VanDerWaalsContact OE2-CD 3.28Å; E198-R274 WeakPolarHBondContact OE2-CD 3.35Å; E198-R274 IonicContact OE2-CZ 2.94Å; E198-R274 IonicContact OE2-NE 3.16Å; E198-R274 IonicContact OE2-NH1 2.67Å; E198-R274 PolarHBondContact OE2-NH1 2.93Å; E198-R274 VanDerWaalsContact OE2-NH1 3.12Å; A199-R274 VanDerWaalsContact O-CZ 3.29Å; A199-R274 PolarHBondContact O-NH1 2.75Å; A199-R274 PolarHBondContact O-NH2 2.99Å; R271-R274 HydrophobicContact CB-CG 4.14Å; R271-R274 VanDerWaalsContact NE-NH2 3.1Å; R271-R274 VanDerWaalsContact NH2-NH2 3.14Å; R271-R274 WeakPolarHBondContact O-CB 3.29Å; R271-R274 VanDerWaalsContact O-CG 3.32Å; R271-R274 WeakPolarHBondContact O-CG 3.3Å; R271-R274 PolarHBondContact O-N 2.77Å; R271-R274 PolarHBondContact O-NE 3.43Å; V272-R274 PolarHBondContact O-N 2.74Å; R274-L276 PolarHBondContact O-N 3.21Å; R274-R277 VanDerWaalsContact O-CB 3.3Å; R274-R277 WeakPolarHBondContact O-CB 3.25Å; R274-R277 WeakPolarHBondContact O-CG 3.49Å; R274-R277 PolarHBondContact O-N 2.81Å; R274-R277 VanDerWaalsContact O-N 3.09Å; R274-Y651 WeakPolarHBondContact O-CE1 3.11Å; R274-I655 HydrophobicContact CB-CD1 4.14Å; R274-I655 HydrophobicContact CB-CG2 3.83Å; R274-E659 IonicContact CZ-OE1 3.87Å; R274-E659 IonicContact NE-OE1 2.66Å; R274-E659 PolarHBondContact NE-OE1 2.92Å; R274-E659 IonicContact NH2-OE1 2.86Å; R274-E659 PolarHBondContact NH2-OE1 3.49Å
275	A	95.3	Very high	91.9	Very high	15 Å²	15	42.8 Å²	42.8	12%	0.124	22%	0.215	C	C	.	.	G	3₁₀ helix	trans	-59.6	-27.9	176.4	0	0	0	0	0	112.3	V272 T273 R277 I655	V272-A275 VanDerWaalsContact O-CB 3.29Å; V272-A275 WeakPolarHBondContact O-CB 3.44Å; V272-A275 PolarHBondContact O-N 2.79Å; T273-A275 PolarHBondContact O-N 2.82Å; T273-A275 VanDerWaalsContact O-N 3.16Å; A275-R277 VanDerWaalsContact C-N 3.29Å; A275-R277 PolarHBondContact O-N 2.69Å; A275-I655 HydrophobicContact CB-CB 4.18Å; A275-I655 HydrophobicContact CB-CG2 4.09Å
276	L	94.7	Very high	91.8	Very high	89 Å²	89	40.8 Å²	40.8	47%	0.466	21%	0.209	S	C	.	.	G	3₁₀ helix	trans	-75.5	-12.7	179.7	-57.5	176.7	0	0	0	113.3	V251 T273 R274 C278 I279	V251-L276 HydrophobicContact CG1-CB 3.81Å; V251-L276 HydrophobicContact CG2-CB 4.31Å; V251-L276 HydrophobicContact CG2-CD1 4.29Å; T273-L276 WeakPolarHBondContact O-CB 3.34Å; T273-L276 PolarHBondContact O-N 3.36Å; R274-L276 PolarHBondContact O-N 3.21Å; L276-C278 PolarHBondContact O-N 3.19Å; L276-I279 WeakPolarHBondContact O-CG2 3.46Å; L276-I279 PolarHBondContact O-N 3.17Å
277	R	94.9	Very high	91.8	Very high	0 Å²	0	37.2 Å²	37.2	0%	0	19%	0.193	C	C	.	.	G	3₁₀ helix	trans	-56.5	-24.6	178.6	-72.2	-179.9	-176	170.7	7.6	113.4	L191 L192 E198 E216 Q255 R274 A275 I279 F280 Y651	L191-R277 WeakPolarHBondContact O-CD 3.3Å; L191-R277 PolarHBondContact O-NH1 3.08Å; L191-R277 VanDerWaalsContact O-NH1 3.07Å; L192-R277 HydrophobicContact CD1-CB 4.13Å; E198-R277 IonicContact OE1-CZ 2.69Å; E198-R277 VanDerWaalsContact OE1-CZ 3.31Å; E198-R277 IonicContact OE1-NH1 3.62Å; E198-R277 PolarHBondContact OE1-NH1 2.97Å; E198-R277 IonicContact OE1-NH2 3.3Å; E198-R277 PolarHBondContact OE1-NH2 2.92Å; E198-R277 IonicContact OE2-NH1 3.93Å; E198-R277 IonicContact OE2-NH2 2.68Å; E198-R277 PolarHBondContact OE2-NH2 3.14Å; E216-R277 IonicContact OE1-CZ 3.07Å; E216-R277 IonicContact OE1-NE 2.74Å; E216-R277 IonicContact OE1-NH2 3.15Å; E216-R277 PolarHBondContact OE1-NH2 3.17Å; E216-R277 IonicContact OE2-NH2 3.16Å; E216-R277 PolarHBondContact OE2-NH2 3.26Å; Q255-R277 VanDerWaalsContact OE1-CG 3.26Å; R274-R277 VanDerWaalsContact O-CB 3.3Å; R274-R277 WeakPolarHBondContact O-CB 3.25Å; R274-R277 WeakPolarHBondContact O-CG 3.49Å; R274-R277 PolarHBondContact O-N 2.81Å; R274-R277 VanDerWaalsContact O-N 3.09Å; A275-R277 VanDerWaalsContact C-N 3.29Å; A275-R277 PolarHBondContact O-N 2.69Å; R277-I279 PolarHBondContact O-N 2.95Å; R277-F280 HydrophobicContact CB-CD2 4.38Å; R277-F280 WeakPolarHBondContact O-CB 3.18Å; R277-F280 WeakPolarHBondContact O-CD2 3.42Å; R277-F280 PolarHBondContact O-N 3.44Å; R277-Y651 HydrophobicContact CB-CE1 4.41Å
278	C	95.3	Very high	91.9	Very high	11 Å²	11	31.8 Å²	31.8	7%	0.074	17%	0.169	C	C	.	.	H	α-helix	trans	-53	-29.3	174.8	-62.8	0	0	0	0	113.4	L276 F280 L281 V282 I648 Y651	L276-C278 PolarHBondContact O-N 3.19Å; C278-F280 PolarHBondContact O-N 3.02Å; C278-L281 PolarHBondContact O-N 3.1Å; C278-V282 WeakPolarHBondContact O-CG2 3.36Å; C278-V282 PolarHBondContact O-N 3.36Å; C278-I648 HydrophobicContact CB-CG2 3.83Å; C278-Y651 WeakPolarHBondContact SG-CD1 3.14Å
279	I	95.3	Very high	92.3	Very high	40 Å²	40	31 Å²	31	21%	0.205	17%	0.167	C	C	.	.	H	α-helix	trans	-60.4	-32.4	179.5	-164.4	59.1	0	0	0	112.3	V251 L276 R277 V282 D283	V251-I279 HydrophobicContact CB-CG2 4.22Å; V251-I279 HydrophobicContact CG1-CG2 3.95Å; V251-I279 HydrophobicContact CG2-CG2 4.38Å; L276-I279 WeakPolarHBondContact O-CG2 3.46Å; L276-I279 PolarHBondContact O-N 3.17Å; R277-I279 PolarHBondContact O-N 2.95Å; I279-V282 PolarHBondContact O-N 3Å; I279-D283 WeakPolarHBondContact O-CB 3.46Å; I279-D283 PolarHBondContact O-N 3.31Å
280	F	95.6	Very high	92.5	Very high	5 Å²	5	28.7 Å²	28.7	2%	0.022	16%	0.157	C	C	.	.	H	α-helix	trans	-66.3	-42.7	179.3	-59.9	-56.7	0	0	0	110.8	A188 L191 L220 V223 K248 V251 L252 R277 C278 C284	A188-F280 HydrophobicContact CB-CB 4.09Å; L191-F280 HydrophobicContact CD1-CD2 3.81Å; L191-F280 HydrophobicContact CD1-CE2 4.16Å; L191-F280 HydrophobicContact CD1-CG 4.31Å; L220-F280 HydrophobicContact CD2-CE2 4.39Å; L220-F280 HydrophobicContact CD2-CZ 4.34Å; V223-F280 HydrophobicContact CG1-CD1 4.06Å; V223-F280 HydrophobicContact CG1-CE1 3.88Å; V223-F280 HydrophobicContact CG2-CD1 4.46Å; K248-F280 HydrophobicContact CD-CD1 4.43Å; K248-F280 HydrophobicContact CG-CD1 4.06Å; K248-F280 HydrophobicContact CG-CE1 3.98Å; V251-F280 HydrophobicContact CG1-CE2 4.4Å; V251-F280 HydrophobicContact CG1-CZ 4.12Å; L252-F280 HydrophobicContact CB-CE1 4.43Å; L252-F280 HydrophobicContact CB-CZ 4.41Å; R277-F280 HydrophobicContact CB-CD2 4.38Å; R277-F280 WeakPolarHBondContact O-CB 3.18Å; R277-F280 WeakPolarHBondContact O-CD2 3.42Å; R277-F280 PolarHBondContact O-N 3.44Å; C278-F280 PolarHBondContact O-N 3.02Å; F280-C284 PolarHBondContact O-N 2.88Å; F280-C284 PolarHBondContact O-SG 3.15Å
281	L	95.6	Very high	92.9	Very high	9 Å²	9	26.2 Å²	26.2	5%	0.047	14%	0.138	C	C	.	.	H	α-helix	trans	-68.9	-42	175.9	-175	66.2	0	0	0	111.9	L185 A188 L192 C278 D283 C284 C287 L644	L185-L281 HydrophobicContact CD1-CD1 3.77Å; A188-L281 HydrophobicContact CB-CB 4.25Å; A188-L281 HydrophobicContact CB-CD1 4.32Å; L192-L281 HydrophobicContact CD2-CD2 3.97Å; C278-L281 PolarHBondContact O-N 3.1Å; L281-D283 VanDerWaalsContact C-N 3.33Å; L281-D283 PolarHBondContact O-N 3.13Å; L281-C284 WeakPolarHBondContact O-CB 3.44Å; L281-C284 PolarHBondContact O-N 3.18Å; L281-C287 VanDerWaalsContact O-CB 3.23Å; L281-C287 WeakPolarHBondContact O-CB 3.33Å; L281-L644 HydrophobicContact CD2-CD1 4.36Å
282	V	95	Very high	93	Very high	11 Å²	11	29.2 Å²	29.2	7%	0.067	15%	0.149	C	C	.	.	H	α-helix	trans	-66.4	-33.4	-179.7	173.5	0	0	0	0	112.1	C278 I279 C284 R291 I648	C278-V282 WeakPolarHBondContact O-CG2 3.36Å; C278-V282 PolarHBondContact O-N 3.36Å; I279-V282 PolarHBondContact O-N 3Å; V282-C284 VanDerWaalsContact C-N 3.34Å; V282-R291 HydrophobicContact CG1-CB 3.81Å; V282-R291 HydrophobicContact CG1-CG 3.84Å; V282-R291 WeakPolarHBondContact O-CD 3.4Å; V282-R291 PolarHBondContact O-NH1 3.41Å; V282-I648 HydrophobicContact CG2-CD1 3.63Å
283	D	93.3	Very high	92.9	Very high	4 Å²	4	27.5 Å²	27.5	2%	0.021	14%	0.138	C	C	.	.	H	α-helix	trans	-78.1	-14.7	178.2	-171.2	54.4	0	0	0	113.7	K230 R244 K248 I279 L281 R291	K230-D283 IonicContact NZ-OD2 3.76Å; R244-D283 WeakPolarHBondContact CD-OD1 3.31Å; R244-D283 IonicContact CZ-OD1 3.75Å; R244-D283 IonicContact NE-OD1 2.72Å; R244-D283 PolarHBondContact NE-OD1 3.06Å; R244-D283 IonicContact NH2-OD1 3.11Å; R244-D283 PolarHBondContact NH2-OD1 3.46Å; K248-D283 HydrophobicContact CD-CB 4.06Å; K248-D283 WeakPolarHBondContact CD-OD2 3.48Å; K248-D283 IonicContact NZ-OD2 2.79Å; K248-D283 PolarHBondContact NZ-OD2 3Å; I279-D283 WeakPolarHBondContact O-CB 3.46Å; I279-D283 PolarHBondContact O-N 3.31Å; L281-D283 VanDerWaalsContact C-N 3.33Å; L281-D283 PolarHBondContact O-N 3.13Å; D283-R291 PolarHBondContact O-NH1 3.28Å
284	C	91.8	Very high	92.8	Very high	2 Å²	2	27.6 Å²	27.6	1%	0.014	14%	0.137	C	C	.	.	S	Bend	trans	-57.4	154.3	176.6	-64.8	0	0	0	0	112.7	F280 L281 V282 C287 R291	F280-C284 PolarHBondContact O-N 2.88Å; F280-C284 PolarHBondContact O-SG 3.15Å; L281-C284 WeakPolarHBondContact O-CB 3.44Å; L281-C284 PolarHBondContact O-N 3.18Å; V282-C284 VanDerWaalsContact C-N 3.34Å; C284-C287 HydrophobicContact CB-CB 4.4Å; C284-R291 PolarHBondContact O-NH1 2.89Å
285	R	90.2	Very high	92.7	Very high	77 Å²	77	33.1 Å²	33.1	29%	0.291	16%	0.158	S	C	.	.	S	Bend	trans	-63.3	-49.5	176.9	-177.7	61	134	77	19.2	113.8	N155 Y181 E184 C287 G288	N155-R285 VanDerWaalsContact CG-CZ 3.41Å; N155-R285 PolarHBondContact ND2-NH2 3.08Å; N155-R285 PolarHBondContact OD1-NH1 3.31Å; N155-R285 PolarHBondContact OD1-NH2 2.82Å; Y181-R285 HydrophobicContact CD1-CB 3.66Å; Y181-R285 HydrophobicContact CD1-CG 3.9Å; Y181-R285 HydrophobicContact CD2-CB 4.4Å; Y181-R285 HydrophobicContact CD2-CG 3.92Å; Y181-R285 HydrophobicContact CE1-CB 4.01Å; Y181-R285 HydrophobicContact CE1-CG 3.9Å; Y181-R285 HydrophobicContact CE2-CG 3.89Å; Y181-R285 HydrophobicContact CG-CB 3.88Å; Y181-R285 HydrophobicContact CG-CG 3.92Å; Y181-R285 PolarHBondContact OH-NE 3.4Å; Y181-R285 PolarHBondContact OH-NH2 2.89Å; E184-R285 PolarHBondContact OE2-N 3.47Å; R285-C287 VanDerWaalsContact C-N 3.28Å; R285-C287 PolarHBondContact O-N 2.97Å; R285-G288 PolarHBondContact O-N 3.34Å
286	Y	90.6	Very high	92.4	Very high	105 Å²	105	32.9 Å²	32.9	41%	0.412	15%	0.154	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64	-33.7	-177.2	-69.2	-63.3	0	0	0	112.6	H178 L185 G288	H178-Y286 PolarHBondContact CD2-OH 3.33Å; H178-Y286 PolarHBondContact CE1-OH 3.34Å; H178-Y286 PolarHBondContact ND1-OH 3.03Å; H178-Y286 PolarHBondContact NE2-OH 3.5Å; L185-Y286 HydrophobicContact CB-CD2 4.27Å; L185-Y286 HydrophobicContact CD2-CD2 3.93Å; Y286-G288 PolarHBondContact O-N 3.28Å
287	C	92.6	Very high	92.2	Very high	12 Å²	12	29.1 Å²	29.1	8%	0.081	13%	0.134	C	C	.	.	T	Hydrogen-bonded Turn	trans	-82.5	19.3	178.3	-61.4	0	0	0	0	113.5	L281 C284 R285 G289 V290 R291	L281-C287 VanDerWaalsContact O-CB 3.23Å; L281-C287 WeakPolarHBondContact O-CB 3.33Å; C284-C287 HydrophobicContact CB-CB 4.4Å; R285-C287 VanDerWaalsContact C-N 3.28Å; R285-C287 PolarHBondContact O-N 2.97Å; C287-G289 PolarHBondContact O-N 3.31Å; C287-V290 HydrophobicContact CB-CB 4.33Å; C287-V290 HydrophobicContact CB-CG2 4.28Å; C287-V290 WeakPolarHBondContact O-CB 3.36Å; C287-V290 PolarHBondContact O-N 3.28Å; C287-V290 VanDerWaalsContact O-N 3.16Å; C287-R291 PolarHBondContact O-N 3.07Å
288	G	88.8	Confident	92	Very high	10 Å²	10	34.4 Å²	34.4	10%	0.103	16%	0.158	C	C	.	.	H	α-helix	trans	-58.8	-30	177.2	0	0	0	0	0	114	R285 Y286 R292	R285-G288 PolarHBondContact O-N 3.34Å; Y286-G288 PolarHBondContact O-N 3.28Å; G288-R292 VanDerWaalsContact O-CG 3.25Å; G288-R292 WeakPolarHBondContact O-CG 3.41Å; G288-R292 PolarHBondContact O-N 2.88Å
289	G	88.6	Confident	91.8	Very high	24 Å²	24	38.6 Å²	38.6	25%	0.247	18%	0.176	C	C	.	.	H	α-helix	trans	-66.3	-51.9	172.1	0	0	0	0	0	112.3	C287 R291 R292 N293	C287-G289 PolarHBondContact O-N 3.31Å; G289-R291 VanDerWaalsContact C-N 3.28Å; G289-R291 PolarHBondContact O-N 3.47Å; G289-R292 PolarHBondContact O-N 2.64Å; G289-N293 VanDerWaalsContact O-CG 3.25Å; G289-N293 PolarHBondContact O-N 2.99Å; G289-N293 PolarHBondContact O-ND2 2.89Å; G289-N293 PolarHBondContact O-OD1 3.3Å
290	V	92.6	Very high	91.5	Very high	6 Å²	6	36.8 Å²	36.8	4%	0.036	17%	0.167	C	C	.	.	H	α-helix	trans	-54.5	-44.9	176.6	-175.4	0	0	0	0	111.2	C287 R292 N293 L294 L644 T645 I648	C287-V290 HydrophobicContact CB-CB 4.33Å; C287-V290 HydrophobicContact CB-CG2 4.28Å; C287-V290 WeakPolarHBondContact O-CB 3.36Å; C287-V290 PolarHBondContact O-N 3.28Å; C287-V290 VanDerWaalsContact O-N 3.16Å; V290-R292 VanDerWaalsContact C-N 3.34Å; V290-R292 PolarHBondContact O-N 3.12Å; V290-N293 PolarHBondContact O-N 3.07Å; V290-L294 WeakPolarHBondContact O-CB 3.29Å; V290-L294 PolarHBondContact O-N 3.1Å; V290-L644 HydrophobicContact CG2-CB 4.17Å; V290-L644 HydrophobicContact CG2-CD2 3.78Å; V290-L644 HydrophobicContact CG2-CG 4.08Å; V290-T645 WeakPolarHBondContact CG1-OG1 3.26Å; V290-I648 HydrophobicContact CG1-CD1 3.43Å; V290-I648 VanDerWaalsContact CG1-CD1 3.43Å
291	R	93.1	Very high	91.1	Very high	41 Å²	41	39.5 Å²	39.5	16%	0.155	18%	0.181	C	C	.	.	H	α-helix	trans	-61.5	-39	177.4	-179.2	171.8	60.7	-121.3	7.2	113.2	V282 D283 C284 C287 G289 R295	V282-R291 HydrophobicContact CG1-CB 3.81Å; V282-R291 HydrophobicContact CG1-CG 3.84Å; V282-R291 WeakPolarHBondContact O-CD 3.4Å; V282-R291 PolarHBondContact O-NH1 3.41Å; D283-R291 PolarHBondContact O-NH1 3.28Å; C284-R291 PolarHBondContact O-NH1 2.89Å; C287-R291 PolarHBondContact O-N 3.07Å; G289-R291 VanDerWaalsContact C-N 3.28Å; G289-R291 PolarHBondContact O-N 3.47Å; R291-R295 WeakPolarHBondContact O-CB 3.35Å; R291-R295 PolarHBondContact O-N 2.95Å; R291-R295 VanDerWaalsContact O-N 3.15Å
292	R	89.7	Confident	90.8	Very high	67 Å²	67	42.9 Å²	42.9	25%	0.253	20%	0.204	S	C	.	.	H	α-helix	trans	-68.4	-50.1	177.5	-71.5	169.1	-170.5	-176.3	4.4	109.6	G288 G289 V290 L294 R295 Q296	G288-R292 VanDerWaalsContact O-CG 3.25Å; G288-R292 WeakPolarHBondContact O-CG 3.41Å; G288-R292 PolarHBondContact O-N 2.88Å; G289-R292 PolarHBondContact O-N 2.64Å; V290-R292 VanDerWaalsContact C-N 3.34Å; V290-R292 PolarHBondContact O-N 3.12Å; R292-L294 VanDerWaalsContact C-N 3.34Å; R292-L294 PolarHBondContact O-N 3.23Å; R292-R295 WeakPolarHBondContact O-CB 3.42Å; R292-R295 PolarHBondContact O-N 3.3Å; R292-R295 VanDerWaalsContact O-N 3.15Å; R292-Q296 VanDerWaalsContact O-CG 3.24Å; R292-Q296 WeakPolarHBondContact O-CG 3.21Å; R292-Q296 PolarHBondContact O-N 3.03Å; R292-Q296 PolarHBondContact O-OE1 2.98Å
293	N	89.9	Confident	90.5	Very high	14 Å²	14	44.4 Å²	44.4	8%	0.075	21%	0.214	C	C	.	.	H	α-helix	trans	-55.8	-48.5	178.6	-59.8	-15.2	0	0	0	111.3	G289 V290 R295 Q296 I297 S641 L642	G289-N293 VanDerWaalsContact O-CG 3.25Å; G289-N293 PolarHBondContact O-N 2.99Å; G289-N293 PolarHBondContact O-ND2 2.89Å; G289-N293 PolarHBondContact O-OD1 3.3Å; V290-N293 PolarHBondContact O-N 3.07Å; N293-R295 PolarHBondContact O-N 3.15Å; N293-Q296 PolarHBondContact O-N 3.24Å; N293-I297 WeakPolarHBondContact O-CG1 3.36Å; N293-I297 PolarHBondContact O-N 3.4Å; N293-S641 PolarHBondContact ND2-OG 3.38Å; N293-L642 HydrophobicContact CB-CD2 4.02Å; N293-L642 WeakPolarHBondContact ND2-CD2 3.35Å
294	L	92.1	Very high	90.3	Very high	32 Å²	32	44.6 Å²	44.6	17%	0.168	22%	0.215	C	C	.	.	H	α-helix	trans	-61.3	-43.5	178.9	-175.8	144.8	0	0	0	111.9	V290 R292 Q296 I297 F298 T645 I648	V290-L294 WeakPolarHBondContact O-CB 3.29Å; V290-L294 PolarHBondContact O-N 3.1Å; R292-L294 VanDerWaalsContact C-N 3.34Å; R292-L294 PolarHBondContact O-N 3.23Å; L294-Q296 VanDerWaalsContact C-N 3.34Å; L294-Q296 PolarHBondContact O-N 2.97Å; L294-I297 PolarHBondContact O-N 3.46Å; L294-F298 HydrophobicContact CD1-CE2 4.45Å; L294-F298 HydrophobicContact CD2-CD2 3.65Å; L294-F298 HydrophobicContact CD2-CE2 3.56Å; L294-F298 HydrophobicContact CG-CD2 4.04Å; L294-F298 HydrophobicContact CG-CE2 3.77Å; L294-F298 WeakPolarHBondContact O-CD2 3.48Å; L294-F298 PolarHBondContact O-N 2.86Å; L294-F298 VanDerWaalsContact O-N 3.15Å; L294-T645 HydrophobicContact CB-CG2 4.21Å; L294-I648 HydrophobicContact CD1-CG2 4.19Å
295	R	91.8	Very high	90.2	Very high	121 Å²	121	49.2 Å²	49.2	46%	0.457	24%	0.237	S	C	.	.	H	α-helix	trans	-60.5	-44.1	175	179.1	-175.8	-58.3	-92	-12.5	111.8	R291 R292 N293 F298 Q299	R291-R295 WeakPolarHBondContact O-CB 3.35Å; R291-R295 PolarHBondContact O-N 2.95Å; R291-R295 VanDerWaalsContact O-N 3.15Å; R292-R295 WeakPolarHBondContact O-CB 3.42Å; R292-R295 PolarHBondContact O-N 3.3Å; R292-R295 VanDerWaalsContact O-N 3.15Å; N293-R295 PolarHBondContact O-N 3.15Å; R295-F298 PolarHBondContact O-N 3.04Å; R295-Q299 HydrophobicContact CG-CG 4.26Å; R295-Q299 WeakPolarHBondContact O-CB 3.44Å; R295-Q299 VanDerWaalsContact O-CG 3.3Å; R295-Q299 WeakPolarHBondContact O-CG 3.38Å; R295-Q299 PolarHBondContact O-N 3.43Å
296	Q	89.8	Confident	90.2	Very high	11 Å²	11	51.2 Å²	51.2	5%	0.051	25%	0.254	C	S	.	.	H	α-helix	trans	-63.8	-42.3	-178.4	-67.8	167.5	-61.5	0	0	111.1	R292 N293 L294 F298 Q299 S300 F395 I398	R292-Q296 VanDerWaalsContact O-CG 3.24Å; R292-Q296 WeakPolarHBondContact O-CG 3.21Å; R292-Q296 PolarHBondContact O-N 3.03Å; R292-Q296 PolarHBondContact O-OE1 2.98Å; N293-Q296 PolarHBondContact O-N 3.24Å; L294-Q296 VanDerWaalsContact C-N 3.34Å; L294-Q296 PolarHBondContact O-N 2.97Å; Q296-F298 VanDerWaalsContact C-N 3.33Å; Q296-F298 PolarHBondContact O-N 2.99Å; Q296-Q299 PolarHBondContact O-N 3.35Å; Q296-Q299 VanDerWaalsContact O-N 3.13Å; Q296-S300 PolarHBondContact O-N 2.99Å; Q296-S300 PolarHBondContact O-OG 2.67Å; Q296-F395 HydrophobicContact CB-CD2 4.06Å; Q296-F395 HydrophobicContact CB-CE2 3.53Å; Q296-F395 HydrophobicContact CB-CZ 4.28Å; Q296-I398 HydrophobicContact CB-CG2 4.27Å; Q296-I398 HydrophobicContact CG-CG2 3.85Å
297	I	90.2	Very high	90.3	Very high	9 Å²	9	47.3 Å²	47.3	5%	0.046	24%	0.24	C	C	.	.	H	α-helix	trans	-58.3	-43.7	173.9	-67	166.3	0	0	0	111.4	N293 L294 S300 F395 T645 V750 I753	N293-I297 WeakPolarHBondContact O-CG1 3.36Å; N293-I297 PolarHBondContact O-N 3.4Å; L294-I297 PolarHBondContact O-N 3.46Å; I297-S300 PolarHBondContact O-N 3.43Å; I297-S300 PolarHBondContact O-OG 3.33Å; I297-F395 HydrophobicContact CG1-CE2 4.28Å; I297-T645 HydrophobicContact CD1-CG2 3.97Å; I297-V750 HydrophobicContact CG2-CG2 4.29Å; I297-I753 HydrophobicContact CB-CD1 4.34Å; I297-I753 HydrophobicContact CG1-CD1 3.92Å; I297-I753 HydrophobicContact CG1-CG2 4.17Å; I297-I753 HydrophobicContact CG2-CD1 4.11Å
298	F	90.8	Very high	90.2	Very high	111 Å²	111	47.7 Å²	47.7	49%	0.487	24%	0.241	S	C	.	.	H	α-helix	trans	-70.8	-30.2	176.9	-77.6	-65.8	0	0	0	113.1	L294 R295 Q296 L301 F649	L294-F298 HydrophobicContact CD1-CE2 4.45Å; L294-F298 HydrophobicContact CD2-CD2 3.65Å; L294-F298 HydrophobicContact CD2-CE2 3.56Å; L294-F298 HydrophobicContact CG-CD2 4.04Å; L294-F298 HydrophobicContact CG-CE2 3.77Å; L294-F298 WeakPolarHBondContact O-CD2 3.48Å; L294-F298 PolarHBondContact O-N 2.86Å; L294-F298 VanDerWaalsContact O-N 3.15Å; R295-F298 PolarHBondContact O-N 3.04Å; Q296-F298 VanDerWaalsContact C-N 3.33Å; Q296-F298 PolarHBondContact O-N 2.99Å; F298-L301 VanDerWaalsContact O-CB 3.26Å; F298-L301 WeakPolarHBondContact O-CB 3.32Å; F298-L301 PolarHBondContact O-N 2.97Å; F298-F649 HydrophobicContact CE2-CZ 4.24Å; F298-F649 HydrophobicContact CZ-CE1 4.05Å; F298-F649 HydrophobicContact CZ-CZ 4.12Å
299	Q	90.9	Very high	90.4	Very high	99 Å²	99	53 Å²	53	46%	0.463	27%	0.267	S	S	.	.	H	α-helix	trans	-74.3	-26.2	176.4	-75	175.5	-31.1	0	0	112.9	R295 Q296 L301 P302 I398	R295-Q299 HydrophobicContact CG-CG 4.26Å; R295-Q299 WeakPolarHBondContact O-CB 3.44Å; R295-Q299 VanDerWaalsContact O-CG 3.3Å; R295-Q299 WeakPolarHBondContact O-CG 3.38Å; R295-Q299 PolarHBondContact O-N 3.43Å; Q296-Q299 PolarHBondContact O-N 3.35Å; Q296-Q299 VanDerWaalsContact O-N 3.13Å; Q299-L301 VanDerWaalsContact C-N 3.26Å; Q299-P302 VanDerWaalsContact O-CD 3.27Å; Q299-P302 WeakPolarHBondContact O-CD 3.45Å; Q299-I398 HydrophobicContact CB-CD1 3.83Å
300	S	88.8	Confident	90.5	Very high	2 Å²	2	55.1 Å²	55.1	1%	0.014	27%	0.272	C	S	.	.	T	Hydrogen-bonded Turn	trans	-81.3	-1.9	172.3	55.7	0	0	0	0	113.5	Q296 I297	Q296-S300 PolarHBondContact O-N 2.99Å; Q296-S300 PolarHBondContact O-OG 2.67Å; I297-S300 PolarHBondContact O-N 3.43Å; I297-S300 PolarHBondContact O-OG 3.33Å
301	L	86.6	Confident	90.6	Very high	62 Å²	62	55 Å²	55	33%	0.325	27%	0.271	S	S	.	.	H	α-helix	trans	-70.4	-34.6	-176.2	-164.1	68.6	0	0	0	115	F298 Q299 F304 M305	F298-L301 VanDerWaalsContact O-CB 3.26Å; F298-L301 WeakPolarHBondContact O-CB 3.32Å; F298-L301 PolarHBondContact O-N 2.97Å; Q299-L301 VanDerWaalsContact C-N 3.26Å; L301-F304 HydrophobicContact CD1-CD1 3.55Å; L301-F304 HydrophobicContact CD1-CE1 4.12Å; L301-F304 HydrophobicContact CD1-CG 4.31Å; L301-F304 HydrophobicContact CG-CD1 4.46Å; L301-F304 VanDerWaalsContact O-CB 3.27Å; L301-F304 WeakPolarHBondContact O-CB 3.41Å; L301-F304 PolarHBondContact O-N 3.23Å; L301-M305 HydrophobicContact CG-CG 4.19Å; L301-M305 HydrophobicContact CG-SD 4.41Å; L301-M305 WeakPolarHBondContact O-CG 3.46Å; L301-M305 PolarHBondContact O-N 3.44Å
302	P	89.8	Confident	90.6	Very high	80 Å²	80	55.9 Å²	55.9	52%	0.519	28%	0.278	S	S	.	.	H	α-helix	trans	-60.3	-50.8	-176.1	-20.8	30.9	0	0	0	114.3	Q299 F304 M305 D306	Q299-P302 VanDerWaalsContact O-CD 3.27Å; Q299-P302 WeakPolarHBondContact O-CD 3.45Å; P302-F304 PolarHBondContact O-N 3.11Å; P302-M305 PolarHBondContact O-N 3.16Å; P302-D306 PolarHBondContact O-N 3.27Å
303	P	89	Confident	90.9	Very high	44 Å²	44	58.1 Å²	58.1	29%	0.286	29%	0.29	S	S	.	.	H	α-helix	trans	-61.7	-29.6	176.3	-22.8	35.5	0	0	0	113.1	V390 T394	P303-V390 HydrophobicContact CB-CG1 3.94Å; P303-T394 HydrophobicContact CB-CG2 4.28Å; P303-T394 HydrophobicContact CG-CG2 3.99Å
304	F	88.3	Confident	91.1	Very high	8 Å²	8	60.6 Å²	60.6	4%	0.035	30%	0.3	C	S	.	.	H	α-helix	trans	-65.3	-41.5	174.5	166.7	-91.5	0	0	0	112.2	L301 P302 D306 I307 L308 L387 V391 I745 V749	L301-F304 HydrophobicContact CD1-CD1 3.55Å; L301-F304 HydrophobicContact CD1-CE1 4.12Å; L301-F304 HydrophobicContact CD1-CG 4.31Å; L301-F304 HydrophobicContact CG-CD1 4.46Å; L301-F304 VanDerWaalsContact O-CB 3.27Å; L301-F304 WeakPolarHBondContact O-CB 3.41Å; L301-F304 PolarHBondContact O-N 3.23Å; P302-F304 PolarHBondContact O-N 3.11Å; F304-D306 VanDerWaalsContact C-N 3.27Å; F304-D306 PolarHBondContact O-N 3.13Å; F304-I307 PolarHBondContact O-N 3.1Å; F304-L308 HydrophobicContact CE1-CB 4.19Å; F304-L308 HydrophobicContact CE1-CD2 3.67Å; F304-L308 HydrophobicContact CE1-CG 4.44Å; F304-L308 HydrophobicContact CZ-CB 4.24Å; F304-L308 HydrophobicContact CZ-CD1 4.43Å; F304-L308 HydrophobicContact CZ-CD2 3.99Å; F304-L308 HydrophobicContact CZ-CG 4.45Å; F304-L308 VanDerWaalsContact O-CB 3.28Å; F304-L308 WeakPolarHBondContact O-CB 3.29Å; F304-L308 PolarHBondContact O-N 3.14Å; F304-L387 HydrophobicContact CD2-CD1 3.39Å; F304-L387 HydrophobicContact CD2-CD2 4.22Å; F304-L387 HydrophobicContact CD2-CG 3.83Å; F304-L387 HydrophobicContact CE2-CD1 3.65Å; F304-L387 HydrophobicContact CE2-CD2 3.65Å; F304-L387 HydrophobicContact CE2-CG 3.79Å; F304-L387 HydrophobicContact CG-CD1 4.23Å; F304-V391 HydrophobicContact CB-CG2 3.81Å; F304-V391 HydrophobicContact CD2-CG2 3.69Å; F304-V391 HydrophobicContact CG-CG2 4.2Å; F304-I745 HydrophobicContact CE1-CG2 4.02Å; F304-I745 HydrophobicContact CZ-CG2 3.64Å; F304-V749 HydrophobicContact CD2-CG2 3.67Å; F304-V749 HydrophobicContact CE1-CG2 4.09Å; F304-V749 HydrophobicContact CE2-CG2 3.1Å; F304-V749 HydrophobicContact CG-CG2 4.37Å; F304-V749 HydrophobicContact CZ-CG2 3.37Å
305	M	89.9	Confident	91.3	Very high	98 Å²	98	59.5 Å²	59.5	48%	0.483	30%	0.295	S	S	.	.	H	α-helix	trans	-63.6	-34.2	-179.3	-66.4	-61.2	-74.1	0	0	112	L301 P302 L308 L309	L301-M305 HydrophobicContact CG-CG 4.19Å; L301-M305 HydrophobicContact CG-SD 4.41Å; L301-M305 WeakPolarHBondContact O-CG 3.46Å; L301-M305 PolarHBondContact O-N 3.44Å; P302-M305 PolarHBondContact O-N 3.16Å; M305-L308 HydrophobicContact SD-CD2 4.23Å; M305-L309 WeakPolarHBondContact O-CB 3.37Å; M305-L309 PolarHBondContact O-N 2.91Å
306	D	91.6	Very high	91.6	Very high	119 Å²	119	57.6 Å²	57.6	64%	0.636	29%	0.293	S	S	*	.	H	α-helix	trans	-65.2	-45.3	178.4	-64.5	-23.8	0	0	0	111.9	P302 F304 L309 L310	P302-D306 PolarHBondContact O-N 3.27Å; F304-D306 VanDerWaalsContact C-N 3.27Å; F304-D306 PolarHBondContact O-N 3.13Å; D306-L309 WeakPolarHBondContact O-CB 3.27Å; D306-L309 PolarHBondContact O-N 3.14Å; D306-L310 PolarHBondContact O-N 3.01Å; D306-L310 VanDerWaalsContact O-N 3.17Å
307	I	91.1	Very high	91.9	Very high	24 Å²	24	60.8 Å²	60.8	12%	0.123	31%	0.309	C	S	.	.	H	α-helix	trans	-75.8	-34.5	179	-55.6	168.1	0	0	0	110.8	F304 L309 L310 L311 I383 L387 V390	F304-I307 PolarHBondContact O-N 3.1Å; I307-L309 VanDerWaalsContact C-N 3.26Å; I307-L309 PolarHBondContact O-N 3.5Å; I307-L310 WeakPolarHBondContact O-CB 3.35Å; I307-L310 PolarHBondContact O-N 3.17Å; I307-L311 PolarHBondContact O-N 2.98Å; I307-I383 HydrophobicContact CG2-CG2 4.25Å; I307-L387 HydrophobicContact CB-CD1 3.52Å; I307-L387 HydrophobicContact CD1-CD1 4.45Å; I307-L387 HydrophobicContact CG2-CB 3.87Å; I307-L387 HydrophobicContact CG2-CD1 3.61Å; I307-L387 HydrophobicContact CG2-CG 4.37Å; I307-V390 HydrophobicContact CD1-CB 3.6Å; I307-V390 HydrophobicContact CD1-CG1 3.78Å; I307-V390 HydrophobicContact CD1-CG2 3.6Å
308	L	90.4	Very high	92.3	Very high	19 Å²	19	61.4 Å²	61.4	10%	0.099	31%	0.312	C	S	.	.	H	α-helix	trans	-60.4	-39.2	171.7	178.5	64.8	0	0	0	110.9	F304 M305 L311 L312 I745	F304-L308 HydrophobicContact CE1-CB 4.19Å; F304-L308 HydrophobicContact CE1-CD2 3.67Å; F304-L308 HydrophobicContact CE1-CG 4.44Å; F304-L308 HydrophobicContact CZ-CB 4.24Å; F304-L308 HydrophobicContact CZ-CD1 4.43Å; F304-L308 HydrophobicContact CZ-CD2 3.99Å; F304-L308 HydrophobicContact CZ-CG 4.45Å; F304-L308 VanDerWaalsContact O-CB 3.28Å; F304-L308 WeakPolarHBondContact O-CB 3.29Å; F304-L308 PolarHBondContact O-N 3.14Å; M305-L308 HydrophobicContact SD-CD2 4.23Å; L308-L311 HydrophobicContact CD1-CD2 4.12Å; L308-L311 WeakPolarHBondContact O-CB 3.44Å; L308-L311 PolarHBondContact O-N 3.33Å; L308-L312 HydrophobicContact CD1-CD1 4.43Å; L308-L312 HydrophobicContact CD1-CG 4.29Å; L308-L312 HydrophobicContact CG-CD1 4.18Å; L308-L312 HydrophobicContact CG-CG 4.43Å; L308-L312 VanDerWaalsContact O-CG 3.3Å; L308-L312 WeakPolarHBondContact O-CG 3.23Å; L308-L312 PolarHBondContact O-N 2.88Å; L308-I745 HydrophobicContact CD1-CD1 4.29Å; L308-I745 HydrophobicContact CD2-CD1 4.42Å; L308-I745 HydrophobicContact CD2-CG2 4.16Å
309	L	92.5	Very high	92.6	Very high	123 Å²	123	56.1 Å²	56.1	64%	0.644	29%	0.288	S	S	*	.	H	α-helix	trans	-63.1	-43.5	174.6	-175	155.4	0	0	0	111.1	M305 D306 I307 L311 L312 F313	M305-L309 WeakPolarHBondContact O-CB 3.37Å; M305-L309 PolarHBondContact O-N 2.91Å; D306-L309 WeakPolarHBondContact O-CB 3.27Å; D306-L309 PolarHBondContact O-N 3.14Å; I307-L309 VanDerWaalsContact C-N 3.26Å; I307-L309 PolarHBondContact O-N 3.5Å; L309-L311 VanDerWaalsContact C-N 3.32Å; L309-L311 PolarHBondContact O-N 3.16Å; L309-L312 PolarHBondContact O-N 2.87Å; L309-F313 VanDerWaalsContact O-CB 3.31Å; L309-F313 WeakPolarHBondContact O-CB 3.19Å; L309-F313 PolarHBondContact O-N 2.68Å
310	L	92.4	Very high	93	Very high	68 Å²	68	55 Å²	55	36%	0.356	29%	0.285	S	S	.	.	H	α-helix	trans	-58.8	-43.9	174.8	-176.8	65.6	0	0	0	111.9	D306 I307 F313 F314	D306-L310 PolarHBondContact O-N 3.01Å; D306-L310 VanDerWaalsContact O-N 3.17Å; I307-L310 WeakPolarHBondContact O-CB 3.35Å; I307-L310 PolarHBondContact O-N 3.17Å; L310-F313 WeakPolarHBondContact O-CB 3.25Å; L310-F313 PolarHBondContact O-N 3.33Å; L310-F314 HydrophobicContact CD1-CD2 4Å; L310-F314 HydrophobicContact CD1-CE2 3.59Å; L310-F314 HydrophobicContact CG-CD2 4.09Å; L310-F314 HydrophobicContact CG-CE2 3.98Å; L310-F314 WeakPolarHBondContact O-CD2 3.38Å; L310-F314 PolarHBondContact O-N 3.45Å; L310-F314 VanDerWaalsContact O-N 3.1Å
311	L	93.1	Very high	93.4	Very high	4 Å²	4	59.1 Å²	59.1	2%	0.021	31%	0.306	C	S	.	.	H	α-helix	trans	-61.7	-51.5	176.1	178.4	123.1	0	0	0	112	I307 L308 L309 F313 F314 M315 L349 E379 I383 M384	I307-L311 PolarHBondContact O-N 2.98Å; L308-L311 HydrophobicContact CD1-CD2 4.12Å; L308-L311 WeakPolarHBondContact O-CB 3.44Å; L308-L311 PolarHBondContact O-N 3.33Å; L309-L311 VanDerWaalsContact C-N 3.32Å; L309-L311 PolarHBondContact O-N 3.16Å; L311-F313 PolarHBondContact O-N 3.47Å; L311-F314 PolarHBondContact O-N 3.38Å; L311-M315 WeakPolarHBondContact O-CB 3.37Å; L311-M315 PolarHBondContact O-N 2.74Å; L311-L349 HydrophobicContact CD1-CD1 4.1Å; L311-L349 HydrophobicContact CD1-CD2 4.08Å; L311-L349 HydrophobicContact CD2-CD2 3.77Å; L311-L349 HydrophobicContact CG-CD2 4.35Å; L311-E379 WeakPolarHBondContact CD1-OE2 3.36Å; L311-E379 WeakPolarHBondContact CG-OE2 3.28Å; L311-I383 HydrophobicContact CB-CG2 3.85Å; L311-I383 HydrophobicContact CD1-CB 4.37Å; L311-I383 HydrophobicContact CD1-CG2 3.76Å; L311-I383 HydrophobicContact CG-CG2 4.39Å; L311-M384 HydrophobicContact CD1-CG 4.04Å; L311-M384 HydrophobicContact CD1-SD 3.11Å; L311-M384 WeakPolarHBondContact CD1-SD 3.47Å; L311-M384 HydrophobicContact CG-SD 4.4Å
312	L	93.3	Very high	93.8	Very high	58 Å²	58	56.1 Å²	56.1	30%	0.304	29%	0.291	S	S	.	.	H	α-helix	trans	-61.6	-32.7	179.2	-67.4	175.5	0	0	0	111.4	L308 L309 M315 I316	L308-L312 HydrophobicContact CD1-CD1 4.43Å; L308-L312 HydrophobicContact CD1-CG 4.29Å; L308-L312 HydrophobicContact CG-CD1 4.18Å; L308-L312 HydrophobicContact CG-CG 4.43Å; L308-L312 VanDerWaalsContact O-CG 3.3Å; L308-L312 WeakPolarHBondContact O-CG 3.23Å; L308-L312 PolarHBondContact O-N 2.88Å; L309-L312 PolarHBondContact O-N 2.87Å; L312-M315 HydrophobicContact CD2-CE 3.59Å; L312-I316 WeakPolarHBondContact O-CB 3.5Å; L312-I316 WeakPolarHBondContact O-CD1 3.49Å; L312-I316 WeakPolarHBondContact O-CG1 3.22Å; L312-I316 PolarHBondContact O-N 3.06Å
313	F	95.8	Very high	94.1	Very high	114 Å²	114	55.1 Å²	55.1	50%	0.5	28%	0.278	S	S	.	.	H	α-helix	trans	-63.9	-51.5	175.4	175.7	-104.1	0	0	0	112.5	L309 L310 L311 M315 I316 I317	L309-F313 VanDerWaalsContact O-CB 3.31Å; L309-F313 WeakPolarHBondContact O-CB 3.19Å; L309-F313 PolarHBondContact O-N 2.68Å; L310-F313 WeakPolarHBondContact O-CB 3.25Å; L310-F313 PolarHBondContact O-N 3.33Å; L311-F313 PolarHBondContact O-N 3.47Å; F313-M315 VanDerWaalsContact C-N 3.32Å; F313-M315 PolarHBondContact O-N 3.15Å; F313-I316 PolarHBondContact O-N 2.96Å; F313-I317 HydrophobicContact CD1-CD1 3.96Å; F313-I317 HydrophobicContact CE1-CD1 3.44Å; F313-I317 VanDerWaalsContact CE1-CD1 3.44Å; F313-I317 HydrophobicContact CE2-CD1 4.13Å; F313-I317 HydrophobicContact CZ-CD1 3.55Å; F313-I317 WeakPolarHBondContact O-CG1 3.46Å; F313-I317 PolarHBondContact O-N 3.1Å; F313-I317 VanDerWaalsContact O-N 3.13Å
314	F	95.5	Very high	94.5	Very high	67 Å²	67	61.4 Å²	61.4	29%	0.294	30%	0.297	S	S	.	.	H	α-helix	trans	-63.8	-38.5	176.6	-81.7	-71	0	0	0	111.9	L310 L311 I316 I317 F318 E379 I383	L310-F314 HydrophobicContact CD1-CD2 4Å; L310-F314 HydrophobicContact CD1-CE2 3.59Å; L310-F314 HydrophobicContact CG-CD2 4.09Å; L310-F314 HydrophobicContact CG-CE2 3.98Å; L310-F314 WeakPolarHBondContact O-CD2 3.38Å; L310-F314 PolarHBondContact O-N 3.45Å; L310-F314 VanDerWaalsContact O-N 3.1Å; L311-F314 PolarHBondContact O-N 3.38Å; F314-I316 VanDerWaalsContact C-N 3.33Å; F314-I316 PolarHBondContact O-N 3.43Å; F314-I317 WeakPolarHBondContact O-CB 3.45Å; F314-I317 PolarHBondContact O-N 2.99Å; F314-I317 VanDerWaalsContact O-N 3.16Å; F314-F318 WeakPolarHBondContact O-CD2 3.35Å; F314-F318 PolarHBondContact O-N 2.88Å; F314-E379 WeakPolarHBondContact CB-OE1 3.48Å; F314-I383 HydrophobicContact CB-CD1 4.41Å; F314-I383 HydrophobicContact CD2-CD1 3.56Å; F314-I383 HydrophobicContact CE2-CD1 4.09Å; F314-I383 HydrophobicContact CG-CD1 4.2Å
315	M	96.4	Very high	94.8	Very high	9 Å²	9	65.8 Å²	65.8	4%	0.044	32%	0.32	C	S	.	.	H	α-helix	trans	-61	-42.9	177.9	-177.2	-172.4	68.9	0	0	111.3	L311 L312 F313 F318 A319 I342 L345 F346 E379	L311-M315 WeakPolarHBondContact O-CB 3.37Å; L311-M315 PolarHBondContact O-N 2.74Å; L312-M315 HydrophobicContact CD2-CE 3.59Å; F313-M315 VanDerWaalsContact C-N 3.32Å; F313-M315 PolarHBondContact O-N 3.15Å; M315-F318 PolarHBondContact O-N 3.38Å; M315-A319 VanDerWaalsContact O-CB 3.31Å; M315-A319 WeakPolarHBondContact O-CB 3.39Å; M315-A319 PolarHBondContact O-N 3.34Å; M315-I342 HydrophobicContact CE-CG2 4.2Å; M315-L345 HydrophobicContact CG-CB 4.32Å; M315-F346 HydrophobicContact CE-CD2 4.22Å; M315-F346 HydrophobicContact SD-CB 3.82Å; M315-F346 HydrophobicContact SD-CD2 3.75Å; M315-F346 HydrophobicContact SD-CG 4.28Å; M315-E379 WeakPolarHBondContact CA-OE1 3.16Å; M315-E379 PolarHBondContact N-OE1 3.36Å
316	I	96.8	Very high	95.1	Very high	81 Å²	81	61.6 Å²	61.6	42%	0.415	30%	0.299	S	S	.	.	H	α-helix	trans	-64.8	-41.4	176.6	-70.3	165.7	0	0	0	110.9	L312 F313 F314 A319 I320	L312-I316 WeakPolarHBondContact O-CB 3.5Å; L312-I316 WeakPolarHBondContact O-CD1 3.49Å; L312-I316 WeakPolarHBondContact O-CG1 3.22Å; L312-I316 PolarHBondContact O-N 3.06Å; F313-I316 PolarHBondContact O-N 2.96Å; F314-I316 VanDerWaalsContact C-N 3.33Å; F314-I316 PolarHBondContact O-N 3.43Å; I316-A319 PolarHBondContact O-N 2.68Å; I316-I320 HydrophobicContact CG2-CD1 3.91Å; I316-I320 HydrophobicContact CG2-CG1 4.49Å; I316-I320 VanDerWaalsContact O-CG1 3.3Å; I316-I320 WeakPolarHBondContact O-CG1 3.49Å; I316-I320 PolarHBondContact O-N 3.47Å
317	I	97.7	Very high	95.2	Very high	77 Å²	77	58 Å²	58	40%	0.395	28%	0.284	S	S	.	.	H	α-helix	trans	-59.4	-49.3	175.9	-69.9	170.8	0	0	0	110.7	F313 F314 A319 I320 L321	F313-I317 HydrophobicContact CD1-CD1 3.96Å; F313-I317 HydrophobicContact CE1-CD1 3.44Å; F313-I317 VanDerWaalsContact CE1-CD1 3.44Å; F313-I317 HydrophobicContact CE2-CD1 4.13Å; F313-I317 HydrophobicContact CZ-CD1 3.55Å; F313-I317 WeakPolarHBondContact O-CG1 3.46Å; F313-I317 PolarHBondContact O-N 3.1Å; F313-I317 VanDerWaalsContact O-N 3.13Å; F314-I317 WeakPolarHBondContact O-CB 3.45Å; F314-I317 PolarHBondContact O-N 2.99Å; F314-I317 VanDerWaalsContact O-N 3.16Å; I317-A319 VanDerWaalsContact C-N 3.3Å; I317-A319 PolarHBondContact O-N 2.91Å; I317-I320 PolarHBondContact O-N 2.95Å; I317-L321 WeakPolarHBondContact O-CB 3.41Å; I317-L321 PolarHBondContact O-N 2.91Å
318	F	97.9	Very high	95.3	Very high	23 Å²	23	61.5 Å²	61.5	10%	0.101	31%	0.308	C	S	.	.	H	α-helix	trans	-66.2	-32.6	178	-82	-71.7	0	0	0	112.4	F314 M315 L321 G322 L345 F371 V374 Y375 I378	F314-F318 WeakPolarHBondContact O-CD2 3.35Å; F314-F318 PolarHBondContact O-N 2.88Å; M315-F318 PolarHBondContact O-N 3.38Å; F318-L321 HydrophobicContact CD1-CD2 4.43Å; F318-L321 PolarHBondContact O-N 3.03Å; F318-G322 PolarHBondContact O-N 2.92Å; F318-L345 VanDerWaalsContact C-CD1 3.44Å; F318-L345 HydrophobicContact CB-CD1 3.79Å; F318-F371 HydrophobicContact CB-CZ 4.38Å; F318-F371 HydrophobicContact CD1-CD2 4.38Å; F318-F371 AromaticContact CD1-CE2 3.76Å; F318-F371 HydrophobicContact CD1-CE2 3.76Å; F318-F371 HydrophobicContact CD1-CZ 4.16Å; F318-F371 WeakPolarHBondContact O-CZ 3.42Å; F318-V374 HydrophobicContact CE1-CG1 4.46Å; F318-V374 HydrophobicContact CZ-CG1 4.18Å; F318-Y375 HydrophobicContact CB-CD2 3.79Å; F318-Y375 HydrophobicContact CB-CE2 4.11Å; F318-Y375 HydrophobicContact CD1-CD2 4.27Å; F318-Y375 AromaticContact CD2-CD2 3.76Å; F318-Y375 HydrophobicContact CD2-CD2 3.76Å; F318-Y375 HydrophobicContact CD2-CE2 4.33Å; F318-Y375 HydrophobicContact CE2-CD2 4.4Å; F318-Y375 AromaticContact CG-CD2 3.69Å; F318-Y375 HydrophobicContact CG-CD2 3.69Å; F318-Y375 HydrophobicContact CG-CE2 4.38Å; F318-I378 HydrophobicContact CZ-CD1 4.34Å
319	A	97.6	Very high	95.4	Very high	0 Å²	0	61.4 Å²	61.4	0%	0	31%	0.308	C	S	.	.	H	α-helix	trans	-66.1	-43	175.6	0	0	0	0	0	111.5	M315 I316 I317 F323 I342 L345	M315-A319 VanDerWaalsContact O-CB 3.31Å; M315-A319 WeakPolarHBondContact O-CB 3.39Å; M315-A319 PolarHBondContact O-N 3.34Å; I316-A319 PolarHBondContact O-N 2.68Å; I317-A319 VanDerWaalsContact C-N 3.3Å; I317-A319 PolarHBondContact O-N 2.91Å; A319-F323 VanDerWaalsContact O-CB 3.32Å; A319-F323 WeakPolarHBondContact O-CB 3.39Å; A319-F323 PolarHBondContact O-N 3.47Å; A319-I342 HydrophobicContact CB-CB 4.41Å; A319-I342 HydrophobicContact CB-CG1 3.61Å; A319-L345 VanDerWaalsContact CA-CD1 3.46Å; A319-L345 HydrophobicContact CB-CD1 3.93Å; A319-L345 VanDerWaalsContact N-CD1 3.29Å
320	I	97.6	Very high	95.2	Very high	75 Å²	75	61.7 Å²	61.7	39%	0.385	32%	0.317	S	S	.	.	H	α-helix	trans	-63.2	-46.9	175	-66.1	166.2	0	0	0	109.9	I316 I317 F323 Y324 L338	I316-I320 HydrophobicContact CG2-CD1 3.91Å; I316-I320 HydrophobicContact CG2-CG1 4.49Å; I316-I320 VanDerWaalsContact O-CG1 3.3Å; I316-I320 WeakPolarHBondContact O-CG1 3.49Å; I316-I320 PolarHBondContact O-N 3.47Å; I317-I320 PolarHBondContact O-N 2.95Å; I320-F323 PolarHBondContact O-N 3.25Å; I320-Y324 HydrophobicContact CG2-CD2 3.97Å; I320-Y324 HydrophobicContact CG2-CE2 3.81Å; I320-Y324 VanDerWaalsContact O-CD2 3.22Å; I320-Y324 WeakPolarHBondContact O-CD2 3.18Å; I320-Y324 PolarHBondContact O-N 2.93Å; I320-Y324 VanDerWaalsContact O-N 3.14Å; I320-L338 HydrophobicContact CG1-CD1 4.08Å
321	L	97.1	Very high	94.9	Very high	88 Å²	88	62.2 Å²	62.2	46%	0.461	33%	0.326	S	S	.	.	H	α-helix	trans	-62	-46.2	178.2	179.3	61.3	0	0	0	112.1	I317 F318 Y324 L325 F371	I317-L321 WeakPolarHBondContact O-CB 3.41Å; I317-L321 PolarHBondContact O-N 2.91Å; F318-L321 HydrophobicContact CD1-CD2 4.43Å; F318-L321 PolarHBondContact O-N 3.03Å; L321-Y324 PolarHBondContact O-N 3.41Å; L321-L325 WeakPolarHBondContact O-CB 3.49Å; L321-L325 PolarHBondContact O-N 3.21Å; L321-F371 HydrophobicContact CB-CE2 4.37Å; L321-F371 HydrophobicContact CD2-CD2 4.27Å; L321-F371 HydrophobicContact CD2-CE2 4.07Å; L321-F371 HydrophobicContact CG-CD2 4.5Å; L321-F371 HydrophobicContact CG-CE2 4.09Å
322	G	96.1	Very high	94.7	Very high	0 Å²	0	62.3 Å²	62.3	0%	0	33%	0.327	C	S	.	.	H	α-helix	trans	-63.1	-40.1	178.7	0	0	0	0	0	112.2	F318 L325 F326	F318-G322 PolarHBondContact O-N 2.92Å; G322-L325 PolarHBondContact O-N 3.4Å; G322-F326 WeakPolarHBondContact O-CB 3.33Å; G322-F326 WeakPolarHBondContact O-CD2 3.45Å; G322-F326 PolarHBondContact O-N 2.93Å
323	F	96.8	Very high	94.4	Very high	59 Å²	59	62.6 Å²	62.6	26%	0.259	33%	0.332	S	S	.	.	H	α-helix	trans	-57.9	-50.9	173	176.1	-104.5	0	0	0	111.3	A319 I320 L325 S327	A319-F323 VanDerWaalsContact O-CB 3.32Å; A319-F323 WeakPolarHBondContact O-CB 3.39Å; A319-F323 PolarHBondContact O-N 3.47Å; I320-F323 PolarHBondContact O-N 3.25Å; F323-L325 VanDerWaalsContact C-N 3.3Å; F323-L325 PolarHBondContact O-N 3.16Å; F323-S327 WeakPolarHBondContact O-CB 3.02Å; F323-S327 PolarHBondContact O-N 3Å
324	Y	95.8	Very high	94.3	Very high	176 Å²	176	60 Å²	60	69%	0.69	32%	0.319	S	S	*	.	H	α-helix	trans	-63	-34.8	177.7	-80.6	-68.9	0	0	0	113.4	I320 L321	I320-Y324 HydrophobicContact CG2-CD2 3.97Å; I320-Y324 HydrophobicContact CG2-CE2 3.81Å; I320-Y324 VanDerWaalsContact O-CD2 3.22Å; I320-Y324 WeakPolarHBondContact O-CD2 3.18Å; I320-Y324 PolarHBondContact O-N 2.93Å; I320-Y324 VanDerWaalsContact O-N 3.14Å; L321-Y324 PolarHBondContact O-N 3.41Å
325	L	95.1	Very high	94.3	Very high	99 Å²	99	56.8 Å²	56.8	52%	0.518	31%	0.305	S	S	.	.	H	α-helix	trans	-79.7	-36.2	-175	-167	62	0	0	0	113.1	L321 G322 F323 F371	L321-L325 WeakPolarHBondContact O-CB 3.49Å; L321-L325 PolarHBondContact O-N 3.21Å; G322-L325 PolarHBondContact O-N 3.4Å; F323-L325 VanDerWaalsContact C-N 3.3Å; F323-L325 PolarHBondContact O-N 3.16Å; L325-F371 HydrophobicContact CD2-CD2 4.46Å
326	F	95.9	Very high	94.1	Very high	10 Å²	10	59 Å²	59	4%	0.044	32%	0.322	C	S	.	.	H	α-helix	trans	-117.4	-18.4	-167.8	-54.1	-52.8	0	0	0	115	G322 P328 N329 F335 S361 F371 F372	G322-F326 WeakPolarHBondContact O-CB 3.33Å; G322-F326 WeakPolarHBondContact O-CD2 3.45Å; G322-F326 PolarHBondContact O-N 2.93Å; F326-P328 VanDerWaalsContact C-N 3.29Å; F326-N329 WeakPolarHBondContact O-CB 3.2Å; F326-N329 PolarHBondContact O-N 3.34Å; F326-F335 HydrophobicContact CB-CB 3.77Å; F326-F335 HydrophobicContact CB-CD2 4.02Å; F326-F335 HydrophobicContact CB-CG 3.95Å; F326-F335 HydrophobicContact CD2-CD1 4.3Å; F326-F335 AromaticContact CD2-CD2 3.93Å; F326-F335 HydrophobicContact CD2-CD2 3.93Å; F326-F335 HydrophobicContact CD2-CE1 4.4Å; F326-F335 HydrophobicContact CD2-CE2 4.04Å; F326-F335 HydrophobicContact CD2-CG 4.07Å; F326-F335 HydrophobicContact CD2-CZ 4.28Å; F326-F335 HydrophobicContact CG-CD2 4.35Å; F326-F335 HydrophobicContact CG-CG 4.5Å; F326-S361 WeakPolarHBondContact CD1-OG 3.43Å; F326-S361 WeakPolarHBondContact CG-OG 3.23Å; F326-F371 HydrophobicContact CE2-CB 4.4Å; F326-F371 AromaticContact CE2-CD1 3.62Å; F326-F371 HydrophobicContact CE2-CD1 3.62Å; F326-F371 HydrophobicContact CE2-CD2 4.36Å; F326-F371 AromaticContact CE2-CE1 3.91Å; F326-F371 HydrophobicContact CE2-CE1 3.91Å; F326-F371 AromaticContact CE2-CG 3.88Å; F326-F371 HydrophobicContact CE2-CG 3.88Å; F326-F371 HydrophobicContact CE2-CZ 4.39Å; F326-F371 HydrophobicContact CZ-CB 4.08Å; F326-F371 HydrophobicContact CZ-CD1 4.11Å; F326-F371 HydrophobicContact CZ-CG 4.06Å; F326-F372 HydrophobicContact CE2-CE2 4.07Å; F326-F372 HydrophobicContact CE2-CZ 4.06Å; F326-F372 HydrophobicContact CZ-CE2 4Å; F326-F372 HydrophobicContact CZ-CZ 4.44Å
327	S	94.6	Very high	94	Very high	43 Å²	43	58 Å²	58	30%	0.301	32%	0.32	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.9	-32.9	176.9	-178.9	0	0	0	0	115.1	F323 N329 F335	F323-S327 WeakPolarHBondContact O-CB 3.02Å; F323-S327 PolarHBondContact O-N 3Å; S327-N329 PolarHBondContact O-N 3.24Å; S327-F335 WeakPolarHBondContact CA-O 3.26Å; S327-F335 WeakPolarHBondContact CB-O 2.9Å
328	P	93.1	Very high	93.8	Very high	99 Å²	99	58.3 Å²	58.3	64%	0.643	32%	0.321	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.2	-9.2	176.3	-24	35.1	0	0	0	114.9	F326 P330	F326-P328 VanDerWaalsContact C-N 3.29Å; P328-P330 WeakPolarHBondContact O-CD 3.49Å
329	N	91.3	Very high	93.6	Very high	17 Å²	17	61.1 Å²	61.1	9%	0.091	34%	0.335	C	S	.	.			trans	-88.6	109.7	-179.2	-165.6	24.1	0	0	0	111.5	F326 S327 S331 D332 P360 R364	F326-N329 WeakPolarHBondContact O-CB 3.2Å; F326-N329 PolarHBondContact O-N 3.34Å; S327-N329 PolarHBondContact O-N 3.24Å; N329-S331 PolarHBondContact ND2-OG 3.47Å; N329-S331 PolarHBondContact O-N 3.04Å; N329-S331 PolarHBondContact OD1-OG 3.36Å; N329-D332 HydrophobicContact CB-CB 4.09Å; N329-D332 PolarHBondContact O-N 3.03Å; N329-P360 PolarHBondContact ND2-O 3.04Å; N329-R364 PolarHBondContact OD1-NH1 2.89Å; N329-R364 VanDerWaalsContact OD1-NH1 3.17Å
330	P	88.1	Confident	93.4	Very high	129 Å²	129	63.3 Å²	63.3	84%	0.838	35%	0.346	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.1	-17.5	-176.6	28.9	-35.7	0	0	0	113.6	P328 D332	P328-P330 WeakPolarHBondContact O-CD 3.49Å; P330-D332 VanDerWaalsContact C-N 3.32Å
331	S	87.8	Confident	93.3	Very high	78 Å²	78	59.7 Å²	59.7	55%	0.545	33%	0.328	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.5	-0.8	177.6	62.6	0	0	0	0	113.6	N329 P333	N329-S331 PolarHBondContact ND2-OG 3.47Å; N329-S331 PolarHBondContact O-N 3.04Å; N329-S331 PolarHBondContact OD1-OG 3.36Å; S331-P333 WeakPolarHBondContact O-CD 3.3Å
332	D	87.3	Confident	93.3	Very high	7 Å²	7	58 Å²	58	4%	0.037	32%	0.319	C	S	.	.			trans	-101.7	107.6	-179	-168.1	-26.3	0	0	0	110.4	N329 P330 Y334 F335 P360 S361	N329-D332 HydrophobicContact CB-CB 4.09Å; N329-D332 PolarHBondContact O-N 3.03Å; P330-D332 VanDerWaalsContact C-N 3.32Å; D332-Y334 VanDerWaalsContact C-N 3.3Å; D332-Y334 WeakPolarHBondContact OD1-CA 3.34Å; D332-Y334 VanDerWaalsContact OD1-CB 3.3Å; D332-Y334 WeakPolarHBondContact OD1-CB 3.33Å; D332-Y334 VanDerWaalsContact OD1-CD2 3.3Å; D332-Y334 WeakPolarHBondContact OD1-CD2 3.31Å; D332-Y334 PolarHBondContact OD1-N 2.94Å; D332-F335 PolarHBondContact OD1-N 3.16Å; D332-P360 HydrophobicContact CB-CB 4Å; D332-S361 PolarHBondContact OD2-OG 2.91Å; D332-S361 VanDerWaalsContact OD2-OG 3.08Å
333	P	88.9	Confident	93.3	Very high	63 Å²	63	58.6 Å²	58.6	41%	0.409	32%	0.322	S	S	.	.	S	Bend	trans	-78.1	-13.5	177.4	32.4	-34.7	0	0	0	113.3	S331 T674	S331-P333 WeakPolarHBondContact O-CD 3.3Å; P333-T674 HydrophobicContact CB-CG2 4.47Å
334	Y	93.5	Very high	93.2	Very high	59 Å²	59	56.3 Å²	56.3	23%	0.231	31%	0.314	C	S	.	.	S	Bend	trans	-85.3	-42.5	-169.3	-55.7	-76.8	0	0	0	112.7	D332 N340 S341 S344 D356 V357 P360	D332-Y334 VanDerWaalsContact C-N 3.3Å; D332-Y334 WeakPolarHBondContact OD1-CA 3.34Å; D332-Y334 VanDerWaalsContact OD1-CB 3.3Å; D332-Y334 WeakPolarHBondContact OD1-CB 3.33Å; D332-Y334 VanDerWaalsContact OD1-CD2 3.3Å; D332-Y334 WeakPolarHBondContact OD1-CD2 3.31Å; D332-Y334 PolarHBondContact OD1-N 2.94Å; Y334-N340 CarbonylContact O-C 3.57Å; Y334-N340 VanDerWaalsContact O-CB 3.29Å; Y334-N340 WeakPolarHBondContact O-CB 3.31Å; Y334-S341 PolarHBondContact O-N 3.03Å; Y334-S344 PolarHBondContact O-OG 3.4Å; Y334-D356 WeakPolarHBondContact CE2-O 3.35Å; Y334-V357 HydrophobicContact CD1-CB 4.36Å; Y334-V357 HydrophobicContact CD1-CG2 3.99Å; Y334-V357 HydrophobicContact CD2-CG2 4.3Å; Y334-V357 HydrophobicContact CE1-CB 4.47Å; Y334-V357 HydrophobicContact CG-CB 4.41Å; Y334-V357 HydrophobicContact CG-CG2 3.84Å; Y334-P360 HydrophobicContact CD2-CG 4.32Å; Y334-P360 HydrophobicContact CE2-CG 4.09Å
335	F	95.3	Very high	93.3	Very high	1 Å²	1	48 Å²	48	0%	0.004	28%	0.281	C	S	.	.	S	Bend	trans	-103.9	24	-176.5	-64.5	-83.5	0	0	0	113.8	F326 S327 D332 L345 V357 F371 F372	F326-F335 HydrophobicContact CB-CB 3.77Å; F326-F335 HydrophobicContact CB-CD2 4.02Å; F326-F335 HydrophobicContact CB-CG 3.95Å; F326-F335 HydrophobicContact CD2-CD1 4.3Å; F326-F335 AromaticContact CD2-CD2 3.93Å; F326-F335 HydrophobicContact CD2-CD2 3.93Å; F326-F335 HydrophobicContact CD2-CE1 4.4Å; F326-F335 HydrophobicContact CD2-CE2 4.04Å; F326-F335 HydrophobicContact CD2-CG 4.07Å; F326-F335 HydrophobicContact CD2-CZ 4.28Å; F326-F335 HydrophobicContact CG-CD2 4.35Å; F326-F335 HydrophobicContact CG-CG 4.5Å; S327-F335 WeakPolarHBondContact CA-O 3.26Å; S327-F335 WeakPolarHBondContact CB-O 2.9Å; D332-F335 PolarHBondContact OD1-N 3.16Å; F335-L345 HydrophobicContact CE1-CD2 4.19Å; F335-L345 HydrophobicContact CE1-CG 4.25Å; F335-L345 HydrophobicContact CZ-CD2 4.03Å; F335-V357 HydrophobicContact CE2-CG2 4.1Å; F335-V357 HydrophobicContact CZ-CG2 4.45Å; F335-F371 HydrophobicContact CZ-CE1 4.38Å; F335-F372 HydrophobicContact CE2-CE1 4.04Å; F335-F372 AromaticContact CE2-CZ 3.83Å; F335-F372 HydrophobicContact CE2-CZ 3.83Å; F335-F372 AromaticContact CZ-CE1 3.98Å; F335-F372 HydrophobicContact CZ-CE1 3.98Å; F335-F372 HydrophobicContact CZ-CZ 4.11Å
336	S	92.2	Very high	93.4	Very high	55 Å²	55	43.5 Å²	43.5	39%	0.385	26%	0.258	S	S	.	.	S	Bend	trans	-71.6	-33.4	-176.1	64.4	0	0	0	0	113.6	N340	S336-N340 PolarHBondContact OG-ND2 2.86Å
337	T	94.2	Very high	93.4	Very high	61 Å²	61	43.2 Å²	43.2	37%	0.374	26%	0.257	S	S	.	.	S	Bend	trans	-132.7	161.8	177	67	0	0	0	0	110.5	E339 N340 S341	T337-E339 VanDerWaalsContact C-N 3.3Å; T337-E339 PolarHBondContact O-N 3.12Å; T337-N340 PolarHBondContact O-N 2.84Å; T337-N340 WeakPolarHBondContact OG1-CB 3.44Å; T337-N340 PolarHBondContact OG1-N 3.39Å; T337-N340 VanDerWaalsContact OG1-N 3.16Å; T337-N340 PolarHBondContact OG1-ND2 2.98Å; T337-S341 WeakPolarHBondContact O-CB 3.33Å; T337-S341 PolarHBondContact O-N 2.81Å; T337-S341 PolarHBondContact O-OG 3.03Å
338	L	93.9	Very high	93.5	Very high	82 Å²	82	41.2 Å²	41.2	43%	0.429	24%	0.242	S	C	.	.	H	α-helix	trans	-60.3	-41	176.7	-176.9	62.4	0	0	0	111.7	I320 S341 I342	I320-L338 HydrophobicContact CG1-CD1 4.08Å; L338-S341 WeakPolarHBondContact O-CB 3.5Å; L338-S341 PolarHBondContact O-N 3.28Å; L338-I342 HydrophobicContact CD1-CD1 4.43Å; L338-I342 HydrophobicContact CG-CD1 4.12Å; L338-I342 WeakPolarHBondContact O-CG1 3.36Å; L338-I342 PolarHBondContact O-N 3.06Å
339	E	93.5	Very high	93.6	Very high	83 Å²	83	36.6 Å²	36.6	39%	0.388	21%	0.213	S	C	.	.	H	α-helix	trans	-62.4	-48.7	176.8	-174.6	-177.2	173.2	0	0	111.6	T337 S341 I342 V343 H734 R737	T337-E339 VanDerWaalsContact C-N 3.3Å; T337-E339 PolarHBondContact O-N 3.12Å; E339-S341 PolarHBondContact O-N 3.01Å; E339-I342 PolarHBondContact O-N 2.95Å; E339-V343 HydrophobicContact CG-CG2 4.47Å; E339-V343 WeakPolarHBondContact O-CG2 3.38Å; E339-V343 PolarHBondContact O-N 3.2Å; E339-H734 IonicContact OE1-CG 3.57Å; E339-H734 IonicContact OE1-ND1 3.46Å; E339-H734 PolarHBondContact OE1-ND1 3.28Å; E339-R737 VanDerWaalsContact CD-NH1 3.33Å; E339-R737 IonicContact OE1-CZ 2.8Å; E339-R737 IonicContact OE1-NH1 3.92Å; E339-R737 PolarHBondContact OE1-NH1 3.03Å
340	N	92.9	Very high	93.8	Very high	45 Å²	45	36.3 Å²	36.3	24%	0.241	21%	0.211	C	C	.	.	H	α-helix	trans	-61.8	-35.4	178.3	-69.7	-13.3	0	0	0	111.5	Y334 S336 T337 S344	Y334-N340 CarbonylContact O-C 3.57Å; Y334-N340 VanDerWaalsContact O-CB 3.29Å; Y334-N340 WeakPolarHBondContact O-CB 3.31Å; S336-N340 PolarHBondContact OG-ND2 2.86Å; T337-N340 PolarHBondContact O-N 2.84Å; T337-N340 WeakPolarHBondContact OG1-CB 3.44Å; T337-N340 PolarHBondContact OG1-N 3.39Å; T337-N340 VanDerWaalsContact OG1-N 3.16Å; T337-N340 PolarHBondContact OG1-ND2 2.98Å; N340-S344 WeakPolarHBondContact O-CB 3.14Å; N340-S344 PolarHBondContact O-N 3.25Å; N340-S344 PolarHBondContact O-OG 3.27Å
341	S	96.4	Very high	94.2	Very high	0 Å²	0	33.5 Å²	33.5	0%	0	19%	0.192	C	C	.	.	H	α-helix	trans	-64.5	-46.4	175.9	-53.7	0	0	0	0	111.3	Y334 T337 L338 E339 S344 L345	Y334-S341 PolarHBondContact O-N 3.03Å; T337-S341 WeakPolarHBondContact O-CB 3.33Å; T337-S341 PolarHBondContact O-N 2.81Å; T337-S341 PolarHBondContact O-OG 3.03Å; L338-S341 WeakPolarHBondContact O-CB 3.5Å; L338-S341 PolarHBondContact O-N 3.28Å; E339-S341 PolarHBondContact O-N 3.01Å; S341-S344 PolarHBondContact O-N 3.1Å; S341-L345 WeakPolarHBondContact O-CB 3.36Å; S341-L345 WeakPolarHBondContact O-CG 3.31Å; S341-L345 PolarHBondContact O-N 3.31Å
342	I	96.5	Very high	94.6	Very high	52 Å²	52	30.4 Å²	30.4	27%	0.267	17%	0.171	S	C	.	.	H	α-helix	trans	-62.2	-48.1	177.3	-67.6	166.2	0	0	0	110.6	M315 A319 L338 E339 L345 F346	M315-I342 HydrophobicContact CE-CG2 4.2Å; A319-I342 HydrophobicContact CB-CB 4.41Å; A319-I342 HydrophobicContact CB-CG1 3.61Å; L338-I342 HydrophobicContact CD1-CD1 4.43Å; L338-I342 HydrophobicContact CG-CD1 4.12Å; L338-I342 WeakPolarHBondContact O-CG1 3.36Å; L338-I342 PolarHBondContact O-N 3.06Å; E339-I342 PolarHBondContact O-N 2.95Å; I342-L345 PolarHBondContact O-N 3.38Å; I342-F346 WeakPolarHBondContact O-CB 3.43Å; I342-F346 PolarHBondContact O-N 3.46Å
343	V	95.9	Very high	94.9	Very high	12 Å²	12	30.3 Å²	30.3	7%	0.073	17%	0.171	C	C	.	.	H	α-helix	trans	-63.9	-45.1	179.8	176	0	0	0	0	110.7	E339 L345 F346 V347 M725 M741	E339-V343 HydrophobicContact CG-CG2 4.47Å; E339-V343 WeakPolarHBondContact O-CG2 3.38Å; E339-V343 PolarHBondContact O-N 3.2Å; V343-L345 VanDerWaalsContact C-N 3.32Å; V343-L345 PolarHBondContact O-N 3.38Å; V343-F346 PolarHBondContact O-N 3.34Å; V343-V347 HydrophobicContact CG1-CG2 4.44Å; V343-V347 VanDerWaalsContact O-CG2 3.32Å; V343-V347 WeakPolarHBondContact O-CG2 3.38Å; V343-V347 PolarHBondContact O-N 2.9Å; V343-M725 HydrophobicContact CG1-CE 3.68Å; V343-M741 HydrophobicContact CB-CE 4.38Å; V343-M741 HydrophobicContact CG1-CE 4.23Å; V343-M741 HydrophobicContact CG2-CE 3.99Å
344	S	95.9	Very high	95.2	Very high	12 Å²	12	31.9 Å²	31.9	8%	0.084	17%	0.171	C	C	.	.	H	α-helix	trans	-62.9	-38.7	-179.6	-62.2	0	0	0	0	112.2	Y334 N340 S341 L348 N353	Y334-S344 PolarHBondContact O-OG 3.4Å; N340-S344 WeakPolarHBondContact O-CB 3.14Å; N340-S344 PolarHBondContact O-N 3.25Å; N340-S344 PolarHBondContact O-OG 3.27Å; S341-S344 PolarHBondContact O-N 3.1Å; S344-L348 WeakPolarHBondContact O-CB 3.34Å; S344-L348 PolarHBondContact O-N 2.86Å; S344-N353 PolarHBondContact O-ND2 2.97Å
345	L	97.3	Very high	95.3	Very high	0 Å²	0	31.7 Å²	31.7	0%	0	18%	0.177	C	C	.	.	H	α-helix	trans	-72.2	-38.2	174.3	-69.5	-171.3	0	0	0	112.4	M315 F318 A319 F335 S341 I342 V343 V347 L348 L349 F371 Y375	M315-L345 HydrophobicContact CG-CB 4.32Å; F318-L345 VanDerWaalsContact C-CD1 3.44Å; F318-L345 HydrophobicContact CB-CD1 3.79Å; A319-L345 VanDerWaalsContact CA-CD1 3.46Å; A319-L345 HydrophobicContact CB-CD1 3.93Å; A319-L345 VanDerWaalsContact N-CD1 3.29Å; F335-L345 HydrophobicContact CE1-CD2 4.19Å; F335-L345 HydrophobicContact CE1-CG 4.25Å; F335-L345 HydrophobicContact CZ-CD2 4.03Å; S341-L345 WeakPolarHBondContact O-CB 3.36Å; S341-L345 WeakPolarHBondContact O-CG 3.31Å; S341-L345 PolarHBondContact O-N 3.31Å; I342-L345 PolarHBondContact O-N 3.38Å; V343-L345 VanDerWaalsContact C-N 3.32Å; V343-L345 PolarHBondContact O-N 3.38Å; L345-V347 VanDerWaalsContact C-N 3.29Å; L345-V347 PolarHBondContact O-N 2.9Å; L345-L348 HydrophobicContact CD2-CD2 3.9Å; L345-L348 CarbonylContact O-C 3.07Å; L345-L348 WeakPolarHBondContact O-CB 3.49Å; L345-L348 PolarHBondContact O-N 3.5Å; L345-L348 VanDerWaalsContact O-N 3.12Å; L345-L349 PolarHBondContact O-N 3.35Å; L345-F371 HydrophobicContact CD2-CE1 4.26Å; L345-Y375 HydrophobicContact CB-CE2 4.38Å; L345-Y375 HydrophobicContact CD1-CE2 4.23Å; L345-Y375 HydrophobicContact CD2-CE1 4.38Å; L345-Y375 HydrophobicContact CD2-CE2 4.4Å; L345-Y375 PolarHBondContact O-OH 3.42Å
346	F	96.4	Very high	95.3	Very high	6 Å²	6	35.4 Å²	35.4	3%	0.026	20%	0.197	C	C	.	.	H	α-helix	trans	-60.5	-40.1	172.5	-172.3	-83.8	0	0	0	111.6	M315 I342 V343 L349 W721 M741 Y744 I745	M315-F346 HydrophobicContact CE-CD2 4.22Å; M315-F346 HydrophobicContact SD-CB 3.82Å; M315-F346 HydrophobicContact SD-CD2 3.75Å; M315-F346 HydrophobicContact SD-CG 4.28Å; I342-F346 WeakPolarHBondContact O-CB 3.43Å; I342-F346 PolarHBondContact O-N 3.46Å; V343-F346 PolarHBondContact O-N 3.34Å; F346-L349 WeakPolarHBondContact O-CB 3.44Å; F346-L349 PolarHBondContact O-N 2.9Å; F346-W721 AromaticContact CD1-CH2 3.75Å; F346-W721 HydrophobicContact CD1-CH2 3.75Å; F346-W721 AromaticContact CD1-CZ2 3.86Å; F346-W721 HydrophobicContact CD1-CZ2 3.86Å; F346-W721 AromaticContact CE1-CH2 3.65Å; F346-W721 HydrophobicContact CE1-CH2 3.65Å; F346-W721 AromaticContact CE1-CZ2 3.89Å; F346-W721 HydrophobicContact CE1-CZ2 3.89Å; F346-M741 HydrophobicContact CB-CE 4.1Å; F346-M741 HydrophobicContact CD1-CE 3.94Å; F346-M741 HydrophobicContact CD1-CG 3.91Å; F346-M741 HydrophobicContact CD1-SD 4.3Å; F346-M741 HydrophobicContact CD2-SD 4.5Å; F346-M741 HydrophobicContact CE1-CB 4.02Å; F346-M741 HydrophobicContact CE1-CG 3.62Å; F346-M741 HydrophobicContact CE1-SD 4.46Å; F346-M741 HydrophobicContact CG-CE 3.98Å; F346-M741 HydrophobicContact CG-CG 4.48Å; F346-M741 HydrophobicContact CG-SD 4.32Å; F346-M741 HydrophobicContact CZ-CB 3.89Å; F346-M741 HydrophobicContact CZ-CG 3.94Å; F346-Y744 HydrophobicContact CE1-CD1 4.01Å; F346-Y744 AromaticContact CZ-CD1 3.8Å; F346-Y744 HydrophobicContact CZ-CD1 3.8Å; F346-Y744 HydrophobicContact CZ-CE1 4.43Å; F346-I745 HydrophobicContact CE2-CD1 4.48Å; F346-I745 HydrophobicContact CZ-CD1 4.47Å; F346-I745 HydrophobicContact CZ-CG1 4.34Å
347	V	96.8	Very high	95.4	Very high	4 Å²	4	32.8 Å²	32.8	2%	0.024	18%	0.179	C	C	.	.	H	α-helix	trans	-68.2	-38.7	173.7	179.1	0	0	0	0	110.8	V343 L345 L349 T350 T351 A352 N353 W721 Y722 M725	V343-V347 HydrophobicContact CG1-CG2 4.44Å; V343-V347 VanDerWaalsContact O-CG2 3.32Å; V343-V347 WeakPolarHBondContact O-CG2 3.38Å; V343-V347 PolarHBondContact O-N 2.9Å; L345-V347 VanDerWaalsContact C-N 3.29Å; L345-V347 PolarHBondContact O-N 2.9Å; V347-L349 VanDerWaalsContact C-N 3.32Å; V347-L349 PolarHBondContact O-N 2.77Å; V347-T350 WeakPolarHBondContact O-CB 3.4Å; V347-T350 PolarHBondContact O-N 2.73Å; V347-T350 VanDerWaalsContact O-N 3.07Å; V347-T350 PolarHBondContact O-OG1 3.22Å; V347-T351 PolarHBondContact O-N 2.75Å; V347-A352 HydrophobicContact CG1-CB 4Å; V347-A352 PolarHBondContact O-N 3.12Å; V347-N353 HydrophobicContact CG1-CB 3.78Å; V347-N353 VanDerWaalsContact CG1-CG 3.48Å; V347-W721 HydrophobicContact CB-CZ2 4.45Å; V347-W721 HydrophobicContact CG2-CH2 4.29Å; V347-W721 HydrophobicContact CG2-CZ2 3.83Å; V347-Y722 HydrophobicContact CG1-CD1 3.76Å; V347-Y722 HydrophobicContact CG1-CG 3.9Å; V347-M725 HydrophobicContact CG2-CE 4.28Å
348	L	96.8	Very high	95.5	Very high	0 Å²	0	30.8 Å²	30.8	0%	0	17%	0.165	C	C	.	.	H	α-helix	trans	-65.3	-32.9	176.6	179.1	60.9	0	0	0	112.9	S344 L345 T350 T351 N353 F354 V357 F372 Y375 L376	S344-L348 WeakPolarHBondContact O-CB 3.34Å; S344-L348 PolarHBondContact O-N 2.86Å; L345-L348 HydrophobicContact CD2-CD2 3.9Å; L345-L348 CarbonylContact O-C 3.07Å; L345-L348 WeakPolarHBondContact O-CB 3.49Å; L345-L348 PolarHBondContact O-N 3.5Å; L345-L348 VanDerWaalsContact O-N 3.12Å; L348-T350 PolarHBondContact O-N 3.08Å; L348-T351 WeakPolarHBondContact O-CA 3.34Å; L348-T351 PolarHBondContact O-N 3.46Å; L348-N353 WeakPolarHBondContact CA-OD1 3.49Å; L348-N353 PolarHBondContact N-OD1 2.94Å; L348-F354 HydrophobicContact CD1-CB 3.9Å; L348-F354 HydrophobicContact CD1-CD2 4.27Å; L348-V357 HydrophobicContact CD1-CG1 3.89Å; L348-V357 HydrophobicContact CD2-CG1 4.23Å; L348-V357 HydrophobicContact CG-CG1 4.43Å; L348-F372 HydrophobicContact CD2-CD1 3.63Å; L348-F372 HydrophobicContact CD2-CE1 4.19Å; L348-Y375 HydrophobicContact CB-CE1 4.14Å; L348-Y375 HydrophobicContact CD2-CD1 3.53Å; L348-Y375 HydrophobicContact CD2-CE1 3.71Å; L348-Y375 HydrophobicContact CG-CD1 3.96Å; L348-Y375 HydrophobicContact CG-CE1 3.75Å; L348-L376 HydrophobicContact CD1-CD1 4.4Å; L348-L376 HydrophobicContact CD1-CD2 4Å; L348-L376 HydrophobicContact CD1-CG 4.47Å; L348-L376 HydrophobicContact CG-CD2 4Å
349	L	95.6	Very high	95.7	Very high	3 Å²	3	30.8 Å²	30.8	2%	0.016	16%	0.164	C	C	.	.	H	α-helix	trans	-54.1	-35.2	171.7	-179.6	66.4	0	0	0	111.4	L311 L345 F346 V347 T351 E379 M384	L311-L349 HydrophobicContact CD1-CD1 4.1Å; L311-L349 HydrophobicContact CD1-CD2 4.08Å; L311-L349 HydrophobicContact CD2-CD2 3.77Å; L311-L349 HydrophobicContact CG-CD2 4.35Å; L345-L349 PolarHBondContact O-N 3.35Å; F346-L349 WeakPolarHBondContact O-CB 3.44Å; F346-L349 PolarHBondContact O-N 2.9Å; V347-L349 VanDerWaalsContact C-N 3.32Å; V347-L349 PolarHBondContact O-N 2.77Å; L349-T351 VanDerWaalsContact C-N 3.31Å; L349-E379 HydrophobicContact CD1-CB 3.86Å; L349-M384 HydrophobicContact CD1-CG 3.7Å; L349-M384 HydrophobicContact CD1-SD 3.86Å; L349-M384 HydrophobicContact CD2-SD 3.88Å; L349-M384 HydrophobicContact CG-CG 4.31Å; L349-M384 HydrophobicContact CG-SD 4.06Å
350	T	95.3	Very high	95.7	Very high	11 Å²	11	28.1 Å²	28.1	7%	0.067	15%	0.154	C	C	.	.	T	Hydrogen-bonded Turn	trans	-85.5	-3.4	177.1	75.4	0	0	0	0	113.5	V347 L348 A352 V718 W721 Y744	V347-T350 WeakPolarHBondContact O-CB 3.4Å; V347-T350 PolarHBondContact O-N 2.73Å; V347-T350 VanDerWaalsContact O-N 3.07Å; V347-T350 PolarHBondContact O-OG1 3.22Å; L348-T350 PolarHBondContact O-N 3.08Å; T350-A352 PolarHBondContact O-N 3.05Å; T350-A352 WeakPolarHBondContact OG1-CB 3.02Å; T350-V718 HydrophobicContact CG2-CG1 4.36Å; T350-W721 HydrophobicContact CG2-CZ2 4.2Å; T350-W721 PolarHBondContact OG1-NE1 2.68Å; T350-Y744 HydrophobicContact CG2-CD1 4.33Å; T350-Y744 HydrophobicContact CG2-CD2 4.14Å; T350-Y744 HydrophobicContact CG2-CE1 3.75Å; T350-Y744 HydrophobicContact CG2-CE2 3.53Å; T350-Y744 WeakPolarHBondContact CG2-OH 3.49Å
351	T	96.2	Very high	95.9	Very high	69 Å²	69	26.1 Å²	26.1	42%	0.423	14%	0.144	S	C	.	.	T	Hydrogen-bonded Turn	trans	60.5	12.1	-173.4	65.9	0	0	0	0	115.6	V347 L348 L349 N353 F354 L376 L380	V347-T351 PolarHBondContact O-N 2.75Å; L348-T351 WeakPolarHBondContact O-CA 3.34Å; L348-T351 PolarHBondContact O-N 3.46Å; L349-T351 VanDerWaalsContact C-N 3.31Å; T351-N353 VanDerWaalsContact C-N 3.32Å; T351-N353 PolarHBondContact O-N 2.62Å; T351-F354 PolarHBondContact O-N 3.29Å; T351-L376 HydrophobicContact CG2-CD2 4.29Å; T351-L380 HydrophobicContact CG2-CD2 3.38Å
352	A	95.4	Very high	95.8	Very high	14 Å²	14	31 Å²	31	12%	0.116	16%	0.163	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72.2	-20.9	-173.1	0	0	0	0	0	114.6	V347 T350 Y722	V347-A352 HydrophobicContact CG1-CB 4Å; V347-A352 PolarHBondContact O-N 3.12Å; T350-A352 PolarHBondContact O-N 3.05Å; T350-A352 WeakPolarHBondContact OG1-CB 3.02Å; A352-Y722 HydrophobicContact CB-CD1 4.3Å
353	N	94.7	Very high	95.8	Very high	5 Å²	5	33.5 Å²	33.5	3%	0.027	19%	0.185	C	C	.	.	T	Hydrogen-bonded Turn	trans	-119	15.4	179.9	65.6	-11.2	0	0	0	112.9	S344 V347 L348 T351 D356 V357 Y722	S344-N353 PolarHBondContact O-ND2 2.97Å; V347-N353 HydrophobicContact CG1-CB 3.78Å; V347-N353 VanDerWaalsContact CG1-CG 3.48Å; L348-N353 WeakPolarHBondContact CA-OD1 3.49Å; L348-N353 PolarHBondContact N-OD1 2.94Å; T351-N353 VanDerWaalsContact C-N 3.32Å; T351-N353 PolarHBondContact O-N 2.62Å; N353-D356 PolarHBondContact O-N 2.91Å; N353-V357 PolarHBondContact O-N 3.47Å; N353-Y722 HydrophobicContact CB-CD1 4.45Å; N353-Y722 HydrophobicContact CB-CE1 4.11Å
354	F	94.8	Very high	95.7	Very high	95 Å²	95	40.1 Å²	40.1	42%	0.417	21%	0.209	S	C	.	.	T	Hydrogen-bonded Turn	trans	-89.1	126.1	169.9	-176.7	-98.7	0	0	0	108.5	L348 T351 M358 L376	L348-F354 HydrophobicContact CD1-CB 3.9Å; L348-F354 HydrophobicContact CD1-CD2 4.27Å; T351-F354 PolarHBondContact O-N 3.29Å; F354-M358 HydrophobicContact CE2-CE 3.98Å; F354-M358 HydrophobicContact CE2-SD 4.23Å; F354-M358 HydrophobicContact CZ-CE 4.36Å; F354-L376 HydrophobicContact CD2-CD1 4.4Å
355	P	95.8	Very high	95.7	Very high	55 Å²	55	44 Å²	44	36%	0.357	23%	0.229	S	C	.	.	T	Hydrogen-bonded Turn	cis	-95.4	-7.2	19.1	36.6	-36.6	0	0	0	116.4	V357 M358 M359	P355-V357 VanDerWaalsContact C-N 3.35Å; P355-V357 PolarHBondContact O-N 3.22Å; P355-M358 PolarHBondContact O-N 3.36Å; P355-M359 HydrophobicContact CB-CE 3.65Å; P355-M359 HydrophobicContact CG-CE 4.43Å; P355-M359 PolarHBondContact O-N 2.91Å
356	D	94.4	Very high	95.6	Very high	80 Å²	80	47.5 Å²	47.5	43%	0.428	25%	0.251	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.9	-41.4	-165.6	-58.7	-25.7	0	0	0	114.2	Y334 N353 M358 M359 P360	Y334-D356 WeakPolarHBondContact CE2-O 3.35Å; N353-D356 PolarHBondContact O-N 2.91Å; D356-M358 PolarHBondContact O-N 3.11Å; D356-M359 PolarHBondContact O-N 3.11Å; D356-P360 WeakPolarHBondContact O-CD 3.17Å
357	V	95.4	Very high	95.6	Very high	0 Å²	0	56.9 Å²	56.9	0%	0	29%	0.287	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.5	-26.3	179.4	68.6	0	0	0	0	113.7	Y334 F335 L348 N353 P355 F372	Y334-V357 HydrophobicContact CD1-CB 4.36Å; Y334-V357 HydrophobicContact CD1-CG2 3.99Å; Y334-V357 HydrophobicContact CD2-CG2 4.3Å; Y334-V357 HydrophobicContact CE1-CB 4.47Å; Y334-V357 HydrophobicContact CG-CB 4.41Å; Y334-V357 HydrophobicContact CG-CG2 3.84Å; F335-V357 HydrophobicContact CE2-CG2 4.1Å; F335-V357 HydrophobicContact CZ-CG2 4.45Å; L348-V357 HydrophobicContact CD1-CG1 3.89Å; L348-V357 HydrophobicContact CD2-CG1 4.23Å; L348-V357 HydrophobicContact CG-CG1 4.43Å; N353-V357 PolarHBondContact O-N 3.47Å; P355-V357 VanDerWaalsContact C-N 3.35Å; P355-V357 PolarHBondContact O-N 3.22Å; V357-F372 HydrophobicContact CG1-CE1 4.23Å; V357-F372 HydrophobicContact CG2-CE1 4.4Å
358	M	96.6	Very high	95.5	Very high	18 Å²	18	57.5 Å²	57.5	9%	0.089	29%	0.291	C	S	.	.	T	Hydrogen-bonded Turn	trans	-89.1	-29.6	-178.3	175.1	179.8	74.7	0	0	112.4	F354 P355 D356 S361 Y362 C369 F372	F354-M358 HydrophobicContact CE2-CE 3.98Å; F354-M358 HydrophobicContact CE2-SD 4.23Å; F354-M358 HydrophobicContact CZ-CE 4.36Å; P355-M358 PolarHBondContact O-N 3.36Å; D356-M358 PolarHBondContact O-N 3.11Å; M358-S361 PolarHBondContact O-N 2.98Å; M358-S361 VanDerWaalsContact O-N 3.12Å; M358-Y362 WeakPolarHBondContact O-CB 3.22Å; M358-Y362 PolarHBondContact O-N 2.75Å; M358-C369 HydrophobicContact SD-CB 3.98Å; M358-F372 HydrophobicContact CB-CD1 4.23Å; M358-F372 HydrophobicContact CB-CD2 3.84Å; M358-F372 HydrophobicContact CB-CE1 4.29Å; M358-F372 HydrophobicContact CB-CE2 3.91Å; M358-F372 HydrophobicContact CB-CG 4.01Å; M358-F372 HydrophobicContact CB-CZ 4.13Å; M358-F372 HydrophobicContact CG-CD2 3.44Å; M358-F372 VanDerWaalsContact CG-CD2 3.44Å; M358-F372 HydrophobicContact CG-CE2 3.71Å; M358-F372 HydrophobicContact CG-CG 3.98Å; M358-F372 HydrophobicContact CG-CZ 4.43Å; M358-F372 HydrophobicContact SD-CB 4.12Å; M358-F372 HydrophobicContact SD-CD2 3.94Å; M358-F372 HydrophobicContact SD-CG 4.2Å
359	M	96.4	Very high	95.5	Very high	83 Å²	83	58.8 Å²	58.8	41%	0.409	30%	0.3	S	S	.	.	H	α-helix	trans	-59.7	-43	-165.2	-73.5	-62.9	146.4	0	0	115.1	P355 D356 S361 Y362 S363	P355-M359 HydrophobicContact CB-CE 3.65Å; P355-M359 HydrophobicContact CG-CE 4.43Å; P355-M359 PolarHBondContact O-N 2.91Å; D356-M359 PolarHBondContact O-N 3.11Å; M359-S361 VanDerWaalsContact C-N 3.27Å; M359-S361 PolarHBondContact O-N 2.72Å; M359-Y362 PolarHBondContact O-N 3.43Å; M359-Y362 HydrophobicContact SD-CD1 4.46Å; M359-S363 WeakPolarHBondContact O-CB 3.32Å; M359-S363 PolarHBondContact O-N 3.24Å
360	P	95.3	Very high	95.6	Very high	27 Å²	27	62.1 Å²	62.1	18%	0.175	32%	0.32	C	S	.	.	H	α-helix	trans	-59.3	-38.3	176.7	-25.1	34.9	0	0	0	113	N329 D332 Y334 D356	N329-P360 PolarHBondContact ND2-O 3.04Å; D332-P360 HydrophobicContact CB-CB 4Å; Y334-P360 HydrophobicContact CD2-CG 4.32Å; Y334-P360 HydrophobicContact CE2-CG 4.09Å; D356-P360 WeakPolarHBondContact O-CD 3.17Å
361	S	95.3	Very high	95.7	Very high	3 Å²	3	62.5 Å²	62.5	2%	0.021	32%	0.321	C	S	.	.	H	α-helix	trans	-79.6	-34.4	-179.6	-75.9	0	0	0	0	112.7	F326 D332 M358 M359 R364 N365 S368	F326-S361 WeakPolarHBondContact CD1-OG 3.43Å; F326-S361 WeakPolarHBondContact CG-OG 3.23Å; D332-S361 PolarHBondContact OD2-OG 2.91Å; D332-S361 VanDerWaalsContact OD2-OG 3.08Å; M358-S361 PolarHBondContact O-N 2.98Å; M358-S361 VanDerWaalsContact O-N 3.12Å; M359-S361 VanDerWaalsContact C-N 3.27Å; M359-S361 PolarHBondContact O-N 2.72Å; S361-R364 PolarHBondContact O-N 3.45Å; S361-N365 PolarHBondContact O-N 3.08Å; S361-S368 WeakPolarHBondContact O-CB 3.33Å; S361-S368 PolarHBondContact O-OG 3.18Å
362	Y	95.9	Very high	95.7	Very high	101 Å²	101	59.3 Å²	59.3	40%	0.396	30%	0.301	S	S	.	.	H	α-helix	trans	-72	-39.2	176.4	-176.6	-105.9	0	0	0	112.9	M358 M359 R364 N365 P366 C369	M358-Y362 WeakPolarHBondContact O-CB 3.22Å; M358-Y362 PolarHBondContact O-N 2.75Å; M359-Y362 PolarHBondContact O-N 3.43Å; M359-Y362 HydrophobicContact SD-CD1 4.46Å; Y362-R364 PolarHBondContact O-N 2.98Å; Y362-N365 CarbonylContact O-C 3.07Å; Y362-N365 VanDerWaalsContact O-C 3.24Å; Y362-N365 PolarHBondContact O-N 3.15Å; Y362-P366 WeakPolarHBondContact CD2-O 3.49Å; Y362-P366 HydrophobicContact CE2-CB 4.1Å; Y362-P366 VanDerWaalsContact CE2-O 3.23Å; Y362-P366 WeakPolarHBondContact CE2-O 3.23Å; Y362-C369 HydrophobicContact CD2-CB 3.84Å; Y362-C369 HydrophobicContact CE2-CB 3.93Å
363	S	95.9	Very high	95.8	Very high	106 Å²	106	63.3 Å²	63.3	74%	0.741	32%	0.32	S	S	*	.	H	α-helix	trans	-62.1	-26.4	175.7	-177	0	0	0	0	112.4	M359	M359-S363 WeakPolarHBondContact O-CB 3.32Å; M359-S363 PolarHBondContact O-N 3.24Å
364	R	93.7	Very high	96	Very high	151 Å²	151	66 Å²	66	57%	0.57	34%	0.336	S	S	*	.	H	α-helix	trans	-81.7	-50.2	177.3	-168.2	-178	-178.5	128.8	-1.8	111.6	N329 S361 Y362	N329-R364 PolarHBondContact OD1-NH1 2.89Å; N329-R364 VanDerWaalsContact OD1-NH1 3.17Å; S361-R364 PolarHBondContact O-N 3.45Å; Y362-R364 PolarHBondContact O-N 2.98Å
365	N	94.9	Very high	96.1	Very high	93 Å²	93	61.5 Å²	61.5	50%	0.497	32%	0.316	S	S	.	.			trans	-137.8	123.7	178.1	-75.4	-32.7	0	0	0	109.6	S361 Y362 W367 S368	S361-N365 PolarHBondContact O-N 3.08Å; Y362-N365 CarbonylContact O-C 3.07Å; Y362-N365 VanDerWaalsContact O-C 3.24Å; Y362-N365 PolarHBondContact O-N 3.15Å; N365-W367 PolarHBondContact O-N 3.49Å; N365-S368 VanDerWaalsContact O-CB 3.29Å; N365-S368 WeakPolarHBondContact O-CB 3.2Å; N365-S368 PolarHBondContact O-N 3.07Å; N365-S368 PolarHBondContact O-OG 3.43Å
366	P	95.4	Very high	96.2	Very high	73 Å²	73	59.8 Å²	59.8	47%	0.474	30%	0.304	S	S	.	.	G	3₁₀ helix	trans	-63.6	-26.9	-179.1	25.4	-34	0	0	0	112.3	Y362 S368 C369	Y362-P366 WeakPolarHBondContact CD2-O 3.49Å; Y362-P366 HydrophobicContact CE2-CB 4.1Å; Y362-P366 VanDerWaalsContact CE2-O 3.23Å; Y362-P366 WeakPolarHBondContact CE2-O 3.23Å; P366-S368 PolarHBondContact O-N 3.14Å; P366-C369 PolarHBondContact O-N 3.33Å; P366-C369 PolarHBondContact O-SG 3.09Å
367	W	96.3	Very high	96.3	Very high	204 Å²	204	58.8 Å²	58.8	77%	0.773	30%	0.303	S	S	*	.	G	3₁₀ helix	trans	-69.2	-14.8	177.1	-63.3	111.3	0	0	0	114.3	N365 C369 V370	N365-W367 PolarHBondContact O-N 3.49Å; W367-C369 PolarHBondContact O-N 3.46Å; W367-C369 VanDerWaalsContact O-N 3.12Å; W367-V370 HydrophobicContact CE3-CG2 4.22Å; W367-V370 WeakPolarHBondContact O-CB 3.42Å; W367-V370 WeakPolarHBondContact O-CG2 3.32Å; W367-V370 PolarHBondContact O-N 3.09Å
368	S	95.2	Very high	96.3	Very high	16 Å²	16	61.6 Å²	61.6	11%	0.112	32%	0.318	C	S	.	.	G	3₁₀ helix	trans	-59.2	-22.4	173.8	-56.6	0	0	0	0	112.2	S361 N365 P366 V370 F371 F372	S361-S368 WeakPolarHBondContact O-CB 3.33Å; S361-S368 PolarHBondContact O-OG 3.18Å; N365-S368 VanDerWaalsContact O-CB 3.29Å; N365-S368 WeakPolarHBondContact O-CB 3.2Å; N365-S368 PolarHBondContact O-N 3.07Å; N365-S368 PolarHBondContact O-OG 3.43Å; P366-S368 PolarHBondContact O-N 3.14Å; S368-V370 PolarHBondContact O-N 2.67Å; S368-F371 PolarHBondContact O-N 2.82Å; S368-F372 WeakPolarHBondContact O-CD2 3.13Å
369	C	96.5	Very high	96.2	Very high	28 Å²	28	60.8 Å²	60.8	19%	0.189	31%	0.313	C	S	.	.	H	α-helix	trans	-60.1	-28.6	175.5	71	0	0	0	0	113	M358 Y362 P366 W367 F371 F372 I373	M358-C369 HydrophobicContact SD-CB 3.98Å; Y362-C369 HydrophobicContact CD2-CB 3.84Å; Y362-C369 HydrophobicContact CE2-CB 3.93Å; P366-C369 PolarHBondContact O-N 3.33Å; P366-C369 PolarHBondContact O-SG 3.09Å; W367-C369 PolarHBondContact O-N 3.46Å; W367-C369 VanDerWaalsContact O-N 3.12Å; C369-F371 VanDerWaalsContact C-N 3.27Å; C369-F371 PolarHBondContact O-N 2.54Å; C369-F372 PolarHBondContact O-N 3.37Å; C369-I373 HydrophobicContact CB-CD1 4.22Å; C369-I373 WeakPolarHBondContact O-CB 3.47Å; C369-I373 VanDerWaalsContact O-CG1 3.28Å; C369-I373 WeakPolarHBondContact O-CG1 3.44Å; C369-I373 PolarHBondContact O-N 3.32Å
370	V	97.4	Very high	96.1	Very high	73 Å²	73	58.4 Å²	58.4	44%	0.442	30%	0.302	S	S	.	.	H	α-helix	trans	-60.3	-39.9	-178.6	176.8	0	0	0	0	110.7	W367 S368 F372 I373 V374	W367-V370 HydrophobicContact CE3-CG2 4.22Å; W367-V370 WeakPolarHBondContact O-CB 3.42Å; W367-V370 WeakPolarHBondContact O-CG2 3.32Å; W367-V370 PolarHBondContact O-N 3.09Å; S368-V370 PolarHBondContact O-N 2.67Å; V370-F372 PolarHBondContact O-N 2.68Å; V370-I373 PolarHBondContact O-N 3.16Å; V370-V374 HydrophobicContact CG1-CG2 4.17Å; V370-V374 WeakPolarHBondContact O-CB 3.42Å; V370-V374 WeakPolarHBondContact O-CG2 3.39Å; V370-V374 PolarHBondContact O-N 3.16Å
371	F	97.7	Very high	96.1	Very high	19 Å²	19	64.5 Å²	64.5	8%	0.083	32%	0.323	C	S	.	.	H	α-helix	trans	-57.3	-51.5	176.4	173.3	-91	0	0	0	111.5	F318 L321 L325 F326 F335 L345 S368 C369 V374 Y375	F318-F371 HydrophobicContact CB-CZ 4.38Å; F318-F371 HydrophobicContact CD1-CD2 4.38Å; F318-F371 AromaticContact CD1-CE2 3.76Å; F318-F371 HydrophobicContact CD1-CE2 3.76Å; F318-F371 HydrophobicContact CD1-CZ 4.16Å; F318-F371 WeakPolarHBondContact O-CZ 3.42Å; L321-F371 HydrophobicContact CB-CE2 4.37Å; L321-F371 HydrophobicContact CD2-CD2 4.27Å; L321-F371 HydrophobicContact CD2-CE2 4.07Å; L321-F371 HydrophobicContact CG-CD2 4.5Å; L321-F371 HydrophobicContact CG-CE2 4.09Å; L325-F371 HydrophobicContact CD2-CD2 4.46Å; F326-F371 HydrophobicContact CE2-CB 4.4Å; F326-F371 AromaticContact CE2-CD1 3.62Å; F326-F371 HydrophobicContact CE2-CD1 3.62Å; F326-F371 HydrophobicContact CE2-CD2 4.36Å; F326-F371 AromaticContact CE2-CE1 3.91Å; F326-F371 HydrophobicContact CE2-CE1 3.91Å; F326-F371 AromaticContact CE2-CG 3.88Å; F326-F371 HydrophobicContact CE2-CG 3.88Å; F326-F371 HydrophobicContact CE2-CZ 4.39Å; F326-F371 HydrophobicContact CZ-CB 4.08Å; F326-F371 HydrophobicContact CZ-CD1 4.11Å; F326-F371 HydrophobicContact CZ-CG 4.06Å; F335-F371 HydrophobicContact CZ-CE1 4.38Å; L345-F371 HydrophobicContact CD2-CE1 4.26Å; S368-F371 PolarHBondContact O-N 2.82Å; C369-F371 VanDerWaalsContact C-N 3.27Å; C369-F371 PolarHBondContact O-N 2.54Å; F371-V374 PolarHBondContact O-N 3.15Å; F371-Y375 VanDerWaalsContact O-CB 3.32Å; F371-Y375 WeakPolarHBondContact O-CB 3.27Å; F371-Y375 PolarHBondContact O-N 2.69Å
372	F	97.6	Very high	96.1	Very high	1 Å²	1	70.7 Å²	70.7	0%	0.004	35%	0.35	C	S	.	.	H	α-helix	trans	-70.3	-37.7	-177.1	-62.8	-83.3	0	0	0	112.6	F326 F335 L348 V357 M358 S368 C369 V370 Y375 L376	F326-F372 HydrophobicContact CE2-CE2 4.07Å; F326-F372 HydrophobicContact CE2-CZ 4.06Å; F326-F372 HydrophobicContact CZ-CE2 4Å; F326-F372 HydrophobicContact CZ-CZ 4.44Å; F335-F372 HydrophobicContact CE2-CE1 4.04Å; F335-F372 AromaticContact CE2-CZ 3.83Å; F335-F372 HydrophobicContact CE2-CZ 3.83Å; F335-F372 AromaticContact CZ-CE1 3.98Å; F335-F372 HydrophobicContact CZ-CE1 3.98Å; F335-F372 HydrophobicContact CZ-CZ 4.11Å; L348-F372 HydrophobicContact CD2-CD1 3.63Å; L348-F372 HydrophobicContact CD2-CE1 4.19Å; V357-F372 HydrophobicContact CG1-CE1 4.23Å; V357-F372 HydrophobicContact CG2-CE1 4.4Å; M358-F372 HydrophobicContact CB-CD1 4.23Å; M358-F372 HydrophobicContact CB-CD2 3.84Å; M358-F372 HydrophobicContact CB-CE1 4.29Å; M358-F372 HydrophobicContact CB-CE2 3.91Å; M358-F372 HydrophobicContact CB-CG 4.01Å; M358-F372 HydrophobicContact CB-CZ 4.13Å; M358-F372 HydrophobicContact CG-CD2 3.44Å; M358-F372 VanDerWaalsContact CG-CD2 3.44Å; M358-F372 HydrophobicContact CG-CE2 3.71Å; M358-F372 HydrophobicContact CG-CG 3.98Å; M358-F372 HydrophobicContact CG-CZ 4.43Å; M358-F372 HydrophobicContact SD-CB 4.12Å; M358-F372 HydrophobicContact SD-CD2 3.94Å; M358-F372 HydrophobicContact SD-CG 4.2Å; S368-F372 WeakPolarHBondContact O-CD2 3.13Å; C369-F372 PolarHBondContact O-N 3.37Å; V370-F372 PolarHBondContact O-N 2.68Å; F372-Y375 PolarHBondContact O-N 3.39Å; F372-L376 WeakPolarHBondContact O-CB 3.01Å; F372-L376 WeakPolarHBondContact O-CG 3.36Å; F372-L376 PolarHBondContact O-N 3.49Å
373	I	97.4	Very high	96	Very high	99 Å²	99	66 Å²	66	51%	0.508	33%	0.332	S	S	.	.	H	α-helix	trans	-64.6	-45.2	176.5	-68.5	167.5	0	0	0	110.4	C369 V370 S377	C369-I373 HydrophobicContact CB-CD1 4.22Å; C369-I373 WeakPolarHBondContact O-CB 3.47Å; C369-I373 VanDerWaalsContact O-CG1 3.28Å; C369-I373 WeakPolarHBondContact O-CG1 3.44Å; C369-I373 PolarHBondContact O-N 3.32Å; V370-I373 PolarHBondContact O-N 3.16Å; I373-S377 VanDerWaalsContact O-CB 3.3Å; I373-S377 WeakPolarHBondContact O-CB 3.34Å; I373-S377 PolarHBondContact O-N 3.4Å; I373-S377 PolarHBondContact O-OG 3.27Å
374	V	97.6	Very high	95.8	Very high	61 Å²	61	61.4 Å²	61.4	37%	0.37	30%	0.299	S	S	.	.	H	α-helix	trans	-65	-44.6	177.5	171.1	0	0	0	0	110.6	F318 V370 F371 S377 I378	F318-V374 HydrophobicContact CE1-CG1 4.46Å; F318-V374 HydrophobicContact CZ-CG1 4.18Å; V370-V374 HydrophobicContact CG1-CG2 4.17Å; V370-V374 WeakPolarHBondContact O-CB 3.42Å; V370-V374 WeakPolarHBondContact O-CG2 3.39Å; V370-V374 PolarHBondContact O-N 3.16Å; F371-V374 PolarHBondContact O-N 3.15Å; V374-S377 PolarHBondContact O-N 3.1Å; V374-I378 HydrophobicContact CG1-CD1 3.75Å; V374-I378 WeakPolarHBondContact O-CG1 3.37Å; V374-I378 PolarHBondContact O-N 3.24Å
375	Y	97.6	Very high	95.6	Very high	0 Å²	0	58.3 Å²	58.3	0%	0	29%	0.293	C	S	.	.	H	α-helix	trans	-54.9	-55.2	175.3	175.8	-98	0	0	0	111.5	F318 L345 L348 F371 F372 S377 I378 E379	F318-Y375 HydrophobicContact CB-CD2 3.79Å; F318-Y375 HydrophobicContact CB-CE2 4.11Å; F318-Y375 HydrophobicContact CD1-CD2 4.27Å; F318-Y375 AromaticContact CD2-CD2 3.76Å; F318-Y375 HydrophobicContact CD2-CD2 3.76Å; F318-Y375 HydrophobicContact CD2-CE2 4.33Å; F318-Y375 HydrophobicContact CE2-CD2 4.4Å; F318-Y375 AromaticContact CG-CD2 3.69Å; F318-Y375 HydrophobicContact CG-CD2 3.69Å; F318-Y375 HydrophobicContact CG-CE2 4.38Å; L345-Y375 HydrophobicContact CB-CE2 4.38Å; L345-Y375 HydrophobicContact CD1-CE2 4.23Å; L345-Y375 HydrophobicContact CD2-CE1 4.38Å; L345-Y375 HydrophobicContact CD2-CE2 4.4Å; L345-Y375 PolarHBondContact O-OH 3.42Å; L348-Y375 HydrophobicContact CB-CE1 4.14Å; L348-Y375 HydrophobicContact CD2-CD1 3.53Å; L348-Y375 HydrophobicContact CD2-CE1 3.71Å; L348-Y375 HydrophobicContact CG-CD1 3.96Å; L348-Y375 HydrophobicContact CG-CE1 3.75Å; F371-Y375 VanDerWaalsContact O-CB 3.32Å; F371-Y375 WeakPolarHBondContact O-CB 3.27Å; F371-Y375 PolarHBondContact O-N 2.69Å; F372-Y375 PolarHBondContact O-N 3.39Å; Y375-S377 VanDerWaalsContact C-N 3.31Å; Y375-S377 PolarHBondContact O-N 2.87Å; Y375-I378 PolarHBondContact O-N 2.92Å; Y375-E379 HydrophobicContact CD2-CG 3.93Å; Y375-E379 HydrophobicContact CE2-CB 4.2Å; Y375-E379 HydrophobicContact CE2-CG 3.63Å; Y375-E379 VanDerWaalsContact O-CB 3.28Å; Y375-E379 WeakPolarHBondContact O-CB 3.42Å; Y375-E379 PolarHBondContact O-N 2.8Å
376	L	97.4	Very high	95.4	Very high	20 Å²	20	57.2 Å²	57.2	11%	0.105	29%	0.287	C	S	.	.	I	π-helix	trans	-64.6	-33.8	-179.8	-69.7	175.1	0	0	0	112.7	L348 T351 F354 F372 L380 Y381	L348-L376 HydrophobicContact CD1-CD1 4.4Å; L348-L376 HydrophobicContact CD1-CD2 4Å; L348-L376 HydrophobicContact CD1-CG 4.47Å; L348-L376 HydrophobicContact CG-CD2 4Å; T351-L376 HydrophobicContact CG2-CD2 4.29Å; F354-L376 HydrophobicContact CD2-CD1 4.4Å; F372-L376 WeakPolarHBondContact O-CB 3.01Å; F372-L376 WeakPolarHBondContact O-CG 3.36Å; F372-L376 PolarHBondContact O-N 3.49Å; L376-L380 HydrophobicContact CD2-CB 4.29Å; L376-L380 HydrophobicContact CD2-CD2 4.14Å; L376-L380 VanDerWaalsContact O-CB 3.3Å; L376-L380 WeakPolarHBondContact O-CB 3.37Å; L376-L380 PolarHBondContact O-N 3.44Å; L376-L380 VanDerWaalsContact O-N 3.15Å; L376-Y381 PolarHBondContact O-N 3.32Å; L376-Y381 VanDerWaalsContact O-N 3.08Å
377	S	96.8	Very high	95	Very high	58 Å²	58	54 Å²	54	41%	0.406	27%	0.266	S	S	.	.	I	π-helix	trans	-65.4	-44.6	177.9	-60	0	0	0	0	112	I373 V374 Y375 F382	I373-S377 VanDerWaalsContact O-CB 3.3Å; I373-S377 WeakPolarHBondContact O-CB 3.34Å; I373-S377 PolarHBondContact O-N 3.4Å; I373-S377 PolarHBondContact O-OG 3.27Å; V374-S377 PolarHBondContact O-N 3.1Å; Y375-S377 VanDerWaalsContact C-N 3.31Å; Y375-S377 PolarHBondContact O-N 2.87Å; S377-F382 PolarHBondContact O-N 3.39Å
378	I	95.9	Very high	94.5	Very high	60 Å²	60	46.5 Å²	46.5	31%	0.308	24%	0.241	S	C	.	.	I	π-helix	trans	-78.4	-53.3	-178.4	-64.3	173	0	0	0	110.4	F318 V374 Y375 F382 I383	F318-I378 HydrophobicContact CZ-CD1 4.34Å; V374-I378 HydrophobicContact CG1-CD1 3.75Å; V374-I378 WeakPolarHBondContact O-CG1 3.37Å; V374-I378 PolarHBondContact O-N 3.24Å; Y375-I378 PolarHBondContact O-N 2.92Å; I378-F382 WeakPolarHBondContact O-CB 3.44Å; I378-F382 PolarHBondContact O-N 3.33Å; I378-I383 HydrophobicContact CG2-CD1 4.01Å; I378-I383 WeakPolarHBondContact O-CG1 3.41Å; I378-I383 PolarHBondContact O-N 3.41Å
379	E	94.9	Very high	94.2	Very high	0 Å²	0	47.9 Å²	47.9	0%	0	25%	0.253	C	S	.	.	I	π-helix	trans	-77.2	-54.1	-170.2	-72.6	-83.7	-156	0	0	112	L311 F314 M315 L349 Y375 I383 M384	L311-E379 WeakPolarHBondContact CD1-OE2 3.36Å; L311-E379 WeakPolarHBondContact CG-OE2 3.28Å; F314-E379 WeakPolarHBondContact CB-OE1 3.48Å; M315-E379 WeakPolarHBondContact CA-OE1 3.16Å; M315-E379 PolarHBondContact N-OE1 3.36Å; L349-E379 HydrophobicContact CD1-CB 3.86Å; Y375-E379 HydrophobicContact CD2-CG 3.93Å; Y375-E379 HydrophobicContact CE2-CB 4.2Å; Y375-E379 HydrophobicContact CE2-CG 3.63Å; Y375-E379 VanDerWaalsContact O-CB 3.28Å; Y375-E379 WeakPolarHBondContact O-CB 3.42Å; Y375-E379 PolarHBondContact O-N 2.8Å; E379-I383 PolarHBondContact O-N 3.29Å; E379-M384 WeakPolarHBondContact O-CG 3.48Å; E379-M384 PolarHBondContact O-N 3.42Å
380	L	93.6	Very high	93.8	Very high	34 Å²	34	48.5 Å²	48.5	18%	0.178	26%	0.256	C	S	.	.	I	π-helix	trans	-76.3	-54.8	-176.2	171.1	68.4	0	0	0	112	T351 L376 M384	T351-L380 HydrophobicContact CG2-CD2 3.38Å; L376-L380 HydrophobicContact CD2-CB 4.29Å; L376-L380 HydrophobicContact CD2-CD2 4.14Å; L376-L380 VanDerWaalsContact O-CB 3.3Å; L376-L380 WeakPolarHBondContact O-CB 3.37Å; L376-L380 PolarHBondContact O-N 3.44Å; L376-L380 VanDerWaalsContact O-N 3.15Å; L380-M384 HydrophobicContact CD1-CG 4.48Å; L380-M384 WeakPolarHBondContact O-CB 3.44Å
381	Y	94.8	Very high	93.3	Very high	154 Å²	154	45.2 Å²	45.2	60%	0.604	24%	0.236	S	C	*	.	I	π-helix	trans	-80	-33.8	-171.5	-65.4	-46.6	0	0	0	114.1	L376 N385	L376-Y381 PolarHBondContact O-N 3.32Å; L376-Y381 VanDerWaalsContact O-N 3.08Å; Y381-N385 WeakPolarHBondContact O-CB 3.2Å; Y381-N385 PolarHBondContact O-ND2 2.72Å
382	F	94.9	Very high	92.7	Very high	133 Å²	133	47 Å²	47	58%	0.583	24%	0.244	S	C	*	.	I	π-helix	trans	-92.1	-63.3	179.8	-179.3	-103.9	0	0	0	111.6	S377 I378 L386	S377-F382 PolarHBondContact O-N 3.39Å; I378-F382 WeakPolarHBondContact O-CB 3.44Å; I378-F382 PolarHBondContact O-N 3.33Å; F382-L386 VanDerWaalsContact O-CB 3.26Å; F382-L386 WeakPolarHBondContact O-CB 3.19Å; F382-L386 PolarHBondContact O-N 3.33Å
383	I	94.1	Very high	92.3	Very high	3 Å²	3	51.5 Å²	51.5	2%	0.015	27%	0.267	C	S	.	.	I	π-helix	trans	-69.4	-48.1	-171.9	-60.1	172.7	0	0	0	112.2	I307 L311 F314 I378 E379 N385 L386 L387	I307-I383 HydrophobicContact CG2-CG2 4.25Å; L311-I383 HydrophobicContact CB-CG2 3.85Å; L311-I383 HydrophobicContact CD1-CB 4.37Å; L311-I383 HydrophobicContact CD1-CG2 3.76Å; L311-I383 HydrophobicContact CG-CG2 4.39Å; F314-I383 HydrophobicContact CB-CD1 4.41Å; F314-I383 HydrophobicContact CD2-CD1 3.56Å; F314-I383 HydrophobicContact CE2-CD1 4.09Å; F314-I383 HydrophobicContact CG-CD1 4.2Å; I378-I383 HydrophobicContact CG2-CD1 4.01Å; I378-I383 WeakPolarHBondContact O-CG1 3.41Å; I378-I383 PolarHBondContact O-N 3.41Å; E379-I383 PolarHBondContact O-N 3.29Å; I383-N385 PolarHBondContact O-N 2.92Å; I383-L386 PolarHBondContact O-N 3.39Å; I383-L387 WeakPolarHBondContact O-CB 3.3Å; I383-L387 PolarHBondContact O-N 3.44Å
384	M	90.9	Very high	91.8	Very high	10 Å²	10	48.3 Å²	48.3	5%	0.049	25%	0.253	C	S	.	.	I	π-helix	trans	-62.8	-40.9	179.6	-62.2	-61.8	-68.3	0	0	112.2	L311 L349 E379 L380 L387 L388 M748	L311-M384 HydrophobicContact CD1-CG 4.04Å; L311-M384 HydrophobicContact CD1-SD 3.11Å; L311-M384 WeakPolarHBondContact CD1-SD 3.47Å; L311-M384 HydrophobicContact CG-SD 4.4Å; L349-M384 HydrophobicContact CD1-CG 3.7Å; L349-M384 HydrophobicContact CD1-SD 3.86Å; L349-M384 HydrophobicContact CD2-SD 3.88Å; L349-M384 HydrophobicContact CG-CG 4.31Å; L349-M384 HydrophobicContact CG-SD 4.06Å; E379-M384 WeakPolarHBondContact O-CG 3.48Å; E379-M384 PolarHBondContact O-N 3.42Å; L380-M384 HydrophobicContact CD1-CG 4.48Å; L380-M384 WeakPolarHBondContact O-CB 3.44Å; M384-L387 HydrophobicContact CE-CD2 4.34Å; M384-L387 WeakPolarHBondContact O-CB 3.32Å; M384-L387 PolarHBondContact O-N 2.95Å; M384-L387 HydrophobicContact SD-CD2 4.41Å; M384-L388 VanDerWaalsContact O-CG 3.27Å; M384-L388 WeakPolarHBondContact O-CG 3.34Å; M384-L388 PolarHBondContact O-N 2.97Å; M384-L388 VanDerWaalsContact O-N 3.07Å; M384-M748 HydrophobicContact CE-CE 3.22Å; M384-M748 HydrophobicContact CE-SD 3.14Å; M384-M748 WeakPolarHBondContact CE-SD 3.4Å
385	N	90.1	Very high	91.3	Very high	85 Å²	85	45.5 Å²	45.5	46%	0.455	24%	0.236	S	C	.	.	H	α-helix	trans	-71.1	-33.2	178.6	-70.3	-37.4	0	0	0	112.5	Y381 I383 L388 A389	Y381-N385 WeakPolarHBondContact O-CB 3.2Å; Y381-N385 PolarHBondContact O-ND2 2.72Å; I383-N385 PolarHBondContact O-N 2.92Å; N385-L388 PolarHBondContact O-N 2.79Å; N385-A389 PolarHBondContact O-N 3.1Å
386	L	90.3	Very high	90.8	Very high	71 Å²	71	46.5 Å²	46.5	37%	0.372	24%	0.241	S	C	.	.	H	α-helix	trans	-63.1	-45.1	171.3	177.6	63.7	0	0	0	111.3	F382 I383 L388 A389 V390	F382-L386 VanDerWaalsContact O-CB 3.26Å; F382-L386 WeakPolarHBondContact O-CB 3.19Å; F382-L386 PolarHBondContact O-N 3.33Å; I383-L386 PolarHBondContact O-N 3.39Å; L386-L388 VanDerWaalsContact C-N 3.27Å; L386-L388 PolarHBondContact O-N 3.02Å; L386-A389 PolarHBondContact O-N 3.4Å; L386-V390 HydrophobicContact CD1-CG2 4.26Å; L386-V390 WeakPolarHBondContact O-CG2 3.49Å; L386-V390 PolarHBondContact O-N 3.48Å
387	L	87.4	Confident	90.4	Very high	5 Å²	5	49.7 Å²	49.7	3%	0.026	26%	0.258	C	S	.	.	H	α-helix	trans	-54.2	-46.1	174.8	-178.2	70.9	0	0	0	111	F304 I307 I383 M384 V391	F304-L387 HydrophobicContact CD2-CD1 3.39Å; F304-L387 HydrophobicContact CD2-CD2 4.22Å; F304-L387 HydrophobicContact CD2-CG 3.83Å; F304-L387 HydrophobicContact CE2-CD1 3.65Å; F304-L387 HydrophobicContact CE2-CD2 3.65Å; F304-L387 HydrophobicContact CE2-CG 3.79Å; F304-L387 HydrophobicContact CG-CD1 4.23Å; I307-L387 HydrophobicContact CB-CD1 3.52Å; I307-L387 HydrophobicContact CD1-CD1 4.45Å; I307-L387 HydrophobicContact CG2-CB 3.87Å; I307-L387 HydrophobicContact CG2-CD1 3.61Å; I307-L387 HydrophobicContact CG2-CG 4.37Å; I383-L387 WeakPolarHBondContact O-CB 3.3Å; I383-L387 PolarHBondContact O-N 3.44Å; M384-L387 HydrophobicContact CE-CD2 4.34Å; M384-L387 WeakPolarHBondContact O-CB 3.32Å; M384-L387 PolarHBondContact O-N 2.95Å; M384-L387 HydrophobicContact SD-CD2 4.41Å; L387-V391 VanDerWaalsContact O-CG2 3.28Å; L387-V391 WeakPolarHBondContact O-CG2 3.27Å; L387-V391 PolarHBondContact O-N 3.17Å; L387-V391 VanDerWaalsContact O-N 3.13Å
388	L	85.7	Confident	90.1	Very high	47 Å²	47	47.9 Å²	47.9	25%	0.246	24%	0.244	C	C	.	.	H	α-helix	trans	-63	-43.1	177.7	-68.8	178.4	0	0	0	112.9	M384 N385 L386 F392 M748 T752	M384-L388 VanDerWaalsContact O-CG 3.27Å; M384-L388 WeakPolarHBondContact O-CG 3.34Å; M384-L388 PolarHBondContact O-N 2.97Å; M384-L388 VanDerWaalsContact O-N 3.07Å; N385-L388 PolarHBondContact O-N 2.79Å; L386-L388 VanDerWaalsContact C-N 3.27Å; L386-L388 PolarHBondContact O-N 3.02Å; L388-F392 WeakPolarHBondContact O-CB 3.15Å; L388-F392 PolarHBondContact O-N 3.4Å; L388-M748 HydrophobicContact CD1-CE 4.02Å; L388-M748 HydrophobicContact CD2-CE 3.54Å; L388-M748 HydrophobicContact CG-CE 3.86Å; L388-T752 HydrophobicContact CD1-CG2 4.25Å; L388-T752 VanDerWaalsContact CD2-CB 3.44Å; L388-T752 HydrophobicContact CD2-CG2 3.2Å; L388-T752 WeakPolarHBondContact CD2-OG1 3.28Å; L388-T752 HydrophobicContact CG-CG2 4.34Å
389	A	89	Confident	89.7	Confident	44 Å²	44	46.5 Å²	46.5	36%	0.364	24%	0.236	S	C	.	.	H	α-helix	trans	-63.3	-47.1	179.1	0	0	0	0	0	111.9	N385 L386 V391 F392 D393	N385-A389 PolarHBondContact O-N 3.1Å; L386-A389 PolarHBondContact O-N 3.4Å; A389-V391 PolarHBondContact O-N 3.21Å; A389-F392 WeakPolarHBondContact O-CB 3.33Å; A389-F392 PolarHBondContact O-N 3.33Å; A389-D393 PolarHBondContact O-N 3.36Å
390	V	89.4	Confident	89.5	Confident	41 Å²	41	49 Å²	49	25%	0.248	25%	0.247	C	C	.	.	H	α-helix	trans	-64.5	-40.8	-179.4	173.2	0	0	0	0	111.8	P303 I307 L386 F392 T394	P303-V390 HydrophobicContact CB-CG1 3.94Å; I307-V390 HydrophobicContact CD1-CB 3.6Å; I307-V390 HydrophobicContact CD1-CG1 3.78Å; I307-V390 HydrophobicContact CD1-CG2 3.6Å; L386-V390 HydrophobicContact CD1-CG2 4.26Å; L386-V390 WeakPolarHBondContact O-CG2 3.49Å; L386-V390 PolarHBondContact O-N 3.48Å; V390-F392 VanDerWaalsContact C-N 3.31Å; V390-F392 PolarHBondContact O-N 3.34Å; V390-T394 HydrophobicContact CG1-CG2 4.34Å; V390-T394 WeakPolarHBondContact O-CB 3.27Å; V390-T394 WeakPolarHBondContact O-CG2 3.47Å; V390-T394 PolarHBondContact O-N 3.31Å; V390-T394 VanDerWaalsContact O-N 3.1Å; V390-T394 PolarHBondContact O-OG1 3.4Å
391	V	86.6	Confident	89.4	Confident	4 Å²	4	54.4 Å²	54.4	2%	0.024	27%	0.265	C	S	.	.	H	α-helix	trans	-61.6	-41.9	174.8	170.1	0	0	0	0	111.3	F304 L387 A389 T394 F395 V749 I753	F304-V391 HydrophobicContact CB-CG2 3.81Å; F304-V391 HydrophobicContact CD2-CG2 3.69Å; F304-V391 HydrophobicContact CG-CG2 4.2Å; L387-V391 VanDerWaalsContact O-CG2 3.28Å; L387-V391 WeakPolarHBondContact O-CG2 3.27Å; L387-V391 PolarHBondContact O-N 3.17Å; L387-V391 VanDerWaalsContact O-N 3.13Å; A389-V391 PolarHBondContact O-N 3.21Å; V391-T394 PolarHBondContact O-OG1 2.99Å; V391-F395 WeakPolarHBondContact O-CB 3.41Å; V391-F395 PolarHBondContact O-N 3.15Å; V391-V749 HydrophobicContact CG1-CG1 4.41Å; V391-I753 HydrophobicContact CG1-CD1 3.61Å; V391-I753 HydrophobicContact CG1-CG1 3.49Å; V391-I753 VanDerWaalsContact CG1-CG1 3.49Å
392	F	84.4	Confident	89.1	Confident	58 Å²	58	50 Å²	50	25%	0.254	25%	0.249	S	C	.	.	H	α-helix	trans	-65.3	-50.2	180	173	-109.3	0	0	0	112.4	L388 A389 V390 T394 F395 N396 A756 E760	L388-F392 WeakPolarHBondContact O-CB 3.15Å; L388-F392 PolarHBondContact O-N 3.4Å; A389-F392 WeakPolarHBondContact O-CB 3.33Å; A389-F392 PolarHBondContact O-N 3.33Å; V390-F392 VanDerWaalsContact C-N 3.31Å; V390-F392 PolarHBondContact O-N 3.34Å; F392-T394 PolarHBondContact O-N 2.85Å; F392-F395 PolarHBondContact O-N 3.24Å; F392-N396 WeakPolarHBondContact CE1-ND2 3.5Å; F392-N396 VanDerWaalsContact CE2-ND2 3.28Å; F392-N396 WeakPolarHBondContact CE2-ND2 3.41Å; F392-N396 WeakPolarHBondContact CZ-ND2 3.13Å; F392-N396 PolarHBondContact O-N 2.97Å; F392-A756 HydrophobicContact CD2-CB 3.31Å; F392-A756 HydrophobicContact CE2-CB 3.55Å; F392-A756 HydrophobicContact CG-CB 4.2Å; F392-E760 WeakPolarHBondContact CZ-OE2 3.2Å
393	D	88.4	Confident	88.9	Confident	94 Å²	94	44.8 Å²	44.8	50%	0.503	23%	0.226	S	C	.	.	H	α-helix	trans	-62.2	-44.9	-178.3	-71.5	-19.3	0	0	0	111.1	A389 F395 N396 D397	A389-D393 PolarHBondContact O-N 3.36Å; D393-F395 VanDerWaalsContact C-N 3.35Å; D393-F395 PolarHBondContact O-N 3.07Å; D393-N396 PolarHBondContact O-N 3.34Å; D393-D397 PolarHBondContact O-N 3.26Å
394	T	88.7	Confident	88.9	Confident	32 Å²	32	47 Å²	47	20%	0.196	24%	0.235	C	C	.	.	H	α-helix	trans	-64.4	-38.8	177.6	56.3	0	0	0	0	112.3	P303 V390 V391 F392 D397 I398	P303-T394 HydrophobicContact CB-CG2 4.28Å; P303-T394 HydrophobicContact CG-CG2 3.99Å; V390-T394 HydrophobicContact CG1-CG2 4.34Å; V390-T394 WeakPolarHBondContact O-CB 3.27Å; V390-T394 WeakPolarHBondContact O-CG2 3.47Å; V390-T394 PolarHBondContact O-N 3.31Å; V390-T394 VanDerWaalsContact O-N 3.1Å; V390-T394 PolarHBondContact O-OG1 3.4Å; V391-T394 PolarHBondContact O-OG1 2.99Å; F392-T394 PolarHBondContact O-N 2.85Å; T394-D397 PolarHBondContact O-N 2.88Å; T394-I398 WeakPolarHBondContact O-CD1 3.42Å; T394-I398 WeakPolarHBondContact O-CG1 3.45Å; T394-I398 PolarHBondContact O-N 3.31Å; T394-I398 VanDerWaalsContact O-N 3.11Å
395	F	86.6	Confident	89	Confident	3 Å²	3	48.9 Å²	48.9	1%	0.013	25%	0.249	C	C	.	.	H	α-helix	trans	-62.8	-44.6	175.2	-179.5	-88.4	0	0	0	111.7	Q296 I297 V391 F392 D393 I398 E399 I753 F757	Q296-F395 HydrophobicContact CB-CD2 4.06Å; Q296-F395 HydrophobicContact CB-CE2 3.53Å; Q296-F395 HydrophobicContact CB-CZ 4.28Å; I297-F395 HydrophobicContact CG1-CE2 4.28Å; V391-F395 WeakPolarHBondContact O-CB 3.41Å; V391-F395 PolarHBondContact O-N 3.15Å; F392-F395 PolarHBondContact O-N 3.24Å; D393-F395 VanDerWaalsContact C-N 3.35Å; D393-F395 PolarHBondContact O-N 3.07Å; F395-I398 PolarHBondContact O-N 3.36Å; F395-E399 PolarHBondContact O-N 3.42Å; F395-I753 HydrophobicContact CD1-CG2 4.16Å; F395-I753 HydrophobicContact CD2-CD1 4.42Å; F395-I753 HydrophobicContact CD2-CG2 3.59Å; F395-I753 HydrophobicContact CE1-CG2 4.11Å; F395-I753 HydrophobicContact CE2-CG2 3.51Å; F395-I753 HydrophobicContact CG-CG2 3.92Å; F395-I753 HydrophobicContact CZ-CG2 3.8Å; F395-F757 AromaticContact CE1-CD2 3.78Å; F395-F757 HydrophobicContact CE1-CD2 3.78Å; F395-F757 HydrophobicContact CE1-CE2 4.19Å; F395-F757 HydrophobicContact CZ-CD2 4.44Å
396	N	86.6	Confident	89.1	Confident	20 Å²	20	46.4 Å²	46.4	11%	0.107	24%	0.236	C	C	.	.	H	α-helix	trans	-63.3	-41.6	178.8	-83.9	-4.2	0	0	0	112.4	F392 D393 I398 E399 K400 E760	F392-N396 WeakPolarHBondContact CE1-ND2 3.5Å; F392-N396 VanDerWaalsContact CE2-ND2 3.28Å; F392-N396 WeakPolarHBondContact CE2-ND2 3.41Å; F392-N396 WeakPolarHBondContact CZ-ND2 3.13Å; F392-N396 PolarHBondContact O-N 2.97Å; D393-N396 PolarHBondContact O-N 3.34Å; N396-I398 VanDerWaalsContact C-N 3.31Å; N396-I398 PolarHBondContact O-N 2.99Å; N396-E399 PolarHBondContact O-N 3.34Å; N396-E399 VanDerWaalsContact O-N 3.17Å; N396-K400 WeakPolarHBondContact O-CB 3.27Å; N396-K400 PolarHBondContact O-N 2.99Å; N396-E760 PolarHBondContact ND2-OE2 2.71Å; N396-E760 PolarHBondContact OD1-OE2 2.95Å
397	D	90.1	Very high	89.2	Confident	87 Å²	87	44.3 Å²	44.3	47%	0.465	23%	0.225	S	C	.	.	H	α-helix	trans	-62.5	-37.9	174.4	-78.1	-20.4	0	0	0	112.6	D393 T394 R401	D393-D397 PolarHBondContact O-N 3.26Å; T394-D397 PolarHBondContact O-N 2.88Å; D397-R401 WeakPolarHBondContact O-CB 3.49Å; D397-R401 WeakPolarHBondContact O-CG 3.39Å; D397-R401 PolarHBondContact O-N 3.37Å; D397-R401 PolarHBondContact O-NE 3.17Å
398	I	90.3	Very high	89.5	Confident	20 Å²	20	45 Å²	45	10%	0.103	23%	0.229	C	C	.	.	H	α-helix	trans	-67.3	-41.7	174.4	-65	162.5	0	0	0	110.2	Q296 Q299 T394 F395 N396 K402	Q296-I398 HydrophobicContact CB-CG2 4.27Å; Q296-I398 HydrophobicContact CG-CG2 3.85Å; Q299-I398 HydrophobicContact CB-CD1 3.83Å; T394-I398 WeakPolarHBondContact O-CD1 3.42Å; T394-I398 WeakPolarHBondContact O-CG1 3.45Å; T394-I398 PolarHBondContact O-N 3.31Å; T394-I398 VanDerWaalsContact O-N 3.11Å; F395-I398 PolarHBondContact O-N 3.36Å; N396-I398 VanDerWaalsContact C-N 3.31Å; N396-I398 PolarHBondContact O-N 2.99Å; I398-K402 VanDerWaalsContact O-CB 3.3Å; I398-K402 WeakPolarHBondContact O-CB 3.31Å; I398-K402 PolarHBondContact O-N 3.37Å
399	E	86.4	Confident	89.9	Confident	32 Å²	32	44 Å²	44	15%	0.15	22%	0.223	C	C	.	.	H	α-helix	trans	-63.2	-46.8	176.5	-172.8	174.8	-165.4	0	0	111.9	F395 N396 K402 F403 R638 F757	F395-E399 PolarHBondContact O-N 3.42Å; N396-E399 PolarHBondContact O-N 3.34Å; N396-E399 VanDerWaalsContact O-N 3.17Å; E399-K402 PolarHBondContact O-N 3.43Å; E399-K402 VanDerWaalsContact O-N 3.16Å; E399-F403 WeakPolarHBondContact O-CB 3.25Å; E399-F403 PolarHBondContact O-N 3.22Å; E399-R638 IonicContact OE1-CZ 3.27Å; E399-R638 IonicContact OE1-NH2 3.85Å; E399-R638 PolarHBondContact OE1-NH2 3.08Å; E399-R638 IonicContact OE2-NH2 2.68Å; E399-F757 VanDerWaalsContact OE1-CE2 3.31Å; E399-F757 WeakPolarHBondContact OE1-CE2 3.31Å; E399-F757 WeakPolarHBondContact OE2-CD2 3.43Å; E399-F757 WeakPolarHBondContact OE2-CE2 3.11Å
400	K	90.3	Very high	90.2	Very high	51 Å²	51	44 Å²	44	22%	0.222	22%	0.215	C	C	.	.	H	α-helix	trans	-56.8	-52.2	176.9	-179.3	179.1	-179.9	178.3	0	111.6	N396 K402 F403 K404 Y845 E848 W852	N396-K400 WeakPolarHBondContact O-CB 3.27Å; N396-K400 PolarHBondContact O-N 2.99Å; K400-K402 VanDerWaalsContact C-N 3.28Å; K400-K402 PolarHBondContact O-N 3.06Å; K400-F403 PolarHBondContact O-N 3.03Å; K400-K404 PolarHBondContact O-N 3.34Å; K400-Y845 HydrophobicContact CB-CE1 4.1Å; K400-Y845 HydrophobicContact CD-CD1 4.28Å; K400-Y845 HydrophobicContact CD-CE1 3.89Å; K400-Y845 HydrophobicContact CG-CD1 4.14Å; K400-Y845 HydrophobicContact CG-CE1 3.74Å; K400-E848 WeakPolarHBondContact CE-OE2 3.49Å; K400-E848 IonicContact NZ-OE1 2.7Å; K400-E848 PolarHBondContact NZ-OE1 3.26Å; K400-E848 IonicContact NZ-OE2 3.32Å; K400-E848 PolarHBondContact NZ-OE2 2.67Å; K400-W852 HydrophobicContact CG-CH2 4.38Å; K400-W852 HydrophobicContact CG-CZ2 4.22Å
401	R	91.4	Very high	90.4	Very high	149 Å²	149	44.3 Å²	44.3	56%	0.562	21%	0.211	S	C	*	.	H	α-helix	trans	-59.6	-39.5	176	-75.7	-177	-71.6	-161.9	-1.3	111.8	D397 K404 S405	D397-R401 WeakPolarHBondContact O-CB 3.49Å; D397-R401 WeakPolarHBondContact O-CG 3.39Å; D397-R401 PolarHBondContact O-N 3.37Å; D397-R401 PolarHBondContact O-NE 3.17Å; R401-K404 PolarHBondContact O-N 3.03Å; R401-S405 PolarHBondContact O-N 2.96Å
402	K	90	Very high	90.8	Very high	61 Å²	61	44.9 Å²	44.9	27%	0.265	22%	0.215	S	C	.	.	H	α-helix	trans	-67.4	-39.5	178.2	-171.3	54.9	177.3	174.6	0	112.1	I398 E399 K400 S405 L406	I398-K402 VanDerWaalsContact O-CB 3.3Å; I398-K402 WeakPolarHBondContact O-CB 3.31Å; I398-K402 PolarHBondContact O-N 3.37Å; E399-K402 PolarHBondContact O-N 3.43Å; E399-K402 VanDerWaalsContact O-N 3.16Å; K400-K402 VanDerWaalsContact C-N 3.28Å; K400-K402 PolarHBondContact O-N 3.06Å; K402-S405 PolarHBondContact O-N 3.26Å; K402-L406 HydrophobicContact CG-CD1 4.41Å; K402-L406 VanDerWaalsContact O-CG 3.3Å; K402-L406 WeakPolarHBondContact O-CG 2.8Å; K402-L406 PolarHBondContact O-N 3.12Å
403	F	91.1	Very high	91.4	Very high	24 Å²	24	42.1 Å²	42.1	11%	0.105	20%	0.203	C	C	.	.	H	α-helix	trans	-63.6	-46.4	175.1	178.8	-107	0	0	0	111.5	E399 K400 S405 L406 L407 S841 L842 Y845 W852	E399-F403 WeakPolarHBondContact O-CB 3.25Å; E399-F403 PolarHBondContact O-N 3.22Å; K400-F403 PolarHBondContact O-N 3.03Å; F403-S405 PolarHBondContact O-N 2.89Å; F403-L406 PolarHBondContact O-N 3.5Å; F403-L406 VanDerWaalsContact O-N 3.17Å; F403-L407 HydrophobicContact CE1-CD2 4.48Å; F403-L407 WeakPolarHBondContact O-CB 3.43Å; F403-L407 PolarHBondContact O-N 3.26Å; F403-S841 VanDerWaalsContact CZ-CB 3.44Å; F403-L842 HydrophobicContact CE1-CD2 4.4Å; F403-L842 HydrophobicContact CZ-CD2 3.9Å; F403-L842 HydrophobicContact CZ-CG 3.97Å; F403-Y845 AromaticContact CD1-CD2 3.68Å; F403-Y845 HydrophobicContact CD1-CD2 3.68Å; F403-Y845 HydrophobicContact CD1-CE2 4.16Å; F403-Y845 AromaticContact CE1-CD2 4Å; F403-Y845 HydrophobicContact CE1-CD2 4Å; F403-W852 HydrophobicContact CD1-CH2 4.32Å; F403-W852 AromaticContact CD1-CZ3 3.98Å; F403-W852 HydrophobicContact CD1-CZ3 3.98Å; F403-W852 HydrophobicContact CE1-CZ3 4.2Å
404	K	93.9	Very high	91.7	Very high	49 Å²	49	37.9 Å²	37.9	21%	0.213	18%	0.18	C	C	.	.	H	α-helix	trans	-51.4	-53.3	171.9	178	-179.7	179.8	180	0	111	K400 R401 L406 L407 L408 W852 E855	K400-K404 PolarHBondContact O-N 3.34Å; R401-K404 PolarHBondContact O-N 3.03Å; K404-L406 VanDerWaalsContact C-N 3.34Å; K404-L406 PolarHBondContact O-N 3.22Å; K404-L407 PolarHBondContact O-N 2.92Å; K404-L408 HydrophobicContact CG-CD1 3.92Å; K404-L408 HydrophobicContact CG-CG 4.44Å; K404-L408 VanDerWaalsContact O-CG 3.31Å; K404-L408 WeakPolarHBondContact O-CG 3.5Å; K404-L408 PolarHBondContact O-N 3.29Å; K404-W852 HydrophobicContact CB-CD2 4.09Å; K404-W852 HydrophobicContact CB-CE3 3.88Å; K404-W852 HydrophobicContact CB-CH2 4.33Å; K404-W852 HydrophobicContact CB-CZ3 4.01Å; K404-W852 HydrophobicContact CD-CB 4.35Å; K404-W852 HydrophobicContact CD-CD2 3.87Å; K404-W852 HydrophobicContact CD-CE3 4.5Å; K404-W852 HydrophobicContact CD-CG 3.77Å; K404-W852 HydrophobicContact CG-CB 4.26Å; K404-W852 HydrophobicContact CG-CD2 3.74Å; K404-W852 HydrophobicContact CG-CE3 3.87Å; K404-W852 HydrophobicContact CG-CG 3.92Å; K404-E855 IonicContact NZ-OE1 2.68Å; K404-E855 IonicContact NZ-OE2 2.75Å; K404-E855 PolarHBondContact NZ-OE2 3.2Å
405	S	92.3	Very high	92	Very high	49 Å²	49	37.2 Å²	37.2	34%	0.343	18%	0.175	S	C	.	.	H	α-helix	trans	-57.1	-42.6	178.4	174.3	0	0	0	0	113.2	R401 K402 F403 H409	R401-S405 PolarHBondContact O-N 2.96Å; K402-S405 PolarHBondContact O-N 3.26Å; F403-S405 PolarHBondContact O-N 2.89Å; S405-H409 WeakPolarHBondContact O-CB 3.36Å; S405-H409 PolarHBondContact O-N 2.92Å
406	L	91.6	Very high	92.3	Very high	34 Å²	34	40 Å²	40	18%	0.178	19%	0.188	C	C	.	.	H	α-helix	trans	-66.6	-40.4	177.9	-71.3	170.1	0	0	0	112.4	N156 K402 F403 K404 K410	N156-L406 HydrophobicContact CB-CD2 3.69Å; N156-L406 VanDerWaalsContact CG-CD2 3.49Å; N156-L406 WeakPolarHBondContact OD1-CD2 3.47Å; K402-L406 HydrophobicContact CG-CD1 4.41Å; K402-L406 VanDerWaalsContact O-CG 3.3Å; K402-L406 WeakPolarHBondContact O-CG 2.8Å; K402-L406 PolarHBondContact O-N 3.12Å; F403-L406 PolarHBondContact O-N 3.5Å; F403-L406 VanDerWaalsContact O-N 3.17Å; K404-L406 VanDerWaalsContact C-N 3.34Å; K404-L406 PolarHBondContact O-N 3.22Å; L406-K410 WeakPolarHBondContact O-CG 3.43Å; L406-K410 PolarHBondContact O-N 3.49Å; L406-K410 VanDerWaalsContact O-N 3.1Å
407	L	93.2	Very high	92.7	Very high	26 Å²	26	39.1 Å²	39.1	14%	0.136	18%	0.183	C	C	.	.	H	α-helix	trans	-65.8	-45	179.3	-174.2	64.5	0	0	0	111.1	F403 K404 K410 R411 L842 I849 W852 Y853	F403-L407 HydrophobicContact CE1-CD2 4.48Å; F403-L407 WeakPolarHBondContact O-CB 3.43Å; F403-L407 PolarHBondContact O-N 3.26Å; K404-L407 PolarHBondContact O-N 2.92Å; L407-K410 PolarHBondContact O-N 3.05Å; L407-R411 PolarHBondContact O-N 3.35Å; L407-L842 HydrophobicContact CD1-CD2 3.92Å; L407-L842 HydrophobicContact CD2-CD2 4.05Å; L407-I849 HydrophobicContact CD2-CG1 4.27Å; L407-I849 HydrophobicContact CD2-CG2 4.1Å; L407-W852 HydrophobicContact CD2-CE3 4.41Å; L407-Y853 HydrophobicContact CD2-CE1 3.95Å; L407-Y853 WeakPolarHBondContact CD2-OH 3.3Å; L407-Y853 HydrophobicContact CG-CE1 4.07Å
408	L	94.5	Very high	92.9	Very high	21 Å²	21	36.7 Å²	36.7	11%	0.11	17%	0.167	C	C	.	.	H	α-helix	trans	-65.4	-41.1	177.6	-64.5	178.6	0	0	0	111.7	K404 K410 R411 T412 Y853 H856	K404-L408 HydrophobicContact CG-CD1 3.92Å; K404-L408 HydrophobicContact CG-CG 4.44Å; K404-L408 VanDerWaalsContact O-CG 3.31Å; K404-L408 WeakPolarHBondContact O-CG 3.5Å; K404-L408 PolarHBondContact O-N 3.29Å; L408-K410 PolarHBondContact O-N 3.38Å; L408-R411 WeakPolarHBondContact O-CA 3.48Å; L408-R411 WeakPolarHBondContact O-CB 3.22Å; L408-R411 PolarHBondContact O-N 3.17Å; L408-R411 VanDerWaalsContact O-N 3.08Å; L408-T412 PolarHBondContact O-N 3.09Å; L408-T412 PolarHBondContact O-OG1 3.45Å; L408-Y853 HydrophobicContact CD2-CD1 3.92Å; L408-Y853 HydrophobicContact CD2-CE1 4.32Å; L408-H856 HydrophobicContact CD1-CB 4.03Å; L408-H856 HydrophobicContact CD2-CB 3.66Å; L408-H856 HydrophobicContact CG-CB 4.41Å
409	H	94.1	Very high	93	Very high	24 Å²	24	41.7 Å²	41.7	11%	0.111	19%	0.185	C	C	.	.	H	α-helix	trans	-62.2	-39.2	176	-172.2	76.3	0	0	0	113	D157 F159 S405 T412 A413	D157-H409 PolarHBondContact O-CE1 3.21Å; D157-H409 PolarHBondContact O-NE2 3.31Å; F159-H409 AromaticContact CD2-CE1 3.79Å; F159-H409 AromaticContact CE2-CE1 3.16Å; F159-H409 WeakPolarHBondContact CE2-CE1 3.47Å; F159-H409 AromaticContact CE2-ND1 3.46Å; F159-H409 WeakPolarHBondContact CE2-ND1 3.46Å; F159-H409 AromaticContact CE2-NE2 3.89Å; F159-H409 AromaticContact CZ-CE1 3.28Å; F159-H409 WeakPolarHBondContact CZ-CE1 3Å; F159-H409 AromaticContact CZ-ND1 3.82Å; F159-H409 AromaticContact CZ-NE2 3.52Å; S405-H409 WeakPolarHBondContact O-CB 3.36Å; S405-H409 PolarHBondContact O-N 2.92Å; H409-T412 WeakPolarHBondContact CA-OG1 3.28Å; H409-T412 PolarHBondContact O-N 3.13Å; H409-T412 PolarHBondContact O-OG1 2.74Å; H409-A413 PolarHBondContact O-N 2.79Å
410	K	94	Very high	93.2	Very high	45 Å²	45	42.2 Å²	42.2	20%	0.196	19%	0.189	C	C	.	.	H	α-helix	trans	-62.9	-43.2	170.9	-76.3	-170.7	-178.2	-151.8	0	111.3	G153 E154 L406 L407 L408 T412 A413 I414 Y475	G153-K410 WeakPolarHBondContact O-CG 3.37Å; E154-K410 IonicContact OE1-NZ 3.28Å; E154-K410 PolarHBondContact OE1-NZ 2.85Å; E154-K410 WeakPolarHBondContact OE2-CE 3.28Å; E154-K410 IonicContact OE2-NZ 2.81Å; E154-K410 PolarHBondContact OE2-NZ 3.17Å; L406-K410 WeakPolarHBondContact O-CG 3.43Å; L406-K410 PolarHBondContact O-N 3.49Å; L406-K410 VanDerWaalsContact O-N 3.1Å; L407-K410 PolarHBondContact O-N 3.05Å; L408-K410 PolarHBondContact O-N 3.38Å; K410-T412 PolarHBondContact O-N 3.2Å; K410-A413 WeakPolarHBondContact O-CB 3.49Å; K410-A413 PolarHBondContact O-N 3.23Å; K410-I414 WeakPolarHBondContact O-CG1 3.24Å; K410-I414 PolarHBondContact O-N 3.46Å; K410-I414 VanDerWaalsContact O-N 3.09Å; K410-Y475 HydrophobicContact CB-CD2 4.3Å; K410-Y475 HydrophobicContact CB-CE2 3.76Å; K410-Y475 HydrophobicContact CD-CD2 4.12Å; K410-Y475 HydrophobicContact CD-CE2 4.12Å; K410-Y475 HydrophobicContact CG-CD2 4.5Å; K410-Y475 HydrophobicContact CG-CE2 4.02Å
411	R	94.8	Very high	93.1	Very high	47 Å²	47	39.8 Å²	39.8	18%	0.177	18%	0.178	C	C	.	.	H	α-helix	trans	-62.1	-40.7	178.9	-167.4	177.3	-177.6	85.5	-5.8	112.1	L407 L408 I414 Q415 Y472	L407-R411 PolarHBondContact O-N 3.35Å; L408-R411 WeakPolarHBondContact O-CA 3.48Å; L408-R411 WeakPolarHBondContact O-CB 3.22Å; L408-R411 PolarHBondContact O-N 3.17Å; L408-R411 VanDerWaalsContact O-N 3.08Å; R411-I414 PolarHBondContact O-N 3.21Å; R411-Q415 WeakPolarHBondContact O-CG 3.46Å; R411-Q415 PolarHBondContact O-N 2.68Å; R411-Y472 HydrophobicContact CG-CD1 4Å; R411-Y472 HydrophobicContact CG-CE1 3.63Å; R411-Y472 VanDerWaalsContact CZ-CE2 3.43Å; R411-Y472 VanDerWaalsContact CZ-CZ 3.44Å
412	T	94.4	Very high	93	Very high	17 Å²	17	34.2 Å²	34.2	10%	0.104	16%	0.161	C	C	.	.	H	α-helix	trans	-63.8	-42.1	175	46.7	0	0	0	0	112.3	F159 L408 H409 K410 I414 Q415 H416 H856	F159-T412 VanDerWaalsContact CE2-OG1 3.26Å; F159-T412 WeakPolarHBondContact CE2-OG1 3.48Å; L408-T412 PolarHBondContact O-N 3.09Å; L408-T412 PolarHBondContact O-OG1 3.45Å; H409-T412 WeakPolarHBondContact CA-OG1 3.28Å; H409-T412 PolarHBondContact O-N 3.13Å; H409-T412 PolarHBondContact O-OG1 2.74Å; K410-T412 PolarHBondContact O-N 3.2Å; T412-I414 VanDerWaalsContact C-N 3.32Å; T412-I414 PolarHBondContact O-N 3.44Å; T412-Q415 WeakPolarHBondContact O-CB 3.16Å; T412-Q415 PolarHBondContact O-N 3.1Å; T412-Q415 VanDerWaalsContact O-N 3.17Å; T412-H416 PolarHBondContact O-CD2 2.8Å; T412-H416 PolarHBondContact O-N 2.69Å; T412-H856 VanDerWaalsContact CG2-CE1 3.41Å; T412-H856 WeakPolarHBondContact CG2-CE1 3.47Å; T412-H856 WeakPolarHBondContact CG2-NE2 3.28Å
413	A	95.6	Very high	92.4	Very high	0 Å²	0	32.5 Å²	32.5	0%	0	16%	0.156	C	C	.	.	H	α-helix	trans	-58.4	-44.5	175.4	0	0	0	0	0	112	Y149 F159 H409 K410 Q415 H416 A417	Y149-A413 VanDerWaalsContact O-CB 3.3Å; Y149-A413 WeakPolarHBondContact O-CB 3.24Å; F159-A413 HydrophobicContact CE1-CB 3.92Å; F159-A413 HydrophobicContact CZ-CB 3.77Å; H409-A413 PolarHBondContact O-N 2.79Å; K410-A413 WeakPolarHBondContact O-CB 3.49Å; K410-A413 PolarHBondContact O-N 3.23Å; A413-Q415 VanDerWaalsContact C-N 3.33Å; A413-Q415 PolarHBondContact O-N 3.41Å; A413-H416 PolarHBondContact O-N 2.79Å; A413-A417 PolarHBondContact O-N 2.83Å
414	I	96	Very high	91.4	Very high	5 Å²	5	41 Å²	41	3%	0.026	20%	0.196	C	C	.	.	H	α-helix	trans	-60.5	-44	176.4	-64.6	169.4	0	0	0	110.8	K410 R411 T412 H416 A417 Y418 F471 Y472 I474 Y475	K410-I414 WeakPolarHBondContact O-CG1 3.24Å; K410-I414 PolarHBondContact O-N 3.46Å; K410-I414 VanDerWaalsContact O-N 3.09Å; R411-I414 PolarHBondContact O-N 3.21Å; T412-I414 VanDerWaalsContact C-N 3.32Å; T412-I414 PolarHBondContact O-N 3.44Å; I414-H416 PolarHBondContact O-N 3.22Å; I414-A417 PolarHBondContact O-N 3.47Å; I414-Y418 VanDerWaalsContact O-CB 3.27Å; I414-Y418 WeakPolarHBondContact O-CB 3.34Å; I414-Y418 PolarHBondContact O-N 3.39Å; I414-F471 HydrophobicContact CG2-CD1 3.37Å; I414-F471 HydrophobicContact CG2-CE1 3.81Å; I414-F471 HydrophobicContact CG2-CG 4.31Å; I414-F471 WeakPolarHBondContact CG2-O 3.33Å; I414-Y472 HydrophobicContact CB-CD1 4.36Å; I414-Y472 HydrophobicContact CD1-CD1 4.36Å; I414-Y472 VanDerWaalsContact CD1-O 3.28Å; I414-Y472 WeakPolarHBondContact CD1-O 3.48Å; I414-Y472 HydrophobicContact CG2-CD1 3.86Å; I414-Y472 HydrophobicContact CG2-CE1 4.29Å; I414-I474 HydrophobicContact CD1-CG2 3.94Å; I414-I474 HydrophobicContact CG1-CG2 3.89Å; I414-Y475 HydrophobicContact CD1-CD2 3.79Å; I414-Y475 HydrophobicContact CD1-CE2 3.66Å; I414-Y475 HydrophobicContact CG1-CD2 4.24Å; I414-Y475 HydrophobicContact CG1-CE2 3.67Å
415	Q	94.8	Very high	90.2	Very high	17 Å²	17	48.6 Å²	48.6	8%	0.079	22%	0.224	C	C	.	.	H	α-helix	trans	-62.8	-40.2	177.7	-69.6	172.2	-8.5	0	0	112.3	R411 T412 A413 R419 L468 Y472 Q860	R411-Q415 WeakPolarHBondContact O-CG 3.46Å; R411-Q415 PolarHBondContact O-N 2.68Å; T412-Q415 WeakPolarHBondContact O-CB 3.16Å; T412-Q415 PolarHBondContact O-N 3.1Å; T412-Q415 VanDerWaalsContact O-N 3.17Å; A413-Q415 VanDerWaalsContact C-N 3.33Å; A413-Q415 PolarHBondContact O-N 3.41Å; Q415-R419 VanDerWaalsContact O-CG 3.32Å; Q415-R419 WeakPolarHBondContact O-CG 3.46Å; Q415-R419 PolarHBondContact O-N 3.47Å; Q415-L468 HydrophobicContact CG-CD1 4.44Å; Q415-Y472 HydrophobicContact CG-CE1 4.05Å; Q415-Y472 PolarHBondContact NE2-OH 3.49Å; Q415-Q860 VanDerWaalsContact OE1-OE1 3.13Å
416	H	93.8	Very high	89.1	Confident	63 Å²	63	58.1 Å²	58.1	29%	0.292	25%	0.252	S	S	.	.	H	α-helix	trans	-64.1	-48.5	175.7	-78.6	-71.7	0	0	0	111.7	Y149 T412 A413 I414 Y418 R419 L420	Y149-H416 HydrophobicContact CD1-CB 3.83Å; Y149-H416 HydrophobicContact CD2-CB 4.33Å; Y149-H416 HydrophobicContact CE1-CB 4.03Å; Y149-H416 HydrophobicContact CG-CB 4Å; T412-H416 PolarHBondContact O-CD2 2.8Å; T412-H416 PolarHBondContact O-N 2.69Å; A413-H416 PolarHBondContact O-N 2.79Å; I414-H416 PolarHBondContact O-N 3.22Å; H416-Y418 VanDerWaalsContact C-N 3.35Å; H416-Y418 PolarHBondContact O-N 2.94Å; H416-R419 PolarHBondContact O-N 3Å; H416-L420 PolarHBondContact O-N 3.44Å
417	A	94.8	Very high	88.1	Confident	0 Å²	0	61.2 Å²	61.2	0%	0	27%	0.274	C	S	.	.	H	α-helix	trans	-62.4	-40.5	176.6	0	0	0	0	0	112.5	A146 L150 A413 I414 R419 L420 L421 F471	A146-A417 HydrophobicContact CB-CB 4.15Å; L150-A417 HydrophobicContact CD1-CB 3.16Å; A413-A417 PolarHBondContact O-N 2.83Å; I414-A417 PolarHBondContact O-N 3.47Å; A417-R419 PolarHBondContact O-N 3.26Å; A417-L420 PolarHBondContact O-N 3.19Å; A417-L421 VanDerWaalsContact O-CG 3.27Å; A417-L421 WeakPolarHBondContact O-CG 3.31Å; A417-L421 PolarHBondContact O-N 3.22Å; A417-L421 VanDerWaalsContact O-N 3.1Å; A417-F471 HydrophobicContact CB-CE1 4.36Å
418	Y	94.4	Very high	87.4	Confident	36 Å²	36	63.5 Å²	63.5	14%	0.141	30%	0.297	C	S	.	.	H	α-helix	trans	-60	-46.3	176.2	-176.1	-96.1	0	0	0	111.3	I414 H416 L420 L421 V422 I430 L468 F471	I414-Y418 VanDerWaalsContact O-CB 3.27Å; I414-Y418 WeakPolarHBondContact O-CB 3.34Å; I414-Y418 PolarHBondContact O-N 3.39Å; H416-Y418 VanDerWaalsContact C-N 3.35Å; H416-Y418 PolarHBondContact O-N 2.94Å; Y418-L420 PolarHBondContact O-N 3.44Å; Y418-L421 PolarHBondContact O-N 3.06Å; Y418-V422 HydrophobicContact CD1-CG2 3.55Å; Y418-V422 HydrophobicContact CD2-CG2 4.1Å; Y418-V422 HydrophobicContact CE1-CG2 3.23Å; Y418-V422 HydrophobicContact CE2-CG2 3.79Å; Y418-V422 HydrophobicContact CG-CG2 3.97Å; Y418-V422 WeakPolarHBondContact O-CB 3.19Å; Y418-V422 WeakPolarHBondContact O-CG2 3.46Å; Y418-V422 PolarHBondContact O-N 3.36Å; Y418-I430 HydrophobicContact CD2-CD1 3.49Å; Y418-I430 VanDerWaalsContact CD2-CD1 3.49Å; Y418-I430 HydrophobicContact CD2-CG1 3.95Å; Y418-I430 HydrophobicContact CE2-CD1 3.92Å; Y418-I430 HydrophobicContact CE2-CG1 3.92Å; Y418-I430 HydrophobicContact CG-CD1 4.41Å; Y418-L468 HydrophobicContact CD1-CB 4.2Å; Y418-L468 HydrophobicContact CD1-CD1 3.83Å; Y418-L468 HydrophobicContact CD1-CG 4.45Å; Y418-L468 HydrophobicContact CD2-CB 4.38Å; Y418-L468 HydrophobicContact CD2-CD1 4.06Å; Y418-L468 HydrophobicContact CE1-CB 3.89Å; Y418-L468 HydrophobicContact CE1-CD1 4.4Å; Y418-L468 HydrophobicContact CE2-CB 4.12Å; Y418-L468 HydrophobicContact CG-CB 4.44Å; Y418-L468 HydrophobicContact CG-CD1 3.64Å; Y418-L468 PolarHBondContact OH-N 3.06Å; Y418-F471 HydrophobicContact CD2-CB 4.09Å; Y418-F471 AromaticContact CD2-CD1 3.9Å; Y418-F471 HydrophobicContact CD2-CD1 3.9Å; Y418-F471 HydrophobicContact CD2-CG 4.12Å; Y418-F471 HydrophobicContact CG-CD1 4.4Å
419	R	91.6	Very high	87.1	Confident	125 Å²	125	62.5 Å²	62.5	47%	0.472	29%	0.291	S	S	.	.	H	α-helix	trans	-60	-33.1	178	-73.2	176.9	-160.4	152.4	15.6	113	Q415 H416 A417	Q415-R419 VanDerWaalsContact O-CG 3.32Å; Q415-R419 WeakPolarHBondContact O-CG 3.46Å; Q415-R419 PolarHBondContact O-N 3.47Å; H416-R419 PolarHBondContact O-N 3Å; A417-R419 PolarHBondContact O-N 3.26Å
420	L	90.5	Very high	86.9	Confident	44 Å²	44	61.3 Å²	61.3	23%	0.23	29%	0.286	C	S	.	.	H	α-helix	trans	-77.7	-29.8	179.8	-164.7	63.7	0	0	0	113	N142 E145 A146 H416 A417 Y418	N142-L420 HydrophobicContact CB-CD1 4.46Å; N142-L420 HydrophobicContact CB-CD2 4.33Å; N142-L420 HydrophobicContact CB-CG 4.07Å; N142-L420 VanDerWaalsContact O-CD2 3.26Å; N142-L420 WeakPolarHBondContact O-CD2 3.48Å; E145-L420 HydrophobicContact CB-CD2 3.69Å; E145-L420 HydrophobicContact CG-CD2 3.87Å; A146-L420 HydrophobicContact CB-CD2 4.12Å; H416-L420 PolarHBondContact O-N 3.44Å; A417-L420 PolarHBondContact O-N 3.19Å; Y418-L420 PolarHBondContact O-N 3.44Å
421	L	89.4	Confident	86.8	Confident	0 Å²	0	60.8 Å²	60.8	0%	0	29%	0.288	C	S	.	.	H	α-helix	trans	-95.3	-18.5	-174.9	-64.9	172	0	0	0	114.4	Y143 A146 A417 Y418 S423 I430 Q434 L438 F471	Y143-L421 HydrophobicContact CD1-CD2 3.63Å; Y143-L421 HydrophobicContact CE1-CD2 4.02Å; A146-L421 HydrophobicContact CB-CD1 3.94Å; A146-L421 HydrophobicContact CB-CD2 3.95Å; A146-L421 HydrophobicContact CB-CG 3.87Å; A417-L421 VanDerWaalsContact O-CG 3.27Å; A417-L421 WeakPolarHBondContact O-CG 3.31Å; A417-L421 PolarHBondContact O-N 3.22Å; A417-L421 VanDerWaalsContact O-N 3.1Å; Y418-L421 PolarHBondContact O-N 3.06Å; L421-S423 PolarHBondContact O-N 3.01Å; L421-I430 HydrophobicContact CB-CD1 4.02Å; L421-I430 HydrophobicContact CB-CG1 4.09Å; L421-I430 HydrophobicContact CB-CG2 4.49Å; L421-I430 HydrophobicContact CD1-CD1 4.31Å; L421-Q434 HydrophobicContact CD2-CB 4.49Å; L421-L438 HydrophobicContact CD1-CB 4.11Å; L421-L438 HydrophobicContact CD1-CD1 4.24Å; L421-L438 HydrophobicContact CD1-CD2 3.76Å; L421-L438 HydrophobicContact CD1-CG 4.25Å; L421-F471 HydrophobicContact CD1-CZ 4.34Å
422	V	89.1	Confident	86.6	Confident	32 Å²	32	59.7 Å²	59.7	19%	0.194	28%	0.284	C	S	.	.	S	Bend	trans	-63.8	131.9	-177.9	161.9	0	0	0	0	111.4	Y418 Q424 A428 I430	Y418-V422 HydrophobicContact CD1-CG2 3.55Å; Y418-V422 HydrophobicContact CD2-CG2 4.1Å; Y418-V422 HydrophobicContact CE1-CG2 3.23Å; Y418-V422 HydrophobicContact CE2-CG2 3.79Å; Y418-V422 HydrophobicContact CG-CG2 3.97Å; Y418-V422 WeakPolarHBondContact O-CB 3.19Å; Y418-V422 WeakPolarHBondContact O-CG2 3.46Å; Y418-V422 PolarHBondContact O-N 3.36Å; V422-Q424 PolarHBondContact O-N 3.37Å; V422-A428 HydrophobicContact CG1-CB 4.47Å; V422-I430 HydrophobicContact CG2-CG1 4.28Å
423	S	75.9	Confident	86.3	Confident	25 Å²	25	67.7 Å²	67.7	18%	0.175	31%	0.312	C	S	.	.			trans	-64.1	125.8	166.4	161.4	0	0	0	0	110.1	L421 R425 G429	L421-S423 PolarHBondContact O-N 3.01Å; S423-R425 PolarHBondContact O-N 3.29Å; S423-R425 WeakPolarHBondContact OG-CB 3.39Å; S423-R425 PolarHBondContact OG-N 2.97Å; S423-R425 PolarHBondContact OG-O 3.19Å; S423-G429 PolarHBondContact N-O 3.45Å
424	Q	70.6	Confident	86.1	Confident	203 Å²	203	68.7 Å²	68.7	95%	0.949	32%	0.317	S	S	*	.	S	Bend	trans	-67.7	-10.3	170.9	-66.5	-176.4	0.9	0	0	113.1	V422	V422-Q424 PolarHBondContact O-N 3.37Å
425	R	69.7	Low	86	Confident	208 Å²	208	68.4 Å²	68.4	79%	0.785	32%	0.316	S	S	*	.	S	Bend	trans	-80.3	140.8	175.3	-55.6	-179	177.7	-175.9	-1.8	109.9	S423 P427	S423-R425 PolarHBondContact O-N 3.29Å; S423-R425 WeakPolarHBondContact OG-CB 3.39Å; S423-R425 PolarHBondContact OG-N 2.97Å; S423-R425 PolarHBondContact OG-O 3.19Å; R425-P427 CarbonylContact O-C 3.58Å; R425-P427 VanDerWaalsContact O-C 3.24Å
426	R	67.4	Low	85.9	Confident	248 Å²	248	68.5 Å²	68.5	94%	0.936	32%	0.316	S	S	*	.	S	Bend	trans	-71.4	132.8	169.3	-68.5	-173.8	178.8	156.2	0.3	109.4
427	P	71.6	Confident	85.7	Confident	99 Å²	99	65.5 Å²	65.5	64%	0.643	30%	0.302	S	S	*	.	S	Bend	cis	-78.1	142.7	3.5	5.6	9.5	0	0	0	113	R425 G429 L465	R425-P427 CarbonylContact O-C 3.58Å; R425-P427 VanDerWaalsContact O-C 3.24Å; P427-G429 PolarHBondContact O-N 3.4Å; P427-L465 HydrophobicContact CB-CD1 3.65Å; P427-L465 HydrophobicContact CG-CD1 3.63Å; P427-L465 WeakPolarHBondContact O-CD1 3.48Å
428	A	79.6	Confident	85.7	Confident	74 Å²	74	65.5 Å²	65.5	61%	0.612	30%	0.302	S	S	*	.	P	Polyproline II helix	trans	-75.3	119.3	179.5	0	0	0	0	0	110.5	V422	V422-A428 HydrophobicContact CG1-CB 4.47Å
429	G	86.4	Confident	85.7	Confident	0 Å²	0	63.8 Å²	63.8	0%	0	30%	0.296	C	S	.	.	S	Bend	trans	175.9	177.4	176.9	0	0	0	0	0	111.5	S423 P427 L466	S423-G429 PolarHBondContact N-O 3.45Å; P427-G429 PolarHBondContact O-N 3.4Å; G429-L466 WeakPolarHBondContact CA-O 3.4Å
430	I	91.2	Very high	85.6	Confident	0 Å²	0	62.9 Å²	62.9	0%	0	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.6	120.8	177.3	-57.9	175	0	0	0	108.4	Y418 L421 V422 Q434 F435 L465 L466 F471	Y418-I430 HydrophobicContact CD2-CD1 3.49Å; Y418-I430 VanDerWaalsContact CD2-CD1 3.49Å; Y418-I430 HydrophobicContact CD2-CG1 3.95Å; Y418-I430 HydrophobicContact CE2-CD1 3.92Å; Y418-I430 HydrophobicContact CE2-CG1 3.92Å; Y418-I430 HydrophobicContact CG-CD1 4.41Å; L421-I430 HydrophobicContact CB-CD1 4.02Å; L421-I430 HydrophobicContact CB-CG1 4.09Å; L421-I430 HydrophobicContact CB-CG2 4.49Å; L421-I430 HydrophobicContact CD1-CD1 4.31Å; V422-I430 HydrophobicContact CG2-CG1 4.28Å; I430-Q434 HydrophobicContact CG2-CB 3.92Å; I430-F435 HydrophobicContact CG2-CB 4.14Å; I430-L465 WeakPolarHBondContact O-CA 3.32Å; I430-L466 HydrophobicContact CB-CB 4.27Å; I430-L466 PolarHBondContact N-O 3.38Å; I430-L466 VanDerWaalsContact N-O 3.15Å; I430-L466 PolarHBondContact O-N 3.44Å; I430-F471 HydrophobicContact CD1-CD1 4.27Å; I430-F471 HydrophobicContact CD1-CD2 3.86Å; I430-F471 HydrophobicContact CD1-CE1 4.27Å; I430-F471 HydrophobicContact CD1-CE2 3.81Å; I430-F471 HydrophobicContact CD1-CG 4.09Å; I430-F471 HydrophobicContact CD1-CZ 4.04Å
431	S	90.8	Very high	85.7	Confident	33 Å²	33	63.8 Å²	63.8	23%	0.231	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.3	160.6	171.9	80.7	0	0	0	0	111.2	R433 Q434 F435	S431-R433 PolarHBondContact O-N 3.3Å; S431-R433 VanDerWaalsContact O-N 3.14Å; S431-R433 PolarHBondContact OG-N 3.25Å; S431-Q434 PolarHBondContact O-N 2.97Å; S431-Q434 PolarHBondContact OG-OE1 3.25Å; S431-F435 PolarHBondContact O-N 2.86Å; S431-F435 VanDerWaalsContact O-N 3.08Å
432	Y	90.8	Very high	85.8	Confident	25 Å²	25	65 Å²	65	10%	0.098	30%	0.299	C	S	.	.	H	α-helix	trans	-54	-35.2	176.4	178.9	-114.9	0	0	0	112.7	Q434 F435 E436 Y452 F455 V795 L798	Y432-Q434 PolarHBondContact O-N 3.02Å; Y432-F435 PolarHBondContact O-N 2.95Å; Y432-E436 WeakPolarHBondContact O-CB 3.45Å; Y432-E436 PolarHBondContact O-N 3.35Å; Y432-Y452 HydrophobicContact CD2-CD2 4.12Å; Y432-Y452 HydrophobicContact CE1-CD2 4.37Å; Y432-Y452 AromaticContact CE2-CD2 3.7Å; Y432-Y452 HydrophobicContact CE2-CD2 3.7Å; Y432-Y452 HydrophobicContact CE2-CG 4.45Å; Y432-Y452 AromaticContact CZ-CD2 3.82Å; Y432-F455 HydrophobicContact CD2-CB 3.96Å; Y432-F455 AromaticContact CD2-CD1 4Å; Y432-F455 HydrophobicContact CD2-CD1 4Å; Y432-F455 HydrophobicContact CD2-CD2 4.05Å; Y432-F455 AromaticContact CD2-CG 3.73Å; Y432-F455 HydrophobicContact CD2-CG 3.73Å; Y432-F455 HydrophobicContact CE2-CB 4.22Å; Y432-F455 HydrophobicContact CE2-CG 4.47Å; Y432-V795 HydrophobicContact CE1-CG1 4.16Å; Y432-V795 HydrophobicContact CE1-CG2 4.33Å; Y432-L798 HydrophobicContact CD1-CD1 4.05Å; Y432-L798 HydrophobicContact CE1-CD1 4.44Å
433	R	89.4	Confident	85.9	Confident	184 Å²	184	68 Å²	68	69%	0.694	31%	0.31	S	S	*	.	H	α-helix	trans	-62.6	-41.9	177.8	-175.2	176.2	178.4	168	0.9	112.7	S431 G437	S431-R433 PolarHBondContact O-N 3.3Å; S431-R433 VanDerWaalsContact O-N 3.14Å; S431-R433 PolarHBondContact OG-N 3.25Å; R433-G437 PolarHBondContact O-N 3.38Å
434	Q	91.3	Very high	86.5	Confident	21 Å²	21	71.7 Å²	71.7	10%	0.098	33%	0.333	C	S	.	.	H	α-helix	trans	-72.2	-38.6	177	-71.4	110.7	-1.6	0	0	111.8	W139 Y143 L421 I430 S431 Y432 E436 G437 L438	W139-Q434 HydrophobicContact CE3-CG 4.34Å; W139-Q434 HydrophobicContact CH2-CG 4.39Å; W139-Q434 HydrophobicContact CZ3-CG 3.9Å; Y143-Q434 HydrophobicContact CE1-CB 4.04Å; Y143-Q434 HydrophobicContact CE1-CG 4.11Å; L421-Q434 HydrophobicContact CD2-CB 4.49Å; I430-Q434 HydrophobicContact CG2-CB 3.92Å; S431-Q434 PolarHBondContact O-N 2.97Å; S431-Q434 PolarHBondContact OG-OE1 3.25Å; Y432-Q434 PolarHBondContact O-N 3.02Å; Q434-E436 VanDerWaalsContact C-N 3.32Å; Q434-E436 PolarHBondContact O-N 3.42Å; Q434-G437 PolarHBondContact O-N 3.25Å; Q434-L438 PolarHBondContact O-N 3.22Å
435	F	93.3	Very high	87.3	Confident	0 Å²	0	73.7 Å²	73.7	0%	0	33%	0.332	C	S	.	.	H	α-helix	trans	-63.2	-40.3	175.6	-177.7	-94.1	0	0	0	112.1	I430 S431 Y432 L438 M439 R451 F455 L458 L466 I474	I430-F435 HydrophobicContact CG2-CB 4.14Å; S431-F435 PolarHBondContact O-N 2.86Å; S431-F435 VanDerWaalsContact O-N 3.08Å; Y432-F435 PolarHBondContact O-N 2.95Å; F435-L438 PolarHBondContact O-N 3.49Å; F435-M439 HydrophobicContact CD1-CG 4.06Å; F435-M439 HydrophobicContact CD2-CE 4.32Å; F435-M439 HydrophobicContact CE1-CE 4.19Å; F435-M439 HydrophobicContact CE1-CG 3.68Å; F435-M439 HydrophobicContact CE2-CE 3.48Å; F435-M439 VanDerWaalsContact CE2-CE 3.48Å; F435-M439 HydrophobicContact CE2-CG 4.44Å; F435-M439 HydrophobicContact CZ-CE 3.42Å; F435-M439 VanDerWaalsContact CZ-CE 3.42Å; F435-M439 HydrophobicContact CZ-CG 3.92Å; F435-M439 HydrophobicContact CZ-SD 4.34Å; F435-M439 WeakPolarHBondContact O-CG 3.3Å; F435-M439 PolarHBondContact O-N 3.45Å; F435-R451 WeakPolarHBondContact CE1-O 3.29Å; F435-F455 HydrophobicContact CB-CD2 3.87Å; F435-F455 HydrophobicContact CB-CE2 4.29Å; F435-F455 HydrophobicContact CD1-CB 3.8Å; F435-F455 AromaticContact CD1-CD2 3.85Å; F435-F455 HydrophobicContact CD1-CD2 3.85Å; F435-F455 HydrophobicContact CD1-CG 4.29Å; F435-F455 HydrophobicContact CD2-CD2 4.26Å; F435-F455 HydrophobicContact CE1-CB 3.72Å; F435-F455 HydrophobicContact CE1-CD2 4.44Å; F435-F455 HydrophobicContact CG-CB 4.49Å; F435-F455 AromaticContact CG-CD2 3.74Å; F435-F455 HydrophobicContact CG-CD2 3.74Å; F435-F455 HydrophobicContact CZ-CB 4.34Å; F435-L458 HydrophobicContact CE2-CD1 4.46Å; F435-L458 HydrophobicContact CE2-CD2 4.3Å; F435-L458 HydrophobicContact CZ-CD1 4.37Å; F435-L466 HydrophobicContact CD2-CD1 3.93Å; F435-L466 HydrophobicContact CE2-CD1 4.29Å; F435-I474 HydrophobicContact CE2-CD1 4.43Å
436	E	91.8	Very high	88.3	Confident	18 Å²	18	65 Å²	65	8%	0.084	30%	0.3	C	S	.	.	H	α-helix	trans	-61.4	-44.4	176.1	-169.2	-85.2	164.7	0	0	111.3	Y432 Q434 M439 R440 R451 Y799	Y432-E436 WeakPolarHBondContact O-CB 3.45Å; Y432-E436 PolarHBondContact O-N 3.35Å; Q434-E436 VanDerWaalsContact C-N 3.32Å; Q434-E436 PolarHBondContact O-N 3.42Å; E436-M439 PolarHBondContact O-N 3.14Å; E436-R440 VanDerWaalsContact CD-NH2 3.28Å; E436-R440 WeakPolarHBondContact O-CG 3.48Å; E436-R440 PolarHBondContact O-N 3.46Å; E436-R440 VanDerWaalsContact O-N 3.16Å; E436-R440 IonicContact OE1-CZ 3.12Å; E436-R440 IonicContact OE1-NE 3.81Å; E436-R440 PolarHBondContact OE1-NE 3.15Å; E436-R440 IonicContact OE1-NH2 3.31Å; E436-R440 PolarHBondContact OE1-NH2 3.44Å; E436-R440 IonicContact OE2-CZ 3.54Å; E436-R440 VanDerWaalsContact OE2-CZ 3.3Å; E436-R440 IonicContact OE2-NE 2.91Å; E436-R440 PolarHBondContact OE2-NE 2.96Å; E436-R440 VanDerWaalsContact OE2-NE 3.15Å; E436-R440 IonicContact OE2-NH2 3.37Å; E436-R440 PolarHBondContact OE2-NH2 3.36Å; E436-R440 VanDerWaalsContact OE2-NH2 3.16Å; E436-R451 IonicContact OE1-CZ 2.68Å; E436-R451 IonicContact OE1-NH1 3.72Å; E436-R451 PolarHBondContact OE1-NH1 3.39Å; E436-Y799 WeakPolarHBondContact CG-OH 3.21Å; E436-Y799 PolarHBondContact OE1-OH 3.47Å
437	G	91	Very high	89.3	Confident	1 Å²	1	53.3 Å²	53.3	1%	0.01	26%	0.256	C	S	.	.	H	α-helix	trans	-59.4	-47.3	172.9	0	0	0	0	0	113.3	R433 Q434 M439 R440 F441	R433-G437 PolarHBondContact O-N 3.38Å; Q434-G437 PolarHBondContact O-N 3.25Å; G437-M439 VanDerWaalsContact C-N 3.34Å; G437-M439 PolarHBondContact O-N 3.49Å; G437-R440 PolarHBondContact O-N 3.24Å; G437-F441 WeakPolarHBondContact O-CD2 3.46Å
438	L	94.1	Very high	90.2	Very high	0 Å²	0	48.6 Å²	48.6	0%	0	23%	0.226	C	C	.	.	H	α-helix	trans	-56.6	-47.7	174.8	172.9	68.4	0	0	0	111.5	A146 A147 L150 L421 Q434 F435 R440 F441 Y442 F471 I474	A146-L438 HydrophobicContact CB-CD1 3.81Å; A147-L438 HydrophobicContact CB-CD1 4.06Å; L150-L438 HydrophobicContact CD2-CD2 4.33Å; L421-L438 HydrophobicContact CD1-CB 4.11Å; L421-L438 HydrophobicContact CD1-CD1 4.24Å; L421-L438 HydrophobicContact CD1-CD2 3.76Å; L421-L438 HydrophobicContact CD1-CG 4.25Å; Q434-L438 PolarHBondContact O-N 3.22Å; F435-L438 PolarHBondContact O-N 3.49Å; L438-R440 VanDerWaalsContact C-N 3.29Å; L438-R440 PolarHBondContact O-N 3.44Å; L438-F441 PolarHBondContact O-N 3.49Å; L438-F441 VanDerWaalsContact O-N 3.17Å; L438-Y442 WeakPolarHBondContact O-CB 3.36Å; L438-Y442 PolarHBondContact O-N 3.03Å; L438-F471 HydrophobicContact CD2-CE2 4.21Å; L438-F471 HydrophobicContact CD2-CZ 3.94Å; L438-I474 HydrophobicContact CD2-CD1 3.9Å
439	M	93.6	Very high	90.7	Very high	0 Å²	0	47.6 Å²	47.6	0%	0	21%	0.207	C	C	.	.	H	α-helix	trans	-68.7	-26.8	-174.3	-71.9	-62.6	158.6	0	0	113.2	F435 E436 G437 F441 Y442 K443 R451 I474 A478	F435-M439 HydrophobicContact CD1-CG 4.06Å; F435-M439 HydrophobicContact CD2-CE 4.32Å; F435-M439 HydrophobicContact CE1-CE 4.19Å; F435-M439 HydrophobicContact CE1-CG 3.68Å; F435-M439 HydrophobicContact CE2-CE 3.48Å; F435-M439 VanDerWaalsContact CE2-CE 3.48Å; F435-M439 HydrophobicContact CE2-CG 4.44Å; F435-M439 HydrophobicContact CZ-CE 3.42Å; F435-M439 VanDerWaalsContact CZ-CE 3.42Å; F435-M439 HydrophobicContact CZ-CG 3.92Å; F435-M439 HydrophobicContact CZ-SD 4.34Å; F435-M439 WeakPolarHBondContact O-CG 3.3Å; F435-M439 PolarHBondContact O-N 3.45Å; E436-M439 PolarHBondContact O-N 3.14Å; G437-M439 VanDerWaalsContact C-N 3.34Å; G437-M439 PolarHBondContact O-N 3.49Å; M439-F441 VanDerWaalsContact C-N 3.25Å; M439-F441 PolarHBondContact O-N 2.98Å; M439-Y442 HydrophobicContact CE-CD1 4.44Å; M439-Y442 HydrophobicContact SD-CD1 4.17Å; M439-K443 CarbonylContact O-C 3.45Å; M439-K443 WeakPolarHBondContact O-CA 3.49Å; M439-K443 PolarHBondContact O-N 3.14Å; M439-R451 HydrophobicContact CB-CG 3.91Å; M439-I474 HydrophobicContact CE-CD1 3.64Å; M439-I474 HydrophobicContact CE-CG1 4.08Å; M439-A478 HydrophobicContact CE-CB 4.36Å
440	R	90.5	Very high	91	Very high	106 Å²	106	49.9 Å²	49.9	40%	0.4	22%	0.217	S	C	.	.	H	α-helix	trans	-59.2	-36.2	172.2	-72.7	176.9	-176	-171.3	4.8	112.3	E436 G437 L438 P444	E436-R440 VanDerWaalsContact CD-NH2 3.28Å; E436-R440 WeakPolarHBondContact O-CG 3.48Å; E436-R440 PolarHBondContact O-N 3.46Å; E436-R440 VanDerWaalsContact O-N 3.16Å; E436-R440 IonicContact OE1-CZ 3.12Å; E436-R440 IonicContact OE1-NE 3.81Å; E436-R440 PolarHBondContact OE1-NE 3.15Å; E436-R440 IonicContact OE1-NH2 3.31Å; E436-R440 PolarHBondContact OE1-NH2 3.44Å; E436-R440 IonicContact OE2-CZ 3.54Å; E436-R440 VanDerWaalsContact OE2-CZ 3.3Å; E436-R440 IonicContact OE2-NE 2.91Å; E436-R440 PolarHBondContact OE2-NE 2.96Å; E436-R440 VanDerWaalsContact OE2-NE 3.15Å; E436-R440 IonicContact OE2-NH2 3.37Å; E436-R440 PolarHBondContact OE2-NH2 3.36Å; E436-R440 VanDerWaalsContact OE2-NH2 3.16Å; G437-R440 PolarHBondContact O-N 3.24Å; L438-R440 VanDerWaalsContact C-N 3.29Å; L438-R440 PolarHBondContact O-N 3.44Å; R440-P444 WeakPolarHBondContact O-CA 3.34Å; R440-P444 VanDerWaalsContact O-CB 3.28Å; R440-P444 WeakPolarHBondContact O-CB 3.45Å
441	F	91.4	Very high	91	Very high	62 Å²	62	50.2 Å²	50.2	27%	0.272	22%	0.218	S	C	.	.	H	α-helix	trans	-95.9	-38.8	-179	-66	-68.2	0	0	0	113.1	E140 Q144 A147 G437 L438 M439	E140-F441 HydrophobicContact CG-CE2 3.95Å; E140-F441 HydrophobicContact CG-CZ 3.71Å; Q144-F441 HydrophobicContact CB-CD2 4.41Å; Q144-F441 HydrophobicContact CB-CG 4.44Å; A147-F441 HydrophobicContact CB-CB 3.64Å; G437-F441 WeakPolarHBondContact O-CD2 3.46Å; L438-F441 PolarHBondContact O-N 3.49Å; L438-F441 VanDerWaalsContact O-N 3.17Å; M439-F441 VanDerWaalsContact C-N 3.25Å; M439-F441 PolarHBondContact O-N 2.98Å
442	Y	92.6	Very high	91.1	Very high	25 Å²	25	50.2 Å²	50.2	10%	0.098	21%	0.214	C	C	.	.	H	α-helix	trans	-70.9	-39.8	179.8	-177.4	-113.8	0	0	0	112.6	L150 Q151 L438 M439 Y475 A478	L150-Y442 HydrophobicContact CB-CD2 3.7Å; L150-Y442 HydrophobicContact CB-CE2 3.55Å; L150-Y442 HydrophobicContact CD2-CD1 4.19Å; L150-Y442 HydrophobicContact CD2-CD2 4.08Å; L150-Y442 HydrophobicContact CD2-CE1 4.17Å; L150-Y442 HydrophobicContact CD2-CE2 4.08Å; L150-Y442 HydrophobicContact CD2-CG 4.16Å; L150-Y442 HydrophobicContact CG-CE2 4.41Å; Q151-Y442 HydrophobicContact CG-CD2 4.05Å; Q151-Y442 HydrophobicContact CG-CE2 4.12Å; L438-Y442 WeakPolarHBondContact O-CB 3.36Å; L438-Y442 PolarHBondContact O-N 3.03Å; M439-Y442 HydrophobicContact CE-CD1 4.44Å; M439-Y442 HydrophobicContact SD-CD1 4.17Å; Y442-Y475 WeakPolarHBondContact OH-CD1 3.27Å; Y442-A478 HydrophobicContact CE1-CB 4.28Å
443	K	91.1	Very high	91.2	Very high	97 Å²	97	49 Å²	49	42%	0.422	21%	0.209	S	C	.	.	S	Bend	trans	-139.3	72.4	179.6	-70.1	-70.1	-177.5	177.2	0	111.1	M439 R445 M446	M439-K443 CarbonylContact O-C 3.45Å; M439-K443 WeakPolarHBondContact O-CA 3.49Å; M439-K443 PolarHBondContact O-N 3.14Å; K443-R445 VanDerWaalsContact C-N 3.25Å; K443-R445 PolarHBondContact O-N 3.31Å; K443-R445 VanDerWaalsContact O-N 3.09Å; K443-M446 HydrophobicContact CB-CB 4.3Å; K443-M446 VanDerWaalsContact O-CB 3.23Å; K443-M446 WeakPolarHBondContact O-CB 3.48Å; K443-M446 PolarHBondContact O-N 3.43Å; K443-M446 VanDerWaalsContact O-N 3.09Å
444	P	88	Confident	91.4	Very high	101 Å²	101	40.3 Å²	40.3	66%	0.656	18%	0.176	S	C	*	.	T	Hydrogen-bonded Turn	trans	-61.8	-26.2	-170.6	22.1	-34	0	0	0	115.1	R440 M446	R440-P444 WeakPolarHBondContact O-CA 3.34Å; R440-P444 VanDerWaalsContact O-CB 3.28Å; R440-P444 WeakPolarHBondContact O-CB 3.45Å; P444-M446 PolarHBondContact O-N 2.72Å
445	R	88	Confident	91.5	Very high	246 Å²	246	39.9 Å²	39.9	93%	0.928	17%	0.174	S	C	*	.	T	Hydrogen-bonded Turn	trans	-80.9	0.9	-179.2	-67.2	-175.7	174.9	174.9	-1.5	113.9	K443	K443-R445 VanDerWaalsContact C-N 3.25Å; K443-R445 PolarHBondContact O-N 3.31Å; K443-R445 VanDerWaalsContact O-N 3.09Å
446	M	89.4	Confident	91.5	Very high	24 Å²	24	41.2 Å²	41.2	12%	0.118	18%	0.18	C	C	.	.			trans	-82.4	130	-176.2	-165.2	173.8	-157.6	0	0	111.8	K443 P444 E450 R451 T454	K443-M446 HydrophobicContact CB-CB 4.3Å; K443-M446 VanDerWaalsContact O-CB 3.23Å; K443-M446 WeakPolarHBondContact O-CB 3.48Å; K443-M446 PolarHBondContact O-N 3.43Å; K443-M446 VanDerWaalsContact O-N 3.09Å; P444-M446 PolarHBondContact O-N 2.72Å; M446-E450 HydrophobicContact CE-CB 3.68Å; M446-E450 WeakPolarHBondContact CE-O 3.15Å; M446-E450 HydrophobicContact CG-CB 3.63Å; M446-E450 HydrophobicContact SD-CB 4.44Å; M446-R451 HydrophobicContact CB-CG 4.07Å; M446-R451 HydrophobicContact CG-CG 3.77Å; M446-R451 PolarHBondContact O-NE 2.68Å; M446-R451 HydrophobicContact SD-CG 3.75Å; M446-T454 HydrophobicContact CE-CG2 3.32Å
447	S	89.9	Confident	91.6	Very high	3 Å²	3	40.8 Å²	40.8	2%	0.021	18%	0.179	C	C	.	.			trans	-68.6	153.3	179.6	62.5	0	0	0	0	112.3	R449 E450 R451	S447-R449 PolarHBondContact O-N 3.15Å; S447-E450 PolarHBondContact N-OE2 3.31Å; S447-E450 PolarHBondContact O-N 3.45Å; S447-E450 WeakPolarHBondContact OG-CB 3.47Å; S447-E450 WeakPolarHBondContact OG-CG 3.47Å; S447-E450 PolarHBondContact OG-N 3.11Å; S447-E450 PolarHBondContact OG-OE2 2.81Å; S447-R451 WeakPolarHBondContact O-CG 3.32Å; S447-R451 PolarHBondContact O-N 3.11Å
448	A	89.5	Confident	91.7	Very high	1 Å²	1	40.9 Å²	40.9	1%	0.008	18%	0.179	C	C	.	.	H	α-helix	trans	-51.4	-41.8	175.2	0	0	0	0	0	113.6	R451 Y452 Y799 D808 L812	A448-R451 PolarHBondContact O-N 3.3Å; A448-Y452 PolarHBondContact O-N 3.45Å; A448-Y799 HydrophobicContact CB-CE1 3.79Å; A448-Y799 HydrophobicContact CB-CE2 3.97Å; A448-Y799 VanDerWaalsContact CB-CZ 3.44Å; A448-Y799 WeakPolarHBondContact CB-OH 3.34Å; A448-D808 HydrophobicContact CB-CB 3.79Å; A448-D808 WeakPolarHBondContact CB-OD1 3.46Å; A448-D808 PolarHBondContact N-OD1 3.13Å; A448-D808 VanDerWaalsContact N-OD1 3.12Å; A448-L812 HydrophobicContact CB-CD1 4.17Å; A448-L812 HydrophobicContact CB-CD2 4.47Å; A448-L812 HydrophobicContact CB-CG 4.35Å
449	R	90.3	Very high	91.5	Very high	53 Å²	53	41.4 Å²	41.4	20%	0.2	18%	0.182	C	C	.	.	H	α-helix	trans	-59.7	-47.1	175.3	-178.2	-163.9	66.8	-166.5	-3	112	S447 R451 Y452 L453 L812	S447-R449 PolarHBondContact O-N 3.15Å; R449-R451 VanDerWaalsContact C-N 3.34Å; R449-Y452 PolarHBondContact O-N 3.17Å; R449-L453 HydrophobicContact CG-CD1 4.29Å; R449-L453 WeakPolarHBondContact O-CG 3.44Å; R449-L453 PolarHBondContact O-N 3.34Å; R449-L812 HydrophobicContact CB-CD2 4.27Å
450	E	92	Very high	91.1	Very high	47 Å²	47	47.3 Å²	47.3	22%	0.22	21%	0.21	C	C	.	.	H	α-helix	trans	-65.4	-38.8	178.9	-75	160.1	176.2	0	0	111.6	M446 S447 Y452 L453 T454 W482	M446-E450 HydrophobicContact CE-CB 3.68Å; M446-E450 WeakPolarHBondContact CE-O 3.15Å; M446-E450 HydrophobicContact CG-CB 3.63Å; M446-E450 HydrophobicContact SD-CB 4.44Å; S447-E450 PolarHBondContact N-OE2 3.31Å; S447-E450 PolarHBondContact O-N 3.45Å; S447-E450 WeakPolarHBondContact OG-CB 3.47Å; S447-E450 WeakPolarHBondContact OG-CG 3.47Å; S447-E450 PolarHBondContact OG-N 3.11Å; S447-E450 PolarHBondContact OG-OE2 2.81Å; E450-Y452 VanDerWaalsContact C-N 3.32Å; E450-Y452 PolarHBondContact O-N 3.25Å; E450-L453 PolarHBondContact O-N 3.1Å; E450-T454 PolarHBondContact O-N 3.44Å; E450-T454 PolarHBondContact O-OG1 3.46Å; E450-W482 HydrophobicContact CG-CB 4.12Å; E450-W482 HydrophobicContact CG-CG 4.5Å
451	R	93.1	Very high	90.6	Very high	7 Å²	7	47.4 Å²	47.4	3%	0.026	22%	0.218	C	C	.	.	H	α-helix	trans	-61.6	-38.6	174.8	-71.1	-178.2	-82.7	138.4	-0.9	112.1	F435 E436 M439 M446 S447 A448 R449 T454 F455 Y799 D808	F435-R451 WeakPolarHBondContact CE1-O 3.29Å; E436-R451 IonicContact OE1-CZ 2.68Å; E436-R451 IonicContact OE1-NH1 3.72Å; E436-R451 PolarHBondContact OE1-NH1 3.39Å; M439-R451 HydrophobicContact CB-CG 3.91Å; M446-R451 HydrophobicContact CB-CG 4.07Å; M446-R451 HydrophobicContact CG-CG 3.77Å; M446-R451 PolarHBondContact O-NE 2.68Å; M446-R451 HydrophobicContact SD-CG 3.75Å; S447-R451 WeakPolarHBondContact O-CG 3.32Å; S447-R451 PolarHBondContact O-N 3.11Å; A448-R451 PolarHBondContact O-N 3.3Å; R449-R451 VanDerWaalsContact C-N 3.34Å; R451-T454 PolarHBondContact O-OG1 2.96Å; R451-F455 PolarHBondContact O-N 3.42Å; R451-F455 VanDerWaalsContact O-N 3.16Å; R451-Y799 PolarHBondContact NH1-OH 3.27Å; R451-Y799 PolarHBondContact NH2-OH 3.32Å; R451-D808 VanDerWaalsContact NH2-CG 3.26Å; R451-D808 IonicContact NH2-OD1 3.64Å; R451-D808 PolarHBondContact NH2-OD1 2.89Å; R451-D808 IonicContact NH2-OD2 2.68Å; R451-D808 PolarHBondContact NH2-OD2 2.91Å
452	Y	92	Very high	90.1	Very high	34 Å²	34	50.6 Å²	50.6	13%	0.133	24%	0.238	C	C	.	.	H	α-helix	trans	-69.1	-42.1	173.4	-174	-107.3	0	0	0	112.4	Y432 A448 R449 E450 T454 F455 K456 I787 E791 V795	Y432-Y452 HydrophobicContact CD2-CD2 4.12Å; Y432-Y452 HydrophobicContact CE1-CD2 4.37Å; Y432-Y452 AromaticContact CE2-CD2 3.7Å; Y432-Y452 HydrophobicContact CE2-CD2 3.7Å; Y432-Y452 HydrophobicContact CE2-CG 4.45Å; Y432-Y452 AromaticContact CZ-CD2 3.82Å; A448-Y452 PolarHBondContact O-N 3.45Å; R449-Y452 PolarHBondContact O-N 3.17Å; E450-Y452 VanDerWaalsContact C-N 3.32Å; E450-Y452 PolarHBondContact O-N 3.25Å; Y452-T454 VanDerWaalsContact C-N 3.32Å; Y452-T454 PolarHBondContact O-N 2.92Å; Y452-F455 WeakPolarHBondContact O-CB 3.3Å; Y452-F455 PolarHBondContact O-N 3.17Å; Y452-K456 HydrophobicContact CE1-CD 4.46Å; Y452-K456 PolarHBondContact O-N 3.33Å; Y452-I787 HydrophobicContact CD1-CD1 3.89Å; Y452-I787 HydrophobicContact CD1-CG1 4.24Å; Y452-I787 HydrophobicContact CE1-CD1 4.39Å; Y452-I787 HydrophobicContact CE1-CG1 4.25Å; Y452-I787 HydrophobicContact CE1-CG2 4.47Å; Y452-E791 HydrophobicContact CE1-CB 4.29Å; Y452-V795 HydrophobicContact CD1-CG2 4.43Å; Y452-V795 HydrophobicContact CD2-CG2 3.48Å; Y452-V795 VanDerWaalsContact CD2-CG2 3.48Å; Y452-V795 HydrophobicContact CE1-CG2 4.48Å; Y452-V795 HydrophobicContact CE2-CG2 3.55Å; Y452-V795 HydrophobicContact CG-CG2 3.94Å
453	L	92.9	Very high	89.8	Confident	0 Å²	0	52.5 Å²	52.5	0%	0	25%	0.252	C	S	.	.	H	α-helix	trans	-60.3	-40	176.3	-75.9	167.5	0	0	0	112.4	R449 E450 K456 A457 W482 K785 I787 F829	R449-L453 HydrophobicContact CG-CD1 4.29Å; R449-L453 WeakPolarHBondContact O-CG 3.44Å; R449-L453 PolarHBondContact O-N 3.34Å; E450-L453 PolarHBondContact O-N 3.1Å; L453-K456 PolarHBondContact O-N 3.05Å; L453-A457 WeakPolarHBondContact O-CB 3.44Å; L453-A457 PolarHBondContact O-N 3.21Å; L453-W482 HydrophobicContact CB-CD2 3.62Å; L453-W482 HydrophobicContact CB-CE3 4.05Å; L453-W482 HydrophobicContact CB-CG 3.95Å; L453-W482 HydrophobicContact CB-CH2 4.41Å; L453-W482 HydrophobicContact CB-CZ2 4.02Å; L453-W482 HydrophobicContact CB-CZ3 4.42Å; L453-W482 HydrophobicContact CD1-CB 3.62Å; L453-W482 HydrophobicContact CD1-CD2 3.77Å; L453-W482 HydrophobicContact CD1-CE3 3.9Å; L453-W482 HydrophobicContact CD1-CG 3.65Å; L453-W482 HydrophobicContact CD2-CE3 4.16Å; L453-W482 HydrophobicContact CD2-CZ3 4.31Å; L453-W482 HydrophobicContact CG-CD2 4.18Å; L453-W482 HydrophobicContact CG-CE3 4.27Å; L453-W482 HydrophobicContact CG-CG 4.41Å; L453-K785 HydrophobicContact CD2-CB 4.31Å; L453-I787 HydrophobicContact CD1-CD1 4.33Å; L453-I787 HydrophobicContact CD2-CD1 3.31Å; L453-I787 HydrophobicContact CD2-CG1 3.7Å; L453-I787 HydrophobicContact CG-CD1 3.6Å; L453-I787 HydrophobicContact CG-CG1 4.49Å; L453-F829 HydrophobicContact CD1-CB 3.85Å; L453-F829 HydrophobicContact CD1-CD1 3.85Å; L453-F829 HydrophobicContact CD1-CD2 4.28Å; L453-F829 HydrophobicContact CD1-CG 3.72Å; L453-F829 HydrophobicContact CD2-CB 3.87Å; L453-F829 HydrophobicContact CD2-CD2 4.06Å; L453-F829 HydrophobicContact CD2-CG 4.07Å
454	T	93.6	Very high	89.5	Confident	0 Å²	0	53.1 Å²	53.1	0%	0	27%	0.266	C	S	.	.	H	α-helix	trans	-67.1	-42.6	174.8	48.6	0	0	0	0	111.9	M446 E450 R451 Y452 K456 A457 L458	M446-T454 HydrophobicContact CE-CG2 3.32Å; E450-T454 PolarHBondContact O-N 3.44Å; E450-T454 PolarHBondContact O-OG1 3.46Å; R451-T454 PolarHBondContact O-OG1 2.96Å; Y452-T454 VanDerWaalsContact C-N 3.32Å; Y452-T454 PolarHBondContact O-N 2.92Å; T454-K456 VanDerWaalsContact C-N 3.34Å; T454-K456 PolarHBondContact O-N 3.18Å; T454-A457 WeakPolarHBondContact O-CB 3.15Å; T454-A457 PolarHBondContact O-N 3.25Å; T454-A457 VanDerWaalsContact O-N 3.1Å; T454-L458 WeakPolarHBondContact O-CD1 3.33Å; T454-L458 PolarHBondContact O-N 3.1Å
455	F	94	Very high	89.6	Confident	13 Å²	13	49.9 Å²	49.9	6%	0.057	24%	0.243	C	C	.	.	H	α-helix	trans	-55.9	-48.2	173.9	-179.2	-96.4	0	0	0	112	Y432 F435 R451 Y452 A457 L458 N459 L466	Y432-F455 HydrophobicContact CD2-CB 3.96Å; Y432-F455 AromaticContact CD2-CD1 4Å; Y432-F455 HydrophobicContact CD2-CD1 4Å; Y432-F455 HydrophobicContact CD2-CD2 4.05Å; Y432-F455 AromaticContact CD2-CG 3.73Å; Y432-F455 HydrophobicContact CD2-CG 3.73Å; Y432-F455 HydrophobicContact CE2-CB 4.22Å; Y432-F455 HydrophobicContact CE2-CG 4.47Å; F435-F455 HydrophobicContact CB-CD2 3.87Å; F435-F455 HydrophobicContact CB-CE2 4.29Å; F435-F455 HydrophobicContact CD1-CB 3.8Å; F435-F455 AromaticContact CD1-CD2 3.85Å; F435-F455 HydrophobicContact CD1-CD2 3.85Å; F435-F455 HydrophobicContact CD1-CG 4.29Å; F435-F455 HydrophobicContact CD2-CD2 4.26Å; F435-F455 HydrophobicContact CE1-CB 3.72Å; F435-F455 HydrophobicContact CE1-CD2 4.44Å; F435-F455 HydrophobicContact CG-CB 4.49Å; F435-F455 AromaticContact CG-CD2 3.74Å; F435-F455 HydrophobicContact CG-CD2 3.74Å; F435-F455 HydrophobicContact CZ-CB 4.34Å; R451-F455 PolarHBondContact O-N 3.42Å; R451-F455 VanDerWaalsContact O-N 3.16Å; Y452-F455 WeakPolarHBondContact O-CB 3.3Å; Y452-F455 PolarHBondContact O-N 3.17Å; F455-A457 VanDerWaalsContact C-N 3.26Å; F455-A457 PolarHBondContact O-N 3.39Å; F455-L458 PolarHBondContact O-N 2.94Å; F455-N459 WeakPolarHBondContact O-CB 3.38Å; F455-N459 PolarHBondContact O-N 2.98Å; F455-L466 HydrophobicContact CD2-CD1 3.64Å; F455-L466 HydrophobicContact CD2-CG 4.03Å; F455-L466 HydrophobicContact CE2-CD1 3.61Å; F455-L466 HydrophobicContact CE2-CD2 4.27Å; F455-L466 HydrophobicContact CE2-CG 3.57Å; F455-L466 HydrophobicContact CZ-CG 4.18Å
456	K	93.1	Very high	89.8	Confident	27 Å²	27	38.2 Å²	38.2	12%	0.117	20%	0.199	C	C	.	.	H	α-helix	trans	-67.8	-24.7	177.3	-168.5	170.7	-172.7	173.2	0	113.3	Y452 L453 T454 K785 E786 E791	Y452-K456 HydrophobicContact CE1-CD 4.46Å; Y452-K456 PolarHBondContact O-N 3.33Å; L453-K456 PolarHBondContact O-N 3.05Å; T454-K456 VanDerWaalsContact C-N 3.34Å; T454-K456 PolarHBondContact O-N 3.18Å; K456-K785 PolarHBondContact O-NZ 3.48Å; K456-E786 WeakPolarHBondContact CE-O 3.45Å; K456-E786 PolarHBondContact NZ-O 3.34Å; K456-E791 IonicContact NZ-OE1 3.93Å; K456-E791 PolarHBondContact NZ-OE1 3.05Å; K456-E791 IonicContact NZ-OE2 2.77Å; K456-E791 PolarHBondContact NZ-OE2 3.41Å
457	A	92.6	Very high	89.9	Confident	9 Å²	9	38.9 Å²	38.9	7%	0.074	21%	0.207	C	C	.	.	H	α-helix	trans	-77.8	-37.5	175.1	0	0	0	0	0	112.9	L453 T454 F455 V477 W482 L783 K785	L453-A457 WeakPolarHBondContact O-CB 3.44Å; L453-A457 PolarHBondContact O-N 3.21Å; T454-A457 WeakPolarHBondContact O-CB 3.15Å; T454-A457 PolarHBondContact O-N 3.25Å; T454-A457 VanDerWaalsContact O-N 3.1Å; F455-A457 VanDerWaalsContact C-N 3.26Å; F455-A457 PolarHBondContact O-N 3.39Å; A457-V477 HydrophobicContact CB-CG1 3.43Å; A457-V477 VanDerWaalsContact CB-CG1 3.43Å; A457-W482 HydrophobicContact CB-CH2 3.83Å; A457-W482 HydrophobicContact CB-CZ2 3.69Å; A457-L783 HydrophobicContact CB-CD2 3.57Å; A457-K785 HydrophobicContact CB-CG 4.37Å
458	L	93.2	Very high	90	Very high	3 Å²	3	41.1 Å²	41.1	2%	0.016	22%	0.218	C	C	.	.	H	α-helix	trans	-67.6	-38.9	171.7	-86.2	87.1	0	0	0	111.2	F435 T454 F455 Q460 L466 D470 F471 I474 V477	F435-L458 HydrophobicContact CE2-CD1 4.46Å; F435-L458 HydrophobicContact CE2-CD2 4.3Å; F435-L458 HydrophobicContact CZ-CD1 4.37Å; T454-L458 WeakPolarHBondContact O-CD1 3.33Å; T454-L458 PolarHBondContact O-N 3.1Å; F455-L458 PolarHBondContact O-N 2.94Å; L458-Q460 PolarHBondContact O-N 3.08Å; L458-L466 HydrophobicContact CB-CD1 4.36Å; L458-L466 HydrophobicContact CB-CD2 3.85Å; L458-L466 HydrophobicContact CD2-CD1 4.22Å; L458-D470 WeakPolarHBondContact O-CB 3.36Å; L458-F471 HydrophobicContact CD2-CD2 4.05Å; L458-I474 HydrophobicContact CD2-CB 4.2Å; L458-V477 HydrophobicContact CD1-CB 3.66Å; L458-V477 HydrophobicContact CD1-CG1 3.51Å; L458-V477 HydrophobicContact CD1-CG2 4.37Å; L458-V477 HydrophobicContact CG-CB 4.35Å; L458-V477 HydrophobicContact CG-CG1 4.43Å
459	N	91	Very high	90.1	Very high	11 Å²	11	49.3 Å²	49.3	6%	0.059	25%	0.254	C	S	.	.			trans	-72.3	100.8	-177.9	-168.7	17.9	0	0	0	111.5	F455 D462 T463 L466	F455-N459 WeakPolarHBondContact O-CB 3.38Å; F455-N459 PolarHBondContact O-N 2.98Å; N459-D462 PolarHBondContact OD1-N 3.03Å; N459-T463 PolarHBondContact ND2-N 3.43Å; N459-T463 PolarHBondContact ND2-O 3.17Å; N459-T463 PolarHBondContact OD1-N 3.39Å; N459-T463 PolarHBondContact OD1-O 3.49Å; N459-L466 HydrophobicContact CB-CD2 3.77Å
460	Q	84.4	Confident	90.2	Very high	125 Å²	125	47.1 Å²	47.1	58%	0.584	25%	0.246	S	C	*	.	S	Bend	trans	-87	-23.4	178.3	-63.7	-179	10.7	0	0	112.7	L458	L458-Q460 PolarHBondContact O-N 3.08Å
461	N	81.1	Confident	90.3	Very high	107 Å²	107	44.9 Å²	44.9	57%	0.572	24%	0.235	S	C	*	.	S	Bend	trans	-100.4	8.5	-172.8	-60.4	-47.6	0	0	0	113.7	T463	N461-T463 HydrophobicContact CB-CG2 4.44Å; N461-T463 PolarHBondContact O-N 2.73Å
462	D	80.8	Confident	90.4	Very high	130 Å²	130	46.4 Å²	46.4	70%	0.695	24%	0.241	S	C	*	.			trans	50.8	21.7	-176.7	-67.2	-40.2	0	0	0	115.2	N459	N459-D462 PolarHBondContact OD1-N 3.03Å
463	T	85.6	Confident	90.5	Very high	64 Å²	64	48 Å²	48	39%	0.393	25%	0.252	S	S	.	.			trans	-81.8	149	175.2	49.2	0	0	0	0	111.1	N459 N461 L465	N459-T463 PolarHBondContact ND2-N 3.43Å; N459-T463 PolarHBondContact ND2-O 3.17Å; N459-T463 PolarHBondContact OD1-N 3.39Å; N459-T463 PolarHBondContact OD1-O 3.49Å; N461-T463 HydrophobicContact CB-CG2 4.44Å; N461-T463 PolarHBondContact O-N 2.73Å; T463-L465 PolarHBondContact O-N 3.32Å; T463-L465 PolarHBondContact OG1-O 2.91Å
464	P	85.3	Confident	90.5	Very high	110 Å²	110	48 Å²	48	71%	0.714	25%	0.252	S	S	*	.	S	Bend	trans	-67.6	-0.1	179.8	28.2	-35.9	0	0	0	114.6
465	L	89.6	Confident	90.5	Very high	33 Å²	33	49.3 Å²	49.3	17%	0.173	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	146	-177.6	-61.3	171.4	0	0	0	109.9	P427 I430 T463	P427-L465 HydrophobicContact CB-CD1 3.65Å; P427-L465 HydrophobicContact CG-CD1 3.63Å; P427-L465 WeakPolarHBondContact O-CD1 3.48Å; I430-L465 WeakPolarHBondContact O-CA 3.32Å; T463-L465 PolarHBondContact O-N 3.32Å; T463-L465 PolarHBondContact OG1-O 2.91Å
466	L	91.7	Very high	90.4	Very high	1 Å²	1	52.1 Å²	52.1	1%	0.005	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.2	131.2	172	-63.6	172.4	0	0	0	111	G429 I430 F435 F455 L458 N459 D470 F471	G429-L466 WeakPolarHBondContact CA-O 3.4Å; I430-L466 HydrophobicContact CB-CB 4.27Å; I430-L466 PolarHBondContact N-O 3.38Å; I430-L466 VanDerWaalsContact N-O 3.15Å; I430-L466 PolarHBondContact O-N 3.44Å; F435-L466 HydrophobicContact CD2-CD1 3.93Å; F435-L466 HydrophobicContact CE2-CD1 4.29Å; F455-L466 HydrophobicContact CD2-CD1 3.64Å; F455-L466 HydrophobicContact CD2-CG 4.03Å; F455-L466 HydrophobicContact CE2-CD1 3.61Å; F455-L466 HydrophobicContact CE2-CD2 4.27Å; F455-L466 HydrophobicContact CE2-CG 3.57Å; F455-L466 HydrophobicContact CZ-CG 4.18Å; L458-L466 HydrophobicContact CB-CD1 4.36Å; L458-L466 HydrophobicContact CB-CD2 3.85Å; L458-L466 HydrophobicContact CD2-CD1 4.22Å; N459-L466 HydrophobicContact CB-CD2 3.77Å; L466-D470 HydrophobicContact CD2-CB 4.28Å; L466-F471 HydrophobicContact CD1-CD2 4.49Å
467	S	92.4	Very high	90.4	Very high	39 Å²	39	51.7 Å²	51.7	27%	0.273	27%	0.27	S	S	.	.			trans	-82.2	166.6	170.3	78	0	0	0	0	111.5	K469 D470 F471	S467-K469 PolarHBondContact O-N 3.45Å; S467-K469 PolarHBondContact OG-N 3.17Å; S467-D470 WeakPolarHBondContact CB-OD2 3.23Å; S467-D470 PolarHBondContact N-OD2 3.12Å; S467-D470 VanDerWaalsContact N-OD2 3.12Å; S467-D470 PolarHBondContact O-N 3.27Å; S467-D470 PolarHBondContact OG-N 2.9Å; S467-D470 PolarHBondContact OG-OD2 3.42Å; S467-F471 WeakPolarHBondContact O-CB 3.29Å; S467-F471 PolarHBondContact O-N 2.65Å
468	L	92	Very high	90.4	Very high	50 Å²	50	51.7 Å²	51.7	26%	0.262	27%	0.27	S	S	.	.	H	α-helix	trans	-61.9	-32	174.6	-179	61.6	0	0	0	112.3	Q415 Y418 F471 Y472	Q415-L468 HydrophobicContact CG-CD1 4.44Å; Y418-L468 HydrophobicContact CD1-CB 4.2Å; Y418-L468 HydrophobicContact CD1-CD1 3.83Å; Y418-L468 HydrophobicContact CD1-CG 4.45Å; Y418-L468 HydrophobicContact CD2-CB 4.38Å; Y418-L468 HydrophobicContact CD2-CD1 4.06Å; Y418-L468 HydrophobicContact CE1-CB 3.89Å; Y418-L468 HydrophobicContact CE1-CD1 4.4Å; Y418-L468 HydrophobicContact CE2-CB 4.12Å; Y418-L468 HydrophobicContact CG-CB 4.44Å; Y418-L468 HydrophobicContact CG-CD1 3.64Å; Y418-L468 PolarHBondContact OH-N 3.06Å; L468-F471 PolarHBondContact O-N 3.09Å; L468-Y472 HydrophobicContact CD1-CE1 3.93Å; L468-Y472 WeakPolarHBondContact CD2-OH 3.45Å; L468-Y472 HydrophobicContact CG-CE1 4.17Å; L468-Y472 HydrophobicContact CG-CE2 3.95Å; L468-Y472 VanDerWaalsContact O-CD2 3.27Å; L468-Y472 WeakPolarHBondContact O-CD2 3.49Å; L468-Y472 PolarHBondContact O-N 3.25Å
469	K	91.9	Very high	90.3	Very high	173 Å²	173	54 Å²	54	75%	0.752	29%	0.29	S	S	*	.	H	α-helix	trans	-65.1	-46.7	177.9	-67.8	-175.5	-180	-177.9	0	110.7	S467 F471 Y472	S467-K469 PolarHBondContact O-N 3.45Å; S467-K469 PolarHBondContact OG-N 3.17Å; K469-F471 VanDerWaalsContact C-N 3.29Å; K469-F471 PolarHBondContact O-N 3.44Å; K469-Y472 PolarHBondContact O-N 2.68Å
470	D	92.3	Very high	90.3	Very high	6 Å²	6	54 Å²	54	3%	0.032	29%	0.29	C	S	.	.	H	α-helix	trans	-64.4	-36.3	176.7	-53.7	-41.8	0	0	0	111.5	L458 L466 S467 Y472	L458-D470 WeakPolarHBondContact O-CB 3.36Å; L466-D470 HydrophobicContact CD2-CB 4.28Å; S467-D470 WeakPolarHBondContact CB-OD2 3.23Å; S467-D470 PolarHBondContact N-OD2 3.12Å; S467-D470 VanDerWaalsContact N-OD2 3.12Å; S467-D470 PolarHBondContact O-N 3.27Å; S467-D470 PolarHBondContact OG-N 2.9Å; S467-D470 PolarHBondContact OG-OD2 3.42Å; D470-Y472 VanDerWaalsContact C-N 3.3Å; D470-Y472 PolarHBondContact O-N 3.01Å
471	F	94.4	Very high	90.6	Very high	0 Å²	0	55.9 Å²	55.9	0%	0	30%	0.296	C	S	.	.	H	α-helix	trans	-74.9	-15	-177.5	-162.5	-114.3	0	0	0	114	I414 A417 Y418 L421 I430 L438 L458 L466 S467 L468 K469 D473 I474	I414-F471 HydrophobicContact CG2-CD1 3.37Å; I414-F471 HydrophobicContact CG2-CE1 3.81Å; I414-F471 HydrophobicContact CG2-CG 4.31Å; I414-F471 WeakPolarHBondContact CG2-O 3.33Å; A417-F471 HydrophobicContact CB-CE1 4.36Å; Y418-F471 HydrophobicContact CD2-CB 4.09Å; Y418-F471 AromaticContact CD2-CD1 3.9Å; Y418-F471 HydrophobicContact CD2-CD1 3.9Å; Y418-F471 HydrophobicContact CD2-CG 4.12Å; Y418-F471 HydrophobicContact CG-CD1 4.4Å; L421-F471 HydrophobicContact CD1-CZ 4.34Å; I430-F471 HydrophobicContact CD1-CD1 4.27Å; I430-F471 HydrophobicContact CD1-CD2 3.86Å; I430-F471 HydrophobicContact CD1-CE1 4.27Å; I430-F471 HydrophobicContact CD1-CE2 3.81Å; I430-F471 HydrophobicContact CD1-CG 4.09Å; I430-F471 HydrophobicContact CD1-CZ 4.04Å; L438-F471 HydrophobicContact CD2-CE2 4.21Å; L438-F471 HydrophobicContact CD2-CZ 3.94Å; L458-F471 HydrophobicContact CD2-CD2 4.05Å; L466-F471 HydrophobicContact CD1-CD2 4.49Å; S467-F471 WeakPolarHBondContact O-CB 3.29Å; S467-F471 PolarHBondContact O-N 2.65Å; L468-F471 PolarHBondContact O-N 3.09Å; K469-F471 VanDerWaalsContact C-N 3.29Å; K469-F471 PolarHBondContact O-N 3.44Å; F471-D473 PolarHBondContact O-N 3.25Å; F471-I474 HydrophobicContact CD2-CD1 4.08Å; F471-I474 HydrophobicContact CE1-CD1 4.48Å; F471-I474 HydrophobicContact CE2-CD1 3.28Å; F471-I474 HydrophobicContact CE2-CG1 4.44Å; F471-I474 HydrophobicContact CZ-CD1 3.51Å; F471-I474 WeakPolarHBondContact O-CB 3.49Å; F471-I474 WeakPolarHBondContact O-CG2 3.42Å; F471-I474 PolarHBondContact O-N 3.05Å
472	Y	94.6	Very high	91	Very high	40 Å²	40	51.1 Å²	51.1	16%	0.157	27%	0.27	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.1	-27.8	175.9	-75.6	-45.8	0	0	0	113.6	R411 I414 Q415 L468 K469 D470 I474	R411-Y472 HydrophobicContact CG-CD1 4Å; R411-Y472 HydrophobicContact CG-CE1 3.63Å; R411-Y472 VanDerWaalsContact CZ-CE2 3.43Å; R411-Y472 VanDerWaalsContact CZ-CZ 3.44Å; I414-Y472 HydrophobicContact CB-CD1 4.36Å; I414-Y472 HydrophobicContact CD1-CD1 4.36Å; I414-Y472 VanDerWaalsContact CD1-O 3.28Å; I414-Y472 WeakPolarHBondContact CD1-O 3.48Å; I414-Y472 HydrophobicContact CG2-CD1 3.86Å; I414-Y472 HydrophobicContact CG2-CE1 4.29Å; Q415-Y472 HydrophobicContact CG-CE1 4.05Å; Q415-Y472 PolarHBondContact NE2-OH 3.49Å; L468-Y472 HydrophobicContact CD1-CE1 3.93Å; L468-Y472 WeakPolarHBondContact CD2-OH 3.45Å; L468-Y472 HydrophobicContact CG-CE1 4.17Å; L468-Y472 HydrophobicContact CG-CE2 3.95Å; L468-Y472 VanDerWaalsContact O-CD2 3.27Å; L468-Y472 WeakPolarHBondContact O-CD2 3.49Å; L468-Y472 PolarHBondContact O-N 3.25Å; K469-Y472 PolarHBondContact O-N 2.68Å; D470-Y472 VanDerWaalsContact C-N 3.3Å; D470-Y472 PolarHBondContact O-N 3.01Å; Y472-I474 VanDerWaalsContact C-N 3.27Å; Y472-I474 PolarHBondContact O-N 3.34Å
473	D	93.3	Very high	91.4	Very high	67 Å²	67	52.3 Å²	52.3	36%	0.358	27%	0.269	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.4	11.1	-177.5	-66.7	-17.9	0	0	0	113.5	F471 Y475 E476 V477	F471-D473 PolarHBondContact O-N 3.25Å; D473-Y475 VanDerWaalsContact C-N 3.3Å; D473-Y475 PolarHBondContact O-N 3.48Å; D473-E476 PolarHBondContact O-N 3.43Å; D473-E476 VanDerWaalsContact O-N 3.1Å; D473-V477 HydrophobicContact CB-CG2 4.25Å; D473-V477 WeakPolarHBondContact O-CG2 3.48Å; D473-V477 PolarHBondContact O-N 3.47Å
474	I	94.9	Very high	91.3	Very high	0 Å²	0	50.7 Å²	50.7	0%	0	26%	0.262	C	S	.	.	H	α-helix	trans	-55	-41.2	-175.5	-175.2	155.2	0	0	0	113.4	L150 I414 F435 L438 M439 L458 F471 Y472 E476 A478	L150-I474 HydrophobicContact CD2-CD1 3.63Å; L150-I474 HydrophobicContact CD2-CG1 4.1Å; L150-I474 HydrophobicContact CD2-CG2 4.35Å; I414-I474 HydrophobicContact CD1-CG2 3.94Å; I414-I474 HydrophobicContact CG1-CG2 3.89Å; F435-I474 HydrophobicContact CE2-CD1 4.43Å; L438-I474 HydrophobicContact CD2-CD1 3.9Å; M439-I474 HydrophobicContact CE-CD1 3.64Å; M439-I474 HydrophobicContact CE-CG1 4.08Å; L458-I474 HydrophobicContact CD2-CB 4.2Å; F471-I474 HydrophobicContact CD2-CD1 4.08Å; F471-I474 HydrophobicContact CE1-CD1 4.48Å; F471-I474 HydrophobicContact CE2-CD1 3.28Å; F471-I474 HydrophobicContact CE2-CG1 4.44Å; F471-I474 HydrophobicContact CZ-CD1 3.51Å; F471-I474 WeakPolarHBondContact O-CB 3.49Å; F471-I474 WeakPolarHBondContact O-CG2 3.42Å; F471-I474 PolarHBondContact O-N 3.05Å; Y472-I474 VanDerWaalsContact C-N 3.27Å; Y472-I474 PolarHBondContact O-N 3.34Å; I474-E476 VanDerWaalsContact C-N 3.31Å; I474-E476 PolarHBondContact O-N 3.23Å; I474-A478 HydrophobicContact CG1-CB 4.44Å; I474-A478 WeakPolarHBondContact O-CB 3.46Å; I474-A478 PolarHBondContact O-N 3.16Å
475	Y	93.5	Very high	91.1	Very high	28 Å²	28	50.5 Å²	50.5	11%	0.11	25%	0.25	C	S	.	.	H	α-helix	trans	-63.8	-37.7	-179	-70.9	-64.9	0	0	0	112.3	L150 E154 K410 I414 Y442 D473	L150-Y475 WeakPolarHBondContact CA-OH 3.26Å; L150-Y475 HydrophobicContact CG-CE1 4.49Å; L150-Y475 WeakPolarHBondContact O-CE1 3.47Å; L150-Y475 PolarHBondContact O-OH 3.5Å; E154-Y475 HydrophobicContact CB-CE1 4Å; E154-Y475 WeakPolarHBondContact OE2-CD1 3.42Å; E154-Y475 WeakPolarHBondContact OE2-CE1 3.39Å; K410-Y475 HydrophobicContact CB-CD2 4.3Å; K410-Y475 HydrophobicContact CB-CE2 3.76Å; K410-Y475 HydrophobicContact CD-CD2 4.12Å; K410-Y475 HydrophobicContact CD-CE2 4.12Å; K410-Y475 HydrophobicContact CG-CD2 4.5Å; K410-Y475 HydrophobicContact CG-CE2 4.02Å; I414-Y475 HydrophobicContact CD1-CD2 3.79Å; I414-Y475 HydrophobicContact CD1-CE2 3.66Å; I414-Y475 HydrophobicContact CG1-CD2 4.24Å; I414-Y475 HydrophobicContact CG1-CE2 3.67Å; Y442-Y475 WeakPolarHBondContact OH-CD1 3.27Å; D473-Y475 VanDerWaalsContact C-N 3.3Å; D473-Y475 PolarHBondContact O-N 3.48Å
476	E	91.3	Very high	90.2	Very high	71 Å²	71	57.4 Å²	57.4	33%	0.332	28%	0.278	S	S	.	.	H	α-helix	trans	-76.6	-44.9	-178.3	-61.6	-163.2	-168.4	0	0	111.7	D473 I474 A479 R833 L842	D473-E476 PolarHBondContact O-N 3.43Å; D473-E476 VanDerWaalsContact O-N 3.1Å; I474-E476 VanDerWaalsContact C-N 3.31Å; I474-E476 PolarHBondContact O-N 3.23Å; E476-A479 PolarHBondContact O-N 3.05Å; E476-R833 WeakPolarHBondContact O-CD 3.3Å; E476-R833 PolarHBondContact O-NE 3.48Å; E476-R833 IonicContact OE2-NH2 2.79Å; E476-R833 PolarHBondContact OE2-NH2 3.19Å; E476-L842 WeakPolarHBondContact OE1-CD1 3.38Å
477	V	92.9	Very high	88.6	Confident	18 Å²	18	63.1 Å²	63.1	11%	0.109	31%	0.309	C	S	.	.	H	α-helix	trans	-77.1	-36.2	-175.4	-176.5	0	0	0	0	111.4	A457 L458 D473 A479 L480	A457-V477 HydrophobicContact CB-CG1 3.43Å; A457-V477 VanDerWaalsContact CB-CG1 3.43Å; L458-V477 HydrophobicContact CD1-CB 3.66Å; L458-V477 HydrophobicContact CD1-CG1 3.51Å; L458-V477 HydrophobicContact CD1-CG2 4.37Å; L458-V477 HydrophobicContact CG-CB 4.35Å; L458-V477 HydrophobicContact CG-CG1 4.43Å; D473-V477 HydrophobicContact CB-CG2 4.25Å; D473-V477 WeakPolarHBondContact O-CG2 3.48Å; D473-V477 PolarHBondContact O-N 3.47Å; V477-A479 PolarHBondContact O-N 2.97Å; V477-L480 HydrophobicContact CB-CD1 4.47Å; V477-L480 HydrophobicContact CG1-CD1 4.01Å; V477-L480 WeakPolarHBondContact O-CB 3.23Å; V477-L480 PolarHBondContact O-N 3.31Å; V477-L480 VanDerWaalsContact O-N 3.15Å
478	A	92.6	Very high	86.9	Confident	9 Å²	9	67.5 Å²	67.5	7%	0.074	32%	0.32	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68.5	-15.7	175.7	0	0	0	0	0	113.4	M439 Y442 I474	M439-A478 HydrophobicContact CE-CB 4.36Å; Y442-A478 HydrophobicContact CE1-CB 4.28Å; I474-A478 HydrophobicContact CG1-CB 4.44Å; I474-A478 WeakPolarHBondContact O-CB 3.46Å; I474-A478 PolarHBondContact O-N 3.16Å
479	A	91.2	Very high	85.3	Confident	53 Å²	53	71.5 Å²	71.5	44%	0.438	34%	0.337	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.8	-11	174.7	0	0	0	0	0	113.6	E476 V477	E476-A479 PolarHBondContact O-N 3.05Å; V477-A479 PolarHBondContact O-N 2.97Å
480	L	90.6	Very high	84	Confident	11 Å²	11	65.5 Å²	65.5	6%	0.058	31%	0.311	C	S	.	.	P	Polyproline II helix	trans	-68.3	134.7	179	-66.2	168	0	0	0	111.4	V477 W482 L783 R833	V477-L480 HydrophobicContact CB-CD1 4.47Å; V477-L480 HydrophobicContact CG1-CD1 4.01Å; V477-L480 WeakPolarHBondContact O-CB 3.23Å; V477-L480 PolarHBondContact O-N 3.31Å; V477-L480 VanDerWaalsContact O-N 3.15Å; L480-W482 HydrophobicContact CD1-CZ2 4.07Å; L480-L783 HydrophobicContact CD1-CB 4.19Å; L480-L783 HydrophobicContact CD1-CD2 3.88Å; L480-R833 HydrophobicContact CD2-CB 3.91Å; L480-R833 HydrophobicContact CD2-CG 3.67Å
481	K	90.6	Very high	83	Confident	164 Å²	164	70.7 Å²	70.7	71%	0.713	33%	0.331	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-97.2	122.6	168.6	-67.3	-176.8	179.3	178.1	0	109.2	G831 R832	K481-G831 WeakPolarHBondContact O-CA 3.43Å; K481-R832 PolarHBondContact N-O 3.47Å; K481-R832 PolarHBondContact O-N 2.92Å
482	W	90.3	Very high	81.9	Confident	7 Å²	7	70.8 Å²	70.8	3%	0.027	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.8	133.7	-176.4	-61.4	91.6	0	0	0	111.9	E450 L453 A457 L480 L783 K785 F829 G831	E450-W482 HydrophobicContact CG-CB 4.12Å; E450-W482 HydrophobicContact CG-CG 4.5Å; L453-W482 HydrophobicContact CB-CD2 3.62Å; L453-W482 HydrophobicContact CB-CE3 4.05Å; L453-W482 HydrophobicContact CB-CG 3.95Å; L453-W482 HydrophobicContact CB-CH2 4.41Å; L453-W482 HydrophobicContact CB-CZ2 4.02Å; L453-W482 HydrophobicContact CB-CZ3 4.42Å; L453-W482 HydrophobicContact CD1-CB 3.62Å; L453-W482 HydrophobicContact CD1-CD2 3.77Å; L453-W482 HydrophobicContact CD1-CE3 3.9Å; L453-W482 HydrophobicContact CD1-CG 3.65Å; L453-W482 HydrophobicContact CD2-CE3 4.16Å; L453-W482 HydrophobicContact CD2-CZ3 4.31Å; L453-W482 HydrophobicContact CG-CD2 4.18Å; L453-W482 HydrophobicContact CG-CE3 4.27Å; L453-W482 HydrophobicContact CG-CG 4.41Å; A457-W482 HydrophobicContact CB-CH2 3.83Å; A457-W482 HydrophobicContact CB-CZ2 3.69Å; L480-W482 HydrophobicContact CD1-CZ2 4.07Å; W482-L783 HydrophobicContact CH2-CD2 4Å; W482-L783 HydrophobicContact CH2-CG 4.37Å; W482-K785 HydrophobicContact CH2-CB 4.09Å; W482-K785 HydrophobicContact CH2-CG 3.83Å; W482-K785 HydrophobicContact CZ3-CB 3.91Å; W482-K785 HydrophobicContact CZ3-CG 4.12Å; W482-F829 HydrophobicContact CE3-CB 4.07Å; W482-G831 VanDerWaalsContact CE3-CA 3.49Å; W482-G831 VanDerWaalsContact CE3-N 3.32Å
483	K	87.8	Confident	80.8	Confident	155 Å²	155	71.8 Å²	71.8	67%	0.674	34%	0.339	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-128.8	139.5	172.3	-67.3	-175.1	177.9	-178.5	0	109.4	F829 L830	K483-F829 CarbonylContact O-C 3.59Å; K483-F829 WeakPolarHBondContact O-CA 3.38Å; K483-L830 PolarHBondContact N-O 3.17Å; K483-L830 PolarHBondContact O-N 3.5Å
484	A	85.3	Confident	79.6	Confident	29 Å²	29	77 Å²	77	24%	0.24	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.3	135	171	0	0	0	0	0	109.2	K486 M827 F829	A484-K486 PolarHBondContact O-N 2.98Å; A484-K486 VanDerWaalsContact O-N 3.08Å; A484-M827 HydrophobicContact CB-SD 4.12Å; A484-F829 HydrophobicContact CB-CD1 3.94Å; A484-F829 HydrophobicContact CB-CE1 3.6Å; A484-F829 HydrophobicContact CB-CZ 4.31Å
485	K	80.6	Confident	78.8	Confident	107 Å²	107	79.9 Å²	79.9	47%	0.465	38%	0.377	S	S	.	.			trans	-73.1	99.1	170.9	-163.8	169	-173.3	165.3	0	107.1	E784 V828	K485-E784 IonicContact NZ-OE1 2.65Å; K485-E784 PolarHBondContact NZ-OE1 3.5Å; K485-E784 IonicContact NZ-OE2 3.87Å; K485-V828 HydrophobicContact CB-CB 4.42Å; K485-V828 WeakPolarHBondContact CB-O 3.31Å; K485-V828 HydrophobicContact CD-CB 4.49Å; K485-V828 HydrophobicContact CD-CG1 4.22Å; K485-V828 PolarHBondContact N-O 3.33Å
486	K	70.6	Confident	78.1	Confident	177 Å²	177	82.7 Å²	82.7	77%	0.77	40%	0.398	S	S	*	.			trans	-79.9	127.2	179.2	-71.1	-174	177.7	-175.9	0	109.2	A484	A484-K486 PolarHBondContact O-N 2.98Å; A484-K486 VanDerWaalsContact O-N 3.08Å
487	N	56.7	Low	77.3	Confident	121 Å²	121	90 Å²	90	65%	0.647	42%	0.423	S	S	*	.	S	Bend	trans	-79	-13.6	175	-72.1	-8.1	0	0	0	113.7	E489 Q824	N487-E489 PolarHBondContact O-N 3.21Å; N487-Q824 PolarHBondContact ND2-NE2 3.44Å
488	R	56.8	Low	76.6	Confident	131 Å²	131	94.5 Å²	94.5	49%	0.494	45%	0.45	S	S	.	.			trans	-83.5	105.6	171.4	-73.1	-167.6	176.4	-170.5	-4	109
489	E	58.4	Low	76	Confident	134 Å²	134	95.1 Å²	95.1	63%	0.626	46%	0.455	S	S	*	.			trans	-79.6	-15.5	-172.6	-66.1	-168.4	169.4	0	0	113.8	N487	N487-E489 PolarHBondContact O-N 3.21Å
490	H	65.1	Low	75.6	Confident	47 Å²	47	95.1 Å²	95.1	22%	0.218	45%	0.448	C	S	.	.			trans	-128.4	130.3	-166.1	-59.5	-25.3	0	0	0	113.5	F492 D493 N507	H490-F492 HydrophobicContact CB-CD1 3.99Å; H490-F492 HydrophobicContact CB-CD2 3.99Å; H490-F492 HydrophobicContact CB-CE1 3.62Å; H490-F492 HydrophobicContact CB-CE2 3.62Å; H490-F492 HydrophobicContact CB-CG 4.17Å; H490-F492 HydrophobicContact CB-CZ 3.43Å; H490-F492 VanDerWaalsContact CB-CZ 3.43Å; H490-F492 AromaticContact CD2-CE2 3.83Å; H490-F492 AromaticContact CD2-CZ 3.59Å; H490-F492 AromaticContact CG-CE1 3.85Å; H490-F492 AromaticContact CG-CE2 3.85Å; H490-F492 AromaticContact CG-CZ 3.38Å; H490-F492 PolarHBondContact O-N 3.03Å; H490-D493 PolarHBondContact O-N 3.41Å; H490-N507 PolarHBondContact CE1-ND2 3.18Å; H490-N507 PolarHBondContact ND1-ND2 3.21Å; H490-N507 PolarHBondContact NE2-ND2 3.2Å
491	W	72.6	Confident	75.3	Confident	116 Å²	116	100.9 Å²	100.9	44%	0.439	48%	0.478	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.7	-19.5	179.3	72.8	-86.9	0	0	0	113.4	L495 F503 A567	W491-L495 HydrophobicContact CH2-CD1 4.44Å; W491-L495 HydrophobicContact CZ3-CD1 4.29Å; W491-F503 HydrophobicContact CH2-CD1 4.29Å; W491-F503 AromaticContact CH2-CE1 3.76Å; W491-F503 HydrophobicContact CH2-CE1 3.76Å; W491-F503 HydrophobicContact CH2-CE2 4.23Å; W491-F503 AromaticContact CH2-CZ 3.73Å; W491-F503 HydrophobicContact CH2-CZ 3.73Å; W491-F503 AromaticContact CZ2-CD1 3.71Å; W491-F503 HydrophobicContact CZ2-CD1 3.71Å; W491-F503 AromaticContact CZ2-CE1 3.48Å; W491-F503 HydrophobicContact CZ2-CE1 3.48Å; W491-F503 VanDerWaalsContact CZ2-CE1 3.48Å; W491-F503 HydrophobicContact CZ2-CG 4.37Å; W491-F503 AromaticContact CZ2-CZ 3.96Å; W491-F503 HydrophobicContact CZ2-CZ 3.96Å; W491-A567 WeakPolarHBondContact CZ2-O 3.4Å; W491-A567 PolarHBondContact NE1-O 3.01Å
492	F	71.2	Confident	75.1	Confident	1 Å²	1	98.1 Å²	98.1	0%	0.004	47%	0.47	C	S	.	.	T	Hydrogen-bonded Turn	trans	-91.5	5	-178.3	50.6	-99.4	0	0	0	114.1	H490 E494 L495 F503 K504 N507	H490-F492 HydrophobicContact CB-CD1 3.99Å; H490-F492 HydrophobicContact CB-CD2 3.99Å; H490-F492 HydrophobicContact CB-CE1 3.62Å; H490-F492 HydrophobicContact CB-CE2 3.62Å; H490-F492 HydrophobicContact CB-CG 4.17Å; H490-F492 HydrophobicContact CB-CZ 3.43Å; H490-F492 VanDerWaalsContact CB-CZ 3.43Å; H490-F492 AromaticContact CD2-CE2 3.83Å; H490-F492 AromaticContact CD2-CZ 3.59Å; H490-F492 AromaticContact CG-CE1 3.85Å; H490-F492 AromaticContact CG-CE2 3.85Å; H490-F492 AromaticContact CG-CZ 3.38Å; H490-F492 PolarHBondContact O-N 3.03Å; F492-E494 PolarHBondContact O-N 2.97Å; F492-E494 VanDerWaalsContact O-N 3.15Å; F492-L495 HydrophobicContact CB-CD1 3.75Å; F492-L495 HydrophobicContact CB-CG 4.46Å; F492-L495 WeakPolarHBondContact O-CB 2.96Å; F492-L495 PolarHBondContact O-N 3.26Å; F492-L495 VanDerWaalsContact O-N 3.1Å; F492-F503 HydrophobicContact CB-CB 3.77Å; F492-F503 HydrophobicContact CB-CD2 4.09Å; F492-F503 HydrophobicContact CB-CG 4Å; F492-F503 HydrophobicContact CD1-CB 3.62Å; F492-F503 HydrophobicContact CD1-CG 4.3Å; F492-F503 HydrophobicContact CD2-CB 3.8Å; F492-F503 HydrophobicContact CE1-CB 4.07Å; F492-F503 HydrophobicContact CE2-CB 4.23Å; F492-F503 HydrophobicContact CG-CB 3.46Å; F492-F503 VanDerWaalsContact CG-CB 3.46Å; F492-F503 HydrophobicContact CG-CG 4.18Å; F492-F503 HydrophobicContact CZ-CB 4.34Å; F492-K504 HydrophobicContact CE2-CB 4.28Å; F492-N507 HydrophobicContact CE1-CB 4.23Å; F492-N507 HydrophobicContact CZ-CB 4Å
493	D	69.9	Low	74.9	Confident	62 Å²	62	99.9 Å²	99.9	33%	0.332	48%	0.478	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.6	-14.7	178	-76.9	-14.8	0	0	0	113.5	H490	H490-D493 PolarHBondContact O-N 3.41Å
494	E	69.7	Low	74.7	Confident	177 Å²	177	98.1 Å²	98.1	83%	0.827	47%	0.47	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.2	-3.7	176.3	-66.5	-175.2	170.4	0	0	113.7	F492	F492-E494 PolarHBondContact O-N 2.97Å; F492-E494 VanDerWaalsContact O-N 3.15Å
495	L	76.8	Confident	74.9	Confident	60 Å²	60	98.5 Å²	98.5	31%	0.314	48%	0.477	S	S	.	.	S	Bend	trans	-85	153.2	-176.3	-69.5	174.6	0	0	0	113	W491 F492 A499 F503	W491-L495 HydrophobicContact CH2-CD1 4.44Å; W491-L495 HydrophobicContact CZ3-CD1 4.29Å; F492-L495 HydrophobicContact CB-CD1 3.75Å; F492-L495 HydrophobicContact CB-CG 4.46Å; F492-L495 WeakPolarHBondContact O-CB 2.96Å; F492-L495 PolarHBondContact O-N 3.26Å; F492-L495 VanDerWaalsContact O-N 3.1Å; L495-A499 HydrophobicContact CB-CB 4.12Å; L495-A499 HydrophobicContact CD1-CB 4.42Å; L495-F503 HydrophobicContact CD1-CD2 3.52Å; L495-F503 HydrophobicContact CD1-CE2 3.46Å; L495-F503 VanDerWaalsContact CD1-CE2 3.46Å; L495-F503 HydrophobicContact CD1-CZ 4.46Å
496	P	80.1	Confident	75.3	Confident	86 Å²	86	94.9 Å²	94.9	56%	0.558	46%	0.462	S	S	*	.			trans	-60.1	153.6	176.2	25.2	-34.4	0	0	0	111.9	T498 A499 L500	P496-T498 PolarHBondContact O-N 3.13Å; P496-A499 HydrophobicContact CG-CB 4.29Å; P496-A499 PolarHBondContact O-N 2.98Å; P496-L500 PolarHBondContact O-N 3.23Å
497	R	73.1	Confident	76.2	Confident	226 Å²	226	86.9 Å²	86.9	85%	0.853	43%	0.428	S	S	*	.	H	α-helix	trans	-52	-34.7	-168	-66.1	-159.8	-170.5	-162.3	5.8	114.9	L501	R497-L501 PolarHBondContact O-N 3.07Å
498	T	79.4	Confident	77.7	Confident	112 Å²	112	86.6 Å²	86.6	69%	0.687	43%	0.425	S	S	*	.	H	α-helix	trans	-67.6	-48.2	178.1	45.7	0	0	0	0	112	P496 L501 I502	P496-T498 PolarHBondContact O-N 3.13Å; T498-L501 PolarHBondContact O-N 2.72Å; T498-I502 PolarHBondContact O-N 2.97Å
499	A	80.3	Confident	79.4	Confident	22 Å²	22	84.5 Å²	84.5	18%	0.182	42%	0.423	C	S	.	.	H	α-helix	trans	-67.6	-38	176.8	0	0	0	0	0	111.8	L495 P496 L501 I502 F503	L495-A499 HydrophobicContact CB-CB 4.12Å; L495-A499 HydrophobicContact CD1-CB 4.42Å; P496-A499 HydrophobicContact CG-CB 4.29Å; P496-A499 PolarHBondContact O-N 2.98Å; A499-L501 VanDerWaalsContact C-N 3.27Å; A499-L501 PolarHBondContact O-N 2.97Å; A499-I502 WeakPolarHBondContact O-CB 3.45Å; A499-I502 PolarHBondContact O-N 2.85Å; A499-F503 WeakPolarHBondContact O-CD2 2.89Å; A499-F503 PolarHBondContact O-N 3.13Å
500	L	81.7	Confident	81	Confident	52 Å²	52	78.4 Å²	78.4	27%	0.272	40%	0.395	S	S	.	.	H	α-helix	trans	-57.5	-41.8	176	-168.5	158.1	0	0	0	111.4	P496 I502 F503 K504	P496-L500 PolarHBondContact O-N 3.23Å; L500-I502 VanDerWaalsContact C-N 3.34Å; L500-I502 PolarHBondContact O-N 3Å; L500-F503 PolarHBondContact O-N 3.44Å; L500-K504 HydrophobicContact CD2-CD 4.49Å; L500-K504 WeakPolarHBondContact O-CB 3.16Å; L500-K504 PolarHBondContact O-N 3.29Å
501	L	84.1	Confident	82.1	Confident	132 Å²	132	80.6 Å²	80.6	69%	0.691	40%	0.404	S	S	*	.	H	α-helix	trans	-66.1	-37.3	179.6	-148.5	138.1	0	0	0	112.1	R497 T498 A499 G505	R497-L501 PolarHBondContact O-N 3.07Å; T498-L501 PolarHBondContact O-N 2.72Å; A499-L501 VanDerWaalsContact C-N 3.27Å; A499-L501 PolarHBondContact O-N 2.97Å; L501-G505 PolarHBondContact O-N 3.33Å
502	I	86.4	Confident	83.1	Confident	106 Å²	106	76.8 Å²	76.8	54%	0.544	40%	0.395	S	S	.	.	H	α-helix	trans	-63.9	-54	174.6	-62.8	168.3	0	0	0	110.5	T498 A499 L500 K504 G505 I506	T498-I502 PolarHBondContact O-N 2.97Å; A499-I502 WeakPolarHBondContact O-CB 3.45Å; A499-I502 PolarHBondContact O-N 2.85Å; L500-I502 VanDerWaalsContact C-N 3.34Å; L500-I502 PolarHBondContact O-N 3Å; I502-K504 VanDerWaalsContact C-N 3.33Å; I502-K504 PolarHBondContact O-N 3.08Å; I502-G505 PolarHBondContact O-N 3.03Å; I502-G505 VanDerWaalsContact O-N 3.14Å; I502-I506 HydrophobicContact CG2-CD1 3.9Å; I502-I506 WeakPolarHBondContact O-CG1 3.41Å; I502-I506 PolarHBondContact O-N 3.5Å
503	F	85.3	Confident	84	Confident	44 Å²	44	84.1 Å²	84.1	19%	0.193	43%	0.427	C	S	.	.	H	α-helix	trans	-66.8	-33.6	-178.5	-73.9	-70.5	0	0	0	113	W491 F492 L495 A499 L500 G505 I506 N507 A567	W491-F503 HydrophobicContact CH2-CD1 4.29Å; W491-F503 AromaticContact CH2-CE1 3.76Å; W491-F503 HydrophobicContact CH2-CE1 3.76Å; W491-F503 HydrophobicContact CH2-CE2 4.23Å; W491-F503 AromaticContact CH2-CZ 3.73Å; W491-F503 HydrophobicContact CH2-CZ 3.73Å; W491-F503 AromaticContact CZ2-CD1 3.71Å; W491-F503 HydrophobicContact CZ2-CD1 3.71Å; W491-F503 AromaticContact CZ2-CE1 3.48Å; W491-F503 HydrophobicContact CZ2-CE1 3.48Å; W491-F503 VanDerWaalsContact CZ2-CE1 3.48Å; W491-F503 HydrophobicContact CZ2-CG 4.37Å; W491-F503 AromaticContact CZ2-CZ 3.96Å; W491-F503 HydrophobicContact CZ2-CZ 3.96Å; F492-F503 HydrophobicContact CB-CB 3.77Å; F492-F503 HydrophobicContact CB-CD2 4.09Å; F492-F503 HydrophobicContact CB-CG 4Å; F492-F503 HydrophobicContact CD1-CB 3.62Å; F492-F503 HydrophobicContact CD1-CG 4.3Å; F492-F503 HydrophobicContact CD2-CB 3.8Å; F492-F503 HydrophobicContact CE1-CB 4.07Å; F492-F503 HydrophobicContact CE2-CB 4.23Å; F492-F503 HydrophobicContact CG-CB 3.46Å; F492-F503 VanDerWaalsContact CG-CB 3.46Å; F492-F503 HydrophobicContact CG-CG 4.18Å; F492-F503 HydrophobicContact CZ-CB 4.34Å; L495-F503 HydrophobicContact CD1-CD2 3.52Å; L495-F503 HydrophobicContact CD1-CE2 3.46Å; L495-F503 VanDerWaalsContact CD1-CE2 3.46Å; L495-F503 HydrophobicContact CD1-CZ 4.46Å; A499-F503 WeakPolarHBondContact O-CD2 2.89Å; A499-F503 PolarHBondContact O-N 3.13Å; L500-F503 PolarHBondContact O-N 3.44Å; F503-G505 VanDerWaalsContact C-N 3.35Å; F503-I506 HydrophobicContact CD1-CD1 4.28Å; F503-I506 PolarHBondContact O-N 2.93Å; F503-N507 WeakPolarHBondContact O-CB 3.31Å; F503-N507 PolarHBondContact O-N 2.97Å; F503-A567 HydrophobicContact CD1-CB 4.33Å; F503-A567 HydrophobicContact CE1-CB 3.97Å
504	K	84.8	Confident	85.1	Confident	119 Å²	119	84.6 Å²	84.6	52%	0.517	44%	0.44	S	S	.	.	H	α-helix	trans	-63.1	-42	171.9	-169.4	173.5	-175.7	175.8	0	111.4	F492 L500 I502 N507 I508	F492-K504 HydrophobicContact CE2-CB 4.28Å; L500-K504 HydrophobicContact CD2-CD 4.49Å; L500-K504 WeakPolarHBondContact O-CB 3.16Å; L500-K504 PolarHBondContact O-N 3.29Å; I502-K504 VanDerWaalsContact C-N 3.33Å; I502-K504 PolarHBondContact O-N 3.08Å; K504-N507 PolarHBondContact O-N 3.11Å; K504-I508 HydrophobicContact CG-CD1 4.25Å; K504-I508 WeakPolarHBondContact O-CD1 3.18Å; K504-I508 VanDerWaalsContact O-CG1 3.27Å; K504-I508 WeakPolarHBondContact O-CG1 3.39Å; K504-I508 PolarHBondContact O-N 2.83Å
505	G	88.6	Confident	86.2	Confident	37 Å²	37	77.2 Å²	77.2	38%	0.381	41%	0.405	S	S	.	.	H	α-helix	trans	-61.2	-46.5	172.7	0	0	0	0	0	112.7	L501 I502 F503 N507 I508 L509	L501-G505 PolarHBondContact O-N 3.33Å; I502-G505 PolarHBondContact O-N 3.03Å; I502-G505 VanDerWaalsContact O-N 3.14Å; F503-G505 VanDerWaalsContact C-N 3.35Å; G505-N507 VanDerWaalsContact C-N 3.34Å; G505-N507 PolarHBondContact O-N 3.41Å; G505-I508 PolarHBondContact O-N 3.38Å; G505-L509 WeakPolarHBondContact O-CB 3.29Å; G505-L509 PolarHBondContact O-N 2.88Å
506	I	89.5	Confident	86.8	Confident	31 Å²	31	79 Å²	79	16%	0.159	41%	0.411	C	S	.	.	H	α-helix	trans	-61	-43.2	176.8	-64.4	168	0	0	0	110.8	I502 F503 L509 V510 L564 A567	I502-I506 HydrophobicContact CG2-CD1 3.9Å; I502-I506 WeakPolarHBondContact O-CG1 3.41Å; I502-I506 PolarHBondContact O-N 3.5Å; F503-I506 HydrophobicContact CD1-CD1 4.28Å; F503-I506 PolarHBondContact O-N 2.93Å; I506-L509 PolarHBondContact O-N 2.95Å; I506-V510 HydrophobicContact CG2-CG2 4.12Å; I506-V510 WeakPolarHBondContact O-CB 3.5Å; I506-V510 VanDerWaalsContact O-CG2 3.29Å; I506-V510 WeakPolarHBondContact O-CG2 3.47Å; I506-V510 PolarHBondContact O-N 2.88Å; I506-L564 HydrophobicContact CG2-CD2 4.23Å; I506-L564 WeakPolarHBondContact CG2-O 3.38Å; I506-A567 HydrophobicContact CG2-CB 4.45Å
507	N	89	Confident	87.4	Confident	9 Å²	9	82.1 Å²	82.1	5%	0.048	41%	0.413	C	S	.	.	H	α-helix	trans	-62.3	-45.3	178.1	-172.9	10.7	0	0	0	111.8	H490 F492 F503 K504 G505 L509 V510 K511 G568	H490-N507 PolarHBondContact CE1-ND2 3.18Å; H490-N507 PolarHBondContact ND1-ND2 3.21Å; H490-N507 PolarHBondContact NE2-ND2 3.2Å; F492-N507 HydrophobicContact CE1-CB 4.23Å; F492-N507 HydrophobicContact CZ-CB 4Å; F503-N507 WeakPolarHBondContact O-CB 3.31Å; F503-N507 PolarHBondContact O-N 2.97Å; K504-N507 PolarHBondContact O-N 3.11Å; G505-N507 VanDerWaalsContact C-N 3.34Å; G505-N507 PolarHBondContact O-N 3.41Å; N507-L509 VanDerWaalsContact C-N 3.33Å; N507-L509 PolarHBondContact O-N 3.45Å; N507-V510 PolarHBondContact O-N 2.97Å; N507-K511 WeakPolarHBondContact O-CB 3.28Å; N507-K511 WeakPolarHBondContact O-CG 3.31Å; N507-K511 PolarHBondContact O-N 2.79Å; N507-K511 VanDerWaalsContact OD1-CD 3.32Å; N507-K511 WeakPolarHBondContact OD1-CD 3.47Å; N507-K511 WeakPolarHBondContact OD1-CE 3.45Å; N507-G568 WeakPolarHBondContact CB-O 3.26Å
508	I	89.9	Confident	88.4	Confident	115 Å²	115	76.6 Å²	76.6	59%	0.59	40%	0.396	S	S	*	.	H	α-helix	trans	-60.8	-43.6	175.7	-67.2	164	0	0	0	110.8	K504 G505 S512	K504-I508 HydrophobicContact CG-CD1 4.25Å; K504-I508 WeakPolarHBondContact O-CD1 3.18Å; K504-I508 VanDerWaalsContact O-CG1 3.27Å; K504-I508 WeakPolarHBondContact O-CG1 3.39Å; K504-I508 PolarHBondContact O-N 2.83Å; G505-I508 PolarHBondContact O-N 3.38Å; I508-S512 PolarHBondContact O-N 2.85Å; I508-S512 VanDerWaalsContact O-N 3.15Å
509	L	92.3	Very high	89	Confident	86 Å²	86	71.9 Å²	71.9	45%	0.45	37%	0.366	S	S	.	.	H	α-helix	trans	-62.4	-50.4	178.2	-179.9	66	0	0	0	111.6	G505 I506 N507 K511 S512 F515	G505-L509 WeakPolarHBondContact O-CB 3.29Å; G505-L509 PolarHBondContact O-N 2.88Å; I506-L509 PolarHBondContact O-N 2.95Å; N507-L509 VanDerWaalsContact C-N 3.33Å; N507-L509 PolarHBondContact O-N 3.45Å; L509-K511 PolarHBondContact O-N 2.91Å; L509-S512 VanDerWaalsContact O-CB 3.28Å; L509-S512 WeakPolarHBondContact O-CB 3.4Å; L509-S512 PolarHBondContact O-N 3.43Å; L509-S512 VanDerWaalsContact O-N 3.15Å; L509-S512 PolarHBondContact O-OG 3.32Å; L509-F515 VanDerWaalsContact O-CB 3.3Å; L509-F515 WeakPolarHBondContact O-CB 3.36Å
510	V	91	Very high	89.6	Confident	6 Å²	6	73.6 Å²	73.6	4%	0.036	37%	0.368	C	S	.	.	H	α-helix	trans	-66.4	-37.3	-177	168	0	0	0	0	112.1	I506 N507 S512 F515 L564 K565 L569	I506-V510 HydrophobicContact CG2-CG2 4.12Å; I506-V510 WeakPolarHBondContact O-CB 3.5Å; I506-V510 VanDerWaalsContact O-CG2 3.29Å; I506-V510 WeakPolarHBondContact O-CG2 3.47Å; I506-V510 PolarHBondContact O-N 2.88Å; N507-V510 PolarHBondContact O-N 2.97Å; V510-S512 VanDerWaalsContact C-N 3.26Å; V510-S512 PolarHBondContact O-N 3.4Å; V510-F515 HydrophobicContact CG2-CE1 4.4Å; V510-L564 HydrophobicContact CG2-CB 4.18Å; V510-K565 HydrophobicContact CG1-CB 4.38Å; V510-K565 HydrophobicContact CG1-CG 3.78Å; V510-L569 HydrophobicContact CG1-CD1 4.19Å; V510-L569 HydrophobicContact CG1-CG 4.18Å
511	K	87.9	Confident	90.1	Very high	94 Å²	94	76.2 Å²	76.2	41%	0.409	38%	0.382	S	S	.	.	H	α-helix	trans	-76.2	-11.3	175.9	-71.7	-170.3	176.9	-171.3	0	113.1	N507 L509 L569	N507-K511 WeakPolarHBondContact O-CB 3.28Å; N507-K511 WeakPolarHBondContact O-CG 3.31Å; N507-K511 PolarHBondContact O-N 2.79Å; N507-K511 VanDerWaalsContact OD1-CD 3.32Å; N507-K511 WeakPolarHBondContact OD1-CD 3.47Å; N507-K511 WeakPolarHBondContact OD1-CE 3.45Å; L509-K511 PolarHBondContact O-N 2.91Å; K511-L569 HydrophobicContact CG-CD2 4.18Å
512	S	93.4	Very high	90.6	Very high	36 Å²	36	70.7 Å²	70.7	25%	0.252	35%	0.354	S	S	.	.	S	Bend	trans	-66.2	138.4	178.2	78.5	0	0	0	0	111.6	I508 L509 V510 A514 F515	I508-S512 PolarHBondContact O-N 2.85Å; I508-S512 VanDerWaalsContact O-N 3.15Å; L509-S512 VanDerWaalsContact O-CB 3.28Å; L509-S512 WeakPolarHBondContact O-CB 3.4Å; L509-S512 PolarHBondContact O-N 3.43Å; L509-S512 VanDerWaalsContact O-N 3.15Å; L509-S512 PolarHBondContact O-OG 3.32Å; V510-S512 VanDerWaalsContact C-N 3.26Å; V510-S512 PolarHBondContact O-N 3.4Å; S512-A514 PolarHBondContact O-N 2.87Å; S512-F515 PolarHBondContact O-N 2.83Å; S512-F515 WeakPolarHBondContact OG-CB 3.4Å; S512-F515 PolarHBondContact OG-N 2.99Å
513	K	90.4	Very high	90.9	Very high	154 Å²	154	65.8 Å²	65.8	67%	0.67	33%	0.329	S	S	*	.	H	α-helix	trans	-61.8	-32	174.6	-66	-174.7	179.5	-179.8	0	111.8	F515 Q516 Y517	K513-F515 PolarHBondContact O-N 2.93Å; K513-Q516 PolarHBondContact O-N 3.12Å; K513-Y517 HydrophobicContact CB-CD2 4.4Å; K513-Y517 HydrophobicContact CB-CE2 4.19Å; K513-Y517 WeakPolarHBondContact O-CD2 3.5Å; K513-Y517 PolarHBondContact O-N 3.15Å
514	A	93.2	Very high	91.3	Very high	73 Å²	73	65.7 Å²	65.7	60%	0.603	34%	0.336	S	S	*	.	H	α-helix	trans	-60.6	-43.8	178.1	0	0	0	0	0	112.2	S512 Q516 Y517 F518	S512-A514 PolarHBondContact O-N 2.87Å; A514-Q516 VanDerWaalsContact C-N 3.33Å; A514-Q516 PolarHBondContact O-N 2.87Å; A514-Y517 PolarHBondContact O-N 3.44Å; A514-F518 WeakPolarHBondContact O-CB 3.33Å; A514-F518 PolarHBondContact O-N 3.03Å
515	F	93.2	Very high	91.8	Very high	22 Å²	22	63.6 Å²	63.6	10%	0.096	33%	0.333	C	S	.	.	H	α-helix	trans	-61.3	-41	176.4	-179.9	-105	0	0	0	112	L509 V510 S512 K513 F518 M519 E561 K565	L509-F515 VanDerWaalsContact O-CB 3.3Å; L509-F515 WeakPolarHBondContact O-CB 3.36Å; V510-F515 HydrophobicContact CG2-CE1 4.4Å; S512-F515 PolarHBondContact O-N 2.83Å; S512-F515 WeakPolarHBondContact OG-CB 3.4Å; S512-F515 PolarHBondContact OG-N 2.99Å; K513-F515 PolarHBondContact O-N 2.93Å; F515-F518 PolarHBondContact O-N 3Å; F515-M519 HydrophobicContact CE1-CG 4.29Å; F515-M519 HydrophobicContact CE2-CG 4.42Å; F515-M519 HydrophobicContact CE2-SD 4.47Å; F515-M519 HydrophobicContact CZ-CG 4.17Å; F515-M519 HydrophobicContact CZ-SD 4.45Å; F515-M519 WeakPolarHBondContact O-CG 3.3Å; F515-M519 PolarHBondContact O-N 3.34Å; F515-E561 HydrophobicContact CE1-CG 4.34Å; F515-E561 HydrophobicContact CZ-CG 3.89Å; F515-K565 HydrophobicContact CE1-CG 4.15Å
516	Q	89.6	Confident	92	Very high	96 Å²	96	62.2 Å²	62.2	45%	0.449	32%	0.317	S	S	.	.	H	α-helix	trans	-63.4	-48.1	176.6	-63.6	179.8	-10.1	0	0	112.1	K513 A514 F518 M519 Y520	K513-Q516 PolarHBondContact O-N 3.12Å; A514-Q516 VanDerWaalsContact C-N 3.33Å; A514-Q516 PolarHBondContact O-N 2.87Å; Q516-F518 VanDerWaalsContact C-N 3.34Å; Q516-F518 PolarHBondContact O-N 2.88Å; Q516-M519 PolarHBondContact O-N 2.88Å; Q516-Y520 HydrophobicContact CB-CE2 4.42Å; Q516-Y520 WeakPolarHBondContact O-CD2 3.39Å; Q516-Y520 PolarHBondContact O-N 2.92Å
517	Y	91.9	Very high	92.1	Very high	153 Å²	153	61.4 Å²	61.4	60%	0.6	32%	0.316	S	S	*	.	H	α-helix	trans	-63.3	-38.8	177	-72.8	-61.6	0	0	0	112.7	K513 A514 M519 Y520 L521	K513-Y517 HydrophobicContact CB-CD2 4.4Å; K513-Y517 HydrophobicContact CB-CE2 4.19Å; K513-Y517 WeakPolarHBondContact O-CD2 3.5Å; K513-Y517 PolarHBondContact O-N 3.15Å; A514-Y517 PolarHBondContact O-N 3.44Å; Y517-M519 VanDerWaalsContact C-N 3.35Å; Y517-M519 PolarHBondContact O-N 3.4Å; Y517-Y520 HydrophobicContact CD1-CD2 4.41Å; Y517-Y520 PolarHBondContact O-N 3.34Å; Y517-L521 PolarHBondContact O-N 2.86Å
518	F	94.3	Very high	92.3	Very high	110 Å²	110	65.4 Å²	65.4	48%	0.482	34%	0.341	S	S	.	.	H	α-helix	trans	-58.4	-46.7	173.5	173.7	-100.3	0	0	0	111.4	A514 F515 Q516 Y520 L521 V522	A514-F518 WeakPolarHBondContact O-CB 3.33Å; A514-F518 PolarHBondContact O-N 3.03Å; F515-F518 PolarHBondContact O-N 3Å; Q516-F518 VanDerWaalsContact C-N 3.34Å; Q516-F518 PolarHBondContact O-N 2.88Å; F518-Y520 VanDerWaalsContact C-N 3.34Å; F518-Y520 PolarHBondContact O-N 3.16Å; F518-L521 WeakPolarHBondContact O-CB 3.24Å; F518-L521 PolarHBondContact O-N 3.42Å; F518-L521 VanDerWaalsContact O-N 3.17Å; F518-V522 HydrophobicContact CD1-CG2 4.3Å; F518-V522 HydrophobicContact CE1-CG2 3.83Å; F518-V522 HydrophobicContact CE2-CG2 4.19Å; F518-V522 HydrophobicContact CZ-CG2 3.77Å; F518-V522 WeakPolarHBondContact O-CG2 3.43Å; F518-V522 PolarHBondContact O-N 3.37Å
519	M	92.9	Very high	92.4	Very high	12 Å²	12	65 Å²	65	6%	0.059	33%	0.332	C	S	.	.	H	α-helix	trans	-64.4	-37.2	177.6	-68.4	-51.1	-51.4	0	0	112.7	F515 Q516 Y517 L521 V522 V523 I557 Y558 E561	F515-M519 HydrophobicContact CE1-CG 4.29Å; F515-M519 HydrophobicContact CE2-CG 4.42Å; F515-M519 HydrophobicContact CE2-SD 4.47Å; F515-M519 HydrophobicContact CZ-CG 4.17Å; F515-M519 HydrophobicContact CZ-SD 4.45Å; F515-M519 WeakPolarHBondContact O-CG 3.3Å; F515-M519 PolarHBondContact O-N 3.34Å; Q516-M519 PolarHBondContact O-N 2.88Å; Y517-M519 VanDerWaalsContact C-N 3.35Å; Y517-M519 PolarHBondContact O-N 3.4Å; M519-L521 VanDerWaalsContact C-N 3.35Å; M519-V522 PolarHBondContact O-N 2.88Å; M519-V523 WeakPolarHBondContact O-CG2 3.4Å; M519-V523 PolarHBondContact O-N 3.5Å; M519-I557 HydrophobicContact CE-CG2 4.28Å; M519-Y558 HydrophobicContact CE-CD1 3.9Å; M519-Y558 HydrophobicContact CE-CE1 4.12Å; M519-E561 HydrophobicContact CE-CB 3.8Å; M519-E561 VanDerWaalsContact CE-CD 3.46Å; M519-E561 HydrophobicContact CE-CG 3.66Å; M519-E561 VanDerWaalsContact CE-OE2 3.3Å; M519-E561 WeakPolarHBondContact CE-OE2 3.34Å; M519-E561 HydrophobicContact CG-CG 3.98Å; M519-E561 HydrophobicContact SD-CB 4.02Å; M519-E561 HydrophobicContact SD-CG 3.78Å
520	Y	91.7	Very high	92.2	Very high	59 Å²	59	61.6 Å²	61.6	23%	0.231	31%	0.314	C	S	.	.	H	α-helix	trans	-64	-39.9	172.8	-66.4	-46.6	0	0	0	112.5	Q516 Y517 F518 V523 A524 K620 L621	Q516-Y520 HydrophobicContact CB-CE2 4.42Å; Q516-Y520 WeakPolarHBondContact O-CD2 3.39Å; Q516-Y520 PolarHBondContact O-N 2.92Å; Y517-Y520 HydrophobicContact CD1-CD2 4.41Å; Y517-Y520 PolarHBondContact O-N 3.34Å; F518-Y520 VanDerWaalsContact C-N 3.34Å; F518-Y520 PolarHBondContact O-N 3.16Å; Y520-V523 PolarHBondContact O-N 3.21Å; Y520-A524 WeakPolarHBondContact O-CB 3.39Å; Y520-A524 PolarHBondContact O-N 3.37Å; Y520-K620 HydrophobicContact CE1-CB 4.41Å; Y520-L621 HydrophobicContact CD2-CD1 4.19Å; Y520-L621 HydrophobicContact CE2-CD1 4.23Å
521	L	93.7	Very high	92.2	Very high	107 Å²	107	65.7 Å²	65.7	56%	0.56	34%	0.335	S	S	*	.	H	α-helix	trans	-61.1	-44.9	174.1	-178.9	66.4	0	0	0	111.1	Y517 F518 M519 V523 A524 V525	Y517-L521 PolarHBondContact O-N 2.86Å; F518-L521 WeakPolarHBondContact O-CB 3.24Å; F518-L521 PolarHBondContact O-N 3.42Å; F518-L521 VanDerWaalsContact O-N 3.17Å; M519-L521 VanDerWaalsContact C-N 3.35Å; L521-V523 VanDerWaalsContact C-N 3.34Å; L521-V523 PolarHBondContact O-N 3.31Å; L521-A524 PolarHBondContact O-N 3.39Å; L521-V525 HydrophobicContact CD1-CG2 4.39Å; L521-V525 HydrophobicContact CG-CG2 4.47Å; L521-V525 WeakPolarHBondContact O-CG2 3.48Å; L521-V525 PolarHBondContact O-N 3.16Å
522	V	94.4	Very high	92.3	Very high	16 Å²	16	64.5 Å²	64.5	10%	0.097	34%	0.336	C	S	.	.	H	α-helix	trans	-58.5	-45	175.9	171.7	0	0	0	0	111.3	F518 M519 V525 N526 F554 I557 Y558	F518-V522 HydrophobicContact CD1-CG2 4.3Å; F518-V522 HydrophobicContact CE1-CG2 3.83Å; F518-V522 HydrophobicContact CE2-CG2 4.19Å; F518-V522 HydrophobicContact CZ-CG2 3.77Å; F518-V522 WeakPolarHBondContact O-CG2 3.43Å; F518-V522 PolarHBondContact O-N 3.37Å; M519-V522 PolarHBondContact O-N 2.88Å; V522-V525 PolarHBondContact O-N 2.99Å; V522-N526 WeakPolarHBondContact O-CB 3.26Å; V522-N526 PolarHBondContact O-N 3.21Å; V522-F554 HydrophobicContact CG1-CD1 4.12Å; V522-F554 HydrophobicContact CG1-CE1 4.37Å; V522-I557 HydrophobicContact CG1-CG2 3.95Å; V522-I557 HydrophobicContact CG2-CG2 4.48Å; V522-Y558 HydrophobicContact CG1-CE1 4.08Å
523	V	92.8	Very high	91.9	Very high	3 Å²	3	64.3 Å²	64.3	2%	0.018	33%	0.331	C	S	.	.	H	α-helix	trans	-63	-41.6	176.6	173.7	0	0	0	0	111.5	M519 Y520 L521 N526 G527 Y558 L615 R617 L618	M519-V523 WeakPolarHBondContact O-CG2 3.4Å; M519-V523 PolarHBondContact O-N 3.5Å; Y520-V523 PolarHBondContact O-N 3.21Å; L521-V523 VanDerWaalsContact C-N 3.34Å; L521-V523 PolarHBondContact O-N 3.31Å; V523-N526 PolarHBondContact O-N 3.5Å; V523-G527 PolarHBondContact O-N 3.48Å; V523-Y558 HydrophobicContact CG2-CE1 3.91Å; V523-L615 HydrophobicContact CG1-CD2 4.09Å; V523-L615 WeakPolarHBondContact O-CD2 3.49Å; V523-R617 HydrophobicContact CG1-CB 4.41Å; V523-R617 HydrophobicContact CG2-CB 4.27Å; V523-L618 HydrophobicContact CG1-CB 4.32Å
524	A	92.9	Very high	91.5	Very high	41 Å²	41	58.8 Å²	58.8	34%	0.339	31%	0.31	S	S	.	.	H	α-helix	trans	-64.2	-45.3	177.5	0	0	0	0	0	111.9	Y520 L521 N526 G527 V528	Y520-A524 WeakPolarHBondContact O-CB 3.39Å; Y520-A524 PolarHBondContact O-N 3.37Å; L521-A524 PolarHBondContact O-N 3.39Å; A524-N526 PolarHBondContact O-N 3.49Å; A524-G527 PolarHBondContact O-N 3.32Å; A524-V528 WeakPolarHBondContact O-CG2 3.45Å; A524-V528 PolarHBondContact O-N 3.43Å
525	V	95	Very high	91.2	Very high	76 Å²	76	61.5 Å²	61.5	46%	0.461	31%	0.308	S	S	.	.	H	α-helix	trans	-62	-42.7	176	173.1	0	0	0	0	110.9	L521 V522 G527 V528 W529 F554	L521-V525 HydrophobicContact CD1-CG2 4.39Å; L521-V525 HydrophobicContact CG-CG2 4.47Å; L521-V525 WeakPolarHBondContact O-CG2 3.48Å; L521-V525 PolarHBondContact O-N 3.16Å; V522-V525 PolarHBondContact O-N 2.99Å; V525-G527 VanDerWaalsContact C-N 3.33Å; V525-G527 PolarHBondContact O-N 3.27Å; V525-V528 PolarHBondContact O-N 3.02Å; V525-W529 WeakPolarHBondContact O-CB 3.38Å; V525-W529 PolarHBondContact O-N 3.11Å; V525-F554 HydrophobicContact CG1-CZ 4.26Å
526	N	93.1	Very high	90.7	Very high	7 Å²	7	67.9 Å²	67.9	4%	0.037	34%	0.34	C	S	.	.	H	α-helix	trans	-59.1	-44.1	173.9	-172.8	13.6	0	0	0	111.3	V522 V523 A524 V528 W529 I530 F554 Y558 Q614	V522-N526 WeakPolarHBondContact O-CB 3.26Å; V522-N526 PolarHBondContact O-N 3.21Å; V523-N526 PolarHBondContact O-N 3.5Å; A524-N526 PolarHBondContact O-N 3.49Å; N526-V528 PolarHBondContact O-N 2.93Å; N526-W529 WeakPolarHBondContact O-CB 3.36Å; N526-W529 PolarHBondContact O-N 3.22Å; N526-I530 VanDerWaalsContact O-CG1 3.31Å; N526-I530 WeakPolarHBondContact O-CG1 3.48Å; N526-I530 PolarHBondContact O-N 3.4Å; N526-F554 HydrophobicContact CB-CD1 3.71Å; N526-F554 HydrophobicContact CB-CD2 4.19Å; N526-F554 HydrophobicContact CB-CE1 3.65Å; N526-F554 HydrophobicContact CB-CE2 4.14Å; N526-F554 HydrophobicContact CB-CG 3.99Å; N526-F554 HydrophobicContact CB-CZ 3.88Å; N526-F554 WeakPolarHBondContact OD1-CD2 3.41Å; N526-Y558 PolarHBondContact ND2-OH 3.12Å; N526-Q614 PolarHBondContact ND2-OE1 3.42Å
527	G	91.8	Very high	90	Very high	15 Å²	15	65.4 Å²	65.4	16%	0.155	33%	0.33	C	S	.	.	H	α-helix	trans	-61.3	-45.4	177.3	0	0	0	0	0	113.5	V523 A524 V525 W529 I530 L531	V523-G527 PolarHBondContact O-N 3.48Å; A524-G527 PolarHBondContact O-N 3.32Å; V525-G527 VanDerWaalsContact C-N 3.33Å; V525-G527 PolarHBondContact O-N 3.27Å; G527-W529 VanDerWaalsContact C-N 3.33Å; G527-I530 PolarHBondContact O-N 3.23Å; G527-L531 WeakPolarHBondContact O-CB 3.21Å; G527-L531 PolarHBondContact O-N 3.4Å
528	V	93.4	Very high	88.5	Confident	92 Å²	92	66.5 Å²	66.5	56%	0.558	34%	0.338	S	S	*	.	H	α-helix	trans	-63.6	-41.4	174.8	175.3	0	0	0	0	110.7	A524 V525 N526 L531 V532	A524-V528 WeakPolarHBondContact O-CG2 3.45Å; A524-V528 PolarHBondContact O-N 3.43Å; V525-V528 PolarHBondContact O-N 3.02Å; N526-V528 PolarHBondContact O-N 2.93Å; V528-L531 PolarHBondContact O-N 2.87Å; V528-V532 HydrophobicContact CG1-CG2 4.31Å; V528-V532 WeakPolarHBondContact O-CG2 3.37Å; V528-V532 PolarHBondContact O-N 3.5Å
529	W	91.8	Very high	86.7	Confident	107 Å²	107	65.1 Å²	65.1	41%	0.405	36%	0.355	S	S	.	.	H	α-helix	trans	-61.4	-48.6	177.3	-173.2	-89.1	0	0	0	112	V525 N526 G527 L531 V532 E533 S550 F554	V525-W529 WeakPolarHBondContact O-CB 3.38Å; V525-W529 PolarHBondContact O-N 3.11Å; N526-W529 WeakPolarHBondContact O-CB 3.36Å; N526-W529 PolarHBondContact O-N 3.22Å; G527-W529 VanDerWaalsContact C-N 3.33Å; W529-L531 VanDerWaalsContact C-N 3.27Å; W529-L531 PolarHBondContact O-N 2.92Å; W529-V532 PolarHBondContact O-N 3.04Å; W529-E533 VanDerWaalsContact O-CB 3.27Å; W529-E533 WeakPolarHBondContact O-CB 3.27Å; W529-E533 PolarHBondContact O-N 3.22Å; W529-S550 VanDerWaalsContact NE1-CB 3.26Å; W529-S550 PolarHBondContact NE1-OG 2.88Å; W529-F554 HydrophobicContact CB-CE2 4.26Å; W529-F554 HydrophobicContact CB-CZ 4.48Å; W529-F554 HydrophobicContact CG-CE2 4.25Å
530	I	88.8	Confident	84.9	Confident	14 Å²	14	67.2 Å²	67.2	7%	0.072	38%	0.379	C	S	.	.	H	α-helix	trans	-57.1	-44.2	176.1	-68.6	170.5	0	0	0	109.9	N526 G527 E533 T534 R611	N526-I530 VanDerWaalsContact O-CG1 3.31Å; N526-I530 WeakPolarHBondContact O-CG1 3.48Å; N526-I530 PolarHBondContact O-N 3.4Å; G527-I530 PolarHBondContact O-N 3.23Å; I530-E533 PolarHBondContact O-N 3.29Å; I530-T534 HydrophobicContact CG2-CG2 4.46Å; I530-T534 VanDerWaalsContact O-CG2 3.32Å; I530-T534 WeakPolarHBondContact O-CG2 3.4Å; I530-T534 PolarHBondContact O-N 2.83Å; I530-T534 PolarHBondContact O-OG1 3.03Å; I530-R611 HydrophobicContact CD1-CG 4.27Å
531	L	89.8	Confident	83	Confident	93 Å²	93	68.6 Å²	68.6	49%	0.487	39%	0.391	S	S	.	.	H	α-helix	trans	-64.4	-44.3	179.4	-177.4	64.4	0	0	0	112.7	G527 V528 W529 T534 F535	G527-L531 WeakPolarHBondContact O-CB 3.21Å; G527-L531 PolarHBondContact O-N 3.4Å; V528-L531 PolarHBondContact O-N 2.87Å; W529-L531 VanDerWaalsContact C-N 3.27Å; W529-L531 PolarHBondContact O-N 2.92Å; L531-T534 PolarHBondContact O-N 2.93Å; L531-T534 PolarHBondContact O-OG1 2.9Å; L531-F535 HydrophobicContact CD1-CD2 4.08Å; L531-F535 HydrophobicContact CD1-CE2 3.55Å; L531-F535 HydrophobicContact CD1-CZ 4.32Å; L531-F535 HydrophobicContact CD2-CE2 4.35Å; L531-F535 HydrophobicContact CG-CD2 4.02Å; L531-F535 HydrophobicContact CG-CE2 3.74Å; L531-F535 WeakPolarHBondContact O-CD2 3.38Å; L531-F535 PolarHBondContact O-N 2.92Å; L531-F535 VanDerWaalsContact O-N 3.1Å
532	V	90.1	Very high	81.1	Confident	69 Å²	69	68.7 Å²	68.7	42%	0.418	39%	0.387	S	S	.	.	H	α-helix	trans	-65.2	-43.6	176.8	171.6	0	0	0	0	110.4	V528 W529 T534 F535 M536	V528-V532 HydrophobicContact CG1-CG2 4.31Å; V528-V532 WeakPolarHBondContact O-CG2 3.37Å; V528-V532 PolarHBondContact O-N 3.5Å; W529-V532 PolarHBondContact O-N 3.04Å; V532-T534 VanDerWaalsContact C-N 3.34Å; V532-T534 PolarHBondContact O-N 3.03Å; V532-F535 PolarHBondContact O-N 3.47Å; V532-M536 HydrophobicContact CG1-CE 4.47Å; V532-M536 HydrophobicContact CG1-CG 4.23Å; V532-M536 VanDerWaalsContact O-CG 3.29Å; V532-M536 WeakPolarHBondContact O-CG 3.27Å; V532-M536 PolarHBondContact O-N 3.44Å
533	E	85	Confident	79.3	Confident	32 Å²	32	76.5 Å²	76.5	15%	0.15	42%	0.42	C	S	.	.	H	α-helix	trans	-60	-43.6	176.6	-172.3	-179.2	-165.1	0	0	110.9	W529 I530 F535 M536 L537 P548 R611	W529-E533 VanDerWaalsContact O-CB 3.27Å; W529-E533 WeakPolarHBondContact O-CB 3.27Å; W529-E533 PolarHBondContact O-N 3.22Å; I530-E533 PolarHBondContact O-N 3.29Å; E533-F535 VanDerWaalsContact C-N 3.35Å; E533-F535 PolarHBondContact O-N 3.17Å; E533-M536 PolarHBondContact O-N 3.17Å; E533-L537 HydrophobicContact CG-CD1 3.68Å; E533-L537 HydrophobicContact CG-CG 4.12Å; E533-L537 VanDerWaalsContact O-CB 3.23Å; E533-L537 WeakPolarHBondContact O-CB 3.43Å; E533-L537 WeakPolarHBondContact O-CG 3.42Å; E533-L537 PolarHBondContact O-N 3.3Å; E533-P548 WeakPolarHBondContact OE1-CG 3.36Å; E533-R611 IonicContact OE1-NH1 3.52Å; E533-R611 IonicContact OE2-CZ 3.38Å; E533-R611 IonicContact OE2-NH1 3.57Å; E533-R611 PolarHBondContact OE2-NH1 3.48Å; E533-R611 IonicContact OE2-NH2 3.03Å; E533-R611 PolarHBondContact OE2-NH2 2.68Å
534	T	83.3	Confident	77.8	Confident	38 Å²	38	78.2 Å²	78.2	23%	0.233	43%	0.432	C	S	.	.	H	α-helix	trans	-65.5	-35	176.8	55.9	0	0	0	0	113.1	I530 L531 V532 K538 F542	I530-T534 HydrophobicContact CG2-CG2 4.46Å; I530-T534 VanDerWaalsContact O-CG2 3.32Å; I530-T534 WeakPolarHBondContact O-CG2 3.4Å; I530-T534 PolarHBondContact O-N 2.83Å; I530-T534 PolarHBondContact O-OG1 3.03Å; L531-T534 PolarHBondContact O-N 2.93Å; L531-T534 PolarHBondContact O-OG1 2.9Å; V532-T534 VanDerWaalsContact C-N 3.34Å; V532-T534 PolarHBondContact O-N 3.03Å; T534-K538 PolarHBondContact O-N 3.16Å; T534-F542 HydrophobicContact CG2-CE1 3.6Å; T534-F542 HydrophobicContact CG2-CZ 3.49Å; T534-F542 VanDerWaalsContact CG2-CZ 3.49Å
535	F	85.6	Confident	76.5	Confident	130 Å²	130	81.6 Å²	81.6	57%	0.57	44%	0.439	S	S	*	.	H	α-helix	trans	-68	-40.3	172.6	-79.6	-60	0	0	0	112.8	L531 V532 E533 L537 K538	L531-F535 HydrophobicContact CD1-CD2 4.08Å; L531-F535 HydrophobicContact CD1-CE2 3.55Å; L531-F535 HydrophobicContact CD1-CZ 4.32Å; L531-F535 HydrophobicContact CD2-CE2 4.35Å; L531-F535 HydrophobicContact CG-CD2 4.02Å; L531-F535 HydrophobicContact CG-CE2 3.74Å; L531-F535 WeakPolarHBondContact O-CD2 3.38Å; L531-F535 PolarHBondContact O-N 2.92Å; L531-F535 VanDerWaalsContact O-N 3.1Å; V532-F535 PolarHBondContact O-N 3.47Å; E533-F535 VanDerWaalsContact C-N 3.35Å; E533-F535 PolarHBondContact O-N 3.17Å; F535-L537 VanDerWaalsContact C-N 3.34Å; F535-K538 VanDerWaalsContact O-CB 3.29Å; F535-K538 WeakPolarHBondContact O-CB 3.42Å; F535-K538 PolarHBondContact O-N 3.38Å
536	M	83.7	Confident	75.4	Confident	156 Å²	156	85.3 Å²	85.3	77%	0.768	45%	0.451	S	S	*	.	H	α-helix	trans	-70.2	-32.1	177.2	-67.9	-64.1	171.9	0	0	112.1	V532 E533 K538	V532-M536 HydrophobicContact CG1-CE 4.47Å; V532-M536 HydrophobicContact CG1-CG 4.23Å; V532-M536 VanDerWaalsContact O-CG 3.29Å; V532-M536 WeakPolarHBondContact O-CG 3.27Å; V532-M536 PolarHBondContact O-N 3.44Å; E533-M536 PolarHBondContact O-N 3.17Å; M536-K538 VanDerWaalsContact C-N 3.31Å; M536-K538 PolarHBondContact O-N 2.96Å
537	L	74.8	Confident	74.7	Confident	44 Å²	44	86.9 Å²	86.9	23%	0.23	46%	0.461	C	S	.	.	T	Hydrogen-bonded Turn	trans	-89	13	179.5	-64.5	-176.6	0	0	0	113.9	E533 F535 G539 G540 N541	E533-L537 HydrophobicContact CG-CD1 3.68Å; E533-L537 HydrophobicContact CG-CG 4.12Å; E533-L537 VanDerWaalsContact O-CB 3.23Å; E533-L537 WeakPolarHBondContact O-CB 3.43Å; E533-L537 WeakPolarHBondContact O-CG 3.42Å; E533-L537 PolarHBondContact O-N 3.3Å; F535-L537 VanDerWaalsContact C-N 3.34Å; L537-G539 PolarHBondContact O-N 3.48Å; L537-G540 PolarHBondContact O-N 2.93Å; L537-N541 HydrophobicContact CD1-CB 4.04Å; L537-N541 HydrophobicContact CD2-CB 3.7Å; L537-N541 HydrophobicContact CG-CB 4.29Å
538	K	60.4	Low	74.4	Confident	175 Å²	175	87.8 Å²	87.8	76%	0.761	46%	0.464	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.5	38.4	179.8	-155.5	178.3	-177.6	-177	0	113.6	T534 F535 M536	T534-K538 PolarHBondContact O-N 3.16Å; F535-K538 VanDerWaalsContact O-CB 3.29Å; F535-K538 WeakPolarHBondContact O-CB 3.42Å; F535-K538 PolarHBondContact O-N 3.38Å; M536-K538 VanDerWaalsContact C-N 3.31Å; M536-K538 PolarHBondContact O-N 2.96Å
539	G	54.9	Low	74.1	Confident	81 Å²	81	92 Å²	92	84%	0.835	47%	0.47	S	S	*	.	T	Hydrogen-bonded Turn	trans	-157.2	3.3	178.8	0	0	0	0	0	116.4	L537	L537-G539 PolarHBondContact O-N 3.48Å
540	G	55.2	Low	74	Confident	56 Å²	56	87.3 Å²	87.3	58%	0.577	45%	0.453	S	S	*	.	T	Hydrogen-bonded Turn	trans	158.2	3.2	167	0	0	0	0	0	123.4	L537	L537-G540 PolarHBondContact O-N 2.93Å
541	N	53.3	Low	74	Confident	89 Å²	89	87 Å²	87	48%	0.476	45%	0.451	S	S	.	.			trans	-113.2	11.5	-164.2	-71.2	16.4	0	0	0	117.8	L537 F543 S544	L537-N541 HydrophobicContact CD1-CB 4.04Å; L537-N541 HydrophobicContact CD2-CB 3.7Å; L537-N541 HydrophobicContact CG-CB 4.29Å; N541-F543 PolarHBondContact O-N 3.34Å; N541-F543 VanDerWaalsContact O-N 3.1Å; N541-S544 PolarHBondContact O-N 3.06Å; N541-S544 VanDerWaalsContact O-N 3.15Å
542	F	54.1	Low	74.1	Confident	108 Å²	108	86 Å²	86	47%	0.474	45%	0.446	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.8	-22.6	171.2	-73.8	-74	0	0	0	113	T534 Y605	T534-F542 HydrophobicContact CG2-CE1 3.6Å; T534-F542 HydrophobicContact CG2-CZ 3.49Å; T534-F542 VanDerWaalsContact CG2-CZ 3.49Å; F542-Y605 WeakPolarHBondContact O-CE1 3.4Å; F542-Y605 PolarHBondContact O-OH 2.95Å
543	F	55.9	Low	74.3	Confident	181 Å²	181	85.7 Å²	85.7	79%	0.794	44%	0.444	S	S	*	.	T	Hydrogen-bonded Turn	trans	-108.6	16.2	179.9	-60.5	-77.3	0	0	0	113.4	N541 K545	N541-F543 PolarHBondContact O-N 3.34Å; N541-F543 VanDerWaalsContact O-N 3.1Å; F543-K545 PolarHBondContact O-N 3.46Å
544	S	61.6	Low	74.7	Confident	38 Å²	38	85.2 Å²	85.2	27%	0.266	44%	0.441	S	S	.	.			trans	-67.7	126.2	170.8	-168.8	0	0	0	0	108.7	N541 H546 Y605	N541-S544 PolarHBondContact O-N 3.06Å; N541-S544 VanDerWaalsContact O-N 3.15Å; S544-H546 PolarHBondContact O-N 3.03Å; S544-Y605 PolarHBondContact O-OH 3.14Å
545	K	64.4	Low	75.1	Confident	113 Å²	113	83.5 Å²	83.5	49%	0.491	43%	0.431	S	S	.	.	S	Bend	trans	-59.6	-12.6	175.8	-172.6	167.1	174	165.1	0	112.7	F543 V547 E602	F543-K545 PolarHBondContact O-N 3.46Å; K545-V547 PolarHBondContact O-N 3.02Å; K545-E602 VanDerWaalsContact CE-OE1 3.23Å; K545-E602 WeakPolarHBondContact CE-OE1 3.27Å; K545-E602 IonicContact NZ-OE1 3.46Å; K545-E602 PolarHBondContact NZ-OE1 3.44Å
546	H	73.4	Confident	75.5	Confident	154 Å²	154	81 Å²	81	71%	0.713	43%	0.426	S	S	*	.	S	Bend	trans	-79	116.9	177	-69.7	-67.2	0	0	0	112.1	S544 P548	S544-H546 PolarHBondContact O-N 3.03Å; H546-P548 WeakPolarHBondContact O-CD 3.19Å
547	V	78.4	Confident	76.1	Confident	40 Å²	40	76.2 Å²	76.2	24%	0.242	40%	0.403	C	S	.	.	P	Polyproline II helix	trans	-65.5	124.3	169.5	-177.1	0	0	0	0	109.3	K545 W549 Y551 L552 L594 L597	K545-V547 PolarHBondContact O-N 3.02Å; V547-W549 PolarHBondContact O-N 3.26Å; V547-Y551 HydrophobicContact CG1-CD1 3.64Å; V547-Y551 HydrophobicContact CG1-CE1 4.43Å; V547-Y551 HydrophobicContact CG1-CG 4.46Å; V547-L552 HydrophobicContact CG1-CD2 4.23Å; V547-L552 HydrophobicContact CG1-CG 4.27Å; V547-L594 HydrophobicContact CG1-CD1 4.38Å; V547-L594 HydrophobicContact CG2-CD1 4.42Å; V547-L597 HydrophobicContact CG2-CD2 3.26Å; V547-L597 HydrophobicContact CG2-CG 4.43Å
548	P	84.8	Confident	77	Confident	33 Å²	33	74.1 Å²	74.1	21%	0.214	39%	0.392	C	S	.	.	P	Polyproline II helix	trans	-60.3	133.9	175.1	-23.7	34.2	0	0	0	111.1	E533 H546 S550 Y551	E533-P548 WeakPolarHBondContact OE1-CG 3.36Å; H546-P548 WeakPolarHBondContact O-CD 3.19Å; P548-S550 PolarHBondContact O-N 3.01Å; P548-Y551 WeakPolarHBondContact O-CB 3.3Å; P548-Y551 PolarHBondContact O-N 3.26Å
549	W	87.6	Confident	78.7	Confident	182 Å²	182	66.6 Å²	66.6	69%	0.689	36%	0.364	S	S	*	.	H	α-helix	trans	-58.5	-33.3	176.6	69.9	-83.7	0	0	0	112.1	V547 Y551 L552 V553	V547-W549 PolarHBondContact O-N 3.26Å; W549-Y551 VanDerWaalsContact C-N 3.27Å; W549-Y551 PolarHBondContact O-N 2.96Å; W549-L552 WeakPolarHBondContact O-CB 3.27Å; W549-L552 PolarHBondContact O-N 3.43Å; W549-L552 VanDerWaalsContact O-N 3.15Å; W549-V553 HydrophobicContact CE3-CG2 3.87Å; W549-V553 HydrophobicContact CZ3-CG2 4.06Å; W549-V553 WeakPolarHBondContact O-CG2 3.4Å; W549-V553 PolarHBondContact O-N 3.24Å; W549-V553 VanDerWaalsContact O-N 3.08Å
550	S	89.8	Confident	80.6	Confident	7 Å²	7	66.9 Å²	66.9	5%	0.049	35%	0.35	C	S	.	.	H	α-helix	trans	-57.4	-39.1	174.6	56.1	0	0	0	0	112.1	W529 P548 L552 V553 F554	W529-S550 VanDerWaalsContact NE1-CB 3.26Å; W529-S550 PolarHBondContact NE1-OG 2.88Å; P548-S550 PolarHBondContact O-N 3.01Å; S550-L552 PolarHBondContact O-N 3.05Å; S550-V553 PolarHBondContact O-N 3.5Å; S550-F554 WeakPolarHBondContact O-CD2 3.39Å; S550-F554 PolarHBondContact O-N 3.44Å
551	Y	88.6	Confident	82.4	Confident	8 Å²	8	64.7 Å²	64.7	3%	0.031	33%	0.325	C	S	.	.	H	α-helix	trans	-64.1	-41.2	177.4	175.8	-105.1	0	0	0	111.6	V547 P548 W549 V553 F554 L555 V608 R611	V547-Y551 HydrophobicContact CG1-CD1 3.64Å; V547-Y551 HydrophobicContact CG1-CE1 4.43Å; V547-Y551 HydrophobicContact CG1-CG 4.46Å; P548-Y551 WeakPolarHBondContact O-CB 3.3Å; P548-Y551 PolarHBondContact O-N 3.26Å; W549-Y551 VanDerWaalsContact C-N 3.27Å; W549-Y551 PolarHBondContact O-N 2.96Å; Y551-V553 VanDerWaalsContact C-N 3.33Å; Y551-V553 PolarHBondContact O-N 2.84Å; Y551-F554 PolarHBondContact O-N 3.11Å; Y551-L555 HydrophobicContact CE1-CD2 4.13Å; Y551-L555 VanDerWaalsContact O-CB 3.23Å; Y551-L555 WeakPolarHBondContact O-CB 3.31Å; Y551-L555 PolarHBondContact O-N 3.12Å; Y551-V608 HydrophobicContact CE1-CG1 4.35Å; Y551-R611 HydrophobicContact CD2-CB 4.19Å; Y551-R611 HydrophobicContact CE2-CB 3.97Å
552	L	90.8	Very high	84.4	Confident	73 Å²	73	61.9 Å²	61.9	38%	0.382	31%	0.309	S	S	.	.	H	α-helix	trans	-63	-40.1	175.2	-61.7	176	0	0	0	111.5	V547 W549 S550 T556 L594	V547-L552 HydrophobicContact CG1-CD2 4.23Å; V547-L552 HydrophobicContact CG1-CG 4.27Å; W549-L552 WeakPolarHBondContact O-CB 3.27Å; W549-L552 PolarHBondContact O-N 3.43Å; W549-L552 VanDerWaalsContact O-N 3.15Å; S550-L552 PolarHBondContact O-N 3.05Å; L552-T556 WeakPolarHBondContact O-CB 3.28Å; L552-T556 VanDerWaalsContact O-CG2 3.28Å; L552-T556 WeakPolarHBondContact O-CG2 3.45Å; L552-T556 PolarHBondContact O-N 3.12Å; L552-T556 PolarHBondContact O-OG1 3.32Å; L552-L594 HydrophobicContact CD2-CD1 3.76Å; L552-L594 HydrophobicContact CD2-CD2 3.55Å; L552-L594 HydrophobicContact CD2-CG 4.33Å
553	V	94	Very high	86.3	Confident	62 Å²	62	63.6 Å²	63.6	38%	0.376	32%	0.317	S	S	.	.	H	α-helix	trans	-62.9	-50.1	176.9	174.6	0	0	0	0	111.1	W549 S550 Y551 L555 T556 I557	W549-V553 HydrophobicContact CE3-CG2 3.87Å; W549-V553 HydrophobicContact CZ3-CG2 4.06Å; W549-V553 WeakPolarHBondContact O-CG2 3.4Å; W549-V553 PolarHBondContact O-N 3.24Å; W549-V553 VanDerWaalsContact O-N 3.08Å; S550-V553 PolarHBondContact O-N 3.5Å; Y551-V553 VanDerWaalsContact C-N 3.33Å; Y551-V553 PolarHBondContact O-N 2.84Å; V553-L555 PolarHBondContact O-N 3.17Å; V553-T556 PolarHBondContact O-N 3.41Å; V553-T556 PolarHBondContact O-OG1 3.18Å; V553-I557 HydrophobicContact CG1-CD1 4.04Å; V553-I557 VanDerWaalsContact O-CG1 3.29Å; V553-I557 WeakPolarHBondContact O-CG1 3.4Å; V553-I557 PolarHBondContact O-N 2.65Å; V553-I557 VanDerWaalsContact O-N 3.11Å
554	F	93.9	Very high	88	Confident	22 Å²	22	57 Å²	57	10%	0.096	29%	0.289	C	S	.	.	H	α-helix	trans	-66.5	-39.8	179	-70.8	-65.1	0	0	0	112.5	V522 V525 N526 W529 S550 Y551 T556 I557 Y558	V522-F554 HydrophobicContact CG1-CD1 4.12Å; V522-F554 HydrophobicContact CG1-CE1 4.37Å; V525-F554 HydrophobicContact CG1-CZ 4.26Å; N526-F554 HydrophobicContact CB-CD1 3.71Å; N526-F554 HydrophobicContact CB-CD2 4.19Å; N526-F554 HydrophobicContact CB-CE1 3.65Å; N526-F554 HydrophobicContact CB-CE2 4.14Å; N526-F554 HydrophobicContact CB-CG 3.99Å; N526-F554 HydrophobicContact CB-CZ 3.88Å; N526-F554 WeakPolarHBondContact OD1-CD2 3.41Å; W529-F554 HydrophobicContact CB-CE2 4.26Å; W529-F554 HydrophobicContact CB-CZ 4.48Å; W529-F554 HydrophobicContact CG-CE2 4.25Å; S550-F554 WeakPolarHBondContact O-CD2 3.39Å; S550-F554 PolarHBondContact O-N 3.44Å; Y551-F554 PolarHBondContact O-N 3.11Å; F554-T556 PolarHBondContact O-N 3.35Å; F554-I557 PolarHBondContact O-N 3.49Å; F554-Y558 HydrophobicContact CB-CE2 4.02Å; F554-Y558 WeakPolarHBondContact O-CD2 3.4Å; F554-Y558 PolarHBondContact O-N 2.96Å
555	L	92.6	Very high	89.5	Confident	2 Å²	2	56.5 Å²	56.5	1%	0.01	28%	0.283	C	S	.	.	H	α-helix	trans	-63.3	-40.4	178	-178.3	59.2	0	0	0	112.2	Y551 V553 Y558 G559 T587 A590 F591 L594	Y551-L555 HydrophobicContact CE1-CD2 4.13Å; Y551-L555 VanDerWaalsContact O-CB 3.23Å; Y551-L555 WeakPolarHBondContact O-CB 3.31Å; Y551-L555 PolarHBondContact O-N 3.12Å; V553-L555 PolarHBondContact O-N 3.17Å; L555-Y558 PolarHBondContact O-N 3.48Å; L555-G559 PolarHBondContact O-N 3.32Å; L555-T587 HydrophobicContact CD1-CG2 4.44Å; L555-A590 HydrophobicContact CD1-CB 3.62Å; L555-F591 HydrophobicContact CD1-CD2 3.95Å; L555-F591 HydrophobicContact CD1-CE2 3.84Å; L555-F591 HydrophobicContact CD1-CG 4.37Å; L555-F591 HydrophobicContact CD1-CZ 4.18Å; L555-F591 HydrophobicContact CD2-CD1 4.14Å; L555-F591 HydrophobicContact CD2-CE1 4.19Å; L555-F591 HydrophobicContact CD2-CG 4.42Å; L555-F591 HydrophobicContact CG-CD1 4.38Å; L555-F591 HydrophobicContact CG-CD2 4.42Å; L555-F591 HydrophobicContact CG-CE1 4.07Å; L555-F591 HydrophobicContact CG-CE2 4.1Å; L555-F591 HydrophobicContact CG-CZ 3.91Å; L555-L594 HydrophobicContact CD2-CB 4.32Å; L555-L594 HydrophobicContact CD2-CD2 3.78Å
556	T	94.1	Very high	90.8	Very high	78 Å²	78	53.1 Å²	53.1	48%	0.479	27%	0.271	S	S	.	.	H	α-helix	trans	-65.7	-40.9	175.6	49.3	0	0	0	0	111.7	L552 V553 F554 Y558 G559 V560	L552-T556 WeakPolarHBondContact O-CB 3.28Å; L552-T556 VanDerWaalsContact O-CG2 3.28Å; L552-T556 WeakPolarHBondContact O-CG2 3.45Å; L552-T556 PolarHBondContact O-N 3.12Å; L552-T556 PolarHBondContact O-OG1 3.32Å; V553-T556 PolarHBondContact O-N 3.41Å; V553-T556 PolarHBondContact O-OG1 3.18Å; F554-T556 PolarHBondContact O-N 3.35Å; T556-Y558 PolarHBondContact O-N 3.36Å; T556-G559 PolarHBondContact O-N 3.03Å; T556-V560 WeakPolarHBondContact O-CG2 3.13Å; T556-V560 PolarHBondContact O-N 3.04Å
557	I	95.4	Very high	91.5	Very high	55 Å²	55	46.3 Å²	46.3	28%	0.282	24%	0.241	S	C	.	.	H	α-helix	trans	-59.1	-46.9	173.9	-64.8	164.1	0	0	0	111	M519 V522 V553 F554 G559 V560 E561	M519-I557 HydrophobicContact CE-CG2 4.28Å; V522-I557 HydrophobicContact CG1-CG2 3.95Å; V522-I557 HydrophobicContact CG2-CG2 4.48Å; V553-I557 HydrophobicContact CG1-CD1 4.04Å; V553-I557 VanDerWaalsContact O-CG1 3.29Å; V553-I557 WeakPolarHBondContact O-CG1 3.4Å; V553-I557 PolarHBondContact O-N 2.65Å; V553-I557 VanDerWaalsContact O-N 3.11Å; F554-I557 PolarHBondContact O-N 3.49Å; I557-G559 PolarHBondContact O-N 3.05Å; I557-V560 PolarHBondContact O-N 3.07Å; I557-E561 WeakPolarHBondContact O-CB 3.29Å; I557-E561 PolarHBondContact O-N 3.5Å
558	Y	94.4	Very high	92	Very high	0 Å²	0	44.4 Å²	44.4	0%	0	23%	0.23	C	C	.	.	H	α-helix	trans	-66.6	-34.9	177.3	-61.4	-43.9	0	0	0	113	M519 V522 V523 N526 F554 L555 T556 L562 Q614 R617	M519-Y558 HydrophobicContact CE-CD1 3.9Å; M519-Y558 HydrophobicContact CE-CE1 4.12Å; V522-Y558 HydrophobicContact CG1-CE1 4.08Å; V523-Y558 HydrophobicContact CG2-CE1 3.91Å; N526-Y558 PolarHBondContact ND2-OH 3.12Å; F554-Y558 HydrophobicContact CB-CE2 4.02Å; F554-Y558 WeakPolarHBondContact O-CD2 3.4Å; F554-Y558 PolarHBondContact O-N 2.96Å; L555-Y558 PolarHBondContact O-N 3.48Å; T556-Y558 PolarHBondContact O-N 3.36Å; Y558-L562 VanDerWaalsContact O-CB 3.32Å; Y558-L562 WeakPolarHBondContact O-CB 3.24Å; Y558-L562 PolarHBondContact O-N 2.81Å; Y558-Q614 HydrophobicContact CE2-CB 4.43Å; Y558-Q614 HydrophobicContact CE2-CG 4.47Å; Y558-R617 VanDerWaalsContact CD1-NH1 3.31Å
559	G	94.4	Very high	92	Very high	17 Å²	17	44.2 Å²	44.2	18%	0.175	23%	0.227	C	C	.	.	H	α-helix	trans	-64.1	-44.1	174.1	0	0	0	0	0	112.5	L555 T556 I557 L562 F563	L555-G559 PolarHBondContact O-N 3.32Å; T556-G559 PolarHBondContact O-N 3.03Å; I557-G559 PolarHBondContact O-N 3.05Å; G559-L562 PolarHBondContact O-N 3.34Å; G559-F563 PolarHBondContact O-N 2.99Å
560	V	95.4	Very high	92	Very high	87 Å²	87	35.6 Å²	35.6	53%	0.527	20%	0.195	S	C	.	.	H	α-helix	trans	-66	-44	176.4	172.8	0	0	0	0	111	T556 I557 L562 F563 L564	T556-V560 WeakPolarHBondContact O-CG2 3.13Å; T556-V560 PolarHBondContact O-N 3.04Å; I557-V560 PolarHBondContact O-N 3.07Å; V560-L562 VanDerWaalsContact C-N 3.33Å; V560-L562 PolarHBondContact O-N 3.43Å; V560-F563 PolarHBondContact O-N 2.89Å; V560-L564 HydrophobicContact CG1-CD1 3.9Å; V560-L564 HydrophobicContact CG1-CG 4.29Å; V560-L564 WeakPolarHBondContact O-CB 3.49Å; V560-L564 VanDerWaalsContact O-CG 3.31Å; V560-L564 WeakPolarHBondContact O-CG 3.26Å; V560-L564 PolarHBondContact O-N 2.93Å
561	E	94.4	Very high	91.8	Very high	10 Å²	10	38.5 Å²	38.5	5%	0.047	21%	0.213	C	C	.	.	H	α-helix	trans	-53.6	-49.9	173.4	179.3	-143.4	173.6	0	0	111.5	F515 M519 I557 F563 L564 K565 R617	F515-E561 HydrophobicContact CE1-CG 4.34Å; F515-E561 HydrophobicContact CZ-CG 3.89Å; M519-E561 HydrophobicContact CE-CB 3.8Å; M519-E561 VanDerWaalsContact CE-CD 3.46Å; M519-E561 HydrophobicContact CE-CG 3.66Å; M519-E561 VanDerWaalsContact CE-OE2 3.3Å; M519-E561 WeakPolarHBondContact CE-OE2 3.34Å; M519-E561 HydrophobicContact CG-CG 3.98Å; M519-E561 HydrophobicContact SD-CB 4.02Å; M519-E561 HydrophobicContact SD-CG 3.78Å; I557-E561 WeakPolarHBondContact O-CB 3.29Å; I557-E561 PolarHBondContact O-N 3.5Å; E561-F563 PolarHBondContact O-N 3.44Å; E561-L564 PolarHBondContact O-N 3.34Å; E561-K565 HydrophobicContact CG-CD 4.27Å; E561-K565 WeakPolarHBondContact O-CB 3.23Å; E561-K565 WeakPolarHBondContact O-CG 3.23Å; E561-K565 PolarHBondContact O-N 3.08Å; E561-K565 WeakPolarHBondContact OE1-CE 3.46Å; E561-K565 IonicContact OE1-NZ 2.72Å; E561-K565 PolarHBondContact OE1-NZ 3.21Å; E561-R617 IonicContact OE2-NH1 3.76Å; E561-R617 PolarHBondContact OE2-NH1 3.18Å
562	L	94.3	Very high	91.6	Very high	29 Å²	29	44.1 Å²	44.1	15%	0.152	25%	0.249	C	C	.	.	H	α-helix	trans	-60	-47.2	179.9	-178.5	157.5	0	0	0	111.1	Y558 G559 V560 K565 V566 F584 T587	Y558-L562 VanDerWaalsContact O-CB 3.32Å; Y558-L562 WeakPolarHBondContact O-CB 3.24Å; Y558-L562 PolarHBondContact O-N 2.81Å; G559-L562 PolarHBondContact O-N 3.34Å; V560-L562 VanDerWaalsContact C-N 3.33Å; V560-L562 PolarHBondContact O-N 3.43Å; L562-K565 PolarHBondContact O-N 3.12Å; L562-V566 HydrophobicContact CD2-CG2 4.23Å; L562-V566 WeakPolarHBondContact O-CB 3.48Å; L562-V566 VanDerWaalsContact O-CG2 3.28Å; L562-V566 WeakPolarHBondContact O-CG2 3.33Å; L562-V566 PolarHBondContact O-N 3.16Å; L562-F584 HydrophobicContact CD1-CB 4.28Å; L562-F584 HydrophobicContact CD1-CD2 3.75Å; L562-F584 HydrophobicContact CD1-CG 4.39Å; L562-F584 HydrophobicContact CD2-CD2 4.13Å; L562-F584 HydrophobicContact CD2-CE2 4.46Å; L562-F584 HydrophobicContact CG-CD2 4.17Å; L562-T587 HydrophobicContact CD1-CG2 3.9Å
563	F	93.8	Very high	91.3	Very high	144 Å²	144	44.7 Å²	44.7	63%	0.632	25%	0.249	S	C	*	.	H	α-helix	trans	-61.2	-46.2	178.1	-175.9	-97.9	0	0	0	111.7	G559 V560 E561 K565 V566 A567	G559-F563 PolarHBondContact O-N 2.99Å; V560-F563 PolarHBondContact O-N 2.89Å; E561-F563 PolarHBondContact O-N 3.44Å; F563-K565 PolarHBondContact O-N 3.27Å; F563-V566 PolarHBondContact O-N 2.91Å; F563-A567 WeakPolarHBondContact O-CB 3.36Å; F563-A567 PolarHBondContact O-N 3.11Å
564	L	92.9	Very high	91.1	Very high	42 Å²	42	41.8 Å²	41.8	22%	0.22	23%	0.232	C	C	.	.	H	α-helix	trans	-60.8	-44.7	177.2	-71.9	173	0	0	0	111.8	I506 V510 V560 E561 A567 G568	I506-L564 HydrophobicContact CG2-CD2 4.23Å; I506-L564 WeakPolarHBondContact CG2-O 3.38Å; V510-L564 HydrophobicContact CG2-CB 4.18Å; V560-L564 HydrophobicContact CG1-CD1 3.9Å; V560-L564 HydrophobicContact CG1-CG 4.29Å; V560-L564 WeakPolarHBondContact O-CB 3.49Å; V560-L564 VanDerWaalsContact O-CG 3.31Å; V560-L564 WeakPolarHBondContact O-CG 3.26Å; V560-L564 PolarHBondContact O-N 2.93Å; E561-L564 PolarHBondContact O-N 3.34Å; L564-A567 PolarHBondContact O-N 3.19Å; L564-G568 PolarHBondContact O-N 3.1Å
565	K	91.5	Very high	90.8	Very high	29 Å²	29	44.9 Å²	44.9	13%	0.126	25%	0.249	C	C	.	.	H	α-helix	trans	-65	-45.1	179	-78.7	-177.5	172.8	175.2	0	112.6	V510 F515 E561 L562 F563 A567 G568 L569 Y574	V510-K565 HydrophobicContact CG1-CB 4.38Å; V510-K565 HydrophobicContact CG1-CG 3.78Å; F515-K565 HydrophobicContact CE1-CG 4.15Å; E561-K565 HydrophobicContact CG-CD 4.27Å; E561-K565 WeakPolarHBondContact O-CB 3.23Å; E561-K565 WeakPolarHBondContact O-CG 3.23Å; E561-K565 PolarHBondContact O-N 3.08Å; E561-K565 WeakPolarHBondContact OE1-CE 3.46Å; E561-K565 IonicContact OE1-NZ 2.72Å; E561-K565 PolarHBondContact OE1-NZ 3.21Å; L562-K565 PolarHBondContact O-N 3.12Å; F563-K565 PolarHBondContact O-N 3.27Å; K565-A567 VanDerWaalsContact C-N 3.33Å; K565-G568 PolarHBondContact O-N 2.88Å; K565-L569 WeakPolarHBondContact O-CB 3.21Å; K565-L569 PolarHBondContact O-N 3Å; K565-Y574 HydrophobicContact CB-CD2 3.77Å; K565-Y574 HydrophobicContact CB-CE2 3.56Å; K565-Y574 HydrophobicContact CD-CE2 3.98Å; K565-Y574 HydrophobicContact CG-CE2 4.41Å
566	V	91.9	Very high	90.3	Very high	41 Å²	41	49.3 Å²	49.3	25%	0.248	28%	0.279	C	S	.	.	H	α-helix	trans	-64.8	-40	178.2	172.8	0	0	0	0	110.7	L562 F563 G570 P571 Y574	L562-V566 HydrophobicContact CD2-CG2 4.23Å; L562-V566 WeakPolarHBondContact O-CB 3.48Å; L562-V566 VanDerWaalsContact O-CG2 3.28Å; L562-V566 WeakPolarHBondContact O-CG2 3.33Å; L562-V566 PolarHBondContact O-N 3.16Å; F563-V566 PolarHBondContact O-N 2.91Å; V566-G570 CarbonylContact O-C 3.4Å; V566-G570 WeakPolarHBondContact O-CA 3.24Å; V566-G570 PolarHBondContact O-N 3.4Å; V566-P571 HydrophobicContact CG1-CB 4.39Å; V566-Y574 HydrophobicContact CG2-CD1 3.79Å; V566-Y574 HydrophobicContact CG2-CD2 4.09Å; V566-Y574 HydrophobicContact CG2-CE1 3.96Å; V566-Y574 HydrophobicContact CG2-CE2 4.22Å; V566-Y574 HydrophobicContact CG2-CG 3.87Å
567	A	89.4	Confident	89.8	Confident	11 Å²	11	47.6 Å²	47.6	9%	0.091	27%	0.271	C	S	.	.	H	α-helix	trans	-67.7	-43	175.4	0	0	0	0	0	112.9	W491 F503 I506 F563 L564 K565	W491-A567 WeakPolarHBondContact CZ2-O 3.4Å; W491-A567 PolarHBondContact NE1-O 3.01Å; F503-A567 HydrophobicContact CD1-CB 4.33Å; F503-A567 HydrophobicContact CE1-CB 3.97Å; I506-A567 HydrophobicContact CG2-CB 4.45Å; F563-A567 WeakPolarHBondContact O-CB 3.36Å; F563-A567 PolarHBondContact O-N 3.11Å; L564-A567 PolarHBondContact O-N 3.19Å; K565-A567 VanDerWaalsContact C-N 3.33Å
568	G	87.3	Confident	89.2	Confident	0 Å²	0	47.7 Å²	47.7	0%	0	29%	0.286	C	S	.	.	H	α-helix	trans	-75.6	-43	-175	0	0	0	0	0	114.6	N507 L564 K565	N507-G568 WeakPolarHBondContact CB-O 3.26Å; L564-G568 PolarHBondContact O-N 3.1Å; K565-G568 PolarHBondContact O-N 2.88Å
569	L	85.1	Confident	88.8	Confident	29 Å²	29	50 Å²	50	15%	0.152	29%	0.294	C	S	.	.	H	α-helix	trans	-89.9	-26.3	179.7	-62.6	166.6	0	0	0	111.9	V510 K511 K565 E573 Y574	V510-L569 HydrophobicContact CG1-CD1 4.19Å; V510-L569 HydrophobicContact CG1-CG 4.18Å; K511-L569 HydrophobicContact CG-CD2 4.18Å; K565-L569 WeakPolarHBondContact O-CB 3.21Å; K565-L569 PolarHBondContact O-N 3Å; L569-E573 HydrophobicContact CB-CB 4.42Å; L569-E573 WeakPolarHBondContact O-CB 3.32Å; L569-Y574 HydrophobicContact CD1-CD2 4.44Å
570	G	86.9	Confident	88.6	Confident	2 Å²	2	50.5 Å²	50.5	2%	0.021	29%	0.293	C	S	.	.			trans	87.2	151.2	-169.5	0	0	0	0	0	112.2	V566 V572 E573 Y574	V566-G570 CarbonylContact O-C 3.4Å; V566-G570 WeakPolarHBondContact O-CA 3.24Å; V566-G570 PolarHBondContact O-N 3.4Å; G570-V572 VanDerWaalsContact C-N 3.28Å; G570-V572 PolarHBondContact O-N 2.99Å; G570-E573 PolarHBondContact O-N 3.19Å; G570-Y574 WeakPolarHBondContact O-CB 3.47Å; G570-Y574 PolarHBondContact O-N 3.23Å
571	P	87	Confident	88.3	Confident	67 Å²	67	50.4 Å²	50.4	44%	0.435	29%	0.289	S	S	.	.	H	α-helix	trans	-63.3	-31.8	-173.4	21.3	-30.9	0	0	0	113.2	V566 L575	V566-P571 HydrophobicContact CG1-CB 4.39Å; P571-L575 VanDerWaalsContact O-CB 3.31Å; P571-L575 WeakPolarHBondContact O-CB 3.45Å; P571-L575 VanDerWaalsContact O-CG 3.23Å; P571-L575 WeakPolarHBondContact O-CG 3.43Å; P571-L575 PolarHBondContact O-N 3.15Å
572	V	84.9	Confident	88.1	Confident	127 Å²	127	52.8 Å²	52.8	77%	0.77	30%	0.299	S	S	*	.	H	α-helix	trans	-72.1	-46.4	-179.2	-179.2	0	0	0	0	111.8	G570 S576	G570-V572 VanDerWaalsContact C-N 3.28Å; G570-V572 PolarHBondContact O-N 2.99Å; V572-S576 PolarHBondContact O-N 3.36Å
573	E	84.5	Confident	87.8	Confident	84 Å²	84	51.7 Å²	51.7	39%	0.393	29%	0.294	S	S	.	.	H	α-helix	trans	-70.8	-39.4	177.4	-168.6	177.5	164.1	0	0	110.4	L569 G570 S576	L569-E573 HydrophobicContact CB-CB 4.42Å; L569-E573 WeakPolarHBondContact O-CB 3.32Å; G570-E573 PolarHBondContact O-N 3.19Å; E573-S576 WeakPolarHBondContact O-CB 3.31Å; E573-S576 PolarHBondContact O-N 3.44Å; E573-S576 PolarHBondContact O-OG 3.03Å
574	Y	88	Confident	87.8	Confident	2 Å²	2	48.5 Å²	48.5	1%	0.008	28%	0.28	C	S	.	.	H	α-helix	trans	-59.4	-51.1	176.8	-179.2	-90.5	0	0	0	112.5	K565 V566 L569 G570 S576 S577 N580 F584	K565-Y574 HydrophobicContact CB-CD2 3.77Å; K565-Y574 HydrophobicContact CB-CE2 3.56Å; K565-Y574 HydrophobicContact CD-CE2 3.98Å; K565-Y574 HydrophobicContact CG-CE2 4.41Å; V566-Y574 HydrophobicContact CG2-CD1 3.79Å; V566-Y574 HydrophobicContact CG2-CD2 4.09Å; V566-Y574 HydrophobicContact CG2-CE1 3.96Å; V566-Y574 HydrophobicContact CG2-CE2 4.22Å; V566-Y574 HydrophobicContact CG2-CG 3.87Å; L569-Y574 HydrophobicContact CD1-CD2 4.44Å; G570-Y574 WeakPolarHBondContact O-CB 3.47Å; G570-Y574 PolarHBondContact O-N 3.23Å; Y574-S576 PolarHBondContact O-N 2.93Å; Y574-S577 PolarHBondContact O-N 3Å; Y574-N580 HydrophobicContact CD1-CB 4.28Å; Y574-N580 HydrophobicContact CD2-CB 4.03Å; Y574-N580 HydrophobicContact CE1-CB 3.97Å; Y574-N580 WeakPolarHBondContact CE1-O 3.47Å; Y574-N580 HydrophobicContact CE2-CB 3.74Å; Y574-N580 HydrophobicContact CG-CB 4.3Å; Y574-N580 VanDerWaalsContact O-CB 3.24Å; Y574-N580 WeakPolarHBondContact O-CB 3.46Å; Y574-N580 PolarHBondContact O-ND2 3.21Å; Y574-N580 PolarHBondContact OH-O 3.01Å; Y574-F584 HydrophobicContact CE1-CB 3.9Å; Y574-F584 HydrophobicContact CE1-CD2 4.46Å; Y574-F584 HydrophobicContact CE1-CG 4.47Å
575	L	88	Confident	87.7	Confident	87 Å²	87	49.2 Å²	49.2	46%	0.455	29%	0.288	S	S	.	.	H	α-helix	trans	-72.7	-9.4	-179.2	-67.3	173	0	0	0	113.6	P571 S577 L581	P571-L575 VanDerWaalsContact O-CB 3.31Å; P571-L575 WeakPolarHBondContact O-CB 3.45Å; P571-L575 VanDerWaalsContact O-CG 3.23Å; P571-L575 WeakPolarHBondContact O-CG 3.43Å; P571-L575 PolarHBondContact O-N 3.15Å; L575-S577 VanDerWaalsContact C-N 3.3Å; L575-L581 HydrophobicContact CD2-CD1 3.83Å
576	S	82.2	Confident	87.7	Confident	94 Å²	94	48.9 Å²	48.9	66%	0.657	29%	0.288	S	S	*	.	H	α-helix	trans	-70.4	-27.2	176.5	77.4	0	0	0	0	112.9	V572 E573 Y574	V572-S576 PolarHBondContact O-N 3.36Å; E573-S576 WeakPolarHBondContact O-CB 3.31Å; E573-S576 PolarHBondContact O-N 3.44Å; E573-S576 PolarHBondContact O-OG 3.03Å; Y574-S576 PolarHBondContact O-N 2.93Å
577	S	83.1	Confident	87.7	Confident	43 Å²	43	47 Å²	47	30%	0.301	28%	0.277	S	S	.	.	S	Bend	trans	-90.8	122.4	177.5	179	0	0	0	0	111.1	Y574 L575 W579 N580 L581	Y574-S577 PolarHBondContact O-N 3Å; L575-S577 VanDerWaalsContact C-N 3.3Å; S577-W579 PolarHBondContact O-N 3.46Å; S577-N580 PolarHBondContact O-N 3.35Å; S577-N580 VanDerWaalsContact O-N 3.11Å; S577-L581 PolarHBondContact O-N 3.41Å
578	G	83.9	Confident	87.8	Confident	57 Å²	57	49.8 Å²	49.8	59%	0.588	29%	0.293	S	S	*	.	H	α-helix	trans	-58.5	-31	178	0	0	0	0	0	113.3	L581 F582	G578-L581 PolarHBondContact O-N 3.02Å; G578-F582 PolarHBondContact O-N 3.38Å
579	W	85.7	Confident	88	Confident	48 Å²	48	54.2 Å²	54.2	18%	0.182	31%	0.312	C	S	.	.	H	α-helix	trans	-72.4	-35	177.5	-75.5	111.9	0	0	0	113.7	S577 D583 K620 R626 L629	S577-W579 PolarHBondContact O-N 3.46Å; W579-D583 VanDerWaalsContact O-CG 3.31Å; W579-D583 PolarHBondContact O-N 2.97Å; W579-D583 VanDerWaalsContact O-N 3.09Å; W579-K620 HydrophobicContact CB-CD 4.01Å; W579-K620 HydrophobicContact CD2-CD 3.73Å; W579-K620 HydrophobicContact CD2-CG 3.62Å; W579-K620 HydrophobicContact CE3-CD 3.56Å; W579-K620 HydrophobicContact CE3-CG 3.43Å; W579-K620 VanDerWaalsContact CE3-CG 3.43Å; W579-K620 HydrophobicContact CG-CD 3.99Å; W579-K620 HydrophobicContact CG-CG 4.28Å; W579-K620 HydrophobicContact CH2-CG 3.73Å; W579-K620 HydrophobicContact CZ2-CG 4.05Å; W579-K620 HydrophobicContact CZ3-CD 4.08Å; W579-K620 HydrophobicContact CZ3-CG 3.46Å; W579-K620 VanDerWaalsContact CZ3-CG 3.46Å; W579-K620 PolarHBondContact O-NZ 3.15Å; W579-R626 HydrophobicContact CZ2-CB 4.47Å; W579-R626 HydrophobicContact CZ2-CG 4.4Å; W579-L629 HydrophobicContact CH2-CD1 3.32Å; W579-L629 HydrophobicContact CZ2-CB 4.47Å; W579-L629 HydrophobicContact CZ2-CD1 3.86Å; W579-L629 HydrophobicContact CZ3-CD1 4.26Å
580	N	89.4	Confident	88.3	Confident	27 Å²	27	53.1 Å²	53.1	14%	0.144	31%	0.307	C	S	.	.	H	α-helix	trans	-73.2	-35.7	173.6	-73.2	-19.9	0	0	0	110.8	Y574 S577 F582 D583 F584	Y574-N580 HydrophobicContact CD1-CB 4.28Å; Y574-N580 HydrophobicContact CD2-CB 4.03Å; Y574-N580 HydrophobicContact CE1-CB 3.97Å; Y574-N580 WeakPolarHBondContact CE1-O 3.47Å; Y574-N580 HydrophobicContact CE2-CB 3.74Å; Y574-N580 HydrophobicContact CG-CB 4.3Å; Y574-N580 VanDerWaalsContact O-CB 3.24Å; Y574-N580 WeakPolarHBondContact O-CB 3.46Å; Y574-N580 PolarHBondContact O-ND2 3.21Å; Y574-N580 PolarHBondContact OH-O 3.01Å; S577-N580 PolarHBondContact O-N 3.35Å; S577-N580 VanDerWaalsContact O-N 3.11Å; N580-F582 VanDerWaalsContact C-N 3.35Å; N580-D583 PolarHBondContact O-N 3.23Å; N580-F584 VanDerWaalsContact O-CB 3.31Å; N580-F584 WeakPolarHBondContact O-CB 3.35Å; N580-F584 PolarHBondContact O-N 2.92Å
581	L	90.5	Very high	88.5	Confident	86 Å²	86	57.2 Å²	57.2	45%	0.45	33%	0.325	S	S	.	.	H	α-helix	trans	-62.3	-40.9	172.3	-179.3	64.2	0	0	0	111.8	L575 S577 G578 F584 S585	L575-L581 HydrophobicContact CD2-CD1 3.83Å; S577-L581 PolarHBondContact O-N 3.41Å; G578-L581 PolarHBondContact O-N 3.02Å; L581-F584 PolarHBondContact O-N 3.38Å; L581-S585 PolarHBondContact O-N 3.23Å; L581-S585 PolarHBondContact O-OG 2.87Å
582	F	88.8	Confident	88.7	Confident	59 Å²	59	58.3 Å²	58.3	26%	0.259	33%	0.327	S	S	.	.	H	α-helix	trans	-63.6	-45	173	175.9	-98.3	0	0	0	112.4	G578 N580 F584 S585 V586 L616 R617	G578-F582 PolarHBondContact O-N 3.38Å; N580-F582 VanDerWaalsContact C-N 3.35Å; F582-F584 VanDerWaalsContact C-N 3.27Å; F582-F584 PolarHBondContact O-N 3.43Å; F582-S585 PolarHBondContact O-N 3.15Å; F582-S585 PolarHBondContact O-OG 3.04Å; F582-V586 HydrophobicContact CD1-CG2 4.39Å; F582-V586 HydrophobicContact CD2-CG2 4.16Å; F582-V586 HydrophobicContact CE1-CG2 3.98Å; F582-V586 HydrophobicContact CE2-CG2 3.73Å; F582-V586 HydrophobicContact CG-CG2 4.48Å; F582-V586 HydrophobicContact CZ-CG2 3.63Å; F582-V586 WeakPolarHBondContact O-CG2 3.43Å; F582-V586 PolarHBondContact O-N 3.4Å; F582-L616 HydrophobicContact CE1-CB 4.11Å; F582-L616 HydrophobicContact CZ-CB 3.92Å; F582-L616 HydrophobicContact CZ-CD1 3.98Å; F582-R617 HydrophobicContact CE1-CG 4.42Å
583	D	89.2	Confident	88.9	Confident	7 Å²	7	52.3 Å²	52.3	4%	0.037	29%	0.29	C	S	.	.	H	α-helix	trans	-62.6	-39.5	177.2	-68.4	-11.1	0	0	0	111.3	W579 N580 T587 R617 K620	W579-D583 VanDerWaalsContact O-CG 3.31Å; W579-D583 PolarHBondContact O-N 2.97Å; W579-D583 VanDerWaalsContact O-N 3.09Å; N580-D583 PolarHBondContact O-N 3.23Å; D583-T587 VanDerWaalsContact O-CB 3.3Å; D583-T587 WeakPolarHBondContact O-CB 3.28Å; D583-T587 PolarHBondContact O-N 3.34Å; D583-T587 PolarHBondContact O-OG1 3.4Å; D583-R617 PolarHBondContact O-NH2 3.19Å; D583-R617 WeakPolarHBondContact OD1-CD 3.44Å; D583-R617 VanDerWaalsContact OD1-CG 3.27Å; D583-R617 WeakPolarHBondContact OD1-CG 3.2Å; D583-R617 IonicContact OD1-CZ 2.65Å; D583-R617 IonicContact OD1-NE 3.62Å; D583-R617 PolarHBondContact OD1-NE 3Å; D583-K620 IonicContact OD1-NZ 2.91Å; D583-K620 PolarHBondContact OD1-NZ 3.4Å; D583-K620 IonicContact OD2-NZ 3.89Å; D583-K620 PolarHBondContact OD2-NZ 3.27Å
584	F	92.6	Very high	89.1	Confident	76 Å²	76	50.2 Å²	50.2	33%	0.333	28%	0.281	S	S	.	.	H	α-helix	trans	-62	-50.9	174.5	175.4	-94.1	0	0	0	111.7	L562 Y574 N580 L581 F582 V586 T587 V588	L562-F584 HydrophobicContact CD1-CB 4.28Å; L562-F584 HydrophobicContact CD1-CD2 3.75Å; L562-F584 HydrophobicContact CD1-CG 4.39Å; L562-F584 HydrophobicContact CD2-CD2 4.13Å; L562-F584 HydrophobicContact CD2-CE2 4.46Å; L562-F584 HydrophobicContact CG-CD2 4.17Å; Y574-F584 HydrophobicContact CE1-CB 3.9Å; Y574-F584 HydrophobicContact CE1-CD2 4.46Å; Y574-F584 HydrophobicContact CE1-CG 4.47Å; N580-F584 VanDerWaalsContact O-CB 3.31Å; N580-F584 WeakPolarHBondContact O-CB 3.35Å; N580-F584 PolarHBondContact O-N 2.92Å; L581-F584 PolarHBondContact O-N 3.38Å; F582-F584 VanDerWaalsContact C-N 3.27Å; F582-F584 PolarHBondContact O-N 3.43Å; F584-V586 PolarHBondContact O-N 2.91Å; F584-T587 PolarHBondContact O-N 3.25Å; F584-V588 HydrophobicContact CD1-CG2 4.34Å; F584-V588 HydrophobicContact CD2-CG2 4.13Å; F584-V588 HydrophobicContact CE1-CG2 4.05Å; F584-V588 HydrophobicContact CE2-CG2 3.81Å; F584-V588 HydrophobicContact CG-CG2 4.37Å; F584-V588 HydrophobicContact CZ-CG2 3.76Å; F584-V588 WeakPolarHBondContact O-CB 3.16Å; F584-V588 VanDerWaalsContact O-CG2 3.26Å; F584-V588 WeakPolarHBondContact O-CG2 3.16Å; F584-V588 PolarHBondContact O-N 2.82Å
585	S	91.6	Very high	89.3	Confident	58 Å²	58	55 Å²	55	41%	0.406	31%	0.306	S	S	.	.	H	α-helix	trans	-62.5	-45.5	-178	66.8	0	0	0	0	112.1	L581 F582 T587 V588 F589	L581-S585 PolarHBondContact O-N 3.23Å; L581-S585 PolarHBondContact O-OG 2.87Å; F582-S585 PolarHBondContact O-N 3.15Å; F582-S585 PolarHBondContact O-OG 3.04Å; S585-T587 PolarHBondContact O-N 3.29Å; S585-V588 PolarHBondContact O-N 3.44Å; S585-F589 WeakPolarHBondContact O-CB 3.18Å; S585-F589 PolarHBondContact O-N 3.36Å
586	V	91	Very high	89.3	Confident	21 Å²	21	51.3 Å²	51.3	13%	0.127	29%	0.289	C	S	.	.	H	α-helix	trans	-63.8	-41	178.5	173.7	0	0	0	0	111.5	F582 F584 A590 Q614	F582-V586 HydrophobicContact CD1-CG2 4.39Å; F582-V586 HydrophobicContact CD2-CG2 4.16Å; F582-V586 HydrophobicContact CE1-CG2 3.98Å; F582-V586 HydrophobicContact CE2-CG2 3.73Å; F582-V586 HydrophobicContact CG-CG2 4.48Å; F582-V586 HydrophobicContact CZ-CG2 3.63Å; F582-V586 WeakPolarHBondContact O-CG2 3.43Å; F582-V586 PolarHBondContact O-N 3.4Å; F584-V586 PolarHBondContact O-N 2.91Å; V586-A590 WeakPolarHBondContact O-CB 3.25Å; V586-A590 PolarHBondContact O-N 3.45Å; V586-Q614 HydrophobicContact CG1-CG 3.74Å
587	T	92.1	Very high	89.5	Confident	2 Å²	2	47.6 Å²	47.6	1%	0.012	26%	0.261	C	S	.	.	H	α-helix	trans	-69.1	-45.4	179.8	-51.6	0	0	0	0	111.1	L555 L562 D583 F584 S585 A590 F591 R617	L555-T587 HydrophobicContact CD1-CG2 4.44Å; L562-T587 HydrophobicContact CD1-CG2 3.9Å; D583-T587 VanDerWaalsContact O-CB 3.3Å; D583-T587 WeakPolarHBondContact O-CB 3.28Å; D583-T587 PolarHBondContact O-N 3.34Å; D583-T587 PolarHBondContact O-OG1 3.4Å; F584-T587 PolarHBondContact O-N 3.25Å; S585-T587 PolarHBondContact O-N 3.29Å; T587-A590 PolarHBondContact O-N 3.32Å; T587-F591 HydrophobicContact CG2-CD2 3.89Å; T587-F591 HydrophobicContact CG2-CE2 3.72Å; T587-F591 VanDerWaalsContact O-CD2 3.26Å; T587-F591 WeakPolarHBondContact O-CD2 3.37Å; T587-F591 PolarHBondContact O-N 3.08Å; T587-R617 PolarHBondContact OG1-NH2 2.89Å
588	V	92.1	Very high	89.6	Confident	69 Å²	69	49.1 Å²	49.1	42%	0.418	28%	0.277	S	S	.	.	H	α-helix	trans	-63.3	-42.5	177.1	171	0	0	0	0	111.1	F584 S585 A590 F591 L592	F584-V588 HydrophobicContact CD1-CG2 4.34Å; F584-V588 HydrophobicContact CD2-CG2 4.13Å; F584-V588 HydrophobicContact CE1-CG2 4.05Å; F584-V588 HydrophobicContact CE2-CG2 3.81Å; F584-V588 HydrophobicContact CG-CG2 4.37Å; F584-V588 HydrophobicContact CZ-CG2 3.76Å; F584-V588 WeakPolarHBondContact O-CB 3.16Å; F584-V588 VanDerWaalsContact O-CG2 3.26Å; F584-V588 WeakPolarHBondContact O-CG2 3.16Å; F584-V588 PolarHBondContact O-N 2.82Å; S585-V588 PolarHBondContact O-N 3.44Å; V588-A590 VanDerWaalsContact C-N 3.33Å; V588-A590 PolarHBondContact O-N 3.4Å; V588-F591 PolarHBondContact O-N 3.27Å; V588-L592 WeakPolarHBondContact O-CB 3.46Å; V588-L592 PolarHBondContact O-N 2.84Å
589	F	91.5	Very high	89.9	Confident	93 Å²	93	51.7 Å²	51.7	41%	0.408	28%	0.277	S	S	.	.	H	α-helix	trans	-63	-40.5	177.2	-160.2	-108.8	0	0	0	111.4	S585 L592 G593 F606 I607 L610	S585-F589 WeakPolarHBondContact O-CB 3.18Å; S585-F589 PolarHBondContact O-N 3.36Å; F589-L592 PolarHBondContact O-N 2.86Å; F589-G593 PolarHBondContact O-N 2.88Å; F589-F606 HydrophobicContact CE1-CE2 4.33Å; F589-F606 HydrophobicContact CZ-CE2 4.25Å; F589-F606 HydrophobicContact CZ-CZ 4.49Å; F589-I607 HydrophobicContact CD1-CB 4.46Å; F589-I607 HydrophobicContact CD1-CD1 4.31Å; F589-I607 HydrophobicContact CD1-CG1 4.25Å; F589-I607 HydrophobicContact CD1-CG2 3.59Å; F589-I607 HydrophobicContact CE1-CB 4.13Å; F589-I607 HydrophobicContact CE1-CD1 3.75Å; F589-I607 HydrophobicContact CE1-CG1 3.53Å; F589-I607 HydrophobicContact CE1-CG2 3.76Å; F589-I607 HydrophobicContact CE2-CD1 4.15Å; F589-I607 HydrophobicContact CG-CG2 4.41Å; F589-I607 HydrophobicContact CZ-CD1 3.66Å; F589-I607 HydrophobicContact CZ-CG1 3.83Å; F589-I607 VanDerWaalsContact O-CG2 3.29Å; F589-I607 WeakPolarHBondContact O-CG2 3.46Å; F589-L610 HydrophobicContact CE1-CD1 4.4Å
590	A	90.9	Very high	89.9	Confident	6 Å²	6	54.7 Å²	54.7	5%	0.05	30%	0.296	C	S	.	.	H	α-helix	trans	-63.5	-42.7	174.4	0	0	0	0	0	113.1	L555 V586 T587 V588 L592 G593 L594	L555-A590 HydrophobicContact CD1-CB 3.62Å; V586-A590 WeakPolarHBondContact O-CB 3.25Å; V586-A590 PolarHBondContact O-N 3.45Å; T587-A590 PolarHBondContact O-N 3.32Å; V588-A590 VanDerWaalsContact C-N 3.33Å; V588-A590 PolarHBondContact O-N 3.4Å; A590-L592 VanDerWaalsContact C-N 3.34Å; A590-G593 PolarHBondContact O-N 3.41Å; A590-L594 PolarHBondContact O-N 3Å
591	F	92.2	Very high	89.7	Confident	88 Å²	88	57.9 Å²	57.9	39%	0.386	31%	0.311	S	S	.	.	H	α-helix	trans	-62.8	-40.1	172.9	-85.6	-71.2	0	0	0	112.3	L555 T587 V588 L594 L595	L555-F591 HydrophobicContact CD1-CD2 3.95Å; L555-F591 HydrophobicContact CD1-CE2 3.84Å; L555-F591 HydrophobicContact CD1-CG 4.37Å; L555-F591 HydrophobicContact CD1-CZ 4.18Å; L555-F591 HydrophobicContact CD2-CD1 4.14Å; L555-F591 HydrophobicContact CD2-CE1 4.19Å; L555-F591 HydrophobicContact CD2-CG 4.42Å; L555-F591 HydrophobicContact CG-CD1 4.38Å; L555-F591 HydrophobicContact CG-CD2 4.42Å; L555-F591 HydrophobicContact CG-CE1 4.07Å; L555-F591 HydrophobicContact CG-CE2 4.1Å; L555-F591 HydrophobicContact CG-CZ 3.91Å; T587-F591 HydrophobicContact CG2-CD2 3.89Å; T587-F591 HydrophobicContact CG2-CE2 3.72Å; T587-F591 VanDerWaalsContact O-CD2 3.26Å; T587-F591 WeakPolarHBondContact O-CD2 3.37Å; T587-F591 PolarHBondContact O-N 3.08Å; V588-F591 PolarHBondContact O-N 3.27Å; F591-L594 PolarHBondContact O-N 3.24Å; F591-L595 WeakPolarHBondContact O-CB 3.42Å; F591-L595 PolarHBondContact O-N 3.21Å
592	L	91.2	Very high	89.1	Confident	91 Å²	91	58.3 Å²	58.3	48%	0.476	31%	0.311	S	S	.	.	H	α-helix	trans	-64.2	-41.9	176.5	-173.2	65.6	0	0	0	111.5	V588 F589 A590 L595 A596	V588-L592 WeakPolarHBondContact O-CB 3.46Å; V588-L592 PolarHBondContact O-N 2.84Å; F589-L592 PolarHBondContact O-N 2.86Å; A590-L592 VanDerWaalsContact C-N 3.34Å; L592-L595 PolarHBondContact O-N 2.89Å; L592-A596 VanDerWaalsContact O-CB 3.29Å; L592-A596 WeakPolarHBondContact O-CB 3.24Å; L592-A596 PolarHBondContact O-N 2.98Å
593	G	89.2	Confident	88.7	Confident	0 Å²	0	60.6 Å²	60.6	0%	0	33%	0.332	C	S	.	.	H	α-helix	trans	-62.2	-43.3	174	0	0	0	0	0	112.9	F589 A590 A596 L597	F589-G593 PolarHBondContact O-N 2.88Å; A590-G593 PolarHBondContact O-N 3.41Å; G593-A596 PolarHBondContact O-N 2.9Å; G593-L597 WeakPolarHBondContact O-CB 3.44Å; G593-L597 PolarHBondContact O-N 3.05Å
594	L	89.1	Confident	88.4	Confident	40 Å²	40	64 Å²	64	21%	0.209	35%	0.346	C	S	.	.	H	α-helix	trans	-63.9	-43	175.7	-179.1	63.9	0	0	0	111.9	V547 L552 L555 A590 F591 L597 A598	V547-L594 HydrophobicContact CG1-CD1 4.38Å; V547-L594 HydrophobicContact CG2-CD1 4.42Å; L552-L594 HydrophobicContact CD2-CD1 3.76Å; L552-L594 HydrophobicContact CD2-CD2 3.55Å; L552-L594 HydrophobicContact CD2-CG 4.33Å; L555-L594 HydrophobicContact CD2-CB 4.32Å; L555-L594 HydrophobicContact CD2-CD2 3.78Å; A590-L594 PolarHBondContact O-N 3Å; F591-L594 PolarHBondContact O-N 3.24Å; L594-L597 PolarHBondContact O-N 2.91Å; L594-A598 WeakPolarHBondContact O-CB 3.41Å; L594-A598 PolarHBondContact O-N 3.47Å
595	L	90.4	Very high	87.9	Confident	102 Å²	102	62.4 Å²	62.4	53%	0.534	34%	0.338	S	S	.	.	H	α-helix	trans	-65.2	-44.1	177.3	-177.6	63.3	0	0	0	111.5	F591 L592 L597 A598 L599	F591-L595 WeakPolarHBondContact O-CB 3.42Å; F591-L595 PolarHBondContact O-N 3.21Å; L592-L595 PolarHBondContact O-N 2.89Å; L595-L597 VanDerWaalsContact C-N 3.31Å; L595-L597 PolarHBondContact O-N 3.43Å; L595-A598 WeakPolarHBondContact O-CB 3.47Å; L595-A598 PolarHBondContact O-N 3.05Å; L595-L599 HydrophobicContact CG-CD1 4.39Å; L595-L599 WeakPolarHBondContact O-CG 3.4Å; L595-L599 PolarHBondContact O-N 3.47Å
596	A	89	Confident	87.4	Confident	11 Å²	11	64.6 Å²	64.6	9%	0.091	34%	0.341	C	S	.	.	H	α-helix	trans	-62.5	-39	177.1	0	0	0	0	0	112	L592 G593 L599 N600 M601 F604	L592-A596 VanDerWaalsContact O-CB 3.29Å; L592-A596 WeakPolarHBondContact O-CB 3.24Å; L592-A596 PolarHBondContact O-N 2.98Å; G593-A596 PolarHBondContact O-N 2.9Å; A596-L599 CarbonylContact O-C 3.49Å; A596-L599 PolarHBondContact O-N 2.95Å; A596-N600 PolarHBondContact O-N 2.94Å; A596-M601 PolarHBondContact O-N 3Å; A596-F604 HydrophobicContact CB-CB 3.66Å; A596-F604 HydrophobicContact CB-CD1 4.48Å; A596-F604 HydrophobicContact CB-CD2 3.94Å; A596-F604 HydrophobicContact CB-CG 3.78Å
597	L	85.5	Confident	87.1	Confident	15 Å²	15	63.9 Å²	63.9	8%	0.079	34%	0.336	C	S	.	.	H	α-helix	trans	-67.6	-39.6	174.9	-174	61.8	0	0	0	112	V547 G593 L594 L595 L599 N600 Y605 V608	V547-L597 HydrophobicContact CG2-CD2 3.26Å; V547-L597 HydrophobicContact CG2-CG 4.43Å; G593-L597 WeakPolarHBondContact O-CB 3.44Å; G593-L597 PolarHBondContact O-N 3.05Å; L594-L597 PolarHBondContact O-N 2.91Å; L595-L597 VanDerWaalsContact C-N 3.31Å; L595-L597 PolarHBondContact O-N 3.43Å; L597-L599 PolarHBondContact O-N 2.71Å; L597-N600 WeakPolarHBondContact O-CA 3.35Å; L597-N600 PolarHBondContact O-N 2.79Å; L597-Y605 HydrophobicContact CD1-CD2 4.35Å; L597-Y605 HydrophobicContact CD2-CD2 4.28Å; L597-V608 HydrophobicContact CD2-CG2 4.21Å
598	A	86.8	Confident	86.5	Confident	75 Å²	75	64 Å²	64	62%	0.62	34%	0.337	S	S	*	.	H	α-helix	trans	-62.6	-29	173.2	0	0	0	0	0	112.5	L594 L595 N600	L594-A598 WeakPolarHBondContact O-CB 3.41Å; L594-A598 PolarHBondContact O-N 3.47Å; L595-A598 WeakPolarHBondContact O-CB 3.47Å; L595-A598 PolarHBondContact O-N 3.05Å; A598-N600 VanDerWaalsContact C-N 3.25Å; A598-N600 PolarHBondContact O-N 3.47Å
599	L	88.6	Confident	86	Confident	112 Å²	112	64.4 Å²	64.4	59%	0.586	34%	0.339	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.8	9.4	172.4	-64.1	173.4	0	0	0	113.6	L595 A596 L597 M601	L595-L599 HydrophobicContact CG-CD1 4.39Å; L595-L599 WeakPolarHBondContact O-CG 3.4Å; L595-L599 PolarHBondContact O-N 3.47Å; A596-L599 CarbonylContact O-C 3.49Å; A596-L599 PolarHBondContact O-N 2.95Å; L597-L599 PolarHBondContact O-N 2.71Å; L599-M601 VanDerWaalsContact C-N 3.27Å; L599-M601 HydrophobicContact CB-CG 4.48Å; L599-M601 PolarHBondContact O-N 3.28Å
600	N	86.2	Confident	85.7	Confident	110 Å²	110	63.5 Å²	63.5	59%	0.588	34%	0.338	S	S	*	.	T	Hydrogen-bonded Turn	trans	58.7	28.8	-178.1	-63.8	-61.4	0	0	0	115	A596 L597 A598 E602	A596-N600 PolarHBondContact O-N 2.94Å; L597-N600 WeakPolarHBondContact O-CA 3.35Å; L597-N600 PolarHBondContact O-N 2.79Å; A598-N600 VanDerWaalsContact C-N 3.25Å; A598-N600 PolarHBondContact O-N 3.47Å; N600-E602 PolarHBondContact O-N 3.45Å; N600-E602 VanDerWaalsContact O-N 3.16Å
601	M	85.3	Confident	85.4	Confident	95 Å²	95	64.7 Å²	64.7	47%	0.468	34%	0.342	S	S	.	.			trans	-85	83.3	171.8	-58.4	-161.3	-177.5	0	0	110.7	A596 L599 P603 F604	A596-M601 PolarHBondContact O-N 3Å; L599-M601 VanDerWaalsContact C-N 3.27Å; L599-M601 HydrophobicContact CB-CG 4.48Å; L599-M601 PolarHBondContact O-N 3.28Å; M601-P603 VanDerWaalsContact C-N 3.32Å; M601-P603 VanDerWaalsContact O-N 3.17Å; M601-F604 HydrophobicContact CB-CD2 3.56Å; M601-F604 HydrophobicContact CB-CE2 4.02Å; M601-F604 PolarHBondContact O-N 3.2Å; M601-F604 HydrophobicContact SD-CD2 4.26Å; M601-F604 HydrophobicContact SD-CE2 3.82Å
602	E	77.9	Confident	85.2	Confident	95 Å²	95	63.4 Å²	63.4	44%	0.444	34%	0.342	S	S	.	.	G	3₁₀ helix	trans	-47.3	-39.7	-177.5	-62.1	-69.7	168.4	0	0	115.1	K545 N600 F604 Y605	K545-E602 VanDerWaalsContact CE-OE1 3.23Å; K545-E602 WeakPolarHBondContact CE-OE1 3.27Å; K545-E602 IonicContact NZ-OE1 3.46Å; K545-E602 PolarHBondContact NZ-OE1 3.44Å; N600-E602 PolarHBondContact O-N 3.45Å; N600-E602 VanDerWaalsContact O-N 3.16Å; E602-F604 PolarHBondContact O-N 3.1Å; E602-Y605 WeakPolarHBondContact O-CB 3.47Å; E602-Y605 PolarHBondContact O-N 3.46Å; E602-Y605 VanDerWaalsContact O-N 3.1Å
603	P	81.3	Confident	85	Confident	106 Å²	106	62.7 Å²	62.7	69%	0.688	34%	0.339	S	S	*	.	G	3₁₀ helix	trans	-62.3	-15.9	-179.6	-24.3	35.4	0	0	0	114.5	M601 F606	M601-P603 VanDerWaalsContact C-N 3.32Å; M601-P603 VanDerWaalsContact O-N 3.17Å; P603-F606 WeakPolarHBondContact O-CD1 3.4Å; P603-F606 VanDerWaalsContact O-CE1 3.3Å; P603-F606 WeakPolarHBondContact O-CE1 3.4Å
604	F	82.4	Confident	84.9	Confident	80 Å²	80	62.9 Å²	62.9	35%	0.351	34%	0.339	S	S	.	.	G	3₁₀ helix	trans	-88.9	0.1	178.9	-66.5	-84	0	0	0	113.8	A596 M601 E602 F606 I607	A596-F604 HydrophobicContact CB-CB 3.66Å; A596-F604 HydrophobicContact CB-CD1 4.48Å; A596-F604 HydrophobicContact CB-CD2 3.94Å; A596-F604 HydrophobicContact CB-CG 3.78Å; M601-F604 HydrophobicContact CB-CD2 3.56Å; M601-F604 HydrophobicContact CB-CE2 4.02Å; M601-F604 PolarHBondContact O-N 3.2Å; M601-F604 HydrophobicContact SD-CD2 4.26Å; M601-F604 HydrophobicContact SD-CE2 3.82Å; E602-F604 PolarHBondContact O-N 3.1Å; F604-F606 HydrophobicContact CD1-CE1 4.44Å; F604-F606 PolarHBondContact O-N 3.11Å; F604-F606 VanDerWaalsContact O-N 3.16Å; F604-I607 HydrophobicContact CB-CD1 4.39Å; F604-I607 HydrophobicContact CD1-CD1 3.94Å; F604-I607 WeakPolarHBondContact O-CB 3.47Å; F604-I607 WeakPolarHBondContact O-CG1 3.22Å; F604-I607 PolarHBondContact O-N 3.29Å
605	Y	81.2	Confident	84.9	Confident	42 Å²	42	63.3 Å²	63.3	17%	0.165	34%	0.342	C	S	.	.	H	α-helix	trans	-57.8	-29.1	177.6	-178.4	-103.1	0	0	0	113.1	F542 S544 L597 E602 I607 V608 V609	F542-Y605 WeakPolarHBondContact O-CE1 3.4Å; F542-Y605 PolarHBondContact O-OH 2.95Å; S544-Y605 PolarHBondContact O-OH 3.14Å; L597-Y605 HydrophobicContact CD1-CD2 4.35Å; L597-Y605 HydrophobicContact CD2-CD2 4.28Å; E602-Y605 WeakPolarHBondContact O-CB 3.47Å; E602-Y605 PolarHBondContact O-N 3.46Å; E602-Y605 VanDerWaalsContact O-N 3.1Å; Y605-I607 PolarHBondContact O-N 2.96Å; Y605-V608 HydrophobicContact CD2-CB 4.49Å; Y605-V608 HydrophobicContact CE2-CB 4.45Å; Y605-V608 WeakPolarHBondContact O-CB 3.34Å; Y605-V608 PolarHBondContact O-N 3.24Å; Y605-V609 HydrophobicContact CD1-CG2 3.87Å; Y605-V609 HydrophobicContact CE1-CG2 3.6Å; Y605-V609 PolarHBondContact O-N 3.2Å
606	F	81.8	Confident	84.8	Confident	103 Å²	103	61.4 Å²	61.4	45%	0.452	33%	0.331	S	S	.	.	H	α-helix	trans	-56.2	-27.7	175.8	76	-90.9	0	0	0	112.9	F589 P603 F604 V608 V609 L610	F589-F606 HydrophobicContact CE1-CE2 4.33Å; F589-F606 HydrophobicContact CZ-CE2 4.25Å; F589-F606 HydrophobicContact CZ-CZ 4.49Å; P603-F606 WeakPolarHBondContact O-CD1 3.4Å; P603-F606 VanDerWaalsContact O-CE1 3.3Å; P603-F606 WeakPolarHBondContact O-CE1 3.4Å; F604-F606 HydrophobicContact CD1-CE1 4.44Å; F604-F606 PolarHBondContact O-N 3.11Å; F604-F606 VanDerWaalsContact O-N 3.16Å; F606-V608 VanDerWaalsContact C-N 3.28Å; F606-V608 PolarHBondContact O-N 3.15Å; F606-V609 WeakPolarHBondContact O-CA 3.36Å; F606-V609 WeakPolarHBondContact O-CB 3.34Å; F606-V609 PolarHBondContact O-N 3.35Å; F606-V609 VanDerWaalsContact O-N 3.12Å; F606-L610 HydrophobicContact CD2-CD1 3.99Å; F606-L610 HydrophobicContact CE2-CD1 4.3Å; F606-L610 WeakPolarHBondContact O-CG 3.49Å; F606-L610 PolarHBondContact O-N 3.42Å
607	I	83.7	Confident	84.6	Confident	6 Å²	6	61.2 Å²	61.2	3%	0.031	33%	0.328	C	S	.	.	H	α-helix	trans	-63.6	-37.5	177.5	-59.5	-176	0	0	0	110.8	F589 F604 Y605 V609 L610	F589-I607 HydrophobicContact CD1-CB 4.46Å; F589-I607 HydrophobicContact CD1-CD1 4.31Å; F589-I607 HydrophobicContact CD1-CG1 4.25Å; F589-I607 HydrophobicContact CD1-CG2 3.59Å; F589-I607 HydrophobicContact CE1-CB 4.13Å; F589-I607 HydrophobicContact CE1-CD1 3.75Å; F589-I607 HydrophobicContact CE1-CG1 3.53Å; F589-I607 HydrophobicContact CE1-CG2 3.76Å; F589-I607 HydrophobicContact CE2-CD1 4.15Å; F589-I607 HydrophobicContact CG-CG2 4.41Å; F589-I607 HydrophobicContact CZ-CD1 3.66Å; F589-I607 HydrophobicContact CZ-CG1 3.83Å; F589-I607 VanDerWaalsContact O-CG2 3.29Å; F589-I607 WeakPolarHBondContact O-CG2 3.46Å; F604-I607 HydrophobicContact CB-CD1 4.39Å; F604-I607 HydrophobicContact CD1-CD1 3.94Å; F604-I607 WeakPolarHBondContact O-CB 3.47Å; F604-I607 WeakPolarHBondContact O-CG1 3.22Å; F604-I607 PolarHBondContact O-N 3.29Å; Y605-I607 PolarHBondContact O-N 2.96Å; I607-V609 VanDerWaalsContact C-N 3.34Å; I607-L610 PolarHBondContact O-N 3.33Å
608	V	80.9	Confident	84.7	Confident	6 Å²	6	63.8 Å²	63.8	4%	0.036	34%	0.342	C	S	.	.	H	α-helix	trans	-69.2	-36.3	174.8	-176.8	0	0	0	0	110.4	Y551 L597 Y605 F606 L610 R611	Y551-V608 HydrophobicContact CE1-CG1 4.35Å; L597-V608 HydrophobicContact CD2-CG2 4.21Å; Y605-V608 HydrophobicContact CD2-CB 4.49Å; Y605-V608 HydrophobicContact CE2-CB 4.45Å; Y605-V608 WeakPolarHBondContact O-CB 3.34Å; Y605-V608 PolarHBondContact O-N 3.24Å; F606-V608 VanDerWaalsContact C-N 3.28Å; F606-V608 PolarHBondContact O-N 3.15Å; V608-L610 PolarHBondContact O-N 3.48Å; V608-R611 WeakPolarHBondContact O-CB 3.43Å; V608-R611 WeakPolarHBondContact O-CG 3.47Å; V608-R611 PolarHBondContact O-N 3.33Å
609	V	81.6	Confident	84.6	Confident	77 Å²	77	64.5 Å²	64.5	47%	0.467	33%	0.331	S	S	.	.	H	α-helix	trans	-62.8	-31.9	174.5	-178.7	0	0	0	0	111.7	Y605 F606 I607 R611 P612	Y605-V609 HydrophobicContact CD1-CG2 3.87Å; Y605-V609 HydrophobicContact CE1-CG2 3.6Å; Y605-V609 PolarHBondContact O-N 3.2Å; F606-V609 WeakPolarHBondContact O-CA 3.36Å; F606-V609 WeakPolarHBondContact O-CB 3.34Å; F606-V609 PolarHBondContact O-N 3.35Å; F606-V609 VanDerWaalsContact O-N 3.12Å; I607-V609 VanDerWaalsContact C-N 3.34Å; V609-R611 PolarHBondContact O-N 3.12Å; V609-R611 VanDerWaalsContact O-N 3.13Å; V609-P612 WeakPolarHBondContact O-CD 3.27Å
610	L	85.2	Confident	84.2	Confident	74 Å²	74	60.4 Å²	60.4	39%	0.387	31%	0.309	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.4	8.7	176.8	-67.3	176.9	0	0	0	114.6	F589 F606 I607 V608 P612 L613	F589-L610 HydrophobicContact CE1-CD1 4.4Å; F606-L610 HydrophobicContact CD2-CD1 3.99Å; F606-L610 HydrophobicContact CE2-CD1 4.3Å; F606-L610 WeakPolarHBondContact O-CG 3.49Å; F606-L610 PolarHBondContact O-N 3.42Å; I607-L610 PolarHBondContact O-N 3.33Å; V608-L610 PolarHBondContact O-N 3.48Å; L610-P612 VanDerWaalsContact C-N 3.27Å; L610-P612 WeakPolarHBondContact O-CD 3.25Å; L610-P612 VanDerWaalsContact O-N 3.11Å; L610-L613 HydrophobicContact CB-CD1 3.91Å; L610-L613 HydrophobicContact CB-CG 4.3Å; L610-L613 HydrophobicContact CD1-CD1 4.25Å; L610-L613 HydrophobicContact CD2-CD1 4.12Å; L610-L613 HydrophobicContact CD2-CG 4.48Å; L610-L613 HydrophobicContact CG-CD1 4.31Å; L610-L613 VanDerWaalsContact O-CB 3.3Å; L610-L613 WeakPolarHBondContact O-CB 3.35Å; L610-L613 WeakPolarHBondContact O-CG 3.3Å; L610-L613 PolarHBondContact O-N 2.84Å
611	R	84.6	Confident	84.1	Confident	30 Å²	30	60.2 Å²	60.2	11%	0.113	31%	0.307	C	S	.	.	G	3₁₀ helix	trans	-47.1	-34.7	174.5	63.9	-176	-167.1	165.4	12.7	115.4	I530 E533 Y551 V608 V609 L613 Q614	I530-R611 HydrophobicContact CD1-CG 4.27Å; E533-R611 IonicContact OE1-NH1 3.52Å; E533-R611 IonicContact OE2-CZ 3.38Å; E533-R611 IonicContact OE2-NH1 3.57Å; E533-R611 PolarHBondContact OE2-NH1 3.48Å; E533-R611 IonicContact OE2-NH2 3.03Å; E533-R611 PolarHBondContact OE2-NH2 2.68Å; Y551-R611 HydrophobicContact CD2-CB 4.19Å; Y551-R611 HydrophobicContact CE2-CB 3.97Å; V608-R611 WeakPolarHBondContact O-CB 3.43Å; V608-R611 WeakPolarHBondContact O-CG 3.47Å; V608-R611 PolarHBondContact O-N 3.33Å; V609-R611 PolarHBondContact O-N 3.12Å; V609-R611 VanDerWaalsContact O-N 3.13Å; R611-L613 PolarHBondContact O-N 3.38Å; R611-Q614 WeakPolarHBondContact O-CB 3.06Å; R611-Q614 WeakPolarHBondContact O-CG 3.29Å; R611-Q614 PolarHBondContact O-N 3.05Å
612	P	86.6	Confident	84	Confident	62 Å²	62	60.7 Å²	60.7	40%	0.403	31%	0.307	S	S	.	.	G	3₁₀ helix	trans	-65.4	-18	177.7	-20.8	35.7	0	0	0	114.1	V609 L610 Q614 L615	V609-P612 WeakPolarHBondContact O-CD 3.27Å; L610-P612 VanDerWaalsContact C-N 3.27Å; L610-P612 WeakPolarHBondContact O-CD 3.25Å; L610-P612 VanDerWaalsContact O-N 3.11Å; P612-Q614 PolarHBondContact O-N 3Å; P612-Q614 VanDerWaalsContact O-N 3.14Å; P612-L615 HydrophobicContact CB-CD1 4.44Å; P612-L615 VanDerWaalsContact O-CB 3.25Å; P612-L615 WeakPolarHBondContact O-CB 3.45Å; P612-L615 WeakPolarHBondContact O-CG 3.42Å; P612-L615 PolarHBondContact O-N 3.25Å
613	L	88	Confident	84.1	Confident	76 Å²	76	60 Å²	60	40%	0.398	30%	0.303	S	S	.	.	G	3₁₀ helix	trans	-59.7	-24.4	174.7	-66.2	-177.9	0	0	0	112.3	L610 R611 L615 L616	L610-L613 HydrophobicContact CB-CD1 3.91Å; L610-L613 HydrophobicContact CB-CG 4.3Å; L610-L613 HydrophobicContact CD1-CD1 4.25Å; L610-L613 HydrophobicContact CD2-CD1 4.12Å; L610-L613 HydrophobicContact CD2-CG 4.48Å; L610-L613 HydrophobicContact CG-CD1 4.31Å; L610-L613 VanDerWaalsContact O-CB 3.3Å; L610-L613 WeakPolarHBondContact O-CB 3.35Å; L610-L613 WeakPolarHBondContact O-CG 3.3Å; L610-L613 PolarHBondContact O-N 2.84Å; R611-L613 PolarHBondContact O-N 3.38Å; L613-L615 PolarHBondContact O-N 3.39Å; L613-L616 HydrophobicContact CB-CD1 4.49Å; L613-L616 HydrophobicContact CD2-CD1 3.9Å; L613-L616 VanDerWaalsContact O-CB 3.3Å; L613-L616 WeakPolarHBondContact O-CB 3.45Å; L613-L616 WeakPolarHBondContact O-CG 3.37Å; L613-L616 PolarHBondContact O-N 3.49Å; L613-L616 VanDerWaalsContact O-N 3.17Å
614	Q	87.6	Confident	84	Confident	4 Å²	4	63.1 Å²	63.1	2%	0.019	30%	0.301	C	S	.	.	G	3₁₀ helix	trans	-62.7	-24.4	173.8	-63.3	172	-12.9	0	0	112.3	N526 Y558 V586 R611 P612 L616 R617	N526-Q614 PolarHBondContact ND2-OE1 3.42Å; Y558-Q614 HydrophobicContact CE2-CB 4.43Å; Y558-Q614 HydrophobicContact CE2-CG 4.47Å; V586-Q614 HydrophobicContact CG1-CG 3.74Å; R611-Q614 WeakPolarHBondContact O-CB 3.06Å; R611-Q614 WeakPolarHBondContact O-CG 3.29Å; R611-Q614 PolarHBondContact O-N 3.05Å; P612-Q614 PolarHBondContact O-N 3Å; P612-Q614 VanDerWaalsContact O-N 3.14Å; Q614-L616 VanDerWaalsContact C-N 3.28Å; Q614-L616 PolarHBondContact O-N 2.86Å; Q614-R617 WeakPolarHBondContact O-CB 3.39Å; Q614-R617 WeakPolarHBondContact O-CG 3.35Å; Q614-R617 PolarHBondContact O-N 3.28Å
615	L	89.1	Confident	84.1	Confident	49 Å²	49	64 Å²	64	26%	0.257	30%	0.303	S	S	.	.	G	3₁₀ helix	trans	-73.8	-18.6	178.1	-55.1	176.7	0	0	0	112.8	V523 P612 L613 R617 L618	V523-L615 HydrophobicContact CG1-CD2 4.09Å; V523-L615 WeakPolarHBondContact O-CD2 3.49Å; P612-L615 HydrophobicContact CB-CD1 4.44Å; P612-L615 VanDerWaalsContact O-CB 3.25Å; P612-L615 WeakPolarHBondContact O-CB 3.45Å; P612-L615 WeakPolarHBondContact O-CG 3.42Å; P612-L615 PolarHBondContact O-N 3.25Å; L613-L615 PolarHBondContact O-N 3.39Å; L615-R617 PolarHBondContact O-N 3.16Å; L615-L618 VanDerWaalsContact O-CB 3.27Å; L615-L618 WeakPolarHBondContact O-CB 3.24Å; L615-L618 PolarHBondContact O-N 3.06Å
616	L	87.8	Confident	84.1	Confident	61 Å²	61	66 Å²	66	32%	0.319	31%	0.31	S	S	.	.	G	3₁₀ helix	trans	-59.3	-19.5	173	-67	171.6	0	0	0	112	F582 L613 Q614 L618 F619	F582-L616 HydrophobicContact CE1-CB 4.11Å; F582-L616 HydrophobicContact CZ-CB 3.92Å; F582-L616 HydrophobicContact CZ-CD1 3.98Å; L613-L616 HydrophobicContact CB-CD1 4.49Å; L613-L616 HydrophobicContact CD2-CD1 3.9Å; L613-L616 VanDerWaalsContact O-CB 3.3Å; L613-L616 WeakPolarHBondContact O-CB 3.45Å; L613-L616 WeakPolarHBondContact O-CG 3.37Å; L613-L616 PolarHBondContact O-N 3.49Å; L613-L616 VanDerWaalsContact O-N 3.17Å; Q614-L616 VanDerWaalsContact C-N 3.28Å; Q614-L616 PolarHBondContact O-N 2.86Å; L616-L618 PolarHBondContact O-N 3.09Å; L616-F619 HydrophobicContact CD2-CD2 3.95Å; L616-F619 HydrophobicContact CD2-CE2 3.66Å; L616-F619 HydrophobicContact CD2-CZ 4.23Å; L616-F619 WeakPolarHBondContact O-CB 3.32Å; L616-F619 PolarHBondContact O-N 3.01Å; L616-F619 VanDerWaalsContact O-N 3.1Å
617	R	85	Confident	84.1	Confident	7 Å²	7	62.3 Å²	62.3	3%	0.026	30%	0.295	C	S	.	.	G	3₁₀ helix	trans	-59.9	-28.6	171.9	-62.6	-174.6	-171.7	-169.7	4.8	113.1	V523 Y558 E561 F582 D583 T587 Q614 L615 F619 K620	V523-R617 HydrophobicContact CG1-CB 4.41Å; V523-R617 HydrophobicContact CG2-CB 4.27Å; Y558-R617 VanDerWaalsContact CD1-NH1 3.31Å; E561-R617 IonicContact OE2-NH1 3.76Å; E561-R617 PolarHBondContact OE2-NH1 3.18Å; F582-R617 HydrophobicContact CE1-CG 4.42Å; D583-R617 PolarHBondContact O-NH2 3.19Å; D583-R617 WeakPolarHBondContact OD1-CD 3.44Å; D583-R617 VanDerWaalsContact OD1-CG 3.27Å; D583-R617 WeakPolarHBondContact OD1-CG 3.2Å; D583-R617 IonicContact OD1-CZ 2.65Å; D583-R617 IonicContact OD1-NE 3.62Å; D583-R617 PolarHBondContact OD1-NE 3Å; T587-R617 PolarHBondContact OG1-NH2 2.89Å; Q614-R617 WeakPolarHBondContact O-CB 3.39Å; Q614-R617 WeakPolarHBondContact O-CG 3.35Å; Q614-R617 PolarHBondContact O-N 3.28Å; L615-R617 PolarHBondContact O-N 3.16Å; R617-F619 PolarHBondContact O-N 3.11Å; R617-K620 WeakPolarHBondContact O-CB 3.35Å; R617-K620 VanDerWaalsContact O-CG 3.28Å; R617-K620 WeakPolarHBondContact O-CG 3.33Å; R617-K620 PolarHBondContact O-N 2.95Å
618	L	87	Confident	84.2	Confident	69 Å²	69	64.4 Å²	64.4	36%	0.361	31%	0.308	S	S	.	.	G	3₁₀ helix	trans	-68.3	-24.3	178.2	-167.5	64.7	0	0	0	111.9	V523 L615 L616 K620 L621	V523-L618 HydrophobicContact CG1-CB 4.32Å; L615-L618 VanDerWaalsContact O-CB 3.27Å; L615-L618 WeakPolarHBondContact O-CB 3.24Å; L615-L618 PolarHBondContact O-N 3.06Å; L616-L618 PolarHBondContact O-N 3.09Å; L618-K620 PolarHBondContact O-N 3.16Å; L618-K620 VanDerWaalsContact O-N 3.17Å; L618-L621 HydrophobicContact CD1-CD2 4.41Å; L618-L621 VanDerWaalsContact O-CB 3.25Å; L618-L621 WeakPolarHBondContact O-CB 3.43Å; L618-L621 PolarHBondContact O-N 2.88Å
619	F	84.9	Confident	84.3	Confident	91 Å²	91	66 Å²	66	40%	0.399	32%	0.316	S	S	.	.	G	3₁₀ helix	trans	-65.1	-20.2	178.1	-69.7	2	0	0	0	112.5	L616 R617 L621 K622 Y625	L616-F619 HydrophobicContact CD2-CD2 3.95Å; L616-F619 HydrophobicContact CD2-CE2 3.66Å; L616-F619 HydrophobicContact CD2-CZ 4.23Å; L616-F619 WeakPolarHBondContact O-CB 3.32Å; L616-F619 PolarHBondContact O-N 3.01Å; L616-F619 VanDerWaalsContact O-N 3.1Å; R617-F619 PolarHBondContact O-N 3.11Å; F619-L621 PolarHBondContact O-N 3.07Å; F619-K622 PolarHBondContact O-N 3Å; F619-Y625 HydrophobicContact CB-CD2 4.35Å; F619-Y625 HydrophobicContact CD1-CD2 4.38Å; F619-Y625 HydrophobicContact CG-CD2 4.41Å; F619-Y625 WeakPolarHBondContact O-CB 3.43Å
620	K	80.4	Confident	84.3	Confident	25 Å²	25	65.2 Å²	65.2	11%	0.109	31%	0.31	C	S	.	.	G	3₁₀ helix	trans	-62.7	-24.6	173.6	-57.4	-176	-151.7	-160.8	0	113.2	Y520 W579 D583 R617 L618	Y520-K620 HydrophobicContact CE1-CB 4.41Å; W579-K620 HydrophobicContact CB-CD 4.01Å; W579-K620 HydrophobicContact CD2-CD 3.73Å; W579-K620 HydrophobicContact CD2-CG 3.62Å; W579-K620 HydrophobicContact CE3-CD 3.56Å; W579-K620 HydrophobicContact CE3-CG 3.43Å; W579-K620 VanDerWaalsContact CE3-CG 3.43Å; W579-K620 HydrophobicContact CG-CD 3.99Å; W579-K620 HydrophobicContact CG-CG 4.28Å; W579-K620 HydrophobicContact CH2-CG 3.73Å; W579-K620 HydrophobicContact CZ2-CG 4.05Å; W579-K620 HydrophobicContact CZ3-CD 4.08Å; W579-K620 HydrophobicContact CZ3-CG 3.46Å; W579-K620 VanDerWaalsContact CZ3-CG 3.46Å; W579-K620 PolarHBondContact O-NZ 3.15Å; D583-K620 IonicContact OD1-NZ 2.91Å; D583-K620 PolarHBondContact OD1-NZ 3.4Å; D583-K620 IonicContact OD2-NZ 3.89Å; D583-K620 PolarHBondContact OD2-NZ 3.27Å; R617-K620 WeakPolarHBondContact O-CB 3.35Å; R617-K620 VanDerWaalsContact O-CG 3.28Å; R617-K620 WeakPolarHBondContact O-CG 3.33Å; R617-K620 PolarHBondContact O-N 2.95Å; L618-K620 PolarHBondContact O-N 3.16Å; L618-K620 VanDerWaalsContact O-N 3.17Å
621	L	83.2	Confident	84.2	Confident	106 Å²	106	61.7 Å²	61.7	56%	0.555	29%	0.291	S	S	*	.	G	3₁₀ helix	trans	-67.9	-36.6	-175.4	-173.4	67.6	0	0	0	112	Y520 L618 F619	Y520-L621 HydrophobicContact CD2-CD1 4.19Å; Y520-L621 HydrophobicContact CE2-CD1 4.23Å; L618-L621 HydrophobicContact CD1-CD2 4.41Å; L618-L621 VanDerWaalsContact O-CB 3.25Å; L618-L621 WeakPolarHBondContact O-CB 3.43Å; L618-L621 PolarHBondContact O-N 2.88Å; F619-L621 PolarHBondContact O-N 3.07Å
622	K	84.5	Confident	84.3	Confident	106 Å²	106	63.8 Å²	63.8	46%	0.461	30%	0.303	S	S	.	.	S	Bend	trans	-99.4	118.2	-177.8	-164.9	176.8	-172.2	173.1	0	110	F619 R624 Y625 R626	F619-K622 PolarHBondContact O-N 3Å; K622-R624 HydrophobicContact CG-CB 4.45Å; K622-R624 PolarHBondContact O-N 3.4Å; K622-R624 VanDerWaalsContact O-N 3.16Å; K622-Y625 HydrophobicContact CB-CD2 3.55Å; K622-Y625 HydrophobicContact CB-CE2 3.9Å; K622-Y625 HydrophobicContact CB-CG 4.28Å; K622-Y625 HydrophobicContact CD-CD2 3.95Å; K622-Y625 HydrophobicContact CD-CE2 3.53Å; K622-Y625 HydrophobicContact CG-CD2 4.24Å; K622-Y625 HydrophobicContact CG-CE2 4.3Å; K622-Y625 PolarHBondContact O-N 3.19Å; K622-R626 PolarHBondContact O-N 2.98Å
623	E	79.3	Confident	84.2	Confident	79 Å²	79	67 Å²	67	37%	0.369	31%	0.311	S	S	.	.	H	α-helix	trans	-51.2	-41.1	179	171	167.4	-152.3	0	0	113.3	Y625 R626 N627 Q773	E623-Y625 VanDerWaalsContact C-N 3.28Å; E623-Y625 PolarHBondContact O-N 3.23Å; E623-R626 WeakPolarHBondContact O-CB 3.44Å; E623-R626 PolarHBondContact O-N 3.49Å; E623-R626 VanDerWaalsContact O-N 3.17Å; E623-R626 IonicContact OE1-NH2 2.82Å; E623-N627 PolarHBondContact O-N 3.5Å; E623-N627 PolarHBondContact O-OD1 2.84Å; E623-Q773 PolarHBondContact OE1-NE2 3.1Å; E623-Q773 PolarHBondContact OE2-NE2 3.24Å
624	R	79.8	Confident	83.9	Confident	172 Å²	172	66.1 Å²	66.1	65%	0.649	31%	0.305	S	S	*	.	H	α-helix	trans	-57.4	-39.2	177.9	-172.5	177.2	-74.7	-175.5	-2.5	112.7	K622 V628	K622-R624 HydrophobicContact CG-CB 4.45Å; K622-R624 PolarHBondContact O-N 3.4Å; K622-R624 VanDerWaalsContact O-N 3.16Å; R624-V628 VanDerWaalsContact O-CG2 3.27Å; R624-V628 WeakPolarHBondContact O-CG2 3.39Å; R624-V628 PolarHBondContact O-N 3.23Å; R624-V628 VanDerWaalsContact O-N 3.14Å
625	Y	85.2	Confident	83.8	Confident	98 Å²	98	66.5 Å²	66.5	38%	0.384	31%	0.307	S	S	.	.	H	α-helix	trans	-73.7	-36.6	179	-61.2	-39.2	0	0	0	112.1	F619 K622 E623 N627 V628 L629	F619-Y625 HydrophobicContact CB-CD2 4.35Å; F619-Y625 HydrophobicContact CD1-CD2 4.38Å; F619-Y625 HydrophobicContact CG-CD2 4.41Å; F619-Y625 WeakPolarHBondContact O-CB 3.43Å; K622-Y625 HydrophobicContact CB-CD2 3.55Å; K622-Y625 HydrophobicContact CB-CE2 3.9Å; K622-Y625 HydrophobicContact CB-CG 4.28Å; K622-Y625 HydrophobicContact CD-CD2 3.95Å; K622-Y625 HydrophobicContact CD-CE2 3.53Å; K622-Y625 HydrophobicContact CG-CD2 4.24Å; K622-Y625 HydrophobicContact CG-CE2 4.3Å; K622-Y625 PolarHBondContact O-N 3.19Å; E623-Y625 VanDerWaalsContact C-N 3.28Å; E623-Y625 PolarHBondContact O-N 3.23Å; Y625-N627 VanDerWaalsContact C-N 3.35Å; Y625-V628 PolarHBondContact O-N 2.92Å; Y625-L629 WeakPolarHBondContact O-CG 3.49Å; Y625-L629 PolarHBondContact O-N 3.07Å
626	R	81.2	Confident	83.8	Confident	86 Å²	86	68.3 Å²	68.3	33%	0.325	32%	0.316	S	S	.	.	H	α-helix	trans	-58.2	-49.5	171.8	180	-179.7	65.3	-127.5	4.1	110.7	W579 K622 E623 V628 L629 D630	W579-R626 HydrophobicContact CZ2-CB 4.47Å; W579-R626 HydrophobicContact CZ2-CG 4.4Å; K622-R626 PolarHBondContact O-N 2.98Å; E623-R626 WeakPolarHBondContact O-CB 3.44Å; E623-R626 PolarHBondContact O-N 3.49Å; E623-R626 VanDerWaalsContact O-N 3.17Å; E623-R626 IonicContact OE1-NH2 2.82Å; R626-V628 VanDerWaalsContact C-N 3.3Å; R626-V628 PolarHBondContact O-N 3.49Å; R626-L629 PolarHBondContact O-N 3.2Å; R626-L629 VanDerWaalsContact O-N 3.14Å; R626-D630 WeakPolarHBondContact CG-OD2 3.5Å; R626-D630 WeakPolarHBondContact O-CB 3.41Å; R626-D630 VanDerWaalsContact O-CG 3.24Å; R626-D630 PolarHBondContact O-N 3.15Å
627	N	79.9	Confident	83.8	Confident	24 Å²	24	70 Å²	70	13%	0.128	33%	0.331	C	S	.	.	H	α-helix	trans	-59.7	-42.1	179.6	-65.1	-0.1	0	0	0	111.3	E623 Y625 D630 T631	E623-N627 PolarHBondContact O-N 3.5Å; E623-N627 PolarHBondContact O-OD1 2.84Å; Y625-N627 VanDerWaalsContact C-N 3.35Å; N627-D630 PolarHBondContact O-N 3.36Å; N627-T631 VanDerWaalsContact O-CG2 3.25Å; N627-T631 WeakPolarHBondContact O-CG2 3.41Å; N627-T631 PolarHBondContact O-N 3.12Å; N627-T631 PolarHBondContact O-OG1 3.29Å
628	V	85.7	Confident	83.7	Confident	50 Å²	50	71.5 Å²	71.5	30%	0.303	34%	0.337	S	S	.	.	H	α-helix	trans	-62	-39.1	175.8	162.1	0	0	0	0	113.2	R624 Y625 R626 T631 M632 F762	R624-V628 VanDerWaalsContact O-CG2 3.27Å; R624-V628 WeakPolarHBondContact O-CG2 3.39Å; R624-V628 PolarHBondContact O-N 3.23Å; R624-V628 VanDerWaalsContact O-N 3.14Å; Y625-V628 PolarHBondContact O-N 2.92Å; R626-V628 VanDerWaalsContact C-N 3.3Å; R626-V628 PolarHBondContact O-N 3.49Å; V628-T631 VanDerWaalsContact C-OG1 3.27Å; V628-T631 WeakPolarHBondContact CA-OG1 3.28Å; V628-T631 PolarHBondContact O-OG1 2.94Å; V628-M632 WeakPolarHBondContact O-CB 3.31Å; V628-M632 PolarHBondContact O-N 3.24Å; V628-M632 VanDerWaalsContact O-N 3.08Å; V628-F762 HydrophobicContact CB-CZ 4.14Å; V628-F762 HydrophobicContact CG1-CZ 3.92Å; V628-F762 HydrophobicContact CG2-CE1 4.43Å; V628-F762 HydrophobicContact CG2-CZ 3.98Å
629	L	84.3	Confident	83.8	Confident	39 Å²	39	71.5 Å²	71.5	20%	0.204	34%	0.335	C	S	.	.	H	α-helix	trans	-76.8	-39.2	178.9	-71.8	168	0	0	0	111.4	W579 Y625 R626 T631 M632 F633	W579-L629 HydrophobicContact CH2-CD1 3.32Å; W579-L629 HydrophobicContact CZ2-CB 4.47Å; W579-L629 HydrophobicContact CZ2-CD1 3.86Å; W579-L629 HydrophobicContact CZ3-CD1 4.26Å; Y625-L629 WeakPolarHBondContact O-CG 3.49Å; Y625-L629 PolarHBondContact O-N 3.07Å; R626-L629 PolarHBondContact O-N 3.2Å; R626-L629 VanDerWaalsContact O-N 3.14Å; L629-T631 VanDerWaalsContact C-N 3.31Å; L629-T631 PolarHBondContact O-N 3.33Å; L629-M632 HydrophobicContact CD2-CE 4.03Å; L629-M632 WeakPolarHBondContact O-CB 3.49Å; L629-M632 PolarHBondContact O-N 3.29Å; L629-F633 WeakPolarHBondContact O-CD2 3.42Å; L629-F633 PolarHBondContact O-N 3.03Å
630	D	81	Confident	84	Confident	62 Å²	62	70 Å²	70	33%	0.332	34%	0.34	S	S	.	.	H	α-helix	trans	-63	-39.4	174.4	-66.1	-20.9	0	0	0	110.8	R626 N627 E634 R765	R626-D630 WeakPolarHBondContact CG-OD2 3.5Å; R626-D630 WeakPolarHBondContact O-CB 3.41Å; R626-D630 VanDerWaalsContact O-CG 3.24Å; R626-D630 PolarHBondContact O-N 3.15Å; N627-D630 PolarHBondContact O-N 3.36Å; D630-E634 WeakPolarHBondContact O-CB 3.3Å; D630-E634 PolarHBondContact O-N 3.33Å; D630-E634 VanDerWaalsContact O-N 3.11Å; D630-R765 PolarHBondContact O-NH2 2.72Å
631	T	83.9	Confident	84.5	Confident	0 Å²	0	70.1 Å²	70.1	0%	0	34%	0.344	C	S	.	.	H	α-helix	trans	-64.1	-44.6	174.3	52.2	0	0	0	0	110.1	N627 V628 L629 E634 L635 F762 R765	N627-T631 VanDerWaalsContact O-CG2 3.25Å; N627-T631 WeakPolarHBondContact O-CG2 3.41Å; N627-T631 PolarHBondContact O-N 3.12Å; N627-T631 PolarHBondContact O-OG1 3.29Å; V628-T631 VanDerWaalsContact C-OG1 3.27Å; V628-T631 WeakPolarHBondContact CA-OG1 3.28Å; V628-T631 PolarHBondContact O-OG1 2.94Å; L629-T631 VanDerWaalsContact C-N 3.31Å; L629-T631 PolarHBondContact O-N 3.33Å; T631-E634 PolarHBondContact O-N 3.27Å; T631-L635 WeakPolarHBondContact O-CB 3.23Å; T631-L635 VanDerWaalsContact O-CG 3.31Å; T631-L635 WeakPolarHBondContact O-CG 3.39Å; T631-L635 PolarHBondContact O-N 2.69Å; T631-F762 WeakPolarHBondContact OG1-CE2 3.44Å; T631-F762 VanDerWaalsContact OG1-CZ 3.26Å; T631-F762 WeakPolarHBondContact OG1-CZ 3.41Å; T631-R765 HydrophobicContact CG2-CB 4.02Å; T631-R765 HydrophobicContact CG2-CG 3.75Å
632	M	85.9	Confident	84.9	Confident	73 Å²	73	65.2 Å²	65.2	36%	0.36	32%	0.318	S	S	.	.	H	α-helix	trans	-60.8	-48.4	-179.7	-173.9	-170.3	77	0	0	111.9	V628 L629 E634 L635 L636	V628-M632 WeakPolarHBondContact O-CB 3.31Å; V628-M632 PolarHBondContact O-N 3.24Å; V628-M632 VanDerWaalsContact O-N 3.08Å; L629-M632 HydrophobicContact CD2-CE 4.03Å; L629-M632 WeakPolarHBondContact O-CB 3.49Å; L629-M632 PolarHBondContact O-N 3.29Å; M632-E634 VanDerWaalsContact C-N 3.34Å; M632-E634 PolarHBondContact O-N 3.35Å; M632-L635 PolarHBondContact O-N 3.48Å; M632-L636 PolarHBondContact O-N 2.95Å
633	F	84.3	Confident	85.3	Confident	130 Å²	130	61.7 Å²	61.7	57%	0.57	31%	0.312	S	S	*	.	H	α-helix	trans	-68.1	-32.8	179.6	-72.9	-61	0	0	0	112.8	L629	L629-F633 WeakPolarHBondContact O-CD2 3.42Å; L629-F633 PolarHBondContact O-N 3.03Å
634	E	82.3	Confident	86	Confident	57 Å²	57	60.6 Å²	60.6	27%	0.266	31%	0.308	S	S	.	.	H	α-helix	trans	-68.2	-37.2	174.1	-171.7	171.1	154.1	0	0	112.2	D630 T631 M632 R765 R835	D630-E634 WeakPolarHBondContact O-CB 3.3Å; D630-E634 PolarHBondContact O-N 3.33Å; D630-E634 VanDerWaalsContact O-N 3.11Å; T631-E634 PolarHBondContact O-N 3.27Å; M632-E634 VanDerWaalsContact C-N 3.34Å; M632-E634 PolarHBondContact O-N 3.35Å; E634-R765 VanDerWaalsContact CD-NE 3.31Å; E634-R765 IonicContact OE1-NE 2.74Å; E634-R765 IonicContact OE2-CZ 3.6Å; E634-R765 IonicContact OE2-NE 2.74Å; E634-R765 PolarHBondContact OE2-NE 3.12Å; E634-R765 IonicContact OE2-NH2 3.15Å; E634-R765 PolarHBondContact OE2-NH2 3.38Å; E634-R835 WeakPolarHBondContact OE1-CB 3.33Å
635	L	86.4	Confident	86.7	Confident	12 Å²	12	52.4 Å²	52.4	6%	0.063	28%	0.277	C	S	.	.	H	α-helix	trans	-85.8	-11.6	179.7	-64.3	177.3	0	0	0	113.8	T631 M632 R638 M639 A761 F762 L840	T631-L635 WeakPolarHBondContact O-CB 3.23Å; T631-L635 VanDerWaalsContact O-CG 3.31Å; T631-L635 WeakPolarHBondContact O-CG 3.39Å; T631-L635 PolarHBondContact O-N 2.69Å; M632-L635 PolarHBondContact O-N 3.48Å; L635-R638 WeakPolarHBondContact O-CA 3.35Å; L635-R638 VanDerWaalsContact O-CB 3.27Å; L635-R638 WeakPolarHBondContact O-CB 3.45Å; L635-R638 PolarHBondContact O-N 3.49Å; L635-M639 PolarHBondContact O-N 2.89Å; L635-A761 HydrophobicContact CD1-CB 4.06Å; L635-A761 HydrophobicContact CD2-CB 4.08Å; L635-F762 HydrophobicContact CD1-CB 4.1Å; L635-F762 HydrophobicContact CD1-CD2 4.25Å; L635-L840 HydrophobicContact CD2-CD2 4.4Å
636	L	88	Confident	87.1	Confident	88 Å²	88	49 Å²	49	46%	0.461	27%	0.266	S	S	.	.	H	α-helix	trans	-52.3	-44.7	-175.5	-177	68	0	0	0	114	M632 R638 M639 A640	M632-L636 PolarHBondContact O-N 2.95Å; L636-R638 PolarHBondContact O-N 3.33Å; L636-M639 PolarHBondContact O-N 3.31Å; L636-A640 WeakPolarHBondContact O-CB 3.36Å; L636-A640 PolarHBondContact O-N 2.88Å
637	P	87.3	Confident	87.7	Confident	95 Å²	95	48.9 Å²	48.9	62%	0.617	27%	0.271	S	S	*	.	H	α-helix	trans	-63	-32.4	177.2	-22	34.6	0	0	0	112.9	S641	P637-S641 PolarHBondContact O-N 2.9Å
638	R	84.3	Confident	88.4	Confident	40 Å²	40	48.3 Å²	48.3	15%	0.151	27%	0.268	C	S	.	.	H	α-helix	trans	-70.6	-46.4	176.4	-157.2	-173.5	-172.5	-169.8	-9.3	109.8	E399 L635 L636 A640 S641 L642 F757	E399-R638 IonicContact OE1-CZ 3.27Å; E399-R638 IonicContact OE1-NH2 3.85Å; E399-R638 PolarHBondContact OE1-NH2 3.08Å; E399-R638 IonicContact OE2-NH2 2.68Å; L635-R638 WeakPolarHBondContact O-CA 3.35Å; L635-R638 VanDerWaalsContact O-CB 3.27Å; L635-R638 WeakPolarHBondContact O-CB 3.45Å; L635-R638 PolarHBondContact O-N 3.49Å; L636-R638 PolarHBondContact O-N 3.33Å; R638-A640 PolarHBondContact O-N 2.93Å; R638-S641 PolarHBondContact O-N 3.28Å; R638-S641 PolarHBondContact O-OG 3.12Å; R638-L642 PolarHBondContact O-N 2.93Å; R638-F757 VanDerWaalsContact CD-CE1 3.45Å; R638-F757 HydrophobicContact CG-CE1 3.69Å; R638-F757 HydrophobicContact CG-CZ 4.03Å; R638-F757 VanDerWaalsContact CZ-CE1 3.43Å; R638-F757 VanDerWaalsContact CZ-CE2 3.48Å
639	M	88.3	Confident	88.9	Confident	69 Å²	69	47 Å²	47	34%	0.34	26%	0.258	S	S	.	.	H	α-helix	trans	-59.5	-43.7	175.4	-65.6	176.4	69.1	0	0	111.9	L635 L636 S641 L642 G643 I758	L635-M639 PolarHBondContact O-N 2.89Å; L636-M639 PolarHBondContact O-N 3.31Å; M639-S641 VanDerWaalsContact C-N 3.29Å; M639-S641 PolarHBondContact O-N 3.15Å; M639-L642 PolarHBondContact O-N 2.92Å; M639-L642 VanDerWaalsContact O-N 3.17Å; M639-G643 PolarHBondContact O-N 3.45Å; M639-I758 HydrophobicContact CB-CD1 4.5Å; M639-I758 HydrophobicContact CE-CD1 4.22Å; M639-I758 HydrophobicContact CE-CG2 4.44Å; M639-I758 HydrophobicContact CG-CD1 3.91Å; M639-I758 HydrophobicContact CG-CG1 4.07Å; M639-I758 HydrophobicContact CG-CG2 4.45Å; M639-I758 HydrophobicContact SD-CG2 4.42Å
640	A	90	Very high	89.5	Confident	60 Å²	60	45.8 Å²	45.8	50%	0.496	25%	0.251	S	S	.	.	H	α-helix	trans	-60.3	-38.6	176.7	0	0	0	0	0	112.1	L636 R638 L642 G643 L644	L636-A640 WeakPolarHBondContact O-CB 3.36Å; L636-A640 PolarHBondContact O-N 2.88Å; R638-A640 PolarHBondContact O-N 2.93Å; A640-L642 PolarHBondContact O-N 3.36Å; A640-G643 PolarHBondContact O-N 3.42Å; A640-L644 WeakPolarHBondContact O-CB 3.46Å; A640-L644 PolarHBondContact O-N 3.41Å
641	S	91	Very high	90.3	Very high	27 Å²	27	43.4 Å²	43.4	19%	0.189	24%	0.237	C	C	.	.	H	α-helix	trans	-66.5	-34.8	176.6	76.4	0	0	0	0	113.4	N293 P637 R638 M639 T645	N293-S641 PolarHBondContact ND2-OG 3.38Å; P637-S641 PolarHBondContact O-N 2.9Å; R638-S641 PolarHBondContact O-N 3.28Å; R638-S641 PolarHBondContact O-OG 3.12Å; M639-S641 VanDerWaalsContact C-N 3.29Å; M639-S641 PolarHBondContact O-N 3.15Å; S641-T645 PolarHBondContact O-N 3.01Å; S641-T645 PolarHBondContact O-OG1 2.98Å
642	L	91	Very high	90.8	Very high	2 Å²	2	44.9 Å²	44.9	1%	0.01	25%	0.248	C	C	.	.	H	α-helix	trans	-74.4	-42.6	174.6	-74.6	176.8	0	0	0	112.1	N293 R638 M639 A640 L644 T645 L646 I754 F757 I758	N293-L642 HydrophobicContact CB-CD2 4.02Å; N293-L642 WeakPolarHBondContact ND2-CD2 3.35Å; R638-L642 PolarHBondContact O-N 2.93Å; M639-L642 PolarHBondContact O-N 2.92Å; M639-L642 VanDerWaalsContact O-N 3.17Å; A640-L642 PolarHBondContact O-N 3.36Å; L642-L644 PolarHBondContact O-N 3.01Å; L642-T645 WeakPolarHBondContact O-CA 3.34Å; L642-T645 VanDerWaalsContact O-CB 3.29Å; L642-T645 WeakPolarHBondContact O-CB 3.3Å; L642-T645 PolarHBondContact O-N 3Å; L642-L646 PolarHBondContact O-N 3.28Å; L642-I754 HydrophobicContact CB-CD1 4.34Å; L642-I754 HydrophobicContact CB-CG1 4.07Å; L642-I754 HydrophobicContact CB-CG2 4.2Å; L642-I754 HydrophobicContact CD1-CG1 4.41Å; L642-I754 HydrophobicContact CD1-CG2 4.2Å; L642-I754 HydrophobicContact CD2-CG1 4.16Å; L642-I754 HydrophobicContact CG-CG1 4.45Å; L642-F757 HydrophobicContact CD1-CD1 3.32Å; L642-F757 HydrophobicContact CD1-CE1 3.37Å; L642-F757 HydrophobicContact CD1-CG 4.25Å; L642-F757 HydrophobicContact CD1-CZ 4.32Å; L642-F757 HydrophobicContact CG-CD1 4.49Å; L642-F757 HydrophobicContact CG-CE1 4.16Å; L642-I758 HydrophobicContact CD1-CD1 4.31Å; L642-I758 HydrophobicContact CD1-CG1 4.07Å
643	G	92.2	Very high	91.4	Very high	32 Å²	32	42.9 Å²	42.9	33%	0.33	24%	0.237	S	C	.	.	H	α-helix	trans	-58.5	-38.1	173.3	0	0	0	0	0	111.9	M639 A640 T645 L646 L647	M639-G643 PolarHBondContact O-N 3.45Å; A640-G643 PolarHBondContact O-N 3.42Å; G643-T645 VanDerWaalsContact C-N 3.34Å; G643-T645 PolarHBondContact O-N 2.84Å; G643-L646 WeakPolarHBondContact O-CB 3.49Å; G643-L646 PolarHBondContact O-N 3.07Å; G643-L647 WeakPolarHBondContact O-CG 3.46Å; G643-L647 PolarHBondContact O-N 3.2Å
644	L	94.6	Very high	92	Very high	56 Å²	56	36.7 Å²	36.7	29%	0.293	21%	0.21	S	C	.	.	H	α-helix	trans	-67.1	-33	173.8	-173.3	55.7	0	0	0	112.7	L281 V290 A640 L642 L647 I648	L281-L644 HydrophobicContact CD2-CD1 4.36Å; V290-L644 HydrophobicContact CG2-CB 4.17Å; V290-L644 HydrophobicContact CG2-CD2 3.78Å; V290-L644 HydrophobicContact CG2-CG 4.08Å; A640-L644 WeakPolarHBondContact O-CB 3.46Å; A640-L644 PolarHBondContact O-N 3.41Å; L642-L644 PolarHBondContact O-N 3.01Å; L644-L647 HydrophobicContact CD1-CB 4.5Å; L644-L647 PolarHBondContact O-N 3.02Å; L644-I648 WeakPolarHBondContact O-CG1 3.37Å; L644-I648 PolarHBondContact O-N 3.22Å; L644-I648 VanDerWaalsContact O-N 3.11Å
645	T	93.4	Very high	92.7	Very high	0 Å²	0	34 Å²	34	0%	0	20%	0.197	C	C	.	.	H	α-helix	trans	-62.1	-43.1	170.4	-59.8	0	0	0	0	111.4	V290 L294 I297 S641 L642 G643 I648 F649	V290-T645 WeakPolarHBondContact CG1-OG1 3.26Å; L294-T645 HydrophobicContact CB-CG2 4.21Å; I297-T645 HydrophobicContact CD1-CG2 3.97Å; S641-T645 PolarHBondContact O-N 3.01Å; S641-T645 PolarHBondContact O-OG1 2.98Å; L642-T645 WeakPolarHBondContact O-CA 3.34Å; L642-T645 VanDerWaalsContact O-CB 3.29Å; L642-T645 WeakPolarHBondContact O-CB 3.3Å; L642-T645 PolarHBondContact O-N 3Å; G643-T645 VanDerWaalsContact C-N 3.34Å; G643-T645 PolarHBondContact O-N 2.84Å; T645-I648 WeakPolarHBondContact O-CB 3.41Å; T645-I648 PolarHBondContact O-N 3.37Å; T645-F649 HydrophobicContact CG2-CD2 4.47Å; T645-F649 HydrophobicContact CG2-CE2 4.05Å; T645-F649 VanDerWaalsContact O-CD2 3.31Å; T645-F649 WeakPolarHBondContact O-CD2 3.33Å; T645-F649 PolarHBondContact O-N 3.19Å
646	L	93.4	Very high	93.2	Very high	27 Å²	27	35.2 Å²	35.2	14%	0.141	21%	0.205	C	C	.	.	H	α-helix	trans	-62.2	-44	175	-179.3	64.8	0	0	0	111.8	L642 G643 I648 F649 Y650 V750 I754	L642-L646 PolarHBondContact O-N 3.28Å; G643-L646 WeakPolarHBondContact O-CB 3.49Å; G643-L646 PolarHBondContact O-N 3.07Å; L646-I648 PolarHBondContact O-N 2.82Å; L646-F649 WeakPolarHBondContact O-CB 3.48Å; L646-F649 PolarHBondContact O-N 3.43Å; L646-F649 VanDerWaalsContact O-N 3.08Å; L646-Y650 HydrophobicContact CD1-CD1 4.29Å; L646-Y650 HydrophobicContact CD1-CE1 3.8Å; L646-Y650 HydrophobicContact CG-CD1 4.44Å; L646-Y650 HydrophobicContact CG-CE1 4.06Å; L646-Y650 PolarHBondContact O-N 3.13Å; L646-V750 HydrophobicContact CD1-CG1 3.98Å; L646-I754 HydrophobicContact CB-CD1 4.16Å
647	L	94.9	Very high	93.6	Very high	83 Å²	83	31 Å²	31	44%	0.435	18%	0.183	S	C	.	.	H	α-helix	trans	-61.9	-29.4	177	-72.4	176.7	0	0	0	113.4	G643 L644 Y650 Y651	G643-L647 WeakPolarHBondContact O-CG 3.46Å; G643-L647 PolarHBondContact O-N 3.2Å; L644-L647 HydrophobicContact CD1-CB 4.5Å; L644-L647 PolarHBondContact O-N 3.02Å; L647-Y650 HydrophobicContact CD2-CD2 4.2Å; L647-Y650 PolarHBondContact O-N 2.81Å; L647-Y651 WeakPolarHBondContact O-CB 3.34Å; L647-Y651 PolarHBondContact O-N 3.03Å
648	I	95.3	Very high	93.9	Very high	13 Å²	13	26.6 Å²	26.6	7%	0.067	15%	0.154	C	C	.	.	H	α-helix	trans	-65.8	-42.2	173.4	-74.5	161.3	0	0	0	111	C278 V282 V290 L294 L644 T645 L646 Y651 S652	C278-I648 HydrophobicContact CB-CG2 3.83Å; V282-I648 HydrophobicContact CG2-CD1 3.63Å; V290-I648 HydrophobicContact CG1-CD1 3.43Å; V290-I648 VanDerWaalsContact CG1-CD1 3.43Å; L294-I648 HydrophobicContact CD1-CG2 4.19Å; L644-I648 WeakPolarHBondContact O-CG1 3.37Å; L644-I648 PolarHBondContact O-N 3.22Å; L644-I648 VanDerWaalsContact O-N 3.11Å; T645-I648 WeakPolarHBondContact O-CB 3.41Å; T645-I648 PolarHBondContact O-N 3.37Å; L646-I648 PolarHBondContact O-N 2.82Å; I648-Y651 PolarHBondContact O-N 3.38Å; I648-S652 PolarHBondContact O-N 3.47Å
649	F	95.2	Very high	94.4	Very high	23 Å²	23	26.4 Å²	26.4	10%	0.101	16%	0.155	C	C	.	.	H	α-helix	trans	-62.4	-47.3	173	-73.7	-73.6	0	0	0	110.6	F298 T645 L646 Y651 S652 F653 V746 V750	F298-F649 HydrophobicContact CE2-CZ 4.24Å; F298-F649 HydrophobicContact CZ-CE1 4.05Å; F298-F649 HydrophobicContact CZ-CZ 4.12Å; T645-F649 HydrophobicContact CG2-CD2 4.47Å; T645-F649 HydrophobicContact CG2-CE2 4.05Å; T645-F649 VanDerWaalsContact O-CD2 3.31Å; T645-F649 WeakPolarHBondContact O-CD2 3.33Å; T645-F649 PolarHBondContact O-N 3.19Å; L646-F649 WeakPolarHBondContact O-CB 3.48Å; L646-F649 PolarHBondContact O-N 3.43Å; L646-F649 VanDerWaalsContact O-N 3.08Å; F649-Y651 VanDerWaalsContact C-N 3.31Å; F649-Y651 PolarHBondContact O-N 3.22Å; F649-S652 PolarHBondContact O-N 3.07Å; F649-S652 PolarHBondContact O-OG 3.27Å; F649-F653 WeakPolarHBondContact O-CD2 3.28Å; F649-F653 PolarHBondContact O-N 3.27Å; F649-F653 VanDerWaalsContact O-N 3.07Å; F649-V746 HydrophobicContact CD1-CG1 3.81Å; F649-V746 HydrophobicContact CE1-CG1 3.99Å; F649-V746 HydrophobicContact CG-CG1 4.4Å; F649-V750 HydrophobicContact CD2-CG1 4.17Å; F649-V750 HydrophobicContact CD2-CG2 3.87Å; F649-V750 HydrophobicContact CE2-CG1 4.25Å; F649-V750 HydrophobicContact CE2-CG2 3.53Å; F649-V750 HydrophobicContact CZ-CG2 3.95Å
650	Y	96.9	Very high	94.7	Very high	12 Å²	12	28.7 Å²	28.7	5%	0.047	16%	0.163	C	C	.	.	H	α-helix	trans	-56.3	-44.1	176.1	-76.4	10.4	0	0	0	112.5	L646 L647 S652 F653 A654 L712 F713 T716 F743	L646-Y650 HydrophobicContact CD1-CD1 4.29Å; L646-Y650 HydrophobicContact CD1-CE1 3.8Å; L646-Y650 HydrophobicContact CG-CD1 4.44Å; L646-Y650 HydrophobicContact CG-CE1 4.06Å; L646-Y650 PolarHBondContact O-N 3.13Å; L647-Y650 HydrophobicContact CD2-CD2 4.2Å; L647-Y650 PolarHBondContact O-N 2.81Å; Y650-S652 PolarHBondContact O-N 3.1Å; Y650-F653 PolarHBondContact O-N 2.62Å; Y650-A654 WeakPolarHBondContact O-CB 3.2Å; Y650-A654 PolarHBondContact O-N 3.11Å; Y650-L712 WeakPolarHBondContact O-CD1 3.33Å; Y650-F713 HydrophobicContact CE2-CB 4.35Å; Y650-T716 WeakPolarHBondContact CE1-OG1 3.39Å; Y650-T716 WeakPolarHBondContact OH-CB 3.35Å; Y650-T716 WeakPolarHBondContact OH-CG2 3.24Å; Y650-T716 PolarHBondContact OH-OG1 3.48Å; Y650-F743 HydrophobicContact CD1-CE2 4.19Å; Y650-F743 HydrophobicContact CD1-CZ 4.36Å; Y650-F743 HydrophobicContact CE1-CE2 4.19Å; Y650-F743 AromaticContact CE1-CZ 3.93Å; Y650-F743 HydrophobicContact CE1-CZ 3.93Å
651	Y	97	Very high	94.9	Very high	12 Å²	12	26.5 Å²	26.5	5%	0.047	14%	0.143	C	C	.	.	H	α-helix	trans	-57.5	-48.9	177.6	-176.5	-83.9	0	0	0	111.8	L192 R274 R277 C278 L647 I648 F649 F653 A654 I655 F709	L192-Y651 HydrophobicContact CB-CE2 4.23Å; L192-Y651 HydrophobicContact CG-CD2 4.41Å; L192-Y651 HydrophobicContact CG-CE2 4.01Å; R274-Y651 WeakPolarHBondContact O-CE1 3.11Å; R277-Y651 HydrophobicContact CB-CE1 4.41Å; C278-Y651 WeakPolarHBondContact SG-CD1 3.14Å; L647-Y651 WeakPolarHBondContact O-CB 3.34Å; L647-Y651 PolarHBondContact O-N 3.03Å; I648-Y651 PolarHBondContact O-N 3.38Å; F649-Y651 VanDerWaalsContact C-N 3.31Å; F649-Y651 PolarHBondContact O-N 3.22Å; Y651-F653 PolarHBondContact O-N 2.97Å; Y651-A654 PolarHBondContact O-N 3.18Å; Y651-I655 HydrophobicContact CD1-CG1 4.1Å; Y651-I655 HydrophobicContact CE1-CD1 4.29Å; Y651-I655 HydrophobicContact CE1-CG1 3.77Å; Y651-I655 HydrophobicContact CE2-CD1 4.47Å; Y651-I655 VanDerWaalsContact O-CG1 3.26Å; Y651-I655 WeakPolarHBondContact O-CG1 3.2Å; Y651-I655 PolarHBondContact O-N 2.96Å; Y651-F709 HydrophobicContact CD2-CZ 4.38Å
652	S	96.2	Very high	95	Very high	32 Å²	32	28 Å²	28	22%	0.224	15%	0.152	C	C	.	.	H	α-helix	trans	-60.6	-46.7	178.7	62.8	0	0	0	0	112.9	I648 F649 Y650 V656	I648-S652 PolarHBondContact O-N 3.47Å; F649-S652 PolarHBondContact O-N 3.07Å; F649-S652 PolarHBondContact O-OG 3.27Å; Y650-S652 PolarHBondContact O-N 3.1Å; S652-V656 WeakPolarHBondContact O-CG2 3.36Å; S652-V656 PolarHBondContact O-N 3.43Å
653	F	97.4	Very high	95	Very high	30 Å²	30	30.3 Å²	30.3	13%	0.132	18%	0.177	C	C	.	.	H	α-helix	trans	-69.3	-35.6	179.3	-85.1	-91.8	0	0	0	112.8	F649 Y650 Y651 V656 G657 L712 Y739 T742 F743 V746	F649-F653 WeakPolarHBondContact O-CD2 3.28Å; F649-F653 PolarHBondContact O-N 3.27Å; F649-F653 VanDerWaalsContact O-N 3.07Å; Y650-F653 PolarHBondContact O-N 2.62Å; Y651-F653 PolarHBondContact O-N 2.97Å; F653-V656 PolarHBondContact O-N 2.9Å; F653-G657 PolarHBondContact O-N 3.42Å; F653-L712 HydrophobicContact CB-CD1 3.92Å; F653-L712 HydrophobicContact CB-CD2 4.38Å; F653-Y739 HydrophobicContact CD1-CD2 4.27Å; F653-Y739 AromaticContact CD1-CE2 3.67Å; F653-Y739 HydrophobicContact CD1-CE2 3.67Å; F653-Y739 AromaticContact CD1-CZ 3.96Å; F653-Y739 HydrophobicContact CE1-CE2 4.42Å; F653-Y739 PolarHBondContact O-OH 3.4Å; F653-T742 HydrophobicContact CZ-CG2 4.33Å; F653-F743 HydrophobicContact CB-CD2 4.11Å; F653-F743 HydrophobicContact CB-CE2 4.41Å; F653-F743 HydrophobicContact CD1-CB 3.92Å; F653-F743 AromaticContact CD1-CD2 3.66Å; F653-F743 HydrophobicContact CD1-CD2 3.66Å; F653-F743 HydrophobicContact CD1-CG 4.23Å; F653-F743 HydrophobicContact CD2-CD2 4.04Å; F653-F743 HydrophobicContact CE1-CB 3.69Å; F653-F743 HydrophobicContact CE1-CD2 4.02Å; F653-F743 HydrophobicContact CE1-CG 4.37Å; F653-F743 HydrophobicContact CE2-CD2 4.36Å; F653-F743 AromaticContact CG-CD2 3.67Å; F653-F743 HydrophobicContact CG-CD2 3.67Å; F653-F743 HydrophobicContact CG-CE2 4.34Å; F653-F743 HydrophobicContact CZ-CB 4.34Å; F653-F743 HydrophobicContact CZ-CD2 4.35Å; F653-V746 HydrophobicContact CE2-CG1 4.32Å; F653-V746 HydrophobicContact CZ-CG2 4.42Å
654	A	97.5	Very high	94.9	Very high	0 Å²	0	30.6 Å²	30.6	0%	0	17%	0.171	C	C	.	.	H	α-helix	trans	-68.5	-41.9	178.8	0	0	0	0	0	111.3	Y650 Y651 V656 G657 M658 I705 F709 L712	Y650-A654 WeakPolarHBondContact O-CB 3.2Å; Y650-A654 PolarHBondContact O-N 3.11Å; Y651-A654 PolarHBondContact O-N 3.18Å; A654-V656 PolarHBondContact O-N 3.23Å; A654-G657 PolarHBondContact O-N 2.86Å; A654-M658 WeakPolarHBondContact O-CB 3.21Å; A654-M658 VanDerWaalsContact O-CG 3.24Å; A654-M658 WeakPolarHBondContact O-CG 3.41Å; A654-M658 PolarHBondContact O-N 3.27Å; A654-I705 HydrophobicContact CB-CD1 3.58Å; A654-F709 HydrophobicContact CB-CD1 3.76Å; A654-F709 HydrophobicContact CB-CE1 3.68Å; A654-L712 HydrophobicContact CB-CD1 3.8Å
655	I	96.7	Very high	94.8	Very high	0 Å²	0	28.3 Å²	28.3	0%	0	16%	0.159	C	C	.	.	H	α-helix	trans	-59.2	-48.5	173.9	-66.3	-70.8	0	0	0	110.5	S195 R274 A275 Y651 G657 M658 E659 I705	S195-I655 VanDerWaalsContact OG-CD1 3.25Å; S195-I655 WeakPolarHBondContact OG-CD1 3.49Å; R274-I655 HydrophobicContact CB-CD1 4.14Å; R274-I655 HydrophobicContact CB-CG2 3.83Å; A275-I655 HydrophobicContact CB-CB 4.18Å; A275-I655 HydrophobicContact CB-CG2 4.09Å; Y651-I655 HydrophobicContact CD1-CG1 4.1Å; Y651-I655 HydrophobicContact CE1-CD1 4.29Å; Y651-I655 HydrophobicContact CE1-CG1 3.77Å; Y651-I655 HydrophobicContact CE2-CD1 4.47Å; Y651-I655 VanDerWaalsContact O-CG1 3.26Å; Y651-I655 WeakPolarHBondContact O-CG1 3.2Å; Y651-I655 PolarHBondContact O-N 2.96Å; I655-G657 PolarHBondContact O-N 3.42Å; I655-M658 HydrophobicContact CD1-CE 3.68Å; I655-M658 HydrophobicContact CG1-CE 4.45Å; I655-M658 PolarHBondContact O-N 3.47Å; I655-E659 VanDerWaalsContact O-CG 3.29Å; I655-E659 WeakPolarHBondContact O-CG 3.37Å; I655-E659 PolarHBondContact O-N 3.46Å; I655-E659 VanDerWaalsContact O-N 3.09Å; I655-I705 HydrophobicContact CD1-CD1 4.39Å
656	V	96.4	Very high	94.6	Very high	38 Å²	38	33.4 Å²	33.4	23%	0.23	18%	0.182	C	C	.	.	H	α-helix	trans	-59.5	-47.7	177.1	172.3	0	0	0	0	110.6	V272 S652 F653 A654 M658 E659 F660 Y739	V272-V656 HydrophobicContact CG1-CG2 4.16Å; S652-V656 WeakPolarHBondContact O-CG2 3.36Å; S652-V656 PolarHBondContact O-N 3.43Å; F653-V656 PolarHBondContact O-N 2.9Å; A654-V656 PolarHBondContact O-N 3.23Å; V656-M658 PolarHBondContact O-N 3.03Å; V656-E659 PolarHBondContact O-N 2.99Å; V656-F660 HydrophobicContact CG1-CD2 3.73Å; V656-F660 HydrophobicContact CG1-CE2 3.9Å; V656-F660 WeakPolarHBondContact O-CD2 3.47Å; V656-F660 PolarHBondContact O-N 3.42Å; V656-Y739 HydrophobicContact CB-CE2 4.22Å; V656-Y739 HydrophobicContact CG1-CD2 4.02Å; V656-Y739 HydrophobicContact CG1-CE2 3.81Å
657	G	96.1	Very high	94.6	Very high	0 Å²	0	35.3 Å²	35.3	0%	0	20%	0.195	C	C	.	.	H	α-helix	trans	-62.4	-40.5	-179.8	0	0	0	0	0	113	F653 A654 I655 F660 F661	F653-G657 PolarHBondContact O-N 3.42Å; A654-G657 PolarHBondContact O-N 2.86Å; I655-G657 PolarHBondContact O-N 3.42Å; G657-F660 PolarHBondContact O-N 3.41Å; G657-F661 WeakPolarHBondContact O-CA 3.35Å; G657-F661 WeakPolarHBondContact O-CB 3.33Å; G657-F661 WeakPolarHBondContact O-CD2 3.49Å; G657-F661 PolarHBondContact O-N 3.42Å
658	M	95.1	Very high	94.4	Very high	2 Å²	2	35.4 Å²	35.4	1%	0.01	20%	0.196	C	C	.	.	H	α-helix	trans	-64.1	-45	175.8	-76.3	-168.9	-59	0	0	112.5	P200 A654 I655 V656 F660 C662 F702 I705 S708	P200-M658 HydrophobicContact CG-CB 3.74Å; P200-M658 HydrophobicContact CG-CG 4.21Å; P200-M658 HydrophobicContact CG-SD 4.03Å; A654-M658 WeakPolarHBondContact O-CB 3.21Å; A654-M658 VanDerWaalsContact O-CG 3.24Å; A654-M658 WeakPolarHBondContact O-CG 3.41Å; A654-M658 PolarHBondContact O-N 3.27Å; I655-M658 HydrophobicContact CD1-CE 3.68Å; I655-M658 HydrophobicContact CG1-CE 4.45Å; I655-M658 PolarHBondContact O-N 3.47Å; V656-M658 PolarHBondContact O-N 3.03Å; M658-F660 VanDerWaalsContact C-N 3.29Å; M658-F660 PolarHBondContact O-N 2.82Å; M658-C662 WeakPolarHBondContact O-CB 3.49Å; M658-C662 PolarHBondContact O-N 3.01Å; M658-F702 WeakPolarHBondContact CA-O 3.42Å; M658-F702 WeakPolarHBondContact CG-O 3.42Å; M658-I705 HydrophobicContact CE-CB 3.98Å; M658-I705 HydrophobicContact CE-CD1 3.5Å; M658-I705 HydrophobicContact CE-CG1 4.32Å; M658-I705 WeakPolarHBondContact SD-CA 3.25Å; M658-I705 HydrophobicContact SD-CB 3.87Å; M658-I705 HydrophobicContact SD-CD1 4.27Å; M658-I705 PolarHBondContact SD-N 3.3Å; M658-S708 VanDerWaalsContact CG-OG 3.22Å; M658-S708 WeakPolarHBondContact CG-OG 3.47Å
659	E	94.1	Very high	94.1	Very high	36 Å²	36	35 Å²	35	17%	0.168	20%	0.195	C	C	.	.	H	α-helix	trans	-67.1	-31.1	-178.1	-66	-71.1	160.8	0	0	112.4	V270 R271 V272 R274 I655 V656	V270-E659 WeakPolarHBondContact CA-OE2 3.18Å; V270-E659 HydrophobicContact CG1-CB 4.33Å; R271-E659 PolarHBondContact N-OE2 2.87Å; V272-E659 HydrophobicContact CG2-CB 4.11Å; V272-E659 HydrophobicContact CG2-CG 4.25Å; R274-E659 IonicContact CZ-OE1 3.87Å; R274-E659 IonicContact NE-OE1 2.66Å; R274-E659 PolarHBondContact NE-OE1 2.92Å; R274-E659 IonicContact NH2-OE1 2.86Å; R274-E659 PolarHBondContact NH2-OE1 3.49Å; I655-E659 VanDerWaalsContact O-CG 3.29Å; I655-E659 WeakPolarHBondContact O-CG 3.37Å; I655-E659 PolarHBondContact O-N 3.46Å; I655-E659 VanDerWaalsContact O-N 3.09Å; V656-E659 PolarHBondContact O-N 2.99Å
660	F	94.1	Very high	93.9	Very high	117 Å²	117	34 Å²	34	51%	0.513	19%	0.191	S	C	.	.	H	α-helix	trans	-98.4	-28.4	-178.3	-68.9	-62.1	0	0	0	114.8	V272 V656 G657 M658 I664	V272-F660 HydrophobicContact CG2-CE2 4.05Å; V272-F660 HydrophobicContact CG2-CZ 4.11Å; V656-F660 HydrophobicContact CG1-CD2 3.73Å; V656-F660 HydrophobicContact CG1-CE2 3.9Å; V656-F660 WeakPolarHBondContact O-CD2 3.47Å; V656-F660 PolarHBondContact O-N 3.42Å; G657-F660 PolarHBondContact O-N 3.41Å; M658-F660 VanDerWaalsContact C-N 3.29Å; M658-F660 PolarHBondContact O-N 2.82Å; F660-I664 VanDerWaalsContact O-CD1 3.28Å; F660-I664 WeakPolarHBondContact O-CD1 3.3Å
661	F	95.2	Very high	93.6	Very high	14 Å²	14	39.4 Å²	39.4	6%	0.061	22%	0.22	C	C	.	.	H	α-helix	trans	-121	7.2	-169.7	-46.2	-48.8	0	0	0	114.8	G657 G663 I664 F702 V728 T732 Y739	G657-F661 WeakPolarHBondContact O-CA 3.35Å; G657-F661 WeakPolarHBondContact O-CB 3.33Å; G657-F661 WeakPolarHBondContact O-CD2 3.49Å; G657-F661 PolarHBondContact O-N 3.42Å; F661-G663 PolarHBondContact O-N 3.38Å; F661-I664 HydrophobicContact CD1-CD1 4.47Å; F661-F702 HydrophobicContact CB-CB 4.05Å; F661-F702 HydrophobicContact CB-CD2 3.96Å; F661-F702 HydrophobicContact CB-CG 4.21Å; F661-F702 HydrophobicContact CD2-CD2 4.15Å; F661-F702 HydrophobicContact CD2-CE2 4.32Å; F661-F702 HydrophobicContact CD2-CG 4.44Å; F661-V728 HydrophobicContact CD1-CG1 3.59Å; F661-V728 HydrophobicContact CD2-CG1 4.46Å; F661-V728 HydrophobicContact CE1-CG1 3.75Å; F661-V728 HydrophobicContact CG-CG1 3.98Å; F661-V728 HydrophobicContact CZ-CG1 4.26Å; F661-T732 HydrophobicContact CD1-CG2 4.36Å; F661-Y739 AromaticContact CE2-CD1 3.71Å; F661-Y739 HydrophobicContact CE2-CD1 3.71Å; F661-Y739 HydrophobicContact CE2-CD2 4.3Å; F661-Y739 AromaticContact CE2-CE1 3.89Å; F661-Y739 HydrophobicContact CE2-CE1 3.89Å; F661-Y739 HydrophobicContact CE2-CE2 4.43Å; F661-Y739 AromaticContact CE2-CG 3.94Å; F661-Y739 HydrophobicContact CE2-CG 3.94Å; F661-Y739 HydrophobicContact CZ-CD1 4.32Å; F661-Y739 HydrophobicContact CZ-CG 4.26Å
662	C	92.6	Very high	93.1	Very high	58 Å²	58	44.6 Å²	44.6	39%	0.392	25%	0.253	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.9	130.8	175.3	174.3	0	0	0	0	111.7	P200 M658 I664	P200-C662 HydrophobicContact CB-CB 4.43Å; P200-C662 HydrophobicContact CG-CB 4.37Å; M658-C662 WeakPolarHBondContact O-CB 3.49Å; M658-C662 PolarHBondContact O-N 3.01Å; C662-I664 PolarHBondContact O-N 3.41Å
663	G	90.2	Very high	92.8	Very high	52 Å²	52	44.2 Å²	44.2	54%	0.536	25%	0.251	S	S	.	.	T	Hydrogen-bonded Turn	trans	71.8	8	175.4	0	0	0	0	0	115.4	F661 D703	F661-G663 PolarHBondContact O-N 3.38Å; G663-D703 WeakPolarHBondContact CA-OD1 3.45Å; G663-D703 PolarHBondContact N-OD1 3.12Å
664	I	90.9	Very high	92.4	Very high	37 Å²	37	48.3 Å²	48.3	19%	0.19	28%	0.278	C	S	.	.	T	Hydrogen-bonded Turn	trans	-84	-37	-177.3	-60	-163.1	0	0	0	111.7	F660 F661 C662 F666 Q731 T732	F660-I664 VanDerWaalsContact O-CD1 3.28Å; F660-I664 WeakPolarHBondContact O-CD1 3.3Å; F661-I664 HydrophobicContact CD1-CD1 4.47Å; C662-I664 PolarHBondContact O-N 3.41Å; I664-F666 WeakPolarHBondContact O-CD1 3.49Å; I664-Q731 HydrophobicContact CG2-CB 3.23Å; I664-Q731 HydrophobicContact CG2-CG 3.96Å; I664-T732 HydrophobicContact CD1-CG2 3.38Å; I664-T732 HydrophobicContact CG2-CG2 3.94Å
665	V	91.6	Very high	92.1	Very high	9 Å²	9	48.8 Å²	48.8	6%	0.055	28%	0.281	C	S	.	.			trans	-93.8	120.8	179.5	178.6	0	0	0	0	108.8	Y679 V728	V665-Y679 HydrophobicContact CG1-CD1 4.05Å; V665-Y679 HydrophobicContact CG1-CE1 3.62Å; V665-V728 HydrophobicContact CG2-CG2 4.11Å
666	F	90.6	Very high	91.8	Very high	107 Å²	107	50.2 Å²	50.2	47%	0.469	29%	0.293	S	S	.	.			trans	-139.4	162.6	179.4	57	-90.4	0	0	0	111.1	I664 N668 C669	I664-F666 WeakPolarHBondContact O-CD1 3.49Å; F666-N668 PolarHBondContact O-N 3.07Å; F666-C669 HydrophobicContact CD1-CB 4.1Å; F666-C669 HydrophobicContact CD2-CB 3.83Å; F666-C669 HydrophobicContact CE1-CB 3.85Å; F666-C669 HydrophobicContact CE2-CB 3.58Å; F666-C669 HydrophobicContact CG-CB 4.08Å; F666-C669 HydrophobicContact CZ-CB 3.59Å; F666-C669 WeakPolarHBondContact O-CB 3.47Å; F666-C669 PolarHBondContact O-N 3.49Å; F666-C669 PolarHBondContact O-SG 2.9Å
667	P	92.4	Very high	91.6	Very high	66 Å²	66	54.1 Å²	54.1	43%	0.429	31%	0.313	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.8	135	-178.6	-24.7	34.5	0	0	0	112.4	W681 Y698	P667-W681 HydrophobicContact CB-CB 4.04Å; P667-W681 HydrophobicContact CB-CD2 4.37Å; P667-W681 HydrophobicContact CB-CE3 4.32Å; P667-W681 HydrophobicContact CB-CG 4.25Å; P667-Y698 HydrophobicContact CB-CD2 4.44Å; P667-Y698 HydrophobicContact CB-CG 4.36Å; P667-Y698 HydrophobicContact CG-CD2 3.98Å; P667-Y698 HydrophobicContact CG-CE2 4.4Å; P667-Y698 HydrophobicContact CG-CG 4.29Å
668	N	90.1	Very high	91.4	Very high	85 Å²	85	54.9 Å²	54.9	46%	0.455	32%	0.319	S	S	.	.	T	Hydrogen-bonded Turn	trans	64.8	29.3	-179.7	-151.2	33.8	0	0	0	115.6	F666 Y679 W681	F666-N668 PolarHBondContact O-N 3.07Å; N668-Y679 WeakPolarHBondContact CA-O 3.16Å; N668-Y679 PolarHBondContact N-O 3.02Å; N668-W681 HydrophobicContact CB-CB 4.13Å
669	C	90.1	Very high	91.3	Very high	6 Å²	6	54.9 Å²	54.9	4%	0.041	32%	0.319	C	S	.	.			trans	-88.8	-169.9	171.9	72.9	0	0	0	0	112.6	F666 N671	F666-C669 HydrophobicContact CD1-CB 4.1Å; F666-C669 HydrophobicContact CD2-CB 3.83Å; F666-C669 HydrophobicContact CE1-CB 3.85Å; F666-C669 HydrophobicContact CE2-CB 3.58Å; F666-C669 HydrophobicContact CG-CB 4.08Å; F666-C669 HydrophobicContact CZ-CB 3.59Å; F666-C669 WeakPolarHBondContact O-CB 3.47Å; F666-C669 PolarHBondContact O-N 3.49Å; F666-C669 PolarHBondContact O-SG 2.9Å; C669-N671 PolarHBondContact O-N 3.34Å; C669-N671 VanDerWaalsContact O-N 3.07Å
670	C	91	Very high	91.2	Very high	1 Å²	1	56.3 Å²	56.3	1%	0.007	32%	0.323	C	S	.	.			trans	58.6	21.7	173.3	-53	0	0	0	0	116.1	T672 S673 Y679 G727 S730	C670-T672 PolarHBondContact O-N 2.91Å; C670-T672 VanDerWaalsContact O-N 3.16Å; C670-S673 PolarHBondContact O-N 3.42Å; C670-S673 VanDerWaalsContact O-N 3.12Å; C670-S673 PolarHBondContact O-OG 3.26Å; C670-Y679 HydrophobicContact CB-CD2 4Å; C670-Y679 HydrophobicContact CB-CG 4.22Å; C670-G727 PolarHBondContact SG-O 3.13Å; C670-S730 WeakPolarHBondContact CB-OG 3.12Å; C670-S730 PolarHBondContact SG-OG 3.44Å
671	N	89.7	Confident	91	Very high	125 Å²	125	55 Å²	55	67%	0.668	32%	0.315	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.4	-19	-172.9	64.6	-8.7	0	0	0	115.2	C669	C669-N671 PolarHBondContact O-N 3.34Å; C669-N671 VanDerWaalsContact O-N 3.07Å
672	T	88	Confident	90.6	Very high	121 Å²	121	61.2 Å²	61.2	74%	0.742	34%	0.338	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.3	-12	177.6	51.7	0	0	0	0	113.6	C670	C670-T672 PolarHBondContact O-N 2.91Å; C670-T672 VanDerWaalsContact O-N 3.16Å
673	S	89.8	Confident	90.4	Very high	25 Å²	25	63.4 Å²	63.4	18%	0.175	35%	0.346	C	S	.	.	S	Bend	trans	-96.5	167.2	-175.7	71.9	0	0	0	0	112.1	C670 V675 A676	C670-S673 PolarHBondContact O-N 3.42Å; C670-S673 VanDerWaalsContact O-N 3.12Å; C670-S673 PolarHBondContact O-OG 3.26Å; S673-V675 PolarHBondContact O-N 3.15Å; S673-V675 WeakPolarHBondContact OG-CG2 3.11Å; S673-V675 PolarHBondContact OG-N 3.43Å; S673-A676 PolarHBondContact O-N 3.46Å
674	T	87.8	Confident	90.2	Very high	115 Å²	115	64.9 Å²	64.9	71%	0.706	34%	0.339	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.6	-13.6	173.1	52.6	0	0	0	0	113.2	P333	P333-T674 HydrophobicContact CB-CG2 4.47Å
675	V	92	Very high	90	Very high	10 Å²	10	68.4 Å²	68.4	6%	0.061	36%	0.362	C	S	.	.	T	Hydrogen-bonded Turn	trans	-98.6	11.8	-179.2	-60	0	0	0	0	113.4	S673 D677 A678 Y679 I723 E726	S673-V675 PolarHBondContact O-N 3.15Å; S673-V675 WeakPolarHBondContact OG-CG2 3.11Å; S673-V675 PolarHBondContact OG-N 3.43Å; V675-D677 PolarHBondContact O-N 3.12Å; V675-D677 VanDerWaalsContact O-N 3.12Å; V675-A678 WeakPolarHBondContact O-CB 3.46Å; V675-A678 PolarHBondContact O-N 3.38Å; V675-Y679 HydrophobicContact CB-CE2 4.44Å; V675-Y679 HydrophobicContact CG2-CD2 4.15Å; V675-Y679 HydrophobicContact CG2-CE2 3.97Å; V675-I723 HydrophobicContact CB-CG2 4.25Å; V675-I723 HydrophobicContact CG1-CG2 4.26Å; V675-E726 HydrophobicContact CG1-CB 4.04Å; V675-E726 HydrophobicContact CG2-CB 4.23Å
676	A	90.8	Very high	89.6	Confident	31 Å²	31	73.1 Å²	73.1	26%	0.256	39%	0.39	S	S	.	.	T	Hydrogen-bonded Turn	trans	-52.8	-34.9	-179.1	0	0	0	0	0	113.8	S673 A678 Y679 R680	S673-A676 PolarHBondContact O-N 3.46Å; A676-A678 VanDerWaalsContact C-N 3.29Å; A676-A678 PolarHBondContact O-N 3.22Å; A676-Y679 PolarHBondContact O-N 3.43Å; A676-R680 PolarHBondContact O-N 3.24Å
677	D	90.9	Very high	89.4	Confident	119 Å²	119	71.4 Å²	71.4	64%	0.636	40%	0.403	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.6	-30.9	-179.8	-163.8	39.7	0	0	0	112.6	V675 R680	V675-D677 PolarHBondContact O-N 3.12Å; V675-D677 VanDerWaalsContact O-N 3.12Å; D677-R680 VanDerWaalsContact O-CD 3.23Å; D677-R680 WeakPolarHBondContact O-CD 3.37Å; D677-R680 VanDerWaalsContact O-CG 3.24Å; D677-R680 WeakPolarHBondContact O-CG 3.45Å; D677-R680 WeakPolarHBondContact OD1-CD 3.39Å; D677-R680 IonicContact OD1-NE 3.06Å; D677-R680 PolarHBondContact OD1-NE 3.37Å
678	A	92.1	Very high	89.2	Confident	17 Å²	17	76.8 Å²	76.8	14%	0.14	43%	0.428	C	S	.	.	T	Hydrogen-bonded Turn	trans	-74.6	-26	179	0	0	0	0	0	113.1	V675 A676 G695 Y697 I723	V675-A678 WeakPolarHBondContact O-CB 3.46Å; V675-A678 PolarHBondContact O-N 3.38Å; A676-A678 VanDerWaalsContact C-N 3.29Å; A676-A678 PolarHBondContact O-N 3.22Å; A678-G695 CarbonylContact O-C 3.24Å; A678-G695 WeakPolarHBondContact O-CA 3.24Å; A678-G695 VanDerWaalsContact O-O 3.05Å; A678-Y697 HydrophobicContact CB-CD2 3.74Å; A678-Y697 HydrophobicContact CB-CE2 4.42Å; A678-Y697 HydrophobicContact CB-CG 4.16Å; A678-Y697 PolarHBondContact O-N 3.44Å; A678-I723 HydrophobicContact CB-CG2 3.69Å
679	Y	93.6	Very high	88.9	Confident	1 Å²	1	82.5 Å²	82.5	0%	0.004	44%	0.444	C	S	.	.	T	Hydrogen-bonded Turn	trans	-100.7	6	-177.9	-70.5	-84.9	0	0	0	113.6	V665 N668 C670 V675 A676 Y697 I723	V665-Y679 HydrophobicContact CG1-CD1 4.05Å; V665-Y679 HydrophobicContact CG1-CE1 3.62Å; N668-Y679 WeakPolarHBondContact CA-O 3.16Å; N668-Y679 PolarHBondContact N-O 3.02Å; C670-Y679 HydrophobicContact CB-CD2 4Å; C670-Y679 HydrophobicContact CB-CG 4.22Å; V675-Y679 HydrophobicContact CB-CE2 4.44Å; V675-Y679 HydrophobicContact CG2-CD2 4.15Å; V675-Y679 HydrophobicContact CG2-CE2 3.97Å; A676-Y679 PolarHBondContact O-N 3.43Å; Y679-Y697 WeakPolarHBondContact CE1-O 3.4Å; Y679-I723 HydrophobicContact CE2-CG2 4.21Å; Y679-I723 PolarHBondContact OH-O 3.15Å
680	R	92.1	Very high	88.6	Confident	66 Å²	66	87 Å²	87	25%	0.249	47%	0.471	C	S	.	.			trans	-66.1	143.3	-176.1	75.2	-167.7	179.7	104.3	-0.7	112.7	A676 D677 E693 E694 G695	A676-R680 PolarHBondContact O-N 3.24Å; D677-R680 VanDerWaalsContact O-CD 3.23Å; D677-R680 WeakPolarHBondContact O-CD 3.37Å; D677-R680 VanDerWaalsContact O-CG 3.24Å; D677-R680 WeakPolarHBondContact O-CG 3.45Å; D677-R680 WeakPolarHBondContact OD1-CD 3.39Å; D677-R680 IonicContact OD1-NE 3.06Å; D677-R680 PolarHBondContact OD1-NE 3.37Å; R680-E693 IonicContact CZ-OE2 3.96Å; R680-E693 IonicContact NH1-OE2 2.75Å; R680-E693 PolarHBondContact NH1-OE2 3.44Å; R680-E693 IonicContact NH2-OE2 3.14Å; R680-E694 WeakPolarHBondContact O-CA 3.4Å; R680-G695 PolarHBondContact O-N 3.37Å
681	W	89.6	Confident	88.3	Confident	89 Å²	89	90.7 Å²	90.7	34%	0.337	49%	0.493	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.5	108.6	166.2	178.6	-71.3	0	0	0	108	P667 N668 N683 V692 E694 Y698	P667-W681 HydrophobicContact CB-CB 4.04Å; P667-W681 HydrophobicContact CB-CD2 4.37Å; P667-W681 HydrophobicContact CB-CE3 4.32Å; P667-W681 HydrophobicContact CB-CG 4.25Å; N668-W681 HydrophobicContact CB-CB 4.13Å; W681-N683 PolarHBondContact NE1-OD1 2.93Å; W681-N683 VanDerWaalsContact NE1-OD1 3.16Å; W681-V692 HydrophobicContact CD2-CG1 4.11Å; W681-V692 HydrophobicContact CH2-CG1 4.41Å; W681-V692 HydrophobicContact CZ2-CG1 3.85Å; W681-E694 HydrophobicContact CD2-CG 4.13Å; W681-E694 HydrophobicContact CE3-CB 4.48Å; W681-E694 HydrophobicContact CE3-CG 3.6Å; W681-E694 HydrophobicContact CH2-CG 4.4Å; W681-E694 WeakPolarHBondContact CH2-OE1 3.36Å; W681-E694 HydrophobicContact CZ3-CG 3.77Å; W681-E694 WeakPolarHBondContact CZ3-OE1 3.36Å; W681-E694 WeakPolarHBondContact CZ3-OE2 3.44Å; W681-Y698 AromaticContact CE3-CE1 3.95Å; W681-Y698 HydrophobicContact CE3-CE1 3.95Å; W681-Y698 HydrophobicContact CE3-CE2 4.12Å; W681-Y698 AromaticContact CE3-CZ 3.5Å; W681-Y698 VanDerWaalsContact CE3-CZ 3.5Å; W681-Y698 HydrophobicContact CZ3-CE2 4.14Å; W681-Y698 AromaticContact CZ3-CZ 3.74Å; W681-Y698 WeakPolarHBondContact CZ3-OH 3.43Å
682	R	87.1	Confident	88.1	Confident	146 Å²	146	87.2 Å²	87.2	55%	0.551	48%	0.476	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-130.5	131.5	179.7	-66.4	-171.5	-169.5	177.6	5.1	111.5	V692 E693	R682-V692 WeakPolarHBondContact O-CA 3.11Å; R682-E693 PolarHBondContact N-O 2.7Å; R682-E693 PolarHBondContact O-N 3.07Å
683	N	88.9	Confident	87.9	Confident	103 Å²	103	85.4 Å²	85.4	55%	0.551	46%	0.459	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-95	123.1	174.7	-62.1	-13.7	0	0	0	109	W681 V692	W681-N683 PolarHBondContact NE1-OD1 2.93Å; W681-N683 VanDerWaalsContact NE1-OD1 3.16Å; N683-V692 WeakPolarHBondContact OD1-CG1 3.42Å
684	H	85.4	Confident	87.8	Confident	84 Å²	84	86.3 Å²	86.3	39%	0.389	46%	0.461	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	122.5	171.9	-70.2	-80.6	0	0	0	109.6	V691	H684-V691 PolarHBondContact N-O 3.47Å; H684-V691 PolarHBondContact O-N 3.15Å; H684-V691 VanDerWaalsContact O-O 3.12Å
685	T	86.1	Confident	87.8	Confident	111 Å²	111	81.7 Å²	81.7	68%	0.681	44%	0.436	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-89.3	113.6	175.3	42.5	0	0	0	0	109.9	T690	T685-T690 HydrophobicContact CG2-CG2 3.72Å
686	V	84.2	Confident	87.9	Confident	107 Å²	107	87.8 Å²	87.8	65%	0.648	46%	0.459	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-112.8	100.7	173.1	-175.8	0	0	0	0	107.7	N688 R689	V686-N688 PolarHBondContact O-N 2.83Å; V686-R689 PolarHBondContact N-O 3.28Å; V686-R689 PolarHBondContact O-N 3.43Å
687	G	86.4	Confident	88.1	Confident	72 Å²	72	88.9 Å²	88.9	74%	0.742	46%	0.457	S	S	*	.	T	Hydrogen-bonded Turn	trans	64.8	-126.6	-171	0	0	0	0	0	111.8
688	N	88.1	Confident	88.2	Confident	179 Å²	179	83.9 Å²	83.9	96%	0.957	43%	0.429	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90	3.6	177.5	-71.8	-4.5	0	0	0	114	V686	V686-N688 PolarHBondContact O-N 2.83Å
689	R	82.8	Confident	88.3	Confident	205 Å²	205	87.9 Å²	87.9	77%	0.774	45%	0.447	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-109.2	126	-179	-66	-177.1	-178.6	175.9	0.7	110.3	V686	V686-R689 PolarHBondContact N-O 3.28Å; V686-R689 PolarHBondContact O-N 3.43Å
690	T	84.9	Confident	88.4	Confident	101 Å²	101	88.9 Å²	88.9	62%	0.62	45%	0.453	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-82.6	111	166.1	49.1	0	0	0	0	108.2	T685	T685-T690 HydrophobicContact CG2-CG2 3.72Å
691	V	83.8	Confident	88.5	Confident	77 Å²	77	86.5 Å²	86.5	47%	0.467	45%	0.445	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	125.5	170	-177.2	0	0	0	0	107	H684	H684-V691 PolarHBondContact N-O 3.47Å; H684-V691 PolarHBondContact O-N 3.15Å; H684-V691 VanDerWaalsContact O-O 3.12Å
692	V	85.8	Confident	88.8	Confident	52 Å²	52	82.4 Å²	82.4	32%	0.315	43%	0.43	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	128	177.3	-167.8	0	0	0	0	108.2	W681 R682 N683 E694	W681-V692 HydrophobicContact CD2-CG1 4.11Å; W681-V692 HydrophobicContact CH2-CG1 4.41Å; W681-V692 HydrophobicContact CZ2-CG1 3.85Å; R682-V692 WeakPolarHBondContact O-CA 3.11Å; N683-V692 WeakPolarHBondContact OD1-CG1 3.42Å; V692-E694 HydrophobicContact CB-CG 4.31Å; V692-E694 HydrophobicContact CG1-CG 3.52Å; V692-E694 VanDerWaalsContact CG1-OE1 3.23Å; V692-E694 WeakPolarHBondContact CG1-OE1 3.26Å
693	E	83.5	Confident	89.2	Confident	83 Å²	83	77.9 Å²	77.9	39%	0.388	42%	0.416	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	117.7	170.5	-60.9	-173.3	-177.3	0	0	109.3	R680 R682	R680-E693 IonicContact CZ-OE2 3.96Å; R680-E693 IonicContact NH1-OE2 2.75Å; R680-E693 PolarHBondContact NH1-OE2 3.44Å; R680-E693 IonicContact NH2-OE2 3.14Å; R682-E693 PolarHBondContact N-O 2.7Å; R682-E693 PolarHBondContact O-N 3.07Å
694	E	88.5	Confident	89.4	Confident	45 Å²	45	73.8 Å²	73.8	21%	0.21	39%	0.394	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	139.4	-171.6	-58.6	177.4	-170.4	0	0	110.3	R680 W681 V692 Y696 Y698	R680-E694 WeakPolarHBondContact O-CA 3.4Å; W681-E694 HydrophobicContact CD2-CG 4.13Å; W681-E694 HydrophobicContact CE3-CB 4.48Å; W681-E694 HydrophobicContact CE3-CG 3.6Å; W681-E694 HydrophobicContact CH2-CG 4.4Å; W681-E694 WeakPolarHBondContact CH2-OE1 3.36Å; W681-E694 HydrophobicContact CZ3-CG 3.77Å; W681-E694 WeakPolarHBondContact CZ3-OE1 3.36Å; W681-E694 WeakPolarHBondContact CZ3-OE2 3.44Å; V692-E694 HydrophobicContact CB-CG 4.31Å; V692-E694 HydrophobicContact CG1-CG 3.52Å; V692-E694 VanDerWaalsContact CG1-OE1 3.23Å; V692-E694 WeakPolarHBondContact CG1-OE1 3.26Å; E694-Y696 HydrophobicContact CB-CD1 4.17Å; E694-Y696 HydrophobicContact CB-CE1 3.88Å; E694-Y696 HydrophobicContact CB-CE2 4.33Å; E694-Y696 WeakPolarHBondContact OE2-CE1 3.11Å; E694-Y698 HydrophobicContact CB-CE1 4.41Å; E694-Y698 WeakPolarHBondContact CB-OH 3.24Å; E694-Y698 VanDerWaalsContact CD-OH 3.31Å; E694-Y698 PolarHBondContact OE2-OH 2.82Å
695	G	87.8	Confident	89.9	Confident	17 Å²	17	70 Å²	70	18%	0.175	38%	0.377	C	S	.	.			trans	-90.2	-5.4	171.7	0	0	0	0	0	114.4	A678 R680 Y697	A678-G695 CarbonylContact O-C 3.24Å; A678-G695 WeakPolarHBondContact O-CA 3.24Å; A678-G695 VanDerWaalsContact O-O 3.05Å; R680-G695 PolarHBondContact O-N 3.37Å; G695-Y697 WeakPolarHBondContact O-CD2 3.4Å; G695-Y697 PolarHBondContact O-N 3.49Å
696	Y	94	Very high	90.3	Very high	139 Å²	139	68.8 Å²	68.8	55%	0.545	37%	0.366	S	S	.	.			trans	60.1	-19.9	176.6	-57.3	-69.9	0	0	0	118.2	E694 Y698 L699	E694-Y696 HydrophobicContact CB-CD1 4.17Å; E694-Y696 HydrophobicContact CB-CE1 3.88Å; E694-Y696 HydrophobicContact CB-CE2 4.33Å; E694-Y696 WeakPolarHBondContact OE2-CE1 3.11Å; Y696-Y698 PolarHBondContact O-N 3.07Å; Y696-Y698 VanDerWaalsContact O-N 3.08Å; Y696-L699 HydrophobicContact CD1-CD1 4.31Å; Y696-L699 WeakPolarHBondContact O-CB 3.2Å; Y696-L699 WeakPolarHBondContact O-CG 3.34Å; Y696-L699 PolarHBondContact O-N 2.79Å
697	Y	94.3	Very high	90.8	Very high	53 Å²	53	66.4 Å²	66.4	21%	0.208	35%	0.35	C	S	.	.	G	3₁₀ helix	trans	-65.4	-15.2	-176.1	-85.8	-89.5	0	0	0	114.5	A678 Y679 G695 L699 N700 N720 I723 I724	A678-Y697 HydrophobicContact CB-CD2 3.74Å; A678-Y697 HydrophobicContact CB-CE2 4.42Å; A678-Y697 HydrophobicContact CB-CG 4.16Å; A678-Y697 PolarHBondContact O-N 3.44Å; Y679-Y697 WeakPolarHBondContact CE1-O 3.4Å; G695-Y697 WeakPolarHBondContact O-CD2 3.4Å; G695-Y697 PolarHBondContact O-N 3.49Å; Y697-L699 PolarHBondContact O-N 2.74Å; Y697-N700 PolarHBondContact O-N 3.18Å; Y697-N720 VanDerWaalsContact OH-CB 3.28Å; Y697-N720 WeakPolarHBondContact OH-CB 3.26Å; Y697-N720 PolarHBondContact OH-ND2 2.91Å; Y697-I723 HydrophobicContact CD1-CB 4.46Å; Y697-I723 HydrophobicContact CD1-CG2 3.86Å; Y697-I723 HydrophobicContact CD2-CG2 4.33Å; Y697-I723 HydrophobicContact CE1-CB 4.19Å; Y697-I723 HydrophobicContact CE1-CG2 4.01Å; Y697-I723 HydrophobicContact CE2-CD1 4.31Å; Y697-I723 HydrophobicContact CE2-CG2 4.46Å; Y697-I723 HydrophobicContact CG-CG2 4.04Å; Y697-I724 HydrophobicContact CD1-CG1 4.07Å; Y697-I724 HydrophobicContact CE1-CG1 4.23Å
698	Y	93.1	Very high	91.3	Very high	14 Å²	14	63 Å²	63	6%	0.055	31%	0.314	C	S	.	.	G	3₁₀ helix	trans	-68	-14.1	171.5	56.2	-97.7	0	0	0	113.5	P667 W681 E694 Y696 N700	P667-Y698 HydrophobicContact CB-CD2 4.44Å; P667-Y698 HydrophobicContact CB-CG 4.36Å; P667-Y698 HydrophobicContact CG-CD2 3.98Å; P667-Y698 HydrophobicContact CG-CE2 4.4Å; P667-Y698 HydrophobicContact CG-CG 4.29Å; W681-Y698 AromaticContact CE3-CE1 3.95Å; W681-Y698 HydrophobicContact CE3-CE1 3.95Å; W681-Y698 HydrophobicContact CE3-CE2 4.12Å; W681-Y698 AromaticContact CE3-CZ 3.5Å; W681-Y698 VanDerWaalsContact CE3-CZ 3.5Å; W681-Y698 HydrophobicContact CZ3-CE2 4.14Å; W681-Y698 AromaticContact CZ3-CZ 3.74Å; W681-Y698 WeakPolarHBondContact CZ3-OH 3.43Å; E694-Y698 HydrophobicContact CB-CE1 4.41Å; E694-Y698 WeakPolarHBondContact CB-OH 3.24Å; E694-Y698 VanDerWaalsContact CD-OH 3.31Å; E694-Y698 PolarHBondContact OE2-OH 2.82Å; Y696-Y698 PolarHBondContact O-N 3.07Å; Y696-Y698 VanDerWaalsContact O-N 3.08Å; Y698-N700 VanDerWaalsContact C-N 3.3Å
699	L	94.6	Very high	91.8	Very high	101 Å²	101	57.2 Å²	57.2	53%	0.529	28%	0.281	S	S	.	.	G	3₁₀ helix	trans	-73.9	-24.2	174.4	-62.3	175.6	0	0	0	112.3	Y696 Y697 N701	Y696-L699 HydrophobicContact CD1-CD1 4.31Å; Y696-L699 WeakPolarHBondContact O-CB 3.2Å; Y696-L699 WeakPolarHBondContact O-CG 3.34Å; Y696-L699 PolarHBondContact O-N 2.79Å; Y697-L699 PolarHBondContact O-N 2.74Å; L699-N701 VanDerWaalsContact C-N 3.34Å; L699-N701 PolarHBondContact O-N 3.18Å
700	N	95.9	Very high	92.4	Very high	22 Å²	22	51.2 Å²	51.2	12%	0.118	27%	0.267	C	S	.	.	S	Bend	trans	-83.9	79.9	178.9	-67.2	-17.8	0	0	0	109.8	Y697 Y698 T711 E714 I724	Y697-N700 PolarHBondContact O-N 3.18Å; Y698-N700 VanDerWaalsContact C-N 3.3Å; N700-T711 HydrophobicContact CB-CG2 4.32Å; N700-E714 VanDerWaalsContact CG-OE2 3.29Å; N700-E714 PolarHBondContact ND2-OE2 2.85Å; N700-E714 PolarHBondContact OD1-OE1 3.15Å; N700-E714 PolarHBondContact OD1-OE2 3.12Å; N700-I724 HydrophobicContact CB-CD1 4.39Å
701	N	94	Very high	93	Very high	17 Å²	17	46.5 Å²	46.5	9%	0.091	24%	0.238	C	C	.	.			trans	-121.5	169	-174.6	68.5	41.6	0	0	0	112.9	L699 D703 N707 T711	L699-N701 VanDerWaalsContact C-N 3.34Å; L699-N701 PolarHBondContact O-N 3.18Å; N701-D703 VanDerWaalsContact CG-CG 3.5Å; N701-D703 PolarHBondContact ND2-OD2 3.46Å; N701-D703 WeakPolarHBondContact OD1-CB 3.46Å; N701-D703 PolarHBondContact OD1-N 2.67Å; N701-D703 PolarHBondContact OD1-OD2 2.98Å; N701-N707 CarbonylContact O-C 3.15Å; N701-N707 WeakPolarHBondContact O-CB 3.3Å; N701-N707 WeakPolarHBondContact OD1-CB 3.47Å; N701-N707 PolarHBondContact OD1-ND2 3.31Å; N701-T711 PolarHBondContact O-OG1 3.09Å
702	F	96.2	Very high	93.7	Very high	3 Å²	3	42.8 Å²	42.8	1%	0.013	22%	0.216	C	C	.	.			trans	-107.8	32.6	176.5	-67.2	-89.8	0	0	0	111.4	M658 F661 N704 S708 T711 L712 Y739 F740	M658-F702 WeakPolarHBondContact CA-O 3.42Å; M658-F702 WeakPolarHBondContact CG-O 3.42Å; F661-F702 HydrophobicContact CB-CB 4.05Å; F661-F702 HydrophobicContact CB-CD2 3.96Å; F661-F702 HydrophobicContact CB-CG 4.21Å; F661-F702 HydrophobicContact CD2-CD2 4.15Å; F661-F702 HydrophobicContact CD2-CE2 4.32Å; F661-F702 HydrophobicContact CD2-CG 4.44Å; F702-N704 VanDerWaalsContact C-N 3.31Å; F702-N704 PolarHBondContact O-N 3.33Å; F702-S708 WeakPolarHBondContact CA-OG 3.28Å; F702-S708 WeakPolarHBondContact CD1-OG 3.36Å; F702-T711 HydrophobicContact CE2-CG2 3.96Å; F702-T711 HydrophobicContact CZ-CG2 3.84Å; F702-L712 HydrophobicContact CE1-CD2 4.2Å; F702-L712 HydrophobicContact CE1-CG 4.42Å; F702-L712 HydrophobicContact CZ-CD2 4.43Å; F702-Y739 HydrophobicContact CZ-CE1 4.38Å; F702-F740 HydrophobicContact CE2-CE1 4.46Å; F702-F740 HydrophobicContact CE2-CZ 4.4Å; F702-F740 HydrophobicContact CZ-CE1 4.44Å
703	D	94.3	Very high	94.2	Very high	50 Å²	50	46.2 Å²	46.2	27%	0.267	23%	0.226	S	C	.	.	S	Bend	trans	-76	-21.4	-176.7	-65.4	-19.3	0	0	0	112.9	P200 G663 N701	P200-D703 WeakPolarHBondContact CB-O 3.45Å; G663-D703 WeakPolarHBondContact CA-OD1 3.45Å; G663-D703 PolarHBondContact N-OD1 3.12Å; N701-D703 VanDerWaalsContact CG-CG 3.5Å; N701-D703 PolarHBondContact ND2-OD2 3.46Å; N701-D703 WeakPolarHBondContact OD1-CB 3.46Å; N701-D703 PolarHBondContact OD1-N 2.67Å; N701-D703 PolarHBondContact OD1-OD2 2.98Å
704	N	94.2	Very high	94.8	Very high	17 Å²	17	45.6 Å²	45.6	9%	0.091	22%	0.223	C	C	.	.	S	Bend	trans	-153.9	166.8	176.1	64.1	59.3	0	0	0	110.4	V202 F702 L706 N707 S708	V202-N704 HydrophobicContact CG2-CB 4.12Å; F702-N704 VanDerWaalsContact C-N 3.31Å; F702-N704 PolarHBondContact O-N 3.33Å; N704-L706 VanDerWaalsContact C-N 3.26Å; N704-L706 PolarHBondContact O-N 3.33Å; N704-L706 PolarHBondContact OD1-N 3.39Å; N704-L706 VanDerWaalsContact OD1-N 3.11Å; N704-N707 PolarHBondContact ND2-ND2 3.04Å; N704-N707 VanDerWaalsContact ND2-ND2 3.14Å; N704-N707 PolarHBondContact O-N 3.41Å; N704-N707 WeakPolarHBondContact OD1-CB 3.35Å; N704-N707 VanDerWaalsContact OD1-CG 3.29Å; N704-N707 PolarHBondContact OD1-N 2.82Å; N704-N707 PolarHBondContact OD1-OD1 3.49Å; N704-S708 WeakPolarHBondContact O-CB 3.48Å; N704-S708 PolarHBondContact O-N 3.3Å; N704-S708 PolarHBondContact O-OG 3.41Å
705	I	94.8	Very high	95.2	Very high	6 Å²	6	43.7 Å²	43.7	3%	0.031	22%	0.215	C	C	.	.	H	α-helix	trans	-65.6	-30.1	-173.2	-170.1	71.1	0	0	0	112.4	L196 A654 I655 M658 F709	L196-I705 HydrophobicContact CD1-CG2 4.38Å; L196-I705 HydrophobicContact CG-CG2 3.85Å; A654-I705 HydrophobicContact CB-CD1 3.58Å; I655-I705 HydrophobicContact CD1-CD1 4.39Å; M658-I705 HydrophobicContact CE-CB 3.98Å; M658-I705 HydrophobicContact CE-CD1 3.5Å; M658-I705 HydrophobicContact CE-CG1 4.32Å; M658-I705 WeakPolarHBondContact SD-CA 3.25Å; M658-I705 HydrophobicContact SD-CB 3.87Å; M658-I705 HydrophobicContact SD-CD1 4.27Å; M658-I705 PolarHBondContact SD-N 3.3Å; I705-F709 HydrophobicContact CD1-CD1 4.3Å; I705-F709 HydrophobicContact CD1-CE1 3.78Å; I705-F709 HydrophobicContact CD1-CZ 4.24Å; I705-F709 HydrophobicContact CG1-CD1 4.4Å; I705-F709 HydrophobicContact CG1-CE1 4.05Å; I705-F709 HydrophobicContact CG1-CZ 4.16Å; I705-F709 WeakPolarHBondContact O-CB 3.29Å; I705-F709 WeakPolarHBondContact O-CD1 3.48Å; I705-F709 WeakPolarHBondContact O-CG 3.48Å; I705-F709 PolarHBondContact O-N 3.23Å
706	L	95.4	Very high	95.6	Very high	85 Å²	85	44.1 Å²	44.1	45%	0.445	21%	0.214	S	C	.	.	H	α-helix	trans	-74.3	-48.4	-179	-60.4	179	0	0	0	111.3	L196 V202 N704 S708 F709 V710	L196-L706 HydrophobicContact CD2-CD2 4.49Å; V202-L706 HydrophobicContact CG2-CD1 3.92Å; V202-L706 HydrophobicContact CG2-CG 4.14Å; N704-L706 VanDerWaalsContact C-N 3.26Å; N704-L706 PolarHBondContact O-N 3.33Å; N704-L706 PolarHBondContact OD1-N 3.39Å; N704-L706 VanDerWaalsContact OD1-N 3.11Å; L706-S708 VanDerWaalsContact C-N 3.28Å; L706-S708 PolarHBondContact O-N 3.02Å; L706-F709 WeakPolarHBondContact O-CB 3.33Å; L706-F709 PolarHBondContact O-N 3.45Å; L706-F709 VanDerWaalsContact O-N 3.15Å; L706-V710 PolarHBondContact O-N 3.4Å
707	N	95.3	Very high	95.6	Very high	57 Å²	57	41.9 Å²	41.9	31%	0.305	22%	0.215	S	C	.	.	H	α-helix	trans	-60.8	-40.5	173.7	-67.7	3.9	0	0	0	110.7	N701 N704 F709 V710 T711	N701-N707 CarbonylContact O-C 3.15Å; N701-N707 WeakPolarHBondContact O-CB 3.3Å; N701-N707 WeakPolarHBondContact OD1-CB 3.47Å; N701-N707 PolarHBondContact OD1-ND2 3.31Å; N704-N707 PolarHBondContact ND2-ND2 3.04Å; N704-N707 VanDerWaalsContact ND2-ND2 3.14Å; N704-N707 PolarHBondContact O-N 3.41Å; N704-N707 WeakPolarHBondContact OD1-CB 3.35Å; N704-N707 VanDerWaalsContact OD1-CG 3.29Å; N704-N707 PolarHBondContact OD1-N 2.82Å; N704-N707 PolarHBondContact OD1-OD1 3.49Å; N707-F709 PolarHBondContact O-N 3.06Å; N707-V710 PolarHBondContact O-N 3.25Å; N707-T711 WeakPolarHBondContact O-CB 3.45Å; N707-T711 PolarHBondContact O-N 2.94Å; N707-T711 PolarHBondContact O-OG1 3.41Å
708	S	96.9	Very high	95.6	Very high	0 Å²	0	41.1 Å²	41.1	0%	0	22%	0.215	C	C	.	.	H	α-helix	trans	-61.4	-42.5	174.3	-56.2	0	0	0	0	111.4	M658 F702 N704 L706 T711 L712	M658-S708 VanDerWaalsContact CG-OG 3.22Å; M658-S708 WeakPolarHBondContact CG-OG 3.47Å; F702-S708 WeakPolarHBondContact CA-OG 3.28Å; F702-S708 WeakPolarHBondContact CD1-OG 3.36Å; N704-S708 WeakPolarHBondContact O-CB 3.48Å; N704-S708 PolarHBondContact O-N 3.3Å; N704-S708 PolarHBondContact O-OG 3.41Å; L706-S708 VanDerWaalsContact C-N 3.28Å; L706-S708 PolarHBondContact O-N 3.02Å; S708-T711 PolarHBondContact O-N 2.81Å; S708-L712 WeakPolarHBondContact O-CB 3.39Å; S708-L712 VanDerWaalsContact O-CG 3.24Å; S708-L712 WeakPolarHBondContact O-CG 3.49Å; S708-L712 PolarHBondContact O-N 2.83Å
709	F	96.9	Very high	95.6	Very high	57 Å²	57	45.6 Å²	45.6	25%	0.25	24%	0.24	C	C	.	.	H	α-helix	trans	-64	-41.3	176.8	-82.5	7.6	0	0	0	112.9	Y651 A654 I705 L706 N707 F713	Y651-F709 HydrophobicContact CD2-CZ 4.38Å; A654-F709 HydrophobicContact CB-CD1 3.76Å; A654-F709 HydrophobicContact CB-CE1 3.68Å; I705-F709 HydrophobicContact CD1-CD1 4.3Å; I705-F709 HydrophobicContact CD1-CE1 3.78Å; I705-F709 HydrophobicContact CD1-CZ 4.24Å; I705-F709 HydrophobicContact CG1-CD1 4.4Å; I705-F709 HydrophobicContact CG1-CE1 4.05Å; I705-F709 HydrophobicContact CG1-CZ 4.16Å; I705-F709 WeakPolarHBondContact O-CB 3.29Å; I705-F709 WeakPolarHBondContact O-CD1 3.48Å; I705-F709 WeakPolarHBondContact O-CG 3.48Å; I705-F709 PolarHBondContact O-N 3.23Å; L706-F709 WeakPolarHBondContact O-CB 3.33Å; L706-F709 PolarHBondContact O-N 3.45Å; L706-F709 VanDerWaalsContact O-N 3.15Å; N707-F709 PolarHBondContact O-N 3.06Å; F709-F713 WeakPolarHBondContact O-CB 3.38Å; F709-F713 PolarHBondContact O-N 3.07Å
710	V	96.9	Very high	95.6	Very high	80 Å²	80	43.4 Å²	43.4	49%	0.485	23%	0.229	S	C	.	.	H	α-helix	trans	-65.1	-45.2	175.1	177.3	0	0	0	0	110.3	L706 N707 L712 F713 E714	L706-V710 PolarHBondContact O-N 3.4Å; N707-V710 PolarHBondContact O-N 3.25Å; V710-L712 PolarHBondContact O-N 3.03Å; V710-F713 WeakPolarHBondContact O-CB 3.39Å; V710-F713 PolarHBondContact O-N 3.06Å; V710-F713 VanDerWaalsContact O-N 3.13Å; V710-E714 WeakPolarHBondContact O-CG 3.27Å; V710-E714 PolarHBondContact O-N 3.4Å
711	T	96.8	Very high	95.6	Very high	1 Å²	1	42.6 Å²	42.6	1%	0.006	22%	0.224	C	C	.	.	H	α-helix	trans	-59.9	-46.2	177.4	-56.7	0	0	0	0	111.5	N700 N701 F702 N707 S708 F713 E714 L715 I724	N700-T711 HydrophobicContact CB-CG2 4.32Å; N701-T711 PolarHBondContact O-OG1 3.09Å; F702-T711 HydrophobicContact CE2-CG2 3.96Å; F702-T711 HydrophobicContact CZ-CG2 3.84Å; N707-T711 WeakPolarHBondContact O-CB 3.45Å; N707-T711 PolarHBondContact O-N 2.94Å; N707-T711 PolarHBondContact O-OG1 3.41Å; S708-T711 PolarHBondContact O-N 2.81Å; T711-F713 VanDerWaalsContact C-N 3.32Å; T711-F713 PolarHBondContact O-N 3.27Å; T711-E714 PolarHBondContact O-N 3.19Å; T711-L715 VanDerWaalsContact O-CG 3.32Å; T711-L715 WeakPolarHBondContact O-CG 3.46Å; T711-L715 PolarHBondContact O-N 2.78Å; T711-I724 HydrophobicContact CG2-CD1 4.42Å; T711-I724 HydrophobicContact CG2-CG2 4.26Å
712	L	97.8	Very high	95.7	Very high	0 Å²	0	44 Å²	44	0%	0	23%	0.228	C	C	.	.	H	α-helix	trans	-64.8	-35.4	175.8	-68.5	-179.8	0	0	0	112.4	Y650 F653 A654 F702 S708 V710 L715 T716 F743	Y650-L712 WeakPolarHBondContact O-CD1 3.33Å; F653-L712 HydrophobicContact CB-CD1 3.92Å; F653-L712 HydrophobicContact CB-CD2 4.38Å; A654-L712 HydrophobicContact CB-CD1 3.8Å; F702-L712 HydrophobicContact CE1-CD2 4.2Å; F702-L712 HydrophobicContact CE1-CG 4.42Å; F702-L712 HydrophobicContact CZ-CD2 4.43Å; S708-L712 WeakPolarHBondContact O-CB 3.39Å; S708-L712 VanDerWaalsContact O-CG 3.24Å; S708-L712 WeakPolarHBondContact O-CG 3.49Å; S708-L712 PolarHBondContact O-N 2.83Å; V710-L712 PolarHBondContact O-N 3.03Å; L712-L715 HydrophobicContact CD2-CD1 4.11Å; L712-L715 PolarHBondContact O-N 3.37Å; L712-T716 PolarHBondContact O-N 2.91Å; L712-T716 PolarHBondContact O-OG1 2.88Å; L712-F743 HydrophobicContact CB-CE2 4.33Å; L712-F743 HydrophobicContact CB-CZ 3.97Å; L712-F743 HydrophobicContact CD1-CE2 4.47Å; L712-F743 HydrophobicContact CD2-CD2 4.08Å; L712-F743 HydrophobicContact CD2-CE1 4.32Å; L712-F743 HydrophobicContact CD2-CE2 3.79Å; L712-F743 HydrophobicContact CD2-CG 4.44Å; L712-F743 HydrophobicContact CD2-CZ 3.91Å; L712-F743 HydrophobicContact CG-CE2 4.41Å; L712-F743 HydrophobicContact CG-CZ 4.44Å; L712-F743 WeakPolarHBondContact O-CZ 3.42Å
713	F	97.2	Very high	95.7	Very high	123 Å²	123	44.8 Å²	44.8	54%	0.539	23%	0.233	S	C	.	.	H	α-helix	trans	-63.6	-44.4	173.7	173.4	-99.2	0	0	0	111.6	Y650 F709 V710 T711 L715 T716 V717	Y650-F713 HydrophobicContact CE2-CB 4.35Å; F709-F713 WeakPolarHBondContact O-CB 3.38Å; F709-F713 PolarHBondContact O-N 3.07Å; V710-F713 WeakPolarHBondContact O-CB 3.39Å; V710-F713 PolarHBondContact O-N 3.06Å; V710-F713 VanDerWaalsContact O-N 3.13Å; T711-F713 VanDerWaalsContact C-N 3.32Å; T711-F713 PolarHBondContact O-N 3.27Å; F713-L715 VanDerWaalsContact C-N 3.29Å; F713-L715 PolarHBondContact O-N 3.28Å; F713-T716 WeakPolarHBondContact O-CB 3.39Å; F713-T716 PolarHBondContact O-N 2.98Å; F713-T716 VanDerWaalsContact O-N 3.12Å; F713-V717 HydrophobicContact CE1-CG2 4.4Å; F713-V717 HydrophobicContact CZ-CG2 4.38Å; F713-V717 PolarHBondContact O-N 2.7Å
714	E	96.3	Very high	95.8	Very high	70 Å²	70	42.6 Å²	42.6	33%	0.327	22%	0.221	S	C	.	.	H	α-helix	trans	-60.1	-40.1	174.4	-70	-177	-168.3	0	0	111.8	N700 V710 T711 T716 V717	N700-E714 VanDerWaalsContact CG-OE2 3.29Å; N700-E714 PolarHBondContact ND2-OE2 2.85Å; N700-E714 PolarHBondContact OD1-OE1 3.15Å; N700-E714 PolarHBondContact OD1-OE2 3.12Å; V710-E714 WeakPolarHBondContact O-CG 3.27Å; V710-E714 PolarHBondContact O-N 3.4Å; T711-E714 PolarHBondContact O-N 3.19Å; E714-T716 VanDerWaalsContact C-N 3.34Å; E714-T716 PolarHBondContact O-N 3.32Å; E714-V717 PolarHBondContact O-N 2.75Å
715	L	96.9	Very high	95.9	Very high	6 Å²	6	41.8 Å²	41.8	3%	0.031	22%	0.217	C	C	.	.	H	α-helix	trans	-65	-34.3	174.2	-66.1	172.7	0	0	0	112.8	T711 L712 F713 V717 V718 W721 I724 F740 F743	T711-L715 VanDerWaalsContact O-CG 3.32Å; T711-L715 WeakPolarHBondContact O-CG 3.46Å; T711-L715 PolarHBondContact O-N 2.78Å; L712-L715 HydrophobicContact CD2-CD1 4.11Å; L712-L715 PolarHBondContact O-N 3.37Å; F713-L715 VanDerWaalsContact C-N 3.29Å; F713-L715 PolarHBondContact O-N 3.28Å; L715-V717 VanDerWaalsContact C-N 3.26Å; L715-V717 PolarHBondContact O-N 2.77Å; L715-V718 PolarHBondContact O-N 3.42Å; L715-V718 VanDerWaalsContact O-N 3.11Å; L715-W721 HydrophobicContact CD2-CB 3.67Å; L715-I724 HydrophobicContact CD2-CB 4.32Å; L715-I724 HydrophobicContact CD2-CD1 4.01Å; L715-I724 HydrophobicContact CG-CD1 4.48Å; L715-F740 HydrophobicContact CD1-CD1 3.8Å; L715-F740 HydrophobicContact CD1-CE1 3.87Å; L715-F740 HydrophobicContact CD2-CD1 4.35Å; L715-F743 HydrophobicContact CB-CD1 3.97Å; L715-F743 HydrophobicContact CB-CE1 3.49Å; L715-F743 VanDerWaalsContact CB-CE1 3.49Å; L715-F743 HydrophobicContact CB-CZ 4.49Å; L715-F743 HydrophobicContact CD1-CD1 4.24Å; L715-F743 HydrophobicContact CD1-CE1 4.3Å
716	T	96.2	Very high	95.9	Very high	26 Å²	26	42.8 Å²	42.8	16%	0.16	22%	0.221	C	C	.	.	H	α-helix	trans	-67.2	-25.5	174.9	-66.8	0	0	0	0	112.9	Y650 L712 F713 E714 V718 T747	Y650-T716 WeakPolarHBondContact CE1-OG1 3.39Å; Y650-T716 WeakPolarHBondContact OH-CB 3.35Å; Y650-T716 WeakPolarHBondContact OH-CG2 3.24Å; Y650-T716 PolarHBondContact OH-OG1 3.48Å; L712-T716 PolarHBondContact O-N 2.91Å; L712-T716 PolarHBondContact O-OG1 2.88Å; F713-T716 WeakPolarHBondContact O-CB 3.39Å; F713-T716 PolarHBondContact O-N 2.98Å; F713-T716 VanDerWaalsContact O-N 3.12Å; E714-T716 VanDerWaalsContact C-N 3.34Å; E714-T716 PolarHBondContact O-N 3.32Å; T716-V718 PolarHBondContact O-N 3.17Å; T716-T747 PolarHBondContact OG1-OG1 2.82Å
717	V	94	Very high	95.8	Very high	92 Å²	92	38.8 Å²	38.8	56%	0.558	20%	0.2	S	C	*	.	T	Hydrogen-bonded Turn	trans	-73.5	-13.2	174.2	178.9	0	0	0	0	111.8	F713 E714 L715 N719	F713-V717 HydrophobicContact CE1-CG2 4.4Å; F713-V717 HydrophobicContact CZ-CG2 4.38Å; F713-V717 PolarHBondContact O-N 2.7Å; E714-V717 PolarHBondContact O-N 2.75Å; L715-V717 VanDerWaalsContact C-N 3.26Å; L715-V717 PolarHBondContact O-N 2.77Å; V717-N719 PolarHBondContact O-N 2.79Å
718	V	94.8	Very high	95.8	Very high	37 Å²	37	36.1 Å²	36.1	22%	0.224	19%	0.186	C	C	.	.			trans	69.4	-9.8	174.7	-173.5	0	0	0	0	114.7	T350 L715 T716 Y744	T350-V718 HydrophobicContact CG2-CG1 4.36Å; L715-V718 PolarHBondContact O-N 3.42Å; L715-V718 VanDerWaalsContact O-N 3.11Å; T716-V718 PolarHBondContact O-N 3.17Å; V718-Y744 HydrophobicContact CG1-CE2 3.91Å; V718-Y744 HydrophobicContact CG2-CD2 4.27Å; V718-Y744 HydrophobicContact CG2-CE2 3.89Å
719	N	92.9	Very high	95.7	Very high	107 Å²	107	36.8 Å²	36.8	57%	0.572	19%	0.19	S	C	*	.	T	Hydrogen-bonded Turn	trans	-79.2	139.5	177.2	-167.8	25	0	0	0	112.3	V717 W721	V717-N719 PolarHBondContact O-N 2.79Å; N719-W721 PolarHBondContact O-N 3.33Å
720	N	94.7	Very high	95.6	Very high	55 Å²	55	35.7 Å²	35.7	29%	0.294	19%	0.19	S	C	.	.	T	Hydrogen-bonded Turn	trans	50.8	18.9	176.8	-68.2	-15	0	0	0	115.8	Y697 Y722 I723	Y697-N720 VanDerWaalsContact OH-CB 3.28Å; Y697-N720 WeakPolarHBondContact OH-CB 3.26Å; Y697-N720 PolarHBondContact OH-ND2 2.91Å; N720-Y722 VanDerWaalsContact C-N 3.27Å; N720-Y722 PolarHBondContact O-N 3.1Å; N720-I723 HydrophobicContact CB-CD1 3.99Å; N720-I723 HydrophobicContact CB-CG1 4.46Å; N720-I723 WeakPolarHBondContact O-CB 3.41Å; N720-I723 PolarHBondContact O-N 3.45Å; N720-I723 VanDerWaalsContact O-N 3.12Å
721	W	96.1	Very high	95.4	Very high	5 Å²	5	35.3 Å²	35.3	2%	0.019	18%	0.183	C	C	.	.	H	α-helix	trans	-64.8	-30.9	-173	74.6	-81.7	0	0	0	113.1	F346 V347 T350 L715 N719 I723 I724 M725 F740 M741	F346-W721 AromaticContact CD1-CH2 3.75Å; F346-W721 HydrophobicContact CD1-CH2 3.75Å; F346-W721 AromaticContact CD1-CZ2 3.86Å; F346-W721 HydrophobicContact CD1-CZ2 3.86Å; F346-W721 AromaticContact CE1-CH2 3.65Å; F346-W721 HydrophobicContact CE1-CH2 3.65Å; F346-W721 AromaticContact CE1-CZ2 3.89Å; F346-W721 HydrophobicContact CE1-CZ2 3.89Å; V347-W721 HydrophobicContact CB-CZ2 4.45Å; V347-W721 HydrophobicContact CG2-CH2 4.29Å; V347-W721 HydrophobicContact CG2-CZ2 3.83Å; T350-W721 HydrophobicContact CG2-CZ2 4.2Å; T350-W721 PolarHBondContact OG1-NE1 2.68Å; L715-W721 HydrophobicContact CD2-CB 3.67Å; N719-W721 PolarHBondContact O-N 3.33Å; W721-I723 PolarHBondContact O-N 3.31Å; W721-I724 PolarHBondContact O-N 2.98Å; W721-M725 HydrophobicContact CE3-CB 4.45Å; W721-M725 HydrophobicContact CH2-CE 4.48Å; W721-M725 HydrophobicContact CH2-SD 4.02Å; W721-M725 HydrophobicContact CZ3-CB 4.39Å; W721-M725 HydrophobicContact CZ3-CE 4.4Å; W721-M725 HydrophobicContact CZ3-SD 3.6Å; W721-M725 PolarHBondContact O-N 2.92Å; W721-M725 VanDerWaalsContact O-N 3.15Å; W721-F740 HydrophobicContact CE3-CB 4.38Å; W721-F740 HydrophobicContact CZ3-CB 3.93Å; W721-M741 HydrophobicContact CH2-CG 4.41Å
722	Y	95.4	Very high	95.3	Very high	46 Å²	46	38 Å²	38	18%	0.18	20%	0.199	C	C	.	.	H	α-helix	trans	-65.2	-23.9	178.2	76.8	-88.1	0	0	0	112.5	V347 A352 N353 N720 M725 E726	V347-Y722 HydrophobicContact CG1-CD1 3.76Å; V347-Y722 HydrophobicContact CG1-CG 3.9Å; A352-Y722 HydrophobicContact CB-CD1 4.3Å; N353-Y722 HydrophobicContact CB-CD1 4.45Å; N353-Y722 HydrophobicContact CB-CE1 4.11Å; N720-Y722 VanDerWaalsContact C-N 3.27Å; N720-Y722 PolarHBondContact O-N 3.1Å; Y722-M725 PolarHBondContact O-N 3.5Å; Y722-E726 WeakPolarHBondContact O-CB 3.4Å; Y722-E726 WeakPolarHBondContact O-CG 3.32Å; Y722-E726 PolarHBondContact O-N 3.03Å
723	I	95.9	Very high	95.1	Very high	20 Å²	20	40.6 Å²	40.6	10%	0.103	22%	0.217	C	C	.	.	H	α-helix	trans	-64.6	-44.6	176.6	-60.1	-178	0	0	0	109.9	V675 A678 Y679 Y697 N720 W721 G727	V675-I723 HydrophobicContact CB-CG2 4.25Å; V675-I723 HydrophobicContact CG1-CG2 4.26Å; A678-I723 HydrophobicContact CB-CG2 3.69Å; Y679-I723 HydrophobicContact CE2-CG2 4.21Å; Y679-I723 PolarHBondContact OH-O 3.15Å; Y697-I723 HydrophobicContact CD1-CB 4.46Å; Y697-I723 HydrophobicContact CD1-CG2 3.86Å; Y697-I723 HydrophobicContact CD2-CG2 4.33Å; Y697-I723 HydrophobicContact CE1-CB 4.19Å; Y697-I723 HydrophobicContact CE1-CG2 4.01Å; Y697-I723 HydrophobicContact CE2-CD1 4.31Å; Y697-I723 HydrophobicContact CE2-CG2 4.46Å; Y697-I723 HydrophobicContact CG-CG2 4.04Å; N720-I723 HydrophobicContact CB-CD1 3.99Å; N720-I723 HydrophobicContact CB-CG1 4.46Å; N720-I723 WeakPolarHBondContact O-CB 3.41Å; N720-I723 PolarHBondContact O-N 3.45Å; N720-I723 VanDerWaalsContact O-N 3.12Å; W721-I723 PolarHBondContact O-N 3.31Å; I723-G727 PolarHBondContact O-N 3.18Å
724	I	96.2	Very high	94.8	Very high	4 Å²	4	39.7 Å²	39.7	2%	0.021	21%	0.214	C	C	.	.	H	α-helix	trans	-66.9	-44.9	177.3	-58	171.8	0	0	0	110	Y697 N700 T711 L715 W721 G727 V728 F740	Y697-I724 HydrophobicContact CD1-CG1 4.07Å; Y697-I724 HydrophobicContact CE1-CG1 4.23Å; N700-I724 HydrophobicContact CB-CD1 4.39Å; T711-I724 HydrophobicContact CG2-CD1 4.42Å; T711-I724 HydrophobicContact CG2-CG2 4.26Å; L715-I724 HydrophobicContact CD2-CB 4.32Å; L715-I724 HydrophobicContact CD2-CD1 4.01Å; L715-I724 HydrophobicContact CG-CD1 4.48Å; W721-I724 PolarHBondContact O-N 2.98Å; I724-G727 PolarHBondContact O-N 3.47Å; I724-V728 WeakPolarHBondContact O-CG2 3.22Å; I724-V728 PolarHBondContact O-N 3.37Å; I724-F740 HydrophobicContact CG2-CE1 4.08Å; I724-F740 HydrophobicContact CG2-CZ 4.4Å
725	M	96.6	Very high	94.6	Very high	0 Å²	0	46.2 Å²	46.2	0%	0	24%	0.236	C	C	.	.	H	α-helix	trans	-58.1	-56	176.9	178.6	-176	73.5	0	0	111.4	V343 V347 W721 Y722 G727 V728 T729 R737 F740	V343-M725 HydrophobicContact CG1-CE 3.68Å; V347-M725 HydrophobicContact CG2-CE 4.28Å; W721-M725 HydrophobicContact CE3-CB 4.45Å; W721-M725 HydrophobicContact CH2-CE 4.48Å; W721-M725 HydrophobicContact CH2-SD 4.02Å; W721-M725 HydrophobicContact CZ3-CB 4.39Å; W721-M725 HydrophobicContact CZ3-CE 4.4Å; W721-M725 HydrophobicContact CZ3-SD 3.6Å; W721-M725 PolarHBondContact O-N 2.92Å; W721-M725 VanDerWaalsContact O-N 3.15Å; Y722-M725 PolarHBondContact O-N 3.5Å; M725-G727 VanDerWaalsContact C-N 3.29Å; M725-G727 PolarHBondContact O-N 2.96Å; M725-V728 PolarHBondContact O-N 3.49Å; M725-T729 HydrophobicContact CG-CG2 4.3Å; M725-T729 WeakPolarHBondContact O-CG2 3.29Å; M725-T729 PolarHBondContact O-N 3.2Å; M725-T729 PolarHBondContact O-OG1 3.32Å; M725-R737 HydrophobicContact CG-CG 4.26Å; M725-R737 HydrophobicContact SD-CB 4.18Å; M725-R737 HydrophobicContact SD-CG 4.16Å; M725-F740 HydrophobicContact CB-CB 4.17Å; M725-F740 HydrophobicContact CB-CD1 4.47Å; M725-F740 HydrophobicContact CB-CD2 3.9Å; M725-F740 HydrophobicContact CB-CE2 4.44Å; M725-F740 HydrophobicContact CB-CG 3.92Å; M725-F740 HydrophobicContact CG-CB 3.97Å; M725-F740 HydrophobicContact CG-CD2 3.67Å; M725-F740 HydrophobicContact CG-CE2 4.46Å; M725-F740 HydrophobicContact CG-CG 3.98Å; M725-F740 HydrophobicContact SD-CB 4.15Å
726	E	94.5	Very high	94.6	Very high	28 Å²	28	46.4 Å²	46.4	13%	0.131	24%	0.238	C	C	.	.	H	α-helix	trans	-64.7	-35.7	-178.1	-71.8	-61.4	134.5	0	0	111.5	V675 Y722 T729 S730 R737	V675-E726 HydrophobicContact CG1-CB 4.04Å; V675-E726 HydrophobicContact CG2-CB 4.23Å; Y722-E726 WeakPolarHBondContact O-CB 3.4Å; Y722-E726 WeakPolarHBondContact O-CG 3.32Å; Y722-E726 PolarHBondContact O-N 3.03Å; E726-T729 VanDerWaalsContact CA-OG1 3.31Å; E726-T729 WeakPolarHBondContact CA-OG1 3.35Å; E726-T729 PolarHBondContact O-N 3.38Å; E726-T729 PolarHBondContact O-OG1 3.02Å; E726-S730 WeakPolarHBondContact O-CB 3.37Å; E726-S730 PolarHBondContact O-N 3.27Å; E726-R737 VanDerWaalsContact CD-NH2 3.32Å; E726-R737 IonicContact OE1-CZ 3.47Å; E726-R737 VanDerWaalsContact OE1-CZ 3.31Å; E726-R737 IonicContact OE1-NE 3.85Å; E726-R737 PolarHBondContact OE1-NE 3.36Å; E726-R737 IonicContact OE1-NH2 3.7Å; E726-R737 PolarHBondContact OE1-NH2 3.44Å; E726-R737 IonicContact OE2-CZ 2.72Å; E726-R737 IonicContact OE2-NH2 2.68Å; E726-R737 PolarHBondContact OE2-NH2 2.99Å
727	G	94.1	Very high	94.5	Very high	0 Å²	0	46 Å²	46	0%	0	23%	0.233	C	C	.	.	H	α-helix	trans	-56.3	-52.1	172.4	0	0	0	0	0	112.4	C670 I723 I724 M725 T729 S730	C670-G727 PolarHBondContact SG-O 3.13Å; I723-G727 PolarHBondContact O-N 3.18Å; I724-G727 PolarHBondContact O-N 3.47Å; M725-G727 VanDerWaalsContact C-N 3.29Å; M725-G727 PolarHBondContact O-N 2.96Å; G727-T729 PolarHBondContact O-N 2.99Å; G727-S730 PolarHBondContact O-N 3.37Å; G727-S730 PolarHBondContact O-OG 3.43Å
728	V	95.4	Very high	94.6	Very high	2 Å²	2	46.5 Å²	46.5	1%	0.012	23%	0.232	C	C	.	.	H	α-helix	trans	-65.1	-40.1	177.8	173	0	0	0	0	111.7	F661 V665 I724 M725 S730 Q731 T732 F740	F661-V728 HydrophobicContact CD1-CG1 3.59Å; F661-V728 HydrophobicContact CD2-CG1 4.46Å; F661-V728 HydrophobicContact CE1-CG1 3.75Å; F661-V728 HydrophobicContact CG-CG1 3.98Å; F661-V728 HydrophobicContact CZ-CG1 4.26Å; V665-V728 HydrophobicContact CG2-CG2 4.11Å; I724-V728 WeakPolarHBondContact O-CG2 3.22Å; I724-V728 PolarHBondContact O-N 3.37Å; M725-V728 PolarHBondContact O-N 3.49Å; V728-S730 VanDerWaalsContact C-N 3.28Å; V728-S730 PolarHBondContact O-N 3.46Å; V728-Q731 PolarHBondContact O-N 3.07Å; V728-T732 HydrophobicContact CG1-CG2 4.4Å; V728-T732 WeakPolarHBondContact O-CB 3.35Å; V728-T732 PolarHBondContact O-N 3.39Å; V728-T732 VanDerWaalsContact O-N 3.1Å; V728-T732 PolarHBondContact O-OG1 2.89Å; V728-F740 HydrophobicContact CB-CE2 3.94Å; V728-F740 HydrophobicContact CB-CZ 4.05Å; V728-F740 HydrophobicContact CG1-CE2 4.05Å; V728-F740 HydrophobicContact CG1-CZ 4.31Å; V728-F740 HydrophobicContact CG2-CE2 4.35Å; V728-F740 HydrophobicContact CG2-CZ 3.93Å
729	T	94.7	Very high	94.7	Very high	13 Å²	13	45.9 Å²	45.9	8%	0.08	23%	0.226	C	C	.	.	H	α-helix	trans	-66	-32.4	179.5	67.5	0	0	0	0	112.6	M725 E726 G727 Q731 T732 S736 R737	M725-T729 HydrophobicContact CG-CG2 4.3Å; M725-T729 WeakPolarHBondContact O-CG2 3.29Å; M725-T729 PolarHBondContact O-N 3.2Å; M725-T729 PolarHBondContact O-OG1 3.32Å; E726-T729 VanDerWaalsContact CA-OG1 3.31Å; E726-T729 WeakPolarHBondContact CA-OG1 3.35Å; E726-T729 PolarHBondContact O-N 3.38Å; E726-T729 PolarHBondContact O-OG1 3.02Å; G727-T729 PolarHBondContact O-N 2.99Å; T729-Q731 PolarHBondContact O-N 3Å; T729-T732 PolarHBondContact O-N 3.44Å; T729-S736 WeakPolarHBondContact CG2-OG 3.46Å; T729-R737 HydrophobicContact CG2-CB 4.48Å; T729-R737 HydrophobicContact CG2-CG 3.4Å; T729-R737 VanDerWaalsContact CG2-CG 3.4Å
730	S	93.5	Very high	94.9	Very high	35 Å²	35	41 Å²	41	25%	0.245	20%	0.2	C	C	.	.	H	α-helix	trans	-63.8	-26.7	178.4	81.2	0	0	0	0	113	C670 E726 G727 V728	C670-S730 WeakPolarHBondContact CB-OG 3.12Å; C670-S730 PolarHBondContact SG-OG 3.44Å; E726-S730 WeakPolarHBondContact O-CB 3.37Å; E726-S730 PolarHBondContact O-N 3.27Å; G727-S730 PolarHBondContact O-N 3.37Å; G727-S730 PolarHBondContact O-OG 3.43Å; V728-S730 VanDerWaalsContact C-N 3.28Å; V728-S730 PolarHBondContact O-N 3.46Å
731	Q	93.9	Very high	95	Very high	72 Å²	72	39.8 Å²	39.8	34%	0.336	19%	0.193	S	C	.	.	H	α-helix	trans	-101	-12.9	-179.9	-59	-53.9	-58.7	0	0	113	I664 V728 T729	I664-Q731 HydrophobicContact CG2-CB 3.23Å; I664-Q731 HydrophobicContact CG2-CG 3.96Å; V728-Q731 PolarHBondContact O-N 3.07Å; T729-Q731 PolarHBondContact O-N 3Å
732	T	93.6	Very high	95	Very high	56 Å²	56	42.4 Å²	42.4	34%	0.344	21%	0.209	S	C	.	.	S	Bend	trans	-121.8	-118	-175.1	60.9	0	0	0	0	111.5	F661 I664 V728 T729 S736	F661-T732 HydrophobicContact CD1-CG2 4.36Å; I664-T732 HydrophobicContact CD1-CG2 3.38Å; I664-T732 HydrophobicContact CG2-CG2 3.94Å; V728-T732 HydrophobicContact CG1-CG2 4.4Å; V728-T732 WeakPolarHBondContact O-CB 3.35Å; V728-T732 PolarHBondContact O-N 3.39Å; V728-T732 VanDerWaalsContact O-N 3.1Å; V728-T732 PolarHBondContact O-OG1 2.89Å; T729-T732 PolarHBondContact O-N 3.44Å; T732-S736 PolarHBondContact OG1-OG 3.5Å
733	S	93.8	Very high	95	Very high	55 Å²	55	40.4 Å²	40.4	39%	0.385	20%	0.202	S	C	.	.			trans	-138.3	156.9	-179.2	-175.5	0	0	0	0	109.5	W735 S736	S733-W735 PolarHBondContact O-N 2.92Å; S733-W735 VanDerWaalsContact O-N 3.1Å; S733-S736 WeakPolarHBondContact O-CB 3.38Å; S733-S736 PolarHBondContact O-N 3.48Å; S733-S736 PolarHBondContact O-OG 3.19Å
734	H	91.1	Very high	95	Very high	104 Å²	104	40.6 Å²	40.6	48%	0.481	20%	0.201	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56.6	-25.4	175.9	-60.6	-72.3	0	0	0	113.1	E339 S736 R737	E339-H734 IonicContact OE1-CG 3.57Å; E339-H734 IonicContact OE1-ND1 3.46Å; E339-H734 PolarHBondContact OE1-ND1 3.28Å; H734-S736 PolarHBondContact O-N 3.24Å; H734-S736 VanDerWaalsContact O-N 3.15Å; H734-R737 PolarHBondContact ND1-NH1 3.22Å; H734-R737 VanDerWaalsContact ND1-NH1 3.17Å; H734-R737 VanDerWaalsContact O-CB 3.24Å; H734-R737 WeakPolarHBondContact O-CB 3.46Å; H734-R737 WeakPolarHBondContact O-CG 3.49Å; H734-R737 PolarHBondContact O-N 3.15Å
735	W	93.4	Very high	94.8	Very high	208 Å²	208	42.2 Å²	42.2	79%	0.788	21%	0.21	S	C	*	.	H	α-helix	trans	-59.6	-22.9	173.7	-63.2	109.5	0	0	0	113.9	S733 R737 L738	S733-W735 PolarHBondContact O-N 2.92Å; S733-W735 VanDerWaalsContact O-N 3.1Å; W735-R737 PolarHBondContact O-N 3.37Å; W735-L738 WeakPolarHBondContact O-CB 2.96Å; W735-L738 PolarHBondContact O-N 3.32Å
736	S	95.4	Very high	94.6	Very high	9 Å²	9	44.3 Å²	44.3	6%	0.063	22%	0.222	C	C	.	.	H	α-helix	trans	-66.5	-24.1	173.2	62.8	0	0	0	0	112.7	T729 T732 S733 H734 L738 Y739 F740	T729-S736 WeakPolarHBondContact CG2-OG 3.46Å; T732-S736 PolarHBondContact OG1-OG 3.5Å; S733-S736 WeakPolarHBondContact O-CB 3.38Å; S733-S736 PolarHBondContact O-N 3.48Å; S733-S736 PolarHBondContact O-OG 3.19Å; H734-S736 PolarHBondContact O-N 3.24Å; H734-S736 VanDerWaalsContact O-N 3.15Å; S736-L738 PolarHBondContact O-N 3.35Å; S736-Y739 WeakPolarHBondContact O-CB 3.28Å; S736-Y739 PolarHBondContact O-N 2.89Å; S736-F740 VanDerWaalsContact O-CD2 3.23Å; S736-F740 WeakPolarHBondContact O-CD2 3.39Å; S736-F740 PolarHBondContact O-N 3.39Å
737	R	95.6	Very high	94.6	Very high	17 Å²	17	43.3 Å²	43.3	6%	0.064	22%	0.218	C	C	.	.	H	α-helix	trans	-56.6	-38.9	171.2	-64.4	-178.8	169.7	152.3	-5.2	111.3	E339 M725 E726 T729 H734 W735 Y739 F740 M741	E339-R737 VanDerWaalsContact CD-NH1 3.33Å; E339-R737 IonicContact OE1-CZ 2.8Å; E339-R737 IonicContact OE1-NH1 3.92Å; E339-R737 PolarHBondContact OE1-NH1 3.03Å; M725-R737 HydrophobicContact CG-CG 4.26Å; M725-R737 HydrophobicContact SD-CB 4.18Å; M725-R737 HydrophobicContact SD-CG 4.16Å; E726-R737 VanDerWaalsContact CD-NH2 3.32Å; E726-R737 IonicContact OE1-CZ 3.47Å; E726-R737 VanDerWaalsContact OE1-CZ 3.31Å; E726-R737 IonicContact OE1-NE 3.85Å; E726-R737 PolarHBondContact OE1-NE 3.36Å; E726-R737 IonicContact OE1-NH2 3.7Å; E726-R737 PolarHBondContact OE1-NH2 3.44Å; E726-R737 IonicContact OE2-CZ 2.72Å; E726-R737 IonicContact OE2-NH2 2.68Å; E726-R737 PolarHBondContact OE2-NH2 2.99Å; T729-R737 HydrophobicContact CG2-CB 4.48Å; T729-R737 HydrophobicContact CG2-CG 3.4Å; T729-R737 VanDerWaalsContact CG2-CG 3.4Å; H734-R737 PolarHBondContact ND1-NH1 3.22Å; H734-R737 VanDerWaalsContact ND1-NH1 3.17Å; H734-R737 VanDerWaalsContact O-CB 3.24Å; H734-R737 WeakPolarHBondContact O-CB 3.46Å; H734-R737 WeakPolarHBondContact O-CG 3.49Å; H734-R737 PolarHBondContact O-N 3.15Å; W735-R737 PolarHBondContact O-N 3.37Å; R737-Y739 VanDerWaalsContact C-N 3.27Å; R737-Y739 PolarHBondContact O-N 2.93Å; R737-F740 PolarHBondContact O-N 2.76Å; R737-M741 WeakPolarHBondContact O-CB 3.41Å; R737-M741 VanDerWaalsContact O-CG 3.32Å; R737-M741 WeakPolarHBondContact O-CG 3.48Å; R737-M741 PolarHBondContact O-N 3.17Å
738	L	95.4	Very high	94.3	Very high	103 Å²	103	44.8 Å²	44.8	54%	0.539	23%	0.225	S	C	.	.	H	α-helix	trans	-61.7	-35.2	178.6	-174.7	63.1	0	0	0	112	W735 S736 T742	W735-L738 WeakPolarHBondContact O-CB 2.96Å; W735-L738 PolarHBondContact O-N 3.32Å; S736-L738 PolarHBondContact O-N 3.35Å; L738-T742 WeakPolarHBondContact O-CB 3.3Å; L738-T742 PolarHBondContact O-N 3.03Å; L738-T742 PolarHBondContact O-OG1 3.05Å
739	Y	96.9	Very high	94	Very high	25 Å²	25	45.2 Å²	45.2	10%	0.098	23%	0.228	C	C	.	.	H	α-helix	trans	-60.8	-50.5	175.1	169.7	-89.5	0	0	0	111.2	F653 V656 F661 F702 S736 R737 T742 F743	F653-Y739 HydrophobicContact CD1-CD2 4.27Å; F653-Y739 AromaticContact CD1-CE2 3.67Å; F653-Y739 HydrophobicContact CD1-CE2 3.67Å; F653-Y739 AromaticContact CD1-CZ 3.96Å; F653-Y739 HydrophobicContact CE1-CE2 4.42Å; F653-Y739 PolarHBondContact O-OH 3.4Å; V656-Y739 HydrophobicContact CB-CE2 4.22Å; V656-Y739 HydrophobicContact CG1-CD2 4.02Å; V656-Y739 HydrophobicContact CG1-CE2 3.81Å; F661-Y739 AromaticContact CE2-CD1 3.71Å; F661-Y739 HydrophobicContact CE2-CD1 3.71Å; F661-Y739 HydrophobicContact CE2-CD2 4.3Å; F661-Y739 AromaticContact CE2-CE1 3.89Å; F661-Y739 HydrophobicContact CE2-CE1 3.89Å; F661-Y739 HydrophobicContact CE2-CE2 4.43Å; F661-Y739 AromaticContact CE2-CG 3.94Å; F661-Y739 HydrophobicContact CE2-CG 3.94Å; F661-Y739 HydrophobicContact CZ-CD1 4.32Å; F661-Y739 HydrophobicContact CZ-CG 4.26Å; F702-Y739 HydrophobicContact CZ-CE1 4.38Å; S736-Y739 WeakPolarHBondContact O-CB 3.28Å; S736-Y739 PolarHBondContact O-N 2.89Å; R737-Y739 VanDerWaalsContact C-N 3.27Å; R737-Y739 PolarHBondContact O-N 2.93Å; Y739-T742 PolarHBondContact O-N 2.92Å; Y739-F743 WeakPolarHBondContact O-CB 3.39Å; Y739-F743 PolarHBondContact O-N 2.95Å
740	F	97.4	Very high	93.9	Very high	3 Å²	3	44.7 Å²	44.7	1%	0.013	23%	0.225	C	C	.	.	H	α-helix	trans	-68.7	-40.6	-178.9	-65.5	-79.5	0	0	0	112.4	F702 L715 W721 I724 M725 V728 S736 R737 F743 Y744	F702-F740 HydrophobicContact CE2-CE1 4.46Å; F702-F740 HydrophobicContact CE2-CZ 4.4Å; F702-F740 HydrophobicContact CZ-CE1 4.44Å; L715-F740 HydrophobicContact CD1-CD1 3.8Å; L715-F740 HydrophobicContact CD1-CE1 3.87Å; L715-F740 HydrophobicContact CD2-CD1 4.35Å; W721-F740 HydrophobicContact CE3-CB 4.38Å; W721-F740 HydrophobicContact CZ3-CB 3.93Å; I724-F740 HydrophobicContact CG2-CE1 4.08Å; I724-F740 HydrophobicContact CG2-CZ 4.4Å; M725-F740 HydrophobicContact CB-CB 4.17Å; M725-F740 HydrophobicContact CB-CD1 4.47Å; M725-F740 HydrophobicContact CB-CD2 3.9Å; M725-F740 HydrophobicContact CB-CE2 4.44Å; M725-F740 HydrophobicContact CB-CG 3.92Å; M725-F740 HydrophobicContact CG-CB 3.97Å; M725-F740 HydrophobicContact CG-CD2 3.67Å; M725-F740 HydrophobicContact CG-CE2 4.46Å; M725-F740 HydrophobicContact CG-CG 3.98Å; M725-F740 HydrophobicContact SD-CB 4.15Å; V728-F740 HydrophobicContact CB-CE2 3.94Å; V728-F740 HydrophobicContact CB-CZ 4.05Å; V728-F740 HydrophobicContact CG1-CE2 4.05Å; V728-F740 HydrophobicContact CG1-CZ 4.31Å; V728-F740 HydrophobicContact CG2-CE2 4.35Å; V728-F740 HydrophobicContact CG2-CZ 3.93Å; S736-F740 VanDerWaalsContact O-CD2 3.23Å; S736-F740 WeakPolarHBondContact O-CD2 3.39Å; S736-F740 PolarHBondContact O-N 3.39Å; R737-F740 PolarHBondContact O-N 2.76Å; F740-F743 PolarHBondContact O-N 2.97Å; F740-Y744 PolarHBondContact O-N 3.05Å
741	M	95.7	Very high	93.7	Very high	30 Å²	30	46.8 Å²	46.8	15%	0.148	23%	0.232	C	C	.	.	H	α-helix	trans	-64.5	-42.4	175.7	-68.5	-179	173.3	0	0	111.8	V343 F346 W721 R737 Y744 I745	V343-M741 HydrophobicContact CB-CE 4.38Å; V343-M741 HydrophobicContact CG1-CE 4.23Å; V343-M741 HydrophobicContact CG2-CE 3.99Å; F346-M741 HydrophobicContact CB-CE 4.1Å; F346-M741 HydrophobicContact CD1-CE 3.94Å; F346-M741 HydrophobicContact CD1-CG 3.91Å; F346-M741 HydrophobicContact CD1-SD 4.3Å; F346-M741 HydrophobicContact CD2-SD 4.5Å; F346-M741 HydrophobicContact CE1-CB 4.02Å; F346-M741 HydrophobicContact CE1-CG 3.62Å; F346-M741 HydrophobicContact CE1-SD 4.46Å; F346-M741 HydrophobicContact CG-CE 3.98Å; F346-M741 HydrophobicContact CG-CG 4.48Å; F346-M741 HydrophobicContact CG-SD 4.32Å; F346-M741 HydrophobicContact CZ-CB 3.89Å; F346-M741 HydrophobicContact CZ-CG 3.94Å; W721-M741 HydrophobicContact CH2-CG 4.41Å; R737-M741 WeakPolarHBondContact O-CB 3.41Å; R737-M741 VanDerWaalsContact O-CG 3.32Å; R737-M741 WeakPolarHBondContact O-CG 3.48Å; R737-M741 PolarHBondContact O-N 3.17Å; M741-Y744 PolarHBondContact O-N 3.2Å; M741-I745 WeakPolarHBondContact O-CG1 3.46Å; M741-I745 PolarHBondContact O-N 3.49Å
742	T	95.6	Very high	93.4	Very high	60 Å²	60	45.1 Å²	45.1	37%	0.368	23%	0.227	S	C	.	.	H	α-helix	trans	-64.4	-42.4	175.5	-56.7	0	0	0	0	110.8	F653 L738 Y739 Y744 I745 V746	F653-T742 HydrophobicContact CZ-CG2 4.33Å; L738-T742 WeakPolarHBondContact O-CB 3.3Å; L738-T742 PolarHBondContact O-N 3.03Å; L738-T742 PolarHBondContact O-OG1 3.05Å; Y739-T742 PolarHBondContact O-N 2.92Å; T742-Y744 PolarHBondContact O-N 3.3Å; T742-I745 PolarHBondContact O-N 2.93Å; T742-V746 HydrophobicContact CG2-CG2 4.38Å; T742-V746 WeakPolarHBondContact O-CB 3.28Å; T742-V746 VanDerWaalsContact O-CG2 3.31Å; T742-V746 WeakPolarHBondContact O-CG2 3.3Å; T742-V746 PolarHBondContact O-N 3.46Å
743	F	96.9	Very high	93.1	Very high	5 Å²	5	42.7 Å²	42.7	2%	0.022	21%	0.211	C	C	.	.	H	α-helix	trans	-59.6	-45.6	175.3	177.7	-100.2	0	0	0	111.7	Y650 F653 L712 L715 Y739 F740 V746 T747	Y650-F743 HydrophobicContact CD1-CE2 4.19Å; Y650-F743 HydrophobicContact CD1-CZ 4.36Å; Y650-F743 HydrophobicContact CE1-CE2 4.19Å; Y650-F743 AromaticContact CE1-CZ 3.93Å; Y650-F743 HydrophobicContact CE1-CZ 3.93Å; F653-F743 HydrophobicContact CB-CD2 4.11Å; F653-F743 HydrophobicContact CB-CE2 4.41Å; F653-F743 HydrophobicContact CD1-CB 3.92Å; F653-F743 AromaticContact CD1-CD2 3.66Å; F653-F743 HydrophobicContact CD1-CD2 3.66Å; F653-F743 HydrophobicContact CD1-CG 4.23Å; F653-F743 HydrophobicContact CD2-CD2 4.04Å; F653-F743 HydrophobicContact CE1-CB 3.69Å; F653-F743 HydrophobicContact CE1-CD2 4.02Å; F653-F743 HydrophobicContact CE1-CG 4.37Å; F653-F743 HydrophobicContact CE2-CD2 4.36Å; F653-F743 AromaticContact CG-CD2 3.67Å; F653-F743 HydrophobicContact CG-CD2 3.67Å; F653-F743 HydrophobicContact CG-CE2 4.34Å; F653-F743 HydrophobicContact CZ-CB 4.34Å; F653-F743 HydrophobicContact CZ-CD2 4.35Å; L712-F743 HydrophobicContact CB-CE2 4.33Å; L712-F743 HydrophobicContact CB-CZ 3.97Å; L712-F743 HydrophobicContact CD1-CE2 4.47Å; L712-F743 HydrophobicContact CD2-CD2 4.08Å; L712-F743 HydrophobicContact CD2-CE1 4.32Å; L712-F743 HydrophobicContact CD2-CE2 3.79Å; L712-F743 HydrophobicContact CD2-CG 4.44Å; L712-F743 HydrophobicContact CD2-CZ 3.91Å; L712-F743 HydrophobicContact CG-CE2 4.41Å; L712-F743 HydrophobicContact CG-CZ 4.44Å; L712-F743 WeakPolarHBondContact O-CZ 3.42Å; L715-F743 HydrophobicContact CB-CD1 3.97Å; L715-F743 HydrophobicContact CB-CE1 3.49Å; L715-F743 VanDerWaalsContact CB-CE1 3.49Å; L715-F743 HydrophobicContact CB-CZ 4.49Å; L715-F743 HydrophobicContact CD1-CD1 4.24Å; L715-F743 HydrophobicContact CD1-CE1 4.3Å; Y739-F743 WeakPolarHBondContact O-CB 3.39Å; Y739-F743 PolarHBondContact O-N 2.95Å; F740-F743 PolarHBondContact O-N 2.97Å; F743-V746 PolarHBondContact O-N 3.48Å; F743-T747 HydrophobicContact CD1-CG2 4.3Å; F743-T747 HydrophobicContact CE1-CG2 3.98Å; F743-T747 HydrophobicContact CZ-CG2 4.36Å; F743-T747 WeakPolarHBondContact O-CB 3.32Å; F743-T747 VanDerWaalsContact O-CG2 3.29Å; F743-T747 WeakPolarHBondContact O-CG2 3.15Å; F743-T747 PolarHBondContact O-N 3.08Å
744	Y	94.9	Very high	92.9	Very high	23 Å²	23	40.7 Å²	40.7	9%	0.09	20%	0.196	C	C	.	.	H	α-helix	trans	-56.9	-51.4	176.9	171.4	-100.2	0	0	0	111.7	F346 T350 V718 F740 M741 T742 V746 T747 M748	F346-Y744 HydrophobicContact CE1-CD1 4.01Å; F346-Y744 AromaticContact CZ-CD1 3.8Å; F346-Y744 HydrophobicContact CZ-CD1 3.8Å; F346-Y744 HydrophobicContact CZ-CE1 4.43Å; T350-Y744 HydrophobicContact CG2-CD1 4.33Å; T350-Y744 HydrophobicContact CG2-CD2 4.14Å; T350-Y744 HydrophobicContact CG2-CE1 3.75Å; T350-Y744 HydrophobicContact CG2-CE2 3.53Å; T350-Y744 WeakPolarHBondContact CG2-OH 3.49Å; V718-Y744 HydrophobicContact CG1-CE2 3.91Å; V718-Y744 HydrophobicContact CG2-CD2 4.27Å; V718-Y744 HydrophobicContact CG2-CE2 3.89Å; F740-Y744 PolarHBondContact O-N 3.05Å; M741-Y744 PolarHBondContact O-N 3.2Å; T742-Y744 PolarHBondContact O-N 3.3Å; Y744-V746 PolarHBondContact O-N 3.43Å; Y744-T747 WeakPolarHBondContact O-CG2 3.32Å; Y744-T747 PolarHBondContact O-N 2.83Å; Y744-M748 HydrophobicContact CE1-SD 4.37Å; Y744-M748 WeakPolarHBondContact O-CB 3.44Å; Y744-M748 PolarHBondContact O-N 3.41Å
745	I	92.2	Very high	92.7	Very high	39 Å²	39	38.7 Å²	38.7	20%	0.2	19%	0.191	C	C	.	.	H	α-helix	trans	-59.6	-47.9	-179.4	-66.7	172.7	0	0	0	110.4	F304 L308 F346 M741 T742 V749	F304-I745 HydrophobicContact CE1-CG2 4.02Å; F304-I745 HydrophobicContact CZ-CG2 3.64Å; L308-I745 HydrophobicContact CD1-CD1 4.29Å; L308-I745 HydrophobicContact CD2-CD1 4.42Å; L308-I745 HydrophobicContact CD2-CG2 4.16Å; F346-I745 HydrophobicContact CE2-CD1 4.48Å; F346-I745 HydrophobicContact CZ-CD1 4.47Å; F346-I745 HydrophobicContact CZ-CG1 4.34Å; M741-I745 WeakPolarHBondContact O-CG1 3.46Å; M741-I745 PolarHBondContact O-N 3.49Å; T742-I745 PolarHBondContact O-N 2.93Å; I745-V749 WeakPolarHBondContact O-CG2 3.27Å; I745-V749 PolarHBondContact O-N 3.12Å
746	V	93.1	Very high	92.3	Very high	43 Å²	43	30 Å²	30	26%	0.261	16%	0.163	S	C	.	.	H	α-helix	trans	-64.2	-49.4	179.9	172.6	0	0	0	0	111.4	F649 F653 T742 F743 Y744 M748 V749 V750	F649-V746 HydrophobicContact CD1-CG1 3.81Å; F649-V746 HydrophobicContact CE1-CG1 3.99Å; F649-V746 HydrophobicContact CG-CG1 4.4Å; F653-V746 HydrophobicContact CE2-CG1 4.32Å; F653-V746 HydrophobicContact CZ-CG2 4.42Å; T742-V746 HydrophobicContact CG2-CG2 4.38Å; T742-V746 WeakPolarHBondContact O-CB 3.28Å; T742-V746 VanDerWaalsContact O-CG2 3.31Å; T742-V746 WeakPolarHBondContact O-CG2 3.3Å; T742-V746 PolarHBondContact O-N 3.46Å; F743-V746 PolarHBondContact O-N 3.48Å; Y744-V746 PolarHBondContact O-N 3.43Å; V746-M748 VanDerWaalsContact C-N 3.31Å; V746-M748 PolarHBondContact O-N 2.83Å; V746-V749 PolarHBondContact O-N 3.43Å; V746-V750 HydrophobicContact CG1-CG2 4.33Å; V746-V750 WeakPolarHBondContact O-CB 3.38Å; V746-V750 VanDerWaalsContact O-CG2 3.23Å; V746-V750 WeakPolarHBondContact O-CG2 3.27Å; V746-V750 PolarHBondContact O-N 3Å
747	T	93.4	Very high	91.7	Very high	8 Å²	8	29.9 Å²	29.9	5%	0.049	16%	0.162	C	C	.	.	H	α-helix	trans	-67.8	-32.9	-177.5	-165.5	0	0	0	0	112	T716 F743 Y744 M751	T716-T747 PolarHBondContact OG1-OG1 2.82Å; F743-T747 HydrophobicContact CD1-CG2 4.3Å; F743-T747 HydrophobicContact CE1-CG2 3.98Å; F743-T747 HydrophobicContact CZ-CG2 4.36Å; F743-T747 WeakPolarHBondContact O-CB 3.32Å; F743-T747 VanDerWaalsContact O-CG2 3.29Å; F743-T747 WeakPolarHBondContact O-CG2 3.15Å; F743-T747 PolarHBondContact O-N 3.08Å; Y744-T747 WeakPolarHBondContact O-CG2 3.32Å; Y744-T747 PolarHBondContact O-N 2.83Å; T747-M751 WeakPolarHBondContact O-CB 3.45Å; T747-M751 PolarHBondContact O-N 2.86Å
748	M	89.4	Confident	91.2	Very high	30 Å²	30	30.9 Å²	30.9	15%	0.148	17%	0.168	C	C	.	.	H	α-helix	trans	-62.6	-53.3	175.8	-177.8	-165.1	167.4	0	0	110.3	M384 L388 Y744 V746 V750 M751 T752	M384-M748 HydrophobicContact CE-CE 3.22Å; M384-M748 HydrophobicContact CE-SD 3.14Å; M384-M748 WeakPolarHBondContact CE-SD 3.4Å; L388-M748 HydrophobicContact CD1-CE 4.02Å; L388-M748 HydrophobicContact CD2-CE 3.54Å; L388-M748 HydrophobicContact CG-CE 3.86Å; Y744-M748 HydrophobicContact CE1-SD 4.37Å; Y744-M748 WeakPolarHBondContact O-CB 3.44Å; Y744-M748 PolarHBondContact O-N 3.41Å; V746-M748 VanDerWaalsContact C-N 3.31Å; V746-M748 PolarHBondContact O-N 2.83Å; M748-V750 VanDerWaalsContact C-N 3.34Å; M748-V750 PolarHBondContact O-N 2.93Å; M748-M751 PolarHBondContact O-N 3.4Å; M748-T752 HydrophobicContact CG-CG2 4.41Å; M748-T752 WeakPolarHBondContact O-CG2 3.48Å; M748-T752 PolarHBondContact O-N 3.42Å; M748-T752 PolarHBondContact O-OG1 3.19Å; M748-T752 VanDerWaalsContact O-OG1 3.07Å
749	V	88.6	Confident	90.7	Very high	11 Å²	11	30.7 Å²	30.7	7%	0.067	17%	0.167	C	C	.	.	H	α-helix	trans	-59	-46.5	179.1	172.9	0	0	0	0	111.3	F304 V391 I745 V746 T752 I753	F304-V749 HydrophobicContact CD2-CG2 3.67Å; F304-V749 HydrophobicContact CE1-CG2 4.09Å; F304-V749 HydrophobicContact CE2-CG2 3.1Å; F304-V749 HydrophobicContact CG-CG2 4.37Å; F304-V749 HydrophobicContact CZ-CG2 3.37Å; V391-V749 HydrophobicContact CG1-CG1 4.41Å; I745-V749 WeakPolarHBondContact O-CG2 3.27Å; I745-V749 PolarHBondContact O-N 3.12Å; V746-V749 PolarHBondContact O-N 3.43Å; V749-T752 PolarHBondContact O-N 2.91Å; V749-T752 PolarHBondContact O-OG1 2.72Å; V749-T752 VanDerWaalsContact O-OG1 3.05Å; V749-I753 HydrophobicContact CG1-CD1 3.81Å; V749-I753 VanDerWaalsContact O-CG1 3.27Å; V749-I753 WeakPolarHBondContact O-CG1 3.35Å; V749-I753 PolarHBondContact O-N 3.4Å; V749-I753 VanDerWaalsContact O-N 3.12Å
750	V	91.5	Very high	90.1	Very high	2 Å²	2	32.3 Å²	32.3	1%	0.012	18%	0.176	C	C	.	.	H	α-helix	trans	-64	-45.7	-179.6	173.3	0	0	0	0	110.7	I297 L646 F649 V746 M748 T752 I754	I297-V750 HydrophobicContact CG2-CG2 4.29Å; L646-V750 HydrophobicContact CD1-CG1 3.98Å; F649-V750 HydrophobicContact CD2-CG1 4.17Å; F649-V750 HydrophobicContact CD2-CG2 3.87Å; F649-V750 HydrophobicContact CE2-CG1 4.25Å; F649-V750 HydrophobicContact CE2-CG2 3.53Å; F649-V750 HydrophobicContact CZ-CG2 3.95Å; V746-V750 HydrophobicContact CG1-CG2 4.33Å; V746-V750 WeakPolarHBondContact O-CB 3.38Å; V746-V750 VanDerWaalsContact O-CG2 3.23Å; V746-V750 WeakPolarHBondContact O-CG2 3.27Å; V746-V750 PolarHBondContact O-N 3Å; M748-V750 VanDerWaalsContact C-N 3.34Å; M748-V750 PolarHBondContact O-N 2.93Å; V750-T752 PolarHBondContact O-N 3.36Å; V750-I754 HydrophobicContact CG1-CD1 3.74Å; V750-I754 HydrophobicContact CG1-CG1 4.47Å; V750-I754 WeakPolarHBondContact O-CB 3.49Å; V750-I754 WeakPolarHBondContact O-CG1 3.32Å; V750-I754 PolarHBondContact O-N 3.4Å
751	M	90.4	Very high	89.4	Confident	80 Å²	80	32.3 Å²	32.3	39%	0.394	18%	0.176	S	C	.	.	H	α-helix	trans	-66	-39	-178.1	-172.9	57.8	-179.8	0	0	111.9	T747 M748 I754 V755	T747-M751 WeakPolarHBondContact O-CB 3.45Å; T747-M751 PolarHBondContact O-N 2.86Å; M748-M751 PolarHBondContact O-N 3.4Å; M751-I754 PolarHBondContact O-N 3.19Å; M751-V755 HydrophobicContact CE-CG2 3.66Å; M751-V755 HydrophobicContact CG-CG2 4.33Å; M751-V755 WeakPolarHBondContact O-CB 3.48Å; M751-V755 VanDerWaalsContact O-CG2 3.28Å; M751-V755 WeakPolarHBondContact O-CG2 3.31Å; M751-V755 PolarHBondContact O-N 2.83Å; M751-V755 HydrophobicContact SD-CG2 4.17Å
752	T	86.6	Confident	88.9	Confident	37 Å²	37	33.1 Å²	33.1	23%	0.227	18%	0.179	C	C	.	.	H	α-helix	trans	-70.7	-40.7	-179.2	58.3	0	0	0	0	112.3	L388 M748 V749 V750 I754 V755 A756	L388-T752 HydrophobicContact CD1-CG2 4.25Å; L388-T752 VanDerWaalsContact CD2-CB 3.44Å; L388-T752 HydrophobicContact CD2-CG2 3.2Å; L388-T752 WeakPolarHBondContact CD2-OG1 3.28Å; L388-T752 HydrophobicContact CG-CG2 4.34Å; M748-T752 HydrophobicContact CG-CG2 4.41Å; M748-T752 WeakPolarHBondContact O-CG2 3.48Å; M748-T752 PolarHBondContact O-N 3.42Å; M748-T752 PolarHBondContact O-OG1 3.19Å; M748-T752 VanDerWaalsContact O-OG1 3.07Å; V749-T752 PolarHBondContact O-N 2.91Å; V749-T752 PolarHBondContact O-OG1 2.72Å; V749-T752 VanDerWaalsContact O-OG1 3.05Å; V750-T752 PolarHBondContact O-N 3.36Å; T752-I754 VanDerWaalsContact C-N 3.32Å; T752-I754 PolarHBondContact O-N 3.36Å; T752-V755 PolarHBondContact O-N 2.89Å; T752-A756 VanDerWaalsContact O-CB 3.22Å; T752-A756 WeakPolarHBondContact O-CB 3.26Å; T752-A756 PolarHBondContact O-N 3.21Å
753	I	88.3	Confident	88.3	Confident	4 Å²	4	33.3 Å²	33.3	2%	0.021	18%	0.18	C	C	.	.	H	α-helix	trans	-58	-46.5	171	-68.5	169.5	0	0	0	110.4	I297 V391 F395 V749 F757	I297-I753 HydrophobicContact CB-CD1 4.34Å; I297-I753 HydrophobicContact CG1-CD1 3.92Å; I297-I753 HydrophobicContact CG1-CG2 4.17Å; I297-I753 HydrophobicContact CG2-CD1 4.11Å; V391-I753 HydrophobicContact CG1-CD1 3.61Å; V391-I753 HydrophobicContact CG1-CG1 3.49Å; V391-I753 VanDerWaalsContact CG1-CG1 3.49Å; F395-I753 HydrophobicContact CD1-CG2 4.16Å; F395-I753 HydrophobicContact CD2-CD1 4.42Å; F395-I753 HydrophobicContact CD2-CG2 3.59Å; F395-I753 HydrophobicContact CE1-CG2 4.11Å; F395-I753 HydrophobicContact CE2-CG2 3.51Å; F395-I753 HydrophobicContact CG-CG2 3.92Å; F395-I753 HydrophobicContact CZ-CG2 3.8Å; V749-I753 HydrophobicContact CG1-CD1 3.81Å; V749-I753 VanDerWaalsContact O-CG1 3.27Å; V749-I753 WeakPolarHBondContact O-CG1 3.35Å; V749-I753 PolarHBondContact O-N 3.4Å; V749-I753 VanDerWaalsContact O-N 3.12Å; I753-F757 VanDerWaalsContact O-CB 3.24Å; I753-F757 WeakPolarHBondContact O-CB 3.47Å; I753-F757 PolarHBondContact O-N 3.36Å; I753-F757 VanDerWaalsContact O-N 3.1Å
754	I	88.6	Confident	87.6	Confident	13 Å²	13	35.6 Å²	35.6	7%	0.067	19%	0.19	C	C	.	.	H	α-helix	trans	-61.2	-49.4	179.5	-71.7	173	0	0	0	111.3	L642 L646 V750 M751 T752 I758	L642-I754 HydrophobicContact CB-CD1 4.34Å; L642-I754 HydrophobicContact CB-CG1 4.07Å; L642-I754 HydrophobicContact CB-CG2 4.2Å; L642-I754 HydrophobicContact CD1-CG1 4.41Å; L642-I754 HydrophobicContact CD1-CG2 4.2Å; L642-I754 HydrophobicContact CD2-CG1 4.16Å; L642-I754 HydrophobicContact CG-CG1 4.45Å; L646-I754 HydrophobicContact CB-CD1 4.16Å; V750-I754 HydrophobicContact CG1-CD1 3.74Å; V750-I754 HydrophobicContact CG1-CG1 4.47Å; V750-I754 WeakPolarHBondContact O-CB 3.49Å; V750-I754 WeakPolarHBondContact O-CG1 3.32Å; V750-I754 PolarHBondContact O-N 3.4Å; M751-I754 PolarHBondContact O-N 3.19Å; T752-I754 VanDerWaalsContact C-N 3.32Å; T752-I754 PolarHBondContact O-N 3.36Å; I754-I758 HydrophobicContact CG2-CD1 3.75Å; I754-I758 WeakPolarHBondContact O-CD1 3.44Å; I754-I758 VanDerWaalsContact O-CG1 3.24Å; I754-I758 WeakPolarHBondContact O-CG1 3.49Å; I754-I758 PolarHBondContact O-N 3.39Å; I754-I758 VanDerWaalsContact O-N 3.09Å
755	V	87.6	Confident	86.9	Confident	62 Å²	62	35.9 Å²	35.9	38%	0.376	19%	0.191	S	C	.	.	H	α-helix	trans	-64.1	-47.6	-178.1	169.3	0	0	0	0	110.9	M751 T752 F757 I758 L759	M751-V755 HydrophobicContact CE-CG2 3.66Å; M751-V755 HydrophobicContact CG-CG2 4.33Å; M751-V755 WeakPolarHBondContact O-CB 3.48Å; M751-V755 VanDerWaalsContact O-CG2 3.28Å; M751-V755 WeakPolarHBondContact O-CG2 3.31Å; M751-V755 PolarHBondContact O-N 2.83Å; M751-V755 HydrophobicContact SD-CG2 4.17Å; T752-V755 PolarHBondContact O-N 2.89Å; V755-F757 PolarHBondContact O-N 3.22Å; V755-I758 PolarHBondContact O-N 3.01Å; V755-L759 HydrophobicContact CG1-CD1 3.79Å; V755-L759 HydrophobicContact CG1-CG 4.34Å; V755-L759 WeakPolarHBondContact O-CB 3.23Å; V755-L759 WeakPolarHBondContact O-CG 3.33Å; V755-L759 PolarHBondContact O-N 3.26Å
756	A	84	Confident	86.3	Confident	25 Å²	25	37 Å²	37	21%	0.207	20%	0.196	C	C	.	.	H	α-helix	trans	-62.2	-45.1	-176.9	0	0	0	0	0	111.6	F392 T752 I758 L759 E760	F392-A756 HydrophobicContact CD2-CB 3.31Å; F392-A756 HydrophobicContact CE2-CB 3.55Å; F392-A756 HydrophobicContact CG-CB 4.2Å; T752-A756 VanDerWaalsContact O-CB 3.22Å; T752-A756 WeakPolarHBondContact O-CB 3.26Å; T752-A756 PolarHBondContact O-N 3.21Å; A756-I758 PolarHBondContact O-N 2.89Å; A756-L759 PolarHBondContact O-N 3.02Å; A756-E760 PolarHBondContact O-N 3.39Å
757	F	83.5	Confident	85.7	Confident	8 Å²	8	37.9 Å²	37.9	4%	0.035	20%	0.199	C	C	.	.	H	α-helix	trans	-62.7	-41	176.3	173.3	-91.1	0	0	0	113.8	F395 E399 R638 L642 I753 V755 L759 A761	F395-F757 AromaticContact CE1-CD2 3.78Å; F395-F757 HydrophobicContact CE1-CD2 3.78Å; F395-F757 HydrophobicContact CE1-CE2 4.19Å; F395-F757 HydrophobicContact CZ-CD2 4.44Å; E399-F757 VanDerWaalsContact OE1-CE2 3.31Å; E399-F757 WeakPolarHBondContact OE1-CE2 3.31Å; E399-F757 WeakPolarHBondContact OE2-CD2 3.43Å; E399-F757 WeakPolarHBondContact OE2-CE2 3.11Å; R638-F757 VanDerWaalsContact CD-CE1 3.45Å; R638-F757 HydrophobicContact CG-CE1 3.69Å; R638-F757 HydrophobicContact CG-CZ 4.03Å; R638-F757 VanDerWaalsContact CZ-CE1 3.43Å; R638-F757 VanDerWaalsContact CZ-CE2 3.48Å; L642-F757 HydrophobicContact CD1-CD1 3.32Å; L642-F757 HydrophobicContact CD1-CE1 3.37Å; L642-F757 HydrophobicContact CD1-CG 4.25Å; L642-F757 HydrophobicContact CD1-CZ 4.32Å; L642-F757 HydrophobicContact CG-CD1 4.49Å; L642-F757 HydrophobicContact CG-CE1 4.16Å; I753-F757 VanDerWaalsContact O-CB 3.24Å; I753-F757 WeakPolarHBondContact O-CB 3.47Å; I753-F757 PolarHBondContact O-N 3.36Å; I753-F757 VanDerWaalsContact O-N 3.1Å; V755-F757 PolarHBondContact O-N 3.22Å; F757-L759 VanDerWaalsContact C-N 3.34Å; F757-A761 WeakPolarHBondContact O-CB 3.43Å; F757-A761 PolarHBondContact O-N 2.75Å; F757-A761 VanDerWaalsContact O-N 3.13Å
758	I	85.5	Confident	85	Confident	37 Å²	37	40.1 Å²	40.1	19%	0.19	21%	0.207	C	C	.	.	H	α-helix	trans	-65.1	-43.9	176.6	-70	168.1	0	0	0	109.5	M639 L642 I754 V755 A756 A761 F762	M639-I758 HydrophobicContact CB-CD1 4.5Å; M639-I758 HydrophobicContact CE-CD1 4.22Å; M639-I758 HydrophobicContact CE-CG2 4.44Å; M639-I758 HydrophobicContact CG-CD1 3.91Å; M639-I758 HydrophobicContact CG-CG1 4.07Å; M639-I758 HydrophobicContact CG-CG2 4.45Å; M639-I758 HydrophobicContact SD-CG2 4.42Å; L642-I758 HydrophobicContact CD1-CD1 4.31Å; L642-I758 HydrophobicContact CD1-CG1 4.07Å; I754-I758 HydrophobicContact CG2-CD1 3.75Å; I754-I758 WeakPolarHBondContact O-CD1 3.44Å; I754-I758 VanDerWaalsContact O-CG1 3.24Å; I754-I758 WeakPolarHBondContact O-CG1 3.49Å; I754-I758 PolarHBondContact O-N 3.39Å; I754-I758 VanDerWaalsContact O-N 3.09Å; V755-I758 PolarHBondContact O-N 3.01Å; A756-I758 PolarHBondContact O-N 2.89Å; I758-A761 PolarHBondContact O-N 3Å; I758-F762 WeakPolarHBondContact O-CB 3.5Å; I758-F762 PolarHBondContact O-N 3.29Å
759	L	84.2	Confident	84.3	Confident	99 Å²	99	39.3 Å²	39.3	52%	0.518	20%	0.204	S	C	.	.	H	α-helix	trans	-62.4	-45.6	178.6	-76.5	174.2	0	0	0	112	V755 A756 F757 A761 F762 V763	V755-L759 HydrophobicContact CG1-CD1 3.79Å; V755-L759 HydrophobicContact CG1-CG 4.34Å; V755-L759 WeakPolarHBondContact O-CB 3.23Å; V755-L759 WeakPolarHBondContact O-CG 3.33Å; V755-L759 PolarHBondContact O-N 3.26Å; A756-L759 PolarHBondContact O-N 3.02Å; F757-L759 VanDerWaalsContact C-N 3.34Å; L759-A761 PolarHBondContact O-N 3.3Å; L759-F762 PolarHBondContact O-N 3.12Å; L759-V763 VanDerWaalsContact O-CB 3.32Å; L759-V763 WeakPolarHBondContact O-CB 3.46Å; L759-V763 VanDerWaalsContact O-CG2 3.23Å; L759-V763 WeakPolarHBondContact O-CG2 3.35Å; L759-V763 PolarHBondContact O-N 3.35Å
760	E	83.8	Confident	83.7	Confident	59 Å²	59	46.6 Å²	46.6	28%	0.276	23%	0.231	S	C	.	.	H	α-helix	trans	-60.5	-49.2	178.3	-176.1	177.2	176.8	0	0	111.5	F392 N396 A756 F762 V763 F764	F392-E760 WeakPolarHBondContact CZ-OE2 3.2Å; N396-E760 PolarHBondContact ND2-OE2 2.71Å; N396-E760 PolarHBondContact OD1-OE2 2.95Å; A756-E760 PolarHBondContact O-N 3.39Å; E760-F762 VanDerWaalsContact C-N 3.28Å; E760-F762 PolarHBondContact O-N 3.03Å; E760-V763 PolarHBondContact O-N 3.42Å; E760-F764 WeakPolarHBondContact O-CB 3.28Å; E760-F764 PolarHBondContact O-N 2.95Å
761	A	82.7	Confident	83	Confident	3 Å²	3	54.7 Å²	54.7	3%	0.025	27%	0.266	C	S	.	.	H	α-helix	trans	-60	-40.4	177.5	0	0	0	0	0	112.2	L635 F757 I758 L759 R765	L635-A761 HydrophobicContact CD1-CB 4.06Å; L635-A761 HydrophobicContact CD2-CB 4.08Å; F757-A761 WeakPolarHBondContact O-CB 3.43Å; F757-A761 PolarHBondContact O-N 2.75Å; F757-A761 VanDerWaalsContact O-N 3.13Å; I758-A761 PolarHBondContact O-N 3Å; L759-A761 PolarHBondContact O-N 3.3Å; A761-R765 WeakPolarHBondContact O-CB 3.22Å; A761-R765 PolarHBondContact O-N 2.94Å; A761-R765 VanDerWaalsContact O-N 3.1Å
762	F	84.9	Confident	82	Confident	47 Å²	47	53.2 Å²	53.2	21%	0.206	26%	0.259	C	S	.	.	H	α-helix	trans	-69.5	-48.2	-179.2	-170.8	-81.7	0	0	0	111.7	V628 T631 L635 I758 L759 E760 R765 M766	V628-F762 HydrophobicContact CB-CZ 4.14Å; V628-F762 HydrophobicContact CG1-CZ 3.92Å; V628-F762 HydrophobicContact CG2-CE1 4.43Å; V628-F762 HydrophobicContact CG2-CZ 3.98Å; T631-F762 WeakPolarHBondContact OG1-CE2 3.44Å; T631-F762 VanDerWaalsContact OG1-CZ 3.26Å; T631-F762 WeakPolarHBondContact OG1-CZ 3.41Å; L635-F762 HydrophobicContact CD1-CB 4.1Å; L635-F762 HydrophobicContact CD1-CD2 4.25Å; I758-F762 WeakPolarHBondContact O-CB 3.5Å; I758-F762 PolarHBondContact O-N 3.29Å; L759-F762 PolarHBondContact O-N 3.12Å; E760-F762 VanDerWaalsContact C-N 3.28Å; E760-F762 PolarHBondContact O-N 3.03Å; F762-R765 PolarHBondContact O-N 2.91Å; F762-M766 HydrophobicContact CE1-SD 4.33Å; F762-M766 WeakPolarHBondContact O-CB 3.35Å; F762-M766 PolarHBondContact O-N 2.85Å
763	V	83.3	Confident	80.7	Confident	64 Å²	64	56.5 Å²	56.5	39%	0.388	27%	0.272	S	S	.	.	H	α-helix	trans	-64.6	-44	179	170.9	0	0	0	0	110.5	L759 E760 R765 M766 N767	L759-V763 VanDerWaalsContact O-CB 3.32Å; L759-V763 WeakPolarHBondContact O-CB 3.46Å; L759-V763 VanDerWaalsContact O-CG2 3.23Å; L759-V763 WeakPolarHBondContact O-CG2 3.35Å; L759-V763 PolarHBondContact O-N 3.35Å; E760-V763 PolarHBondContact O-N 3.42Å; V763-R765 PolarHBondContact O-N 3.34Å; V763-M766 PolarHBondContact O-N 2.91Å; V763-N767 WeakPolarHBondContact CG1-ND2 3.46Å; V763-N767 WeakPolarHBondContact O-CB 3.17Å; V763-N767 PolarHBondContact O-N 2.93Å; V763-N767 PolarHBondContact O-ND2 3.21Å
764	F	82.6	Confident	78.6	Confident	53 Å²	53	64.5 Å²	64.5	23%	0.232	32%	0.315	C	S	.	.	H	α-helix	trans	-57.8	-50.2	175.6	178.8	-98.4	0	0	0	111.3	E760 M766 N767 Y768 L840 K843 M844	E760-F764 WeakPolarHBondContact O-CB 3.28Å; E760-F764 PolarHBondContact O-N 2.95Å; F764-M766 PolarHBondContact O-N 3.32Å; F764-N767 PolarHBondContact O-N 3.26Å; F764-Y768 VanDerWaalsContact O-CB 3.31Å; F764-Y768 WeakPolarHBondContact O-CB 3.29Å; F764-Y768 PolarHBondContact O-N 3.46Å; F764-L840 HydrophobicContact CD1-CD1 3.59Å; F764-L840 HydrophobicContact CD1-CD2 4.37Å; F764-L840 HydrophobicContact CD1-CG 3.79Å; F764-L840 HydrophobicContact CE1-CD1 3.62Å; F764-L840 HydrophobicContact CE1-CG 3.87Å; F764-K843 HydrophobicContact CE1-CB 4.31Å; F764-K843 HydrophobicContact CZ-CB 4.02Å; F764-M844 HydrophobicContact CD1-CE 4.21Å; F764-M844 HydrophobicContact CD2-CG 4.38Å; F764-M844 HydrophobicContact CE1-CB 4.2Å; F764-M844 HydrophobicContact CE2-CB 4.06Å; F764-M844 HydrophobicContact CE2-CG 4.23Å; F764-M844 HydrophobicContact CG-CE 4.26Å; F764-M844 VanDerWaalsContact CZ-CA 3.49Å; F764-M844 HydrophobicContact CZ-CB 3.86Å
765	R	80.9	Confident	76.7	Confident	29 Å²	29	68.2 Å²	68.2	11%	0.109	34%	0.342	C	S	.	.	H	α-helix	trans	-63.8	-41.5	178.7	-173	-177	176.3	-82.1	14.4	112.2	D630 T631 E634 A761 F762 V763 Y768 S769 L840	D630-R765 PolarHBondContact O-NH2 2.72Å; T631-R765 HydrophobicContact CG2-CB 4.02Å; T631-R765 HydrophobicContact CG2-CG 3.75Å; E634-R765 VanDerWaalsContact CD-NE 3.31Å; E634-R765 IonicContact OE1-NE 2.74Å; E634-R765 IonicContact OE2-CZ 3.6Å; E634-R765 IonicContact OE2-NE 2.74Å; E634-R765 PolarHBondContact OE2-NE 3.12Å; E634-R765 IonicContact OE2-NH2 3.15Å; E634-R765 PolarHBondContact OE2-NH2 3.38Å; A761-R765 WeakPolarHBondContact O-CB 3.22Å; A761-R765 PolarHBondContact O-N 2.94Å; A761-R765 VanDerWaalsContact O-N 3.1Å; F762-R765 PolarHBondContact O-N 2.91Å; V763-R765 PolarHBondContact O-N 3.34Å; R765-Y768 PolarHBondContact O-N 2.89Å; R765-S769 WeakPolarHBondContact O-CB 3.29Å; R765-S769 PolarHBondContact O-N 3.46Å; R765-L840 HydrophobicContact CB-CD1 4.34Å
766	M	79.8	Confident	74.8	Confident	63 Å²	63	68 Å²	68	31%	0.31	34%	0.337	S	S	.	.	H	α-helix	trans	-64.4	-43	179.3	-174.7	178.8	60.3	0	0	111.5	F762 V763 F764 S769 R770	F762-M766 HydrophobicContact CE1-SD 4.33Å; F762-M766 WeakPolarHBondContact O-CB 3.35Å; F762-M766 PolarHBondContact O-N 2.85Å; V763-M766 PolarHBondContact O-N 2.91Å; F764-M766 PolarHBondContact O-N 3.32Å; M766-S769 PolarHBondContact O-N 3.5Å; M766-R770 PolarHBondContact O-N 3.32Å; M766-R770 VanDerWaalsContact O-N 3.13Å
767	N	80.4	Confident	73.1	Confident	61 Å²	61	73.9 Å²	73.9	33%	0.326	37%	0.37	S	S	.	.	H	α-helix	trans	-65.8	-38.9	175.9	-75.7	-24.6	0	0	0	111.9	V763 F764 R770 K771	V763-N767 WeakPolarHBondContact CG1-ND2 3.46Å; V763-N767 WeakPolarHBondContact O-CB 3.17Å; V763-N767 PolarHBondContact O-N 2.93Å; V763-N767 PolarHBondContact O-ND2 3.21Å; F764-N767 PolarHBondContact O-N 3.26Å; N767-R770 PolarHBondContact O-N 3.06Å; N767-K771 PolarHBondContact O-N 3.16Å; N767-K771 VanDerWaalsContact O-N 3.17Å
768	Y	77.9	Confident	71.5	Confident	55 Å²	55	77.1 Å²	77.1	22%	0.216	39%	0.388	C	S	.	.	H	α-helix	trans	-64.1	-48.1	175.6	-176.5	-98.1	0	0	0	112.1	F764 R765 R770 K771 N772 K843	F764-Y768 VanDerWaalsContact O-CB 3.31Å; F764-Y768 WeakPolarHBondContact O-CB 3.29Å; F764-Y768 PolarHBondContact O-N 3.46Å; R765-Y768 PolarHBondContact O-N 2.89Å; Y768-R770 PolarHBondContact O-N 3.28Å; Y768-K771 PolarHBondContact O-N 3.09Å; Y768-N772 PolarHBondContact O-N 2.71Å; Y768-N772 VanDerWaalsContact O-N 3.1Å; Y768-N772 PolarHBondContact OH-ND2 3.5Å; Y768-K843 HydrophobicContact CE1-CD 4.24Å; Y768-K843 HydrophobicContact CE2-CD 3.89Å; Y768-K843 VanDerWaalsContact CZ-NZ 3.29Å; Y768-K843 VanDerWaalsContact OH-CE 3.31Å; Y768-K843 WeakPolarHBondContact OH-CE 3.09Å; Y768-K843 PolarHBondContact OH-NZ 2.92Å
769	S	75.1	Confident	70.1	Confident	13 Å²	13	78.2 Å²	78.2	9%	0.091	41%	0.408	C	S	.	.	H	α-helix	trans	-58.6	-36.2	177.7	-179.9	0	0	0	0	111.8	R765 M766 N772	R765-S769 WeakPolarHBondContact O-CB 3.29Å; R765-S769 PolarHBondContact O-N 3.46Å; M766-S769 PolarHBondContact O-N 3.5Å; S769-N772 PolarHBondContact O-N 3.27Å
770	R	76.1	Confident	69.6	Low	164 Å²	164	73.7 Å²	73.7	62%	0.619	39%	0.386	S	S	*	.	H	α-helix	trans	-67.9	-35.2	173.7	-172.7	178.2	63	-176.2	-3.8	113.2	M766 N767 Y768	M766-R770 PolarHBondContact O-N 3.32Å; M766-R770 VanDerWaalsContact O-N 3.13Å; N767-R770 PolarHBondContact O-N 3.06Å; Y768-R770 PolarHBondContact O-N 3.28Å
771	K	77.1	Confident	69.5	Low	173 Å²	173	73.5 Å²	73.5	75%	0.752	39%	0.386	S	S	*	.	H	α-helix	trans	-72.3	-28.7	178.4	-74.4	-178.4	177.4	-175.7	0	112.6	N767 Y768	N767-K771 PolarHBondContact O-N 3.16Å; N767-K771 VanDerWaalsContact O-N 3.17Å; Y768-K771 PolarHBondContact O-N 3.09Å
772	N	69.6	Low	69.7	Low	48 Å²	48	76.7 Å²	76.7	26%	0.257	41%	0.406	S	S	.	.	T	Hydrogen-bonded Turn	trans	-106.7	27.1	-172.9	-77.9	20.7	0	0	0	114.4	Y768 S769 D774 S775	Y768-N772 PolarHBondContact O-N 2.71Å; Y768-N772 VanDerWaalsContact O-N 3.1Å; Y768-N772 PolarHBondContact OH-ND2 3.5Å; S769-N772 PolarHBondContact O-N 3.27Å; N772-D774 PolarHBondContact O-N 3.39Å; N772-S775 PolarHBondContact O-N 2.73Å; N772-S775 VanDerWaalsContact O-N 3.09Å; N772-S775 PolarHBondContact O-OG 3.35Å
773	Q	58.2	Low	69.9	Low	107 Å²	107	77.1 Å²	77.1	50%	0.5	41%	0.41	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.9	-20.8	-171.9	-127.7	170.8	-14.3	0	0	114.6	E623	E623-Q773 PolarHBondContact OE1-NE2 3.1Å; E623-Q773 PolarHBondContact OE2-NE2 3.24Å
774	D	45	Very low	70.3	Confident	171 Å²	171	79 Å²	79	91%	0.914	41%	0.414	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.7	-5.7	-179.1	-66.7	-28.9	0	0	0	115.3	N772	N772-D774 PolarHBondContact O-N 3.39Å
775	S	48	Very low	70.7	Confident	91 Å²	91	78.8 Å²	78.8	64%	0.636	41%	0.413	S	S	*	.	T	Hydrogen-bonded Turn	trans	-129.9	-4.9	-171.4	45.4	0	0	0	0	116.4	N772	N772-S775 PolarHBondContact O-N 2.73Å; N772-S775 VanDerWaalsContact O-N 3.09Å; N772-S775 PolarHBondContact O-OG 3.35Å
776	E	47.9	Very low	71.2	Confident	57 Å²	57	82.5 Å²	82.5	27%	0.266	43%	0.432	S	S	.	.			trans	-108.9	58.5	-173.2	-69.8	-164.3	148	0	0	114.4	R835	E776-R835 IonicContact OE1-CZ 2.67Å; E776-R835 VanDerWaalsContact OE1-CZ 3.27Å; E776-R835 IonicContact OE1-NE 3.46Å; E776-R835 IonicContact OE1-NH1 3.3Å; E776-R835 IonicContact OE1-NH2 2.94Å; E776-R835 PolarHBondContact OE1-NH2 3.01Å
777	V	47.7	Very low	71.7	Confident	150 Å²	150	79.6 Å²	79.6	91%	0.909	42%	0.418	S	S	*	.	S	Bend	trans	-77.5	-11.3	167.3	-179	0	0	0	0	112
778	D	50.8	Low	72.2	Confident	75 Å²	75	78.3 Å²	78.3	40%	0.401	41%	0.413	S	S	.	.	S	Bend	trans	-128.7	130	-177	-113.2	-29.5	0	0	0	113.7	G780 R832	D778-G780 PolarHBondContact O-N 3.19Å; D778-R832 VanDerWaalsContact CG-CZ 3.47Å; D778-R832 IonicContact OD1-CZ 3.85Å; D778-R832 IonicContact OD1-NH1 3.86Å; D778-R832 PolarHBondContact OD1-NH1 3.4Å; D778-R832 IonicContact OD1-NH2 3.6Å; D778-R832 PolarHBondContact OD1-NH2 3.06Å; D778-R832 IonicContact OD2-CZ 2.68Å; D778-R832 IonicContact OD2-NH1 3.2Å; D778-R832 PolarHBondContact OD2-NH1 3.05Å; D778-R832 IonicContact OD2-NH2 2.77Å
779	G	57	Low	72.8	Confident	60 Å²	60	80 Å²	80	62%	0.619	42%	0.422	S	S	*	.	S	Bend	trans	-67.9	40.1	-175.5	0	0	0	0	0	116
780	G	73.9	Confident	73.5	Confident	5 Å²	5	87.2 Å²	87.2	5%	0.052	45%	0.454	C	S	.	.	S	Bend	trans	-168.1	-177.5	177.7	0	0	0	0	0	112.7	D778 R833	D778-G780 PolarHBondContact O-N 3.19Å; G780-R833 CarbonylContact C-O 3.57Å; G780-R833 VanDerWaalsContact CA-O 3.22Å; G780-R833 WeakPolarHBondContact CA-O 3.5Å
781	I	81.6	Confident	74.2	Confident	55 Å²	55	82 Å²	82	28%	0.282	44%	0.437	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.8	126.8	171.5	-59.1	170.1	0	0	0	107.2	R833 R835	I781-R833 HydrophobicContact CB-CG 4.25Å; I781-R833 PolarHBondContact N-O 3.46Å; I781-R833 PolarHBondContact O-N 3.44Å; I781-R833 VanDerWaalsContact O-N 3.15Å; I781-R835 HydrophobicContact CG1-CG 4.31Å
782	T	86.4	Confident	74.8	Confident	70 Å²	70	74 Å²	74	43%	0.429	40%	0.402	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	134.2	-178.5	50.7	0	0	0	0	110.6	L830 G831 R832	T782-L830 HydrophobicContact CG2-CD1 4.4Å; T782-G831 CarbonylContact C-O 3.59Å; T782-G831 WeakPolarHBondContact CA-O 3.21Å; T782-R832 HydrophobicContact CG2-CG 4.3Å
783	L	88.7	Confident	75.7	Confident	56 Å²	56	74.2 Å²	74.2	29%	0.293	41%	0.405	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	122.3	175.9	-176.2	67.5	0	0	0	109.1	A457 L480 W482 K785 G831	A457-L783 HydrophobicContact CB-CD2 3.57Å; L480-L783 HydrophobicContact CD1-CB 4.19Å; L480-L783 HydrophobicContact CD1-CD2 3.88Å; W482-L783 HydrophobicContact CH2-CD2 4Å; W482-L783 HydrophobicContact CH2-CG 4.37Å; L783-K785 HydrophobicContact CD2-CG 4.5Å; L783-K785 HydrophobicContact CG-CG 4.4Å; L783-G831 PolarHBondContact N-O 3.4Å; L783-G831 PolarHBondContact O-N 2.77Å
784	E	90.8	Very high	77.2	Confident	104 Å²	104	71.5 Å²	71.5	49%	0.486	40%	0.401	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	131.3	174.7	-67.6	-165.5	160.7	0	0	110.1	K485 F829 L830	K485-E784 IonicContact NZ-OE1 2.65Å; K485-E784 PolarHBondContact NZ-OE1 3.5Å; K485-E784 IonicContact NZ-OE2 3.87Å; E784-F829 WeakPolarHBondContact CA-O 3.33Å; E784-L830 HydrophobicContact CG-CD1 3.5Å; E784-L830 VanDerWaalsContact CG-CD1 3.5Å
785	K	91.6	Very high	79.3	Confident	47 Å²	47	63.6 Å²	63.6	20%	0.204	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.5	135.6	173.3	-72	-71.3	173.5	153.9	0	109.7	L453 K456 A457 W482 L783 F829	L453-K785 HydrophobicContact CD2-CB 4.31Å; K456-K785 PolarHBondContact O-NZ 3.48Å; A457-K785 HydrophobicContact CB-CG 4.37Å; W482-K785 HydrophobicContact CH2-CB 4.09Å; W482-K785 HydrophobicContact CH2-CG 3.83Å; W482-K785 HydrophobicContact CZ3-CB 3.91Å; W482-K785 HydrophobicContact CZ3-CG 4.12Å; L783-K785 HydrophobicContact CD2-CG 4.5Å; L783-K785 HydrophobicContact CG-CG 4.4Å; K785-F829 PolarHBondContact N-O 3.17Å; K785-F829 PolarHBondContact O-N 3.39Å
786	E	91.2	Very high	81.3	Confident	108 Å²	108	59.7 Å²	59.7	51%	0.505	33%	0.331	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.7	148.1	174.8	62.2	178.7	177.7	0	0	111.6	K456 M827 V828	K456-E786 WeakPolarHBondContact CE-O 3.45Å; K456-E786 PolarHBondContact NZ-O 3.34Å; E786-M827 WeakPolarHBondContact CA-O 3.35Å; E786-V828 HydrophobicContact CB-CG2 4.32Å
787	I	90.4	Very high	83.3	Confident	2 Å²	2	62.1 Å²	62.1	1%	0.01	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	130.1	170.7	-67	175.3	0	0	0	108.2	Y452 L453 E791 L792 M819 S826 M827 F829	Y452-I787 HydrophobicContact CD1-CD1 3.89Å; Y452-I787 HydrophobicContact CD1-CG1 4.24Å; Y452-I787 HydrophobicContact CE1-CD1 4.39Å; Y452-I787 HydrophobicContact CE1-CG1 4.25Å; Y452-I787 HydrophobicContact CE1-CG2 4.47Å; L453-I787 HydrophobicContact CD1-CD1 4.33Å; L453-I787 HydrophobicContact CD2-CD1 3.31Å; L453-I787 HydrophobicContact CD2-CG1 3.7Å; L453-I787 HydrophobicContact CG-CD1 3.6Å; L453-I787 HydrophobicContact CG-CG1 4.49Å; I787-E791 HydrophobicContact CG2-CB 4.48Å; I787-L792 HydrophobicContact CG2-CB 4.13Å; I787-L792 HydrophobicContact CG2-CD1 4.44Å; I787-M819 HydrophobicContact CG2-CE 4.39Å; I787-S826 VanDerWaalsContact O-CA 3.29Å; I787-S826 WeakPolarHBondContact O-CA 3.44Å; I787-M827 PolarHBondContact N-O 3.45Å; I787-M827 PolarHBondContact O-N 2.91Å; I787-F829 HydrophobicContact CB-CE2 4.38Å; I787-F829 HydrophobicContact CD1-CD2 4.14Å; I787-F829 HydrophobicContact CD1-CE2 4.08Å; I787-F829 HydrophobicContact CG1-CD2 4.35Å; I787-F829 HydrophobicContact CG1-CE2 4.46Å
788	S	92.1	Very high	85.1	Confident	34 Å²	34	59 Å²	59	24%	0.238	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.1	156.3	173.1	77.9	0	0	0	0	111.6	E790 E791 L792	S788-E790 VanDerWaalsContact C-N 3.25Å; S788-E790 PolarHBondContact O-N 3.16Å; S788-E791 PolarHBondContact N-OE2 3.09Å; S788-E791 PolarHBondContact O-N 2.98Å; S788-E791 WeakPolarHBondContact OG-CB 3.42Å; S788-E791 VanDerWaalsContact OG-CG 3.25Å; S788-E791 WeakPolarHBondContact OG-CG 3.36Å; S788-E791 PolarHBondContact OG-N 3.19Å; S788-L792 PolarHBondContact O-N 2.99Å; S788-L792 VanDerWaalsContact O-N 3.12Å
789	K	90.2	Very high	86.8	Confident	91 Å²	91	55.8 Å²	55.8	40%	0.396	30%	0.302	S	S	.	.	H	α-helix	trans	-59.1	-38	175.3	-172.7	178.1	-179.8	178	0	111.9	L792 V793 L816 M819 R825	K789-L792 PolarHBondContact O-N 3.37Å; K789-V793 VanDerWaalsContact O-CG2 3.29Å; K789-V793 WeakPolarHBondContact O-CG2 3.34Å; K789-V793 PolarHBondContact O-N 2.97Å; K789-L816 HydrophobicContact CG-CD2 3.98Å; K789-M819 HydrophobicContact CB-SD 4.44Å; K789-R825 PolarHBondContact N-O 3.38Å
790	E	90.2	Very high	88.2	Confident	164 Å²	164	59.8 Å²	59.8	77%	0.766	30%	0.299	S	S	*	.	H	α-helix	trans	-64.9	-46	-179.8	-67	172.7	-167.5	0	0	111.8	S788 L792 V793 A794	S788-E790 VanDerWaalsContact C-N 3.25Å; S788-E790 PolarHBondContact O-N 3.16Å; E790-L792 VanDerWaalsContact C-N 3.31Å; E790-L792 PolarHBondContact O-N 3.42Å; E790-V793 PolarHBondContact O-N 3.44Å; E790-A794 PolarHBondContact O-N 3.05Å
791	E	89.6	Confident	88.7	Confident	55 Å²	55	67 Å²	67	26%	0.257	33%	0.331	S	S	.	.	H	α-helix	trans	-58.5	-43.9	173.9	-74.3	171.2	174.8	0	0	111.5	Y452 K456 I787 S788 V793 A794 V795	Y452-E791 HydrophobicContact CE1-CB 4.29Å; K456-E791 IonicContact NZ-OE1 3.93Å; K456-E791 PolarHBondContact NZ-OE1 3.05Å; K456-E791 IonicContact NZ-OE2 2.77Å; K456-E791 PolarHBondContact NZ-OE2 3.41Å; I787-E791 HydrophobicContact CG2-CB 4.48Å; S788-E791 PolarHBondContact N-OE2 3.09Å; S788-E791 PolarHBondContact O-N 2.98Å; S788-E791 WeakPolarHBondContact OG-CB 3.42Å; S788-E791 VanDerWaalsContact OG-CG 3.25Å; S788-E791 WeakPolarHBondContact OG-CG 3.36Å; S788-E791 PolarHBondContact OG-N 3.19Å; E791-V793 VanDerWaalsContact C-N 3.35Å; E791-V793 PolarHBondContact O-N 3.27Å; E791-A794 PolarHBondContact O-N 3.03Å; E791-V795 WeakPolarHBondContact O-CG2 3.29Å; E791-V795 PolarHBondContact O-N 2.88Å
792	L	89.3	Confident	88.4	Confident	4 Å²	4	67.2 Å²	67.2	2%	0.021	34%	0.341	C	S	.	.	H	α-helix	trans	-67.3	-35.9	-178.2	-167.1	65.1	0	0	0	112.2	I787 S788 K789 E790 V795 L796 L812 T815 L816 M819	I787-L792 HydrophobicContact CG2-CB 4.13Å; I787-L792 HydrophobicContact CG2-CD1 4.44Å; S788-L792 PolarHBondContact O-N 2.99Å; S788-L792 VanDerWaalsContact O-N 3.12Å; K789-L792 PolarHBondContact O-N 3.37Å; E790-L792 VanDerWaalsContact C-N 3.31Å; E790-L792 PolarHBondContact O-N 3.42Å; L792-V795 PolarHBondContact O-N 3.3Å; L792-L796 WeakPolarHBondContact O-CB 2.99Å; L792-L796 PolarHBondContact O-N 3.37Å; L792-L812 HydrophobicContact CD1-CD2 3.66Å; L792-T815 HydrophobicContact CD2-CG2 3.86Å; L792-L816 HydrophobicContact CB-CD2 4.31Å; L792-L816 HydrophobicContact CD2-CD2 3.65Å; L792-L816 HydrophobicContact CD2-CG 3.64Å; L792-L816 HydrophobicContact CG-CD2 4.12Å; L792-L816 HydrophobicContact CG-CG 4.16Å; L792-M819 HydrophobicContact CD2-CE 3.91Å; L792-M819 HydrophobicContact CD2-SD 3.88Å
793	V	90.1	Very high	87.9	Confident	52 Å²	52	72.5 Å²	72.5	32%	0.315	36%	0.361	S	S	.	.	H	α-helix	trans	-66	-45.7	174.3	170.8	0	0	0	0	110.7	K789 E790 E791 V795 L796 E797 L816	K789-V793 VanDerWaalsContact O-CG2 3.29Å; K789-V793 WeakPolarHBondContact O-CG2 3.34Å; K789-V793 PolarHBondContact O-N 2.97Å; E790-V793 PolarHBondContact O-N 3.44Å; E791-V793 VanDerWaalsContact C-N 3.35Å; E791-V793 PolarHBondContact O-N 3.27Å; V793-V795 VanDerWaalsContact C-N 3.28Å; V793-V795 PolarHBondContact O-N 3.2Å; V793-L796 WeakPolarHBondContact O-CB 3.22Å; V793-L796 PolarHBondContact O-N 3.2Å; V793-L796 VanDerWaalsContact O-N 3.07Å; V793-E797 PolarHBondContact O-N 3.46Å; V793-L816 HydrophobicContact CG2-CD2 4.22Å
794	A	89.2	Confident	87.1	Confident	51 Å²	51	70.7 Å²	70.7	42%	0.421	36%	0.355	S	S	.	.	H	α-helix	trans	-58.9	-40.5	176.2	0	0	0	0	0	112	E790 E791 L798	E790-A794 PolarHBondContact O-N 3.05Å; E791-A794 PolarHBondContact O-N 3.03Å; A794-L798 WeakPolarHBondContact O-CG 3.32Å; A794-L798 PolarHBondContact O-N 2.87Å
795	V	89.6	Confident	86.5	Confident	4 Å²	4	68.3 Å²	68.3	2%	0.024	35%	0.353	C	S	.	.	H	α-helix	trans	-65.5	-43.8	173.9	176.4	0	0	0	0	111.1	Y432 Y452 E791 L792 V793 E797 L798 Y799 L812	Y432-V795 HydrophobicContact CE1-CG1 4.16Å; Y432-V795 HydrophobicContact CE1-CG2 4.33Å; Y452-V795 HydrophobicContact CD1-CG2 4.43Å; Y452-V795 HydrophobicContact CD2-CG2 3.48Å; Y452-V795 VanDerWaalsContact CD2-CG2 3.48Å; Y452-V795 HydrophobicContact CE1-CG2 4.48Å; Y452-V795 HydrophobicContact CE2-CG2 3.55Å; Y452-V795 HydrophobicContact CG-CG2 3.94Å; E791-V795 WeakPolarHBondContact O-CG2 3.29Å; E791-V795 PolarHBondContact O-N 2.88Å; L792-V795 PolarHBondContact O-N 3.3Å; V793-V795 VanDerWaalsContact C-N 3.28Å; V793-V795 PolarHBondContact O-N 3.2Å; V795-E797 VanDerWaalsContact C-N 3.32Å; V795-E797 PolarHBondContact O-N 2.7Å; V795-L798 WeakPolarHBondContact O-CB 3.39Å; V795-L798 PolarHBondContact O-N 2.91Å; V795-Y799 HydrophobicContact CG1-CD2 3.85Å; V795-Y799 HydrophobicContact CG1-CE2 3.73Å; V795-Y799 WeakPolarHBondContact O-CD2 3.42Å; V795-Y799 PolarHBondContact O-N 3.33Å; V795-Y799 VanDerWaalsContact O-N 3.15Å; V795-L812 HydrophobicContact CG1-CD1 4.23Å
796	L	89.8	Confident	86.1	Confident	10 Å²	10	70.7 Å²	70.7	5%	0.052	38%	0.376	C	S	.	.	H	α-helix	trans	-60.1	-41.3	179.9	-177	70	0	0	0	112.3	L792 V793 Y799 R800 V809 L812 L813 L816	L792-L796 WeakPolarHBondContact O-CB 2.99Å; L792-L796 PolarHBondContact O-N 3.37Å; V793-L796 WeakPolarHBondContact O-CB 3.22Å; V793-L796 PolarHBondContact O-N 3.2Å; V793-L796 VanDerWaalsContact O-N 3.07Å; L796-Y799 PolarHBondContact O-N 3.36Å; L796-R800 WeakPolarHBondContact O-CG 3.45Å; L796-R800 PolarHBondContact O-N 3Å; L796-V809 HydrophobicContact CD1-CG1 3.97Å; L796-L812 HydrophobicContact CD1-CB 3.87Å; L796-L812 HydrophobicContact CD1-CD1 4.2Å; L796-L813 HydrophobicContact CD1-CG 4.37Å; L796-L813 HydrophobicContact CD2-CD2 3.93Å; L796-L816 HydrophobicContact CD2-CD1 3.74Å
797	E	89.3	Confident	85.8	Confident	107 Å²	107	68.8 Å²	68.8	50%	0.5	38%	0.375	S	S	.	.	H	α-helix	trans	-61.5	-45.1	176.5	-72.9	178.4	176.7	0	0	111.3	V793 V795 Y799 R800 E801	V793-E797 PolarHBondContact O-N 3.46Å; V795-E797 VanDerWaalsContact C-N 3.32Å; V795-E797 PolarHBondContact O-N 2.7Å; E797-Y799 VanDerWaalsContact C-N 3.31Å; E797-Y799 PolarHBondContact O-N 3.26Å; E797-R800 PolarHBondContact O-N 3.28Å; E797-R800 VanDerWaalsContact O-N 3.1Å; E797-E801 WeakPolarHBondContact O-CG 3.4Å; E797-E801 PolarHBondContact O-N 3.21Å
798	L	86.2	Confident	85.6	Confident	86 Å²	86	69.7 Å²	69.7	45%	0.45	38%	0.38	S	S	.	.	H	α-helix	trans	-57.3	-40.9	175	-69.5	171.1	0	0	0	112.8	Y432 A794 V795 A802	Y432-L798 HydrophobicContact CD1-CD1 4.05Å; Y432-L798 HydrophobicContact CE1-CD1 4.44Å; A794-L798 WeakPolarHBondContact O-CG 3.32Å; A794-L798 PolarHBondContact O-N 2.87Å; V795-L798 WeakPolarHBondContact O-CB 3.39Å; V795-L798 PolarHBondContact O-N 2.91Å; L798-A802 WeakPolarHBondContact O-CB 3.28Å; L798-A802 PolarHBondContact O-N 2.97Å
799	Y	86.4	Confident	85.4	Confident	6 Å²	6	69.2 Å²	69.2	2%	0.024	38%	0.376	C	S	.	.	H	α-helix	trans	-71.2	-32.5	177.5	-85.4	-95.1	0	0	0	113	E436 A448 R451 V795 L796 E797 Q803 G804 D808 L812	E436-Y799 WeakPolarHBondContact CG-OH 3.21Å; E436-Y799 PolarHBondContact OE1-OH 3.47Å; A448-Y799 HydrophobicContact CB-CE1 3.79Å; A448-Y799 HydrophobicContact CB-CE2 3.97Å; A448-Y799 VanDerWaalsContact CB-CZ 3.44Å; A448-Y799 WeakPolarHBondContact CB-OH 3.34Å; R451-Y799 PolarHBondContact NH1-OH 3.27Å; R451-Y799 PolarHBondContact NH2-OH 3.32Å; V795-Y799 HydrophobicContact CG1-CD2 3.85Å; V795-Y799 HydrophobicContact CG1-CE2 3.73Å; V795-Y799 WeakPolarHBondContact O-CD2 3.42Å; V795-Y799 PolarHBondContact O-N 3.33Å; V795-Y799 VanDerWaalsContact O-N 3.15Å; L796-Y799 PolarHBondContact O-N 3.36Å; E797-Y799 VanDerWaalsContact C-N 3.31Å; E797-Y799 PolarHBondContact O-N 3.26Å; Y799-Q803 PolarHBondContact O-N 2.61Å; Y799-G804 PolarHBondContact O-N 3.31Å; Y799-D808 HydrophobicContact CD1-CB 4.15Å; Y799-D808 HydrophobicContact CE1-CB 4.1Å; Y799-L812 HydrophobicContact CD2-CD1 4.07Å; Y799-L812 HydrophobicContact CE2-CD1 4.47Å; Y799-L812 HydrophobicContact CG-CD1 4.39Å
800	R	86.1	Confident	85.3	Confident	145 Å²	145	69 Å²	69	55%	0.547	38%	0.381	S	S	.	.	H	α-helix	trans	-69.8	-44.9	175.2	-76.4	179.2	175.3	176.3	-1.2	111.4	L796 E797 Q803	L796-R800 WeakPolarHBondContact O-CG 3.45Å; L796-R800 PolarHBondContact O-N 3Å; E797-R800 PolarHBondContact O-N 3.28Å; E797-R800 VanDerWaalsContact O-N 3.1Å; R800-Q803 PolarHBondContact O-N 3.27Å
801	E	83.6	Confident	85.2	Confident	155 Å²	155	67.4 Å²	67.4	72%	0.724	37%	0.369	S	S	*	.	H	α-helix	trans	-63.9	-41	176.9	-73	-177.8	176.7	0	0	112.1	E797 Q803	E797-E801 WeakPolarHBondContact O-CG 3.4Å; E797-E801 PolarHBondContact O-N 3.21Å; E801-Q803 PolarHBondContact O-N 3.49Å
802	A	76.9	Confident	85.1	Confident	60 Å²	60	64.9 Å²	64.9	50%	0.496	36%	0.357	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.1	4.6	-179.9	0	0	0	0	0	114.3	L798 G804	L798-A802 WeakPolarHBondContact O-CB 3.28Å; L798-A802 PolarHBondContact O-N 2.97Å; A802-G804 PolarHBondContact O-N 2.95Å
803	Q	75.6	Confident	85.1	Confident	182 Å²	182	68.1 Å²	68.1	85%	0.85	37%	0.374	S	S	*	.	T	Hydrogen-bonded Turn	trans	46.8	46.7	-173.4	-64.5	-177	-11.6	0	0	112.5	Y799 R800 E801	Y799-Q803 PolarHBondContact O-N 2.61Å; R800-Q803 PolarHBondContact O-N 3.27Å; E801-Q803 PolarHBondContact O-N 3.49Å
804	G	70.6	Confident	85	Confident	17 Å²	17	70.8 Å²	70.8	18%	0.175	38%	0.383	C	S	.	.			trans	-62.7	168.1	179.3	0	0	0	0	0	113.3	Y799 A802 S806	Y799-G804 PolarHBondContact O-N 3.31Å; A802-G804 PolarHBondContact O-N 2.95Å; G804-S806 PolarHBondContact O-N 3.36Å
805	A	79	Confident	84.9	Confident	54 Å²	54	68.7 Å²	68.7	45%	0.446	37%	0.365	S	S	.	.			trans	-55.2	134.7	179.4	0	0	0	0	0	111.6	S807 D808 V809	A805-S807 PolarHBondContact O-N 3.47Å; A805-S807 VanDerWaalsContact O-N 3.11Å; A805-D808 PolarHBondContact O-N 2.99Å; A805-V809 PolarHBondContact O-N 2.89Å
806	S	82.7	Confident	84.8	Confident	98 Å²	98	69.5 Å²	69.5	69%	0.685	37%	0.369	S	S	*	.	H	α-helix	trans	-55.1	-34.9	-178.2	58.4	0	0	0	0	112.9	G804 D808 V809 T810	G804-S806 PolarHBondContact O-N 3.36Å; S806-D808 VanDerWaalsContact C-N 3.34Å; S806-D808 PolarHBondContact O-N 3.44Å; S806-V809 PolarHBondContact O-N 2.89Å; S806-T810 WeakPolarHBondContact O-CG2 3.37Å; S806-T810 PolarHBondContact O-N 3.34Å; S806-T810 PolarHBondContact O-OG1 3.43Å
807	S	85.3	Confident	84.7	Confident	68 Å²	68	72 Å²	72	48%	0.476	39%	0.387	S	S	.	.	H	α-helix	trans	-65.1	-29.9	177.8	68.7	0	0	0	0	114.7	A805 T810 R811	A805-S807 PolarHBondContact O-N 3.47Å; A805-S807 VanDerWaalsContact O-N 3.11Å; S807-T810 WeakPolarHBondContact CA-OG1 3.19Å; S807-T810 PolarHBondContact O-OG1 2.97Å; S807-R811 PolarHBondContact O-N 3.46Å
808	D	85.9	Confident	84.5	Confident	20 Å²	20	69.8 Å²	69.8	11%	0.107	38%	0.377	C	S	.	.	H	α-helix	trans	-74.4	-42.6	176.5	-80.5	-40	0	0	0	110.2	A448 R451 Y799 A805 S806 R811 L812	A448-D808 HydrophobicContact CB-CB 3.79Å; A448-D808 WeakPolarHBondContact CB-OD1 3.46Å; A448-D808 PolarHBondContact N-OD1 3.13Å; A448-D808 VanDerWaalsContact N-OD1 3.12Å; R451-D808 VanDerWaalsContact NH2-CG 3.26Å; R451-D808 IonicContact NH2-OD1 3.64Å; R451-D808 PolarHBondContact NH2-OD1 2.89Å; R451-D808 IonicContact NH2-OD2 2.68Å; R451-D808 PolarHBondContact NH2-OD2 2.91Å; Y799-D808 HydrophobicContact CD1-CB 4.15Å; Y799-D808 HydrophobicContact CE1-CB 4.1Å; A805-D808 PolarHBondContact O-N 2.99Å; S806-D808 VanDerWaalsContact C-N 3.34Å; S806-D808 PolarHBondContact O-N 3.44Å; D808-R811 PolarHBondContact O-N 3.48Å; D808-L812 WeakPolarHBondContact O-CG 3.37Å; D808-L812 PolarHBondContact O-N 3.16Å; D808-L812 VanDerWaalsContact O-N 3.1Å
809	V	88.1	Confident	84.5	Confident	25 Å²	25	65.8 Å²	65.8	15%	0.152	36%	0.356	C	S	.	.	H	α-helix	trans	-62.8	-44.4	177.1	-178.3	0	0	0	0	110.8	L796 A805 S806 R811 L812 L813	L796-V809 HydrophobicContact CD1-CG1 3.97Å; A805-V809 PolarHBondContact O-N 2.89Å; S806-V809 PolarHBondContact O-N 2.89Å; V809-R811 PolarHBondContact O-N 2.98Å; V809-L812 PolarHBondContact O-N 3.2Å; V809-L813 HydrophobicContact CG1-CD1 4.09Å; V809-L813 WeakPolarHBondContact O-CG 3.36Å; V809-L813 PolarHBondContact O-N 3.17Å
810	T	88.4	Confident	84.5	Confident	85 Å²	85	72 Å²	72	52%	0.521	39%	0.385	S	S	.	.	H	α-helix	trans	-64.5	-38.8	178.5	53.4	0	0	0	0	112.5	S806 S807 L813 E814	S806-T810 WeakPolarHBondContact O-CG2 3.37Å; S806-T810 PolarHBondContact O-N 3.34Å; S806-T810 PolarHBondContact O-OG1 3.43Å; S807-T810 WeakPolarHBondContact CA-OG1 3.19Å; S807-T810 PolarHBondContact O-OG1 2.97Å; T810-L813 PolarHBondContact O-N 3.15Å; T810-E814 WeakPolarHBondContact O-CB 3.45Å; T810-E814 PolarHBondContact O-N 2.9Å
811	R	87.3	Confident	84.4	Confident	132 Å²	132	74 Å²	74	50%	0.498	39%	0.393	S	S	.	.	H	α-helix	trans	-65.1	-38.9	175.4	-100.2	174.7	167.1	163.8	-4.9	113.6	S807 D808 V809 E814 T815	S807-R811 PolarHBondContact O-N 3.46Å; D808-R811 PolarHBondContact O-N 3.48Å; V809-R811 PolarHBondContact O-N 2.98Å; R811-E814 PolarHBondContact O-N 3.48Å; R811-T815 PolarHBondContact O-N 3.44Å; R811-T815 PolarHBondContact O-OG1 2.85Å
812	L	88.1	Confident	84.3	Confident	1 Å²	1	71.6 Å²	71.6	1%	0.005	38%	0.378	C	S	.	.	H	α-helix	trans	-67.3	-41.9	175.3	-67.4	172.3	0	0	0	110.6	A448 R449 L792 V795 L796 Y799 D808 V809 E814 T815 L816	A448-L812 HydrophobicContact CB-CD1 4.17Å; A448-L812 HydrophobicContact CB-CD2 4.47Å; A448-L812 HydrophobicContact CB-CG 4.35Å; R449-L812 HydrophobicContact CB-CD2 4.27Å; L792-L812 HydrophobicContact CD1-CD2 3.66Å; V795-L812 HydrophobicContact CG1-CD1 4.23Å; L796-L812 HydrophobicContact CD1-CB 3.87Å; L796-L812 HydrophobicContact CD1-CD1 4.2Å; Y799-L812 HydrophobicContact CD2-CD1 4.07Å; Y799-L812 HydrophobicContact CE2-CD1 4.47Å; Y799-L812 HydrophobicContact CG-CD1 4.39Å; D808-L812 WeakPolarHBondContact O-CG 3.37Å; D808-L812 PolarHBondContact O-N 3.16Å; D808-L812 VanDerWaalsContact O-N 3.1Å; V809-L812 PolarHBondContact O-N 3.2Å; L812-E814 PolarHBondContact O-N 3.08Å; L812-T815 WeakPolarHBondContact O-CB 3.47Å; L812-T815 PolarHBondContact O-N 3.25Å; L812-L816 PolarHBondContact O-N 3.43Å
813	L	89.8	Confident	84.6	Confident	72 Å²	72	77.5 Å²	77.5	38%	0.377	40%	0.395	S	S	.	.	H	α-helix	trans	-62.1	-39.7	173.3	-73.7	169.7	0	0	0	112.7	L796 V809 T810 T815 L816 S817	L796-L813 HydrophobicContact CD1-CG 4.37Å; L796-L813 HydrophobicContact CD2-CD2 3.93Å; V809-L813 HydrophobicContact CG1-CD1 4.09Å; V809-L813 WeakPolarHBondContact O-CG 3.36Å; V809-L813 PolarHBondContact O-N 3.17Å; T810-L813 PolarHBondContact O-N 3.15Å; L813-T815 VanDerWaalsContact C-N 3.28Å; L813-T815 PolarHBondContact O-N 3.24Å; L813-L816 HydrophobicContact CD2-CD1 4.45Å; L813-L816 PolarHBondContact O-N 3.42Å; L813-S817 PolarHBondContact O-N 2.92Å
814	E	88	Confident	84.9	Confident	109 Å²	109	72 Å²	72	51%	0.509	37%	0.369	S	S	.	.	H	α-helix	trans	-62.6	-37.9	174.3	-167.9	-170.3	168.8	0	0	111.4	T810 R811 L812 S817 Q818	T810-E814 WeakPolarHBondContact O-CB 3.45Å; T810-E814 PolarHBondContact O-N 2.9Å; R811-E814 PolarHBondContact O-N 3.48Å; L812-E814 PolarHBondContact O-N 3.08Å; E814-S817 PolarHBondContact O-N 3.27Å; E814-S817 PolarHBondContact O-OG 2.78Å; E814-Q818 WeakPolarHBondContact O-CB 3.33Å; E814-Q818 VanDerWaalsContact O-CG 3.24Å; E814-Q818 WeakPolarHBondContact O-CG 3.34Å; E814-Q818 PolarHBondContact O-N 2.94Å
815	T	86.6	Confident	85.5	Confident	6 Å²	6	81.8 Å²	81.8	4%	0.037	40%	0.401	C	S	.	.	H	α-helix	trans	-68.9	-39.7	176.4	-52.9	0	0	0	0	111	L792 R811 L812 L813 Q818 M819 F829	L792-T815 HydrophobicContact CD2-CG2 3.86Å; R811-T815 PolarHBondContact O-N 3.44Å; R811-T815 PolarHBondContact O-OG1 2.85Å; L812-T815 WeakPolarHBondContact O-CB 3.47Å; L812-T815 PolarHBondContact O-N 3.25Å; L813-T815 VanDerWaalsContact C-N 3.28Å; L813-T815 PolarHBondContact O-N 3.24Å; T815-Q818 WeakPolarHBondContact O-CB 3.48Å; T815-Q818 PolarHBondContact O-N 3.16Å; T815-M819 HydrophobicContact CG2-CE 4.17Å; T815-M819 WeakPolarHBondContact O-CG 3.42Å; T815-M819 PolarHBondContact O-N 3.36Å; T815-F829 HydrophobicContact CG2-CZ 4.27Å
816	L	88.2	Confident	86	Confident	22 Å²	22	81.6 Å²	81.6	12%	0.115	40%	0.397	C	S	.	.	H	α-helix	trans	-63.7	-43.3	174.1	-76.2	167.7	0	0	0	112.2	K789 L792 V793 L796 L812 L813 Q818 M819 E820	K789-L816 HydrophobicContact CG-CD2 3.98Å; L792-L816 HydrophobicContact CB-CD2 4.31Å; L792-L816 HydrophobicContact CD2-CD2 3.65Å; L792-L816 HydrophobicContact CD2-CG 3.64Å; L792-L816 HydrophobicContact CG-CD2 4.12Å; L792-L816 HydrophobicContact CG-CG 4.16Å; V793-L816 HydrophobicContact CG2-CD2 4.22Å; L796-L816 HydrophobicContact CD2-CD1 3.74Å; L812-L816 PolarHBondContact O-N 3.43Å; L813-L816 HydrophobicContact CD2-CD1 4.45Å; L813-L816 PolarHBondContact O-N 3.42Å; L816-Q818 VanDerWaalsContact C-N 3.29Å; L816-Q818 PolarHBondContact O-N 3.39Å; L816-M819 PolarHBondContact O-N 3.02Å; L816-E820 WeakPolarHBondContact O-CB 3.39Å; L816-E820 PolarHBondContact O-N 3.21Å
817	S	87.2	Confident	86.2	Confident	63 Å²	63	77.7 Å²	77.7	44%	0.441	37%	0.367	S	S	.	.	H	α-helix	trans	-66.3	-33.7	177.7	73.4	0	0	0	0	111.7	L813 E814 E820 R821	L813-S817 PolarHBondContact O-N 2.92Å; E814-S817 PolarHBondContact O-N 3.27Å; E814-S817 PolarHBondContact O-OG 2.78Å; S817-E820 PolarHBondContact O-N 3.19Å; S817-R821 VanDerWaalsContact O-CB 3.23Å; S817-R821 WeakPolarHBondContact O-CB 3.33Å; S817-R821 PolarHBondContact O-N 3.46Å
818	Q	85	Confident	86.5	Confident	60 Å²	60	76.8 Å²	76.8	28%	0.28	36%	0.359	S	S	.	.	H	α-helix	trans	-63.3	-48.4	170.1	-73.8	173.5	13.8	0	0	111.4	E814 T815 L816 E820 R821 Y822 M827	E814-Q818 WeakPolarHBondContact O-CB 3.33Å; E814-Q818 VanDerWaalsContact O-CG 3.24Å; E814-Q818 WeakPolarHBondContact O-CG 3.34Å; E814-Q818 PolarHBondContact O-N 2.94Å; T815-Q818 WeakPolarHBondContact O-CB 3.48Å; T815-Q818 PolarHBondContact O-N 3.16Å; L816-Q818 VanDerWaalsContact C-N 3.29Å; L816-Q818 PolarHBondContact O-N 3.39Å; Q818-E820 VanDerWaalsContact C-N 3.29Å; Q818-E820 PolarHBondContact O-N 3.27Å; Q818-R821 PolarHBondContact O-N 3.1Å; Q818-Y822 WeakPolarHBondContact O-CD2 3.47Å; Q818-Y822 PolarHBondContact O-N 3.01Å; Q818-Y822 VanDerWaalsContact O-N 3.09Å; Q818-M827 HydrophobicContact CB-CE 4.35Å
819	M	85.1	Confident	86.7	Confident	1 Å²	1	75.9 Å²	75.9	1%	0.005	35%	0.354	C	S	.	.	H	α-helix	trans	-58.1	-41.8	176.9	-71.4	174.9	175.1	0	0	112	I787 K789 L792 T815 L816 Y822 Q823 Q824 M827	I787-M819 HydrophobicContact CG2-CE 4.39Å; K789-M819 HydrophobicContact CB-SD 4.44Å; L792-M819 HydrophobicContact CD2-CE 3.91Å; L792-M819 HydrophobicContact CD2-SD 3.88Å; T815-M819 HydrophobicContact CG2-CE 4.17Å; T815-M819 WeakPolarHBondContact O-CG 3.42Å; T815-M819 PolarHBondContact O-N 3.36Å; L816-M819 PolarHBondContact O-N 3.02Å; M819-Y822 PolarHBondContact O-N 3.04Å; M819-Q823 PolarHBondContact O-N 3.02Å; M819-Q823 VanDerWaalsContact O-N 3.12Å; M819-Q824 PolarHBondContact O-N 2.93Å; M819-M827 HydrophobicContact CE-CB 3.64Å; M819-M827 HydrophobicContact CG-CB 4.44Å
820	E	87.3	Confident	86.8	Confident	136 Å²	136	77 Å²	77	64%	0.636	36%	0.359	S	S	*	.	H	α-helix	trans	-67.4	-43.9	177.4	-172.8	166.5	-150.2	0	0	112.4	L816 S817 Q818 Y822 Q823	L816-E820 WeakPolarHBondContact O-CB 3.39Å; L816-E820 PolarHBondContact O-N 3.21Å; S817-E820 PolarHBondContact O-N 3.19Å; Q818-E820 VanDerWaalsContact C-N 3.29Å; Q818-E820 PolarHBondContact O-N 3.27Å; E820-Y822 PolarHBondContact O-N 2.72Å; E820-Q823 PolarHBondContact O-N 3.24Å
821	R	84	Confident	86.9	Confident	189 Å²	189	72.9 Å²	72.9	71%	0.713	33%	0.334	S	S	*	.	H	α-helix	trans	-59	-35.2	176.8	-174.8	177.4	-175.6	-179.7	1.5	112.7	S817 Q818	S817-R821 VanDerWaalsContact O-CB 3.23Å; S817-R821 WeakPolarHBondContact O-CB 3.33Å; S817-R821 PolarHBondContact O-N 3.46Å; Q818-R821 PolarHBondContact O-N 3.1Å
822	Y	80.5	Confident	87	Confident	103 Å²	103	71 Å²	71	40%	0.404	33%	0.327	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.4	1.1	178.6	-66.9	-67	0	0	0	113.8	Q818 M819 E820 Q824	Q818-Y822 WeakPolarHBondContact O-CD2 3.47Å; Q818-Y822 PolarHBondContact O-N 3.01Å; Q818-Y822 VanDerWaalsContact O-N 3.09Å; M819-Y822 PolarHBondContact O-N 3.04Å; E820-Y822 PolarHBondContact O-N 2.72Å; Y822-Q824 PolarHBondContact O-N 3.47Å
823	Q	83	Confident	87	Confident	185 Å²	185	71.9 Å²	71.9	86%	0.864	33%	0.33	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.7	34.8	-174.7	-63.4	-179.9	-27.9	0	0	113.2	M819 E820	M819-Q823 PolarHBondContact O-N 3.02Å; M819-Q823 VanDerWaalsContact O-N 3.12Å; E820-Q823 PolarHBondContact O-N 3.24Å
824	Q	82.7	Confident	86.6	Confident	66 Å²	66	72.6 Å²	72.6	31%	0.308	34%	0.341	S	S	.	.			trans	-101.9	133.5	-178.9	-72.5	176.9	-17.4	0	0	110.7	N487 M819 Y822	N487-Q824 PolarHBondContact ND2-NE2 3.44Å; M819-Q824 PolarHBondContact O-N 2.93Å; Y822-Q824 PolarHBondContact O-N 3.47Å
825	R	84.3	Confident	86.3	Confident	222 Å²	222	69.6 Å²	69.6	84%	0.838	33%	0.325	S	S	*	.	S	Bend	trans	-83.4	-24.1	176.6	-69.9	-171.4	-179.9	-171.2	0.5	113.5	K789	K789-R825 PolarHBondContact N-O 3.38Å
826	S	88.1	Confident	86.2	Confident	51 Å²	51	72.1 Å²	72.1	36%	0.357	34%	0.341	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134	151.5	174.6	59.8	0	0	0	0	110.3	I787	I787-S826 VanDerWaalsContact O-CA 3.29Å; I787-S826 WeakPolarHBondContact O-CA 3.44Å
827	M	88.1	Confident	85.8	Confident	15 Å²	15	77.5 Å²	77.5	7%	0.074	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	132.8	174	-177.1	177.2	-87.7	0	0	109.4	A484 E786 I787 Q818 M819 F829	A484-M827 HydrophobicContact CB-SD 4.12Å; E786-M827 WeakPolarHBondContact CA-O 3.35Å; I787-M827 PolarHBondContact N-O 3.45Å; I787-M827 PolarHBondContact O-N 2.91Å; Q818-M827 HydrophobicContact CB-CE 4.35Å; M819-M827 HydrophobicContact CE-CB 3.64Å; M819-M827 HydrophobicContact CG-CB 4.44Å; M827-F829 HydrophobicContact CB-CE2 4.02Å; M827-F829 HydrophobicContact CG-CD2 4.45Å; M827-F829 HydrophobicContact CG-CE2 3.83Å; M827-F829 HydrophobicContact CG-CZ 4.08Å; M827-F829 HydrophobicContact SD-CE1 4.36Å; M827-F829 HydrophobicContact SD-CE2 3.98Å; M827-F829 HydrophobicContact SD-CZ 3.61Å
828	V	90.1	Very high	85.6	Confident	49 Å²	49	76.5 Å²	76.5	30%	0.297	36%	0.356	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.7	131.3	178.8	-176.1	0	0	0	0	110.1	K485 E786	K485-V828 HydrophobicContact CB-CB 4.42Å; K485-V828 WeakPolarHBondContact CB-O 3.31Å; K485-V828 HydrophobicContact CD-CB 4.49Å; K485-V828 HydrophobicContact CD-CG1 4.22Å; K485-V828 PolarHBondContact N-O 3.33Å; E786-V828 HydrophobicContact CB-CG2 4.32Å
829	F	90.9	Very high	85.6	Confident	1 Å²	1	74.1 Å²	74.1	0%	0.004	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	140.5	174.1	-69	-93.5	0	0	0	110.3	L453 W482 K483 A484 E784 K785 I787 T815 M827	L453-F829 HydrophobicContact CD1-CB 3.85Å; L453-F829 HydrophobicContact CD1-CD1 3.85Å; L453-F829 HydrophobicContact CD1-CD2 4.28Å; L453-F829 HydrophobicContact CD1-CG 3.72Å; L453-F829 HydrophobicContact CD2-CB 3.87Å; L453-F829 HydrophobicContact CD2-CD2 4.06Å; L453-F829 HydrophobicContact CD2-CG 4.07Å; W482-F829 HydrophobicContact CE3-CB 4.07Å; K483-F829 CarbonylContact O-C 3.59Å; K483-F829 WeakPolarHBondContact O-CA 3.38Å; A484-F829 HydrophobicContact CB-CD1 3.94Å; A484-F829 HydrophobicContact CB-CE1 3.6Å; A484-F829 HydrophobicContact CB-CZ 4.31Å; E784-F829 WeakPolarHBondContact CA-O 3.33Å; K785-F829 PolarHBondContact N-O 3.17Å; K785-F829 PolarHBondContact O-N 3.39Å; I787-F829 HydrophobicContact CB-CE2 4.38Å; I787-F829 HydrophobicContact CD1-CD2 4.14Å; I787-F829 HydrophobicContact CD1-CE2 4.08Å; I787-F829 HydrophobicContact CG1-CD2 4.35Å; I787-F829 HydrophobicContact CG1-CE2 4.46Å; T815-F829 HydrophobicContact CG2-CZ 4.27Å; M827-F829 HydrophobicContact CB-CE2 4.02Å; M827-F829 HydrophobicContact CG-CD2 4.45Å; M827-F829 HydrophobicContact CG-CE2 3.83Å; M827-F829 HydrophobicContact CG-CZ 4.08Å; M827-F829 HydrophobicContact SD-CE1 4.36Å; M827-F829 HydrophobicContact SD-CE2 3.98Å; M827-F829 HydrophobicContact SD-CZ 3.61Å
830	L	90.5	Very high	85.5	Confident	48 Å²	48	74.7 Å²	74.7	25%	0.251	35%	0.348	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	113.3	175.3	-176.7	69.3	0	0	0	108.9	K483 T782 E784	K483-L830 PolarHBondContact N-O 3.17Å; K483-L830 PolarHBondContact O-N 3.5Å; T782-L830 HydrophobicContact CG2-CD1 4.4Å; E784-L830 HydrophobicContact CG-CD1 3.5Å; E784-L830 VanDerWaalsContact CG-CD1 3.5Å
831	G	90.6	Very high	85.4	Confident	0 Å²	0	68.9 Å²	68.9	0%	0	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.5	129.1	168.3	0	0	0	0	0	109.9	K481 W482 T782 L783	K481-G831 WeakPolarHBondContact O-CA 3.43Å; W482-G831 VanDerWaalsContact CE3-CA 3.49Å; W482-G831 VanDerWaalsContact CE3-N 3.32Å; T782-G831 CarbonylContact C-O 3.59Å; T782-G831 WeakPolarHBondContact CA-O 3.21Å; L783-G831 PolarHBondContact N-O 3.4Å; L783-G831 PolarHBondContact O-N 2.77Å
832	R	88.6	Confident	85.6	Confident	91 Å²	91	61.6 Å²	61.6	34%	0.343	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	136.5	176.7	-171.1	177.7	-179.8	144.1	-0.4	111.6	K481 D778 T782	K481-R832 PolarHBondContact N-O 3.47Å; K481-R832 PolarHBondContact O-N 2.92Å; D778-R832 VanDerWaalsContact CG-CZ 3.47Å; D778-R832 IonicContact OD1-CZ 3.85Å; D778-R832 IonicContact OD1-NH1 3.86Å; D778-R832 PolarHBondContact OD1-NH1 3.4Å; D778-R832 IonicContact OD1-NH2 3.6Å; D778-R832 PolarHBondContact OD1-NH2 3.06Å; D778-R832 IonicContact OD2-CZ 2.68Å; D778-R832 IonicContact OD2-NH1 3.2Å; D778-R832 PolarHBondContact OD2-NH1 3.05Å; D778-R832 IonicContact OD2-NH2 2.77Å; T782-R832 HydrophobicContact CG2-CG 4.3Å
833	R	87.6	Confident	85.8	Confident	20 Å²	20	59.4 Å²	59.4	8%	0.075	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132	149.9	165.8	68	-175.6	-174.6	86.3	-11.4	111	E476 L480 G780 I781 D839	E476-R833 WeakPolarHBondContact O-CD 3.3Å; E476-R833 PolarHBondContact O-NE 3.48Å; E476-R833 IonicContact OE2-NH2 2.79Å; E476-R833 PolarHBondContact OE2-NH2 3.19Å; L480-R833 HydrophobicContact CD2-CB 3.91Å; L480-R833 HydrophobicContact CD2-CG 3.67Å; G780-R833 CarbonylContact C-O 3.57Å; G780-R833 VanDerWaalsContact CA-O 3.22Å; G780-R833 WeakPolarHBondContact CA-O 3.5Å; I781-R833 HydrophobicContact CB-CG 4.25Å; I781-R833 PolarHBondContact N-O 3.46Å; I781-R833 PolarHBondContact O-N 3.44Å; I781-R833 VanDerWaalsContact O-N 3.15Å; R833-D839 IonicContact CZ-OD1 3.95Å; R833-D839 IonicContact CZ-OD2 2.74Å; R833-D839 VanDerWaalsContact NH1-CG 3.28Å; R833-D839 IonicContact NH1-OD1 2.67Å; R833-D839 PolarHBondContact NH1-OD1 3.03Å; R833-D839 VanDerWaalsContact NH1-OD1 3.11Å; R833-D839 IonicContact NH1-OD2 3.99Å; R833-D839 PolarHBondContact NH1-OD2 3.36Å; R833-D839 IonicContact NH2-OD1 3.65Å; R833-D839 PolarHBondContact NH2-OD1 3Å; R833-D839 IonicContact NH2-OD2 2.82Å
834	S	82.4	Confident	85.9	Confident	88 Å²	88	52.6 Å²	52.6	62%	0.615	26%	0.259	S	S	*	.			trans	-69.5	148.3	167.1	53.3	0	0	0	0	109.5
835	R	81.6	Confident	86.2	Confident	46 Å²	46	50.8 Å²	50.8	17%	0.174	25%	0.249	C	C	.	.			trans	-63.5	145.7	170.3	-67	179.3	179.8	86.9	3.6	109.5	E634 E776 I781 D839	E634-R835 WeakPolarHBondContact OE1-CB 3.33Å; E776-R835 IonicContact OE1-CZ 2.67Å; E776-R835 VanDerWaalsContact OE1-CZ 3.27Å; E776-R835 IonicContact OE1-NE 3.46Å; E776-R835 IonicContact OE1-NH1 3.3Å; E776-R835 IonicContact OE1-NH2 2.94Å; E776-R835 PolarHBondContact OE1-NH2 3.01Å; I781-R835 HydrophobicContact CG1-CG 4.31Å; R835-D839 WeakPolarHBondContact CA-OD2 3.49Å
836	T	83.4	Confident	86.4	Confident	59 Å²	59	46.8 Å²	46.8	36%	0.362	24%	0.24	S	C	.	.			trans	-119.3	162.8	179.2	63.8	0	0	0	0	109.2	S838 D839 L840	T836-S838 PolarHBondContact O-N 3.32Å; T836-S838 PolarHBondContact OG1-OG 3.32Å; T836-D839 PolarHBondContact N-OD2 3.16Å; T836-D839 WeakPolarHBondContact O-CB 3.29Å; T836-D839 PolarHBondContact O-N 2.94Å; T836-D839 VanDerWaalsContact OG1-CG 3.26Å; T836-D839 PolarHBondContact OG1-OD2 2.94Å; T836-L840 PolarHBondContact O-N 3.41Å
837	K	80.7	Confident	86.5	Confident	135 Å²	135	53.6 Å²	53.6	59%	0.587	27%	0.267	S	S	*	.	H	α-helix	trans	-54.5	-35.5	176.3	66.1	-179.9	-176.6	178.3	0	113.2	D839 L840 S841	K837-D839 VanDerWaalsContact C-N 3.32Å; K837-D839 PolarHBondContact O-N 3.34Å; K837-L840 PolarHBondContact O-N 2.85Å; K837-S841 PolarHBondContact O-N 3.43Å; K837-S841 PolarHBondContact O-OG 2.66Å
838	S	83.8	Confident	86.8	Confident	42 Å²	42	56 Å²	56	29%	0.294	28%	0.278	S	S	.	.	H	α-helix	trans	-67.2	-34.4	179.1	40.8	0	0	0	0	111.7	T836 L840 S841 L842	T836-S838 PolarHBondContact O-N 3.32Å; T836-S838 PolarHBondContact OG1-OG 3.32Å; S838-L840 VanDerWaalsContact C-N 3.27Å; S838-L840 PolarHBondContact O-N 3.47Å; S838-S841 PolarHBondContact O-N 2.86Å; S838-L842 VanDerWaalsContact O-CB 3.32Å; S838-L842 WeakPolarHBondContact O-CB 3.36Å; S838-L842 WeakPolarHBondContact O-CG 3.37Å; S838-L842 PolarHBondContact O-N 3.17Å
839	D	84.9	Confident	87	Confident	9 Å²	9	54.5 Å²	54.5	5%	0.048	27%	0.268	C	S	.	.	H	α-helix	trans	-64.3	-36.8	176.6	-53.9	-47.8	0	0	0	111.2	R833 R835 T836 K837 K843	R833-D839 IonicContact CZ-OD1 3.95Å; R833-D839 IonicContact CZ-OD2 2.74Å; R833-D839 VanDerWaalsContact NH1-CG 3.28Å; R833-D839 IonicContact NH1-OD1 2.67Å; R833-D839 PolarHBondContact NH1-OD1 3.03Å; R833-D839 VanDerWaalsContact NH1-OD1 3.11Å; R833-D839 IonicContact NH1-OD2 3.99Å; R833-D839 PolarHBondContact NH1-OD2 3.36Å; R833-D839 IonicContact NH2-OD1 3.65Å; R833-D839 PolarHBondContact NH2-OD1 3Å; R833-D839 IonicContact NH2-OD2 2.82Å; R835-D839 WeakPolarHBondContact CA-OD2 3.49Å; T836-D839 PolarHBondContact N-OD2 3.16Å; T836-D839 WeakPolarHBondContact O-CB 3.29Å; T836-D839 PolarHBondContact O-N 2.94Å; T836-D839 VanDerWaalsContact OG1-CG 3.26Å; T836-D839 PolarHBondContact OG1-OD2 2.94Å; K837-D839 VanDerWaalsContact C-N 3.32Å; K837-D839 PolarHBondContact O-N 3.34Å; D839-K843 WeakPolarHBondContact O-CG 3.24Å; D839-K843 PolarHBondContact O-N 3.13Å
840	L	82	Confident	87.1	Confident	14 Å²	14	59.9 Å²	59.9	7%	0.073	29%	0.293	C	S	.	.	H	α-helix	trans	-68.4	-46.3	176.2	-163.4	74.6	0	0	0	110.9	L635 F764 R765 T836 K837 S838 K843 M844	L635-L840 HydrophobicContact CD2-CD2 4.4Å; F764-L840 HydrophobicContact CD1-CD1 3.59Å; F764-L840 HydrophobicContact CD1-CD2 4.37Å; F764-L840 HydrophobicContact CD1-CG 3.79Å; F764-L840 HydrophobicContact CE1-CD1 3.62Å; F764-L840 HydrophobicContact CE1-CG 3.87Å; R765-L840 HydrophobicContact CB-CD1 4.34Å; T836-L840 PolarHBondContact O-N 3.41Å; K837-L840 PolarHBondContact O-N 2.85Å; S838-L840 VanDerWaalsContact C-N 3.27Å; S838-L840 PolarHBondContact O-N 3.47Å; L840-K843 PolarHBondContact O-N 3.43Å; L840-M844 WeakPolarHBondContact O-CB 3.32Å; L840-M844 PolarHBondContact O-N 3.38Å
841	S	85.6	Confident	87.3	Confident	13 Å²	13	63.3 Å²	63.3	9%	0.091	31%	0.308	C	S	.	.	H	α-helix	trans	-65.7	-38.4	177.9	-59.5	0	0	0	0	112.7	F403 K837 S838 K843 M844 Y845	F403-S841 VanDerWaalsContact CZ-CB 3.44Å; K837-S841 PolarHBondContact O-N 3.43Å; K837-S841 PolarHBondContact O-OG 2.66Å; S838-S841 PolarHBondContact O-N 2.86Å; S841-K843 VanDerWaalsContact C-N 3.27Å; S841-K843 PolarHBondContact O-N 2.95Å; S841-M844 PolarHBondContact O-N 3.15Å; S841-Y845 WeakPolarHBondContact O-CD2 3.38Å; S841-Y845 PolarHBondContact O-N 2.68Å
842	L	87.8	Confident	87.5	Confident	36 Å²	36	63.9 Å²	63.9	19%	0.188	31%	0.31	C	S	.	.	H	α-helix	trans	-59.6	-40.2	174.4	-76.9	172	0	0	0	111.2	F403 L407 E476 S838 Q846 I849	F403-L842 HydrophobicContact CE1-CD2 4.4Å; F403-L842 HydrophobicContact CZ-CD2 3.9Å; F403-L842 HydrophobicContact CZ-CG 3.97Å; L407-L842 HydrophobicContact CD1-CD2 3.92Å; L407-L842 HydrophobicContact CD2-CD2 4.05Å; E476-L842 WeakPolarHBondContact OE1-CD1 3.38Å; S838-L842 VanDerWaalsContact O-CB 3.32Å; S838-L842 WeakPolarHBondContact O-CB 3.36Å; S838-L842 WeakPolarHBondContact O-CG 3.37Å; S838-L842 PolarHBondContact O-N 3.17Å; L842-Q846 WeakPolarHBondContact O-CA 3.41Å; L842-Q846 PolarHBondContact O-N 2.91Å; L842-I849 HydrophobicContact CB-CD1 4.41Å; L842-I849 HydrophobicContact CD2-CD1 3.68Å; L842-I849 VanDerWaalsContact O-CD1 3.3Å; L842-I849 WeakPolarHBondContact O-CD1 3.16Å
843	K	86.1	Confident	87.8	Confident	57 Å²	57	61.7 Å²	61.7	25%	0.248	30%	0.302	C	S	.	.	H	α-helix	trans	-72.7	-35.6	176	-71.5	176.4	-178.9	-178	0	112.9	F764 Y768 D839 L840 S841	F764-K843 HydrophobicContact CE1-CB 4.31Å; F764-K843 HydrophobicContact CZ-CB 4.02Å; Y768-K843 HydrophobicContact CE1-CD 4.24Å; Y768-K843 HydrophobicContact CE2-CD 3.89Å; Y768-K843 VanDerWaalsContact CZ-NZ 3.29Å; Y768-K843 VanDerWaalsContact OH-CE 3.31Å; Y768-K843 WeakPolarHBondContact OH-CE 3.09Å; Y768-K843 PolarHBondContact OH-NZ 2.92Å; D839-K843 WeakPolarHBondContact O-CG 3.24Å; D839-K843 PolarHBondContact O-N 3.13Å; L840-K843 PolarHBondContact O-N 3.43Å; S841-K843 VanDerWaalsContact C-N 3.27Å; S841-K843 PolarHBondContact O-N 2.95Å
844	M	84.6	Confident	88.1	Confident	43 Å²	43	65.6 Å²	65.6	21%	0.212	32%	0.321	C	S	.	.	H	α-helix	trans	-65.5	-40.7	179.5	-173	-175	-59.5	0	0	111.8	F764 L840 S841	F764-M844 HydrophobicContact CD1-CE 4.21Å; F764-M844 HydrophobicContact CD2-CG 4.38Å; F764-M844 HydrophobicContact CE1-CB 4.2Å; F764-M844 HydrophobicContact CE2-CB 4.06Å; F764-M844 HydrophobicContact CE2-CG 4.23Å; F764-M844 HydrophobicContact CG-CE 4.26Å; F764-M844 VanDerWaalsContact CZ-CA 3.49Å; F764-M844 HydrophobicContact CZ-CB 3.86Å; L840-M844 WeakPolarHBondContact O-CB 3.32Å; L840-M844 PolarHBondContact O-N 3.38Å; S841-M844 PolarHBondContact O-N 3.15Å
845	Y	88.6	Confident	88.7	Confident	27 Å²	27	64.6 Å²	64.6	11%	0.106	31%	0.306	C	S	.	.	T	Hydrogen-bonded Turn	trans	-104.2	20.6	-177.5	-55.9	-64.1	0	0	0	113.4	K400 F403 S841 E847 E848 I849 W852	K400-Y845 HydrophobicContact CB-CE1 4.1Å; K400-Y845 HydrophobicContact CD-CD1 4.28Å; K400-Y845 HydrophobicContact CD-CE1 3.89Å; K400-Y845 HydrophobicContact CG-CD1 4.14Å; K400-Y845 HydrophobicContact CG-CE1 3.74Å; F403-Y845 AromaticContact CD1-CD2 3.68Å; F403-Y845 HydrophobicContact CD1-CD2 3.68Å; F403-Y845 HydrophobicContact CD1-CE2 4.16Å; F403-Y845 AromaticContact CE1-CD2 4Å; F403-Y845 HydrophobicContact CE1-CD2 4Å; S841-Y845 WeakPolarHBondContact O-CD2 3.38Å; S841-Y845 PolarHBondContact O-N 2.68Å; Y845-E847 PolarHBondContact O-N 3.36Å; Y845-E847 VanDerWaalsContact O-N 3.12Å; Y845-E848 PolarHBondContact O-N 2.95Å; Y845-I849 VanDerWaalsContact O-CG1 3.32Å; Y845-I849 WeakPolarHBondContact O-CG1 3.03Å; Y845-I849 PolarHBondContact O-N 3.19Å; Y845-W852 HydrophobicContact CD1-CH2 4.41Å; Y845-W852 HydrophobicContact CD2-CH2 4.28Å; Y845-W852 AromaticContact CG-CH2 3.86Å; Y845-W852 HydrophobicContact CG-CH2 3.86Å
846	Q	88.7	Confident	89.3	Confident	138 Å²	138	63.4 Å²	63.4	65%	0.645	30%	0.303	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55	-36.6	-170.1	-175	175.4	-23.2	0	0	113.6	L842 E848	L842-Q846 WeakPolarHBondContact O-CA 3.41Å; L842-Q846 PolarHBondContact O-N 2.91Å; Q846-E848 VanDerWaalsContact C-N 3.31Å; Q846-E848 PolarHBondContact O-N 3.36Å
847	E	90.6	Very high	89.7	Confident	195 Å²	195	62.5 Å²	62.5	91%	0.911	30%	0.302	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70	-25.6	-177.1	-61.6	-177.4	175.2	0	0	113.1	Y845	Y845-E847 PolarHBondContact O-N 3.36Å; Y845-E847 VanDerWaalsContact O-N 3.12Å
848	E	93.6	Very high	90.4	Very high	65 Å²	65	63.2 Å²	63.2	30%	0.304	30%	0.301	S	S	.	.	T	Hydrogen-bonded Turn	trans	-102.9	-17.5	-174.8	-61.2	-178.1	-153.8	0	0	114	K400 Y845 Q846 Q850 E851 W852	K400-E848 WeakPolarHBondContact CE-OE2 3.49Å; K400-E848 IonicContact NZ-OE1 2.7Å; K400-E848 PolarHBondContact NZ-OE1 3.26Å; K400-E848 IonicContact NZ-OE2 3.32Å; K400-E848 PolarHBondContact NZ-OE2 2.67Å; Y845-E848 PolarHBondContact O-N 2.95Å; Q846-E848 VanDerWaalsContact C-N 3.31Å; Q846-E848 PolarHBondContact O-N 3.36Å; E848-Q850 PolarHBondContact O-N 3.22Å; E848-E851 WeakPolarHBondContact O-CB 3.45Å; E848-E851 PolarHBondContact O-N 3.42Å; E848-E851 VanDerWaalsContact O-N 3.15Å; E848-W852 HydrophobicContact CB-CZ2 3.92Å; E848-W852 VanDerWaalsContact O-CD1 3.32Å; E848-W852 PolarHBondContact O-N 3.25Å; E848-W852 VanDerWaalsContact O-N 3.13Å; E848-W852 WeakPolarHBondContact OE2-CZ2 3.18Å
849	I	93.9	Very high	90.7	Very high	18 Å²	18	65.6 Å²	65.6	9%	0.092	31%	0.307	C	S	.	.	H	α-helix	trans	-59.2	-37.2	-173.5	-76.8	164.8	0	0	0	112.3	L407 L842 Y845 W852 Y853	L407-I849 HydrophobicContact CD2-CG1 4.27Å; L407-I849 HydrophobicContact CD2-CG2 4.1Å; L842-I849 HydrophobicContact CB-CD1 4.41Å; L842-I849 HydrophobicContact CD2-CD1 3.68Å; L842-I849 VanDerWaalsContact O-CD1 3.3Å; L842-I849 WeakPolarHBondContact O-CD1 3.16Å; Y845-I849 VanDerWaalsContact O-CG1 3.32Å; Y845-I849 WeakPolarHBondContact O-CG1 3.03Å; Y845-I849 PolarHBondContact O-N 3.19Å; I849-W852 HydrophobicContact CG1-CE3 3.92Å; I849-W852 HydrophobicContact CG1-CZ3 3.81Å; I849-W852 WeakPolarHBondContact O-CB 3.44Å; I849-W852 PolarHBondContact O-N 3.15Å; I849-Y853 HydrophobicContact CG2-CD2 3.97Å; I849-Y853 HydrophobicContact CG2-CE1 4.24Å; I849-Y853 HydrophobicContact CG2-CE2 3.33Å; I849-Y853 VanDerWaalsContact CG2-CZ 3.47Å; I849-Y853 WeakPolarHBondContact O-CD2 3.32Å; I849-Y853 PolarHBondContact O-N 3.17Å; I849-Y853 VanDerWaalsContact O-N 3.11Å
850	Q	93	Very high	91	Very high	113 Å²	113	66.4 Å²	66.4	53%	0.528	31%	0.311	S	S	.	.	H	α-helix	trans	-65.8	-41.5	-179.7	-177.2	58.3	22.4	0	0	111.4	E848 W852 Y853 E854	E848-Q850 PolarHBondContact O-N 3.22Å; Q850-W852 VanDerWaalsContact C-N 3.32Å; Q850-W852 PolarHBondContact O-N 2.97Å; Q850-Y853 PolarHBondContact O-N 3.32Å; Q850-E854 PolarHBondContact NE2-OE1 3.18Å; Q850-E854 WeakPolarHBondContact O-CG 3.45Å; Q850-E854 PolarHBondContact O-N 3.42Å; Q850-E854 VanDerWaalsContact O-N 3.11Å
851	E	95.1	Very high	91.4	Very high	121 Å²	121	71.1 Å²	71.1	57%	0.565	33%	0.332	S	S	*	.	H	α-helix	trans	-60.8	-43	174.5	-174.8	-179.1	-178	0	0	111	E848 Y853 E854 E855	E848-E851 WeakPolarHBondContact O-CB 3.45Å; E848-E851 PolarHBondContact O-N 3.42Å; E848-E851 VanDerWaalsContact O-N 3.15Å; E851-Y853 VanDerWaalsContact C-N 3.26Å; E851-Y853 PolarHBondContact O-N 3.18Å; E851-E854 PolarHBondContact O-N 2.88Å; E851-E854 VanDerWaalsContact O-N 3.16Å; E851-E855 WeakPolarHBondContact O-CB 3.38Å; E851-E855 PolarHBondContact O-N 3.07Å
852	W	95.6	Very high	91.6	Very high	12 Å²	12	76.3 Å²	76.3	5%	0.045	36%	0.355	C	S	.	.	H	α-helix	trans	-60.9	-35.8	176.8	-58.6	-10.4	0	0	0	112.5	K400 F403 K404 L407 Y845 E848 I849 Q850 H856	K400-W852 HydrophobicContact CG-CH2 4.38Å; K400-W852 HydrophobicContact CG-CZ2 4.22Å; F403-W852 HydrophobicContact CD1-CH2 4.32Å; F403-W852 AromaticContact CD1-CZ3 3.98Å; F403-W852 HydrophobicContact CD1-CZ3 3.98Å; F403-W852 HydrophobicContact CE1-CZ3 4.2Å; K404-W852 HydrophobicContact CB-CD2 4.09Å; K404-W852 HydrophobicContact CB-CE3 3.88Å; K404-W852 HydrophobicContact CB-CH2 4.33Å; K404-W852 HydrophobicContact CB-CZ3 4.01Å; K404-W852 HydrophobicContact CD-CB 4.35Å; K404-W852 HydrophobicContact CD-CD2 3.87Å; K404-W852 HydrophobicContact CD-CE3 4.5Å; K404-W852 HydrophobicContact CD-CG 3.77Å; K404-W852 HydrophobicContact CG-CB 4.26Å; K404-W852 HydrophobicContact CG-CD2 3.74Å; K404-W852 HydrophobicContact CG-CE3 3.87Å; K404-W852 HydrophobicContact CG-CG 3.92Å; L407-W852 HydrophobicContact CD2-CE3 4.41Å; Y845-W852 HydrophobicContact CD1-CH2 4.41Å; Y845-W852 HydrophobicContact CD2-CH2 4.28Å; Y845-W852 AromaticContact CG-CH2 3.86Å; Y845-W852 HydrophobicContact CG-CH2 3.86Å; E848-W852 HydrophobicContact CB-CZ2 3.92Å; E848-W852 VanDerWaalsContact O-CD1 3.32Å; E848-W852 PolarHBondContact O-N 3.25Å; E848-W852 VanDerWaalsContact O-N 3.13Å; E848-W852 WeakPolarHBondContact OE2-CZ2 3.18Å; I849-W852 HydrophobicContact CG1-CE3 3.92Å; I849-W852 HydrophobicContact CG1-CZ3 3.81Å; I849-W852 WeakPolarHBondContact O-CB 3.44Å; I849-W852 PolarHBondContact O-N 3.15Å; Q850-W852 VanDerWaalsContact C-N 3.32Å; Q850-W852 PolarHBondContact O-N 2.97Å; W852-H856 VanDerWaalsContact O-CB 3.27Å; W852-H856 WeakPolarHBondContact O-CB 3.36Å; W852-H856 PolarHBondContact O-N 3.03Å; W852-H856 VanDerWaalsContact O-N 3.11Å
853	Y	94.6	Very high	91.6	Very high	44 Å²	44	81.1 Å²	81.1	17%	0.173	38%	0.377	C	S	.	.	H	α-helix	trans	-69.9	-37.5	176.4	-66.8	-29.8	0	0	0	112.8	L407 L408 I849 Q850 E851 A857	L407-Y853 HydrophobicContact CD2-CE1 3.95Å; L407-Y853 WeakPolarHBondContact CD2-OH 3.3Å; L407-Y853 HydrophobicContact CG-CE1 4.07Å; L408-Y853 HydrophobicContact CD2-CD1 3.92Å; L408-Y853 HydrophobicContact CD2-CE1 4.32Å; I849-Y853 HydrophobicContact CG2-CD2 3.97Å; I849-Y853 HydrophobicContact CG2-CE1 4.24Å; I849-Y853 HydrophobicContact CG2-CE2 3.33Å; I849-Y853 VanDerWaalsContact CG2-CZ 3.47Å; I849-Y853 WeakPolarHBondContact O-CD2 3.32Å; I849-Y853 PolarHBondContact O-N 3.17Å; I849-Y853 VanDerWaalsContact O-N 3.11Å; Q850-Y853 PolarHBondContact O-N 3.32Å; E851-Y853 VanDerWaalsContact C-N 3.26Å; E851-Y853 PolarHBondContact O-N 3.18Å; Y853-A857 WeakPolarHBondContact O-CB 3.41Å; Y853-A857 PolarHBondContact O-N 3.27Å
854	E	94.3	Very high	91.5	Very high	103 Å²	103	84.4 Å²	84.4	48%	0.481	39%	0.388	S	S	.	.	H	α-helix	trans	-71.1	-42.5	178.8	-71.4	172.4	-166.4	0	0	111.9	Q850 E851 A857 R858	Q850-E854 PolarHBondContact NE2-OE1 3.18Å; Q850-E854 WeakPolarHBondContact O-CG 3.45Å; Q850-E854 PolarHBondContact O-N 3.42Å; Q850-E854 VanDerWaalsContact O-N 3.11Å; E851-E854 PolarHBondContact O-N 2.88Å; E851-E854 VanDerWaalsContact O-N 3.16Å; E854-A857 PolarHBondContact O-N 2.99Å; E854-R858 WeakPolarHBondContact O-CG 3.32Å; E854-R858 PolarHBondContact O-N 3.01Å; E854-R858 VanDerWaalsContact O-N 3.12Å
855	E	94.8	Very high	91.4	Very high	66 Å²	66	88.5 Å²	88.5	31%	0.308	41%	0.406	S	S	.	.	H	α-helix	trans	-58.2	-50.3	171.9	-172.5	-175.7	-171.1	0	0	111.5	K404 E851 A857 R858 E859	K404-E855 IonicContact NZ-OE1 2.68Å; K404-E855 IonicContact NZ-OE2 2.75Å; K404-E855 PolarHBondContact NZ-OE2 3.2Å; E851-E855 WeakPolarHBondContact O-CB 3.38Å; E851-E855 PolarHBondContact O-N 3.07Å; E855-A857 VanDerWaalsContact C-N 3.31Å; E855-A857 PolarHBondContact O-N 3.02Å; E855-R858 WeakPolarHBondContact O-CB 3.38Å; E855-R858 PolarHBondContact O-N 3.4Å; E855-R858 VanDerWaalsContact O-N 3.12Å; E855-E859 PolarHBondContact O-N 2.48Å
856	H	93.9	Very high	91.1	Very high	21 Å²	21	92.9 Å²	92.9	10%	0.097	43%	0.431	C	S	.	.	H	α-helix	trans	-64.9	-33.4	179	177.5	-96.8	0	0	0	112.9	L408 T412 W852 E859 Q860	L408-H856 HydrophobicContact CD1-CB 4.03Å; L408-H856 HydrophobicContact CD2-CB 3.66Å; L408-H856 HydrophobicContact CG-CB 4.41Å; T412-H856 VanDerWaalsContact CG2-CE1 3.41Å; T412-H856 WeakPolarHBondContact CG2-CE1 3.47Å; T412-H856 WeakPolarHBondContact CG2-NE2 3.28Å; W852-H856 VanDerWaalsContact O-CB 3.27Å; W852-H856 WeakPolarHBondContact O-CB 3.36Å; W852-H856 PolarHBondContact O-N 3.03Å; W852-H856 VanDerWaalsContact O-N 3.11Å; H856-E859 PolarHBondContact O-N 3.13Å; H856-Q860 PolarHBondContact CE1-NE2 3.29Å; H856-Q860 WeakPolarHBondContact O-CG 3.47Å; H856-Q860 PolarHBondContact O-N 3.1Å; H856-Q860 VanDerWaalsContact O-N 3.08Å
857	A	92.7	Very high	90.3	Very high	41 Å²	41	90.2 Å²	90.2	34%	0.339	43%	0.427	S	S	.	.	H	α-helix	trans	-62.8	-42.8	173.3	0	0	0	0	0	111.4	Y853 E854 E855 Q860 E861	Y853-A857 WeakPolarHBondContact O-CB 3.41Å; Y853-A857 PolarHBondContact O-N 3.27Å; E854-A857 PolarHBondContact O-N 2.99Å; E855-A857 VanDerWaalsContact C-N 3.31Å; E855-A857 PolarHBondContact O-N 3.02Å; A857-Q860 PolarHBondContact O-N 3.49Å; A857-E861 WeakPolarHBondContact O-CG 3.22Å; A857-E861 PolarHBondContact O-N 3.36Å
858	R	93.6	Very high	88.9	Confident	150 Å²	150	85 Å²	85	57%	0.566	41%	0.413	S	S	*	.	H	α-helix	trans	-62.3	-43.9	175.7	-71	-178	-74.4	153.7	-5.1	112.3	E854 E855 Q860 E861 Q862	E854-R858 WeakPolarHBondContact O-CG 3.32Å; E854-R858 PolarHBondContact O-N 3.01Å; E854-R858 VanDerWaalsContact O-N 3.12Å; E855-R858 WeakPolarHBondContact O-CB 3.38Å; E855-R858 PolarHBondContact O-N 3.4Å; E855-R858 VanDerWaalsContact O-N 3.12Å; R858-Q860 VanDerWaalsContact C-N 3.33Å; R858-Q860 PolarHBondContact O-N 2.85Å; R858-E861 PolarHBondContact O-N 3.41Å; R858-Q862 PolarHBondContact O-N 3.01Å
859	E	91.5	Very high	86.9	Confident	91 Å²	91	86.4 Å²	86.4	43%	0.425	43%	0.429	S	S	.	.	H	α-helix	trans	-59.5	-43.1	175.7	-71.3	179.9	168	0	0	112.1	E855 H856 E861 Q862 Q863	E855-E859 PolarHBondContact O-N 2.48Å; H856-E859 PolarHBondContact O-N 3.13Å; E859-E861 VanDerWaalsContact C-N 3.33Å; E859-E861 PolarHBondContact O-N 2.94Å; E859-Q862 PolarHBondContact O-N 3.44Å; E859-Q863 WeakPolarHBondContact O-CG 3.34Å; E859-Q863 PolarHBondContact O-N 3.41Å
860	Q	89.9	Confident	84.8	Confident	27 Å²	27	89.4 Å²	89.4	13%	0.126	46%	0.457	C	S	.	.	H	α-helix	trans	-64.6	-37.7	176.6	-75.1	-166.7	-6.8	0	0	112.9	Q415 H856 A857 R858 R864	Q415-Q860 VanDerWaalsContact OE1-OE1 3.13Å; H856-Q860 PolarHBondContact CE1-NE2 3.29Å; H856-Q860 WeakPolarHBondContact O-CG 3.47Å; H856-Q860 PolarHBondContact O-N 3.1Å; H856-Q860 VanDerWaalsContact O-N 3.08Å; A857-Q860 PolarHBondContact O-N 3.49Å; R858-Q860 VanDerWaalsContact C-N 3.33Å; R858-Q860 PolarHBondContact O-N 2.85Å; Q860-R864 WeakPolarHBondContact O-CB 3.32Å; Q860-R864 WeakPolarHBondContact O-CG 2.91Å; Q860-R864 PolarHBondContact O-N 2.85Å
861	E	90.6	Very high	82.1	Confident	113 Å²	113	87.6 Å²	87.6	53%	0.528	46%	0.461	S	S	.	.	H	α-helix	trans	-64.8	-44.1	176.8	-75.2	175.2	-178.3	0	0	111.1	A857 R858 E859 Q863 R864 Q865	A857-E861 WeakPolarHBondContact O-CG 3.22Å; A857-E861 PolarHBondContact O-N 3.36Å; R858-E861 PolarHBondContact O-N 3.41Å; E859-E861 VanDerWaalsContact C-N 3.33Å; E859-E861 PolarHBondContact O-N 2.94Å; E861-Q863 PolarHBondContact O-N 3.3Å; E861-R864 PolarHBondContact O-N 2.71Å; E861-Q865 WeakPolarHBondContact O-CG 3.32Å; E861-Q865 PolarHBondContact O-N 3.14Å
862	Q	90.8	Very high	79.5	Confident	122 Å²	122	87.1 Å²	87.1	57%	0.57	47%	0.469	S	S	*	.	H	α-helix	trans	-59.6	-46.9	174.7	-73	178.8	-9.6	0	0	112	R858 E859 R864 Q865 L866	R858-Q862 PolarHBondContact O-N 3.01Å; E859-Q862 PolarHBondContact O-N 3.44Å; Q862-R864 VanDerWaalsContact C-N 3.33Å; Q862-R864 PolarHBondContact O-N 3.11Å; Q862-Q865 PolarHBondContact O-N 2.94Å; Q862-L866 WeakPolarHBondContact O-CG 3.33Å; Q862-L866 PolarHBondContact O-N 2.92Å
863	Q	87.7	Confident	76.8	Confident	137 Å²	137	91.7 Å²	91.7	64%	0.64	51%	0.509	S	S	*	.	H	α-helix	trans	-62.1	-39.7	177.3	-74.5	179.9	-2.8	0	0	112.3	E859 E861 S867	E859-Q863 WeakPolarHBondContact O-CG 3.34Å; E859-Q863 PolarHBondContact O-N 3.41Å; E861-Q863 PolarHBondContact O-N 3.3Å; Q863-S867 WeakPolarHBondContact O-CB 3.46Å; Q863-S867 PolarHBondContact O-N 3.48Å; Q863-S867 PolarHBondContact O-OG 3.46Å
864	R	83.8	Confident	74	Confident	126 Å²	126	95.6 Å²	95.6	48%	0.475	54%	0.538	S	S	.	.	H	α-helix	trans	-65.3	-42.7	175.9	-75.5	-175.7	-156.5	165.8	20.1	111.7	Q860 E861 Q862 S867 S868	Q860-R864 WeakPolarHBondContact O-CB 3.32Å; Q860-R864 WeakPolarHBondContact O-CG 2.91Å; Q860-R864 PolarHBondContact O-N 2.85Å; E861-R864 PolarHBondContact O-N 2.71Å; Q862-R864 VanDerWaalsContact C-N 3.33Å; Q862-R864 PolarHBondContact O-N 3.11Å; R864-S867 WeakPolarHBondContact CA-OG 3.31Å; R864-S867 PolarHBondContact O-N 3.35Å; R864-S867 PolarHBondContact O-OG 2.98Å; R864-S868 WeakPolarHBondContact O-CB 3.36Å; R864-S868 PolarHBondContact O-N 3.3Å; R864-S868 PolarHBondContact O-OG 3.14Å
865	Q	82.4	Confident	71.1	Confident	128 Å²	128	99.7 Å²	99.7	60%	0.598	56%	0.557	S	S	*	*	H	α-helix	trans	-59.7	-48.4	176.9	-73.6	175	4.7	0	0	111.3	E861 Q862 S867 S868 S869	E861-Q865 WeakPolarHBondContact O-CG 3.32Å; E861-Q865 PolarHBondContact O-N 3.14Å; Q862-Q865 PolarHBondContact O-N 2.94Å; Q865-S867 VanDerWaalsContact C-N 3.34Å; Q865-S867 PolarHBondContact O-N 3.01Å; Q865-S868 WeakPolarHBondContact CA-OG 3.37Å; Q865-S868 PolarHBondContact O-N 3.42Å; Q865-S868 VanDerWaalsContact O-N 3.12Å; Q865-S868 PolarHBondContact O-OG 2.92Å; Q865-S869 PolarHBondContact O-N 2.96Å; Q865-S869 PolarHBondContact O-OG 3.34Å
866	L	82.3	Confident	68	Low	120 Å²	120	105.2 Å²	105.2	63%	0.628	58%	0.583	S	S	*	*	H	α-helix	trans	-58.8	-42.1	176.1	-74.5	159.7	0	0	0	112.6	Q862 S868 S869 A870	Q862-L866 WeakPolarHBondContact O-CG 3.33Å; Q862-L866 PolarHBondContact O-N 2.92Å; L866-S868 VanDerWaalsContact C-N 3.33Å; L866-S868 PolarHBondContact O-N 2.97Å; L866-S869 WeakPolarHBondContact CA-OG 3.3Å; L866-S869 PolarHBondContact O-N 3.34Å; L866-S869 PolarHBondContact O-OG 3.28Å; L866-A870 PolarHBondContact O-N 3.13Å
867	S	71.7	Confident	65.1	Low	81 Å²	81	109.5 Å²	109.5	57%	0.566	61%	0.612	S	S	*	*	H	α-helix	trans	-67.7	-32.3	177.2	71.1	0	0	0	0	113.1	Q863 R864 Q865	Q863-S867 WeakPolarHBondContact O-CB 3.46Å; Q863-S867 PolarHBondContact O-N 3.48Å; Q863-S867 PolarHBondContact O-OG 3.46Å; R864-S867 WeakPolarHBondContact CA-OG 3.31Å; R864-S867 PolarHBondContact O-N 3.35Å; R864-S867 PolarHBondContact O-OG 2.98Å; Q865-S867 VanDerWaalsContact C-N 3.34Å; Q865-S867 PolarHBondContact O-N 3.01Å
868	S	60.3	Low	62.2	Low	87 Å²	87	113.5 Å²	113.5	61%	0.608	64%	0.635	S	S	*	*	H	α-helix	trans	-76	-28.8	177.7	67.8	0	0	0	0	113.1	R864 Q865 L866 A870	R864-S868 WeakPolarHBondContact O-CB 3.36Å; R864-S868 PolarHBondContact O-N 3.3Å; R864-S868 PolarHBondContact O-OG 3.14Å; Q865-S868 WeakPolarHBondContact CA-OG 3.37Å; Q865-S868 PolarHBondContact O-N 3.42Å; Q865-S868 VanDerWaalsContact O-N 3.12Å; Q865-S868 PolarHBondContact O-OG 2.92Å; L866-S868 VanDerWaalsContact C-N 3.33Å; L866-S868 PolarHBondContact O-N 2.97Å; S868-A870 VanDerWaalsContact C-N 3.33Å
869	S	53	Low	59.1	Low	93 Å²	93	112.2 Å²	112.2	65%	0.65	65%	0.649	S	S	*	*	H	α-helix	trans	-76.9	-15.6	175.2	52.5	0	0	0	0	114.2	Q865 L866	Q865-S869 PolarHBondContact O-N 2.96Å; Q865-S869 PolarHBondContact O-OG 3.34Å; L866-S869 WeakPolarHBondContact CA-OG 3.3Å; L866-S869 PolarHBondContact O-N 3.34Å; L866-S869 PolarHBondContact O-OG 3.28Å
870	A	49.2	Very low	56.2	Low	82 Å²	82	113.4 Å²	113.4	68%	0.678	67%	0.667	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91.6	1.1	-176.9	0	0	0	0	0	114.6	L866 S868	L866-A870 PolarHBondContact O-N 3.13Å; S868-A870 VanDerWaalsContact C-N 3.33Å
871	A	35.7	Very low	53.3	Low	74 Å²	74	124 Å²	124	61%	0.612	71%	0.706	S	S	*	*	S	Bend	trans	-90	118.8	173.1	0	0	0	0	0	110.2	A873	A871-A873 PolarHBondContact O-N 3.41Å
872	P	41.4	Very low	50.4	Low	112 Å²	112	127.7 Å²	127.7	73%	0.727	72%	0.723	S	S	*	*			trans	-69.4	131.6	177.2	1.9	8.9	0	0	0	110.5	T874	P872-T874 VanDerWaalsContact C-N 3.35Å; P872-T874 PolarHBondContact O-N 3.46Å
873	A	38.5	Very low	47.4	Very low	108 Å²	108	132 Å²	132	89%	0.893	73%	0.734	S	S	*	*			trans	-67.3	89.3	167.9	0	0	0	0	0	110.3	A871	A871-A873 PolarHBondContact O-N 3.41Å
874	T	36.3	Very low	44.6	Very low	126 Å²	126	131.4 Å²	131.4	77%	0.773	75%	0.745	S	S	*	*			trans	-107	78.9	161.3	9.5	0	0	0	0	109.1	P872	P872-T874 VanDerWaalsContact C-N 3.35Å; P872-T874 PolarHBondContact O-N 3.46Å
875	Q	33.1	Very low	42.2	Very low	188 Å²	188	132.4 Å²	132.4	88%	0.879	76%	0.755	S	S	*	*			trans	-109.2	95.1	153.4	-77.7	-174.8	-6.8	0	0	107.4
876	Q	30.3	Very low	39.7	Very low	183 Å²	183	132.3 Å²	132.3	86%	0.855	76%	0.764	S	S	*	*	P	Polyproline II helix	trans	-66.3	129.5	158	-84.2	178.7	-27.9	0	0	108
877	P	32.6	Very low	37.1	Very low	111 Å²	111	132.5 Å²	132.5	72%	0.721	77%	0.769	S	S	*	*	P	Polyproline II helix	trans	-77	148.3	172.6	31.3	-30.8	0	0	0	109.9	S879	P877-S879 PolarHBondContact O-N 3.1Å
878	P	32.2	Very low	35.1	Very low	124 Å²	124	138.8 Å²	138.8	81%	0.805	81%	0.805	S	S	*	*	P	Polyproline II helix	trans	-69	126.7	176.6	27.7	-30.8	0	0	0	110	S880	P878-S880 PolarHBondContact O-N 3.47Å
879	S	28.3	Very low	33.8	Very low	123 Å²	123	141.4 Å²	141.4	86%	0.86	81%	0.814	S	S	*	*	P	Polyproline II helix	trans	-69.3	117.8	171	55.4	0	0	0	0	111	P877	P877-S879 PolarHBondContact O-N 3.1Å
880	S	29.3	Very low	32.8	Very low	117 Å²	117	143.9 Å²	143.9	82%	0.818	82%	0.823	S	S	*	*			trans	-140.2	111.4	153.4	61	0	0	0	0	110.2	P878	P878-S880 PolarHBondContact O-N 3.47Å
881	R	30.9	Very low	31.9	Very low	250 Å²	250	147.3 Å²	147.3	94%	0.943	83%	0.831	S	S	*	*			trans	-55.4	141.8	175.5	-80.8	170.2	159.8	165.5	-5.9	113.4
882	Q	28.5	Very low	31.7	Very low	189 Å²	189	151.6 Å²	151.6	88%	0.883	84%	0.844	S	S	*	*			trans	-162.9	101.5	133.7	-105.2	174.1	1.5	0	0	108
883	R	27.7	Very low	31.1	Very low	212 Å²	212	154.1 Å²	154.1	80%	0.8	85%	0.851	S	S	*	*				91.2	90.8	91.5	-159	-178.1	-161.1	-177.5	4.8	111.5
884	S	29.7	Very low	30.6	Very low	125 Å²	125	157.2 Å²	157.2	87%	0.874	85%	0.849	S	S	*	*			trans	-83.6	127.5	163	-35.9	0	0	0	0	109.8
885	Q	32.1	Very low	30.2	Very low	147 Å²	147	159.4 Å²	159.4	69%	0.687	85%	0.854	S	S	*	*			trans	-135.8	135	153.2	-80	-175.3	-29.2	0	0	103.3
886	T	31	Very low	30	Very low	126 Å²	126	157.2 Å²	157.2	77%	0.773	85%	0.852	S	S	*	*			cis	-174.1	156.3	11.1	17.1	0	0	0	0	103.6
887	V	27.8	Very low	29.9	Very low	124 Å²	124	155.1 Å²	155.1	75%	0.752	85%	0.852	S	S	*	*				-174.1	130.4	58.1	175.5	0	0	0	0	107
888	T	29.4	Very low	29.7	Very low	213 Å²	213	159.1 Å²	159.1	100%	1.307	86%	0.864	S	S	*	*				158.1	0	128.7	45	0	0	0	0	109.2

Retrieved 888 of 888 residues in 228.6 ms (Link to these results)

U.S. Privacy Notice - Disclaimer / Registrations / Copyright Statement - Linking Policy - Notice of Privacy Practices (HIPAA) - Notice of Non‑Discrimination
© Copyright 2026 St. Jude Children's Research Hospital, a not-for-profit, section 501(c)(3).