A0A087YNS5_POEFO Loading...

Cohesin subunit SA

Component of cohesin complex, a complex required for the cohesion of sister chromatids after DNA replication. The cohesin complex apparently forms a large proteinaceous ring within which sister chromatids can be trapped. At anaphase, the complex is cleaved and dissociates from chromatin, allowing sister chromatids to segregate.

AlphaFold DB , UniProt , Accession A0A087YNS5, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 1,275 aa.

						>A0A087YNS5_POEFO|A0A087YNS5
MIAAQDLHAEFQFPQETESQLSSDADLEDPDGRNATAGRGMGVKRGRKVLGDKAKGGGAGRVSSTGWVNGHHQENGTENMSLFEVVKMGRSATQSVVDEWIEAYKQDRDVALLELINFFIQCSGCKGAVSEEMFRHMQNSEIIRKMTEEFDEDSGDYPLTLSGPQWKRFRINFCDFIAVLVRQCQYSIIYDEYMMDTVISLLTGLSDSQVRAFRHTSTLAAMKLMTALVNVALNLSINMDNTQRQYEAERNKVIAKRANDRLELLLQKRKELQENQDDIENMMNAIFKGVFVHRYRDAIAEIRAICIEEIGVWMKLYSDAFLNDSYLKYVGWTMHDKQGEVRLKCLTALQGLFYSRELGSRLELFTSRFKDRIVSMTLDKEYDVAVQAIKLLTLILQSSDEVLTAEDCESVYHLVYSAHRPIAVSAGEFLFKKLFSHRGPEDEGLPRRGRQSLNGSLIKTTVFFFLESELHEHGAYLVDSLWECASELLKDWETMISLLLDEPMPGEEALTDRQETALVEIMLSAIRQACECHPPVGRGSGKRVLTAKEKKTQLDDRTRTTEMFAVALPLLLAKYCVDIDKVTSLLQIPKYFDLDIYTTGRLEKHMDALLRQIWEVVDKHTDTEVLEACSTTYHYLCNEEFTIFNRVDIARSQLLDELVDKFNRLLEDFLQEGEEPDEDDAYQVLSTLKKITAFHNAHDLSKWDLFTSNYSLLSTGLQNGDMPEQIVIHAMQCTHYIVLWHLAKVSEGSSIKGDLVTLRKQMRAFCLICQRYLCSINTAVKEQAFTVLCDVLLIFSHQIMSSGREHLENLVYVPDSSLQAELLNFIVDQVFIDQDDDSNSTDGQQDDEASKIEALHKRRNLLAAYCKLIIYNVVEMNTGADIFKQYMRYYNDYGDIIKETMSKTRQIDKIQCAKTLILSLQKLFNEMMSELGFSFDRSSSAFCGIKELARRFSLTFGLDQLKTREAIAMLHKDGIEFAFKEPSPQGEGGPPLNLPFLDILSEFSSKLLRQDKRTVHMYLERFMTFQMALQRDDCWLPLISYRNSLQAGMDDDTLSVISGISSRGSVRSKKSKQSAVSKRKLPEEENSSSSFDGVWMNREQSVPTPVMMHSPHLTSTVLRDPKRMRPEDGYAATFSMPAEQHLQQALPPQPLPPHQHQAAMDYNTQVTWMLTQRQQAEARQHQERISMHYAKMRNHMQQAIRRGSGLMEEDEEPIVEDVMMSSEDRLEDINEGMDFNTMEIDLPASKNRRERNELKPDYFDPSSIMDDSVLNVSMF
					

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	26.4	Very low	24.2	Very low	230 Å²	230	155.4 Å²	155.4	100%	1.133	84%	0.842	S	S	*	*				0	96.7	0	-60.2	-178	-71.8	0	0	104.7
2	I	23.8	Very low	24.2	Very low	167 Å²	167	155.8 Å²	155.8	86%	0.856	83%	0.834	S	S	*	*				84	133.4	55.1	-63.1	171.5	0	0	0	111.2
3	A	24	Very low	24.3	Very low	91 Å²	91	158.2 Å²	158.2	75%	0.752	83%	0.833	S	S	*	*			trans	66.9	112.4	-167.7	0	0	0	0	0	113
4	A	23.1	Very low	24.5	Very low	98 Å²	98	155.7 Å²	155.7	81%	0.81	83%	0.831	S	S	*	*			cis	68.8	115	11.5	0	0	0	0	0	116.9
5	Q	24.9	Very low	24.5	Very low	193 Å²	193	157.5 Å²	157.5	90%	0.902	83%	0.832	S	S	*	*			trans	-163	140.6	156	-125.9	173.9	-0.4	0	0	110.1
6	D	24.1	Very low	24.6	Very low	149 Å²	149	159.4 Å²	159.4	80%	0.797	84%	0.835	S	S	*	*			trans	-91.9	157.2	-168.2	-43.2	-88.1	0	0	0	113.5
7	L	24.1	Very low	24.8	Very low	175 Å²	175	157.6 Å²	157.6	92%	0.916	83%	0.833	S	S	*	*			trans	-139.3	98.8	166.4	-82.5	176	0	0	0	111.3
8	H	22.8	Very low	24.8	Very low	170 Å²	170	159.7 Å²	159.7	79%	0.787	84%	0.837	S	S	*	*			trans	-69.9	146.4	156.1	-84.8	-112.7	0	0	0	109.9
9	A	25.1	Very low	24.9	Very low	91 Å²	91	157.4 Å²	157.4	75%	0.752	84%	0.836	S	S	*	*			trans	-131.9	78.8	171.3	0	0	0	0	0	110.1
10	E	24.3	Very low	25.1	Very low	144 Å²	144	159 Å²	159	67%	0.673	84%	0.838	S	S	*	*			trans	-72.4	123.9	169.7	-65.1	-175.2	157.1	0	0	110.2	Q12	E10-Q12 PolarHBondContact O-N 3.21Å; E10-Q12 PolarHBondContact OE2-NE2 3.2Å
11	F	23.9	Very low	25.1	Very low	201 Å²	201	160.1 Å²	160.1	88%	0.882	84%	0.844	S	S	*	*			trans	-83.5	88.5	167.9	-87.9	-90.9	0	0	0	109.9
12	Q	23.7	Very low	25.1	Very low	160 Å²	160	154.9 Å²	154.9	75%	0.748	83%	0.83	S	S	*	*	P	Polyproline II helix	trans	-73.5	128.1	171.4	-66.6	-177.2	-4.8	0	0	110.5	E10	E10-Q12 PolarHBondContact O-N 3.21Å; E10-Q12 PolarHBondContact OE2-NE2 3.2Å
13	F	25.5	Very low	25.3	Very low	188 Å²	188	151.8 Å²	151.8	83%	0.825	82%	0.823	S	S	*	*	P	Polyproline II helix	trans	-71.9	145.3	167.3	-80.9	-98.8	0	0	0	110	Q15	F13-Q15 PolarHBondContact O-N 3.25Å
14	P	26.9	Very low	25.5	Very low	123 Å²	123	155 Å²	155	80%	0.799	83%	0.828	S	S	*	*	P	Polyproline II helix	trans	-63.7	118.9	175.4	-20.2	32.8	0	0	0	111.1	E16	P14-E16 PolarHBondContact O-N 3.14Å
15	Q	25.1	Very low	25.8	Very low	182 Å²	182	154.6 Å²	154.6	85%	0.85	82%	0.824	S	S	*	*			trans	-82.4	111	173	-169.2	173.1	23.5	0	0	108.7	F13 T17	F13-Q15 PolarHBondContact O-N 3.25Å; Q15-T17 PolarHBondContact O-N 3.43Å
16	E	26.4	Very low	25.9	Very low	189 Å²	189	152.4 Å²	152.4	88%	0.883	82%	0.819	S	S	*	*	P	Polyproline II helix	trans	-64.5	130.5	176.7	-66.4	-167.6	142	0	0	110.4	P14	P14-E16 PolarHBondContact O-N 3.14Å
17	T	27.3	Very low	26.1	Very low	129 Å²	129	152.1 Å²	152.1	79%	0.791	82%	0.817	S	S	*	*	P	Polyproline II helix	trans	-92.1	133.2	-175.2	36.4	0	0	0	0	112.1	Q15 S19	Q15-T17 PolarHBondContact O-N 3.43Å; T17-S19 PolarHBondContact O-N 3.5Å
18	E	25	Very low	26.2	Very low	194 Å²	194	152.2 Å²	152.2	91%	0.907	81%	0.812	S	S	*	*	P	Polyproline II helix	trans	-53.2	127.1	172.9	-59.6	-179.1	130.4	0	0	110.9
19	S	27.8	Very low	26.6	Very low	117 Å²	117	151 Å²	151	82%	0.818	81%	0.811	S	S	*	*			trans	-122.5	136	167.1	58.2	0	0	0	0	109.8	T17	T17-S19 PolarHBondContact O-N 3.5Å
20	Q	28.4	Very low	27.3	Very low	188 Å²	188	152 Å²	152	88%	0.879	81%	0.81	S	S	*	*			trans	-91.3	128.8	-163.5	-65.2	173.1	-9	0	0	111.4
21	L	25	Very low	27.6	Very low	183 Å²	183	150.5 Å²	150.5	96%	0.958	81%	0.807	S	S	*	*			trans	-78.5	128.9	163.1	-72.5	169.6	0	0	0	109.9
22	S	26.8	Very low	27.8	Very low	120 Å²	120	144.4 Å²	144.4	84%	0.839	80%	0.801	S	S	*	*			trans	-138.7	141	167.8	-175.4	0	0	0	0	108.7
23	S	27.7	Very low	28.1	Very low	102 Å²	102	146 Å²	146	71%	0.713	80%	0.8	S	S	*	*			trans	-84.8	151.8	-171.9	53.1	0	0	0	0	114.5
24	D	28.4	Very low	28.2	Very low	159 Å²	159	144.3 Å²	144.3	85%	0.85	80%	0.8	S	S	*	*			trans	10.1	133.5	151.4	-52.5	-31.5	0	0	0	120.6
25	A	28.6	Very low	28.3	Very low	90 Å²	90	142.4 Å²	142.4	74%	0.744	79%	0.794	S	S	*	*				-175.2	133	99.8	0	0	0	0	0	114.1
26	D	27.7	Very low	28.4	Very low	146 Å²	146	140.3 Å²	140.3	78%	0.781	79%	0.794	S	S	*	*			trans	49.8	127	139.5	-76.1	-21.3	0	0	0	125.8
27	L	26.9	Very low	28.5	Very low	144 Å²	144	136.3 Å²	136.3	75%	0.754	79%	0.793	S	S	*	*			trans	87.4	136	130	-69.8	169.5	0	0	0	124.3
28	E	27.9	Very low	28.5	Very low	176 Å²	176	133.2 Å²	133.2	82%	0.822	79%	0.787	S	S	*	*			trans	68.4	113.2	151.9	-68.3	-178.6	-176.1	0	0	122.9
29	D	30.6	Very low	28.7	Very low	144 Å²	144	136.5 Å²	136.5	77%	0.77	79%	0.791	S	S	*	*			trans	-84.1	142.3	152.8	169.4	44.2	0	0	0	109.7	D31	D29-D31 PolarHBondContact OD1-N 3.29Å; D29-D31 VanDerWaalsContact OD1-N 3.15Å
30	P	40.6	Very low	28.6	Very low	112 Å²	112	134.4 Å²	134.4	73%	0.727	79%	0.788	S	S	*	*				-147	130.6	116.5	33.3	-16.2	0	0	0	118
31	D	30.2	Very low	28.7	Very low	114 Å²	114	134.8 Å²	134.8	61%	0.61	79%	0.792	S	S	*	*			trans	19.5	119.2	139.5	-169.1	15.6	0	0	0	119.1	D29 R33	D29-D31 PolarHBondContact OD1-N 3.29Å; D29-D31 VanDerWaalsContact OD1-N 3.15Å; D31-R33 IonicContact OD1-NE 2.75Å; D31-R33 IonicContact OD2-CZ 3.24Å; D31-R33 IonicContact OD2-NE 3.66Å; D31-R33 IonicContact OD2-NH2 3.81Å; D31-R33 PolarHBondContact OD2-NH2 3.32Å
32	G	27.4	Very low	28.8	Very low	73 Å²	73	129.4 Å²	129.4	75%	0.753	78%	0.781	S	S	*	*			trans	-149.5	2.7	-168.4	0	0	0	0	0	122.7
33	R	30.1	Very low	28.9	Very low	192 Å²	192	131 Å²	131	73%	0.725	79%	0.785	S	S	*	*			trans	34.3	151.3	161.8	-54.3	-176.8	-166.9	179	6.7	124.2	D31	D31-R33 IonicContact OD1-NE 2.75Å; D31-R33 IonicContact OD2-CZ 3.24Å; D31-R33 IonicContact OD2-NE 3.66Å; D31-R33 IonicContact OD2-NH2 3.81Å; D31-R33 PolarHBondContact OD2-NH2 3.32Å
34	N	27.9	Very low	29.3	Very low	154 Å²	154	135.1 Å²	135.1	82%	0.824	79%	0.791	S	S	*	*			trans	82.4	125.4	161.6	-57.4	-33.1	0	0	0	116.8
35	A	28.2	Very low	29.2	Very low	83 Å²	83	139.5 Å²	139.5	69%	0.686	80%	0.795	S	S	*	*			cis	87.5	139	47.6	0	0	0	0	0	112.9
36	T	27.6	Very low	29.3	Very low	138 Å²	138	138.9 Å²	138.9	85%	0.847	80%	0.798	S	S	*	*			cis	-166	166.7	4.1	5.9	0	0	0	0	112.6
37	A	28.6	Very low	29.3	Very low	104 Å²	104	144 Å²	144	86%	0.86	81%	0.806	S	S	*	*			trans	74.5	149.7	157.9	0	0	0	0	0	119.5
38	G	27.4	Very low	29.5	Very low	65 Å²	65	147 Å²	147	67%	0.67	81%	0.813	S	S	*	*			cis	166.7	179.9	-8.2	0	0	0	0	0	115.6
39	R	28.3	Very low	29.9	Very low	263 Å²	263	145.1 Å²	145.1	99%	0.992	81%	0.813	S	S	*	*			trans	78.1	139	-172.1	-49	175.4	-174.9	-154	0.1	113.5
40	G	27.1	Very low	29.8	Very low	73 Å²	73	146.6 Å²	146.6	75%	0.753	82%	0.82	S	S	*	*			cis	117.2	134.3	2.5	0	0	0	0	0	111.5
41	M	29.4	Very low	29.2	Very low	195 Å²	195	144.5 Å²	144.5	96%	0.961	82%	0.819	S	S	*	*			cis	-152	158.8	10.9	-62.9	173.6	68.7	0	0	112.7
42	G	27.9	Very low	29.2	Very low	71 Å²	71	147 Å²	147	73%	0.732	83%	0.832	S	S	*	*			trans	97.7	152.2	131.7	0	0	0	0	0	119.2
43	V	28.3	Very low	29.3	Very low	152 Å²	152	153.1 Å²	153.1	92%	0.921	84%	0.838	S	S	*	*			cis	-144.6	154.3	-0.8	175.5	0	0	0	0	111.6
44	K	35.7	Very low	29.2	Very low	190 Å²	190	148.8 Å²	148.8	83%	0.826	84%	0.843	S	S	*	*			trans	-73.4	157.2	-168.8	-51.8	161.3	178.5	173.7	0	117.3
45	R	27.5	Very low	29.5	Very low	250 Å²	250	151.8 Å²	151.8	94%	0.943	85%	0.849	S	S	*	*				170.5	138	116.7	-93.5	169.3	-178.2	-168.2	2.2	111.1
46	G	29.9	Very low	29.3	Very low	77 Å²	77	151.7 Å²	151.7	79%	0.794	86%	0.856	S	S	*	*			cis	125.8	113.5	-21.2	0	0	0	0	0	116.9
47	R	27.9	Very low	29.3	Very low	255 Å²	255	149.3 Å²	149.3	96%	0.962	86%	0.859	S	S	*	*			trans	-155.1	165.4	157.3	-147.3	170.3	-176.4	169.7	1.4	112.6
48	K	30.8	Very low	29.2	Very low	207 Å²	207	147.9 Å²	147.9	90%	0.9	86%	0.855	S	S	*	*			trans	-139.4	167.3	-173	-138.9	-175.4	-174.2	-172.3	0	112
49	V	35.4	Very low	29.3	Very low	136 Å²	136	150.5 Å²	150.5	82%	0.824	87%	0.87	S	S	*	*			trans	-64	150.9	-176.5	178.3	0	0	0	0	115
50	L	30.6	Very low	29.1	Very low	175 Å²	175	141.5 Å²	141.5	92%	0.916	86%	0.859	S	S	*	*			trans	-165.9	154.1	150.3	-97.3	169.2	0	0	0	107.5
51	G	26.2	Very low	29.1	Very low	68 Å²	68	149.5 Å²	149.5	70%	0.701	87%	0.867	S	S	*	*			cis	176.6	173.2	-0.8	0	0	0	0	0	111.8
52	D	31.7	Very low	29	Very low	167 Å²	167	146.1 Å²	146.1	89%	0.893	86%	0.856	S	S	*	*			trans	-89.5	173.3	-168.3	-127.9	-37.4	0	0	0	115.7
53	K	28.3	Very low	28.7	Very low	201 Å²	201	147.9 Å²	147.9	87%	0.874	86%	0.857	S	S	*	*			trans	-143.3	135.4	168.6	-90.4	-172.1	178.4	175.8	0	113.6
54	A	29.4	Very low	28.5	Very low	101 Å²	101	144.8 Å²	144.8	84%	0.835	84%	0.843	S	S	*	*			trans	-146.8	153.8	175.9	0	0	0	0	0	113.7
55	K	32.3	Very low	28.1	Very low	217 Å²	217	142.6 Å²	142.6	94%	0.943	85%	0.845	S	S	*	*			trans	-180	133.7	163.6	-107.4	-179.5	178.7	-175.2	0	107.6
56	G	25.2	Very low	27.9	Very low	81 Å²	81	133.9 Å²	133.9	84%	0.835	83%	0.834	S	S	*	*			cis	-158.2	171.3	-14.6	0	0	0	0	0	106.2
57	G	27.2	Very low	27.6	Very low	88 Å²	88	142.1 Å²	142.1	91%	0.907	84%	0.841	S	S	*	*			cis	124.7	134.3	25.9	0	0	0	0	0	108.1
58	G	25.9	Very low	27.6	Very low	74 Å²	74	135.4 Å²	135.4	76%	0.763	83%	0.828	S	S	*	*			cis	174.4	-172.7	-3.5	0	0	0	0	0	112.1
59	A	29.2	Very low	27.4	Very low	119 Å²	119	133.1 Å²	133.1	98%	0.983	83%	0.825	S	S	*	*			trans	66.4	144.7	173.4	0	0	0	0	0	118.5
60	G	26	Very low	26.9	Very low	75 Å²	75	129.7 Å²	129.7	77%	0.773	82%	0.818	S	S	*	*			trans	-172.1	-69.8	-176.6	0	0	0	0	0	117.5
61	R	27	Very low	26.8	Very low	241 Å²	241	130.7 Å²	130.7	91%	0.909	82%	0.817	S	S	*	*			trans	56.5	134.6	166.6	-140.4	-167.9	-169.2	-172.9	3.3	119.9
62	V	25.8	Very low	27	Very low	123 Å²	123	136.2 Å²	136.2	75%	0.745	83%	0.825	S	S	*	*			trans	106.6	118.2	149.8	-177.9	0	0	0	0	120.5
63	S	23.2	Very low	27	Very low	108 Å²	108	137.1 Å²	137.1	76%	0.755	82%	0.823	S	S	*	*			trans	51	159.7	149.8	-103.6	0	0	0	0	124
64	S	23.6	Very low	27.1	Very low	88 Å²	88	136.1 Å²	136.1	62%	0.615	82%	0.822	S	S	*	*			cis	-175.9	155	-40.6	54.9	0	0	0	0	111.2
65	T	26.8	Very low	27.3	Very low	143 Å²	143	138.6 Å²	138.6	88%	0.877	82%	0.821	S	S	*	*			trans	61.7	134.1	155.8	47.7	0	0	0	0	121.2
66	G	23.3	Very low	27.1	Very low	68 Å²	68	131.6 Å²	131.6	70%	0.701	81%	0.81	S	S	*	*			trans	119.4	84.5	173.4	0	0	0	0	0	112.7
67	W	24.2	Very low	27.5	Very low	250 Å²	250	133.5 Å²	133.5	95%	0.947	81%	0.806	S	S	*	*				59.2	112.2	65.7	-87.1	57.4	0	0	0	115.6
68	V	26.9	Very low	28.1	Very low	114 Å²	114	137.7 Å²	137.7	69%	0.691	80%	0.802	S	S	*	*				159.1	126.5	117.7	163.3	0	0	0	0	111
69	N	26.1	Very low	29.6	Very low	158 Å²	158	141.9 Å²	141.9	85%	0.845	81%	0.807	S	S	*	*			trans	50.9	148.8	163	-60.3	-0.3	0	0	0	120.8
70	G	26.4	Very low	31.9	Very low	64 Å²	64	141.5 Å²	141.5	66%	0.66	79%	0.786	S	S	*	*			cis	137.2	113.3	-9.3	0	0	0	0	0	113.9
71	H	28.5	Very low	34.9	Very low	196 Å²	196	139.4 Å²	139.4	91%	0.907	76%	0.759	S	S	*	*			trans	-146.1	132.6	154.5	-108.5	-81.5	0	0	0	107.9
72	H	30.8	Very low	38	Very low	185 Å²	185	128.3 Å²	128.3	86%	0.856	72%	0.718	S	S	*	*			trans	-69.2	138.5	170.2	-73.2	-92.6	0	0	0	109.3
73	Q	31.5	Very low	41.2	Very low	185 Å²	185	123.8 Å²	123.8	86%	0.864	69%	0.688	S	S	*	*			trans	-111.4	112.8	154.2	-165.4	163	21.3	0	0	105.4	N75	Q73-N75 PolarHBondContact O-N 3.39Å
74	E	29.9	Very low	44.5	Very low	181 Å²	181	122.5 Å²	122.5	85%	0.846	67%	0.671	S	S	*	*			trans	-73.4	112.9	-175	-68.6	168.2	128.5	0	0	109	G76	E74-G76 VanDerWaalsContact C-N 3.28Å; E74-G76 PolarHBondContact O-N 2.69Å
75	N	33.4	Very low	47.9	Very low	153 Å²	153	120.1 Å²	120.1	82%	0.818	65%	0.652	S	S	*	*			trans	-70.7	93.3	161.9	-84.3	-2.6	0	0	0	107.3	Q73 T77	Q73-N75 PolarHBondContact O-N 3.39Å; N75-T77 VanDerWaalsContact C-N 3.34Å; N75-T77 PolarHBondContact O-N 3.1Å
76	G	29.1	Very low	51.1	Low	69 Å²	69	113.8 Å²	113.8	71%	0.711	61%	0.613	S	S	*	*			trans	-64.5	93.4	168.7	0	0	0	0	0	110	E74 E78	E74-G76 VanDerWaalsContact C-N 3.28Å; E74-G76 PolarHBondContact O-N 2.69Å; G76-E78 PolarHBondContact O-N 3.42Å; G76-E78 VanDerWaalsContact O-N 3.08Å
77	T	33.7	Very low	54.4	Low	122 Å²	122	113.3 Å²	113.3	75%	0.748	59%	0.592	S	S	*	*			trans	-73.5	87.1	158.7	49.1	0	0	0	0	107.5	N75	N75-T77 VanDerWaalsContact C-N 3.34Å; N75-T77 PolarHBondContact O-N 3.1Å
78	E	38.3	Very low	57.5	Low	176 Å²	176	104.5 Å²	104.5	82%	0.822	56%	0.562	S	S	*	*			trans	-60.7	133.3	159.3	-66.4	179.2	147.7	0	0	107.7	G76 M80	G76-E78 PolarHBondContact O-N 3.42Å; G76-E78 VanDerWaalsContact O-N 3.08Å; E78-M80 PolarHBondContact O-N 3.13Å
79	N	59	Low	60.2	Low	162 Å²	162	99.7 Å²	99.7	87%	0.866	54%	0.536	S	S	*	.			trans	-71.1	94.5	176	-71.3	-3.5	0	0	0	108.1	S81	N79-S81 PolarHBondContact O-N 2.83Å
80	M	77.2	Confident	62.9	Low	111 Å²	111	102.4 Å²	102.4	55%	0.547	53%	0.534	S	S	.	.			trans	-53	134.7	174.1	-73	178.6	-69.9	0	0	110	E78 E84 V85 M88	E78-M80 PolarHBondContact O-N 3.13Å; M80-E84 WeakPolarHBondContact CA-OE2 3.5Å; M80-E84 HydrophobicContact CB-CB 4.37Å; M80-V85 HydrophobicContact CB-CG2 4.37Å; M80-M88 HydrophobicContact SD-CE 3.91Å
81	S	87.3	Confident	65.6	Low	30 Å²	30	102.6 Å²	102.6	21%	0.21	53%	0.525	C	S	.	.			trans	-71.1	156.4	-177.5	89.1	0	0	0	0	111.7	N79 F83 E84 V85 Q121	N79-S81 PolarHBondContact O-N 2.83Å; S81-F83 PolarHBondContact O-N 3.13Å; S81-F83 VanDerWaalsContact O-N 3.09Å; S81-F83 PolarHBondContact OG-N 3.32Å; S81-E84 PolarHBondContact N-OE2 3.09Å; S81-E84 WeakPolarHBondContact O-CA 3.42Å; S81-E84 WeakPolarHBondContact O-CB 3.08Å; S81-E84 PolarHBondContact O-N 2.95Å; S81-E84 PolarHBondContact OG-N 3.35Å; S81-V85 PolarHBondContact O-N 3.29Å; S81-Q121 PolarHBondContact OG-OE1 3.02Å
82	L	92.1	Very high	68.4	Low	9 Å²	9	96.4 Å²	96.4	5%	0.047	51%	0.508	C	S	.	.	H	α-helix	trans	-51.2	-33.5	174.1	-176.2	56.2	0	0	0	112.8	V86 V96 E114 F118 F176	L82-V86 HydrophobicContact CD1-CG2 4.38Å; L82-V86 WeakPolarHBondContact O-CB 3.21Å; L82-V86 WeakPolarHBondContact O-CG2 3.42Å; L82-V86 PolarHBondContact O-N 2.85Å; L82-V96 HydrophobicContact CD1-CG1 3.43Å; L82-V96 VanDerWaalsContact CD1-CG1 3.43Å; L82-E114 HydrophobicContact CB-CG 4.1Å; L82-E114 HydrophobicContact CD2-CG 4.23Å; L82-F118 HydrophobicContact CB-CB 4.32Å; L82-F118 HydrophobicContact CB-CD2 4.1Å; L82-F118 HydrophobicContact CD2-CB 3.9Å; L82-F118 HydrophobicContact CD2-CD2 4.15Å; L82-F118 HydrophobicContact CD2-CG 3.95Å; L82-F118 HydrophobicContact CG-CB 4.21Å; L82-F118 HydrophobicContact CG-CD2 3.67Å; L82-F118 HydrophobicContact CG-CE2 4.19Å; L82-F118 HydrophobicContact CG-CG 4.01Å; L82-F176 HydrophobicContact CD1-CE2 3.97Å; L82-F176 HydrophobicContact CD1-CZ 4.11Å; L82-F176 HydrophobicContact CD2-CE1 4.36Å; L82-F176 HydrophobicContact CD2-CZ 3.85Å; L82-F176 HydrophobicContact CG-CZ 4.36Å
83	F	94.3	Very high	71.3	Confident	27 Å²	27	89.4 Å²	89.4	12%	0.118	48%	0.478	C	S	.	.	H	α-helix	trans	-65	-44.7	173.4	164.9	-114.3	0	0	0	112	S81 V86 K87 F118 Q121 C122 P158 F169	S81-F83 PolarHBondContact O-N 3.13Å; S81-F83 VanDerWaalsContact O-N 3.09Å; S81-F83 PolarHBondContact OG-N 3.32Å; F83-V86 PolarHBondContact O-N 3.04Å; F83-K87 HydrophobicContact CE1-CD 4.05Å; F83-K87 HydrophobicContact CE2-CD 4.26Å; F83-K87 HydrophobicContact CZ-CD 3.79Å; F83-K87 WeakPolarHBondContact O-CB 3.44Å; F83-K87 PolarHBondContact O-N 3.11Å; F83-F118 HydrophobicContact CB-CD2 4.21Å; F83-Q121 HydrophobicContact CB-CB 3.83Å; F83-Q121 HydrophobicContact CD1-CB 3.99Å; F83-Q121 HydrophobicContact CG-CB 3.87Å; F83-C122 HydrophobicContact CD2-CB 4.48Å; F83-P158 HydrophobicContact CE2-CG 4.29Å; F83-P158 HydrophobicContact CZ-CG 4.21Å; F83-F169 AromaticContact CD2-CE2 3.82Å; F83-F169 HydrophobicContact CD2-CE2 3.82Å; F83-F169 HydrophobicContact CD2-CZ 4.2Å; F83-F169 HydrophobicContact CE2-CD2 4.4Å; F83-F169 AromaticContact CE2-CE2 3.69Å; F83-F169 HydrophobicContact CE2-CE2 3.69Å; F83-F169 AromaticContact CE2-CZ 3.84Å; F83-F169 HydrophobicContact CE2-CZ 3.84Å
84	E	93.1	Very high	74.2	Confident	82 Å²	82	85.2 Å²	85.2	38%	0.383	46%	0.458	S	S	.	.	H	α-helix	trans	-65.1	-41.6	177.5	-61.9	-168.5	114.8	0	0	112.1	M80 S81 K87 M88	M80-E84 WeakPolarHBondContact CA-OE2 3.5Å; M80-E84 HydrophobicContact CB-CB 4.37Å; S81-E84 PolarHBondContact N-OE2 3.09Å; S81-E84 WeakPolarHBondContact O-CA 3.42Å; S81-E84 WeakPolarHBondContact O-CB 3.08Å; S81-E84 PolarHBondContact O-N 2.95Å; S81-E84 PolarHBondContact OG-N 3.35Å; E84-K87 PolarHBondContact O-N 3.36Å; E84-M88 HydrophobicContact CB-CE 4.47Å; E84-M88 WeakPolarHBondContact O-CB 3.49Å; E84-M88 VanDerWaalsContact O-CG 3.3Å; E84-M88 WeakPolarHBondContact O-CG 3.43Å; E84-M88 PolarHBondContact O-N 3.41Å
85	V	93.6	Very high	77.2	Confident	38 Å²	38	79.1 Å²	79.1	23%	0.23	44%	0.436	C	S	.	.	H	α-helix	trans	-59	-50.3	176.6	176.2	0	0	0	0	110.7	M80 S81 M88 G89 V96	M80-V85 HydrophobicContact CB-CG2 4.37Å; S81-V85 PolarHBondContact O-N 3.29Å; V85-M88 PolarHBondContact O-N 3.16Å; V85-G89 PolarHBondContact O-N 3.25Å; V85-V96 HydrophobicContact CG1-CG1 3.99Å; V85-V96 HydrophobicContact CG1-CG2 3.68Å
86	V	93.9	Very high	80.1	Confident	9 Å²	9	72.4 Å²	72.4	6%	0.055	40%	0.4	C	S	.	.	H	α-helix	trans	-65.8	-39.8	177.9	172.1	0	0	0	0	111.7	L82 F83 G89 F118 F169 N172 F176	L82-V86 HydrophobicContact CD1-CG2 4.38Å; L82-V86 WeakPolarHBondContact O-CB 3.21Å; L82-V86 WeakPolarHBondContact O-CG2 3.42Å; L82-V86 PolarHBondContact O-N 2.85Å; F83-V86 PolarHBondContact O-N 3.04Å; V86-G89 PolarHBondContact O-N 3.01Å; V86-F118 HydrophobicContact CB-CE2 3.97Å; V86-F118 HydrophobicContact CG1-CE2 4.24Å; V86-F118 HydrophobicContact CG1-CZ 4.37Å; V86-F118 HydrophobicContact CG2-CE2 3.78Å; V86-F118 HydrophobicContact CG2-CZ 4.17Å; V86-F169 HydrophobicContact CG1-CD2 4.4Å; V86-F169 HydrophobicContact CG1-CE2 4.38Å; V86-N172 HydrophobicContact CG1-CB 3.82Å; V86-N172 WeakPolarHBondContact O-CB 3.41Å; V86-N172 PolarHBondContact O-ND2 3.19Å; V86-F176 HydrophobicContact CG2-CB 4.45Å; V86-F176 HydrophobicContact CG2-CD2 4.18Å; V86-F176 HydrophobicContact CG2-CG 4.3Å
87	K	92.8	Very high	83.3	Confident	58 Å²	58	69.1 Å²	69.1	25%	0.252	37%	0.366	S	S	.	.	H	α-helix	trans	-67.5	-34.9	177	178.9	-177.6	174.9	-176.5	0	113.5	F83 E84 W166 F169	F83-K87 HydrophobicContact CE1-CD 4.05Å; F83-K87 HydrophobicContact CE2-CD 4.26Å; F83-K87 HydrophobicContact CZ-CD 3.79Å; F83-K87 WeakPolarHBondContact O-CB 3.44Å; F83-K87 PolarHBondContact O-N 3.11Å; E84-K87 PolarHBondContact O-N 3.36Å; K87-W166 HydrophobicContact CD-CH2 4.22Å; K87-W166 HydrophobicContact CD-CZ3 4.16Å; K87-F169 HydrophobicContact CB-CD2 3.98Å; K87-F169 HydrophobicContact CG-CD2 4.49Å
88	M	89	Confident	86.2	Confident	66 Å²	66	66.3 Å²	66.3	33%	0.325	35%	0.347	S	S	.	.	H	α-helix	trans	-79.8	-31.4	175.6	-68.2	-157.9	-143.6	0	0	112.5	M80 E84 V85 R90	M80-M88 HydrophobicContact SD-CE 3.91Å; E84-M88 HydrophobicContact CB-CE 4.47Å; E84-M88 WeakPolarHBondContact O-CB 3.49Å; E84-M88 VanDerWaalsContact O-CG 3.3Å; E84-M88 WeakPolarHBondContact O-CG 3.43Å; E84-M88 PolarHBondContact O-N 3.41Å; V85-M88 PolarHBondContact O-N 3.16Å; M88-R90 VanDerWaalsContact C-N 3.3Å; M88-R90 HydrophobicContact CB-CG 4.13Å; M88-R90 PolarHBondContact O-N 3.24Å
89	G	83.9	Confident	88.9	Confident	13 Å²	13	64.2 Å²	64.2	13%	0.134	34%	0.337	C	S	.	.	T	Hydrogen-bonded Turn	trans	57.2	39.7	175.5	0	0	0	0	0	113.7	V85 V86 R168	V85-G89 PolarHBondContact O-N 3.25Å; V86-G89 PolarHBondContact O-N 3.01Å; G89-R168 PolarHBondContact O-NH2 3.43Å
90	R	83.7	Confident	90.7	Very high	215 Å²	215	56.8 Å²	56.8	81%	0.811	30%	0.297	S	S	*	.			trans	-88.6	-31.9	-179.5	-65.5	-178.7	-172.6	-169.2	6.8	112.8	M88	M88-R90 VanDerWaalsContact C-N 3.3Å; M88-R90 HydrophobicContact CB-CG 4.13Å; M88-R90 PolarHBondContact O-N 3.24Å
91	S	82.1	Confident	91.6	Very high	68 Å²	68	52.2 Å²	52.2	48%	0.476	27%	0.274	S	S	.	.	S	Bend	trans	-91.1	160.7	174.5	-54.9	0	0	0	0	110.8
92	A	88.2	Confident	92	Very high	65 Å²	65	55 Å²	55	54%	0.537	28%	0.284	S	S	.	.			trans	-70.3	135.1	167.4	0	0	0	0	0	109.6	Q94 S95 V96	A92-Q94 PolarHBondContact O-N 3.34Å; A92-Q94 VanDerWaalsContact O-N 3.17Å; A92-S95 WeakPolarHBondContact O-CB 3.5Å; A92-S95 PolarHBondContact O-N 2.93Å; A92-V96 PolarHBondContact O-N 3.14Å
93	T	90.6	Very high	92.2	Very high	38 Å²	38	56.4 Å²	56.4	23%	0.233	30%	0.297	C	S	.	.	H	α-helix	trans	-54.8	-38.1	-176	-45.9	0	0	0	0	112.8	V96 V97 D175 F176	T93-V96 PolarHBondContact O-N 3.04Å; T93-V97 PolarHBondContact O-N 2.9Å; T93-V97 VanDerWaalsContact O-N 3.15Å; T93-D175 HydrophobicContact CG2-CB 4.27Å; T93-F176 VanDerWaalsContact CG2-CA 3.48Å; T93-F176 HydrophobicContact CG2-CB 4Å; T93-F176 HydrophobicContact CG2-CD2 4.41Å
94	Q	92.6	Very high	92.3	Very high	97 Å²	97	55.3 Å²	55.3	45%	0.453	29%	0.292	S	S	.	.	H	α-helix	trans	-62.6	-41.3	175.6	176.2	175.5	-18.7	0	0	112.6	A92 V96 V97 D98 V179	A92-Q94 PolarHBondContact O-N 3.34Å; A92-Q94 VanDerWaalsContact O-N 3.17Å; Q94-V96 VanDerWaalsContact C-N 3.28Å; Q94-V96 PolarHBondContact O-N 3Å; Q94-V97 CarbonylContact O-C 3.55Å; Q94-V97 WeakPolarHBondContact O-CB 3.48Å; Q94-V97 PolarHBondContact O-N 2.89Å; Q94-V97 VanDerWaalsContact O-N 3.11Å; Q94-D98 VanDerWaalsContact CG-OD2 3.26Å; Q94-D98 WeakPolarHBondContact CG-OD2 3.42Å; Q94-D98 PolarHBondContact NE2-OD2 3.24Å; Q94-D98 WeakPolarHBondContact O-CB 3.41Å; Q94-D98 PolarHBondContact O-N 3.12Å; Q94-V179 HydrophobicContact CB-CG1 4.03Å; Q94-V179 HydrophobicContact CG-CG1 4.43Å
95	S	93.8	Very high	92.3	Very high	53 Å²	53	57.4 Å²	57.4	37%	0.371	30%	0.3	S	S	.	.	H	α-helix	trans	-61.5	-38.7	-180	-54.2	0	0	0	0	112	A92 V97 D98 E99	A92-S95 WeakPolarHBondContact O-CB 3.5Å; A92-S95 PolarHBondContact O-N 2.93Å; S95-V97 VanDerWaalsContact C-N 3.35Å; S95-D98 PolarHBondContact O-N 3.16Å; S95-E99 WeakPolarHBondContact O-CB 3.45Å; S95-E99 VanDerWaalsContact O-CG 3.22Å; S95-E99 WeakPolarHBondContact O-CG 3.28Å; S95-E99 PolarHBondContact O-N 3.16Å
96	V	94.4	Very high	92.4	Very high	12 Å²	12	62.9 Å²	62.9	7%	0.073	32%	0.323	C	S	.	.	H	α-helix	trans	-67	-37.1	176.3	-172.8	0	0	0	0	111.3	L82 V85 A92 T93 Q94 W100 F176	L82-V96 HydrophobicContact CD1-CG1 3.43Å; L82-V96 VanDerWaalsContact CD1-CG1 3.43Å; V85-V96 HydrophobicContact CG1-CG1 3.99Å; V85-V96 HydrophobicContact CG1-CG2 3.68Å; A92-V96 PolarHBondContact O-N 3.14Å; T93-V96 PolarHBondContact O-N 3.04Å; Q94-V96 VanDerWaalsContact C-N 3.28Å; Q94-V96 PolarHBondContact O-N 3Å; V96-W100 WeakPolarHBondContact O-CB 3.4Å; V96-W100 PolarHBondContact O-N 3.06Å; V96-F176 HydrophobicContact CG1-CE2 4.25Å
97	V	96.1	Very high	92.5	Very high	0 Å²	0	66 Å²	66	0%	0	34%	0.34	C	S	.	.	H	α-helix	trans	-67.9	-45.1	173.6	163.1	0	0	0	0	111.6	T93 Q94 S95 E99 W100 I101 F176 V179 L180 Q183	T93-V97 PolarHBondContact O-N 2.9Å; T93-V97 VanDerWaalsContact O-N 3.15Å; Q94-V97 CarbonylContact O-C 3.55Å; Q94-V97 WeakPolarHBondContact O-CB 3.48Å; Q94-V97 PolarHBondContact O-N 2.89Å; Q94-V97 VanDerWaalsContact O-N 3.11Å; S95-V97 VanDerWaalsContact C-N 3.35Å; V97-E99 VanDerWaalsContact C-N 3.33Å; V97-E99 PolarHBondContact O-N 3.31Å; V97-W100 PolarHBondContact O-N 3.32Å; V97-I101 HydrophobicContact CG1-CD1 3.68Å; V97-I101 HydrophobicContact CG1-CG1 4.36Å; V97-I101 WeakPolarHBondContact O-CB 3.31Å; V97-I101 VanDerWaalsContact O-CG1 3.3Å; V97-I101 WeakPolarHBondContact O-CG1 3.41Å; V97-I101 PolarHBondContact O-N 3.28Å; V97-F176 HydrophobicContact CG2-CD2 3.69Å; V97-F176 HydrophobicContact CG2-CE2 3.6Å; V97-F176 HydrophobicContact CG2-CZ 4.41Å; V97-V179 HydrophobicContact CB-CG1 4.18Å; V97-V179 HydrophobicContact CG1-CG1 4.24Å; V97-V179 HydrophobicContact CG2-CB 4.3Å; V97-V179 HydrophobicContact CG2-CG1 4.05Å; V97-L180 HydrophobicContact CG1-CB 4.39Å; V97-L180 HydrophobicContact CG1-CD1 4.16Å; V97-L180 HydrophobicContact CG2-CB 4.08Å; V97-Q183 HydrophobicContact CG1-CB 4.05Å; V97-Q183 HydrophobicContact CG1-CG 3.8Å
98	D	95.1	Very high	92.6	Very high	63 Å²	63	68.7 Å²	68.7	34%	0.337	35%	0.348	S	S	.	.	H	α-helix	trans	-65.8	-37.6	-179.2	-65.7	-13.3	0	0	0	110.6	Q94 S95 E102	Q94-D98 VanDerWaalsContact CG-OD2 3.26Å; Q94-D98 WeakPolarHBondContact CG-OD2 3.42Å; Q94-D98 PolarHBondContact NE2-OD2 3.24Å; Q94-D98 WeakPolarHBondContact O-CB 3.41Å; Q94-D98 PolarHBondContact O-N 3.12Å; S95-D98 PolarHBondContact O-N 3.16Å; D98-E102 PolarHBondContact O-N 3.17Å; D98-E102 VanDerWaalsContact O-N 3.09Å
99	E	94.8	Very high	92.8	Very high	132 Å²	132	67.4 Å²	67.4	62%	0.617	34%	0.343	S	S	*	.	H	α-helix	trans	-63.2	-47.7	171.2	-75.7	165.1	-166.1	0	0	111.9	S95 V97 E102 A103	S95-E99 WeakPolarHBondContact O-CB 3.45Å; S95-E99 VanDerWaalsContact O-CG 3.22Å; S95-E99 WeakPolarHBondContact O-CG 3.28Å; S95-E99 PolarHBondContact O-N 3.16Å; V97-E99 VanDerWaalsContact C-N 3.33Å; V97-E99 PolarHBondContact O-N 3.31Å; E99-E102 PolarHBondContact O-N 3.49Å; E99-A103 PolarHBondContact O-N 3.32Å
100	W	96.3	Very high	93.2	Very high	6 Å²	6	70.8 Å²	70.8	2%	0.023	36%	0.36	C	S	.	.	H	α-helix	trans	-64.5	-38.9	176.6	-177.1	87.8	0	0	0	112.6	V96 V97 E102 A103 Y104 A111 L112 L115 L180 M194	V96-W100 WeakPolarHBondContact O-CB 3.4Å; V96-W100 PolarHBondContact O-N 3.06Å; V97-W100 PolarHBondContact O-N 3.32Å; W100-E102 VanDerWaalsContact C-N 3.3Å; W100-E102 PolarHBondContact O-N 3.01Å; W100-A103 WeakPolarHBondContact O-CB 3.49Å; W100-A103 PolarHBondContact O-N 3.35Å; W100-Y104 AromaticContact CH2-CD2 3.81Å; W100-Y104 HydrophobicContact CH2-CD2 3.81Å; W100-Y104 HydrophobicContact CH2-CG 4.04Å; W100-Y104 HydrophobicContact CZ2-CD2 4.2Å; W100-Y104 HydrophobicContact CZ3-CG 4.3Å; W100-Y104 PolarHBondContact O-N 2.97Å; W100-A111 HydrophobicContact CZ2-CB 4.08Å; W100-A111 WeakPolarHBondContact CZ2-O 3.48Å; W100-A111 PolarHBondContact NE1-O 3.5Å; W100-L112 HydrophobicContact CH2-CD2 4.49Å; W100-L112 HydrophobicContact CZ2-CD2 4.38Å; W100-L115 HydrophobicContact CH2-CD2 3.99Å; W100-L115 HydrophobicContact CZ2-CB 3.92Å; W100-L115 HydrophobicContact CZ2-CD2 3.69Å; W100-L115 HydrophobicContact CZ2-CG 4.38Å; W100-L180 HydrophobicContact CE3-CD1 3.57Å; W100-L180 HydrophobicContact CZ3-CD1 3.7Å; W100-M194 HydrophobicContact CH2-CE 3.77Å; W100-M194 HydrophobicContact CH2-CG 4.2Å; W100-M194 HydrophobicContact CH2-SD 4.13Å; W100-M194 HydrophobicContact CZ3-CE 3.81Å; W100-M194 HydrophobicContact CZ3-SD 4.18Å
101	I	96.4	Very high	93.7	Very high	15 Å²	15	60.6 Å²	60.6	8%	0.077	32%	0.323	C	S	.	.	H	α-helix	trans	-63.2	-36.3	175.7	-79.4	174.1	0	0	0	111.4	V97 K105 L180 Q183 I188	V97-I101 HydrophobicContact CG1-CD1 3.68Å; V97-I101 HydrophobicContact CG1-CG1 4.36Å; V97-I101 WeakPolarHBondContact O-CB 3.31Å; V97-I101 VanDerWaalsContact O-CG1 3.3Å; V97-I101 WeakPolarHBondContact O-CG1 3.41Å; V97-I101 PolarHBondContact O-N 3.28Å; I101-K105 VanDerWaalsContact CG2-CE 3.49Å; I101-K105 WeakPolarHBondContact O-CE 3.48Å; I101-K105 WeakPolarHBondContact O-CG 3.43Å; I101-K105 PolarHBondContact O-N 3.46Å; I101-L180 HydrophobicContact CD1-CD1 4.47Å; I101-L180 HydrophobicContact CG1-CD1 4.33Å; I101-Q183 HydrophobicContact CD1-CB 3.43Å; I101-Q183 VanDerWaalsContact CD1-CB 3.43Å; I101-Q183 HydrophobicContact CD1-CG 4.41Å; I101-I188 HydrophobicContact CG2-CD1 3.86Å
102	E	95.9	Very high	94.3	Very high	89 Å²	89	57.4 Å²	57.4	42%	0.416	30%	0.3	S	S	.	.	H	α-helix	trans	-73.9	-33.3	175.5	-165.7	57.3	-148.7	0	0	112.2	D98 E99 W100 K105 Q106	D98-E102 PolarHBondContact O-N 3.17Å; D98-E102 VanDerWaalsContact O-N 3.09Å; E99-E102 PolarHBondContact O-N 3.49Å; W100-E102 VanDerWaalsContact C-N 3.3Å; W100-E102 PolarHBondContact O-N 3.01Å; E102-K105 PolarHBondContact O-N 3.03Å; E102-K105 WeakPolarHBondContact OE2-CD 3.4Å; E102-K105 IonicContact OE2-NZ 3.45Å; E102-K105 PolarHBondContact OE2-NZ 3.03Å; E102-Q106 WeakPolarHBondContact O-CG 3.43Å; E102-Q106 PolarHBondContact O-N 3.08Å; E102-Q106 PolarHBondContact O-NE2 3.48Å
103	A	95	Very high	94.7	Very high	39 Å²	39	55.6 Å²	55.6	32%	0.322	28%	0.281	S	S	.	.	H	α-helix	trans	-62.7	-44.6	169	0	0	0	0	0	111.7	E99 W100 K105 Q106 D107 A111	E99-A103 PolarHBondContact O-N 3.32Å; W100-A103 WeakPolarHBondContact O-CB 3.49Å; W100-A103 PolarHBondContact O-N 3.35Å; A103-K105 VanDerWaalsContact C-N 3.28Å; A103-K105 PolarHBondContact O-N 3.45Å; A103-Q106 WeakPolarHBondContact O-CA 3.31Å; A103-Q106 WeakPolarHBondContact O-CB 3.43Å; A103-Q106 PolarHBondContact O-N 3.16Å; A103-D107 PolarHBondContact O-N 3.13Å; A103-A111 HydrophobicContact CB-CB 4.35Å
104	Y	96.8	Very high	94.9	Very high	4 Å²	4	57.7 Å²	57.7	2%	0.016	29%	0.288	C	S	.	.	H	α-helix	trans	-61.8	-31.2	178	-176.3	-97.2	0	0	0	113.6	W100 Q106 R108 A111 L112 I188 D191 M194	W100-Y104 AromaticContact CH2-CD2 3.81Å; W100-Y104 HydrophobicContact CH2-CD2 3.81Å; W100-Y104 HydrophobicContact CH2-CG 4.04Å; W100-Y104 HydrophobicContact CZ2-CD2 4.2Å; W100-Y104 HydrophobicContact CZ3-CG 4.3Å; W100-Y104 PolarHBondContact O-N 2.97Å; Y104-Q106 VanDerWaalsContact C-N 3.32Å; Y104-R108 HydrophobicContact CD1-CG 4.44Å; Y104-R108 HydrophobicContact CD2-CB 4.17Å; Y104-R108 HydrophobicContact CD2-CG 4.23Å; Y104-R108 HydrophobicContact CE1-CG 4.03Å; Y104-R108 HydrophobicContact CE2-CB 3.69Å; Y104-R108 HydrophobicContact CE2-CG 3.77Å; Y104-R108 WeakPolarHBondContact O-CG 3.27Å; Y104-A111 HydrophobicContact CD2-CB 4.05Å; Y104-A111 HydrophobicContact CG-CB 4.45Å; Y104-L112 HydrophobicContact CD2-CG 4.28Å; Y104-L112 HydrophobicContact CE2-CD1 4Å; Y104-L112 HydrophobicContact CE2-CD2 4.31Å; Y104-L112 HydrophobicContact CE2-CG 3.83Å; Y104-I188 HydrophobicContact CD1-CD1 4.1Å; Y104-I188 HydrophobicContact CD1-CG1 4.36Å; Y104-I188 HydrophobicContact CD1-CG2 3.92Å; Y104-I188 HydrophobicContact CE1-CG1 4.41Å; Y104-I188 HydrophobicContact CE1-CG2 3.6Å; Y104-D191 VanDerWaalsContact CE1-OD2 3.31Å; Y104-D191 WeakPolarHBondContact CE1-OD2 3.45Å; Y104-D191 PolarHBondContact OH-OD1 2.98Å; Y104-D191 PolarHBondContact OH-OD2 2.94Å; Y104-M194 HydrophobicContact CE2-CB 4.37Å
105	K	94.3	Very high	95.1	Very high	126 Å²	126	53.1 Å²	53.1	55%	0.548	27%	0.267	S	S	.	.	H	α-helix	trans	-71.1	-25.2	172	-69.5	172.8	-140	157.5	0	113.3	I101 E102 A103	I101-K105 VanDerWaalsContact CG2-CE 3.49Å; I101-K105 WeakPolarHBondContact O-CE 3.48Å; I101-K105 WeakPolarHBondContact O-CG 3.43Å; I101-K105 PolarHBondContact O-N 3.46Å; E102-K105 PolarHBondContact O-N 3.03Å; E102-K105 WeakPolarHBondContact OE2-CD 3.4Å; E102-K105 IonicContact OE2-NZ 3.45Å; E102-K105 PolarHBondContact OE2-NZ 3.03Å; A103-K105 VanDerWaalsContact C-N 3.28Å; A103-K105 PolarHBondContact O-N 3.45Å
106	Q	95.8	Very high	95.2	Very high	152 Å²	152	51 Å²	51	71%	0.71	25%	0.251	S	S	*	.	H	α-helix	trans	-86.6	-47.3	179.5	-68	171.3	45.2	0	0	111.3	E102 A103 Y104	E102-Q106 WeakPolarHBondContact O-CG 3.43Å; E102-Q106 PolarHBondContact O-N 3.08Å; E102-Q106 PolarHBondContact O-NE2 3.48Å; A103-Q106 WeakPolarHBondContact O-CA 3.31Å; A103-Q106 WeakPolarHBondContact O-CB 3.43Å; A103-Q106 PolarHBondContact O-N 3.16Å; Y104-Q106 VanDerWaalsContact C-N 3.32Å
107	D	95	Very high	95.2	Very high	76 Å²	76	51.3 Å²	51.3	41%	0.406	25%	0.253	S	S	.	.			trans	-148	116	173.7	-167.9	-47.7	0	0	0	110.6	A103 D109 V110 A111	A103-D107 PolarHBondContact O-N 3.13Å; D107-D109 WeakPolarHBondContact OD1-CB 3.44Å; D107-D109 PolarHBondContact OD1-N 2.99Å; D107-V110 HydrophobicContact CB-CB 4.13Å; D107-V110 HydrophobicContact CB-CG2 4.19Å; D107-V110 PolarHBondContact OD1-N 3.24Å; D107-A111 WeakPolarHBondContact O-CB 3.2Å; D107-A111 PolarHBondContact O-N 3.34Å
108	R	94.6	Very high	95.3	Very high	113 Å²	113	51.4 Å²	51.4	43%	0.426	25%	0.253	S	S	.	.	H	α-helix	trans	-72.3	-38.4	-177.9	-63.9	-176.4	174.4	-158.1	-6.2	112.7	Y104 L112 D191 Y193	Y104-R108 HydrophobicContact CD1-CG 4.44Å; Y104-R108 HydrophobicContact CD2-CB 4.17Å; Y104-R108 HydrophobicContact CD2-CG 4.23Å; Y104-R108 HydrophobicContact CE1-CG 4.03Å; Y104-R108 HydrophobicContact CE2-CB 3.69Å; Y104-R108 HydrophobicContact CE2-CG 3.77Å; Y104-R108 WeakPolarHBondContact O-CG 3.27Å; R108-L112 WeakPolarHBondContact O-CB 3.31Å; R108-L112 WeakPolarHBondContact O-CG 3.5Å; R108-L112 PolarHBondContact O-N 2.91Å; R108-D191 IonicContact CZ-OD2 2.69Å; R108-D191 IonicContact NE-OD2 3.96Å; R108-D191 IonicContact NH1-OD2 2.83Å; R108-D191 PolarHBondContact NH1-OD2 2.93Å; R108-D191 IonicContact NH2-OD2 3.81Å; R108-D191 PolarHBondContact NH2-OD2 3.12Å; R108-Y193 HydrophobicContact CB-CD1 4.21Å; R108-Y193 HydrophobicContact CB-CE1 3.96Å
109	D	93.3	Very high	95.4	Very high	40 Å²	40	48.8 Å²	48.8	21%	0.214	24%	0.239	C	C	.	.	H	α-helix	trans	-65.5	-47.2	-178.2	-80.2	17.2	0	0	0	109.5	D107 L113 F134 R135 Y193	D107-D109 WeakPolarHBondContact OD1-CB 3.44Å; D107-D109 PolarHBondContact OD1-N 2.99Å; D109-L113 VanDerWaalsContact O-CB 3.3Å; D109-L113 WeakPolarHBondContact O-CB 3.49Å; D109-L113 PolarHBondContact O-N 3.49Å; D109-F134 HydrophobicContact CB-CE1 4.2Å; D109-R135 IonicContact OD2-CZ 3.5Å; D109-R135 IonicContact OD2-NE 3.83Å; D109-R135 PolarHBondContact OD2-NE 3.24Å; D109-R135 IonicContact OD2-NH2 3.63Å; D109-R135 PolarHBondContact OD2-NH2 2.67Å; D109-Y193 PolarHBondContact OD1-OH 3.36Å
110	V	93.1	Very high	95.5	Very high	83 Å²	83	42.5 Å²	42.5	50%	0.503	21%	0.209	S	C	.	.	H	α-helix	trans	-66.8	-44.6	-177.2	176.3	0	0	0	0	111.4	D107 L113 E114	D107-V110 HydrophobicContact CB-CB 4.13Å; D107-V110 HydrophobicContact CB-CG2 4.19Å; D107-V110 PolarHBondContact OD1-N 3.24Å; V110-L113 PolarHBondContact O-N 2.91Å; V110-E114 PolarHBondContact O-N 2.92Å; V110-E114 VanDerWaalsContact O-N 3.09Å
111	A	94.3	Very high	95.5	Very high	2 Å²	2	44.1 Å²	44.1	2%	0.017	22%	0.217	C	C	.	.	H	α-helix	trans	-68.5	-37.6	179.2	0	0	0	0	0	112.7	W100 A103 Y104 D107 E114 L115	W100-A111 HydrophobicContact CZ2-CB 4.08Å; W100-A111 WeakPolarHBondContact CZ2-O 3.48Å; W100-A111 PolarHBondContact NE1-O 3.5Å; A103-A111 HydrophobicContact CB-CB 4.35Å; Y104-A111 HydrophobicContact CD2-CB 4.05Å; Y104-A111 HydrophobicContact CG-CB 4.45Å; D107-A111 WeakPolarHBondContact O-CB 3.2Å; D107-A111 PolarHBondContact O-N 3.34Å; A111-E114 PolarHBondContact O-N 3.08Å; A111-L115 PolarHBondContact O-N 3.23Å; A111-L115 VanDerWaalsContact O-N 3.09Å
112	L	95.2	Very high	95.5	Very high	0 Å²	0	43.4 Å²	43.4	0%	0	21%	0.214	C	C	.	.	H	α-helix	trans	-67.5	-38.3	172.1	-75.5	173.1	0	0	0	112	W100 Y104 R108 E114 L115 I116 F134 Y193 M194 T197 V198	W100-L112 HydrophobicContact CH2-CD2 4.49Å; W100-L112 HydrophobicContact CZ2-CD2 4.38Å; Y104-L112 HydrophobicContact CD2-CG 4.28Å; Y104-L112 HydrophobicContact CE2-CD1 4Å; Y104-L112 HydrophobicContact CE2-CD2 4.31Å; Y104-L112 HydrophobicContact CE2-CG 3.83Å; R108-L112 WeakPolarHBondContact O-CB 3.31Å; R108-L112 WeakPolarHBondContact O-CG 3.5Å; R108-L112 PolarHBondContact O-N 2.91Å; L112-E114 VanDerWaalsContact C-N 3.27Å; L112-E114 PolarHBondContact O-N 2.8Å; L112-L115 HydrophobicContact CD2-CD2 4.45Å; L112-L115 PolarHBondContact O-N 3.45Å; L112-L115 VanDerWaalsContact O-N 3.12Å; L112-I116 WeakPolarHBondContact O-CB 3.17Å; L112-I116 WeakPolarHBondContact O-CG1 3.39Å; L112-I116 PolarHBondContact O-N 3.35Å; L112-F134 HydrophobicContact CB-CZ 4.19Å; L112-Y193 HydrophobicContact CD1-CD1 3.67Å; L112-Y193 HydrophobicContact CD1-CE1 3.35Å; L112-M194 HydrophobicContact CD2-CG 4.09Å; L112-T197 HydrophobicContact CD1-CG2 4.29Å; L112-V198 HydrophobicContact CD2-CG2 4.5Å
113	L	95.2	Very high	95.6	Very high	28 Å²	28	39.2 Å²	39.2	15%	0.147	19%	0.194	C	C	.	.	H	α-helix	trans	-59.9	-38.6	175.1	-173.7	63.7	0	0	0	111.9	D109 V110 N117 V129 E131 F134	D109-L113 VanDerWaalsContact O-CB 3.3Å; D109-L113 WeakPolarHBondContact O-CB 3.49Å; D109-L113 PolarHBondContact O-N 3.49Å; V110-L113 PolarHBondContact O-N 2.91Å; L113-N117 WeakPolarHBondContact O-CB 3.48Å; L113-N117 PolarHBondContact O-N 3.24Å; L113-N117 PolarHBondContact O-ND2 3.04Å; L113-V129 HydrophobicContact CD1-CB 4.19Å; L113-V129 HydrophobicContact CD1-CG1 3.95Å; L113-V129 WeakPolarHBondContact CD1-O 3.5Å; L113-E131 HydrophobicContact CD2-CB 4.02Å; L113-F134 HydrophobicContact CD1-CB 3.85Å; L113-F134 HydrophobicContact CD1-CG 4.31Å
114	E	95.5	Very high	95.6	Very high	81 Å²	81	38.6 Å²	38.6	38%	0.379	19%	0.192	S	C	.	.	H	α-helix	trans	-64.1	-46	171.8	-177	174.8	-144.7	0	0	111.9	L82 V110 A111 L112 I116 N117 F118	L82-E114 HydrophobicContact CB-CG 4.1Å; L82-E114 HydrophobicContact CD2-CG 4.23Å; V110-E114 PolarHBondContact O-N 2.92Å; V110-E114 VanDerWaalsContact O-N 3.09Å; A111-E114 PolarHBondContact O-N 3.08Å; L112-E114 VanDerWaalsContact C-N 3.27Å; L112-E114 PolarHBondContact O-N 2.8Å; E114-I116 VanDerWaalsContact C-N 3.34Å; E114-I116 PolarHBondContact O-N 2.9Å; E114-N117 PolarHBondContact O-N 3.29Å; E114-F118 WeakPolarHBondContact O-CB 3.36Å; E114-F118 PolarHBondContact O-N 3.12Å
115	L	96.2	Very high	95.5	Very high	2 Å²	2	38.6 Å²	38.6	1%	0.01	19%	0.192	C	C	.	.	H	α-helix	trans	-65.8	-35.1	-179.7	-174.6	61	0	0	0	112.7	W100 A111 L112 F118 F119 F176 L180 M194 V198	W100-L115 HydrophobicContact CH2-CD2 3.99Å; W100-L115 HydrophobicContact CZ2-CB 3.92Å; W100-L115 HydrophobicContact CZ2-CD2 3.69Å; W100-L115 HydrophobicContact CZ2-CG 4.38Å; A111-L115 PolarHBondContact O-N 3.23Å; A111-L115 VanDerWaalsContact O-N 3.09Å; L112-L115 HydrophobicContact CD2-CD2 4.45Å; L112-L115 PolarHBondContact O-N 3.45Å; L112-L115 VanDerWaalsContact O-N 3.12Å; L115-F118 HydrophobicContact CD1-CD1 4.09Å; L115-F118 WeakPolarHBondContact O-CB 3.42Å; L115-F118 PolarHBondContact O-N 3.17Å; L115-F119 HydrophobicContact CD1-CE2 3.9Å; L115-F119 HydrophobicContact CD1-CZ 4.27Å; L115-F119 HydrophobicContact CG-CD2 4.43Å; L115-F119 HydrophobicContact CG-CE2 3.88Å; L115-F119 WeakPolarHBondContact O-CD2 3.32Å; L115-F119 PolarHBondContact O-N 3.06Å; L115-F176 HydrophobicContact CD1-CE1 3.9Å; L115-F176 HydrophobicContact CD1-CZ 4.39Å; L115-L180 HydrophobicContact CD1-CD2 4.15Å; L115-L180 HydrophobicContact CD2-CD2 4.09Å; L115-M194 HydrophobicContact CD2-CE 4.16Å; L115-V198 HydrophobicContact CD2-CG2 3.67Å; L115-V198 HydrophobicContact CG-CG2 4.46Å
116	I	95.8	Very high	95.4	Very high	8 Å²	8	37.5 Å²	37.5	4%	0.041	19%	0.187	C	C	.	.	H	α-helix	trans	-62.4	-51.9	171.6	-72	168	0	0	0	109.9	L112 E114 F118 F119 I120 V129 F134 T197 L201	L112-I116 WeakPolarHBondContact O-CB 3.17Å; L112-I116 WeakPolarHBondContact O-CG1 3.39Å; L112-I116 PolarHBondContact O-N 3.35Å; E114-I116 VanDerWaalsContact C-N 3.34Å; E114-I116 PolarHBondContact O-N 2.9Å; I116-F118 VanDerWaalsContact C-N 3.27Å; I116-F118 PolarHBondContact O-N 2.92Å; I116-F119 PolarHBondContact O-N 3.23Å; I116-I120 WeakPolarHBondContact O-CG1 3.24Å; I116-I120 PolarHBondContact O-N 3.43Å; I116-V129 HydrophobicContact CG2-CB 4.14Å; I116-V129 HydrophobicContact CG2-CG1 4.35Å; I116-V129 HydrophobicContact CG2-CG2 3.86Å; I116-F134 HydrophobicContact CD1-CD2 3.48Å; I116-F134 VanDerWaalsContact CD1-CD2 3.48Å; I116-F134 HydrophobicContact CD1-CE2 3.4Å; I116-F134 HydrophobicContact CD1-CG 4.47Å; I116-F134 HydrophobicContact CD1-CZ 4.33Å; I116-T197 HydrophobicContact CD1-CG2 4.13Å; I116-L201 HydrophobicContact CB-CD2 4.01Å; I116-L201 HydrophobicContact CG1-CD2 3.78Å; I116-L201 HydrophobicContact CG2-CD2 3.8Å
117	N	95.7	Very high	95.2	Very high	19 Å²	19	30.8 Å²	30.8	10%	0.102	16%	0.158	C	C	.	.	H	α-helix	trans	-62.3	-34.1	178	-83	-70.7	0	0	0	112.3	L113 E114 I120 Q121 A128 V129	L113-N117 WeakPolarHBondContact O-CB 3.48Å; L113-N117 PolarHBondContact O-N 3.24Å; L113-N117 PolarHBondContact O-ND2 3.04Å; E114-N117 PolarHBondContact O-N 3.29Å; N117-I120 PolarHBondContact O-N 3.24Å; N117-Q121 WeakPolarHBondContact O-CB 3.48Å; N117-Q121 VanDerWaalsContact O-CG 3.29Å; N117-Q121 WeakPolarHBondContact O-CG 3.4Å; N117-Q121 PolarHBondContact O-N 2.97Å; N117-A128 VanDerWaalsContact OD1-CA 3.25Å; N117-A128 WeakPolarHBondContact OD1-CA 3.44Å; N117-V129 PolarHBondContact ND2-O 2.93Å; N117-V129 PolarHBondContact OD1-N 2.87Å
118	F	97.5	Very high	95.1	Very high	2 Å²	2	29.8 Å²	29.8	1%	0.009	16%	0.161	C	C	.	.	H	α-helix	trans	-58.3	-47.2	173	168.2	-104.6	0	0	0	112.3	L82 F83 V86 E114 L115 I116 I120 Q121 C122 F173 F176	L82-F118 HydrophobicContact CB-CB 4.32Å; L82-F118 HydrophobicContact CB-CD2 4.1Å; L82-F118 HydrophobicContact CD2-CB 3.9Å; L82-F118 HydrophobicContact CD2-CD2 4.15Å; L82-F118 HydrophobicContact CD2-CG 3.95Å; L82-F118 HydrophobicContact CG-CB 4.21Å; L82-F118 HydrophobicContact CG-CD2 3.67Å; L82-F118 HydrophobicContact CG-CE2 4.19Å; L82-F118 HydrophobicContact CG-CG 4.01Å; F83-F118 HydrophobicContact CB-CD2 4.21Å; V86-F118 HydrophobicContact CB-CE2 3.97Å; V86-F118 HydrophobicContact CG1-CE2 4.24Å; V86-F118 HydrophobicContact CG1-CZ 4.37Å; V86-F118 HydrophobicContact CG2-CE2 3.78Å; V86-F118 HydrophobicContact CG2-CZ 4.17Å; E114-F118 WeakPolarHBondContact O-CB 3.36Å; E114-F118 PolarHBondContact O-N 3.12Å; L115-F118 HydrophobicContact CD1-CD1 4.09Å; L115-F118 WeakPolarHBondContact O-CB 3.42Å; L115-F118 PolarHBondContact O-N 3.17Å; I116-F118 VanDerWaalsContact C-N 3.27Å; I116-F118 PolarHBondContact O-N 2.92Å; F118-I120 PolarHBondContact O-N 2.99Å; F118-Q121 PolarHBondContact O-N 3.49Å; F118-C122 WeakPolarHBondContact CE2-SG 3.27Å; F118-C122 VanDerWaalsContact O-CB 3.27Å; F118-C122 WeakPolarHBondContact O-CB 3.34Å; F118-C122 PolarHBondContact O-N 2.84Å; F118-C122 PolarHBondContact O-SG 2.84Å; F118-F173 AromaticContact CE1-CD2 3.99Å; F118-F173 HydrophobicContact CE1-CD2 3.99Å; F118-F173 AromaticContact CE1-CE2 3.86Å; F118-F173 HydrophobicContact CE1-CE2 3.86Å; F118-F173 AromaticContact CZ-CD2 3.66Å; F118-F173 HydrophobicContact CZ-CD2 3.66Å; F118-F173 AromaticContact CZ-CE2 3.99Å; F118-F173 HydrophobicContact CZ-CE2 3.99Å; F118-F176 HydrophobicContact CD1-CD1 4.44Å; F118-F176 HydrophobicContact CD1-CE1 4.16Å; F118-F176 AromaticContact CE1-CD1 3.55Å; F118-F176 HydrophobicContact CE1-CD1 3.55Å; F118-F176 AromaticContact CE1-CE1 3.7Å; F118-F176 HydrophobicContact CE1-CE1 3.7Å; F118-F176 AromaticContact CZ-CD1 3.66Å; F118-F176 HydrophobicContact CZ-CD1 3.66Å; F118-F176 HydrophobicContact CZ-CE1 4.08Å; F118-F176 HydrophobicContact CZ-CG 4.24Å
119	F	97.7	Very high	95.1	Very high	7 Å²	7	24.7 Å²	24.7	3%	0.031	14%	0.142	C	C	.	.	H	α-helix	trans	-66.8	-36.2	178	-69.9	-59.4	0	0	0	113	L115 I116 S123 F173 I177 V198 L202 A220	L115-F119 HydrophobicContact CD1-CE2 3.9Å; L115-F119 HydrophobicContact CD1-CZ 4.27Å; L115-F119 HydrophobicContact CG-CD2 4.43Å; L115-F119 HydrophobicContact CG-CE2 3.88Å; L115-F119 WeakPolarHBondContact O-CD2 3.32Å; L115-F119 PolarHBondContact O-N 3.06Å; I116-F119 PolarHBondContact O-N 3.23Å; F119-S123 PolarHBondContact O-N 3Å; F119-S123 PolarHBondContact O-OG 3.35Å; F119-F173 HydrophobicContact CD1-CE2 4.07Å; F119-F173 HydrophobicContact CD1-CZ 4.14Å; F119-F173 HydrophobicContact CE1-CE2 4.24Å; F119-F173 HydrophobicContact CE1-CZ 4.31Å; F119-I177 HydrophobicContact CE1-CD1 3.91Å; F119-I177 HydrophobicContact CE1-CG1 4.17Å; F119-I177 HydrophobicContact CZ-CG1 4.44Å; F119-V198 HydrophobicContact CE2-CG1 3.99Å; F119-V198 HydrophobicContact CZ-CG1 4.39Å; F119-L202 HydrophobicContact CB-CD2 4.45Å; F119-L202 HydrophobicContact CD1-CD2 4.01Å; F119-L202 HydrophobicContact CD2-CD2 4.24Å; F119-L202 HydrophobicContact CE1-CD2 4.3Å; F119-L202 HydrophobicContact CG-CD2 3.99Å; F119-L202 HydrophobicContact CZ-CD1 4.38Å; F119-A220 HydrophobicContact CD1-CB 4.1Å; F119-A220 HydrophobicContact CE1-CB 3.8Å
120	I	96.1	Very high	95.1	Very high	0 Å²	0	25.3 Å²	25.3	0%	0	15%	0.15	C	C	.	.	H	α-helix	trans	-64.1	-50.2	174.1	-64.4	-63	0	0	0	110.8	I116 N117 F118 C122 S123 C125 V129 M146 L205 F213	I116-I120 WeakPolarHBondContact O-CG1 3.24Å; I116-I120 PolarHBondContact O-N 3.43Å; N117-I120 PolarHBondContact O-N 3.24Å; F118-I120 PolarHBondContact O-N 2.99Å; I120-C122 PolarHBondContact O-N 3.42Å; I120-S123 WeakPolarHBondContact O-CA 3.34Å; I120-S123 VanDerWaalsContact O-CB 3.23Å; I120-S123 WeakPolarHBondContact O-CB 3.44Å; I120-S123 PolarHBondContact O-N 3.43Å; I120-C125 HydrophobicContact CG2-CB 3.67Å; I120-C125 VanDerWaalsContact CG2-SG 3.58Å; I120-V129 HydrophobicContact CG1-CG2 4.4Å; I120-M146 HydrophobicContact CD1-CB 4.33Å; I120-M146 HydrophobicContact CD1-CG 4.25Å; I120-M146 HydrophobicContact CG2-CB 4.42Å; I120-M146 HydrophobicContact CG2-CG 4.32Å; I120-M146 HydrophobicContact CG2-SD 4.09Å; I120-L205 HydrophobicContact CD1-CD1 4.24Å; I120-L205 HydrophobicContact CD1-CD2 3.87Å; I120-F213 HydrophobicContact CD1-CD1 4.34Å; I120-F213 HydrophobicContact CD1-CE1 3.78Å; I120-F213 HydrophobicContact CD1-CZ 4.35Å; I120-F213 HydrophobicContact CG2-CE1 4.21Å
121	Q	96.3	Very high	95	Very high	41 Å²	41	25.8 Å²	25.8	19%	0.192	15%	0.146	C	C	.	.	H	α-helix	trans	-67.3	-35.8	179.4	-70.1	174.4	12.9	0	0	112.8	S81 F83 N117 F118 S123 G124	S81-Q121 PolarHBondContact OG-OE1 3.02Å; F83-Q121 HydrophobicContact CB-CB 3.83Å; F83-Q121 HydrophobicContact CD1-CB 3.99Å; F83-Q121 HydrophobicContact CG-CB 3.87Å; N117-Q121 WeakPolarHBondContact O-CB 3.48Å; N117-Q121 VanDerWaalsContact O-CG 3.29Å; N117-Q121 WeakPolarHBondContact O-CG 3.4Å; N117-Q121 PolarHBondContact O-N 2.97Å; F118-Q121 PolarHBondContact O-N 3.49Å; Q121-S123 PolarHBondContact O-N 3.46Å; Q121-G124 PolarHBondContact O-N 3.12Å
122	C	97.3	Very high	94.9	Very high	0 Å²	0	32.7 Å²	32.7	0%	0	18%	0.178	C	C	.	.	H	α-helix	trans	-60.9	-23.6	171.1	-72.4	0	0	0	0	112.7	F83 F118 I120 G124 P158 F169 F173 T216	F83-C122 HydrophobicContact CD2-CB 4.48Å; F118-C122 WeakPolarHBondContact CE2-SG 3.27Å; F118-C122 VanDerWaalsContact O-CB 3.27Å; F118-C122 WeakPolarHBondContact O-CB 3.34Å; F118-C122 PolarHBondContact O-N 2.84Å; F118-C122 PolarHBondContact O-SG 2.84Å; I120-C122 PolarHBondContact O-N 3.42Å; C122-G124 VanDerWaalsContact C-N 3.29Å; C122-P158 WeakPolarHBondContact O-CB 3.49Å; C122-P158 WeakPolarHBondContact O-CG 3.31Å; C122-F169 HydrophobicContact CB-CZ 3.96Å; C122-F173 HydrophobicContact CB-CD2 4.04Å; C122-F173 HydrophobicContact CB-CE2 3.56Å; C122-F173 HydrophobicContact CB-CZ 4.21Å; C122-F173 VanDerWaalsContact SG-CD2 3.52Å; C122-F173 WeakPolarHBondContact SG-CE2 3.13Å; C122-T216 HydrophobicContact CB-CG2 3.99Å
123	S	96.9	Very high	94.8	Very high	1 Å²	1	33.4 Å²	33.4	1%	0.007	18%	0.182	C	C	.	.	T	Hydrogen-bonded Turn	trans	-82.9	-2.8	174.8	-50.7	0	0	0	0	113.2	F119 I120 Q121 F150 Y157 A212 F213 T216	F119-S123 PolarHBondContact O-N 3Å; F119-S123 PolarHBondContact O-OG 3.35Å; I120-S123 WeakPolarHBondContact O-CA 3.34Å; I120-S123 VanDerWaalsContact O-CB 3.23Å; I120-S123 WeakPolarHBondContact O-CB 3.44Å; I120-S123 PolarHBondContact O-N 3.43Å; Q121-S123 PolarHBondContact O-N 3.46Å; S123-F150 WeakPolarHBondContact O-CZ 3.36Å; S123-Y157 WeakPolarHBondContact O-CB 3.42Å; S123-A212 WeakPolarHBondContact O-CB 3.42Å; S123-F213 VanDerWaalsContact CB-CD1 3.45Å; S123-T216 WeakPolarHBondContact OG-CB 3.48Å; S123-T216 WeakPolarHBondContact OG-CG2 3.49Å
124	G	94.7	Very high	94.6	Very high	26 Å²	26	33.7 Å²	33.7	27%	0.268	18%	0.182	S	C	.	.	T	Hydrogen-bonded Turn	trans	91.1	-8.2	-179.8	0	0	0	0	0	115.4	Q121 C122 K126	Q121-G124 PolarHBondContact O-N 3.12Å; C122-G124 VanDerWaalsContact C-N 3.29Å; G124-K126 PolarHBondContact O-N 2.73Å
125	C	95.6	Very high	94.4	Very high	3 Å²	3	35.8 Å²	35.8	2%	0.02	19%	0.186	C	C	.	.			trans	-63.4	130.8	173.9	176.2	0	0	0	0	110.2	I120 G127 M146 F150 F213	I120-C125 HydrophobicContact CG2-CB 3.67Å; I120-C125 VanDerWaalsContact CG2-SG 3.58Å; C125-G127 PolarHBondContact SG-N 3.08Å; C125-G127 VanDerWaalsContact SG-N 3.4Å; C125-M146 PolarHBondContact SG-O 3.35Å; C125-F150 HydrophobicContact CB-CD1 4.45Å; C125-F150 HydrophobicContact CB-CD2 3.65Å; C125-F150 HydrophobicContact CB-CE1 4.49Å; C125-F150 HydrophobicContact CB-CE2 3.71Å; C125-F150 HydrophobicContact CB-CG 4.05Å; C125-F150 HydrophobicContact CB-CZ 4.14Å; C125-F213 HydrophobicContact CB-CE1 3.77Å; C125-F213 HydrophobicContact CB-CZ 3.77Å
126	K	92.4	Very high	94.2	Very high	104 Å²	104	42.4 Å²	42.4	45%	0.452	22%	0.217	S	C	.	.			trans	-88.4	-16.2	175.1	-60.1	172	-172.7	158.9	0	113	G124 F150 D151 D153	G124-K126 PolarHBondContact O-N 2.73Å; K126-F150 PolarHBondContact N-O 3.23Å; K126-D151 HydrophobicContact CB-CB 4.3Å; K126-D151 HydrophobicContact CD-CB 4Å; K126-D151 VanDerWaalsContact CD-O 3.24Å; K126-D151 WeakPolarHBondContact CD-O 3.48Å; K126-D151 WeakPolarHBondContact CD-OD2 3.29Å; K126-D151 WeakPolarHBondContact CE-O 3.37Å; K126-D151 PolarHBondContact NZ-O 3.03Å; K126-D151 IonicContact NZ-OD2 3.54Å; K126-D151 PolarHBondContact NZ-OD2 3.04Å; K126-D153 WeakPolarHBondContact CE-OD2 3.31Å; K126-D153 IonicContact NZ-OD1 2.66Å; K126-D153 IonicContact NZ-OD2 3.31Å; K126-D153 PolarHBondContact NZ-OD2 3.39Å
127	G	90.9	Very high	94	Very high	10 Å²	10	44.5 Å²	44.5	10%	0.103	23%	0.228	C	C	.	.			trans	-62	160.2	173.1	0	0	0	0	0	113	C125 E149	C125-G127 PolarHBondContact SG-N 3.08Å; C125-G127 VanDerWaalsContact SG-N 3.4Å; G127-E149 VanDerWaalsContact CA-O 3.25Å; G127-E149 WeakPolarHBondContact CA-O 3.3Å; G127-E149 PolarHBondContact N-O 2.95Å; G127-E149 VanDerWaalsContact N-O 3.1Å
128	A	92.1	Very high	93.9	Very high	56 Å²	56	50 Å²	50	46%	0.463	25%	0.252	S	S	.	.			trans	-136.2	134.7	-178.1	0	0	0	0	0	111.8	N117	N117-A128 VanDerWaalsContact OD1-CA 3.25Å; N117-A128 WeakPolarHBondContact OD1-CA 3.44Å
129	V	94.4	Very high	93.7	Very high	5 Å²	5	51.6 Å²	51.6	3%	0.03	26%	0.261	C	S	.	.			trans	-75.3	127.5	172.7	-173.7	0	0	0	0	108.4	L113 I116 N117 I120 M133 I142 M146	L113-V129 HydrophobicContact CD1-CB 4.19Å; L113-V129 HydrophobicContact CD1-CG1 3.95Å; L113-V129 WeakPolarHBondContact CD1-O 3.5Å; I116-V129 HydrophobicContact CG2-CB 4.14Å; I116-V129 HydrophobicContact CG2-CG1 4.35Å; I116-V129 HydrophobicContact CG2-CG2 3.86Å; N117-V129 PolarHBondContact ND2-O 2.93Å; N117-V129 PolarHBondContact OD1-N 2.87Å; I120-V129 HydrophobicContact CG1-CG2 4.4Å; V129-M133 HydrophobicContact CG1-CB 4.02Å; V129-M133 HydrophobicContact CG1-CE 4.39Å; V129-I142 HydrophobicContact CG1-CD1 4.46Å; V129-I142 HydrophobicContact CG1-CG2 4.06Å; V129-I142 HydrophobicContact CG2-CG2 3.62Å; V129-M146 HydrophobicContact CG2-CG 3.95Å; V129-M146 HydrophobicContact CG2-SD 3.75Å
130	S	94	Very high	93.4	Very high	53 Å²	53	55.4 Å²	55.4	37%	0.371	29%	0.289	S	S	.	.			trans	-93.5	163.2	176.5	75.9	0	0	0	0	112.6	E132 M133 F134	S130-E132 PolarHBondContact O-N 3.04Å; S130-M133 WeakPolarHBondContact O-CB 3.24Å; S130-M133 PolarHBondContact O-N 2.99Å; S130-M133 VanDerWaalsContact O-N 3.08Å; S130-M133 WeakPolarHBondContact OG-CG 3.27Å; S130-M133 PolarHBondContact OG-N 3.15Å; S130-F134 PolarHBondContact O-N 2.63Å
131	E	92	Very high	93.3	Very high	93 Å²	93	59.4 Å²	59.4	44%	0.435	31%	0.307	S	S	.	.	H	α-helix	trans	-57	-36.7	174.8	-171.5	-174.3	179.6	0	0	112.3	L113 R135	L113-E131 HydrophobicContact CD2-CB 4.02Å; E131-R135 PolarHBondContact O-N 3.05Å; E131-R135 VanDerWaalsContact O-N 3.12Å; E131-R135 IonicContact OE1-CZ 2.74Å; E131-R135 IonicContact OE1-NH1 2.73Å; E131-R135 PolarHBondContact OE1-NH1 3.43Å; E131-R135 IonicContact OE1-NH2 3.2Å; E131-R135 PolarHBondContact OE1-NH2 3.01Å
132	E	91.8	Very high	93.1	Very high	147 Å²	147	57.7 Å²	57.7	69%	0.687	30%	0.299	S	S	*	.	H	α-helix	trans	-68.1	-37.6	175.8	-174	174.8	-160.7	0	0	112	S130 H136	S130-E132 PolarHBondContact O-N 3.04Å; E132-H136 PolarHBondContact O-N 2.96Å; E132-H136 PolarHBondContact O-ND1 3.43Å
133	M	92.1	Very high	93	Very high	16 Å²	16	58.2 Å²	58.2	8%	0.079	30%	0.302	C	S	.	.	H	α-helix	trans	-66.8	-48.3	174	-65.9	174.6	56.1	0	0	110.8	V129 S130 R135 H136 M137 I142 K145 M146	V129-M133 HydrophobicContact CG1-CB 4.02Å; V129-M133 HydrophobicContact CG1-CE 4.39Å; S130-M133 WeakPolarHBondContact O-CB 3.24Å; S130-M133 PolarHBondContact O-N 2.99Å; S130-M133 VanDerWaalsContact O-N 3.08Å; S130-M133 WeakPolarHBondContact OG-CG 3.27Å; S130-M133 PolarHBondContact OG-N 3.15Å; M133-R135 VanDerWaalsContact C-N 3.32Å; M133-R135 PolarHBondContact O-N 2.86Å; M133-H136 PolarHBondContact O-N 3.25Å; M133-M137 HydrophobicContact CB-SD 3.87Å; M133-M137 HydrophobicContact CE-CE 4.34Å; M133-M137 HydrophobicContact CE-SD 4.12Å; M133-M137 HydrophobicContact CG-SD 3.64Å; M133-M137 WeakPolarHBondContact O-CB 3.49Å; M133-M137 PolarHBondContact O-N 3.02Å; M133-I142 HydrophobicContact CE-CG1 4.4Å; M133-I142 HydrophobicContact CE-CG2 4.26Å; M133-K145 HydrophobicContact CE-CB 4.15Å; M133-K145 HydrophobicContact CE-CD 3.74Å; M133-K145 HydrophobicContact CE-CG 4.04Å; M133-K145 HydrophobicContact SD-CD 4.01Å; M133-M146 HydrophobicContact CE-CE 4.16Å
134	F	92	Very high	92.9	Very high	33 Å²	33	65.7 Å²	65.7	15%	0.145	33%	0.33	C	S	.	.	H	α-helix	trans	-60.1	-37.1	-178	176	-118.6	0	0	0	113.2	D109 L112 L113 I116 S130 T197	D109-F134 HydrophobicContact CB-CE1 4.2Å; L112-F134 HydrophobicContact CB-CZ 4.19Å; L113-F134 HydrophobicContact CD1-CB 3.85Å; L113-F134 HydrophobicContact CD1-CG 4.31Å; I116-F134 HydrophobicContact CD1-CD2 3.48Å; I116-F134 VanDerWaalsContact CD1-CD2 3.48Å; I116-F134 HydrophobicContact CD1-CE2 3.4Å; I116-F134 HydrophobicContact CD1-CG 4.47Å; I116-F134 HydrophobicContact CD1-CZ 4.33Å; S130-F134 PolarHBondContact O-N 2.63Å; F134-T197 HydrophobicContact CE2-CG2 4.05Å
135	R	90	Very high	92.9	Very high	125 Å²	125	67.4 Å²	67.4	47%	0.472	33%	0.33	S	S	.	.	H	α-helix	trans	-81.2	-17.7	178.7	-69.9	-161.3	-175	113.4	10.1	115.7	D109 E131 M133	D109-R135 IonicContact OD2-CZ 3.5Å; D109-R135 IonicContact OD2-NE 3.83Å; D109-R135 PolarHBondContact OD2-NE 3.24Å; D109-R135 IonicContact OD2-NH2 3.63Å; D109-R135 PolarHBondContact OD2-NH2 2.67Å; E131-R135 PolarHBondContact O-N 3.05Å; E131-R135 VanDerWaalsContact O-N 3.12Å; E131-R135 IonicContact OE1-CZ 2.74Å; E131-R135 IonicContact OE1-NH1 2.73Å; E131-R135 PolarHBondContact OE1-NH1 3.43Å; E131-R135 IonicContact OE1-NH2 3.2Å; E131-R135 PolarHBondContact OE1-NH2 3.01Å; M133-R135 VanDerWaalsContact C-N 3.32Å; M133-R135 PolarHBondContact O-N 2.86Å
136	H	92.3	Very high	92.9	Very high	141 Å²	141	67.3 Å²	67.3	65%	0.653	33%	0.329	S	S	*	.	H	α-helix	trans	-129.8	-17.7	-169	-53.4	105.3	0	0	0	115.8	E132 M133	E132-H136 PolarHBondContact O-N 2.96Å; E132-H136 PolarHBondContact O-ND1 3.43Å; M133-H136 PolarHBondContact O-N 3.25Å
137	M	93.1	Very high	92.9	Very high	53 Å²	53	65.1 Å²	65.1	26%	0.261	33%	0.325	S	S	.	.	S	Bend	trans	-104.3	148.9	-179.2	-64.8	177	61.3	0	0	111.5	M133 E141 I142 K145	M133-M137 HydrophobicContact CB-SD 3.87Å; M133-M137 HydrophobicContact CE-CE 4.34Å; M133-M137 HydrophobicContact CE-SD 4.12Å; M133-M137 HydrophobicContact CG-SD 3.64Å; M133-M137 WeakPolarHBondContact O-CB 3.49Å; M133-M137 PolarHBondContact O-N 3.02Å; M137-E141 WeakPolarHBondContact CA-OE2 3.47Å; M137-E141 HydrophobicContact CB-CB 4.3Å; M137-E141 HydrophobicContact CE-CB 3.61Å; M137-E141 WeakPolarHBondContact CE-O 3.45Å; M137-I142 HydrophobicContact CB-CD1 4.24Å; M137-I142 HydrophobicContact CB-CG1 3.72Å; M137-I142 HydrophobicContact CE-CG1 4.41Å; M137-K145 HydrophobicContact CE-CB 4.39Å
138	Q	93	Very high	92.9	Very high	134 Å²	134	70.4 Å²	70.4	63%	0.626	35%	0.347	S	S	*	.			trans	-80.8	155	171.4	-66.5	-62	-62.3	0	0	111.3	S140 E141 I142	Q138-S140 PolarHBondContact O-N 3.42Å; Q138-S140 VanDerWaalsContact O-N 3.12Å; Q138-E141 HydrophobicContact CB-CG 4.31Å; Q138-E141 PolarHBondContact N-OE2 2.94Å; Q138-E141 WeakPolarHBondContact O-CA 3.49Å; Q138-E141 WeakPolarHBondContact O-CB 3.43Å; Q138-E141 PolarHBondContact O-N 3.1Å; Q138-I142 PolarHBondContact O-N 3.12Å
139	N	92.3	Very high	92.9	Very high	35 Å²	35	71.5 Å²	71.5	19%	0.187	34%	0.342	C	S	.	.	H	α-helix	trans	-53.2	-37.1	-179	-84.6	-27	0	0	0	113.2	E141 I142 I143 S200 L201	N139-E141 VanDerWaalsContact C-N 3.33Å; N139-E141 PolarHBondContact O-N 3.36Å; N139-I142 PolarHBondContact O-N 3.44Å; N139-I143 WeakPolarHBondContact O-CB 3.45Å; N139-I143 VanDerWaalsContact O-CD1 3.31Å; N139-I143 WeakPolarHBondContact O-CD1 3.28Å; N139-I143 WeakPolarHBondContact O-CG1 3.43Å; N139-I143 PolarHBondContact O-N 3.47Å; N139-S200 PolarHBondContact ND2-OG 3.28Å; N139-L201 PolarHBondContact ND2-N 3.35Å
140	S	91.9	Very high	92.8	Very high	88 Å²	88	72 Å²	72	62%	0.615	34%	0.344	S	S	*	.	H	α-helix	trans	-62.6	-35.9	174.7	50.3	0	0	0	0	113.6	Q138 R144	Q138-S140 PolarHBondContact O-N 3.42Å; Q138-S140 VanDerWaalsContact O-N 3.12Å; S140-R144 WeakPolarHBondContact O-CB 3.04Å; S140-R144 PolarHBondContact O-N 2.71Å; S140-R144 VanDerWaalsContact O-N 3.13Å
141	E	93.9	Very high	92.5	Very high	83 Å²	83	74.7 Å²	74.7	39%	0.388	35%	0.354	S	S	.	.	H	α-helix	trans	-76.3	-39.6	177.6	-53.6	176.7	136.2	0	0	111.1	M137 Q138 N139 R144 K145	M137-E141 WeakPolarHBondContact CA-OE2 3.47Å; M137-E141 HydrophobicContact CB-CB 4.3Å; M137-E141 HydrophobicContact CE-CB 3.61Å; M137-E141 WeakPolarHBondContact CE-O 3.45Å; Q138-E141 HydrophobicContact CB-CG 4.31Å; Q138-E141 PolarHBondContact N-OE2 2.94Å; Q138-E141 WeakPolarHBondContact O-CA 3.49Å; Q138-E141 WeakPolarHBondContact O-CB 3.43Å; Q138-E141 PolarHBondContact O-N 3.1Å; N139-E141 VanDerWaalsContact C-N 3.33Å; N139-E141 PolarHBondContact O-N 3.36Å; E141-R144 PolarHBondContact O-N 2.89Å; E141-K145 PolarHBondContact O-N 3.43Å
142	I	93.4	Very high	92.3	Very high	5 Å²	5	75.9 Å²	75.9	3%	0.026	36%	0.36	C	S	.	.	H	α-helix	trans	-61.8	-48.8	174.3	-64.9	172.9	0	0	0	110	V129 M133 M137 Q138 N139 R144 K145 M146	V129-I142 HydrophobicContact CG1-CD1 4.46Å; V129-I142 HydrophobicContact CG1-CG2 4.06Å; V129-I142 HydrophobicContact CG2-CG2 3.62Å; M133-I142 HydrophobicContact CE-CG1 4.4Å; M133-I142 HydrophobicContact CE-CG2 4.26Å; M137-I142 HydrophobicContact CB-CD1 4.24Å; M137-I142 HydrophobicContact CB-CG1 3.72Å; M137-I142 HydrophobicContact CE-CG1 4.41Å; Q138-I142 PolarHBondContact O-N 3.12Å; N139-I142 PolarHBondContact O-N 3.44Å; I142-R144 VanDerWaalsContact C-N 3.34Å; I142-R144 PolarHBondContact O-N 3.3Å; I142-K145 PolarHBondContact O-N 3.46Å; I142-K145 VanDerWaalsContact O-N 3.14Å; I142-M146 HydrophobicContact CG2-CG 4.26Å; I142-M146 WeakPolarHBondContact O-CG 3.49Å; I142-M146 PolarHBondContact O-N 2.93Å
143	I	94.9	Very high	91.9	Very high	12 Å²	12	75.9 Å²	75.9	6%	0.062	37%	0.365	C	S	.	.	H	α-helix	trans	-63.3	-39.9	179.5	-67	162.9	0	0	0	111.1	N139 M146 T147 L201 L205	N139-I143 WeakPolarHBondContact O-CB 3.45Å; N139-I143 VanDerWaalsContact O-CD1 3.31Å; N139-I143 WeakPolarHBondContact O-CD1 3.28Å; N139-I143 WeakPolarHBondContact O-CG1 3.43Å; N139-I143 PolarHBondContact O-N 3.47Å; I143-M146 PolarHBondContact O-N 3Å; I143-T147 PolarHBondContact O-N 2.99Å; I143-T147 PolarHBondContact O-OG1 3.29Å; I143-L201 HydrophobicContact CD1-CD1 4.4Å; I143-L201 HydrophobicContact CG1-CD1 4.37Å; I143-L205 HydrophobicContact CD1-CD2 4.09Å; I143-L205 HydrophobicContact CD1-CG 3.99Å; I143-L205 HydrophobicContact CG1-CD2 3.73Å; I143-L205 HydrophobicContact CG1-CG 4.1Å; I143-L205 HydrophobicContact CG2-CD2 4.21Å
144	R	93.9	Very high	91.7	Very high	158 Å²	158	77.9 Å²	77.9	60%	0.596	38%	0.381	S	S	*	.	H	α-helix	trans	-60.8	-46.2	172.8	-176.4	172.3	65.3	96.2	-7.4	111.1	S140 E141 I142 T147 E148	S140-R144 WeakPolarHBondContact O-CB 3.04Å; S140-R144 PolarHBondContact O-N 2.71Å; S140-R144 VanDerWaalsContact O-N 3.13Å; E141-R144 PolarHBondContact O-N 2.89Å; I142-R144 VanDerWaalsContact C-N 3.34Å; I142-R144 PolarHBondContact O-N 3.3Å; R144-T147 WeakPolarHBondContact O-CA 3.26Å; R144-T147 VanDerWaalsContact O-CB 3.32Å; R144-T147 WeakPolarHBondContact O-CB 3.34Å; R144-T147 PolarHBondContact O-N 2.9Å; R144-T147 VanDerWaalsContact O-N 3.08Å; R144-E148 IonicContact CZ-OE1 2.76Å; R144-E148 IonicContact NH1-OE1 3.47Å; R144-E148 PolarHBondContact NH1-OE1 3.22Å; R144-E148 WeakPolarHBondContact O-CG 3.16Å; R144-E148 PolarHBondContact O-N 3.3Å
145	K	94.1	Very high	91.5	Very high	62 Å²	62	80 Å²	80	27%	0.27	41%	0.412	S	S	.	.	H	α-helix	trans	-65.3	-39.3	177.9	-176.7	160.3	169.5	73	0	113.1	M133 M137 E141 I142 T147 E148 E149	M133-K145 HydrophobicContact CE-CB 4.15Å; M133-K145 HydrophobicContact CE-CD 3.74Å; M133-K145 HydrophobicContact CE-CG 4.04Å; M133-K145 HydrophobicContact SD-CD 4.01Å; M137-K145 HydrophobicContact CE-CB 4.39Å; E141-K145 PolarHBondContact O-N 3.43Å; I142-K145 PolarHBondContact O-N 3.46Å; I142-K145 VanDerWaalsContact O-N 3.14Å; K145-T147 PolarHBondContact O-N 3.36Å; K145-E148 CarbonylContact O-C 3.55Å; K145-E148 PolarHBondContact O-N 2.84Å; K145-E148 VanDerWaalsContact O-N 3.13Å; K145-E149 WeakPolarHBondContact CE-OE2 3.5Å; K145-E149 IonicContact NZ-OE1 2.75Å; K145-E149 PolarHBondContact NZ-OE1 3.06Å; K145-E149 IonicContact NZ-OE2 2.68Å; K145-E149 PolarHBondContact NZ-OE2 3.26Å; K145-E149 WeakPolarHBondContact O-CB 3.42Å; K145-E149 PolarHBondContact O-N 3.41Å
146	M	95.8	Very high	91.6	Very high	0 Å²	0	78.1 Å²	78.1	0%	0	41%	0.411	C	S	.	.	H	α-helix	trans	-71.7	-11	173.1	-61.3	-68.1	88.1	0	0	113.4	I120 C125 V129 M133 I142 I143 E149 F150 F213	I120-M146 HydrophobicContact CD1-CB 4.33Å; I120-M146 HydrophobicContact CD1-CG 4.25Å; I120-M146 HydrophobicContact CG2-CB 4.42Å; I120-M146 HydrophobicContact CG2-CG 4.32Å; I120-M146 HydrophobicContact CG2-SD 4.09Å; C125-M146 PolarHBondContact SG-O 3.35Å; V129-M146 HydrophobicContact CG2-CG 3.95Å; V129-M146 HydrophobicContact CG2-SD 3.75Å; M133-M146 HydrophobicContact CE-CE 4.16Å; I142-M146 HydrophobicContact CG2-CG 4.26Å; I142-M146 WeakPolarHBondContact O-CG 3.49Å; I142-M146 PolarHBondContact O-N 2.93Å; I143-M146 PolarHBondContact O-N 3Å; M146-E149 HydrophobicContact CE-CB 4.29Å; M146-E149 WeakPolarHBondContact CE-OE2 3.46Å; M146-F150 PolarHBondContact O-N 3.36Å; M146-F213 HydrophobicContact CB-CE2 4.49Å; M146-F213 HydrophobicContact CB-CZ 3.93Å; M146-F213 WeakPolarHBondContact O-CZ 3.3Å
147	T	92.2	Very high	91.7	Very high	58 Å²	58	71.8 Å²	71.8	36%	0.356	38%	0.382	S	S	.	.	H	α-helix	trans	-85.7	-38.6	166	-53.5	0	0	0	0	111.1	I143 R144 K145 E149 V210	I143-T147 PolarHBondContact O-N 2.99Å; I143-T147 PolarHBondContact O-OG1 3.29Å; R144-T147 WeakPolarHBondContact O-CA 3.26Å; R144-T147 VanDerWaalsContact O-CB 3.32Å; R144-T147 WeakPolarHBondContact O-CB 3.34Å; R144-T147 PolarHBondContact O-N 2.9Å; R144-T147 VanDerWaalsContact O-N 3.08Å; K145-T147 PolarHBondContact O-N 3.36Å; T147-E149 VanDerWaalsContact C-N 3.29Å; T147-E149 PolarHBondContact O-N 2.79Å; T147-V210 HydrophobicContact CG2-CG2 3.56Å
148	E	91.8	Very high	91.9	Very high	122 Å²	122	69.6 Å²	69.6	57%	0.57	37%	0.371	S	S	*	.	H	α-helix	trans	-67.1	-28.5	172.8	-67.7	168.8	-164.3	0	0	112.4	R144 K145	R144-E148 IonicContact CZ-OE1 2.76Å; R144-E148 IonicContact NH1-OE1 3.47Å; R144-E148 PolarHBondContact NH1-OE1 3.22Å; R144-E148 WeakPolarHBondContact O-CG 3.16Å; R144-E148 PolarHBondContact O-N 3.3Å; K145-E148 CarbonylContact O-C 3.55Å; K145-E148 PolarHBondContact O-N 2.84Å; K145-E148 VanDerWaalsContact O-N 3.13Å
149	E	92.9	Very high	92	Very high	78 Å²	78	64 Å²	64	36%	0.364	35%	0.346	S	S	.	.	T	Hydrogen-bonded Turn	trans	-111.6	28.5	-179.3	-63.3	179.2	155.7	0	0	112.8	G127 K145 M146 T147	G127-E149 VanDerWaalsContact CA-O 3.25Å; G127-E149 WeakPolarHBondContact CA-O 3.3Å; G127-E149 PolarHBondContact N-O 2.95Å; G127-E149 VanDerWaalsContact N-O 3.1Å; K145-E149 WeakPolarHBondContact CE-OE2 3.5Å; K145-E149 IonicContact NZ-OE1 2.75Å; K145-E149 PolarHBondContact NZ-OE1 3.06Å; K145-E149 IonicContact NZ-OE2 2.68Å; K145-E149 PolarHBondContact NZ-OE2 3.26Å; K145-E149 WeakPolarHBondContact O-CB 3.42Å; K145-E149 PolarHBondContact O-N 3.41Å; M146-E149 HydrophobicContact CE-CB 4.29Å; M146-E149 WeakPolarHBondContact CE-OE2 3.46Å; T147-E149 VanDerWaalsContact C-N 3.29Å; T147-E149 PolarHBondContact O-N 2.79Å
150	F	91.6	Very high	92.1	Very high	16 Å²	16	64.4 Å²	64.4	7%	0.07	35%	0.349	C	S	.	.			trans	-68.2	-39.9	-178.6	-160.1	-73.6	0	0	0	112.7	S123 C125 K126 M146 E152 V210 A212 F213	S123-F150 WeakPolarHBondContact O-CZ 3.36Å; C125-F150 HydrophobicContact CB-CD1 4.45Å; C125-F150 HydrophobicContact CB-CD2 3.65Å; C125-F150 HydrophobicContact CB-CE1 4.49Å; C125-F150 HydrophobicContact CB-CE2 3.71Å; C125-F150 HydrophobicContact CB-CG 4.05Å; C125-F150 HydrophobicContact CB-CZ 4.14Å; K126-F150 PolarHBondContact N-O 3.23Å; M146-F150 PolarHBondContact O-N 3.36Å; F150-E152 HydrophobicContact CD1-CB 3.86Å; F150-E152 WeakPolarHBondContact CD1-OE2 3.4Å; F150-E152 HydrophobicContact CE1-CB 4.12Å; F150-V210 HydrophobicContact CE2-CG1 4.14Å; F150-A212 HydrophobicContact CE2-CB 4.15Å; F150-A212 HydrophobicContact CZ-CB 3.75Å; F150-F213 HydrophobicContact CD2-CD2 4.48Å; F150-F213 HydrophobicContact CD2-CE1 4.28Å; F150-F213 AromaticContact CD2-CE2 3.67Å; F150-F213 HydrophobicContact CD2-CE2 3.67Å; F150-F213 AromaticContact CD2-CZ 3.54Å; F150-F213 HydrophobicContact CD2-CZ 3.54Å; F150-F213 HydrophobicContact CE2-CD1 4.4Å; F150-F213 HydrophobicContact CE2-CD2 4.31Å; F150-F213 AromaticContact CE2-CE1 3.95Å; F150-F213 HydrophobicContact CE2-CE1 3.95Å; F150-F213 AromaticContact CE2-CE2 3.87Å; F150-F213 HydrophobicContact CE2-CE2 3.87Å; F150-F213 AromaticContact CE2-CZ 3.66Å; F150-F213 HydrophobicContact CE2-CZ 3.66Å
151	D	88.2	Confident	92.1	Very high	109 Å²	109	62.9 Å²	62.9	58%	0.583	33%	0.334	S	S	*	.			trans	56.3	48.2	175.8	-170	65.3	0	0	0	113.6	K126	K126-D151 HydrophobicContact CB-CB 4.3Å; K126-D151 HydrophobicContact CD-CB 4Å; K126-D151 VanDerWaalsContact CD-O 3.24Å; K126-D151 WeakPolarHBondContact CD-O 3.48Å; K126-D151 WeakPolarHBondContact CD-OD2 3.29Å; K126-D151 WeakPolarHBondContact CE-O 3.37Å; K126-D151 PolarHBondContact NZ-O 3.03Å; K126-D151 IonicContact NZ-OD2 3.54Å; K126-D151 PolarHBondContact NZ-OD2 3.04Å
152	E	87.4	Confident	92	Very high	118 Å²	118	64.5 Å²	64.5	55%	0.551	35%	0.354	S	S	*	.			trans	-74.8	141.9	179.7	67.2	-82.6	-158.8	0	0	114.7	F150 S154	F150-E152 HydrophobicContact CD1-CB 3.86Å; F150-E152 WeakPolarHBondContact CD1-OE2 3.4Å; F150-E152 HydrophobicContact CE1-CB 4.12Å; E152-S154 WeakPolarHBondContact CB-O 3.36Å
153	D	82.4	Confident	91.8	Very high	148 Å²	148	65.5 Å²	65.5	79%	0.791	37%	0.366	S	S	*	.	S	Bend	trans	-92.2	-18.6	170.9	-59.2	-79.9	0	0	0	112.7	K126	K126-D153 WeakPolarHBondContact CE-OD2 3.31Å; K126-D153 IonicContact NZ-OD1 2.66Å; K126-D153 IonicContact NZ-OD2 3.31Å; K126-D153 PolarHBondContact NZ-OD2 3.39Å
154	S	89.4	Confident	91.7	Very high	58 Å²	58	70.4 Å²	70.4	41%	0.406	40%	0.399	S	S	.	.	S	Bend	trans	-155.9	174.1	174.7	76.6	0	0	0	0	110.3	E152 D156	E152-S154 WeakPolarHBondContact CB-O 3.36Å; S154-D156 PolarHBondContact O-N 3.02Å; S154-D156 VanDerWaalsContact O-N 3.12Å; S154-D156 WeakPolarHBondContact OG-CB 3.27Å; S154-D156 PolarHBondContact OG-N 3.2Å; S154-D156 PolarHBondContact OG-OD2 2.88Å
155	G	87.2	Confident	91.6	Very high	78 Å²	78	67.9 Å²	67.9	80%	0.804	39%	0.393	S	S	*	.	S	Bend	trans	-71.9	7.9	173.1	0	0	0	0	0	115.4
156	D	91.8	Very high	91.6	Very high	85 Å²	85	67.2 Å²	67.2	46%	0.455	39%	0.389	S	S	.	.			trans	-87.2	149.1	-178.4	-63.8	-74.5	0	0	0	112.9	S154 L161	S154-D156 PolarHBondContact O-N 3.02Å; S154-D156 VanDerWaalsContact O-N 3.12Å; S154-D156 WeakPolarHBondContact OG-CB 3.27Å; S154-D156 PolarHBondContact OG-N 3.2Å; S154-D156 PolarHBondContact OG-OD2 2.88Å; D156-L161 HydrophobicContact CB-CD2 3.63Å; D156-L161 HydrophobicContact CB-CG 4.09Å
157	Y	95.6	Very high	91.5	Very high	8 Å²	8	74.6 Å²	74.6	3%	0.031	42%	0.421	C	S	.	.			trans	-144	164.9	175.8	57.9	-81.4	0	0	0	110.7	S123 L159 T160 L161 R211 A212 H215	S123-Y157 WeakPolarHBondContact O-CB 3.42Å; Y157-L159 HydrophobicContact CD2-CB 4.23Å; Y157-L159 HydrophobicContact CE2-CB 4.04Å; Y157-L159 PolarHBondContact O-N 3.29Å; Y157-T160 HydrophobicContact CD1-CG2 4.15Å; Y157-T160 HydrophobicContact CE1-CG2 3.51Å; Y157-T160 HydrophobicContact CE2-CG2 4.13Å; Y157-T160 PolarHBondContact N-OG1 2.93Å; Y157-T160 PolarHBondContact O-N 2.66Å; Y157-T160 PolarHBondContact O-OG1 2.8Å; Y157-T160 VanDerWaalsContact O-OG1 3.14Å; Y157-L161 PolarHBondContact O-N 3.21Å; Y157-R211 HydrophobicContact CE1-CG 4.27Å; Y157-R211 WeakPolarHBondContact OH-CG 3.47Å; Y157-R211 PolarHBondContact OH-NE 3.3Å; Y157-A212 HydrophobicContact CD1-CB 3.71Å; Y157-A212 HydrophobicContact CD2-CB 3.98Å; Y157-A212 HydrophobicContact CE1-CB 4.23Å; Y157-A212 HydrophobicContact CE2-CB 4.47Å; Y157-A212 HydrophobicContact CG-CB 3.58Å; Y157-H215 HydrophobicContact CE2-CB 3.92Å; Y157-H215 AromaticContact CE2-ND1 3.78Å; Y157-H215 AromaticContact CZ-ND1 3.77Å; Y157-H215 WeakPolarHBondContact OH-CB 3.41Å; Y157-H215 PolarHBondContact OH-ND1 2.81Å
158	P	95.8	Very high	91.5	Very high	6 Å²	6	78.2 Å²	78.2	4%	0.039	43%	0.429	C	S	.	.	T	Hydrogen-bonded Turn	trans	-53.8	-16	-168	-34.5	40.7	0	0	0	118.1	F83 C122 W166 F169	F83-P158 HydrophobicContact CE2-CG 4.29Å; F83-P158 HydrophobicContact CZ-CG 4.21Å; C122-P158 WeakPolarHBondContact O-CB 3.49Å; C122-P158 WeakPolarHBondContact O-CG 3.31Å; P158-W166 HydrophobicContact CB-CE3 4.01Å; P158-W166 HydrophobicContact CB-CZ3 3.66Å; P158-W166 HydrophobicContact CG-CH2 4.49Å; P158-W166 HydrophobicContact CG-CZ3 4.01Å; P158-F169 HydrophobicContact CB-CD1 3.89Å; P158-F169 HydrophobicContact CB-CE1 3.37Å; P158-F169 HydrophobicContact CB-CZ 4.08Å
159	L	95	Very high	91.7	Very high	18 Å²	18	72.4 Å²	72.4	9%	0.094	40%	0.401	C	S	.	.	T	Hydrogen-bonded Turn	trans	-96.9	-19.9	177.3	-62.2	-179.7	0	0	0	114.7	Y157 F169 R170 T216 L219	Y157-L159 HydrophobicContact CD2-CB 4.23Å; Y157-L159 HydrophobicContact CE2-CB 4.04Å; Y157-L159 PolarHBondContact O-N 3.29Å; L159-F169 HydrophobicContact CD2-CE1 4.25Å; L159-R170 HydrophobicContact CD2-CB 4.09Å; L159-R170 HydrophobicContact CD2-CG 3.98Å; L159-T216 HydrophobicContact CD1-CG2 4.28Å; L159-L219 HydrophobicContact CD1-CB 4.47Å; L159-L219 HydrophobicContact CD1-CD2 3.77Å; L159-L219 HydrophobicContact CD2-CD2 3.88Å
160	T	94.2	Very high	91.8	Very high	42 Å²	42	73 Å²	73	26%	0.258	40%	0.4	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.8	-24.6	173.6	56.6	0	0	0	0	112.7	Y157 S162	Y157-T160 HydrophobicContact CD1-CG2 4.15Å; Y157-T160 HydrophobicContact CE1-CG2 3.51Å; Y157-T160 HydrophobicContact CE2-CG2 4.13Å; Y157-T160 PolarHBondContact N-OG1 2.93Å; Y157-T160 PolarHBondContact O-N 2.66Å; Y157-T160 PolarHBondContact O-OG1 2.8Å; Y157-T160 VanDerWaalsContact O-OG1 3.14Å; T160-S162 PolarHBondContact O-N 3.29Å
161	L	93.3	Very high	92	Very high	57 Å²	57	77 Å²	77	30%	0.298	42%	0.421	S	S	.	.			trans	-59.5	127.6	-178.2	-74.5	171.5	0	0	0	112.4	D156 Y157 W166	D156-L161 HydrophobicContact CB-CD2 3.63Å; D156-L161 HydrophobicContact CB-CG 4.09Å; Y157-L161 PolarHBondContact O-N 3.21Å; L161-W166 HydrophobicContact CB-CB 4.25Å; L161-W166 HydrophobicContact CB-CD2 3.92Å; L161-W166 HydrophobicContact CB-CG 3.67Å; L161-W166 HydrophobicContact CD1-CD2 4.09Å; L161-W166 HydrophobicContact CD1-CH2 3.92Å; L161-W166 HydrophobicContact CD1-CZ2 3.47Å; L161-W166 VanDerWaalsContact CD1-CZ2 3.47Å; L161-W166 HydrophobicContact CD1-CZ3 4.44Å; L161-W166 WeakPolarHBondContact O-CB 3.31Å
162	S	90.3	Very high	92.4	Very high	116 Å²	116	72.6 Å²	72.6	81%	0.811	40%	0.398	S	S	*	.			trans	-81.3	145.9	-178.8	-81.5	0	0	0	0	113.2	T160	T160-S162 PolarHBondContact O-N 3.29Å
163	G	91.2	Very high	92.8	Very high	26 Å²	26	67 Å²	67	27%	0.268	37%	0.371	S	S	.	.	S	Bend	trans	128.7	167.6	169.5	0	0	0	0	0	114.4	Q165 W166 K167	G163-Q165 VanDerWaalsContact C-N 3.32Å; G163-Q165 PolarHBondContact O-N 3.41Å; G163-W166 PolarHBondContact O-N 3.31Å; G163-K167 PolarHBondContact O-N 2.93Å; G163-K167 VanDerWaalsContact O-N 3.1Å
164	P	91.6	Very high	93.5	Very high	116 Å²	116	60.7 Å²	60.7	75%	0.753	34%	0.339	S	S	*	.	H	α-helix	trans	-61.9	-35.1	-175.1	-24.6	35.1	0	0	0	114.1	R168	P164-R168 WeakPolarHBondContact O-CB 3.32Å; P164-R168 PolarHBondContact O-N 3.31Å
165	Q	92.8	Very high	93.9	Very high	104 Å²	104	61.4 Å²	61.4	49%	0.486	34%	0.338	S	S	.	.	H	α-helix	trans	-64.6	-45.7	178.9	-176.4	175.7	9.2	0	0	111.9	G163 R168 F169	G163-Q165 VanDerWaalsContact C-N 3.32Å; G163-Q165 PolarHBondContact O-N 3.41Å; Q165-R168 PolarHBondContact O-N 3.15Å; Q165-F169 PolarHBondContact O-N 2.75Å
166	W	93.4	Very high	94.4	Very high	49 Å²	49	57.7 Å²	57.7	19%	0.186	30%	0.3	C	S	.	.	H	α-helix	trans	-73.7	-35.9	-178.4	-62.5	115.6	0	0	0	112.3	K87 P158 L161 G163 R168 F169 R170	K87-W166 HydrophobicContact CD-CH2 4.22Å; K87-W166 HydrophobicContact CD-CZ3 4.16Å; P158-W166 HydrophobicContact CB-CE3 4.01Å; P158-W166 HydrophobicContact CB-CZ3 3.66Å; P158-W166 HydrophobicContact CG-CH2 4.49Å; P158-W166 HydrophobicContact CG-CZ3 4.01Å; L161-W166 HydrophobicContact CB-CB 4.25Å; L161-W166 HydrophobicContact CB-CD2 3.92Å; L161-W166 HydrophobicContact CB-CG 3.67Å; L161-W166 HydrophobicContact CD1-CD2 4.09Å; L161-W166 HydrophobicContact CD1-CH2 3.92Å; L161-W166 HydrophobicContact CD1-CZ2 3.47Å; L161-W166 VanDerWaalsContact CD1-CZ2 3.47Å; L161-W166 HydrophobicContact CD1-CZ3 4.44Å; L161-W166 WeakPolarHBondContact O-CB 3.31Å; G163-W166 PolarHBondContact O-N 3.31Å; W166-R168 VanDerWaalsContact C-N 3.3Å; W166-R168 PolarHBondContact O-N 3.4Å; W166-F169 HydrophobicContact CE3-CB 4.32Å; W166-F169 HydrophobicContact CE3-CD1 4.1Å; W166-F169 HydrophobicContact CE3-CG 4.34Å; W166-F169 HydrophobicContact CZ3-CD1 4.47Å; W166-F169 PolarHBondContact O-N 2.65Å; W166-R170 PolarHBondContact O-N 3.35Å
167	K	92.5	Very high	94.6	Very high	155 Å²	155	53.9 Å²	53.9	67%	0.674	28%	0.28	S	S	*	.	H	α-helix	trans	-57.9	-41.5	167	-71.7	-172.4	177.2	-172	0	112	G163 I171	G163-K167 PolarHBondContact O-N 2.93Å; G163-K167 VanDerWaalsContact O-N 3.1Å; K167-I171 WeakPolarHBondContact O-CG1 2.8Å; K167-I171 PolarHBondContact O-N 2.89Å
168	R	93.3	Very high	94.7	Very high	134 Å²	134	54.7 Å²	54.7	51%	0.506	29%	0.288	S	S	.	.	H	α-helix	trans	-68.9	-41.4	174.9	-172.4	175.2	-176.9	-157.9	-5.5	112.5	G89 P164 Q165 W166 R170 I171 N172	G89-R168 PolarHBondContact O-NH2 3.43Å; P164-R168 WeakPolarHBondContact O-CB 3.32Å; P164-R168 PolarHBondContact O-N 3.31Å; Q165-R168 PolarHBondContact O-N 3.15Å; W166-R168 VanDerWaalsContact C-N 3.3Å; W166-R168 PolarHBondContact O-N 3.4Å; R168-R170 PolarHBondContact O-N 2.87Å; R168-I171 PolarHBondContact O-N 3.47Å; R168-N172 PolarHBondContact O-N 3.36Å; R168-N172 PolarHBondContact O-OD1 2.93Å
169	F	95.9	Very high	94.7	Very high	0 Å²	0	55.4 Å²	55.4	0%	0	29%	0.292	C	S	.	.	H	α-helix	trans	-57.5	-46.7	174.3	163.4	-102	0	0	0	111.5	F83 V86 K87 C122 P158 L159 Q165 W166 I171 N172 F173	F83-F169 AromaticContact CD2-CE2 3.82Å; F83-F169 HydrophobicContact CD2-CE2 3.82Å; F83-F169 HydrophobicContact CD2-CZ 4.2Å; F83-F169 HydrophobicContact CE2-CD2 4.4Å; F83-F169 AromaticContact CE2-CE2 3.69Å; F83-F169 HydrophobicContact CE2-CE2 3.69Å; F83-F169 AromaticContact CE2-CZ 3.84Å; F83-F169 HydrophobicContact CE2-CZ 3.84Å; V86-F169 HydrophobicContact CG1-CD2 4.4Å; V86-F169 HydrophobicContact CG1-CE2 4.38Å; K87-F169 HydrophobicContact CB-CD2 3.98Å; K87-F169 HydrophobicContact CG-CD2 4.49Å; C122-F169 HydrophobicContact CB-CZ 3.96Å; P158-F169 HydrophobicContact CB-CD1 3.89Å; P158-F169 HydrophobicContact CB-CE1 3.37Å; P158-F169 HydrophobicContact CB-CZ 4.08Å; L159-F169 HydrophobicContact CD2-CE1 4.25Å; Q165-F169 PolarHBondContact O-N 2.75Å; W166-F169 HydrophobicContact CE3-CB 4.32Å; W166-F169 HydrophobicContact CE3-CD1 4.1Å; W166-F169 HydrophobicContact CE3-CG 4.34Å; W166-F169 HydrophobicContact CZ3-CD1 4.47Å; W166-F169 PolarHBondContact O-N 2.65Å; F169-I171 VanDerWaalsContact C-N 3.26Å; F169-I171 PolarHBondContact O-N 2.89Å; F169-N172 PolarHBondContact O-N 3.37Å; F169-F173 HydrophobicContact CE2-CB 4.27Å; F169-F173 HydrophobicContact CZ-CB 4.25Å; F169-F173 HydrophobicContact CZ-CD2 4.29Å; F169-F173 HydrophobicContact CZ-CG 4.37Å; F169-F173 VanDerWaalsContact O-CB 3.25Å; F169-F173 WeakPolarHBondContact O-CB 3.42Å; F169-F173 PolarHBondContact O-N 2.92Å
170	R	95.4	Very high	94.8	Very high	91 Å²	91	54.9 Å²	54.9	34%	0.343	29%	0.289	S	S	.	.	H	α-helix	trans	-57.2	-38.6	176.8	179.8	173.3	171.7	168.1	-2.4	112.4	L159 W166 R168 C174 L219	L159-R170 HydrophobicContact CD2-CB 4.09Å; L159-R170 HydrophobicContact CD2-CG 3.98Å; W166-R170 PolarHBondContact O-N 3.35Å; R168-R170 PolarHBondContact O-N 2.87Å; R170-C174 PolarHBondContact O-N 2.97Å; R170-C174 PolarHBondContact O-SG 3.2Å; R170-L219 HydrophobicContact CG-CD2 4.26Å
171	I	95.3	Very high	94.9	Very high	99 Å²	99	53 Å²	53	51%	0.508	28%	0.278	S	S	.	.	H	α-helix	trans	-67.1	-56.3	174.5	-65.1	165.6	0	0	0	110	K167 R168 F169 F173 C174 D175	K167-I171 WeakPolarHBondContact O-CG1 2.8Å; K167-I171 PolarHBondContact O-N 2.89Å; R168-I171 PolarHBondContact O-N 3.47Å; F169-I171 VanDerWaalsContact C-N 3.26Å; F169-I171 PolarHBondContact O-N 2.89Å; I171-F173 PolarHBondContact O-N 3.02Å; I171-F173 VanDerWaalsContact O-N 3.16Å; I171-C174 WeakPolarHBondContact O-CB 3.46Å; I171-C174 PolarHBondContact O-N 3.14Å; I171-D175 WeakPolarHBondContact CG2-OD2 3.38Å; I171-D175 PolarHBondContact O-N 2.95Å
172	N	95.9	Very high	94.9	Very high	16 Å²	16	56 Å²	56	9%	0.086	29%	0.285	C	S	.	.	H	α-helix	trans	-55.5	-36.8	-179	-61.4	-3.7	0	0	0	112.6	V86 R168 F169 F176	V86-N172 HydrophobicContact CG1-CB 3.82Å; V86-N172 WeakPolarHBondContact O-CB 3.41Å; V86-N172 PolarHBondContact O-ND2 3.19Å; R168-N172 PolarHBondContact O-N 3.36Å; R168-N172 PolarHBondContact O-OD1 2.93Å; F169-N172 PolarHBondContact O-N 3.37Å; N172-F176 WeakPolarHBondContact O-CB 3.49Å; N172-F176 PolarHBondContact O-N 2.84Å
173	F	97.3	Very high	95.1	Very high	0 Å²	0	53.6 Å²	53.6	0%	0	26%	0.261	C	S	.	.	H	α-helix	trans	-65.3	-45.7	176.2	176.8	-107	0	0	0	112.2	F118 F119 C122 F169 I171 F176 I177 T216 L219 A220	F118-F173 AromaticContact CE1-CD2 3.99Å; F118-F173 HydrophobicContact CE1-CD2 3.99Å; F118-F173 AromaticContact CE1-CE2 3.86Å; F118-F173 HydrophobicContact CE1-CE2 3.86Å; F118-F173 AromaticContact CZ-CD2 3.66Å; F118-F173 HydrophobicContact CZ-CD2 3.66Å; F118-F173 AromaticContact CZ-CE2 3.99Å; F118-F173 HydrophobicContact CZ-CE2 3.99Å; F119-F173 HydrophobicContact CD1-CE2 4.07Å; F119-F173 HydrophobicContact CD1-CZ 4.14Å; F119-F173 HydrophobicContact CE1-CE2 4.24Å; F119-F173 HydrophobicContact CE1-CZ 4.31Å; C122-F173 HydrophobicContact CB-CD2 4.04Å; C122-F173 HydrophobicContact CB-CE2 3.56Å; C122-F173 HydrophobicContact CB-CZ 4.21Å; C122-F173 VanDerWaalsContact SG-CD2 3.52Å; C122-F173 WeakPolarHBondContact SG-CE2 3.13Å; F169-F173 HydrophobicContact CE2-CB 4.27Å; F169-F173 HydrophobicContact CZ-CB 4.25Å; F169-F173 HydrophobicContact CZ-CD2 4.29Å; F169-F173 HydrophobicContact CZ-CG 4.37Å; F169-F173 VanDerWaalsContact O-CB 3.25Å; F169-F173 WeakPolarHBondContact O-CB 3.42Å; F169-F173 PolarHBondContact O-N 2.92Å; I171-F173 PolarHBondContact O-N 3.02Å; I171-F173 VanDerWaalsContact O-N 3.16Å; F173-F176 PolarHBondContact O-N 3.35Å; F173-I177 HydrophobicContact CD1-CD1 4.43Å; F173-I177 HydrophobicContact CE1-CD1 4.07Å; F173-I177 HydrophobicContact CE2-CD1 4.34Å; F173-I177 HydrophobicContact CZ-CD1 4.04Å; F173-I177 WeakPolarHBondContact O-CG1 3.45Å; F173-I177 PolarHBondContact O-N 3.42Å; F173-T216 HydrophobicContact CE1-CG2 4.29Å; F173-T216 HydrophobicContact CZ-CG2 3.86Å; F173-L219 HydrophobicContact CD1-CD2 4.19Å; F173-L219 HydrophobicContact CE1-CD2 4.25Å; F173-L219 HydrophobicContact CE1-CG 4.33Å; F173-A220 HydrophobicContact CE1-CB 4.22Å; F173-A220 HydrophobicContact CZ-CB 3.92Å
174	C	97.4	Very high	95.3	Very high	17 Å²	17	52.4 Å²	52.4	12%	0.115	25%	0.249	C	C	.	.	H	α-helix	trans	-64.1	-43.2	174.8	-64.9	0	0	0	0	111.5	R170 I171 A178 K223	R170-C174 PolarHBondContact O-N 2.97Å; R170-C174 PolarHBondContact O-SG 3.2Å; I171-C174 WeakPolarHBondContact O-CB 3.46Å; I171-C174 PolarHBondContact O-N 3.14Å; C174-A178 WeakPolarHBondContact O-CB 3.18Å; C174-A178 PolarHBondContact O-N 3.43Å; C174-A178 VanDerWaalsContact O-N 3.14Å; C174-K223 HydrophobicContact CB-CD 3.92Å; C174-K223 HydrophobicContact CB-CG 4.04Å
175	D	95.8	Very high	95.3	Very high	72 Å²	72	47.4 Å²	47.4	39%	0.385	22%	0.215	S	C	.	.	H	α-helix	trans	-65.4	-39.2	179.5	-69.4	-19.1	0	0	0	111.8	T93 I171 I177 A178 V179	T93-D175 HydrophobicContact CG2-CB 4.27Å; I171-D175 WeakPolarHBondContact CG2-OD2 3.38Å; I171-D175 PolarHBondContact O-N 2.95Å; D175-I177 PolarHBondContact O-N 2.85Å; D175-A178 PolarHBondContact O-N 3.4Å; D175-V179 WeakPolarHBondContact O-CB 3.23Å; D175-V179 VanDerWaalsContact O-CG2 3.27Å; D175-V179 WeakPolarHBondContact O-CG2 3.33Å; D175-V179 PolarHBondContact O-N 2.59Å
176	F	97.8	Very high	95.2	Very high	1 Å²	1	50.4 Å²	50.4	0%	0.004	22%	0.223	C	C	.	.	H	α-helix	trans	-58.3	-49.9	177.7	176.6	-97.6	0	0	0	111.4	L82 V86 T93 V96 V97 L115 F118 N172 F173 A178 V179 L180	L82-F176 HydrophobicContact CD1-CE2 3.97Å; L82-F176 HydrophobicContact CD1-CZ 4.11Å; L82-F176 HydrophobicContact CD2-CE1 4.36Å; L82-F176 HydrophobicContact CD2-CZ 3.85Å; L82-F176 HydrophobicContact CG-CZ 4.36Å; V86-F176 HydrophobicContact CG2-CB 4.45Å; V86-F176 HydrophobicContact CG2-CD2 4.18Å; V86-F176 HydrophobicContact CG2-CG 4.3Å; T93-F176 VanDerWaalsContact CG2-CA 3.48Å; T93-F176 HydrophobicContact CG2-CB 4Å; T93-F176 HydrophobicContact CG2-CD2 4.41Å; V96-F176 HydrophobicContact CG1-CE2 4.25Å; V97-F176 HydrophobicContact CG2-CD2 3.69Å; V97-F176 HydrophobicContact CG2-CE2 3.6Å; V97-F176 HydrophobicContact CG2-CZ 4.41Å; L115-F176 HydrophobicContact CD1-CE1 3.9Å; L115-F176 HydrophobicContact CD1-CZ 4.39Å; F118-F176 HydrophobicContact CD1-CD1 4.44Å; F118-F176 HydrophobicContact CD1-CE1 4.16Å; F118-F176 AromaticContact CE1-CD1 3.55Å; F118-F176 HydrophobicContact CE1-CD1 3.55Å; F118-F176 AromaticContact CE1-CE1 3.7Å; F118-F176 HydrophobicContact CE1-CE1 3.7Å; F118-F176 AromaticContact CZ-CD1 3.66Å; F118-F176 HydrophobicContact CZ-CD1 3.66Å; F118-F176 HydrophobicContact CZ-CE1 4.08Å; F118-F176 HydrophobicContact CZ-CG 4.24Å; N172-F176 WeakPolarHBondContact O-CB 3.49Å; N172-F176 PolarHBondContact O-N 2.84Å; F173-F176 PolarHBondContact O-N 3.35Å; F176-A178 PolarHBondContact O-N 2.87Å; F176-V179 PolarHBondContact O-N 2.72Å; F176-L180 HydrophobicContact CE1-CD2 4.04Å; F176-L180 HydrophobicContact CZ-CD2 4.31Å; F176-L180 WeakPolarHBondContact O-CB 3.27Å; F176-L180 PolarHBondContact O-N 3.45Å
177	I	97.6	Very high	95.2	Very high	5 Å²	5	51.7 Å²	51.7	3%	0.026	24%	0.24	C	C	.	.	H	α-helix	trans	-61.9	-44.8	178.6	-60.4	167.6	0	0	0	110.6	F119 F173 D175 V179 L180 V181 A220 K223 L224	F119-I177 HydrophobicContact CE1-CD1 3.91Å; F119-I177 HydrophobicContact CE1-CG1 4.17Å; F119-I177 HydrophobicContact CZ-CG1 4.44Å; F173-I177 HydrophobicContact CD1-CD1 4.43Å; F173-I177 HydrophobicContact CE1-CD1 4.07Å; F173-I177 HydrophobicContact CE2-CD1 4.34Å; F173-I177 HydrophobicContact CZ-CD1 4.04Å; F173-I177 WeakPolarHBondContact O-CG1 3.45Å; F173-I177 PolarHBondContact O-N 3.42Å; D175-I177 PolarHBondContact O-N 2.85Å; I177-V179 PolarHBondContact O-N 2.85Å; I177-L180 PolarHBondContact O-N 2.78Å; I177-V181 WeakPolarHBondContact O-CG2 3.49Å; I177-V181 PolarHBondContact O-N 3.18Å; I177-A220 HydrophobicContact CD1-CB 3.68Å; I177-K223 HydrophobicContact CG2-CB 4.28Å; I177-L224 HydrophobicContact CG2-CB 4.07Å; I177-L224 HydrophobicContact CG2-CD1 4.49Å
178	A	96.1	Very high	95.3	Very high	25 Å²	25	45.2 Å²	45.2	21%	0.207	21%	0.212	C	C	.	.	H	α-helix	trans	-67.6	-33.7	-178.9	0	0	0	0	0	113.5	C174 D175 F176 R182	C174-A178 WeakPolarHBondContact O-CB 3.18Å; C174-A178 PolarHBondContact O-N 3.43Å; C174-A178 VanDerWaalsContact O-N 3.14Å; D175-A178 PolarHBondContact O-N 3.4Å; F176-A178 PolarHBondContact O-N 2.87Å; A178-R182 WeakPolarHBondContact O-CB 3.46Å; A178-R182 PolarHBondContact O-N 3.24Å
179	V	96.7	Very high	95.4	Very high	20 Å²	20	38.9 Å²	38.9	12%	0.121	19%	0.188	C	C	.	.	H	α-helix	trans	-78.3	-39.8	176.4	175.4	0	0	0	0	111.2	Q94 V97 D175 F176 I177 V181 R182 Q183	Q94-V179 HydrophobicContact CB-CG1 4.03Å; Q94-V179 HydrophobicContact CG-CG1 4.43Å; V97-V179 HydrophobicContact CB-CG1 4.18Å; V97-V179 HydrophobicContact CG1-CG1 4.24Å; V97-V179 HydrophobicContact CG2-CB 4.3Å; V97-V179 HydrophobicContact CG2-CG1 4.05Å; D175-V179 WeakPolarHBondContact O-CB 3.23Å; D175-V179 VanDerWaalsContact O-CG2 3.27Å; D175-V179 WeakPolarHBondContact O-CG2 3.33Å; D175-V179 PolarHBondContact O-N 2.59Å; F176-V179 PolarHBondContact O-N 2.72Å; I177-V179 PolarHBondContact O-N 2.85Å; V179-V181 PolarHBondContact O-N 3.36Å; V179-R182 PolarHBondContact O-N 3.41Å; V179-Q183 HydrophobicContact CG1-CG 4.28Å; V179-Q183 WeakPolarHBondContact O-CG 3.12Å; V179-Q183 PolarHBondContact O-N 3.01Å
180	L	97	Very high	95.3	Very high	8 Å²	8	40.8 Å²	40.8	4%	0.042	20%	0.196	C	C	.	.	H	α-helix	trans	-54.1	-55.5	176.8	176.8	57.7	0	0	0	111.8	V97 W100 I101 L115 F176 I177 R182 Q183 C184 M194	V97-L180 HydrophobicContact CG1-CB 4.39Å; V97-L180 HydrophobicContact CG1-CD1 4.16Å; V97-L180 HydrophobicContact CG2-CB 4.08Å; W100-L180 HydrophobicContact CE3-CD1 3.57Å; W100-L180 HydrophobicContact CZ3-CD1 3.7Å; I101-L180 HydrophobicContact CD1-CD1 4.47Å; I101-L180 HydrophobicContact CG1-CD1 4.33Å; L115-L180 HydrophobicContact CD1-CD2 4.15Å; L115-L180 HydrophobicContact CD2-CD2 4.09Å; F176-L180 HydrophobicContact CE1-CD2 4.04Å; F176-L180 HydrophobicContact CZ-CD2 4.31Å; F176-L180 WeakPolarHBondContact O-CB 3.27Å; F176-L180 PolarHBondContact O-N 3.45Å; I177-L180 PolarHBondContact O-N 2.78Å; L180-R182 VanDerWaalsContact C-N 3.28Å; L180-R182 PolarHBondContact O-N 2.57Å; L180-Q183 PolarHBondContact O-N 3.32Å; L180-C184 PolarHBondContact O-N 3.31Å; L180-C184 PolarHBondContact O-SG 3.06Å; L180-M194 HydrophobicContact CD1-CE 3.96Å; L180-M194 HydrophobicContact CD2-CE 3.8Å; L180-M194 HydrophobicContact CG-CE 3.85Å
181	V	96.4	Very high	95.3	Very high	3 Å²	3	38 Å²	38	2%	0.018	19%	0.188	C	C	.	.	H	α-helix	trans	-59.7	-40.2	178.1	177.1	0	0	0	0	111.3	I177 V179 Q183 C184 Q185 I189 L224 A227 L228 V231	I177-V181 WeakPolarHBondContact O-CG2 3.49Å; I177-V181 PolarHBondContact O-N 3.18Å; V179-V181 PolarHBondContact O-N 3.36Å; V181-Q183 PolarHBondContact O-N 2.96Å; V181-C184 PolarHBondContact O-N 3.45Å; V181-Q185 PolarHBondContact O-N 3.27Å; V181-Q185 VanDerWaalsContact O-N 3.08Å; V181-I189 HydrophobicContact CG1-CD1 3.81Å; V181-L224 HydrophobicContact CG2-CD1 3.41Å; V181-L224 VanDerWaalsContact CG2-CD1 3.41Å; V181-A227 HydrophobicContact CB-CB 3.66Å; V181-A227 HydrophobicContact CG1-CB 3.67Å; V181-A227 HydrophobicContact CG2-CB 3.99Å; V181-L228 HydrophobicContact CG1-CD2 4.5Å; V181-V231 HydrophobicContact CG1-CG2 4.13Å
182	R	93.3	Very high	95.2	Very high	118 Å²	118	41.8 Å²	41.8	45%	0.445	20%	0.203	S	C	.	.	H	α-helix	trans	-64.9	-37.9	179.8	-172.9	-176.3	-64.8	141.1	4.4	112.9	A178 V179 L180 Q185	A178-R182 WeakPolarHBondContact O-CB 3.46Å; A178-R182 PolarHBondContact O-N 3.24Å; V179-R182 PolarHBondContact O-N 3.41Å; L180-R182 VanDerWaalsContact C-N 3.28Å; L180-R182 PolarHBondContact O-N 2.57Å; R182-Q185 WeakPolarHBondContact O-CG 3.25Å; R182-Q185 PolarHBondContact O-NE2 2.81Å
183	Q	95.1	Very high	95.1	Very high	67 Å²	67	44.5 Å²	44.5	31%	0.313	21%	0.213	S	C	.	.	H	α-helix	trans	-75.8	-33.8	176.5	-61	-57.6	-1.8	0	0	111.9	V97 I101 V179 L180 V181 Q185	V97-Q183 HydrophobicContact CG1-CB 4.05Å; V97-Q183 HydrophobicContact CG1-CG 3.8Å; I101-Q183 HydrophobicContact CD1-CB 3.43Å; I101-Q183 VanDerWaalsContact CD1-CB 3.43Å; I101-Q183 HydrophobicContact CD1-CG 4.41Å; V179-Q183 HydrophobicContact CG1-CG 4.28Å; V179-Q183 WeakPolarHBondContact O-CG 3.12Å; V179-Q183 PolarHBondContact O-N 3.01Å; L180-Q183 PolarHBondContact O-N 3.32Å; V181-Q183 PolarHBondContact O-N 2.96Å; Q183-Q185 VanDerWaalsContact C-N 3.29Å; Q183-Q185 PolarHBondContact O-N 3.27Å
184	C	95	Very high	95	Very high	1 Å²	1	44.7 Å²	44.7	1%	0.007	21%	0.214	C	C	.	.	H	α-helix	trans	-72.7	-15.3	175.7	-67.5	0	0	0	0	114.5	L180 V181 Y186 S187 I188 I189	L180-C184 PolarHBondContact O-N 3.31Å; L180-C184 PolarHBondContact O-SG 3.06Å; V181-C184 PolarHBondContact O-N 3.45Å; C184-Y186 PolarHBondContact O-N 3.28Å; C184-S187 PolarHBondContact O-N 3.16Å; C184-S187 VanDerWaalsContact O-N 3.07Å; C184-I188 HydrophobicContact CB-CB 4.03Å; C184-I188 HydrophobicContact CB-CG2 4.31Å; C184-I188 PolarHBondContact O-N 3.04Å; C184-I189 HydrophobicContact CB-CB 4.21Å; C184-I189 WeakPolarHBondContact O-CB 3.31Å; C184-I189 WeakPolarHBondContact O-CG2 3.31Å; C184-I189 PolarHBondContact O-N 2.92Å; C184-I189 VanDerWaalsContact O-N 3.14Å
185	Q	92.1	Very high	94.9	Very high	11 Å²	11	44 Å²	44	5%	0.051	21%	0.209	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.5	-14	-163.3	86.3	-175.9	-80.7	0	0	117.1	V181 R182 Q183 Y190 V231 N234	V181-Q185 PolarHBondContact O-N 3.27Å; V181-Q185 VanDerWaalsContact O-N 3.08Å; R182-Q185 WeakPolarHBondContact O-CG 3.25Å; R182-Q185 PolarHBondContact O-NE2 2.81Å; Q183-Q185 VanDerWaalsContact C-N 3.29Å; Q183-Q185 PolarHBondContact O-N 3.27Å; Q185-Y190 WeakPolarHBondContact O-CE2 3.35Å; Q185-Y190 PolarHBondContact O-OH 3.46Å; Q185-V231 HydrophobicContact CB-CG1 4.07Å; Q185-V231 HydrophobicContact CB-CG2 3.65Å; Q185-N234 PolarHBondContact OE1-ND2 2.96Å
186	Y	90.6	Very high	94.9	Very high	167 Å²	167	45.3 Å²	45.3	66%	0.655	22%	0.216	S	C	*	.	T	Hydrogen-bonded Turn	trans	-111	-0	-177.3	-56.6	-58.7	0	0	0	114.1	C184	C184-Y186 PolarHBondContact O-N 3.28Å
187	S	92.4	Very high	94.7	Very high	76 Å²	76	46.4 Å²	46.4	53%	0.531	22%	0.223	S	C	.	.	T	Hydrogen-bonded Turn	trans	-157.6	-77.4	179.9	50.7	0	0	0	0	112.8	C184 I189 Y190	C184-S187 PolarHBondContact O-N 3.16Å; C184-S187 VanDerWaalsContact O-N 3.07Å; S187-I189 PolarHBondContact O-N 2.94Å; S187-I189 VanDerWaalsContact O-N 3.08Å; S187-Y190 PolarHBondContact O-N 2.9Å
188	I	94.3	Very high	94.7	Very high	18 Å²	18	46.6 Å²	46.6	9%	0.092	22%	0.224	C	C	.	.	G	3₁₀ helix	trans	-56.7	-30.6	-171.8	-67.5	167.3	0	0	0	112.6	I101 Y104 C184 Y190 D191 M194	I101-I188 HydrophobicContact CG2-CD1 3.86Å; Y104-I188 HydrophobicContact CD1-CD1 4.1Å; Y104-I188 HydrophobicContact CD1-CG1 4.36Å; Y104-I188 HydrophobicContact CD1-CG2 3.92Å; Y104-I188 HydrophobicContact CE1-CG1 4.41Å; Y104-I188 HydrophobicContact CE1-CG2 3.6Å; C184-I188 HydrophobicContact CB-CB 4.03Å; C184-I188 HydrophobicContact CB-CG2 4.31Å; C184-I188 PolarHBondContact O-N 3.04Å; I188-Y190 PolarHBondContact O-N 2.77Å; I188-D191 WeakPolarHBondContact O-CB 3.35Å; I188-D191 VanDerWaalsContact O-CG 3.31Å; I188-D191 PolarHBondContact O-N 3.49Å; I188-M194 HydrophobicContact CG2-CB 4.19Å; I188-M194 HydrophobicContact CG2-CG 4.41Å; I188-M194 HydrophobicContact CG2-SD 3.59Å; I188-M194 VanDerWaalsContact CG2-SD 3.59Å
189	I	95.5	Very high	94.8	Very high	1 Å²	1	46 Å²	46	1%	0.005	22%	0.218	C	C	.	.	G	3₁₀ helix	trans	-62.1	-25.4	179.7	-155.5	168.2	0	0	0	113.3	V181 C184 S187 M195 L228 V231 I279 M282	V181-I189 HydrophobicContact CG1-CD1 3.81Å; C184-I189 HydrophobicContact CB-CB 4.21Å; C184-I189 WeakPolarHBondContact O-CB 3.31Å; C184-I189 WeakPolarHBondContact O-CG2 3.31Å; C184-I189 PolarHBondContact O-N 2.92Å; C184-I189 VanDerWaalsContact O-N 3.14Å; S187-I189 PolarHBondContact O-N 2.94Å; S187-I189 VanDerWaalsContact O-N 3.08Å; I189-M195 HydrophobicContact CG1-CE 4.35Å; I189-M195 HydrophobicContact CG1-CG 3.7Å; I189-M195 HydrophobicContact CG1-SD 3.96Å; I189-L228 HydrophobicContact CD1-CD2 3.84Å; I189-V231 HydrophobicContact CD1-CG2 4.35Å; I189-I279 HydrophobicContact CD1-CD1 3.71Å; I189-I279 HydrophobicContact CG1-CD1 4.08Å; I189-I279 HydrophobicContact CG2-CD1 4.42Å; I189-M282 WeakPolarHBondContact O-CE 3.43Å
190	Y	95.1	Very high	94.8	Very high	41 Å²	41	48.1 Å²	48.1	16%	0.161	23%	0.233	C	C	.	.	G	3₁₀ helix	trans	-102.5	21	-179.6	-42.8	-81.1	0	0	0	112.7	Q185 S187 I188 E192 N275 I279	Q185-Y190 WeakPolarHBondContact O-CE2 3.35Å; Q185-Y190 PolarHBondContact O-OH 3.46Å; S187-Y190 PolarHBondContact O-N 2.9Å; I188-Y190 PolarHBondContact O-N 2.77Å; Y190-E192 VanDerWaalsContact C-N 3.29Å; Y190-E192 PolarHBondContact O-N 3.11Å; Y190-N275 HydrophobicContact CD1-CB 4.09Å; Y190-N275 HydrophobicContact CE1-CB 3.51Å; Y190-N275 WeakPolarHBondContact CE2-ND2 3.45Å; Y190-N275 VanDerWaalsContact CZ-ND2 3.32Å; Y190-I279 HydrophobicContact CE1-CD1 4.07Å; Y190-I279 HydrophobicContact CE1-CG1 3.84Å
191	D	94.3	Very high	94.8	Very high	32 Å²	32	47.8 Å²	47.8	17%	0.171	23%	0.231	C	C	.	.	S	Bend	trans	-88.5	12.7	-172.3	90.5	-19.7	0	0	0	115.6	Y104 R108 I188 Y193 M194	Y104-D191 VanDerWaalsContact CE1-OD2 3.31Å; Y104-D191 WeakPolarHBondContact CE1-OD2 3.45Å; Y104-D191 PolarHBondContact OH-OD1 2.98Å; Y104-D191 PolarHBondContact OH-OD2 2.94Å; R108-D191 IonicContact CZ-OD2 2.69Å; R108-D191 IonicContact NE-OD2 3.96Å; R108-D191 IonicContact NH1-OD2 2.83Å; R108-D191 PolarHBondContact NH1-OD2 2.93Å; R108-D191 IonicContact NH2-OD2 3.81Å; R108-D191 PolarHBondContact NH2-OD2 3.12Å; I188-D191 WeakPolarHBondContact O-CB 3.35Å; I188-D191 VanDerWaalsContact O-CG 3.31Å; I188-D191 PolarHBondContact O-N 3.49Å; D191-Y193 PolarHBondContact O-N 3.2Å; D191-Y193 PolarHBondContact OD1-N 3.08Å; D191-M194 PolarHBondContact OD1-N 3.47Å
192	E	93.1	Very high	94.9	Very high	178 Å²	178	47.8 Å²	47.8	83%	0.832	23%	0.231	S	C	*	.	S	Bend	trans	53.7	16.3	-177.2	-63.5	179	-147.3	0	0	114.7	Y190	Y190-E192 VanDerWaalsContact C-N 3.29Å; Y190-E192 PolarHBondContact O-N 3.11Å
193	Y	94.3	Very high	95.1	Very high	74 Å²	74	44 Å²	44	29%	0.29	22%	0.221	S	C	.	.	S	Bend	trans	-136.7	-50.5	-172.7	-167.6	-121.7	0	0	0	114.9	R108 D109 L112 D191 T197	R108-Y193 HydrophobicContact CB-CD1 4.21Å; R108-Y193 HydrophobicContact CB-CE1 3.96Å; D109-Y193 PolarHBondContact OD1-OH 3.36Å; L112-Y193 HydrophobicContact CD1-CD1 3.67Å; L112-Y193 HydrophobicContact CD1-CE1 3.35Å; D191-Y193 PolarHBondContact O-N 3.2Å; D191-Y193 PolarHBondContact OD1-N 3.08Å; Y193-T197 WeakPolarHBondContact O-CB 3.47Å; Y193-T197 PolarHBondContact O-N 3.27Å; Y193-T197 PolarHBondContact O-OG1 3.15Å
194	M	95.4	Very high	95.2	Very high	4 Å²	4	42.2 Å²	42.2	2%	0.02	22%	0.22	C	C	.	.	H	α-helix	trans	-63	-54.9	-175.8	-176.6	-158.1	165.1	0	0	111.6	W100 Y104 L112 L115 L180 I188 D191 T197 V198	W100-M194 HydrophobicContact CH2-CE 3.77Å; W100-M194 HydrophobicContact CH2-CG 4.2Å; W100-M194 HydrophobicContact CH2-SD 4.13Å; W100-M194 HydrophobicContact CZ3-CE 3.81Å; W100-M194 HydrophobicContact CZ3-SD 4.18Å; Y104-M194 HydrophobicContact CE2-CB 4.37Å; L112-M194 HydrophobicContact CD2-CG 4.09Å; L115-M194 HydrophobicContact CD2-CE 4.16Å; L180-M194 HydrophobicContact CD1-CE 3.96Å; L180-M194 HydrophobicContact CD2-CE 3.8Å; L180-M194 HydrophobicContact CG-CE 3.85Å; I188-M194 HydrophobicContact CG2-CB 4.19Å; I188-M194 HydrophobicContact CG2-CG 4.41Å; I188-M194 HydrophobicContact CG2-SD 3.59Å; I188-M194 VanDerWaalsContact CG2-SD 3.59Å; D191-M194 PolarHBondContact OD1-N 3.47Å; M194-T197 PolarHBondContact O-N 2.93Å; M194-V198 WeakPolarHBondContact O-CG2 3.44Å; M194-V198 PolarHBondContact O-N 3.06Å; M194-V198 VanDerWaalsContact O-N 3.17Å
195	M	95.6	Very high	95.3	Very high	3 Å²	3	42.2 Å²	42.2	2%	0.015	22%	0.22	C	C	.	.	H	α-helix	trans	-70.2	-42.3	-170.6	-69.4	-64.6	-63.5	0	0	111.9	I189 T197 V198 I199 L224 L228 M282	I189-M195 HydrophobicContact CG1-CE 4.35Å; I189-M195 HydrophobicContact CG1-CG 3.7Å; I189-M195 HydrophobicContact CG1-SD 3.96Å; M195-T197 VanDerWaalsContact C-N 3.33Å; M195-T197 PolarHBondContact O-N 3.49Å; M195-V198 PolarHBondContact O-N 3.49Å; M195-I199 HydrophobicContact CB-CD1 4.48Å; M195-I199 HydrophobicContact CE-CD1 4.19Å; M195-I199 WeakPolarHBondContact O-CB 3.44Å; M195-I199 VanDerWaalsContact O-CG1 3.26Å; M195-I199 WeakPolarHBondContact O-CG1 3.49Å; M195-I199 PolarHBondContact O-N 2.95Å; M195-L224 HydrophobicContact CE-CD1 3.73Å; M195-L224 HydrophobicContact CE-CG 4.42Å; M195-L224 HydrophobicContact SD-CD1 4.47Å; M195-L228 HydrophobicContact CE-CD1 4.09Å; M195-L228 HydrophobicContact CE-CD2 3.87Å; M195-L228 HydrophobicContact CE-CG 4.26Å; M195-M282 HydrophobicContact CB-CE 3.97Å; M195-M282 HydrophobicContact CB-SD 3.71Å; M195-M282 HydrophobicContact CE-SD 4Å; M195-M282 HydrophobicContact CG-CE 4.33Å; M195-M282 HydrophobicContact CG-SD 3.9Å
196	D	94.6	Very high	95.6	Very high	99 Å²	99	41.7 Å²	41.7	53%	0.529	22%	0.218	S	C	.	.	H	α-helix	trans	-60.8	-42	177.3	-79.9	33.9	0	0	0	111.9	S200	D196-S200 WeakPolarHBondContact O-CB 3.27Å; D196-S200 PolarHBondContact O-N 2.91Å
197	T	95	Very high	95.9	Very high	24 Å²	24	38.5 Å²	38.5	15%	0.147	21%	0.213	C	C	.	.	H	α-helix	trans	-60.5	-48.4	175.2	-58.8	0	0	0	0	111.3	L112 I116 F134 Y193 M194 M195 L201	L112-T197 HydrophobicContact CD1-CG2 4.29Å; I116-T197 HydrophobicContact CD1-CG2 4.13Å; F134-T197 HydrophobicContact CE2-CG2 4.05Å; Y193-T197 WeakPolarHBondContact O-CB 3.47Å; Y193-T197 PolarHBondContact O-N 3.27Å; Y193-T197 PolarHBondContact O-OG1 3.15Å; M194-T197 PolarHBondContact O-N 2.93Å; M195-T197 VanDerWaalsContact C-N 3.33Å; M195-T197 PolarHBondContact O-N 3.49Å; T197-L201 WeakPolarHBondContact O-CB 3.46Å; T197-L201 PolarHBondContact O-N 3.46Å; T197-L201 VanDerWaalsContact O-N 3.08Å
198	V	96.6	Very high	96.1	Very high	9 Å²	9	35.7 Å²	35.7	6%	0.055	19%	0.193	C	C	.	.	H	α-helix	trans	-67.6	-45.9	-179.2	172.4	0	0	0	0	111.8	L112 L115 F119 M194 M195 L201 L202 L224	L112-V198 HydrophobicContact CD2-CG2 4.5Å; L115-V198 HydrophobicContact CD2-CG2 3.67Å; L115-V198 HydrophobicContact CG-CG2 4.46Å; F119-V198 HydrophobicContact CE2-CG1 3.99Å; F119-V198 HydrophobicContact CZ-CG1 4.39Å; M194-V198 WeakPolarHBondContact O-CG2 3.44Å; M194-V198 PolarHBondContact O-N 3.06Å; M194-V198 VanDerWaalsContact O-N 3.17Å; M195-V198 PolarHBondContact O-N 3.49Å; V198-L201 PolarHBondContact O-N 2.89Å; V198-L202 HydrophobicContact CG1-CD1 3.79Å; V198-L202 HydrophobicContact CG1-CG 4.27Å; V198-L202 WeakPolarHBondContact O-CB 3.08Å; V198-L202 VanDerWaalsContact O-CG 3.29Å; V198-L202 WeakPolarHBondContact O-CG 3.47Å; V198-L202 PolarHBondContact O-N 2.62Å; V198-L224 HydrophobicContact CG1-CD2 3.97Å
199	I	97.7	Very high	96.2	Very high	13 Å²	13	42.8 Å²	42.8	7%	0.067	23%	0.225	C	C	.	.	H	α-helix	trans	-65.3	-42.2	180	-68.4	170.2	0	0	0	110.5	M195 L202 T203 L224 M282 A285 I286	M195-I199 HydrophobicContact CB-CD1 4.48Å; M195-I199 HydrophobicContact CE-CD1 4.19Å; M195-I199 WeakPolarHBondContact O-CB 3.44Å; M195-I199 VanDerWaalsContact O-CG1 3.26Å; M195-I199 WeakPolarHBondContact O-CG1 3.49Å; M195-I199 PolarHBondContact O-N 2.95Å; I199-L202 PolarHBondContact O-N 3.01Å; I199-T203 VanDerWaalsContact O-CB 3.26Å; I199-T203 WeakPolarHBondContact O-CB 3.44Å; I199-T203 PolarHBondContact O-N 3.22Å; I199-T203 PolarHBondContact O-OG1 2.81Å; I199-L224 HydrophobicContact CG1-CD2 3.88Å; I199-M282 HydrophobicContact CD1-CB 3.81Å; I199-M282 HydrophobicContact CD1-CG 4Å; I199-A285 HydrophobicContact CG2-CB 4.09Å; I199-I286 HydrophobicContact CD1-CD1 4.12Å; I199-I286 HydrophobicContact CD1-CG1 4.17Å; I199-I286 HydrophobicContact CG1-CD1 4.07Å; I199-I286 HydrophobicContact CG1-CG1 4.01Å; I199-I286 HydrophobicContact CG2-CG1 4Å
200	S	97.1	Very high	96.2	Very high	64 Å²	64	44.5 Å²	44.5	45%	0.448	24%	0.236	S	C	.	.	H	α-helix	trans	-60.5	-46.5	176.1	-179	0	0	0	0	111.9	N139 D196 G204	N139-S200 PolarHBondContact ND2-OG 3.28Å; D196-S200 WeakPolarHBondContact O-CB 3.27Å; D196-S200 PolarHBondContact O-N 2.91Å; S200-G204 PolarHBondContact O-N 2.9Å
201	L	97	Very high	96.3	Very high	1 Å²	1	46.7 Å²	46.7	1%	0.005	24%	0.244	C	C	.	.	H	α-helix	trans	-65.1	-48.8	177.2	175.4	62.3	0	0	0	112	I116 N139 I143 T197 V198 T203 G204 L205	I116-L201 HydrophobicContact CB-CD2 4.01Å; I116-L201 HydrophobicContact CG1-CD2 3.78Å; I116-L201 HydrophobicContact CG2-CD2 3.8Å; N139-L201 PolarHBondContact ND2-N 3.35Å; I143-L201 HydrophobicContact CD1-CD1 4.4Å; I143-L201 HydrophobicContact CG1-CD1 4.37Å; T197-L201 WeakPolarHBondContact O-CB 3.46Å; T197-L201 PolarHBondContact O-N 3.46Å; T197-L201 VanDerWaalsContact O-N 3.08Å; V198-L201 PolarHBondContact O-N 2.89Å; L201-T203 VanDerWaalsContact C-N 3.32Å; L201-T203 PolarHBondContact O-N 3.48Å; L201-G204 PolarHBondContact O-N 2.84Å; L201-L205 HydrophobicContact CD1-CD1 3.83Å; L201-L205 HydrophobicContact CD1-CG 3.95Å; L201-L205 HydrophobicContact CD2-CD1 4.36Å; L201-L205 HydrophobicContact CG-CD1 3.78Å; L201-L205 HydrophobicContact CG-CG 4.34Å; L201-L205 WeakPolarHBondContact O-CB 3.44Å; L201-L205 WeakPolarHBondContact O-CG 3.29Å; L201-L205 PolarHBondContact O-N 3.1Å
202	L	98.1	Very high	96.4	Very high	2 Å²	2	45.6 Å²	45.6	1%	0.01	24%	0.239	C	C	.	.	H	α-helix	trans	-64.3	-37.9	-178.2	-70.1	-180	0	0	0	111.8	F119 V198 I199 L205 S206 A220 A221 L224	F119-L202 HydrophobicContact CB-CD2 4.45Å; F119-L202 HydrophobicContact CD1-CD2 4.01Å; F119-L202 HydrophobicContact CD2-CD2 4.24Å; F119-L202 HydrophobicContact CE1-CD2 4.3Å; F119-L202 HydrophobicContact CG-CD2 3.99Å; F119-L202 HydrophobicContact CZ-CD1 4.38Å; V198-L202 HydrophobicContact CG1-CD1 3.79Å; V198-L202 HydrophobicContact CG1-CG 4.27Å; V198-L202 WeakPolarHBondContact O-CB 3.08Å; V198-L202 VanDerWaalsContact O-CG 3.29Å; V198-L202 WeakPolarHBondContact O-CG 3.47Å; V198-L202 PolarHBondContact O-N 2.62Å; I199-L202 PolarHBondContact O-N 3.01Å; L202-L205 PolarHBondContact O-N 2.9Å; L202-S206 VanDerWaalsContact O-CB 3.3Å; L202-S206 WeakPolarHBondContact O-CB 3.3Å; L202-S206 PolarHBondContact O-N 3.28Å; L202-A220 HydrophobicContact CD1-CB 3.96Å; L202-A220 HydrophobicContact CD2-CB 3.77Å; L202-A221 HydrophobicContact CB-CB 4.41Å; L202-L224 HydrophobicContact CD1-CD2 3.87Å
203	T	98.2	Very high	96.7	Very high	39 Å²	39	37.1 Å²	37.1	24%	0.239	20%	0.2	C	C	.	.	H	α-helix	trans	-62.1	-50.4	173.4	-57.6	0	0	0	0	110.7	I199 L201 L205 S206 D207 V290	I199-T203 VanDerWaalsContact O-CB 3.26Å; I199-T203 WeakPolarHBondContact O-CB 3.44Å; I199-T203 PolarHBondContact O-N 3.22Å; I199-T203 PolarHBondContact O-OG1 2.81Å; L201-T203 VanDerWaalsContact C-N 3.32Å; L201-T203 PolarHBondContact O-N 3.48Å; T203-L205 PolarHBondContact O-N 3.25Å; T203-S206 PolarHBondContact O-N 3.39Å; T203-S206 VanDerWaalsContact O-N 3.07Å; T203-S206 PolarHBondContact O-OG 3.2Å; T203-D207 PolarHBondContact O-N 2.98Å; T203-V290 HydrophobicContact CG2-CG2 4.43Å
204	G	97.3	Very high	96.9	Very high	29 Å²	29	34.6 Å²	34.6	30%	0.299	19%	0.19	S	C	.	.	H	α-helix	trans	-58.5	-45.1	176.7	0	0	0	0	0	113.3	S200 L201 S206 D207 S208	S200-G204 PolarHBondContact O-N 2.9Å; L201-G204 PolarHBondContact O-N 2.84Å; G204-S206 VanDerWaalsContact C-N 3.25Å; G204-S206 PolarHBondContact O-N 3.43Å; G204-D207 PolarHBondContact O-N 3.31Å; G204-S208 PolarHBondContact O-N 3.46Å
205	L	97.7	Very high	97	Very high	1 Å²	1	34.5 Å²	34.5	1%	0.005	19%	0.189	C	C	.	.	H	α-helix	trans	-63	-33.6	175.9	-75	168.6	0	0	0	111.7	I120 I143 L201 L202 T203 D207 S208 F213 R214 S217	I120-L205 HydrophobicContact CD1-CD1 4.24Å; I120-L205 HydrophobicContact CD1-CD2 3.87Å; I143-L205 HydrophobicContact CD1-CD2 4.09Å; I143-L205 HydrophobicContact CD1-CG 3.99Å; I143-L205 HydrophobicContact CG1-CD2 3.73Å; I143-L205 HydrophobicContact CG1-CG 4.1Å; I143-L205 HydrophobicContact CG2-CD2 4.21Å; L201-L205 HydrophobicContact CD1-CD1 3.83Å; L201-L205 HydrophobicContact CD1-CG 3.95Å; L201-L205 HydrophobicContact CD2-CD1 4.36Å; L201-L205 HydrophobicContact CG-CD1 3.78Å; L201-L205 HydrophobicContact CG-CG 4.34Å; L201-L205 WeakPolarHBondContact O-CB 3.44Å; L201-L205 WeakPolarHBondContact O-CG 3.29Å; L201-L205 PolarHBondContact O-N 3.1Å; L202-L205 PolarHBondContact O-N 2.9Å; T203-L205 PolarHBondContact O-N 3.25Å; L205-D207 PolarHBondContact O-N 3.26Å; L205-S208 VanDerWaalsContact O-CB 3.3Å; L205-S208 WeakPolarHBondContact O-CB 3.22Å; L205-S208 PolarHBondContact O-N 3.29Å; L205-F213 HydrophobicContact CD2-CB 3.86Å; L205-F213 HydrophobicContact CD2-CD1 3.67Å; L205-F213 HydrophobicContact CD2-CD2 4.33Å; L205-F213 HydrophobicContact CD2-CE1 4.32Å; L205-F213 HydrophobicContact CD2-CG 3.71Å; L205-R214 WeakPolarHBondContact O-CA 3.37Å; L205-S217 PolarHBondContact O-OG 2.92Å
206	S	98.2	Very high	97.2	Very high	1 Å²	1	34.4 Å²	34.4	1%	0.007	19%	0.189	C	C	.	.	H	α-helix	trans	-73.3	-11.8	178.9	81.2	0	0	0	0	114.2	L202 T203 G204 R214 S217 R294	L202-S206 VanDerWaalsContact O-CB 3.3Å; L202-S206 WeakPolarHBondContact O-CB 3.3Å; L202-S206 PolarHBondContact O-N 3.28Å; T203-S206 PolarHBondContact O-N 3.39Å; T203-S206 VanDerWaalsContact O-N 3.07Å; T203-S206 PolarHBondContact O-OG 3.2Å; G204-S206 VanDerWaalsContact C-N 3.25Å; G204-S206 PolarHBondContact O-N 3.43Å; S206-R214 VanDerWaalsContact O-CD 3.23Å; S206-R214 WeakPolarHBondContact O-CD 3.38Å; S206-R214 VanDerWaalsContact O-CG 3.27Å; S206-R214 WeakPolarHBondContact O-CG 3.31Å; S206-S217 WeakPolarHBondContact CA-OG 3.4Å; S206-S217 WeakPolarHBondContact CB-OG 3.4Å; S206-S217 PolarHBondContact N-OG 3.08Å; S206-R294 WeakPolarHBondContact O-CD 3.39Å; S206-R294 PolarHBondContact O-NE 3.2Å
207	D	97.3	Very high	97.3	Very high	100 Å²	100	29.9 Å²	29.9	54%	0.535	17%	0.165	S	C	.	.	H	α-helix	trans	-100.8	-3.4	171.1	-152.1	49.1	0	0	0	113.1	T203 G204 L205 R294	T203-D207 PolarHBondContact O-N 2.98Å; G204-D207 PolarHBondContact O-N 3.31Å; L205-D207 PolarHBondContact O-N 3.26Å; D207-R294 IonicContact OD1-NH2 2.9Å; D207-R294 PolarHBondContact OD1-NH2 2.89Å; D207-R294 VanDerWaalsContact OD1-NH2 3.15Å
208	S	96.9	Very high	97.5	Very high	16 Å²	16	28.7 Å²	28.7	11%	0.112	16%	0.158	C	C	.	.			trans	-62.2	137.6	175.8	-173.7	0	0	0	0	111.9	G204 L205 V210 R214	G204-S208 PolarHBondContact O-N 3.46Å; L205-S208 VanDerWaalsContact O-CB 3.3Å; L205-S208 WeakPolarHBondContact O-CB 3.22Å; L205-S208 PolarHBondContact O-N 3.29Å; S208-V210 PolarHBondContact O-N 3.31Å; S208-V210 PolarHBondContact OG-N 2.94Å; S208-R214 WeakPolarHBondContact O-CB 3.41Å; S208-R214 WeakPolarHBondContact O-CD 3.32Å; S208-R214 PolarHBondContact O-NH1 2.89Å
209	Q	94.9	Very high	97.6	Very high	167 Å²	167	28.5 Å²	28.5	78%	0.78	16%	0.156	S	C	*	.	S	Bend	trans	-66.4	-25.2	173.6	-62.7	-57.6	-33.5	0	0	112	R211 R214	Q209-R211 PolarHBondContact O-N 2.96Å; Q209-R211 VanDerWaalsContact O-N 3.1Å; Q209-R214 PolarHBondContact O-NH1 3.32Å
210	V	96	Very high	97.7	Very high	38 Å²	38	27.9 Å²	27.9	23%	0.23	15%	0.153	C	C	.	.			trans	-63.2	109.8	174.9	-177.7	0	0	0	0	109.8	T147 F150 S208 A212 F213 R214	T147-V210 HydrophobicContact CG2-CG2 3.56Å; F150-V210 HydrophobicContact CE2-CG1 4.14Å; S208-V210 PolarHBondContact O-N 3.31Å; S208-V210 PolarHBondContact OG-N 2.94Å; V210-A212 HydrophobicContact CG1-CB 4.17Å; V210-A212 PolarHBondContact O-N 3.03Å; V210-F213 HydrophobicContact CB-CB 4.42Å; V210-F213 HydrophobicContact CB-CD2 3.8Å; V210-F213 HydrophobicContact CB-CG 4.5Å; V210-F213 HydrophobicContact CG1-CB 4.49Å; V210-F213 HydrophobicContact CG1-CD2 3.78Å; V210-F213 HydrophobicContact CG1-CE2 4.39Å; V210-F213 HydrophobicContact CG1-CG 4.34Å; V210-F213 HydrophobicContact CG2-CD2 4.19Å; V210-F213 PolarHBondContact O-N 3.16Å; V210-R214 WeakPolarHBondContact O-CB 3.42Å; V210-R214 PolarHBondContact O-N 3.49Å
211	R	97	Very high	97.7	Very high	86 Å²	86	24.9 Å²	24.9	33%	0.325	13%	0.132	S	C	.	.	H	α-helix	trans	-54.7	-38.2	-178.7	178.4	-178.5	168.3	175.6	-0.2	112.5	Y157 Q209 R214 H215 I299 E301	Y157-R211 HydrophobicContact CE1-CG 4.27Å; Y157-R211 WeakPolarHBondContact OH-CG 3.47Å; Y157-R211 PolarHBondContact OH-NE 3.3Å; Q209-R211 PolarHBondContact O-N 2.96Å; Q209-R211 VanDerWaalsContact O-N 3.1Å; R211-R214 PolarHBondContact O-N 3.29Å; R211-H215 VanDerWaalsContact O-CB 3.27Å; R211-H215 WeakPolarHBondContact O-CB 3.39Å; R211-H215 PolarHBondContact O-N 2.71Å; R211-I299 HydrophobicContact CG-CG1 4.25Å; R211-E301 IonicContact CZ-OE1 3.75Å; R211-E301 IonicContact CZ-OE2 3.23Å; R211-E301 IonicContact NH2-OE1 2.63Å; R211-E301 PolarHBondContact NH2-OE1 3.04Å; R211-E301 IonicContact NH2-OE2 2.81Å; R211-E301 PolarHBondContact NH2-OE2 3.18Å
212	A	97.5	Very high	97.8	Very high	9 Å²	9	24.8 Å²	24.8	7%	0.074	13%	0.132	C	C	.	.	H	α-helix	trans	-63.3	-48.8	-177.5	0	0	0	0	0	112.5	S123 F150 Y157 V210 T216	S123-A212 WeakPolarHBondContact O-CB 3.42Å; F150-A212 HydrophobicContact CE2-CB 4.15Å; F150-A212 HydrophobicContact CZ-CB 3.75Å; Y157-A212 HydrophobicContact CD1-CB 3.71Å; Y157-A212 HydrophobicContact CD2-CB 3.98Å; Y157-A212 HydrophobicContact CE1-CB 4.23Å; Y157-A212 HydrophobicContact CE2-CB 4.47Å; Y157-A212 HydrophobicContact CG-CB 3.58Å; V210-A212 HydrophobicContact CG1-CB 4.17Å; V210-A212 PolarHBondContact O-N 3.03Å; A212-T216 WeakPolarHBondContact O-CB 3.34Å; A212-T216 PolarHBondContact O-N 3.12Å; A212-T216 PolarHBondContact O-OG1 3.34Å
213	F	98.1	Very high	97.8	Very high	0 Å²	0	26.9 Å²	26.9	0%	0	14%	0.141	C	C	.	.	H	α-helix	trans	-61.3	-51.8	170.7	-71.5	-44.8	0	0	0	111.2	I120 S123 C125 M146 F150 L205 V210 H215 T216 S217	I120-F213 HydrophobicContact CD1-CD1 4.34Å; I120-F213 HydrophobicContact CD1-CE1 3.78Å; I120-F213 HydrophobicContact CD1-CZ 4.35Å; I120-F213 HydrophobicContact CG2-CE1 4.21Å; S123-F213 VanDerWaalsContact CB-CD1 3.45Å; C125-F213 HydrophobicContact CB-CE1 3.77Å; C125-F213 HydrophobicContact CB-CZ 3.77Å; M146-F213 HydrophobicContact CB-CE2 4.49Å; M146-F213 HydrophobicContact CB-CZ 3.93Å; M146-F213 WeakPolarHBondContact O-CZ 3.3Å; F150-F213 HydrophobicContact CD2-CD2 4.48Å; F150-F213 HydrophobicContact CD2-CE1 4.28Å; F150-F213 AromaticContact CD2-CE2 3.67Å; F150-F213 HydrophobicContact CD2-CE2 3.67Å; F150-F213 AromaticContact CD2-CZ 3.54Å; F150-F213 HydrophobicContact CD2-CZ 3.54Å; F150-F213 HydrophobicContact CE2-CD1 4.4Å; F150-F213 HydrophobicContact CE2-CD2 4.31Å; F150-F213 AromaticContact CE2-CE1 3.95Å; F150-F213 HydrophobicContact CE2-CE1 3.95Å; F150-F213 AromaticContact CE2-CE2 3.87Å; F150-F213 HydrophobicContact CE2-CE2 3.87Å; F150-F213 AromaticContact CE2-CZ 3.66Å; F150-F213 HydrophobicContact CE2-CZ 3.66Å; L205-F213 HydrophobicContact CD2-CB 3.86Å; L205-F213 HydrophobicContact CD2-CD1 3.67Å; L205-F213 HydrophobicContact CD2-CD2 4.33Å; L205-F213 HydrophobicContact CD2-CE1 4.32Å; L205-F213 HydrophobicContact CD2-CG 3.71Å; V210-F213 HydrophobicContact CB-CB 4.42Å; V210-F213 HydrophobicContact CB-CD2 3.8Å; V210-F213 HydrophobicContact CB-CG 4.5Å; V210-F213 HydrophobicContact CG1-CB 4.49Å; V210-F213 HydrophobicContact CG1-CD2 3.78Å; V210-F213 HydrophobicContact CG1-CE2 4.39Å; V210-F213 HydrophobicContact CG1-CG 4.34Å; V210-F213 HydrophobicContact CG2-CD2 4.19Å; V210-F213 PolarHBondContact O-N 3.16Å; F213-H215 PolarHBondContact O-N 3.38Å; F213-T216 PolarHBondContact O-N 2.82Å; F213-S217 WeakPolarHBondContact O-CB 3.46Å; F213-S217 PolarHBondContact O-N 3.31Å; F213-S217 PolarHBondContact O-OG 3.27Å; F213-S217 VanDerWaalsContact O-OG 3.05Å
214	R	98.4	Very high	97.8	Very high	22 Å²	22	25.3 Å²	25.3	8%	0.083	13%	0.131	C	C	.	.	H	α-helix	trans	-63	-41.5	-172.9	-174	164.3	79.8	-101.2	2.7	114.2	L205 S206 S208 Q209 V210 R211 S217 T218 D297 I302	L205-R214 WeakPolarHBondContact O-CA 3.37Å; S206-R214 VanDerWaalsContact O-CD 3.23Å; S206-R214 WeakPolarHBondContact O-CD 3.38Å; S206-R214 VanDerWaalsContact O-CG 3.27Å; S206-R214 WeakPolarHBondContact O-CG 3.31Å; S208-R214 WeakPolarHBondContact O-CB 3.41Å; S208-R214 WeakPolarHBondContact O-CD 3.32Å; S208-R214 PolarHBondContact O-NH1 2.89Å; Q209-R214 PolarHBondContact O-NH1 3.32Å; V210-R214 WeakPolarHBondContact O-CB 3.42Å; V210-R214 PolarHBondContact O-N 3.49Å; R211-R214 PolarHBondContact O-N 3.29Å; R214-S217 PolarHBondContact O-OG 3.09Å; R214-T218 VanDerWaalsContact O-CB 3.26Å; R214-T218 WeakPolarHBondContact O-CB 3.5Å; R214-T218 PolarHBondContact O-N 3.45Å; R214-T218 VanDerWaalsContact O-N 3.1Å; R214-T218 PolarHBondContact O-OG1 3.3Å; R214-D297 WeakPolarHBondContact CD-OD2 3.16Å; R214-D297 IonicContact CZ-OD1 2.8Å; R214-D297 IonicContact CZ-OD2 2.9Å; R214-D297 IonicContact NE-OD1 2.74Å; R214-D297 IonicContact NE-OD2 2.91Å; R214-D297 PolarHBondContact NE-OD2 3.37Å; R214-D297 IonicContact NH2-OD1 3.28Å; R214-D297 PolarHBondContact NH2-OD1 3.41Å; R214-D297 IonicContact NH2-OD2 2.7Å; R214-I302 HydrophobicContact CG-CD1 4.26Å
215	H	98.4	Very high	97.9	Very high	2 Å²	2	24 Å²	24	1%	0.009	12%	0.117	C	C	.	.	H	α-helix	trans	-65	-49.8	175.4	-174.6	170.2	0	0	0	109.6	Y157 R211 F213 T218 L219 E301 I302 I305	Y157-H215 HydrophobicContact CE2-CB 3.92Å; Y157-H215 AromaticContact CE2-ND1 3.78Å; Y157-H215 AromaticContact CZ-ND1 3.77Å; Y157-H215 WeakPolarHBondContact OH-CB 3.41Å; Y157-H215 PolarHBondContact OH-ND1 2.81Å; R211-H215 VanDerWaalsContact O-CB 3.27Å; R211-H215 WeakPolarHBondContact O-CB 3.39Å; R211-H215 PolarHBondContact O-N 2.71Å; F213-H215 PolarHBondContact O-N 3.38Å; H215-T218 PolarHBondContact O-N 2.95Å; H215-L219 PolarHBondContact O-N 3.39Å; H215-E301 IonicContact CE1-OE2 2.61Å; H215-E301 PolarHBondContact CE1-OE2 3.18Å; H215-E301 IonicContact ND1-OE2 2.65Å; H215-E301 PolarHBondContact ND1-OE2 2.84Å; H215-E301 VanDerWaalsContact ND1-OE2 3.13Å; H215-I302 HydrophobicContact CB-CD1 3.86Å; H215-I302 HydrophobicContact CB-CG1 4Å; H215-I305 WeakPolarHBondContact NE2-CD1 3.44Å
216	T	98.5	Very high	97.9	Very high	1 Å²	1	25 Å²	25	1%	0.006	12%	0.123	C	C	.	.	H	α-helix	trans	-65.6	-43.9	-174.9	-51.4	0	0	0	0	112.5	C122 S123 L159 F173 A212 F213 L219 A220	C122-T216 HydrophobicContact CB-CG2 3.99Å; S123-T216 WeakPolarHBondContact OG-CB 3.48Å; S123-T216 WeakPolarHBondContact OG-CG2 3.49Å; L159-T216 HydrophobicContact CD1-CG2 4.28Å; F173-T216 HydrophobicContact CE1-CG2 4.29Å; F173-T216 HydrophobicContact CZ-CG2 3.86Å; A212-T216 WeakPolarHBondContact O-CB 3.34Å; A212-T216 PolarHBondContact O-N 3.12Å; A212-T216 PolarHBondContact O-OG1 3.34Å; F213-T216 PolarHBondContact O-N 2.82Å; T216-L219 PolarHBondContact O-N 3.04Å; T216-A220 WeakPolarHBondContact O-CB 3.49Å; T216-A220 PolarHBondContact O-N 3.32Å
217	S	98.4	Very high	97.9	Very high	3 Å²	3	25.5 Å²	25.5	2%	0.021	13%	0.127	C	C	.	.	H	α-helix	trans	-69.7	-34.6	177.1	67.6	0	0	0	0	112.7	L205 S206 F213 R214 A220 A221	L205-S217 PolarHBondContact O-OG 2.92Å; S206-S217 WeakPolarHBondContact CA-OG 3.4Å; S206-S217 WeakPolarHBondContact CB-OG 3.4Å; S206-S217 PolarHBondContact N-OG 3.08Å; F213-S217 WeakPolarHBondContact O-CB 3.46Å; F213-S217 PolarHBondContact O-N 3.31Å; F213-S217 PolarHBondContact O-OG 3.27Å; F213-S217 VanDerWaalsContact O-OG 3.05Å; R214-S217 PolarHBondContact O-OG 3.09Å; S217-A220 PolarHBondContact O-N 3.11Å; S217-A221 WeakPolarHBondContact O-CB 3.27Å; S217-A221 PolarHBondContact O-N 3.49Å
218	T	98.8	Very high	97.9	Very high	0 Å²	0	20.8 Å²	20.8	0%	0	10%	0.102	C	C	.	.	H	α-helix	trans	-63.8	-47	172.9	-57.2	0	0	0	0	110.3	R214 H215 A220 A221 M222 V290 R294 I302	R214-T218 VanDerWaalsContact O-CB 3.26Å; R214-T218 WeakPolarHBondContact O-CB 3.5Å; R214-T218 PolarHBondContact O-N 3.45Å; R214-T218 VanDerWaalsContact O-N 3.1Å; R214-T218 PolarHBondContact O-OG1 3.3Å; H215-T218 PolarHBondContact O-N 2.95Å; T218-A220 VanDerWaalsContact C-N 3.31Å; T218-A220 PolarHBondContact O-N 3.29Å; T218-A221 PolarHBondContact O-N 2.9Å; T218-M222 HydrophobicContact CG2-CG 4.15Å; T218-M222 VanDerWaalsContact O-CG 3.27Å; T218-M222 WeakPolarHBondContact O-CG 3.34Å; T218-M222 PolarHBondContact O-N 3.19Å; T218-V290 HydrophobicContact CG2-CG1 4.24Å; T218-R294 HydrophobicContact CG2-CB 3.75Å; T218-R294 HydrophobicContact CG2-CG 4.1Å; T218-R294 WeakPolarHBondContact OG1-CG 3.5Å; T218-I302 HydrophobicContact CG2-CG2 3.88Å
219	L	98.6	Very high	98	Very high	4 Å²	4	20 Å²	20	2%	0.021	10%	0.097	C	C	.	.	H	α-helix	trans	-58.6	-44.3	175.9	-179.7	60.2	0	0	0	111.5	L159 R170 F173 H215 T216 K223 I305	L159-L219 HydrophobicContact CD1-CB 4.47Å; L159-L219 HydrophobicContact CD1-CD2 3.77Å; L159-L219 HydrophobicContact CD2-CD2 3.88Å; R170-L219 HydrophobicContact CG-CD2 4.26Å; F173-L219 HydrophobicContact CD1-CD2 4.19Å; F173-L219 HydrophobicContact CE1-CD2 4.25Å; F173-L219 HydrophobicContact CE1-CG 4.33Å; H215-L219 PolarHBondContact O-N 3.39Å; T216-L219 PolarHBondContact O-N 3.04Å; L219-K223 HydrophobicContact CD1-CG 4.38Å; L219-K223 WeakPolarHBondContact O-CG 3.48Å; L219-K223 PolarHBondContact O-N 3.34Å; L219-K223 VanDerWaalsContact O-N 3.08Å; L219-I305 HydrophobicContact CB-CD1 4.36Å; L219-I305 HydrophobicContact CB-CG2 4.5Å; L219-I305 HydrophobicContact CD1-CD1 4.21Å; L219-I305 HydrophobicContact CD1-CG1 4.38Å; L219-I305 HydrophobicContact CD1-CG2 3.95Å
220	A	98.6	Very high	98.1	Very high	0 Å²	0	14.1 Å²	14.1	0%	0	7%	0.071	C	C	.	.	H	α-helix	trans	-61.8	-48	176.5	0	0	0	0	0	112.4	F119 F173 I177 L202 T216 S217 T218 K223 L224	F119-A220 HydrophobicContact CD1-CB 4.1Å; F119-A220 HydrophobicContact CE1-CB 3.8Å; F173-A220 HydrophobicContact CE1-CB 4.22Å; F173-A220 HydrophobicContact CZ-CB 3.92Å; I177-A220 HydrophobicContact CD1-CB 3.68Å; L202-A220 HydrophobicContact CD1-CB 3.96Å; L202-A220 HydrophobicContact CD2-CB 3.77Å; T216-A220 WeakPolarHBondContact O-CB 3.49Å; T216-A220 PolarHBondContact O-N 3.32Å; S217-A220 PolarHBondContact O-N 3.11Å; T218-A220 VanDerWaalsContact C-N 3.31Å; T218-A220 PolarHBondContact O-N 3.29Å; A220-K223 PolarHBondContact O-N 3.33Å; A220-L224 VanDerWaalsContact O-CB 3.28Å; A220-L224 WeakPolarHBondContact O-CB 3.22Å; A220-L224 PolarHBondContact O-N 3Å
221	A	98.7	Very high	98.1	Very high	1 Å²	1	12.5 Å²	12.5	1%	0.008	6%	0.061	C	C	.	.	H	α-helix	trans	-64.6	-39.9	-179.6	0	0	0	0	0	112.4	L202 S217 T218 L224 M225 I286 V290	L202-A221 HydrophobicContact CB-CB 4.41Å; S217-A221 WeakPolarHBondContact O-CB 3.27Å; S217-A221 PolarHBondContact O-N 3.49Å; T218-A221 PolarHBondContact O-N 2.9Å; A221-L224 PolarHBondContact O-N 3.39Å; A221-M225 WeakPolarHBondContact O-CB 3.46Å; A221-M225 PolarHBondContact O-N 3.45Å; A221-I286 HydrophobicContact CB-CG2 4.1Å; A221-V290 HydrophobicContact CB-CB 4.34Å; A221-V290 HydrophobicContact CB-CG1 4.05Å; A221-V290 HydrophobicContact CB-CG2 4.03Å
222	M	98.6	Very high	98.1	Very high	0 Å²	0	8.4 Å²	8.4	0%	0	5%	0.045	C	C	.	.	H	α-helix	trans	-68.9	-36	176.3	-59	-59.2	88.2	0	0	111.5	T218 M225 T226 I286 V290 F291 I305 C306 E309 W313	T218-M222 HydrophobicContact CG2-CG 4.15Å; T218-M222 VanDerWaalsContact O-CG 3.27Å; T218-M222 WeakPolarHBondContact O-CG 3.34Å; T218-M222 PolarHBondContact O-N 3.19Å; M222-M225 WeakPolarHBondContact O-CB 3.4Å; M222-M225 PolarHBondContact O-N 3.5Å; M222-T226 PolarHBondContact O-N 3.03Å; M222-T226 PolarHBondContact O-OG1 3.13Å; M222-I286 HydrophobicContact CE-CG2 3.84Å; M222-V290 HydrophobicContact CE-CB 3.97Å; M222-V290 HydrophobicContact CE-CG1 3.78Å; M222-F291 HydrophobicContact CE-CB 4.11Å; M222-F291 HydrophobicContact SD-CB 4.14Å; M222-F291 HydrophobicContact SD-CD2 3.89Å; M222-I305 HydrophobicContact CB-CG2 4.41Å; M222-I305 HydrophobicContact CG-CG2 4.16Å; M222-C306 HydrophobicContact SD-CB 4.45Å; M222-E309 HydrophobicContact CB-CB 3.93Å; M222-E309 HydrophobicContact CB-CG 3.74Å; M222-W313 HydrophobicContact CB-CZ2 4.49Å; M222-W313 HydrophobicContact SD-CH2 3.78Å; M222-W313 HydrophobicContact SD-CZ2 4Å
223	K	98.3	Very high	98	Very high	45 Å²	45	9.8 Å²	9.8	20%	0.196	5%	0.051	C	C	.	.	H	α-helix	trans	-70	-36.3	173.2	-69.7	-69.3	168.9	-158.6	0	113.2	C174 I177 L219 A220 T226 A227 E309	C174-K223 HydrophobicContact CB-CD 3.92Å; C174-K223 HydrophobicContact CB-CG 4.04Å; I177-K223 HydrophobicContact CG2-CB 4.28Å; L219-K223 HydrophobicContact CD1-CG 4.38Å; L219-K223 WeakPolarHBondContact O-CG 3.48Å; L219-K223 PolarHBondContact O-N 3.34Å; L219-K223 VanDerWaalsContact O-N 3.08Å; A220-K223 PolarHBondContact O-N 3.33Å; K223-T226 PolarHBondContact O-N 3.39Å; K223-A227 PolarHBondContact O-N 3.02Å; K223-E309 WeakPolarHBondContact CD-OE2 3.37Å; K223-E309 WeakPolarHBondContact CE-OE1 3.49Å; K223-E309 WeakPolarHBondContact CE-OE2 3.4Å; K223-E309 IonicContact NZ-OE1 2.71Å; K223-E309 PolarHBondContact NZ-OE1 2.7Å; K223-E309 IonicContact NZ-OE2 2.86Å; K223-E309 PolarHBondContact NZ-OE2 3.31Å
224	L	98.3	Very high	97.9	Very high	6 Å²	6	11.8 Å²	11.8	3%	0.031	6%	0.062	C	C	.	.	H	α-helix	trans	-60.9	-46.1	171.6	-179.1	58.8	0	0	0	110.9	I177 V181 M195 V198 I199 L202 A220 A221 A227 L228 I286	I177-L224 HydrophobicContact CG2-CB 4.07Å; I177-L224 HydrophobicContact CG2-CD1 4.49Å; V181-L224 HydrophobicContact CG2-CD1 3.41Å; V181-L224 VanDerWaalsContact CG2-CD1 3.41Å; M195-L224 HydrophobicContact CE-CD1 3.73Å; M195-L224 HydrophobicContact CE-CG 4.42Å; M195-L224 HydrophobicContact SD-CD1 4.47Å; V198-L224 HydrophobicContact CG1-CD2 3.97Å; I199-L224 HydrophobicContact CG1-CD2 3.88Å; L202-L224 HydrophobicContact CD1-CD2 3.87Å; A220-L224 VanDerWaalsContact O-CB 3.28Å; A220-L224 WeakPolarHBondContact O-CB 3.22Å; A220-L224 PolarHBondContact O-N 3Å; A221-L224 PolarHBondContact O-N 3.39Å; L224-A227 PolarHBondContact O-N 3.31Å; L224-L228 WeakPolarHBondContact O-CG 3.46Å; L224-L228 PolarHBondContact O-N 3.33Å; L224-I286 HydrophobicContact CB-CD1 4.26Å; L224-I286 HydrophobicContact CD2-CD1 3.81Å; L224-I286 HydrophobicContact CG-CD1 3.73Å
225	M	98.3	Very high	97.7	Very high	1 Å²	1	11.2 Å²	11.2	1%	0.005	6%	0.06	C	C	.	.	H	α-helix	trans	-59.2	-49.1	172.4	-176.3	71.5	179.9	0	0	111.8	A221 M222 A227 L228 V229 M283 I286 F287 W313 F321	A221-M225 WeakPolarHBondContact O-CB 3.46Å; A221-M225 PolarHBondContact O-N 3.45Å; M222-M225 WeakPolarHBondContact O-CB 3.4Å; M222-M225 PolarHBondContact O-N 3.5Å; M225-A227 PolarHBondContact O-N 3.17Å; M225-L228 PolarHBondContact O-N 3.48Å; M225-L228 VanDerWaalsContact O-N 3.09Å; M225-V229 HydrophobicContact CE-CG2 4.3Å; M225-V229 WeakPolarHBondContact O-CG2 3.45Å; M225-V229 PolarHBondContact O-N 3.27Å; M225-M283 HydrophobicContact CE-CB 3.79Å; M225-M283 HydrophobicContact CE-CG 4.04Å; M225-M283 HydrophobicContact CE-SD 4.26Å; M225-M283 HydrophobicContact SD-CB 3.72Å; M225-M283 HydrophobicContact SD-CG 3.74Å; M225-I286 HydrophobicContact CB-CD1 4.44Å; M225-I286 HydrophobicContact CB-CG2 4.07Å; M225-I286 HydrophobicContact SD-CB 4.36Å; M225-F287 HydrophobicContact CE-CB 4.48Å; M225-W313 HydrophobicContact CB-CH2 4.43Å; M225-W313 HydrophobicContact CB-CZ2 3.76Å; M225-W313 HydrophobicContact CE-CD2 4.48Å; M225-W313 HydrophobicContact CE-CE3 4.21Å; M225-W313 HydrophobicContact CE-CZ3 4.36Å; M225-W313 HydrophobicContact CG-CD2 4.01Å; M225-W313 VanDerWaalsContact CG-CE2 3.46Å; M225-W313 HydrophobicContact CG-CE3 4.32Å; M225-W313 HydrophobicContact CG-CH2 3.77Å; M225-W313 HydrophobicContact CG-CZ2 3.36Å; M225-W313 HydrophobicContact CG-CZ3 4.22Å; M225-F321 HydrophobicContact CE-CE1 3.87Å; M225-F321 HydrophobicContact CE-CZ 3.92Å
226	T	98.4	Very high	97.6	Very high	24 Å²	24	12.4 Å²	12.4	15%	0.147	7%	0.069	C	C	.	.	H	α-helix	trans	-56.7	-35	176.8	-60.6	0	0	0	0	112.5	M222 K223 N230 E309 V312 W313	M222-T226 PolarHBondContact O-N 3.03Å; M222-T226 PolarHBondContact O-OG1 3.13Å; K223-T226 PolarHBondContact O-N 3.39Å; T226-N230 PolarHBondContact O-N 2.85Å; T226-E309 PolarHBondContact OG1-OE2 3.17Å; T226-V312 HydrophobicContact CG2-CG1 3.81Å; T226-W313 PolarHBondContact OG1-NE1 3.09Å
227	A	97.9	Very high	97.4	Very high	11 Å²	11	16 Å²	16	9%	0.091	9%	0.088	C	C	.	.	H	α-helix	trans	-74.2	-41	175.2	0	0	0	0	0	112.7	V181 K223 L224 M225 V229 N230 V231	V181-A227 HydrophobicContact CB-CB 3.66Å; V181-A227 HydrophobicContact CG1-CB 3.67Å; V181-A227 HydrophobicContact CG2-CB 3.99Å; K223-A227 PolarHBondContact O-N 3.02Å; L224-A227 PolarHBondContact O-N 3.31Å; M225-A227 PolarHBondContact O-N 3.17Å; A227-V229 VanDerWaalsContact C-N 3.35Å; A227-V229 PolarHBondContact O-N 2.83Å; A227-N230 VanDerWaalsContact O-CB 3.28Å; A227-N230 WeakPolarHBondContact O-CB 3.46Å; A227-N230 PolarHBondContact O-N 3.44Å; A227-N230 VanDerWaalsContact O-N 3.1Å; A227-V231 PolarHBondContact O-N 3.46Å; A227-V231 VanDerWaalsContact O-N 3.13Å
228	L	98	Very high	97.2	Very high	0 Å²	0	18.9 Å²	18.9	0%	0	10%	0.103	C	C	.	.	H	α-helix	trans	-61.6	-39.3	174.2	-73.5	168.1	0	0	0	112.6	V181 I189 M195 L224 M225 N230 V231 A232 I279 M282 M283 I286	V181-L228 HydrophobicContact CG1-CD2 4.5Å; I189-L228 HydrophobicContact CD1-CD2 3.84Å; M195-L228 HydrophobicContact CE-CD1 4.09Å; M195-L228 HydrophobicContact CE-CD2 3.87Å; M195-L228 HydrophobicContact CE-CG 4.26Å; L224-L228 WeakPolarHBondContact O-CG 3.46Å; L224-L228 PolarHBondContact O-N 3.33Å; M225-L228 PolarHBondContact O-N 3.48Å; M225-L228 VanDerWaalsContact O-N 3.09Å; L228-N230 PolarHBondContact O-N 3.15Å; L228-V231 PolarHBondContact O-N 2.86Å; L228-A232 PolarHBondContact O-N 3.03Å; L228-I279 HydrophobicContact CB-CG2 4.43Å; L228-I279 HydrophobicContact CD2-CD1 3.66Å; L228-I279 HydrophobicContact CD2-CG2 4.21Å; L228-M282 HydrophobicContact CD1-CB 3.89Å; L228-M282 HydrophobicContact CD2-CB 4.46Å; L228-M282 HydrophobicContact CD2-SD 4.31Å; L228-M283 HydrophobicContact CB-CG 3.67Å; L228-M283 HydrophobicContact CB-SD 4.24Å; L228-M283 HydrophobicContact CD1-CG 4.28Å; L228-I286 HydrophobicContact CD1-CD1 3.72Å
229	V	98.1	Very high	96.9	Very high	0 Å²	0	21 Å²	21	0%	0	11%	0.113	C	C	.	.	H	α-helix	trans	-59.1	-34.5	173.6	174	0	0	0	0	111.5	M225 A227 L233 M283 W313 L316 Y317 F321	M225-V229 HydrophobicContact CE-CG2 4.3Å; M225-V229 WeakPolarHBondContact O-CG2 3.45Å; M225-V229 PolarHBondContact O-N 3.27Å; A227-V229 VanDerWaalsContact C-N 3.35Å; A227-V229 PolarHBondContact O-N 2.83Å; V229-L233 WeakPolarHBondContact O-CB 3.48Å; V229-L233 PolarHBondContact O-N 3.22Å; V229-L233 VanDerWaalsContact O-N 3.08Å; V229-M283 HydrophobicContact CB-SD 4.4Å; V229-M283 HydrophobicContact CG2-SD 3.66Å; V229-W313 HydrophobicContact CG2-CB 4.27Å; V229-W313 HydrophobicContact CG2-CG 4.05Å; V229-L316 HydrophobicContact CG1-CD2 4.1Å; V229-L316 HydrophobicContact CG1-CG 4.4Å; V229-Y317 HydrophobicContact CG1-CD1 4.4Å; V229-F321 HydrophobicContact CB-CE2 4.43Å; V229-F321 HydrophobicContact CG1-CD2 4.22Å; V229-F321 HydrophobicContact CG1-CE2 3.94Å; V229-F321 HydrophobicContact CG2-CE1 4.48Å; V229-F321 HydrophobicContact CG2-CE2 3.7Å; V229-F321 HydrophobicContact CG2-CZ 3.68Å
230	N	96.7	Very high	96.7	Very high	44 Å²	44	24.8 Å²	24.8	24%	0.235	13%	0.133	C	C	.	.	H	α-helix	trans	-69.6	-39.7	174.1	-161.8	-91.2	0	0	0	111.9	T226 A227 L228 L233 N234 L316	T226-N230 PolarHBondContact O-N 2.85Å; A227-N230 VanDerWaalsContact O-CB 3.28Å; A227-N230 WeakPolarHBondContact O-CB 3.46Å; A227-N230 PolarHBondContact O-N 3.44Å; A227-N230 VanDerWaalsContact O-N 3.1Å; L228-N230 PolarHBondContact O-N 3.15Å; N230-L233 PolarHBondContact O-N 3.32Å; N230-N234 PolarHBondContact O-N 2.75Å; N230-N234 PolarHBondContact O-ND2 2.82Å; N230-N234 PolarHBondContact OD1-ND2 2.96Å; N230-L316 HydrophobicContact CB-CD2 4.19Å
231	V	97.1	Very high	96.5	Very high	3 Å²	3	27.2 Å²	27.2	2%	0.018	15%	0.146	C	C	.	.	H	α-helix	trans	-64.6	-44.8	174.7	-179.4	0	0	0	0	111.2	V181 Q185 I189 A227 L228 L233 N234 L235 I279	V181-V231 HydrophobicContact CG1-CG2 4.13Å; Q185-V231 HydrophobicContact CB-CG1 4.07Å; Q185-V231 HydrophobicContact CB-CG2 3.65Å; I189-V231 HydrophobicContact CD1-CG2 4.35Å; A227-V231 PolarHBondContact O-N 3.46Å; A227-V231 VanDerWaalsContact O-N 3.13Å; L228-V231 PolarHBondContact O-N 2.86Å; V231-L233 VanDerWaalsContact C-N 3.34Å; V231-L233 PolarHBondContact O-N 3.09Å; V231-N234 WeakPolarHBondContact O-CB 3.5Å; V231-N234 PolarHBondContact O-N 3.09Å; V231-N234 VanDerWaalsContact O-N 3.14Å; V231-L235 HydrophobicContact CG1-CD1 4.21Å; V231-L235 HydrophobicContact CG1-CG 4.42Å; V231-L235 WeakPolarHBondContact O-CG 3.09Å; V231-L235 PolarHBondContact O-N 3.09Å; V231-I279 HydrophobicContact CG1-CD1 3.94Å; V231-I279 HydrophobicContact CG1-CG1 4.12Å
232	A	96.7	Very high	96.3	Very high	0 Å²	0	27.3 Å²	27.3	0%	0	15%	0.147	C	C	.	.	H	α-helix	trans	-59.9	-41.7	175.9	0	0	0	0	0	112.2	L228 L235 S236 Q276 I279 M283 Y317	L228-A232 PolarHBondContact O-N 3.03Å; A232-L235 PolarHBondContact O-N 2.91Å; A232-S236 WeakPolarHBondContact O-CB 3.21Å; A232-S236 PolarHBondContact O-N 3.14Å; A232-Q276 PolarHBondContact O-OE1 3.04Å; A232-I279 HydrophobicContact CB-CG2 3.96Å; A232-M283 HydrophobicContact CB-CE 3.83Å; A232-M283 HydrophobicContact CB-SD 4.39Å; A232-Y317 HydrophobicContact CB-CD1 4.37Å; A232-Y317 HydrophobicContact CB-CE1 4.02Å
233	L	95.9	Very high	96	Very high	38 Å²	38	29.5 Å²	29.5	20%	0.199	16%	0.157	C	C	.	.	H	α-helix	trans	-61.5	-44.3	173.3	179.4	62.4	0	0	0	111.7	V229 N230 V231 L235 S236 I237 L316 Y317	V229-L233 WeakPolarHBondContact O-CB 3.48Å; V229-L233 PolarHBondContact O-N 3.22Å; V229-L233 VanDerWaalsContact O-N 3.08Å; N230-L233 PolarHBondContact O-N 3.32Å; V231-L233 VanDerWaalsContact C-N 3.34Å; V231-L233 PolarHBondContact O-N 3.09Å; L233-L235 PolarHBondContact O-N 3.32Å; L233-S236 PolarHBondContact O-N 2.7Å; L233-I237 HydrophobicContact CD1-CD1 4.08Å; L233-I237 HydrophobicContact CD1-CG1 4.48Å; L233-I237 HydrophobicContact CG-CD1 4.02Å; L233-I237 VanDerWaalsContact O-CG1 3.3Å; L233-I237 WeakPolarHBondContact O-CG1 3.46Å; L233-I237 PolarHBondContact O-N 2.68Å; L233-L316 HydrophobicContact CD2-CD1 4.19Å; L233-L316 HydrophobicContact CD2-CG 4.43Å; L233-Y317 HydrophobicContact CB-CD1 4.12Å; L233-Y317 HydrophobicContact CB-CE1 4.47Å; L233-Y317 HydrophobicContact CB-CG 4.23Å; L233-Y317 HydrophobicContact CD1-CD2 3.77Å; L233-Y317 HydrophobicContact CD1-CE2 4.01Å; L233-Y317 HydrophobicContact CD1-CG 4.13Å
234	N	95.3	Very high	95.9	Very high	42 Å²	42	33.9 Å²	33.9	23%	0.225	17%	0.172	C	C	.	.	H	α-helix	trans	-64.8	-37.2	176.9	-64.6	-24.4	0	0	0	112.1	Q185 N230 V231 N238	Q185-N234 PolarHBondContact OE1-ND2 2.96Å; N230-N234 PolarHBondContact O-N 2.75Å; N230-N234 PolarHBondContact O-ND2 2.82Å; N230-N234 PolarHBondContact OD1-ND2 2.96Å; V231-N234 WeakPolarHBondContact O-CB 3.5Å; V231-N234 PolarHBondContact O-N 3.09Å; V231-N234 VanDerWaalsContact O-N 3.14Å; N234-N238 WeakPolarHBondContact O-CB 3.36Å; N234-N238 PolarHBondContact O-N 3.01Å; N234-N238 VanDerWaalsContact O-N 3.08Å; N234-N238 PolarHBondContact O-ND2 2.87Å
235	L	94.8	Very high	95.6	Very high	11 Å²	11	38.1 Å²	38.1	6%	0.058	19%	0.192	C	C	.	.	H	α-helix	trans	-65.7	-48.3	174.2	-74.9	173.2	0	0	0	111.2	V231 A232 L233 I237 N238 M239 L272 N275 Q276 I279	V231-L235 HydrophobicContact CG1-CD1 4.21Å; V231-L235 HydrophobicContact CG1-CG 4.42Å; V231-L235 WeakPolarHBondContact O-CG 3.09Å; V231-L235 PolarHBondContact O-N 3.09Å; A232-L235 PolarHBondContact O-N 2.91Å; L233-L235 PolarHBondContact O-N 3.32Å; L235-I237 PolarHBondContact O-N 3.28Å; L235-N238 CarbonylContact O-C 3.59Å; L235-N238 PolarHBondContact O-N 2.95Å; L235-N238 VanDerWaalsContact O-N 3.1Å; L235-M239 WeakPolarHBondContact O-CB 3.13Å; L235-M239 PolarHBondContact O-N 2.87Å; L235-L272 HydrophobicContact CD2-CD2 3.83Å; L235-N275 HydrophobicContact CD1-CB 4.19Å; L235-N275 HydrophobicContact CD2-CB 4.1Å; L235-Q276 VanDerWaalsContact CB-OE1 3.25Å; L235-I279 HydrophobicContact CD1-CB 4.41Å; L235-I279 HydrophobicContact CD1-CG1 3.92Å
236	S	95	Very high	95.3	Very high	27 Å²	27	39.8 Å²	39.8	19%	0.189	20%	0.198	C	C	.	.	H	α-helix	trans	-54.3	-48.7	175.3	-171.7	0	0	0	0	112.1	A232 L233 N238 M239 D240 Y317	A232-S236 WeakPolarHBondContact O-CB 3.21Å; A232-S236 PolarHBondContact O-N 3.14Å; L233-S236 PolarHBondContact O-N 2.7Å; S236-N238 VanDerWaalsContact C-N 3.33Å; S236-N238 PolarHBondContact O-N 3.39Å; S236-M239 PolarHBondContact O-N 3.23Å; S236-D240 PolarHBondContact O-N 3.25Å; S236-Y317 WeakPolarHBondContact CB-OH 3.42Å; S236-Y317 PolarHBondContact OG-OH 3.44Å
237	I	94.7	Very high	95.1	Very high	77 Å²	77	42.5 Å²	42.5	40%	0.395	21%	0.21	S	C	.	.	H	α-helix	trans	-61.9	-40.9	177.6	-68.1	165	0	0	0	111.1	L233 L235 N241	L233-I237 HydrophobicContact CD1-CD1 4.08Å; L233-I237 HydrophobicContact CD1-CG1 4.48Å; L233-I237 HydrophobicContact CG-CD1 4.02Å; L233-I237 VanDerWaalsContact O-CG1 3.3Å; L233-I237 WeakPolarHBondContact O-CG1 3.46Å; L233-I237 PolarHBondContact O-N 2.68Å; L235-I237 PolarHBondContact O-N 3.28Å; I237-N241 WeakPolarHBondContact O-CB 3.05Å; I237-N241 PolarHBondContact O-N 2.97Å; I237-N241 PolarHBondContact O-ND2 3.37Å
238	N	93.9	Very high	94.8	Very high	63 Å²	63	45 Å²	45	34%	0.337	23%	0.23	S	C	.	.	H	α-helix	trans	-69.6	-33.6	176.9	-81.6	-56	0	0	0	113.1	N234 L235 S236 T242 L272	N234-N238 WeakPolarHBondContact O-CB 3.36Å; N234-N238 PolarHBondContact O-N 3.01Å; N234-N238 VanDerWaalsContact O-N 3.08Å; N234-N238 PolarHBondContact O-ND2 2.87Å; L235-N238 CarbonylContact O-C 3.59Å; L235-N238 PolarHBondContact O-N 2.95Å; L235-N238 VanDerWaalsContact O-N 3.1Å; S236-N238 VanDerWaalsContact C-N 3.33Å; S236-N238 PolarHBondContact O-N 3.39Å; N238-T242 WeakPolarHBondContact O-CB 3.48Å; N238-T242 PolarHBondContact O-N 2.88Å; N238-T242 PolarHBondContact O-OG1 3.07Å; N238-L272 HydrophobicContact CB-CD1 4.28Å; N238-L272 HydrophobicContact CB-CD2 4.3Å
239	M	93.6	Very high	94.5	Very high	44 Å²	44	45.2 Å²	45.2	22%	0.217	23%	0.231	C	C	.	.	H	α-helix	trans	-67.3	-45.6	175	-173	168.3	63	0	0	110.7	L235 S236 T242 Q243 R269	L235-M239 WeakPolarHBondContact O-CB 3.13Å; L235-M239 PolarHBondContact O-N 2.87Å; S236-M239 PolarHBondContact O-N 3.23Å; M239-T242 PolarHBondContact O-N 3.25Å; M239-Q243 WeakPolarHBondContact O-CB 3.09Å; M239-Q243 PolarHBondContact O-N 2.82Å; M239-R269 HydrophobicContact CG-CG 4.17Å
240	D	93.4	Very high	94.1	Very high	83 Å²	83	51.5 Å²	51.5	44%	0.444	26%	0.255	S	S	.	.	H	α-helix	trans	-62.8	-41.9	174.2	-83.4	-14.4	0	0	0	112.8	S236 T242 Q243 R244	S236-D240 PolarHBondContact O-N 3.25Å; D240-T242 VanDerWaalsContact C-N 3.31Å; D240-T242 PolarHBondContact O-N 3.33Å; D240-Q243 PolarHBondContact O-N 2.95Å; D240-R244 WeakPolarHBondContact O-CB 3.43Å; D240-R244 WeakPolarHBondContact O-CG 3.42Å; D240-R244 PolarHBondContact O-N 3.19Å; D240-R244 PolarHBondContact O-NE 3.42Å
241	N	95.1	Very high	93.8	Very high	51 Å²	51	55.4 Å²	55.4	27%	0.273	28%	0.276	S	S	.	.	H	α-helix	trans	-60.2	-42.6	173.7	-76.8	-26.9	0	0	0	111	I237 R244 Q245	I237-N241 WeakPolarHBondContact O-CB 3.05Å; I237-N241 PolarHBondContact O-N 2.97Å; I237-N241 PolarHBondContact O-ND2 3.37Å; N241-R244 PolarHBondContact OD1-NH1 3.18Å; N241-R244 PolarHBondContact OD1-NH2 3Å; N241-Q245 VanDerWaalsContact O-CG 3.31Å; N241-Q245 WeakPolarHBondContact O-CG 3.49Å; N241-Q245 PolarHBondContact O-N 2.81Å
242	T	94.6	Very high	93.5	Very high	4 Å²	4	59.1 Å²	59.1	3%	0.025	29%	0.292	C	S	.	.	H	α-helix	trans	-69.3	-39.5	178.4	-56.7	0	0	0	0	111.7	N238 M239 D240 Q245 Y246 L265 K268 R269	N238-T242 WeakPolarHBondContact O-CB 3.48Å; N238-T242 PolarHBondContact O-N 2.88Å; N238-T242 PolarHBondContact O-OG1 3.07Å; M239-T242 PolarHBondContact O-N 3.25Å; D240-T242 VanDerWaalsContact C-N 3.31Å; D240-T242 PolarHBondContact O-N 3.33Å; T242-Q245 PolarHBondContact O-N 3.2Å; T242-Y246 WeakPolarHBondContact O-CB 3.46Å; T242-Y246 PolarHBondContact O-N 3.39Å; T242-L265 HydrophobicContact CG2-CD2 4.07Å; T242-K268 HydrophobicContact CG2-CG 4.37Å; T242-R269 HydrophobicContact CG2-CB 4.04Å
243	Q	93.1	Very high	92.9	Very high	45 Å²	45	64.6 Å²	64.6	21%	0.21	33%	0.325	C	S	.	.	H	α-helix	trans	-63.2	-46.3	174.9	-179.4	62.9	24.7	0	0	111.4	M239 D240 Q245 Y246 E247 R269	M239-Q243 WeakPolarHBondContact O-CB 3.09Å; M239-Q243 PolarHBondContact O-N 2.82Å; D240-Q243 PolarHBondContact O-N 2.95Å; Q243-Q245 VanDerWaalsContact C-N 3.33Å; Q243-Q245 PolarHBondContact O-N 2.83Å; Q243-Y246 WeakPolarHBondContact O-CB 3.31Å; Q243-Y246 PolarHBondContact O-N 2.87Å; Q243-E247 PolarHBondContact NE2-OE1 2.75Å; Q243-E247 WeakPolarHBondContact O-CG 3.42Å; Q243-E247 PolarHBondContact O-N 3.37Å; Q243-R269 VanDerWaalsContact OE1-CD 3.26Å
244	R	94.4	Very high	92	Very high	137 Å²	137	69.1 Å²	69.1	52%	0.517	35%	0.348	S	S	.	.	H	α-helix	trans	-61.1	-38.9	174.5	-78.3	-179.3	-90.7	114	0.5	112.2	D240 N241 A248	D240-R244 WeakPolarHBondContact O-CB 3.43Å; D240-R244 WeakPolarHBondContact O-CG 3.42Å; D240-R244 PolarHBondContact O-N 3.19Å; D240-R244 PolarHBondContact O-NE 3.42Å; N241-R244 PolarHBondContact OD1-NH1 3.18Å; N241-R244 PolarHBondContact OD1-NH2 3Å; R244-A248 VanDerWaalsContact O-CB 3.3Å; R244-A248 WeakPolarHBondContact O-CB 3.42Å; R244-A248 PolarHBondContact O-N 3.09Å
245	Q	92.3	Very high	91	Very high	96 Å²	96	71.9 Å²	71.9	45%	0.449	38%	0.376	S	S	.	.	H	α-helix	trans	-66.2	-42.3	173.6	-73.2	179.2	33.6	0	0	112.7	N241 T242 Q243 A248 E249 L265	N241-Q245 VanDerWaalsContact O-CG 3.31Å; N241-Q245 WeakPolarHBondContact O-CG 3.49Å; N241-Q245 PolarHBondContact O-N 2.81Å; T242-Q245 PolarHBondContact O-N 3.2Å; Q243-Q245 VanDerWaalsContact C-N 3.33Å; Q243-Q245 PolarHBondContact O-N 2.83Å; Q245-A248 PolarHBondContact O-N 3.36Å; Q245-E249 PolarHBondContact O-N 3.15Å; Q245-L265 HydrophobicContact CB-CD1 4.27Å; Q245-L265 HydrophobicContact CB-CD2 4.12Å
246	Y	92.7	Very high	90.3	Very high	35 Å²	35	79.4 Å²	79.4	14%	0.137	41%	0.409	C	S	.	.	H	α-helix	trans	-60.9	-46.2	175.8	172.4	-103.6	0	0	0	111.4	T242 Q243 E249 R250 L262 L265 L266	T242-Y246 WeakPolarHBondContact O-CB 3.46Å; T242-Y246 PolarHBondContact O-N 3.39Å; Q243-Y246 WeakPolarHBondContact O-CB 3.31Å; Q243-Y246 PolarHBondContact O-N 2.87Å; Y246-E249 PolarHBondContact O-N 3.22Å; Y246-R250 WeakPolarHBondContact O-CB 3.49Å; Y246-R250 PolarHBondContact O-N 3.25Å; Y246-L262 HydrophobicContact CD2-CB 4.43Å; Y246-L262 HydrophobicContact CD2-CD2 3.48Å; Y246-L262 VanDerWaalsContact CD2-CD2 3.48Å; Y246-L262 HydrophobicContact CE2-CB 4.11Å; Y246-L262 HydrophobicContact CE2-CD2 3.54Å; Y246-L262 HydrophobicContact CE2-CG 4.41Å; Y246-L262 HydrophobicContact CG-CD2 4.34Å; Y246-L262 WeakPolarHBondContact O-CD2 3.38Å; Y246-L265 HydrophobicContact CD2-CB 4.26Å; Y246-L266 HydrophobicContact CD2-CD2 4.23Å; Y246-L266 HydrophobicContact CD2-CG 3.94Å; Y246-L266 HydrophobicContact CE1-CD2 4.3Å; Y246-L266 HydrophobicContact CE2-CD1 3.73Å; Y246-L266 HydrophobicContact CE2-CD2 3.74Å; Y246-L266 HydrophobicContact CE2-CG 3.45Å; Y246-L266 VanDerWaalsContact CE2-CG 3.45Å
247	E	93.1	Very high	89.8	Confident	82 Å²	82	82.1 Å²	82.1	38%	0.383	42%	0.415	S	S	.	.	H	α-helix	trans	-65	-42	176.7	-72.3	179.6	-170.2	0	0	112.6	Q243 E249 R250 N251	Q243-E247 PolarHBondContact NE2-OE1 2.75Å; Q243-E247 WeakPolarHBondContact O-CG 3.42Å; Q243-E247 PolarHBondContact O-N 3.37Å; E247-E249 VanDerWaalsContact C-N 3.34Å; E247-E249 PolarHBondContact O-N 2.84Å; E247-R250 PolarHBondContact O-N 3.49Å; E247-N251 VanDerWaalsContact O-CB 3.26Å; E247-N251 WeakPolarHBondContact O-CB 3.41Å; E247-N251 PolarHBondContact O-N 3.32Å; E247-N251 PolarHBondContact O-ND2 2.85Å
248	A	92.6	Very high	89.4	Confident	64 Å²	64	80.4 Å²	80.4	53%	0.529	41%	0.413	S	S	.	.	H	α-helix	trans	-61.8	-39.4	176.4	0	0	0	0	0	112.7	R244 Q245	R244-A248 VanDerWaalsContact O-CB 3.3Å; R244-A248 WeakPolarHBondContact O-CB 3.42Å; R244-A248 PolarHBondContact O-N 3.09Å; Q245-A248 PolarHBondContact O-N 3.36Å
249	E	90.6	Very high	89.1	Confident	4 Å²	4	82.4 Å²	82.4	2%	0.019	42%	0.423	C	S	.	.	H	α-helix	trans	-71.9	-39	174.5	-169.4	66.5	-128.3	0	0	111.6	Q245 Y246 E247 N251 K252 A258 R261 L262 L265	Q245-E249 PolarHBondContact O-N 3.15Å; Y246-E249 PolarHBondContact O-N 3.22Å; E247-E249 VanDerWaalsContact C-N 3.34Å; E247-E249 PolarHBondContact O-N 2.84Å; E249-N251 PolarHBondContact O-N 3.12Å; E249-K252 WeakPolarHBondContact O-CB 3.43Å; E249-K252 PolarHBondContact O-N 3.3Å; E249-K252 WeakPolarHBondContact OE1-CD 3.12Å; E249-K252 WeakPolarHBondContact OE1-CE 3.4Å; E249-K252 IonicContact OE1-NZ 3.47Å; E249-K252 PolarHBondContact OE1-NZ 2.7Å; E249-K252 WeakPolarHBondContact OE2-CE 3.38Å; E249-K252 IonicContact OE2-NZ 3.97Å; E249-K252 PolarHBondContact OE2-NZ 3.28Å; E249-A258 PolarHBondContact OE1-N 2.86Å; E249-R261 WeakPolarHBondContact OE2-CD 3.49Å; E249-R261 IonicContact OE2-CZ 2.72Å; E249-R261 IonicContact OE2-NE 3.8Å; E249-R261 IonicContact OE2-NH1 3.84Å; E249-R261 PolarHBondContact OE2-NH1 3.34Å; E249-L262 HydrophobicContact CB-CD2 3.73Å; E249-L262 HydrophobicContact CB-CG 4.31Å; E249-L262 HydrophobicContact CG-CD2 3.85Å; E249-L262 HydrophobicContact CG-CG 3.85Å; E249-L265 HydrophobicContact CB-CD1 4.49Å
250	R	90.1	Very high	88.8	Confident	131 Å²	131	86.7 Å²	86.7	49%	0.494	45%	0.447	S	S	.	.	H	α-helix	trans	-65.7	-40.1	179.7	-177.4	-178.9	-179.9	-161.2	1.3	111.5	Y246 E247 K252 R257 L262	Y246-R250 WeakPolarHBondContact O-CB 3.49Å; Y246-R250 PolarHBondContact O-N 3.25Å; E247-R250 PolarHBondContact O-N 3.49Å; R250-K252 PolarHBondContact O-N 3.33Å; R250-R257 VanDerWaalsContact O-CZ 3.28Å; R250-R257 PolarHBondContact O-NE 3.29Å; R250-R257 VanDerWaalsContact O-NE 3.13Å; R250-R257 PolarHBondContact O-NH2 3.48Å; R250-L262 HydrophobicContact CB-CD2 3.95Å
251	N	91.3	Very high	88.6	Confident	127 Å²	127	88.2 Å²	88.2	68%	0.679	45%	0.446	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.4	-4.3	-177.4	-68.1	-20.7	0	0	0	113.6	E247 E249	E247-N251 VanDerWaalsContact O-CB 3.26Å; E247-N251 WeakPolarHBondContact O-CB 3.41Å; E247-N251 PolarHBondContact O-N 3.32Å; E247-N251 PolarHBondContact O-ND2 2.85Å; E249-N251 PolarHBondContact O-N 3.12Å
252	K	91.1	Very high	88.3	Confident	81 Å²	81	86.6 Å²	86.6	35%	0.352	44%	0.438	S	S	.	.	S	Bend	trans	-63.1	145.7	168.9	-64.6	-176.1	-171.1	168.8	0	111.6	E249 R250 I254 K256 R257	E249-K252 WeakPolarHBondContact O-CB 3.43Å; E249-K252 PolarHBondContact O-N 3.3Å; E249-K252 WeakPolarHBondContact OE1-CD 3.12Å; E249-K252 WeakPolarHBondContact OE1-CE 3.4Å; E249-K252 IonicContact OE1-NZ 3.47Å; E249-K252 PolarHBondContact OE1-NZ 2.7Å; E249-K252 WeakPolarHBondContact OE2-CE 3.38Å; E249-K252 IonicContact OE2-NZ 3.97Å; E249-K252 PolarHBondContact OE2-NZ 3.28Å; R250-K252 PolarHBondContact O-N 3.33Å; K252-I254 PolarHBondContact O-N 2.99Å; K252-K256 VanDerWaalsContact CD-O 3.25Å; K252-K256 WeakPolarHBondContact CD-O 3.08Å; K252-R257 HydrophobicContact CB-CB 4.42Å; K252-R257 PolarHBondContact O-NH2 3.34Å
253	V	84.4	Confident	88.1	Confident	115 Å²	115	93.2 Å²	93.2	70%	0.697	47%	0.468	S	S	*	.			trans	-52.5	135.9	167.8	-177.8	0	0	0	0	109.2	A255 K256 R257	V253-A255 PolarHBondContact O-N 3.41Å; V253-K256 WeakPolarHBondContact O-CA 3.38Å; V253-K256 PolarHBondContact O-N 3.37Å; V253-R257 PolarHBondContact O-N 3.18Å
254	I	76.1	Confident	88.1	Confident	132 Å²	132	96.8 Å²	96.8	68%	0.677	49%	0.488	S	S	*	.	G	3₁₀ helix	trans	-50.5	-40.4	-168.2	-61.6	171.2	0	0	0	113	K252 K256 R257	K252-I254 PolarHBondContact O-N 2.99Å; I254-K256 PolarHBondContact O-N 3.04Å; I254-K256 VanDerWaalsContact O-N 3.13Å; I254-R257 PolarHBondContact O-N 3.46Å
255	A	75.3	Confident	88	Confident	100 Å²	100	90.9 Å²	90.9	83%	0.826	47%	0.467	S	S	*	.	G	3₁₀ helix	trans	-70.8	-0.3	178.3	0	0	0	0	0	115.6	V253	V253-A255 PolarHBondContact O-N 3.41Å
256	K	78.1	Confident	88	Confident	169 Å²	169	89.4 Å²	89.4	74%	0.735	46%	0.462	S	S	*	.	G	3₁₀ helix	trans	-129.2	8.4	177.1	-66.6	-169.7	176.1	-173.5	0	113.2	K252 V253 I254	K252-K256 VanDerWaalsContact CD-O 3.25Å; K252-K256 WeakPolarHBondContact CD-O 3.08Å; V253-K256 WeakPolarHBondContact O-CA 3.38Å; V253-K256 PolarHBondContact O-N 3.37Å; I254-K256 PolarHBondContact O-N 3.04Å; I254-K256 VanDerWaalsContact O-N 3.13Å
257	R	84.9	Confident	88.1	Confident	84 Å²	84	91.9 Å²	91.9	32%	0.317	48%	0.475	S	S	.	.			trans	-89.1	124.3	179.8	178.5	-172.9	-68.4	162.8	0.6	109.6	R250 K252 V253 I254 N259 L262	R250-R257 VanDerWaalsContact O-CZ 3.28Å; R250-R257 PolarHBondContact O-NE 3.29Å; R250-R257 VanDerWaalsContact O-NE 3.13Å; R250-R257 PolarHBondContact O-NH2 3.48Å; K252-R257 HydrophobicContact CB-CB 4.42Å; K252-R257 PolarHBondContact O-NH2 3.34Å; V253-R257 PolarHBondContact O-N 3.18Å; I254-R257 PolarHBondContact O-N 3.46Å; R257-N259 WeakPolarHBondContact CD-OD1 3.17Å; R257-N259 PolarHBondContact O-N 3.32Å; R257-L262 HydrophobicContact CG-CD1 3.57Å
258	A	87.8	Confident	88.1	Confident	42 Å²	42	92.9 Å²	92.9	35%	0.347	48%	0.478	S	S	.	.			trans	-86.8	103.4	171.1	0	0	0	0	0	109.8	E249 R261 L262	E249-A258 PolarHBondContact OE1-N 2.86Å; A258-R261 HydrophobicContact CB-CB 3.76Å; A258-R261 PolarHBondContact O-N 2.85Å; A258-L262 PolarHBondContact O-N 2.99Å
259	N	85.8	Confident	88.1	Confident	104 Å²	104	94.2 Å²	94.2	56%	0.556	47%	0.469	S	S	*	.	H	α-helix	trans	-65	-42.9	-179	-70.2	-20.4	0	0	0	111.7	R257 R261 L262 E263	R257-N259 WeakPolarHBondContact CD-OD1 3.17Å; R257-N259 PolarHBondContact O-N 3.32Å; N259-R261 PolarHBondContact O-N 3.2Å; N259-L262 WeakPolarHBondContact O-CA 3.39Å; N259-L262 VanDerWaalsContact O-CB 3.32Å; N259-L262 WeakPolarHBondContact O-CB 3.22Å; N259-L262 PolarHBondContact O-N 3.33Å; N259-E263 PolarHBondContact O-N 2.85Å
260	D	87.9	Confident	88.2	Confident	135 Å²	135	98.8 Å²	98.8	72%	0.722	49%	0.489	S	S	*	.	H	α-helix	trans	-59.5	-33.4	178.9	-35.5	-9.8	0	0	0	111.1	L264	D260-L264 WeakPolarHBondContact O-CB 3.41Å; D260-L264 PolarHBondContact O-N 3.16Å
261	R	88.8	Confident	88.4	Confident	114 Å²	114	96.8 Å²	96.8	43%	0.43	49%	0.485	S	S	.	.	H	α-helix	trans	-73	-33.1	173.5	-169.9	178.3	-177.9	-150.4	4.4	112.6	E249 A258 N259 L265	E249-R261 WeakPolarHBondContact OE2-CD 3.49Å; E249-R261 IonicContact OE2-CZ 2.72Å; E249-R261 IonicContact OE2-NE 3.8Å; E249-R261 IonicContact OE2-NH1 3.84Å; E249-R261 PolarHBondContact OE2-NH1 3.34Å; A258-R261 HydrophobicContact CB-CB 3.76Å; A258-R261 PolarHBondContact O-N 2.85Å; N259-R261 PolarHBondContact O-N 3.2Å; R261-L265 HydrophobicContact CG-CD1 4.1Å; R261-L265 WeakPolarHBondContact O-CB 3.39Å; R261-L265 WeakPolarHBondContact O-CD1 3.4Å; R261-L265 WeakPolarHBondContact O-CG 3.45Å; R261-L265 PolarHBondContact O-N 2.93Å
262	L	88.7	Confident	88.5	Confident	17 Å²	17	91.7 Å²	91.7	9%	0.089	46%	0.458	C	S	.	.	H	α-helix	trans	-68.5	-38.5	172.9	-72.5	169.2	0	0	0	111.6	Y246 E249 R250 R257 A258 N259 L265 L266	Y246-L262 HydrophobicContact CD2-CB 4.43Å; Y246-L262 HydrophobicContact CD2-CD2 3.48Å; Y246-L262 VanDerWaalsContact CD2-CD2 3.48Å; Y246-L262 HydrophobicContact CE2-CB 4.11Å; Y246-L262 HydrophobicContact CE2-CD2 3.54Å; Y246-L262 HydrophobicContact CE2-CG 4.41Å; Y246-L262 HydrophobicContact CG-CD2 4.34Å; Y246-L262 WeakPolarHBondContact O-CD2 3.38Å; E249-L262 HydrophobicContact CB-CD2 3.73Å; E249-L262 HydrophobicContact CB-CG 4.31Å; E249-L262 HydrophobicContact CG-CD2 3.85Å; E249-L262 HydrophobicContact CG-CG 3.85Å; R250-L262 HydrophobicContact CB-CD2 3.95Å; R257-L262 HydrophobicContact CG-CD1 3.57Å; A258-L262 PolarHBondContact O-N 2.99Å; N259-L262 WeakPolarHBondContact O-CA 3.39Å; N259-L262 VanDerWaalsContact O-CB 3.32Å; N259-L262 WeakPolarHBondContact O-CB 3.22Å; N259-L262 PolarHBondContact O-N 3.33Å; L262-L265 PolarHBondContact O-N 3.25Å; L262-L266 WeakPolarHBondContact O-CB 3.42Å; L262-L266 WeakPolarHBondContact O-CG 3.04Å; L262-L266 PolarHBondContact O-N 3.38Å
263	E	91.9	Very high	88.7	Confident	143 Å²	143	91.5 Å²	91.5	67%	0.668	46%	0.458	S	S	*	.	H	α-helix	trans	-65.6	-46.5	174.8	-170.2	163.2	-160.2	0	0	111.1	N259 L265 L266 Q267	N259-E263 PolarHBondContact O-N 2.85Å; E263-L265 VanDerWaalsContact C-N 3.35Å; E263-L265 PolarHBondContact O-N 3.32Å; E263-L266 PolarHBondContact O-N 3.02Å; E263-Q267 WeakPolarHBondContact O-CB 3.17Å; E263-Q267 PolarHBondContact O-N 2.86Å
264	L	92.8	Very high	89.2	Confident	121 Å²	121	90.1 Å²	90.1	63%	0.634	44%	0.444	S	S	*	.	H	α-helix	trans	-59.4	-40.8	173.2	-176.9	64.5	0	0	0	112.9	D260 Q267 K268	D260-L264 WeakPolarHBondContact O-CB 3.41Å; D260-L264 PolarHBondContact O-N 3.16Å; L264-Q267 PolarHBondContact O-N 3.46Å; L264-K268 WeakPolarHBondContact O-CB 3.35Å; L264-K268 PolarHBondContact O-N 3.12Å
265	L	92.7	Very high	90.1	Very high	12 Å²	12	86 Å²	86	6%	0.063	42%	0.424	C	S	.	.	H	α-helix	trans	-70.6	-32.9	177.2	-74.8	167.1	0	0	0	112.5	T242 Q245 Y246 E249 R261 L262 E263 R269	T242-L265 HydrophobicContact CG2-CD2 4.07Å; Q245-L265 HydrophobicContact CB-CD1 4.27Å; Q245-L265 HydrophobicContact CB-CD2 4.12Å; Y246-L265 HydrophobicContact CD2-CB 4.26Å; E249-L265 HydrophobicContact CB-CD1 4.49Å; R261-L265 HydrophobicContact CG-CD1 4.1Å; R261-L265 WeakPolarHBondContact O-CB 3.39Å; R261-L265 WeakPolarHBondContact O-CD1 3.4Å; R261-L265 WeakPolarHBondContact O-CG 3.45Å; R261-L265 PolarHBondContact O-N 2.93Å; L262-L265 PolarHBondContact O-N 3.25Å; E263-L265 VanDerWaalsContact C-N 3.35Å; E263-L265 PolarHBondContact O-N 3.32Å; L265-R269 VanDerWaalsContact O-CB 3.28Å; L265-R269 WeakPolarHBondContact O-CB 3.42Å; L265-R269 PolarHBondContact O-N 3.3Å
266	L	92.3	Very high	91	Very high	66 Å²	66	81.7 Å²	81.7	35%	0.346	39%	0.386	S	S	.	.	H	α-helix	trans	-68.4	-43.8	172	-78	167.6	0	0	0	111.8	Y246 L262 E263 R269 K270	Y246-L266 HydrophobicContact CD2-CD2 4.23Å; Y246-L266 HydrophobicContact CD2-CG 3.94Å; Y246-L266 HydrophobicContact CE1-CD2 4.3Å; Y246-L266 HydrophobicContact CE2-CD1 3.73Å; Y246-L266 HydrophobicContact CE2-CD2 3.74Å; Y246-L266 HydrophobicContact CE2-CG 3.45Å; Y246-L266 VanDerWaalsContact CE2-CG 3.45Å; L262-L266 WeakPolarHBondContact O-CB 3.42Å; L262-L266 WeakPolarHBondContact O-CG 3.04Å; L262-L266 PolarHBondContact O-N 3.38Å; E263-L266 PolarHBondContact O-N 3.02Å; L266-R269 PolarHBondContact O-N 2.93Å; L266-K270 PolarHBondContact O-N 3.35Å
267	Q	93.8	Very high	91.8	Very high	87 Å²	87	77.2 Å²	77.2	41%	0.407	37%	0.37	S	S	.	.	H	α-helix	trans	-62.3	-49.6	176.9	177.3	55.3	29.7	0	0	110.9	E263 L264 R269 K270 E271	E263-Q267 WeakPolarHBondContact O-CB 3.17Å; E263-Q267 PolarHBondContact O-N 2.86Å; L264-Q267 PolarHBondContact O-N 3.46Å; Q267-R269 VanDerWaalsContact C-N 3.29Å; Q267-R269 PolarHBondContact O-N 3.36Å; Q267-K270 WeakPolarHBondContact O-CA 3.34Å; Q267-K270 WeakPolarHBondContact O-CB 3.5Å; Q267-K270 PolarHBondContact O-N 2.89Å; Q267-E271 WeakPolarHBondContact CG-OE1 3.46Å; Q267-E271 PolarHBondContact NE2-OE1 2.7Å; Q267-E271 WeakPolarHBondContact O-CG 3.47Å; Q267-E271 PolarHBondContact O-N 3.33Å
268	K	93.3	Very high	92.3	Very high	103 Å²	103	76.5 Å²	76.5	45%	0.448	37%	0.373	S	S	.	.	H	α-helix	trans	-59.2	-37.2	174.5	-179.7	170.9	178.6	173.4	0	113	T242 L264 K270 E271 L272	T242-K268 HydrophobicContact CG2-CG 4.37Å; L264-K268 WeakPolarHBondContact O-CB 3.35Å; L264-K268 PolarHBondContact O-N 3.12Å; K268-K270 VanDerWaalsContact C-N 3.33Å; K268-E271 PolarHBondContact O-N 2.88Å; K268-L272 HydrophobicContact CG-CD1 4.26Å; K268-L272 WeakPolarHBondContact O-CB 3.39Å; K268-L272 WeakPolarHBondContact O-CG 3.33Å; K268-L272 PolarHBondContact O-N 2.91Å
269	R	91.6	Very high	92.7	Very high	92 Å²	92	74.5 Å²	74.5	35%	0.347	36%	0.356	S	S	.	.	H	α-helix	trans	-69.7	-30.8	175.9	-163.6	-165	68.5	162.8	9.3	112	M239 T242 Q243 L265 L266 Q267 Q273	M239-R269 HydrophobicContact CG-CG 4.17Å; T242-R269 HydrophobicContact CG2-CB 4.04Å; Q243-R269 VanDerWaalsContact OE1-CD 3.26Å; L265-R269 VanDerWaalsContact O-CB 3.28Å; L265-R269 WeakPolarHBondContact O-CB 3.42Å; L265-R269 PolarHBondContact O-N 3.3Å; L266-R269 PolarHBondContact O-N 2.93Å; Q267-R269 VanDerWaalsContact C-N 3.29Å; Q267-R269 PolarHBondContact O-N 3.36Å; R269-Q273 PolarHBondContact O-N 3.17Å
270	K	94.3	Very high	93.2	Very high	99 Å²	99	73.5 Å²	73.5	43%	0.43	35%	0.348	S	S	.	.	H	α-helix	trans	-68.6	-47.1	172.6	-176.6	-177.4	168.1	-74.2	0	110.8	L266 Q267 K268 L272 Q273 E274	L266-K270 PolarHBondContact O-N 3.35Å; Q267-K270 WeakPolarHBondContact O-CA 3.34Å; Q267-K270 WeakPolarHBondContact O-CB 3.5Å; Q267-K270 PolarHBondContact O-N 2.89Å; K268-K270 VanDerWaalsContact C-N 3.33Å; K270-L272 VanDerWaalsContact C-N 3.32Å; K270-L272 PolarHBondContact O-N 2.74Å; K270-Q273 WeakPolarHBondContact O-CB 3.08Å; K270-Q273 PolarHBondContact O-N 2.92Å; K270-E274 WeakPolarHBondContact CE-OE1 3.34Å; K270-E274 IonicContact NZ-OE1 2.77Å; K270-E274 PolarHBondContact NZ-OE1 3.06Å; K270-E274 IonicContact NZ-OE2 2.69Å; K270-E274 PolarHBondContact NZ-OE2 3.1Å; K270-E274 PolarHBondContact O-N 3.09Å
271	E	93.8	Very high	93.6	Very high	89 Å²	89	72 Å²	72	42%	0.416	34%	0.34	S	S	.	.	H	α-helix	trans	-57.2	-43.7	174.7	-68.4	159.6	-175.4	0	0	111.7	Q267 K268 Q273 E274 N275	Q267-E271 WeakPolarHBondContact CG-OE1 3.46Å; Q267-E271 PolarHBondContact NE2-OE1 2.7Å; Q267-E271 WeakPolarHBondContact O-CG 3.47Å; Q267-E271 PolarHBondContact O-N 3.33Å; K268-E271 PolarHBondContact O-N 2.88Å; E271-Q273 VanDerWaalsContact C-N 3.3Å; E271-Q273 PolarHBondContact O-N 2.9Å; E271-E274 PolarHBondContact O-N 2.8Å; E271-N275 WeakPolarHBondContact O-CB 3.28Å; E271-N275 PolarHBondContact O-N 2.92Å; E271-N275 PolarHBondContact O-OD1 2.8Å
272	L	93.1	Very high	94	Very high	21 Å²	21	67.5 Å²	67.5	11%	0.11	32%	0.324	C	S	.	.	H	α-helix	trans	-65.1	-29.2	175.1	-73.8	171.1	0	0	0	113.8	L235 N238 K268 K270 Q276	L235-L272 HydrophobicContact CD2-CD2 3.83Å; N238-L272 HydrophobicContact CB-CD1 4.28Å; N238-L272 HydrophobicContact CB-CD2 4.3Å; K268-L272 HydrophobicContact CG-CD1 4.26Å; K268-L272 WeakPolarHBondContact O-CB 3.39Å; K268-L272 WeakPolarHBondContact O-CG 3.33Å; K268-L272 PolarHBondContact O-N 2.91Å; K270-L272 VanDerWaalsContact C-N 3.32Å; K270-L272 PolarHBondContact O-N 2.74Å; L272-Q276 WeakPolarHBondContact O-CB 3.42Å; L272-Q276 PolarHBondContact O-N 3.45Å; L272-Q276 VanDerWaalsContact O-N 3.13Å
273	Q	94.5	Very high	94.5	Very high	77 Å²	77	67.3 Å²	67.3	36%	0.36	32%	0.323	S	S	.	.	H	α-helix	trans	-75.8	-42	174.1	-176.5	68.9	68.1	0	0	111.4	R269 K270 E271 N275 Q276 D277	R269-Q273 PolarHBondContact O-N 3.17Å; K270-Q273 WeakPolarHBondContact O-CB 3.08Å; K270-Q273 PolarHBondContact O-N 2.92Å; E271-Q273 VanDerWaalsContact C-N 3.3Å; E271-Q273 PolarHBondContact O-N 2.9Å; Q273-N275 VanDerWaalsContact C-N 3.34Å; Q273-N275 PolarHBondContact O-N 3.41Å; Q273-Q276 WeakPolarHBondContact O-CB 3.17Å; Q273-Q276 PolarHBondContact O-N 3.34Å; Q273-Q276 VanDerWaalsContact O-N 3.07Å; Q273-D277 PolarHBondContact NE2-OD1 3.47Å; Q273-D277 VanDerWaalsContact O-CG 3.26Å; Q273-D277 PolarHBondContact O-N 2.96Å
274	E	94.9	Very high	94.7	Very high	86 Å²	86	63.4 Å²	63.4	40%	0.402	31%	0.307	S	S	.	.	H	α-helix	trans	-61.7	-44.6	177	-70.6	171.2	137.1	0	0	110.3	K270 E271 Q276 D277 D278	K270-E274 WeakPolarHBondContact CE-OE1 3.34Å; K270-E274 IonicContact NZ-OE1 2.77Å; K270-E274 PolarHBondContact NZ-OE1 3.06Å; K270-E274 IonicContact NZ-OE2 2.69Å; K270-E274 PolarHBondContact NZ-OE2 3.1Å; K270-E274 PolarHBondContact O-N 3.09Å; E271-E274 PolarHBondContact O-N 2.8Å; E274-Q276 VanDerWaalsContact C-N 3.31Å; E274-Q276 PolarHBondContact O-N 3.5Å; E274-D277 PolarHBondContact O-N 3Å; E274-D278 PolarHBondContact O-N 3.04Å; E274-D278 VanDerWaalsContact O-N 3.09Å
275	N	95.1	Very high	94.9	Very high	46 Å²	46	59.8 Å²	59.8	25%	0.246	29%	0.294	C	S	.	.	H	α-helix	trans	-60.3	-34.7	171	-73.2	25.9	0	0	0	113.8	Y190 L235 E271 Q273 I279	Y190-N275 HydrophobicContact CD1-CB 4.09Å; Y190-N275 HydrophobicContact CE1-CB 3.51Å; Y190-N275 WeakPolarHBondContact CE2-ND2 3.45Å; Y190-N275 VanDerWaalsContact CZ-ND2 3.32Å; L235-N275 HydrophobicContact CD1-CB 4.19Å; L235-N275 HydrophobicContact CD2-CB 4.1Å; E271-N275 WeakPolarHBondContact O-CB 3.28Å; E271-N275 PolarHBondContact O-N 2.92Å; E271-N275 PolarHBondContact O-OD1 2.8Å; Q273-N275 VanDerWaalsContact C-N 3.34Å; Q273-N275 PolarHBondContact O-N 3.41Å; N275-I279 VanDerWaalsContact O-CG1 3.27Å; N275-I279 WeakPolarHBondContact O-CG1 3.45Å; N275-I279 PolarHBondContact O-N 3.5Å
276	Q	93.9	Very high	95.2	Very high	8 Å²	8	59.3 Å²	59.3	4%	0.037	29%	0.292	C	S	.	.	H	α-helix	trans	-68.1	-46.8	177.2	177.9	74	24.9	0	0	110.4	A232 L235 L272 Q273 E274 D278 I279 E280	A232-Q276 PolarHBondContact O-OE1 3.04Å; L235-Q276 VanDerWaalsContact CB-OE1 3.25Å; L272-Q276 WeakPolarHBondContact O-CB 3.42Å; L272-Q276 PolarHBondContact O-N 3.45Å; L272-Q276 VanDerWaalsContact O-N 3.13Å; Q273-Q276 WeakPolarHBondContact O-CB 3.17Å; Q273-Q276 PolarHBondContact O-N 3.34Å; Q273-Q276 VanDerWaalsContact O-N 3.07Å; E274-Q276 VanDerWaalsContact C-N 3.31Å; E274-Q276 PolarHBondContact O-N 3.5Å; Q276-D278 VanDerWaalsContact C-N 3.3Å; Q276-D278 PolarHBondContact O-N 3.33Å; Q276-I279 PolarHBondContact O-N 3.49Å; Q276-E280 PolarHBondContact NE2-OE1 2.86Å; Q276-E280 WeakPolarHBondContact O-CB 3.26Å; Q276-E280 WeakPolarHBondContact O-CG 3.36Å; Q276-E280 PolarHBondContact O-N 3.17Å
277	D	95.3	Very high	95.5	Very high	75 Å²	75	57.2 Å²	57.2	40%	0.401	28%	0.28	S	S	.	.	H	α-helix	trans	-59.8	-40.9	179.4	-64.6	0.1	0	0	0	110.7	Q273 E274 E280 N281	Q273-D277 PolarHBondContact NE2-OD1 3.47Å; Q273-D277 VanDerWaalsContact O-CG 3.26Å; Q273-D277 PolarHBondContact O-N 2.96Å; E274-D277 PolarHBondContact O-N 3Å; D277-E280 PolarHBondContact O-N 3.44Å; D277-N281 VanDerWaalsContact O-CG 3.27Å; D277-N281 PolarHBondContact O-N 2.89Å; D277-N281 PolarHBondContact O-ND2 3.03Å
278	D	95.7	Very high	95.6	Very high	69 Å²	69	59.1 Å²	59.1	37%	0.369	29%	0.287	S	S	.	.	H	α-helix	trans	-65.4	-44.5	176.4	-71.7	-25.6	0	0	0	113.3	E274 Q276 E280 N281 M282	E274-D278 PolarHBondContact O-N 3.04Å; E274-D278 VanDerWaalsContact O-N 3.09Å; Q276-D278 VanDerWaalsContact C-N 3.3Å; Q276-D278 PolarHBondContact O-N 3.33Å; D278-E280 VanDerWaalsContact C-N 3.31Å; D278-E280 PolarHBondContact O-N 3.05Å; D278-N281 WeakPolarHBondContact O-CB 3.22Å; D278-N281 PolarHBondContact O-N 3.47Å; D278-M282 WeakPolarHBondContact O-CG 3.3Å; D278-M282 PolarHBondContact O-N 3.18Å
279	I	97	Very high	95.8	Very high	0 Å²	0	55.5 Å²	55.5	0%	0	28%	0.279	C	S	.	.	H	α-helix	trans	-65.8	-37.4	176.2	-65.6	-70.4	0	0	0	110.4	I189 Y190 L228 V231 A232 L235 N275 Q276 M282 M283	I189-I279 HydrophobicContact CD1-CD1 3.71Å; I189-I279 HydrophobicContact CG1-CD1 4.08Å; I189-I279 HydrophobicContact CG2-CD1 4.42Å; Y190-I279 HydrophobicContact CE1-CD1 4.07Å; Y190-I279 HydrophobicContact CE1-CG1 3.84Å; L228-I279 HydrophobicContact CB-CG2 4.43Å; L228-I279 HydrophobicContact CD2-CD1 3.66Å; L228-I279 HydrophobicContact CD2-CG2 4.21Å; V231-I279 HydrophobicContact CG1-CD1 3.94Å; V231-I279 HydrophobicContact CG1-CG1 4.12Å; A232-I279 HydrophobicContact CB-CG2 3.96Å; L235-I279 HydrophobicContact CD1-CB 4.41Å; L235-I279 HydrophobicContact CD1-CG1 3.92Å; N275-I279 VanDerWaalsContact O-CG1 3.27Å; N275-I279 WeakPolarHBondContact O-CG1 3.45Å; N275-I279 PolarHBondContact O-N 3.5Å; Q276-I279 PolarHBondContact O-N 3.49Å; I279-M282 HydrophobicContact CD1-SD 4.33Å; I279-M282 PolarHBondContact O-N 3.35Å; I279-M283 HydrophobicContact CG2-CE 4.2Å; I279-M283 WeakPolarHBondContact O-CB 3.47Å; I279-M283 VanDerWaalsContact O-CG 3.31Å; I279-M283 WeakPolarHBondContact O-CG 3.32Å; I279-M283 PolarHBondContact O-N 2.97Å
280	E	95.3	Very high	96.1	Very high	84 Å²	84	51.1 Å²	51.1	39%	0.393	26%	0.262	S	S	.	.	H	α-helix	trans	-65.6	-35.3	172.4	-75.3	-173.2	-151.4	0	0	112.7	Q276 D277 D278 M283 N284	Q276-E280 PolarHBondContact NE2-OE1 2.86Å; Q276-E280 WeakPolarHBondContact O-CB 3.26Å; Q276-E280 WeakPolarHBondContact O-CG 3.36Å; Q276-E280 PolarHBondContact O-N 3.17Å; D277-E280 PolarHBondContact O-N 3.44Å; D278-E280 VanDerWaalsContact C-N 3.31Å; D278-E280 PolarHBondContact O-N 3.05Å; E280-M283 HydrophobicContact CB-CE 4.45Å; E280-M283 HydrophobicContact CG-CE 3.81Å; E280-N284 VanDerWaalsContact O-CB 3.28Å; E280-N284 WeakPolarHBondContact O-CB 3.3Å; E280-N284 PolarHBondContact O-N 3.21Å; E280-N284 PolarHBondContact O-ND2 3.12Å
281	N	96.7	Very high	96.3	Very high	103 Å²	103	46.4 Å²	46.4	55%	0.551	24%	0.242	S	C	*	.	H	α-helix	trans	-63.8	-46.7	172.2	-75.1	-42.4	0	0	0	111.7	D277 D278 N284 A285	D277-N281 VanDerWaalsContact O-CG 3.27Å; D277-N281 PolarHBondContact O-N 2.89Å; D277-N281 PolarHBondContact O-ND2 3.03Å; D278-N281 WeakPolarHBondContact O-CB 3.22Å; D278-N281 PolarHBondContact O-N 3.47Å; N281-N284 PolarHBondContact O-N 3.48Å; N281-A285 WeakPolarHBondContact O-CB 3.26Å; N281-A285 PolarHBondContact O-N 3.33Å
282	M	97.9	Very high	96.6	Very high	19 Å²	19	43.3 Å²	43.3	9%	0.094	23%	0.229	C	C	.	.	H	α-helix	trans	-61.8	-43.9	176	-66.7	174.4	-162.3	0	0	112.1	I189 M195 I199 L228 D278 I279 A285 I286	I189-M282 WeakPolarHBondContact O-CE 3.43Å; M195-M282 HydrophobicContact CB-CE 3.97Å; M195-M282 HydrophobicContact CB-SD 3.71Å; M195-M282 HydrophobicContact CE-SD 4Å; M195-M282 HydrophobicContact CG-CE 4.33Å; M195-M282 HydrophobicContact CG-SD 3.9Å; I199-M282 HydrophobicContact CD1-CB 3.81Å; I199-M282 HydrophobicContact CD1-CG 4Å; L228-M282 HydrophobicContact CD1-CB 3.89Å; L228-M282 HydrophobicContact CD2-CB 4.46Å; L228-M282 HydrophobicContact CD2-SD 4.31Å; D278-M282 WeakPolarHBondContact O-CG 3.3Å; D278-M282 PolarHBondContact O-N 3.18Å; I279-M282 HydrophobicContact CD1-SD 4.33Å; I279-M282 PolarHBondContact O-N 3.35Å; M282-A285 PolarHBondContact O-N 3.14Å; M282-I286 PolarHBondContact O-N 3.41Å; M282-I286 VanDerWaalsContact O-N 3.1Å
283	M	97.8	Very high	96.8	Very high	13 Å²	13	46.2 Å²	46.2	6%	0.064	24%	0.242	C	C	.	.	H	α-helix	trans	-61.5	-43.4	174.3	-75.1	-167.1	-59.3	0	0	111.8	M225 L228 V229 A232 I279 E280 A285 I286 F287 F321	M225-M283 HydrophobicContact CE-CB 3.79Å; M225-M283 HydrophobicContact CE-CG 4.04Å; M225-M283 HydrophobicContact CE-SD 4.26Å; M225-M283 HydrophobicContact SD-CB 3.72Å; M225-M283 HydrophobicContact SD-CG 3.74Å; L228-M283 HydrophobicContact CB-CG 3.67Å; L228-M283 HydrophobicContact CB-SD 4.24Å; L228-M283 HydrophobicContact CD1-CG 4.28Å; V229-M283 HydrophobicContact CB-SD 4.4Å; V229-M283 HydrophobicContact CG2-SD 3.66Å; A232-M283 HydrophobicContact CB-CE 3.83Å; A232-M283 HydrophobicContact CB-SD 4.39Å; I279-M283 HydrophobicContact CG2-CE 4.2Å; I279-M283 WeakPolarHBondContact O-CB 3.47Å; I279-M283 VanDerWaalsContact O-CG 3.31Å; I279-M283 WeakPolarHBondContact O-CG 3.32Å; I279-M283 PolarHBondContact O-N 2.97Å; E280-M283 HydrophobicContact CB-CE 4.45Å; E280-M283 HydrophobicContact CG-CE 3.81Å; M283-A285 VanDerWaalsContact C-N 3.33Å; M283-A285 PolarHBondContact O-N 3.05Å; M283-I286 PolarHBondContact O-N 3.15Å; M283-F287 VanDerWaalsContact O-CB 3.24Å; M283-F287 WeakPolarHBondContact O-CB 3.11Å; M283-F287 PolarHBondContact O-N 3.18Å; M283-F321 HydrophobicContact SD-CE2 4.45Å; M283-F321 HydrophobicContact SD-CZ 4.06Å
284	N	97.1	Very high	97	Very high	62 Å²	62	44 Å²	44	33%	0.332	23%	0.23	S	C	.	.	H	α-helix	trans	-62.3	-38.9	175.4	-92	-89.6	0	0	0	112.3	E280 N281 F287 K288	E280-N284 VanDerWaalsContact O-CB 3.28Å; E280-N284 WeakPolarHBondContact O-CB 3.3Å; E280-N284 PolarHBondContact O-N 3.21Å; E280-N284 PolarHBondContact O-ND2 3.12Å; N281-N284 PolarHBondContact O-N 3.48Å; N284-F287 PolarHBondContact O-N 2.81Å; N284-K288 VanDerWaalsContact O-CB 3.3Å; N284-K288 WeakPolarHBondContact O-CB 3.38Å; N284-K288 WeakPolarHBondContact O-CG 3.27Å; N284-K288 PolarHBondContact O-N 3.45Å; N284-K288 WeakPolarHBondContact OD1-CE 3.36Å; N284-K288 PolarHBondContact OD1-NZ 3.38Å
285	A	97.3	Very high	97.1	Very high	44 Å²	44	41.3 Å²	41.3	36%	0.364	22%	0.217	S	C	.	.	H	α-helix	trans	-63.6	-48.9	178	0	0	0	0	0	111.5	I199 N281 M282 M283 F287 G289	I199-A285 HydrophobicContact CG2-CB 4.09Å; N281-A285 WeakPolarHBondContact O-CB 3.26Å; N281-A285 PolarHBondContact O-N 3.33Å; M282-A285 PolarHBondContact O-N 3.14Å; M283-A285 VanDerWaalsContact C-N 3.33Å; M283-A285 PolarHBondContact O-N 3.05Å; A285-F287 PolarHBondContact O-N 2.69Å; A285-G289 WeakPolarHBondContact O-CA 3.47Å; A285-G289 PolarHBondContact O-N 3.16Å
286	I	98.4	Very high	97.3	Very high	2 Å²	2	46.2 Å²	46.2	1%	0.01	23%	0.231	C	C	.	.	H	α-helix	trans	-65.2	-40.9	176.6	-61	169	0	0	0	111.2	I199 A221 M222 L224 M225 L228 M282 M283 V290 F291	I199-I286 HydrophobicContact CD1-CD1 4.12Å; I199-I286 HydrophobicContact CD1-CG1 4.17Å; I199-I286 HydrophobicContact CG1-CD1 4.07Å; I199-I286 HydrophobicContact CG1-CG1 4.01Å; I199-I286 HydrophobicContact CG2-CG1 4Å; A221-I286 HydrophobicContact CB-CG2 4.1Å; M222-I286 HydrophobicContact CE-CG2 3.84Å; L224-I286 HydrophobicContact CB-CD1 4.26Å; L224-I286 HydrophobicContact CD2-CD1 3.81Å; L224-I286 HydrophobicContact CG-CD1 3.73Å; M225-I286 HydrophobicContact CB-CD1 4.44Å; M225-I286 HydrophobicContact CB-CG2 4.07Å; M225-I286 HydrophobicContact SD-CB 4.36Å; L228-I286 HydrophobicContact CD1-CD1 3.72Å; M282-I286 PolarHBondContact O-N 3.41Å; M282-I286 VanDerWaalsContact O-N 3.1Å; M283-I286 PolarHBondContact O-N 3.15Å; I286-V290 HydrophobicContact CG2-CB 4.44Å; I286-V290 HydrophobicContact CG2-CG2 4.44Å; I286-V290 WeakPolarHBondContact O-CA 3.42Å; I286-V290 WeakPolarHBondContact O-CB 3.42Å; I286-V290 PolarHBondContact O-N 3.02Å; I286-F291 PolarHBondContact O-N 2.75Å
287	F	98.3	Very high	97.5	Very high	22 Å²	22	46.1 Å²	46.1	10%	0.096	23%	0.231	C	C	.	.	I	π-helix	trans	-65.4	-45.6	-178.6	-170.6	-100.2	0	0	0	112.3	M225 M283 N284 A285 F291 V292 I310 W313 Y326 Y329	M225-F287 HydrophobicContact CE-CB 4.48Å; M283-F287 VanDerWaalsContact O-CB 3.24Å; M283-F287 WeakPolarHBondContact O-CB 3.11Å; M283-F287 PolarHBondContact O-N 3.18Å; N284-F287 PolarHBondContact O-N 2.81Å; A285-F287 PolarHBondContact O-N 2.69Å; F287-F291 HydrophobicContact CD2-CB 3.89Å; F287-F291 AromaticContact CD2-CD1 3.75Å; F287-F291 HydrophobicContact CD2-CD1 3.75Å; F287-F291 AromaticContact CD2-CG 3.9Å; F287-F291 HydrophobicContact CD2-CG 3.9Å; F287-F291 HydrophobicContact CE1-CD1 4.47Å; F287-F291 HydrophobicContact CE2-CB 4.27Å; F287-F291 AromaticContact CE2-CD1 3.23Å; F287-F291 HydrophobicContact CE2-CD1 3.23Å; F287-F291 AromaticContact CE2-CE1 3.67Å; F287-F291 HydrophobicContact CE2-CE1 3.67Å; F287-F291 AromaticContact CE2-CG 3.77Å; F287-F291 HydrophobicContact CE2-CG 3.77Å; F287-F291 HydrophobicContact CE2-CZ 4.49Å; F287-F291 HydrophobicContact CG-CB 4.46Å; F287-F291 AromaticContact CZ-CD1 3.66Å; F287-F291 HydrophobicContact CZ-CD1 3.66Å; F287-F291 AromaticContact CZ-CE1 3.92Å; F287-F291 HydrophobicContact CZ-CE1 3.92Å; F287-F291 WeakPolarHBondContact O-CB 3.33Å; F287-F291 PolarHBondContact O-N 3.25Å; F287-V292 HydrophobicContact CD1-CG1 4.09Å; F287-V292 HydrophobicContact CE1-CG1 3.76Å; F287-V292 HydrophobicContact CZ-CG1 4.21Å; F287-V292 PolarHBondContact O-N 3.47Å; F287-I310 HydrophobicContact CE2-CD1 4.41Å; F287-W313 AromaticContact CD2-CZ3 3.94Å; F287-W313 HydrophobicContact CD2-CZ3 3.94Å; F287-W313 HydrophobicContact CE2-CZ3 4.09Å; F287-Y326 HydrophobicContact CD2-CE1 4.13Å; F287-Y326 HydrophobicContact CE1-CE1 4.17Å; F287-Y326 AromaticContact CE2-CD1 3.74Å; F287-Y326 HydrophobicContact CE2-CD1 3.74Å; F287-Y326 AromaticContact CE2-CE1 3.57Å; F287-Y326 HydrophobicContact CE2-CE1 3.57Å; F287-Y326 AromaticContact CZ-CD1 3.73Å; F287-Y326 HydrophobicContact CZ-CD1 3.73Å; F287-Y326 AromaticContact CZ-CE1 3.59Å; F287-Y326 HydrophobicContact CZ-CE1 3.59Å; F287-Y329 HydrophobicContact CE1-CE2 4.42Å; F287-Y329 HydrophobicContact CZ-CD2 4.42Å; F287-Y329 AromaticContact CZ-CE2 3.7Å; F287-Y329 HydrophobicContact CZ-CE2 3.7Å
288	K	97.3	Very high	97.6	Very high	127 Å²	127	46.9 Å²	46.9	55%	0.552	25%	0.248	S	C	*	.	I	π-helix	trans	-80.3	-34.4	-179.1	-65.8	169.9	-170.8	162.7	0	113	N284 V292 H293	N284-K288 VanDerWaalsContact O-CB 3.3Å; N284-K288 WeakPolarHBondContact O-CB 3.38Å; N284-K288 WeakPolarHBondContact O-CG 3.27Å; N284-K288 PolarHBondContact O-N 3.45Å; N284-K288 WeakPolarHBondContact OD1-CE 3.36Å; N284-K288 PolarHBondContact OD1-NZ 3.38Å; K288-V292 WeakPolarHBondContact O-CG2 3.21Å; K288-H293 PolarHBondContact O-CD2 3.09Å
289	G	96.6	Very high	97.7	Very high	27 Å²	27	45.4 Å²	45.4	28%	0.278	24%	0.24	S	C	.	.	I	π-helix	trans	-79.1	-38.7	178.9	0	0	0	0	0	113.6	A285	A285-G289 WeakPolarHBondContact O-CA 3.47Å; A285-G289 PolarHBondContact O-N 3.16Å
290	V	98.6	Very high	97.7	Very high	0 Å²	0	46 Å²	46	0%	0	25%	0.245	C	C	.	.	I	π-helix	trans	-112.7	-63	-173.5	-169.6	0	0	0	0	112.1	T203 T218 A221 M222 I286 V292 H293 R294	T203-V290 HydrophobicContact CG2-CG2 4.43Å; T218-V290 HydrophobicContact CG2-CG1 4.24Å; A221-V290 HydrophobicContact CB-CB 4.34Å; A221-V290 HydrophobicContact CB-CG1 4.05Å; A221-V290 HydrophobicContact CB-CG2 4.03Å; M222-V290 HydrophobicContact CE-CB 3.97Å; M222-V290 HydrophobicContact CE-CG1 3.78Å; I286-V290 HydrophobicContact CG2-CB 4.44Å; I286-V290 HydrophobicContact CG2-CG2 4.44Å; I286-V290 WeakPolarHBondContact O-CA 3.42Å; I286-V290 WeakPolarHBondContact O-CB 3.42Å; I286-V290 PolarHBondContact O-N 3.02Å; V290-V292 PolarHBondContact O-N 3.14Å; V290-H293 PolarHBondContact O-N 3.24Å; V290-H293 VanDerWaalsContact O-N 3.11Å; V290-R294 HydrophobicContact CG1-CB 4.42Å; V290-R294 HydrophobicContact CG1-CG 3.87Å; V290-R294 WeakPolarHBondContact O-CB 3.38Å; V290-R294 WeakPolarHBondContact O-CG 3.43Å; V290-R294 PolarHBondContact O-N 3.15Å
291	F	98.7	Very high	97.8	Very high	0 Å²	0	44.9 Å²	44.9	0%	0	24%	0.24	C	C	.	.	I	π-helix	trans	-57.7	-52	-167.1	173.8	-88.3	0	0	0	112.5	M222 I286 F287 H293 R294 Y295 C306 I310 W313 Y329	M222-F291 HydrophobicContact CE-CB 4.11Å; M222-F291 HydrophobicContact SD-CB 4.14Å; M222-F291 HydrophobicContact SD-CD2 3.89Å; I286-F291 PolarHBondContact O-N 2.75Å; F287-F291 HydrophobicContact CD2-CB 3.89Å; F287-F291 AromaticContact CD2-CD1 3.75Å; F287-F291 HydrophobicContact CD2-CD1 3.75Å; F287-F291 AromaticContact CD2-CG 3.9Å; F287-F291 HydrophobicContact CD2-CG 3.9Å; F287-F291 HydrophobicContact CE1-CD1 4.47Å; F287-F291 HydrophobicContact CE2-CB 4.27Å; F287-F291 AromaticContact CE2-CD1 3.23Å; F287-F291 HydrophobicContact CE2-CD1 3.23Å; F287-F291 AromaticContact CE2-CE1 3.67Å; F287-F291 HydrophobicContact CE2-CE1 3.67Å; F287-F291 AromaticContact CE2-CG 3.77Å; F287-F291 HydrophobicContact CE2-CG 3.77Å; F287-F291 HydrophobicContact CE2-CZ 4.49Å; F287-F291 HydrophobicContact CG-CB 4.46Å; F287-F291 AromaticContact CZ-CD1 3.66Å; F287-F291 HydrophobicContact CZ-CD1 3.66Å; F287-F291 AromaticContact CZ-CE1 3.92Å; F287-F291 HydrophobicContact CZ-CE1 3.92Å; F287-F291 WeakPolarHBondContact O-CB 3.33Å; F287-F291 PolarHBondContact O-N 3.25Å; F291-H293 PolarHBondContact O-N 2.95Å; F291-R294 PolarHBondContact O-N 3.04Å; F291-R294 VanDerWaalsContact O-N 3.17Å; F291-Y295 HydrophobicContact CE1-CD1 4.37Å; F291-Y295 HydrophobicContact CE1-CG 4.43Å; F291-Y295 HydrophobicContact CZ-CG 4.4Å; F291-Y295 WeakPolarHBondContact O-CD1 3.48Å; F291-Y295 PolarHBondContact O-N 3.47Å; F291-C306 HydrophobicContact CD2-CB 3.87Å; F291-C306 HydrophobicContact CE2-CB 3.8Å; F291-C306 WeakPolarHBondContact CE2-O 3.28Å; F291-I310 HydrophobicContact CE1-CD1 3.95Å; F291-I310 HydrophobicContact CE2-CB 3.87Å; F291-I310 HydrophobicContact CE2-CD1 3.96Å; F291-I310 HydrophobicContact CE2-CG1 4.48Å; F291-I310 HydrophobicContact CE2-CG2 4.04Å; F291-I310 HydrophobicContact CZ-CB 4.2Å; F291-I310 HydrophobicContact CZ-CD1 3.44Å; F291-I310 VanDerWaalsContact CZ-CD1 3.44Å; F291-I310 HydrophobicContact CZ-CG1 4.4Å; F291-I310 HydrophobicContact CZ-CG2 4.22Å; F291-W313 AromaticContact CD2-CH2 3.8Å; F291-W313 HydrophobicContact CD2-CH2 3.8Å; F291-W313 HydrophobicContact CD2-CZ3 4.03Å; F291-W313 HydrophobicContact CE2-CH2 4.45Å; F291-W313 HydrophobicContact CE2-CZ3 4.41Å; F291-W313 HydrophobicContact CG-CH2 4.33Å; F291-W313 HydrophobicContact CG-CZ3 4.39Å; F291-Y329 HydrophobicContact CE1-CD1 4.03Å; F291-Y329 AromaticContact CE1-CD2 3.72Å; F291-Y329 HydrophobicContact CE1-CD2 3.72Å; F291-Y329 HydrophobicContact CE1-CE1 4.3Å; F291-Y329 HydrophobicContact CE1-CE2 4.02Å; F291-Y329 AromaticContact CE1-CG 3.73Å; F291-Y329 HydrophobicContact CE1-CG 3.73Å; F291-Y329 HydrophobicContact CZ-CD2 4.2Å; F291-Y329 HydrophobicContact CZ-CG 4.03Å
292	V	98.2	Very high	97.9	Very high	24 Å²	24	40 Å²	40	15%	0.145	21%	0.213	C	C	.	.	H	α-helix	trans	-66.9	-8.7	-176.4	-61	0	0	0	0	114.3	F287 K288 V290 Y295 R296	F287-V292 HydrophobicContact CD1-CG1 4.09Å; F287-V292 HydrophobicContact CE1-CG1 3.76Å; F287-V292 HydrophobicContact CZ-CG1 4.21Å; F287-V292 PolarHBondContact O-N 3.47Å; K288-V292 WeakPolarHBondContact O-CG2 3.21Å; V290-V292 PolarHBondContact O-N 3.14Å; V292-Y295 WeakPolarHBondContact O-CE1 3.4Å; V292-R296 VanDerWaalsContact O-CZ 3.28Å; V292-R296 PolarHBondContact O-NE 2.92Å; V292-R296 PolarHBondContact O-NH2 2.81Å
293	H	98	Very high	98	Very high	83 Å²	83	40.4 Å²	40.4	38%	0.384	21%	0.214	S	C	.	.	H	α-helix	trans	-101.2	-40.3	171.3	-67.1	-87.1	0	0	0	111.8	K288 V290 F291 R296	K288-H293 PolarHBondContact O-CD2 3.09Å; V290-H293 PolarHBondContact O-N 3.24Å; V290-H293 VanDerWaalsContact O-N 3.11Å; F291-H293 PolarHBondContact O-N 2.95Å; H293-R296 WeakPolarHBondContact O-CG 3.5Å
294	R	98.4	Very high	98	Very high	30 Å²	30	40 Å²	40	11%	0.113	21%	0.213	C	C	.	.	H	α-helix	trans	-88.1	-21.3	-171.8	-60.5	-63	127.4	-126.1	-2.7	115.3	S206 D207 T218 V290 F291 R296 D297 I302	S206-R294 WeakPolarHBondContact O-CD 3.39Å; S206-R294 PolarHBondContact O-NE 3.2Å; D207-R294 IonicContact OD1-NH2 2.9Å; D207-R294 PolarHBondContact OD1-NH2 2.89Å; D207-R294 VanDerWaalsContact OD1-NH2 3.15Å; T218-R294 HydrophobicContact CG2-CB 3.75Å; T218-R294 HydrophobicContact CG2-CG 4.1Å; T218-R294 WeakPolarHBondContact OG1-CG 3.5Å; V290-R294 HydrophobicContact CG1-CB 4.42Å; V290-R294 HydrophobicContact CG1-CG 3.87Å; V290-R294 WeakPolarHBondContact O-CB 3.38Å; V290-R294 WeakPolarHBondContact O-CG 3.43Å; V290-R294 PolarHBondContact O-N 3.15Å; F291-R294 PolarHBondContact O-N 3.04Å; F291-R294 VanDerWaalsContact O-N 3.17Å; R294-R296 PolarHBondContact O-N 3.13Å; R294-D297 WeakPolarHBondContact CD-OD2 3.38Å; R294-D297 IonicContact CZ-OD2 2.73Å; R294-D297 IonicContact NE-OD2 2.75Å; R294-D297 IonicContact NH1-OD2 3.54Å; R294-D297 PolarHBondContact NH1-OD2 3.34Å; R294-D297 WeakPolarHBondContact O-CB 3.48Å; R294-D297 PolarHBondContact O-N 3.04Å; R294-D297 VanDerWaalsContact O-N 3.11Å; R294-I302 HydrophobicContact CB-CG2 4.03Å
295	Y	98.4	Very high	98.1	Very high	30 Å²	30	37.3 Å²	37.3	12%	0.118	20%	0.198	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.4	-17.3	170.2	92.5	-85.2	0	0	0	113.1	F291 V292 R303 Y329	F291-Y295 HydrophobicContact CE1-CD1 4.37Å; F291-Y295 HydrophobicContact CE1-CG 4.43Å; F291-Y295 HydrophobicContact CZ-CG 4.4Å; F291-Y295 WeakPolarHBondContact O-CD1 3.48Å; F291-Y295 PolarHBondContact O-N 3.47Å; V292-Y295 WeakPolarHBondContact O-CE1 3.4Å; Y295-R303 WeakPolarHBondContact O-CB 3.43Å; Y295-R303 VanDerWaalsContact O-CD 3.27Å; Y295-R303 WeakPolarHBondContact O-CD 3.37Å; Y295-R303 VanDerWaalsContact O-CG 3.24Å; Y295-R303 WeakPolarHBondContact O-CG 3.05Å; Y295-Y329 HydrophobicContact CD1-CD1 4.22Å; Y295-Y329 HydrophobicContact CD1-CE1 4.47Å; Y295-Y329 HydrophobicContact CD2-CD1 4.2Å; Y295-Y329 AromaticContact CE1-CD1 3.85Å; Y295-Y329 HydrophobicContact CE1-CD1 3.85Å; Y295-Y329 AromaticContact CE1-CE1 3.89Å; Y295-Y329 HydrophobicContact CE1-CE1 3.89Å; Y295-Y329 AromaticContact CE2-CD1 3.85Å; Y295-Y329 HydrophobicContact CE2-CD1 3.85Å; Y295-Y329 HydrophobicContact CG-CD1 4.38Å; Y295-Y329 AromaticContact CZ-CD1 3.66Å; Y295-Y329 AromaticContact CZ-CE1 3.97Å
296	R	97.9	Very high	98.1	Very high	148 Å²	148	35.2 Å²	35.2	56%	0.558	18%	0.181	S	C	*	.	T	Hydrogen-bonded Turn	trans	-122.4	29.1	179	57.6	179.9	161.8	156.5	-1.7	112.8	V292 H293 R294	V292-R296 VanDerWaalsContact O-CZ 3.28Å; V292-R296 PolarHBondContact O-NE 2.92Å; V292-R296 PolarHBondContact O-NH2 2.81Å; H293-R296 WeakPolarHBondContact O-CG 3.5Å; R294-R296 PolarHBondContact O-N 3.13Å
297	D	98.6	Very high	98.1	Very high	6 Å²	6	35.1 Å²	35.1	3%	0.032	18%	0.18	C	C	.	.			trans	-59.3	156	171	-154	-75.4	0	0	0	111.7	R214 R294 I299 I302 R303	R214-D297 WeakPolarHBondContact CD-OD2 3.16Å; R214-D297 IonicContact CZ-OD1 2.8Å; R214-D297 IonicContact CZ-OD2 2.9Å; R214-D297 IonicContact NE-OD1 2.74Å; R214-D297 IonicContact NE-OD2 2.91Å; R214-D297 PolarHBondContact NE-OD2 3.37Å; R214-D297 IonicContact NH2-OD1 3.28Å; R214-D297 PolarHBondContact NH2-OD1 3.41Å; R214-D297 IonicContact NH2-OD2 2.7Å; R294-D297 WeakPolarHBondContact CD-OD2 3.38Å; R294-D297 IonicContact CZ-OD2 2.73Å; R294-D297 IonicContact NE-OD2 2.75Å; R294-D297 IonicContact NH1-OD2 3.54Å; R294-D297 PolarHBondContact NH1-OD2 3.34Å; R294-D297 WeakPolarHBondContact O-CB 3.48Å; R294-D297 PolarHBondContact O-N 3.04Å; R294-D297 VanDerWaalsContact O-N 3.11Å; D297-I299 PolarHBondContact O-N 2.99Å; D297-I299 PolarHBondContact OD1-N 3.4Å; D297-I302 HydrophobicContact CB-CB 3.97Å; D297-I302 HydrophobicContact CB-CG2 3.87Å; D297-R303 HydrophobicContact CB-CG 4.27Å; D297-R303 WeakPolarHBondContact O-CD 3.1Å; D297-R303 WeakPolarHBondContact O-CG 3.32Å; D297-R303 PolarHBondContact O-NH1 3.4Å
298	A	97.3	Very high	98.1	Very high	91 Å²	91	37.1 Å²	37.1	75%	0.752	19%	0.19	S	C	*	.	S	Bend	trans	-62.5	-34.9	169.7	0	0	0	0	0	111.7	R303	A298-R303 PolarHBondContact O-NH1 3.18Å
299	I	97.7	Very high	98.2	Very high	38 Å²	38	31.4 Å²	31.4	20%	0.195	17%	0.166	C	C	.	.	S	Bend	trans	-80.2	121.9	-179.3	-51.7	-57.2	0	0	0	110.9	R211 D297 E301 I302 R303	R211-I299 HydrophobicContact CG-CG1 4.25Å; D297-I299 PolarHBondContact O-N 2.99Å; D297-I299 PolarHBondContact OD1-N 3.4Å; I299-E301 HydrophobicContact CG2-CB 4.19Å; I299-I302 HydrophobicContact CB-CB 4.42Å; I299-I302 HydrophobicContact CB-CD1 3.87Å; I299-I302 HydrophobicContact CB-CG1 3.95Å; I299-I302 HydrophobicContact CG1-CD1 4.24Å; I299-I302 HydrophobicContact CG2-CD1 4.23Å; I299-I302 HydrophobicContact CG2-CG1 3.97Å; I299-I302 PolarHBondContact O-N 3.34Å; I299-R303 PolarHBondContact O-N 3.04Å
300	A	98	Very high	98.3	Very high	14 Å²	14	30.1 Å²	30.1	12%	0.116	15%	0.152	C	C	.	.	H	α-helix	trans	-66.7	-41.3	-174.3	0	0	0	0	0	113.7	I302 R303 A304 Q338 E340 V341	A300-I302 PolarHBondContact O-N 2.9Å; A300-I302 VanDerWaalsContact O-N 3.16Å; A300-R303 WeakPolarHBondContact O-CB 3.26Å; A300-R303 PolarHBondContact O-N 3.31Å; A300-A304 WeakPolarHBondContact O-CB 3.4Å; A300-A304 PolarHBondContact O-N 3.27Å; A300-Q338 HydrophobicContact CB-CB 3.95Å; A300-Q338 HydrophobicContact CB-CG 3.8Å; A300-E340 HydrophobicContact CB-CG 4.35Å; A300-E340 WeakPolarHBondContact CB-OE1 3.23Å; A300-V341 HydrophobicContact CB-CG2 3.97Å; A300-V341 WeakPolarHBondContact O-CG2 3.5Å
301	E	97.4	Very high	98.2	Very high	59 Å²	59	30.5 Å²	30.5	28%	0.276	16%	0.156	S	C	.	.	H	α-helix	trans	-48.6	-40.8	171.1	-63.7	161.5	-159.5	0	0	112.9	R211 H215 I299 A304 I305 E340	R211-E301 IonicContact CZ-OE1 3.75Å; R211-E301 IonicContact CZ-OE2 3.23Å; R211-E301 IonicContact NH2-OE1 2.63Å; R211-E301 PolarHBondContact NH2-OE1 3.04Å; R211-E301 IonicContact NH2-OE2 2.81Å; R211-E301 PolarHBondContact NH2-OE2 3.18Å; H215-E301 IonicContact CE1-OE2 2.61Å; H215-E301 PolarHBondContact CE1-OE2 3.18Å; H215-E301 IonicContact ND1-OE2 2.65Å; H215-E301 PolarHBondContact ND1-OE2 2.84Å; H215-E301 VanDerWaalsContact ND1-OE2 3.13Å; I299-E301 HydrophobicContact CG2-CB 4.19Å; E301-A304 PolarHBondContact O-N 3.05Å; E301-I305 WeakPolarHBondContact O-CD1 3.41Å; E301-I305 VanDerWaalsContact O-CG1 3.32Å; E301-I305 WeakPolarHBondContact O-CG1 3.27Å; E301-I305 PolarHBondContact O-N 3.21Å; E301-E340 PolarHBondContact N-OE1 3.34Å
302	I	98.6	Very high	98.1	Very high	0 Å²	0	33.1 Å²	33.1	0%	0	17%	0.172	C	C	.	.	H	α-helix	trans	-71.7	-43	-178.4	-58.4	-176.3	0	0	0	110.1	R214 H215 T218 R294 D297 I299 A300 A304 I305 C306	R214-I302 HydrophobicContact CG-CD1 4.26Å; H215-I302 HydrophobicContact CB-CD1 3.86Å; H215-I302 HydrophobicContact CB-CG1 4Å; T218-I302 HydrophobicContact CG2-CG2 3.88Å; R294-I302 HydrophobicContact CB-CG2 4.03Å; D297-I302 HydrophobicContact CB-CB 3.97Å; D297-I302 HydrophobicContact CB-CG2 3.87Å; I299-I302 HydrophobicContact CB-CB 4.42Å; I299-I302 HydrophobicContact CB-CD1 3.87Å; I299-I302 HydrophobicContact CB-CG1 3.95Å; I299-I302 HydrophobicContact CG1-CD1 4.24Å; I299-I302 HydrophobicContact CG2-CD1 4.23Å; I299-I302 HydrophobicContact CG2-CG1 3.97Å; I299-I302 PolarHBondContact O-N 3.34Å; A300-I302 PolarHBondContact O-N 2.9Å; A300-I302 VanDerWaalsContact O-N 3.16Å; I302-A304 VanDerWaalsContact C-N 3.35Å; I302-A304 PolarHBondContact O-N 3.44Å; I302-I305 PolarHBondContact O-N 3.17Å; I302-C306 PolarHBondContact O-N 2.92Å
303	R	98.8	Very high	98.1	Very high	28 Å²	28	32 Å²	32	11%	0.106	17%	0.165	C	C	.	.	H	α-helix	trans	-60.6	-44.7	173.2	-58.2	-161.2	-63.3	-76.5	2.7	111.3	Y295 D297 A298 I299 A300 I305 C306 I307 D336 V341	Y295-R303 WeakPolarHBondContact O-CB 3.43Å; Y295-R303 VanDerWaalsContact O-CD 3.27Å; Y295-R303 WeakPolarHBondContact O-CD 3.37Å; Y295-R303 VanDerWaalsContact O-CG 3.24Å; Y295-R303 WeakPolarHBondContact O-CG 3.05Å; D297-R303 HydrophobicContact CB-CG 4.27Å; D297-R303 WeakPolarHBondContact O-CD 3.1Å; D297-R303 WeakPolarHBondContact O-CG 3.32Å; D297-R303 PolarHBondContact O-NH1 3.4Å; A298-R303 PolarHBondContact O-NH1 3.18Å; I299-R303 PolarHBondContact O-N 3.04Å; A300-R303 WeakPolarHBondContact O-CB 3.26Å; A300-R303 PolarHBondContact O-N 3.31Å; R303-I305 VanDerWaalsContact C-N 3.34Å; R303-I305 PolarHBondContact O-N 2.83Å; R303-C306 PolarHBondContact O-N 2.93Å; R303-I307 WeakPolarHBondContact O-CG1 3.5Å; R303-I307 PolarHBondContact O-N 2.92Å; R303-D336 IonicContact CZ-OD1 2.65Å; R303-D336 IonicContact CZ-OD2 2.71Å; R303-D336 VanDerWaalsContact CZ-OD2 3.27Å; R303-D336 IonicContact NE-OD1 3.75Å; R303-D336 IonicContact NE-OD2 2.96Å; R303-D336 PolarHBondContact NE-OD2 2.65Å; R303-D336 VanDerWaalsContact NH2-CG 3.33Å; R303-D336 IonicContact NH2-OD1 2.73Å; R303-D336 PolarHBondContact NH2-OD1 3.18Å; R303-D336 IonicContact NH2-OD2 3.94Å; R303-D336 PolarHBondContact NH2-OD2 3.43Å; R303-V341 HydrophobicContact CB-CG1 4.24Å; R303-V341 HydrophobicContact CB-CG2 4.12Å
304	A	98.5	Very high	98	Very high	5 Å²	5	28.1 Å²	28.1	4%	0.041	15%	0.147	C	C	.	.	H	α-helix	trans	-59.4	-41.7	177.9	0	0	0	0	0	112.2	A300 E301 I302 I307 E308 V341 K344	A300-A304 WeakPolarHBondContact O-CB 3.4Å; A300-A304 PolarHBondContact O-N 3.27Å; E301-A304 PolarHBondContact O-N 3.05Å; I302-A304 VanDerWaalsContact C-N 3.35Å; I302-A304 PolarHBondContact O-N 3.44Å; A304-I307 PolarHBondContact O-N 3.27Å; A304-E308 WeakPolarHBondContact O-CB 3.41Å; A304-E308 PolarHBondContact O-N 2.88Å; A304-V341 HydrophobicContact CB-CG2 4.24Å; A304-K344 HydrophobicContact CB-CG 3.93Å
305	I	98.6	Very high	97.8	Very high	5 Å²	5	31.9 Å²	31.9	3%	0.026	16%	0.164	C	C	.	.	H	α-helix	trans	-62	-45.5	175.5	-75.4	164	0	0	0	111.8	H215 L219 M222 E301 I302 R303 E308 E309	H215-I305 WeakPolarHBondContact NE2-CD1 3.44Å; L219-I305 HydrophobicContact CB-CD1 4.36Å; L219-I305 HydrophobicContact CB-CG2 4.5Å; L219-I305 HydrophobicContact CD1-CD1 4.21Å; L219-I305 HydrophobicContact CD1-CG1 4.38Å; L219-I305 HydrophobicContact CD1-CG2 3.95Å; M222-I305 HydrophobicContact CB-CG2 4.41Å; M222-I305 HydrophobicContact CG-CG2 4.16Å; E301-I305 WeakPolarHBondContact O-CD1 3.41Å; E301-I305 VanDerWaalsContact O-CG1 3.32Å; E301-I305 WeakPolarHBondContact O-CG1 3.27Å; E301-I305 PolarHBondContact O-N 3.21Å; I302-I305 PolarHBondContact O-N 3.17Å; R303-I305 VanDerWaalsContact C-N 3.34Å; R303-I305 PolarHBondContact O-N 2.83Å; I305-E308 PolarHBondContact O-N 3.31Å; I305-E309 PolarHBondContact O-N 2.99Å; I305-E309 VanDerWaalsContact O-N 3.16Å
306	C	98.8	Very high	97.6	Very high	0 Å²	0	33.3 Å²	33.3	0%	0	17%	0.174	C	C	.	.	H	α-helix	trans	-62.4	-43.4	176.8	-70.4	0	0	0	0	112.1	M222 F291 I302 R303 I310	M222-C306 HydrophobicContact SD-CB 4.45Å; F291-C306 HydrophobicContact CD2-CB 3.87Å; F291-C306 HydrophobicContact CE2-CB 3.8Å; F291-C306 WeakPolarHBondContact CE2-O 3.28Å; I302-C306 PolarHBondContact O-N 2.92Å; R303-C306 PolarHBondContact O-N 2.93Å; C306-I310 WeakPolarHBondContact O-CG2 3.25Å; C306-I310 PolarHBondContact O-N 2.96Å; C306-I310 VanDerWaalsContact O-N 3.09Å
307	I	98.6	Very high	97.4	Very high	0 Å²	0	27.6 Å²	27.6	0%	0	15%	0.152	C	C	.	.	H	α-helix	trans	-69.1	-34.4	-180	-66.6	-62.8	0	0	0	112.7	R303 A304 I310 G311 T333 K344 C345	R303-I307 WeakPolarHBondContact O-CG1 3.5Å; R303-I307 PolarHBondContact O-N 2.92Å; A304-I307 PolarHBondContact O-N 3.27Å; I307-I310 WeakPolarHBondContact O-CG2 3.43Å; I307-G311 PolarHBondContact O-N 2.98Å; I307-T333 HydrophobicContact CD1-CG2 3.82Å; I307-T333 HydrophobicContact CG1-CG2 3.71Å; I307-K344 HydrophobicContact CB-CB 4.32Å; I307-K344 HydrophobicContact CG2-CB 3.82Å; I307-C345 HydrophobicContact CG2-CB 4.33Å
308	E	98.1	Very high	97.2	Very high	65 Å²	65	28.4 Å²	28.4	30%	0.304	16%	0.158	S	C	.	.	H	α-helix	trans	-63.2	-51	173.7	-179.7	154.9	-133.3	0	0	111.2	A304 I305 G311 V312 K344	A304-E308 WeakPolarHBondContact O-CB 3.41Å; A304-E308 PolarHBondContact O-N 2.88Å; I305-E308 PolarHBondContact O-N 3.31Å; E308-G311 PolarHBondContact O-N 2.88Å; E308-V312 PolarHBondContact O-N 3.28Å; E308-V312 VanDerWaalsContact O-N 3.17Å; E308-K344 HydrophobicContact CB-CD 4.11Å; E308-K344 HydrophobicContact CB-CG 4.45Å; E308-K344 HydrophobicContact CG-CD 4.43Å; E308-K344 IonicContact OE1-NZ 3.13Å; E308-K344 PolarHBondContact OE1-NZ 3.19Å; E308-K344 WeakPolarHBondContact OE2-CE 3.45Å; E308-K344 IonicContact OE2-NZ 3.02Å; E308-K344 PolarHBondContact OE2-NZ 2.75Å
309	E	98.3	Very high	97	Very high	7 Å²	7	29.7 Å²	29.7	3%	0.033	15%	0.152	C	C	.	.	H	α-helix	trans	-73.9	-34.6	-174.6	-62	-63.9	116.6	0	0	113.4	M222 K223 T226 I305 G311 V312 W313	M222-E309 HydrophobicContact CB-CB 3.93Å; M222-E309 HydrophobicContact CB-CG 3.74Å; K223-E309 WeakPolarHBondContact CD-OE2 3.37Å; K223-E309 WeakPolarHBondContact CE-OE1 3.49Å; K223-E309 WeakPolarHBondContact CE-OE2 3.4Å; K223-E309 IonicContact NZ-OE1 2.71Å; K223-E309 PolarHBondContact NZ-OE1 2.7Å; K223-E309 IonicContact NZ-OE2 2.86Å; K223-E309 PolarHBondContact NZ-OE2 3.31Å; T226-E309 PolarHBondContact OG1-OE2 3.17Å; I305-E309 PolarHBondContact O-N 2.99Å; I305-E309 VanDerWaalsContact O-N 3.16Å; E309-G311 PolarHBondContact O-N 2.92Å; E309-V312 CarbonylContact O-C 3.48Å; E309-V312 WeakPolarHBondContact O-CA 3.42Å; E309-V312 WeakPolarHBondContact O-CB 3.5Å; E309-V312 PolarHBondContact O-N 3.19Å; E309-W313 HydrophobicContact CB-CZ2 3.85Å; E309-W313 VanDerWaalsContact O-CG 3.26Å; E309-W313 PolarHBondContact O-N 3.03Å; E309-W313 PolarHBondContact O-NE1 3.37Å
310	I	98.3	Very high	96.8	Very high	0 Å²	0	29.7 Å²	29.7	0%	0	16%	0.158	C	C	.	.	H	α-helix	trans	-62.9	-32.7	171.5	-168.1	169.3	0	0	0	111.9	F287 F291 C306 I307 V312 W313 M314 Y326 Y329 V330	F287-I310 HydrophobicContact CE2-CD1 4.41Å; F291-I310 HydrophobicContact CE1-CD1 3.95Å; F291-I310 HydrophobicContact CE2-CB 3.87Å; F291-I310 HydrophobicContact CE2-CD1 3.96Å; F291-I310 HydrophobicContact CE2-CG1 4.48Å; F291-I310 HydrophobicContact CE2-CG2 4.04Å; F291-I310 HydrophobicContact CZ-CB 4.2Å; F291-I310 HydrophobicContact CZ-CD1 3.44Å; F291-I310 VanDerWaalsContact CZ-CD1 3.44Å; F291-I310 HydrophobicContact CZ-CG1 4.4Å; F291-I310 HydrophobicContact CZ-CG2 4.22Å; C306-I310 WeakPolarHBondContact O-CG2 3.25Å; C306-I310 PolarHBondContact O-N 2.96Å; C306-I310 VanDerWaalsContact O-N 3.09Å; I307-I310 WeakPolarHBondContact O-CG2 3.43Å; I310-V312 VanDerWaalsContact C-N 3.33Å; I310-W313 HydrophobicContact CB-CE3 3.91Å; I310-W313 HydrophobicContact CB-CZ3 3.9Å; I310-W313 HydrophobicContact CD1-CZ3 4.49Å; I310-W313 HydrophobicContact CG1-CE3 3.85Å; I310-W313 HydrophobicContact CG1-CZ3 4.04Å; I310-W313 PolarHBondContact O-N 2.84Å; I310-M314 HydrophobicContact CG1-CE 4.36Å; I310-M314 WeakPolarHBondContact O-CG 3.44Å; I310-M314 PolarHBondContact O-N 3.48Å; I310-M314 VanDerWaalsContact O-N 3.09Å; I310-Y326 HydrophobicContact CD1-CD1 4.03Å; I310-Y329 HydrophobicContact CD1-CD2 4.04Å; I310-V330 HydrophobicContact CG2-CG2 4.2Å
311	G	96.5	Very high	96.7	Very high	7 Å²	7	29.3 Å²	29.3	7%	0.072	15%	0.154	C	C	.	.	H	α-helix	trans	-61.3	-40	169	0	0	0	0	0	112.8	I307 E308 E309 K315	I307-G311 PolarHBondContact O-N 2.98Å; E308-G311 PolarHBondContact O-N 2.88Å; E309-G311 PolarHBondContact O-N 2.92Å; G311-K315 WeakPolarHBondContact O-CB 3.3Å; G311-K315 PolarHBondContact O-N 3.46Å
312	V	96.8	Very high	96.6	Very high	56 Å²	56	27.1 Å²	27.1	34%	0.339	14%	0.144	S	C	.	.	H	α-helix	trans	-65.5	-43.7	174.2	178.4	0	0	0	0	111.4	T226 E308 E309 I310 K315 L316	T226-V312 HydrophobicContact CG2-CG1 3.81Å; E308-V312 PolarHBondContact O-N 3.28Å; E308-V312 VanDerWaalsContact O-N 3.17Å; E309-V312 CarbonylContact O-C 3.48Å; E309-V312 WeakPolarHBondContact O-CA 3.42Å; E309-V312 WeakPolarHBondContact O-CB 3.5Å; E309-V312 PolarHBondContact O-N 3.19Å; I310-V312 VanDerWaalsContact C-N 3.33Å; V312-K315 PolarHBondContact O-N 3.27Å; V312-L316 VanDerWaalsContact O-CB 3.24Å; V312-L316 WeakPolarHBondContact O-CB 3.39Å; V312-L316 PolarHBondContact O-N 2.86Å
313	W	97.8	Very high	96.3	Very high	1 Å²	1	29.8 Å²	29.8	0%	0.004	16%	0.158	C	C	.	.	H	α-helix	trans	-62.6	-47.2	179.8	-48.7	-24.9	0	0	0	111.8	M222 M225 T226 V229 F287 F291 E309 I310 K315 L316 Y317 F321	M222-W313 HydrophobicContact CB-CZ2 4.49Å; M222-W313 HydrophobicContact SD-CH2 3.78Å; M222-W313 HydrophobicContact SD-CZ2 4Å; M225-W313 HydrophobicContact CB-CH2 4.43Å; M225-W313 HydrophobicContact CB-CZ2 3.76Å; M225-W313 HydrophobicContact CE-CD2 4.48Å; M225-W313 HydrophobicContact CE-CE3 4.21Å; M225-W313 HydrophobicContact CE-CZ3 4.36Å; M225-W313 HydrophobicContact CG-CD2 4.01Å; M225-W313 VanDerWaalsContact CG-CE2 3.46Å; M225-W313 HydrophobicContact CG-CE3 4.32Å; M225-W313 HydrophobicContact CG-CH2 3.77Å; M225-W313 HydrophobicContact CG-CZ2 3.36Å; M225-W313 HydrophobicContact CG-CZ3 4.22Å; T226-W313 PolarHBondContact OG1-NE1 3.09Å; V229-W313 HydrophobicContact CG2-CB 4.27Å; V229-W313 HydrophobicContact CG2-CG 4.05Å; F287-W313 AromaticContact CD2-CZ3 3.94Å; F287-W313 HydrophobicContact CD2-CZ3 3.94Å; F287-W313 HydrophobicContact CE2-CZ3 4.09Å; F291-W313 AromaticContact CD2-CH2 3.8Å; F291-W313 HydrophobicContact CD2-CH2 3.8Å; F291-W313 HydrophobicContact CD2-CZ3 4.03Å; F291-W313 HydrophobicContact CE2-CH2 4.45Å; F291-W313 HydrophobicContact CE2-CZ3 4.41Å; F291-W313 HydrophobicContact CG-CH2 4.33Å; F291-W313 HydrophobicContact CG-CZ3 4.39Å; E309-W313 HydrophobicContact CB-CZ2 3.85Å; E309-W313 VanDerWaalsContact O-CG 3.26Å; E309-W313 PolarHBondContact O-N 3.03Å; E309-W313 PolarHBondContact O-NE1 3.37Å; I310-W313 HydrophobicContact CB-CE3 3.91Å; I310-W313 HydrophobicContact CB-CZ3 3.9Å; I310-W313 HydrophobicContact CD1-CZ3 4.49Å; I310-W313 HydrophobicContact CG1-CE3 3.85Å; I310-W313 HydrophobicContact CG1-CZ3 4.04Å; I310-W313 PolarHBondContact O-N 2.84Å; W313-K315 PolarHBondContact O-N 2.9Å; W313-L316 PolarHBondContact O-N 3.26Å; W313-Y317 PolarHBondContact O-N 3.11Å; W313-F321 HydrophobicContact CB-CB 4.43Å; W313-F321 HydrophobicContact CB-CD1 4.01Å; W313-F321 HydrophobicContact CB-CD2 4.44Å; W313-F321 HydrophobicContact CB-CE1 4.41Å; W313-F321 HydrophobicContact CB-CG 4.03Å; W313-F321 HydrophobicContact CE3-CE1 4.4Å
314	M	96.3	Very high	96.1	Very high	0 Å²	0	32.9 Å²	32.9	0%	0	18%	0.177	C	C	.	.	H	α-helix	trans	-61.7	-28.9	176.9	-68	-172.4	-65.3	0	0	113.2	I310 S318 F321 L322 L327 V330 L352	I310-M314 HydrophobicContact CG1-CE 4.36Å; I310-M314 WeakPolarHBondContact O-CG 3.44Å; I310-M314 PolarHBondContact O-N 3.48Å; I310-M314 VanDerWaalsContact O-N 3.09Å; M314-S318 WeakPolarHBondContact O-CA 3.24Å; M314-S318 WeakPolarHBondContact O-CB 3.25Å; M314-F321 HydrophobicContact CG-CB 4.08Å; M314-F321 WeakPolarHBondContact CG-O 3.25Å; M314-L322 HydrophobicContact CB-CD1 4.34Å; M314-L327 HydrophobicContact CE-CD2 4.07Å; M314-L327 HydrophobicContact SD-CD2 3.57Å; M314-L327 VanDerWaalsContact SD-CD2 3.57Å; M314-L327 HydrophobicContact SD-CG 3.82Å; M314-V330 HydrophobicContact CE-CG2 3.95Å; M314-L352 HydrophobicContact CB-CD1 4.4Å; M314-L352 HydrophobicContact CB-CD2 3.93Å; M314-L352 HydrophobicContact CE-CD1 4.32Å
315	K	94.1	Very high	95.9	Very high	110 Å²	110	35.4 Å²	35.4	48%	0.478	19%	0.194	S	C	.	.	H	α-helix	trans	-83.2	-36.8	175.9	-176.3	172.3	-176.9	145.9	0	113.2	G311 V312 W313 G351 L352	G311-K315 WeakPolarHBondContact O-CB 3.3Å; G311-K315 PolarHBondContact O-N 3.46Å; V312-K315 PolarHBondContact O-N 3.27Å; W313-K315 PolarHBondContact O-N 2.9Å; K315-G351 VanDerWaalsContact CD-O 3.3Å; K315-G351 WeakPolarHBondContact CD-O 3.23Å; K315-G351 VanDerWaalsContact CE-O 3.27Å; K315-G351 WeakPolarHBondContact CE-O 3.31Å; K315-G351 PolarHBondContact NZ-O 2.96Å; K315-L352 HydrophobicContact CB-CD2 3.93Å
316	L	94.2	Very high	95.8	Very high	60 Å²	60	37.2 Å²	37.2	31%	0.314	20%	0.201	S	C	.	.	H	α-helix	trans	-78.4	-41.9	-174.8	178.6	61.3	0	0	0	112.4	V229 N230 L233 V312 W313	V229-L316 HydrophobicContact CG1-CD2 4.1Å; V229-L316 HydrophobicContact CG1-CG 4.4Å; N230-L316 HydrophobicContact CB-CD2 4.19Å; L233-L316 HydrophobicContact CD2-CD1 4.19Å; L233-L316 HydrophobicContact CD2-CG 4.43Å; V312-L316 VanDerWaalsContact O-CB 3.24Å; V312-L316 WeakPolarHBondContact O-CB 3.39Å; V312-L316 PolarHBondContact O-N 2.86Å; W313-L316 PolarHBondContact O-N 3.26Å
317	Y	95.2	Very high	95.7	Very high	28 Å²	28	37.2 Å²	37.2	11%	0.11	20%	0.201	C	C	.	.	S	Bend	trans	-134.8	68.1	-179.1	-168.3	-173	0	0	0	110.1	V229 A232 L233 S236 W313 D319 A320 F321	V229-Y317 HydrophobicContact CG1-CD1 4.4Å; A232-Y317 HydrophobicContact CB-CD1 4.37Å; A232-Y317 HydrophobicContact CB-CE1 4.02Å; L233-Y317 HydrophobicContact CB-CD1 4.12Å; L233-Y317 HydrophobicContact CB-CE1 4.47Å; L233-Y317 HydrophobicContact CB-CG 4.23Å; L233-Y317 HydrophobicContact CD1-CD2 3.77Å; L233-Y317 HydrophobicContact CD1-CE2 4.01Å; L233-Y317 HydrophobicContact CD1-CG 4.13Å; S236-Y317 WeakPolarHBondContact CB-OH 3.42Å; S236-Y317 PolarHBondContact OG-OH 3.44Å; W313-Y317 PolarHBondContact O-N 3.11Å; Y317-D319 VanDerWaalsContact C-N 3.32Å; Y317-D319 HydrophobicContact CE2-CB 4.43Å; Y317-D319 PolarHBondContact O-N 3.15Å; Y317-A320 HydrophobicContact CD1-CB 3.88Å; Y317-A320 HydrophobicContact CD2-CB 4.14Å; Y317-A320 HydrophobicContact CE1-CB 3.87Å; Y317-A320 HydrophobicContact CE2-CB 4.14Å; Y317-A320 HydrophobicContact CG-CB 4.02Å; Y317-A320 PolarHBondContact O-N 3.42Å; Y317-F321 HydrophobicContact CD1-CE2 4.47Å; Y317-F321 PolarHBondContact O-N 2.74Å
318	S	93.9	Very high	95.6	Very high	23 Å²	23	40.7 Å²	40.7	16%	0.161	22%	0.216	C	C	.	.	H	α-helix	trans	-59.9	-34.8	-173.2	53.6	0	0	0	0	114	M314 A320 F321 L322	M314-S318 WeakPolarHBondContact O-CA 3.24Å; M314-S318 WeakPolarHBondContact O-CB 3.25Å; S318-A320 PolarHBondContact O-N 3.48Å; S318-F321 PolarHBondContact O-N 2.88Å; S318-L322 WeakPolarHBondContact O-CA 3.38Å; S318-L322 WeakPolarHBondContact O-CB 3.43Å; S318-L322 PolarHBondContact O-N 3.37Å
319	D	92.1	Very high	95.6	Very high	117 Å²	117	38.8 Å²	38.8	63%	0.626	21%	0.206	S	C	*	.	H	α-helix	trans	-65	-25.5	178.9	-66.7	-43.8	0	0	0	113.7	Y317 R361	Y317-D319 VanDerWaalsContact C-N 3.32Å; Y317-D319 HydrophobicContact CE2-CB 4.43Å; Y317-D319 PolarHBondContact O-N 3.15Å; D319-R361 IonicContact OD1-CZ 3.91Å; D319-R361 IonicContact OD1-NH1 3.04Å; D319-R361 PolarHBondContact OD1-NH1 2.78Å; D319-R361 IonicContact OD1-NH2 2.72Å; D319-R361 PolarHBondContact OD1-NH2 3.02Å
320	A	93.6	Very high	95.6	Very high	38 Å²	38	38.4 Å²	38.4	31%	0.314	21%	0.205	S	C	.	.	H	α-helix	trans	-94.9	-39.5	174	0	0	0	0	0	113	Y317 S318 N323	Y317-A320 HydrophobicContact CD1-CB 3.88Å; Y317-A320 HydrophobicContact CD2-CB 4.14Å; Y317-A320 HydrophobicContact CE1-CB 3.87Å; Y317-A320 HydrophobicContact CE2-CB 4.14Å; Y317-A320 HydrophobicContact CG-CB 4.02Å; Y317-A320 PolarHBondContact O-N 3.42Å; S318-A320 PolarHBondContact O-N 3.48Å; A320-N323 PolarHBondContact O-ND2 2.97Å
321	F	95.6	Very high	95.6	Very high	6 Å²	6	38.4 Å²	38.4	3%	0.026	21%	0.205	C	C	.	.	H	α-helix	trans	-105.9	-24.2	-169.1	-73.3	-87.9	0	0	0	115.6	M225 V229 M283 W313 M314 Y317 S318 N323 Y326	M225-F321 HydrophobicContact CE-CE1 3.87Å; M225-F321 HydrophobicContact CE-CZ 3.92Å; V229-F321 HydrophobicContact CB-CE2 4.43Å; V229-F321 HydrophobicContact CG1-CD2 4.22Å; V229-F321 HydrophobicContact CG1-CE2 3.94Å; V229-F321 HydrophobicContact CG2-CE1 4.48Å; V229-F321 HydrophobicContact CG2-CE2 3.7Å; V229-F321 HydrophobicContact CG2-CZ 3.68Å; M283-F321 HydrophobicContact SD-CE2 4.45Å; M283-F321 HydrophobicContact SD-CZ 4.06Å; W313-F321 HydrophobicContact CB-CB 4.43Å; W313-F321 HydrophobicContact CB-CD1 4.01Å; W313-F321 HydrophobicContact CB-CD2 4.44Å; W313-F321 HydrophobicContact CB-CE1 4.41Å; W313-F321 HydrophobicContact CB-CG 4.03Å; W313-F321 HydrophobicContact CE3-CE1 4.4Å; M314-F321 HydrophobicContact CG-CB 4.08Å; M314-F321 WeakPolarHBondContact CG-O 3.25Å; Y317-F321 HydrophobicContact CD1-CE2 4.47Å; Y317-F321 PolarHBondContact O-N 2.74Å; S318-F321 PolarHBondContact O-N 2.88Å; F321-N323 VanDerWaalsContact C-N 3.31Å; F321-N323 PolarHBondContact O-N 3.44Å; F321-Y326 HydrophobicContact CB-CD2 4.38Å; F321-Y326 HydrophobicContact CD1-CD1 4.03Å; F321-Y326 HydrophobicContact CD1-CD2 4.02Å; F321-Y326 AromaticContact CD1-CE1 3.7Å; F321-Y326 HydrophobicContact CD1-CE1 3.7Å; F321-Y326 AromaticContact CD1-CE2 3.66Å; F321-Y326 HydrophobicContact CD1-CE2 3.66Å; F321-Y326 HydrophobicContact CD1-CG 4.19Å; F321-Y326 AromaticContact CD1-CZ 3.5Å; F321-Y326 VanDerWaalsContact CD1-CZ 3.5Å; F321-Y326 AromaticContact CE1-CE1 3.78Å; F321-Y326 HydrophobicContact CE1-CE1 3.78Å; F321-Y326 HydrophobicContact CE1-CE2 4.17Å; F321-Y326 AromaticContact CE1-CZ 3.58Å; F321-Y326 HydrophobicContact CG-CE2 4.34Å; F321-Y326 WeakPolarHBondContact O-CB 3.44Å; F321-Y326 WeakPolarHBondContact O-CD2 3.42Å
322	L	95.3	Very high	95.6	Very high	13 Å²	13	44.5 Å²	44.5	7%	0.068	23%	0.225	C	C	.	.			trans	-81.5	76.4	-177	-173.3	61	0	0	0	111.2	M314 S318 L327 L352 L358 R361 L362	M314-L322 HydrophobicContact CB-CD1 4.34Å; S318-L322 WeakPolarHBondContact O-CA 3.38Å; S318-L322 WeakPolarHBondContact O-CB 3.43Å; S318-L322 PolarHBondContact O-N 3.37Å; L322-L327 HydrophobicContact CD1-CD1 4.12Å; L322-L327 HydrophobicContact CD1-CD2 4.08Å; L322-L327 HydrophobicContact CD1-CG 4.33Å; L322-L352 HydrophobicContact CD1-CD1 3.76Å; L322-L352 HydrophobicContact CD1-CD2 4.22Å; L322-L358 HydrophobicContact CD2-CB 3.88Å; L322-L358 HydrophobicContact CD2-CD2 3.82Å; L322-L358 HydrophobicContact CD2-CG 4.28Å; L322-R361 HydrophobicContact CD2-CB 4.18Å; L322-L362 HydrophobicContact CD1-CD2 3.96Å; L322-L362 HydrophobicContact CD1-CG 4.45Å
323	N	93.8	Very high	95.7	Very high	57 Å²	57	42.3 Å²	42.3	31%	0.305	21%	0.212	S	C	.	.	S	Bend	trans	-152.9	165.5	177	61.8	73.4	0	0	0	111.8	A320 F321 S325 Y326 L327	A320-N323 PolarHBondContact O-ND2 2.97Å; F321-N323 VanDerWaalsContact C-N 3.31Å; F321-N323 PolarHBondContact O-N 3.44Å; N323-S325 PolarHBondContact O-N 3.17Å; N323-S325 VanDerWaalsContact OD1-CB 3.31Å; N323-S325 WeakPolarHBondContact OD1-CB 3.35Å; N323-S325 PolarHBondContact OD1-N 3.29Å; N323-S325 VanDerWaalsContact OD1-N 3.14Å; N323-S325 PolarHBondContact OD1-OG 2.97Å; N323-Y326 PolarHBondContact O-N 3.48Å; N323-L327 PolarHBondContact O-N 3.49Å
324	D	93.4	Very high	95.7	Very high	92 Å²	92	42.2 Å²	42.2	49%	0.492	21%	0.212	S	C	.	.	H	α-helix	trans	-53	-29.1	-176.4	-72	1	0	0	0	114.5	Y326 K328	D324-Y326 PolarHBondContact O-N 3.48Å; D324-K328 WeakPolarHBondContact O-CB 3.36Å; D324-K328 WeakPolarHBondContact O-CG 3.43Å; D324-K328 PolarHBondContact O-N 2.95Å
325	S	94.4	Very high	95.8	Very high	58 Å²	58	46.8 Å²	46.8	41%	0.406	23%	0.233	S	C	.	.	H	α-helix	trans	-66.1	-26.4	-178.8	82.8	0	0	0	0	112.8	N323 K328 Y329	N323-S325 PolarHBondContact O-N 3.17Å; N323-S325 VanDerWaalsContact OD1-CB 3.31Å; N323-S325 WeakPolarHBondContact OD1-CB 3.35Å; N323-S325 PolarHBondContact OD1-N 3.29Å; N323-S325 VanDerWaalsContact OD1-N 3.14Å; N323-S325 PolarHBondContact OD1-OG 2.97Å; S325-K328 WeakPolarHBondContact O-CE 3.37Å; S325-Y329 WeakPolarHBondContact O-CE2 3.35Å
326	Y	96.8	Very high	96	Very high	43 Å²	43	42.9 Å²	42.9	17%	0.169	22%	0.217	C	C	.	.	H	α-helix	trans	-102.2	-44.3	174.8	-64.7	-73.8	0	0	0	112.1	F287 I310 F321 N323 D324 K328 Y329	F287-Y326 HydrophobicContact CD2-CE1 4.13Å; F287-Y326 HydrophobicContact CE1-CE1 4.17Å; F287-Y326 AromaticContact CE2-CD1 3.74Å; F287-Y326 HydrophobicContact CE2-CD1 3.74Å; F287-Y326 AromaticContact CE2-CE1 3.57Å; F287-Y326 HydrophobicContact CE2-CE1 3.57Å; F287-Y326 AromaticContact CZ-CD1 3.73Å; F287-Y326 HydrophobicContact CZ-CD1 3.73Å; F287-Y326 AromaticContact CZ-CE1 3.59Å; F287-Y326 HydrophobicContact CZ-CE1 3.59Å; I310-Y326 HydrophobicContact CD1-CD1 4.03Å; F321-Y326 HydrophobicContact CB-CD2 4.38Å; F321-Y326 HydrophobicContact CD1-CD1 4.03Å; F321-Y326 HydrophobicContact CD1-CD2 4.02Å; F321-Y326 AromaticContact CD1-CE1 3.7Å; F321-Y326 HydrophobicContact CD1-CE1 3.7Å; F321-Y326 AromaticContact CD1-CE2 3.66Å; F321-Y326 HydrophobicContact CD1-CE2 3.66Å; F321-Y326 HydrophobicContact CD1-CG 4.19Å; F321-Y326 AromaticContact CD1-CZ 3.5Å; F321-Y326 VanDerWaalsContact CD1-CZ 3.5Å; F321-Y326 AromaticContact CE1-CE1 3.78Å; F321-Y326 HydrophobicContact CE1-CE1 3.78Å; F321-Y326 HydrophobicContact CE1-CE2 4.17Å; F321-Y326 AromaticContact CE1-CZ 3.58Å; F321-Y326 HydrophobicContact CG-CE2 4.34Å; F321-Y326 WeakPolarHBondContact O-CB 3.44Å; F321-Y326 WeakPolarHBondContact O-CD2 3.42Å; N323-Y326 PolarHBondContact O-N 3.48Å; D324-Y326 PolarHBondContact O-N 3.48Å; Y326-K328 PolarHBondContact O-N 2.95Å; Y326-Y329 WeakPolarHBondContact O-CD2 3.41Å; Y326-Y329 PolarHBondContact O-N 3.12Å; Y326-Y329 VanDerWaalsContact O-N 3.14Å
327	L	96.3	Very high	96.2	Very high	1 Å²	1	48.5 Å²	48.5	1%	0.005	24%	0.239	C	C	.	.	H	α-helix	trans	-57.7	-33.2	-178.4	-76.5	167.4	0	0	0	113.3	M314 L322 N323 Y329 V330 G331 L352 L362 F365	M314-L327 HydrophobicContact CE-CD2 4.07Å; M314-L327 HydrophobicContact SD-CD2 3.57Å; M314-L327 VanDerWaalsContact SD-CD2 3.57Å; M314-L327 HydrophobicContact SD-CG 3.82Å; L322-L327 HydrophobicContact CD1-CD1 4.12Å; L322-L327 HydrophobicContact CD1-CD2 4.08Å; L322-L327 HydrophobicContact CD1-CG 4.33Å; N323-L327 PolarHBondContact O-N 3.49Å; L327-Y329 PolarHBondContact O-N 3.16Å; L327-Y329 VanDerWaalsContact O-N 3.14Å; L327-V330 PolarHBondContact O-N 3.44Å; L327-V330 VanDerWaalsContact O-N 3.07Å; L327-G331 PolarHBondContact O-N 2.93Å; L327-L352 HydrophobicContact CD2-CD1 4.27Å; L327-L362 HydrophobicContact CD1-CD2 3.68Å; L327-L362 HydrophobicContact CD2-CD2 3.7Å; L327-L362 HydrophobicContact CG-CD2 4.37Å; L327-F365 HydrophobicContact CB-CD2 3.82Å; L327-F365 HydrophobicContact CB-CE2 4.15Å; L327-F365 HydrophobicContact CD1-CB 4.36Å; L327-F365 HydrophobicContact CD2-CD2 4.5Å; L327-F365 WeakPolarHBondContact O-CE2 3.04Å
328	K	96.8	Very high	96.4	Very high	72 Å²	72	51.9 Å²	51.9	31%	0.313	26%	0.256	S	S	.	.	H	α-helix	trans	-54	-33.2	177.7	72.5	-169.3	-172.5	-166.3	0	113.7	D324 S325 Y326 G331 W332	D324-K328 WeakPolarHBondContact O-CB 3.36Å; D324-K328 WeakPolarHBondContact O-CG 3.43Å; D324-K328 PolarHBondContact O-N 2.95Å; S325-K328 WeakPolarHBondContact O-CE 3.37Å; Y326-K328 PolarHBondContact O-N 2.95Å; K328-G331 PolarHBondContact O-N 3.46Å; K328-W332 HydrophobicContact CB-CH2 4.47Å; K328-W332 HydrophobicContact CB-CZ2 4.26Å; K328-W332 HydrophobicContact CD-CH2 3.79Å; K328-W332 HydrophobicContact CD-CZ2 4.19Å; K328-W332 HydrophobicContact CD-CZ3 4.26Å; K328-W332 HydrophobicContact CG-CE3 4.45Å; K328-W332 HydrophobicContact CG-CH2 3.99Å; K328-W332 HydrophobicContact CG-CZ2 4.28Å; K328-W332 HydrophobicContact CG-CZ3 4.08Å; K328-W332 VanDerWaalsContact O-CD2 3.31Å; K328-W332 VanDerWaalsContact O-CG 3.24Å; K328-W332 PolarHBondContact O-N 3.39Å
329	Y	98.4	Very high	96.6	Very high	25 Å²	25	50.9 Å²	50.9	10%	0.098	25%	0.249	C	C	.	.	H	α-helix	trans	-68.4	-39	-179.9	-62.4	-72.2	0	0	0	111.3	F287 F291 Y295 I310 S325 Y326 L327 W332 T333	F287-Y329 HydrophobicContact CE1-CE2 4.42Å; F287-Y329 HydrophobicContact CZ-CD2 4.42Å; F287-Y329 AromaticContact CZ-CE2 3.7Å; F287-Y329 HydrophobicContact CZ-CE2 3.7Å; F291-Y329 HydrophobicContact CE1-CD1 4.03Å; F291-Y329 AromaticContact CE1-CD2 3.72Å; F291-Y329 HydrophobicContact CE1-CD2 3.72Å; F291-Y329 HydrophobicContact CE1-CE1 4.3Å; F291-Y329 HydrophobicContact CE1-CE2 4.02Å; F291-Y329 AromaticContact CE1-CG 3.73Å; F291-Y329 HydrophobicContact CE1-CG 3.73Å; F291-Y329 HydrophobicContact CZ-CD2 4.2Å; F291-Y329 HydrophobicContact CZ-CG 4.03Å; Y295-Y329 HydrophobicContact CD1-CD1 4.22Å; Y295-Y329 HydrophobicContact CD1-CE1 4.47Å; Y295-Y329 HydrophobicContact CD2-CD1 4.2Å; Y295-Y329 AromaticContact CE1-CD1 3.85Å; Y295-Y329 HydrophobicContact CE1-CD1 3.85Å; Y295-Y329 AromaticContact CE1-CE1 3.89Å; Y295-Y329 HydrophobicContact CE1-CE1 3.89Å; Y295-Y329 AromaticContact CE2-CD1 3.85Å; Y295-Y329 HydrophobicContact CE2-CD1 3.85Å; Y295-Y329 HydrophobicContact CG-CD1 4.38Å; Y295-Y329 AromaticContact CZ-CD1 3.66Å; Y295-Y329 AromaticContact CZ-CE1 3.97Å; I310-Y329 HydrophobicContact CD1-CD2 4.04Å; S325-Y329 WeakPolarHBondContact O-CE2 3.35Å; Y326-Y329 WeakPolarHBondContact O-CD2 3.41Å; Y326-Y329 PolarHBondContact O-N 3.12Å; Y326-Y329 VanDerWaalsContact O-N 3.14Å; L327-Y329 PolarHBondContact O-N 3.16Å; L327-Y329 VanDerWaalsContact O-N 3.14Å; Y329-W332 HydrophobicContact CD1-CE3 4.03Å; Y329-W332 AromaticContact CD1-CZ3 3.87Å; Y329-W332 HydrophobicContact CD1-CZ3 3.87Å; Y329-W332 HydrophobicContact CE1-CE3 4.47Å; Y329-W332 AromaticContact CE1-CZ3 3.86Å; Y329-W332 HydrophobicContact CE1-CZ3 3.86Å; Y329-T333 WeakPolarHBondContact O-CB 3.45Å; Y329-T333 PolarHBondContact O-N 3.24Å; Y329-T333 PolarHBondContact O-OG1 2.94Å
330	V	98.3	Very high	96.8	Very high	0 Å²	0	49.4 Å²	49.4	0%	0	24%	0.238	C	C	.	.	H	α-helix	trans	-68.4	-43.1	171.9	-176.1	0	0	0	0	110.5	I310 M314 L327 W332 T333 M334 C345 L349	I310-V330 HydrophobicContact CG2-CG2 4.2Å; M314-V330 HydrophobicContact CE-CG2 3.95Å; L327-V330 PolarHBondContact O-N 3.44Å; L327-V330 VanDerWaalsContact O-N 3.07Å; V330-W332 PolarHBondContact O-N 3.26Å; V330-T333 PolarHBondContact O-N 3.46Å; V330-T333 VanDerWaalsContact O-N 3.16Å; V330-M334 PolarHBondContact O-N 3.28Å; V330-C345 HydrophobicContact CG1-CB 3.83Å; V330-L349 HydrophobicContact CG1-CD1 4.17Å; V330-L349 HydrophobicContact CG1-CD2 4.22Å; V330-L349 HydrophobicContact CG1-CG 3.99Å
331	G	97.3	Very high	97	Very high	0 Å²	0	47.6 Å²	47.6	0%	0	22%	0.224	C	C	.	.	H	α-helix	trans	-54.8	-48.8	176.5	0	0	0	0	0	113.8	L327 K328 H335 F369	L327-G331 PolarHBondContact O-N 2.93Å; K328-G331 PolarHBondContact O-N 3.46Å; G331-H335 PolarHBondContact O-CE1 3.32Å; G331-H335 PolarHBondContact O-ND1 2.94Å; G331-F369 WeakPolarHBondContact O-CE1 3.19Å
332	W	98.1	Very high	97.2	Very high	134 Å²	134	47.9 Å²	47.9	51%	0.508	23%	0.225	S	C	.	.	H	α-helix	trans	-64.9	-45.6	173.8	-61.4	-31.1	0	0	0	111.6	K328 Y329 V330 M334 H335	K328-W332 HydrophobicContact CB-CH2 4.47Å; K328-W332 HydrophobicContact CB-CZ2 4.26Å; K328-W332 HydrophobicContact CD-CH2 3.79Å; K328-W332 HydrophobicContact CD-CZ2 4.19Å; K328-W332 HydrophobicContact CD-CZ3 4.26Å; K328-W332 HydrophobicContact CG-CE3 4.45Å; K328-W332 HydrophobicContact CG-CH2 3.99Å; K328-W332 HydrophobicContact CG-CZ2 4.28Å; K328-W332 HydrophobicContact CG-CZ3 4.08Å; K328-W332 VanDerWaalsContact O-CD2 3.31Å; K328-W332 VanDerWaalsContact O-CG 3.24Å; K328-W332 PolarHBondContact O-N 3.39Å; Y329-W332 HydrophobicContact CD1-CE3 4.03Å; Y329-W332 AromaticContact CD1-CZ3 3.87Å; Y329-W332 HydrophobicContact CD1-CZ3 3.87Å; Y329-W332 HydrophobicContact CE1-CE3 4.47Å; Y329-W332 AromaticContact CE1-CZ3 3.86Å; Y329-W332 HydrophobicContact CE1-CZ3 3.86Å; V330-W332 PolarHBondContact O-N 3.26Å; W332-M334 VanDerWaalsContact C-N 3.28Å; W332-M334 PolarHBondContact O-N 2.9Å; W332-H335 WeakPolarHBondContact O-CB 3.33Å; W332-H335 PolarHBondContact O-N 3.01Å; W332-H335 PolarHBondContact O-ND1 3.29Å
333	T	98.4	Very high	97.3	Very high	10 Å²	10	49.6 Å²	49.6	6%	0.061	23%	0.234	C	C	.	.	H	α-helix	trans	-75.6	-11.6	-169.3	-50.5	0	0	0	0	113.9	I307 Y329 V330 H335 D336 V341	I307-T333 HydrophobicContact CD1-CG2 3.82Å; I307-T333 HydrophobicContact CG1-CG2 3.71Å; Y329-T333 WeakPolarHBondContact O-CB 3.45Å; Y329-T333 PolarHBondContact O-N 3.24Å; Y329-T333 PolarHBondContact O-OG1 2.94Å; V330-T333 PolarHBondContact O-N 3.46Å; V330-T333 VanDerWaalsContact O-N 3.16Å; T333-H335 PolarHBondContact O-N 3.31Å; T333-D336 HydrophobicContact CG2-CB 4.4Å; T333-D336 WeakPolarHBondContact O-CB 3.21Å; T333-D336 PolarHBondContact O-N 2.93Å; T333-V341 HydrophobicContact CG2-CG1 3.31Å
334	M	98.4	Very high	97.6	Very high	0 Å²	0	49.5 Å²	49.5	0%	0	23%	0.23	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.1	-10.9	162.4	-74.6	-168.6	-68.4	0	0	114.2	V330 W332 C345 L346 L349 F365 F369 R372 I373 M376	V330-M334 PolarHBondContact O-N 3.28Å; W332-M334 VanDerWaalsContact C-N 3.28Å; W332-M334 PolarHBondContact O-N 2.9Å; M334-C345 HydrophobicContact CG-CB 3.56Å; M334-L346 HydrophobicContact SD-CD2 4.42Å; M334-L349 HydrophobicContact CE-CD1 4.21Å; M334-L349 HydrophobicContact SD-CD1 3.8Å; M334-F365 HydrophobicContact CE-CE1 4.26Å; M334-F365 HydrophobicContact CE-CZ 3.87Å; M334-F369 HydrophobicContact CE-CB 3.83Å; M334-F369 HydrophobicContact CE-CD1 4.23Å; M334-F369 HydrophobicContact CE-CG 4.03Å; M334-R372 HydrophobicContact CB-CG 4.33Å; M334-R372 PolarHBondContact O-NE 3.26Å; M334-R372 VanDerWaalsContact O-NE 3.09Å; M334-R372 PolarHBondContact O-NH2 3.03Å; M334-I373 HydrophobicContact CE-CG1 4.3Å; M334-I373 HydrophobicContact SD-CG1 3.95Å; M334-M376 HydrophobicContact CB-SD 4.11Å; M334-M376 HydrophobicContact CG-SD 4.42Å; M334-M376 HydrophobicContact SD-SD 4.41Å
335	H	98.3	Very high	97.8	Very high	95 Å²	95	45.1 Å²	45.1	44%	0.44	21%	0.207	S	C	.	.	T	Hydrogen-bonded Turn	trans	-99.4	7.4	176.3	-53.4	81	0	0	0	113.4	G331 W332 T333 R372	G331-H335 PolarHBondContact O-CE1 3.32Å; G331-H335 PolarHBondContact O-ND1 2.94Å; W332-H335 WeakPolarHBondContact O-CB 3.33Å; W332-H335 PolarHBondContact O-N 3.01Å; W332-H335 PolarHBondContact O-ND1 3.29Å; T333-H335 PolarHBondContact O-N 3.31Å; H335-R372 WeakPolarHBondContact NE2-CD 3.45Å
336	D	98.6	Very high	98	Very high	28 Å²	28	42.3 Å²	42.3	15%	0.15	19%	0.187	C	C	.	.			trans	-59.1	147.8	177.4	-159.4	-69.5	0	0	0	112.3	R303 T333 Q338 V341 R342	R303-D336 IonicContact CZ-OD1 2.65Å; R303-D336 IonicContact CZ-OD2 2.71Å; R303-D336 VanDerWaalsContact CZ-OD2 3.27Å; R303-D336 IonicContact NE-OD1 3.75Å; R303-D336 IonicContact NE-OD2 2.96Å; R303-D336 PolarHBondContact NE-OD2 2.65Å; R303-D336 VanDerWaalsContact NH2-CG 3.33Å; R303-D336 IonicContact NH2-OD1 2.73Å; R303-D336 PolarHBondContact NH2-OD1 3.18Å; R303-D336 IonicContact NH2-OD2 3.94Å; R303-D336 PolarHBondContact NH2-OD2 3.43Å; T333-D336 HydrophobicContact CG2-CB 4.4Å; T333-D336 WeakPolarHBondContact O-CB 3.21Å; T333-D336 PolarHBondContact O-N 2.93Å; D336-Q338 PolarHBondContact OD1-N 3.37Å; D336-V341 HydrophobicContact CB-CB 3.96Å; D336-V341 HydrophobicContact CB-CG1 3.76Å; D336-R342 HydrophobicContact CB-CG 4.24Å; D336-R342 VanDerWaalsContact O-CD 3.26Å; D336-R342 WeakPolarHBondContact O-CD 3.36Å; D336-R342 WeakPolarHBondContact O-CG 3.3Å; D336-R342 PolarHBondContact O-NH1 3.17Å
337	K	97.7	Very high	98	Very high	178 Å²	178	42.8 Å²	42.8	77%	0.774	20%	0.195	S	C	*	.	S	Bend	trans	-75	-24.2	179.8	-53.2	-51.2	-177	-169.8	0	112.8	R342	K337-R342 PolarHBondContact O-NH1 3.43Å
338	Q	98.3	Very high	98	Very high	100 Å²	100	43.2 Å²	43.2	47%	0.467	20%	0.199	S	C	.	.	S	Bend	trans	-99.6	128	-179.7	-54.1	-57.9	-19	0	0	111.7	A300 D336 E340 V341 R342	A300-Q338 HydrophobicContact CB-CB 3.95Å; A300-Q338 HydrophobicContact CB-CG 3.8Å; D336-Q338 PolarHBondContact OD1-N 3.37Å; Q338-E340 PolarHBondContact O-N 2.86Å; Q338-V341 HydrophobicContact CB-CG2 4.39Å; Q338-V341 WeakPolarHBondContact O-CB 3.44Å; Q338-V341 PolarHBondContact O-N 3.34Å; Q338-R342 PolarHBondContact O-N 2.82Å; Q338-R342 PolarHBondContact O-NH1 3.44Å
339	G	97.8	Very high	97.9	Very high	1 Å²	1	39.8 Å²	39.8	1%	0.01	18%	0.184	C	C	.	.	H	α-helix	trans	-72.3	-23.6	-173.6	0	0	0	0	0	114.5	V341 R342 L343 E381 V384	G339-V341 PolarHBondContact O-N 3.2Å; G339-R342 VanDerWaalsContact CA-CZ 3.45Å; G339-R342 PolarHBondContact O-N 2.94Å; G339-L343 WeakPolarHBondContact O-CB 3.33Å; G339-L343 PolarHBondContact O-N 3.08Å; G339-E381 VanDerWaalsContact CA-CD 3.41Å; G339-E381 WeakPolarHBondContact CA-OE1 3.36Å; G339-E381 WeakPolarHBondContact CA-OE2 3.5Å; G339-E381 PolarHBondContact N-OE1 2.88Å; G339-E381 PolarHBondContact N-OE2 2.85Å; G339-V384 WeakPolarHBondContact O-CG2 3.44Å
340	E	97.4	Very high	97.8	Very high	86 Å²	86	40.2 Å²	40.2	40%	0.402	19%	0.186	S	C	.	.	H	α-helix	trans	-56.2	-36.1	170.8	72.5	171.6	146.2	0	0	111.7	A300 E301 Q338 K344	A300-E340 HydrophobicContact CB-CG 4.35Å; A300-E340 WeakPolarHBondContact CB-OE1 3.23Å; E301-E340 PolarHBondContact N-OE1 3.34Å; Q338-E340 PolarHBondContact O-N 2.86Å; E340-K344 WeakPolarHBondContact O-CG 3.33Å; E340-K344 PolarHBondContact O-N 3.42Å
341	V	98.7	Very high	97.5	Very high	0 Å²	0	41.1 Å²	41.1	0%	0	20%	0.196	C	C	.	.	H	α-helix	trans	-76.6	-43.3	179.7	-179	0	0	0	0	110.4	A300 R303 A304 T333 D336 Q338 G339 L343 K344 C345	A300-V341 HydrophobicContact CB-CG2 3.97Å; A300-V341 WeakPolarHBondContact O-CG2 3.5Å; R303-V341 HydrophobicContact CB-CG1 4.24Å; R303-V341 HydrophobicContact CB-CG2 4.12Å; A304-V341 HydrophobicContact CB-CG2 4.24Å; T333-V341 HydrophobicContact CG2-CG1 3.31Å; D336-V341 HydrophobicContact CB-CB 3.96Å; D336-V341 HydrophobicContact CB-CG1 3.76Å; Q338-V341 HydrophobicContact CB-CG2 4.39Å; Q338-V341 WeakPolarHBondContact O-CB 3.44Å; Q338-V341 PolarHBondContact O-N 3.34Å; G339-V341 PolarHBondContact O-N 3.2Å; V341-L343 VanDerWaalsContact C-N 3.3Å; V341-L343 PolarHBondContact O-N 3.09Å; V341-K344 PolarHBondContact O-N 2.74Å; V341-C345 PolarHBondContact O-N 2.96Å; V341-C345 VanDerWaalsContact O-N 3.14Å; V341-C345 PolarHBondContact O-SG 3Å
342	R	98.7	Very high	97.2	Very high	13 Å²	13	41.1 Å²	41.1	5%	0.049	20%	0.196	C	C	.	.	H	α-helix	trans	-61.4	-38.7	174.2	-63.4	-163.9	-62.5	-70	-6.4	111.9	D336 K337 Q338 G339 C345 L346 M376 D379 E381 V384	D336-R342 HydrophobicContact CB-CG 4.24Å; D336-R342 VanDerWaalsContact O-CD 3.26Å; D336-R342 WeakPolarHBondContact O-CD 3.36Å; D336-R342 WeakPolarHBondContact O-CG 3.3Å; D336-R342 PolarHBondContact O-NH1 3.17Å; K337-R342 PolarHBondContact O-NH1 3.43Å; Q338-R342 PolarHBondContact O-N 2.82Å; Q338-R342 PolarHBondContact O-NH1 3.44Å; G339-R342 VanDerWaalsContact CA-CZ 3.45Å; G339-R342 PolarHBondContact O-N 2.94Å; R342-C345 WeakPolarHBondContact O-CB 3.45Å; R342-C345 PolarHBondContact O-N 3.36Å; R342-L346 PolarHBondContact O-N 3.25Å; R342-L346 VanDerWaalsContact O-N 3.13Å; R342-M376 HydrophobicContact CB-CE 3.78Å; R342-M376 HydrophobicContact CG-CE 4.33Å; R342-D379 IonicContact CZ-OD1 3.23Å; R342-D379 IonicContact CZ-OD2 3.28Å; R342-D379 IonicContact NE-OD1 3.7Å; R342-D379 IonicContact NE-OD2 2.8Å; R342-D379 PolarHBondContact NE-OD2 2.98Å; R342-D379 IonicContact NH2-OD1 2.64Å; R342-D379 PolarHBondContact NH2-OD1 2.98Å; R342-D379 IonicContact NH2-OD2 3.62Å; R342-D379 PolarHBondContact NH2-OD2 2.93Å; R342-E381 IonicContact CZ-OE1 2.9Å; R342-E381 IonicContact NH1-OE1 2.68Å; R342-E381 IonicContact NH2-OE1 3.57Å; R342-E381 PolarHBondContact NH2-OE1 3.36Å; R342-V384 HydrophobicContact CB-CG1 3.9Å; R342-V384 HydrophobicContact CB-CG2 4.38Å
343	L	98.4	Very high	96.8	Very high	49 Å²	49	35.3 Å²	35.3	26%	0.257	17%	0.174	S	C	.	.	H	α-helix	trans	-60.9	-47.4	175.9	-171.8	73.5	0	0	0	110.9	G339 V341 C345 L346 T347 D383 V384 Q387	G339-L343 WeakPolarHBondContact O-CB 3.33Å; G339-L343 PolarHBondContact O-N 3.08Å; V341-L343 VanDerWaalsContact C-N 3.3Å; V341-L343 PolarHBondContact O-N 3.09Å; L343-C345 VanDerWaalsContact C-N 3.33Å; L343-C345 PolarHBondContact O-N 2.69Å; L343-L346 PolarHBondContact O-N 3.48Å; L343-T347 WeakPolarHBondContact O-CG2 3.38Å; L343-T347 PolarHBondContact O-N 3.39Å; L343-T347 PolarHBondContact O-OG1 2.73Å; L343-D383 HydrophobicContact CD1-CB 4.25Å; L343-D383 WeakPolarHBondContact CD1-O 3.29Å; L343-V384 HydrophobicContact CB-CG2 4.32Å; L343-Q387 HydrophobicContact CD1-CB 4.2Å; L343-Q387 HydrophobicContact CD1-CG 3.43Å; L343-Q387 VanDerWaalsContact CD1-CG 3.43Å
344	K	98.3	Very high	96	Very high	54 Å²	54	44.1 Å²	44.1	24%	0.235	21%	0.208	C	C	.	.	H	α-helix	trans	-58.7	-43.6	175	-68.6	-52.3	-169.7	179.9	0	112	A304 I307 E308 E340 V341 L346 T347 A348	A304-K344 HydrophobicContact CB-CG 3.93Å; I307-K344 HydrophobicContact CB-CB 4.32Å; I307-K344 HydrophobicContact CG2-CB 3.82Å; E308-K344 HydrophobicContact CB-CD 4.11Å; E308-K344 HydrophobicContact CB-CG 4.45Å; E308-K344 HydrophobicContact CG-CD 4.43Å; E308-K344 IonicContact OE1-NZ 3.13Å; E308-K344 PolarHBondContact OE1-NZ 3.19Å; E308-K344 WeakPolarHBondContact OE2-CE 3.45Å; E308-K344 IonicContact OE2-NZ 3.02Å; E308-K344 PolarHBondContact OE2-NZ 2.75Å; E340-K344 WeakPolarHBondContact O-CG 3.33Å; E340-K344 PolarHBondContact O-N 3.42Å; V341-K344 PolarHBondContact O-N 2.74Å; K344-L346 VanDerWaalsContact C-N 3.35Å; K344-L346 PolarHBondContact O-N 3.01Å; K344-T347 WeakPolarHBondContact CA-OG1 3.49Å; K344-T347 PolarHBondContact O-N 3.42Å; K344-T347 PolarHBondContact O-OG1 3.14Å; K344-A348 WeakPolarHBondContact O-CB 3.49Å; K344-A348 PolarHBondContact O-N 2.92Å
345	C	98.6	Very high	95	Very high	0 Å²	0	46.2 Å²	46.2	0%	0	22%	0.222	C	C	.	.	H	α-helix	trans	-55.2	-48.7	176.1	-61.9	0	0	0	0	112	I307 V330 M334 V341 R342 L343 A348 L349	I307-C345 HydrophobicContact CG2-CB 4.33Å; V330-C345 HydrophobicContact CG1-CB 3.83Å; M334-C345 HydrophobicContact CG-CB 3.56Å; V341-C345 PolarHBondContact O-N 2.96Å; V341-C345 VanDerWaalsContact O-N 3.14Å; V341-C345 PolarHBondContact O-SG 3Å; R342-C345 WeakPolarHBondContact O-CB 3.45Å; R342-C345 PolarHBondContact O-N 3.36Å; L343-C345 VanDerWaalsContact C-N 3.33Å; L343-C345 PolarHBondContact O-N 2.69Å; C345-A348 PolarHBondContact O-N 2.96Å; C345-L349 WeakPolarHBondContact O-CG 3.23Å; C345-L349 PolarHBondContact O-N 3.06Å; C345-L349 VanDerWaalsContact O-N 3.14Å
346	L	98.3	Very high	93.9	Very high	0 Å²	0	51.2 Å²	51.2	0%	0	24%	0.238	C	C	.	.	H	α-helix	trans	-65.1	-46	179.7	-66.4	172.5	0	0	0	112	M334 R342 L343 K344 A348 L349 Q350 M376 V384 Q387 A388 L391	M334-L346 HydrophobicContact SD-CD2 4.42Å; R342-L346 PolarHBondContact O-N 3.25Å; R342-L346 VanDerWaalsContact O-N 3.13Å; L343-L346 PolarHBondContact O-N 3.48Å; K344-L346 VanDerWaalsContact C-N 3.35Å; K344-L346 PolarHBondContact O-N 3.01Å; L346-A348 VanDerWaalsContact C-N 3.3Å; L346-A348 PolarHBondContact O-N 3.41Å; L346-L349 PolarHBondContact O-N 3.36Å; L346-Q350 WeakPolarHBondContact O-CG 3.29Å; L346-Q350 PolarHBondContact O-N 3.15Å; L346-M376 HydrophobicContact CD1-CE 3.77Å; L346-M376 HydrophobicContact CD2-CE 4.14Å; L346-M376 HydrophobicContact CD2-SD 4.49Å; L346-M376 HydrophobicContact CG-CE 3.94Å; L346-V384 HydrophobicContact CD1-CG1 3.74Å; L346-V384 VanDerWaalsContact CD1-O 3.22Å; L346-V384 WeakPolarHBondContact CD1-O 3.35Å; L346-Q387 HydrophobicContact CB-CB 3.92Å; L346-Q387 HydrophobicContact CD1-CB 3.85Å; L346-A388 HydrophobicContact CD1-CB 4.03Å; L346-A388 HydrophobicContact CD2-CB 4.46Å; L346-L391 HydrophobicContact CD2-CD2 3.6Å
347	T	96.8	Very high	93	Very high	52 Å²	52	57.4 Å²	57.4	32%	0.319	27%	0.265	S	S	.	.	H	α-helix	trans	-65.4	-32.6	179.1	56.2	0	0	0	0	113	L343 K344 G351 Q387	L343-T347 WeakPolarHBondContact O-CG2 3.38Å; L343-T347 PolarHBondContact O-N 3.39Å; L343-T347 PolarHBondContact O-OG1 2.73Å; K344-T347 WeakPolarHBondContact CA-OG1 3.49Å; K344-T347 PolarHBondContact O-N 3.42Å; K344-T347 PolarHBondContact O-OG1 3.14Å; T347-G351 PolarHBondContact O-N 2.65Å; T347-Q387 HydrophobicContact CG2-CG 4.28Å
348	A	95.9	Very high	92.2	Very high	11 Å²	11	49.9 Å²	49.9	9%	0.091	23%	0.234	C	C	.	.	H	α-helix	trans	-63.1	-47.6	172.3	0	0	0	0	0	111.1	K344 C345 L346 G351 L352	K344-A348 WeakPolarHBondContact O-CB 3.49Å; K344-A348 PolarHBondContact O-N 2.92Å; C345-A348 PolarHBondContact O-N 2.96Å; L346-A348 VanDerWaalsContact C-N 3.3Å; L346-A348 PolarHBondContact O-N 3.41Å; A348-G351 PolarHBondContact O-N 3.19Å; A348-L352 PolarHBondContact O-N 3.01Å
349	L	96.3	Very high	91.4	Very high	0 Å²	0	45.3 Å²	45.3	0%	0	21%	0.213	C	C	.	.	H	α-helix	trans	-63.8	-46.7	177.6	-67.1	171.2	0	0	0	112.1	V330 M334 C345 L346 G351 L352 F353 F365 L391	V330-L349 HydrophobicContact CG1-CD1 4.17Å; V330-L349 HydrophobicContact CG1-CD2 4.22Å; V330-L349 HydrophobicContact CG1-CG 3.99Å; M334-L349 HydrophobicContact CE-CD1 4.21Å; M334-L349 HydrophobicContact SD-CD1 3.8Å; C345-L349 WeakPolarHBondContact O-CG 3.23Å; C345-L349 PolarHBondContact O-N 3.06Å; C345-L349 VanDerWaalsContact O-N 3.14Å; L346-L349 PolarHBondContact O-N 3.36Å; L349-G351 PolarHBondContact O-N 3.38Å; L349-L352 WeakPolarHBondContact O-CB 3.36Å; L349-L352 PolarHBondContact O-N 2.87Å; L349-F353 VanDerWaalsContact O-CD2 3.3Å; L349-F353 WeakPolarHBondContact O-CD2 3.4Å; L349-F353 PolarHBondContact O-N 3.18Å; L349-F353 VanDerWaalsContact O-N 3.11Å; L349-F365 HydrophobicContact CD1-CE1 3.8Å; L349-F365 HydrophobicContact CD1-CZ 4.17Å; L349-F365 HydrophobicContact CD2-CD1 4.2Å; L349-F365 HydrophobicContact CD2-CE1 3.51Å; L349-F365 HydrophobicContact CD2-CZ 3.92Å; L349-F365 HydrophobicContact CG-CE1 4.33Å; L349-L391 HydrophobicContact CB-CD1 3.88Å; L349-L391 HydrophobicContact CB-CD2 3.85Å; L349-L391 HydrophobicContact CD1-CD2 3.86Å
350	Q	94.9	Very high	90.6	Very high	33 Å²	33	48.3 Å²	48.3	15%	0.154	23%	0.234	C	C	.	.	H	α-helix	trans	-53.8	-39.2	173.7	-70.6	174.8	-1.3	0	0	111.7	L346 L352 F353 Y354 Q387 L391 L394	L346-Q350 WeakPolarHBondContact O-CG 3.29Å; L346-Q350 PolarHBondContact O-N 3.15Å; Q350-L352 PolarHBondContact O-N 3.21Å; Q350-F353 PolarHBondContact O-N 2.96Å; Q350-Y354 PolarHBondContact O-N 3.18Å; Q350-Q387 PolarHBondContact NE2-O 3.41Å; Q350-L391 HydrophobicContact CG-CB 4.04Å; Q350-L391 HydrophobicContact CG-CD1 4.02Å; Q350-L394 HydrophobicContact CB-CD1 3.87Å; Q350-L394 HydrophobicContact CG-CD1 4.02Å
351	G	91.5	Very high	90.1	Very high	20 Å²	20	50.1 Å²	50.1	21%	0.206	24%	0.237	C	C	.	.	H	α-helix	trans	-58	-28.4	176.6	0	0	0	0	0	114	K315 T347 A348 L349	K315-G351 VanDerWaalsContact CD-O 3.3Å; K315-G351 WeakPolarHBondContact CD-O 3.23Å; K315-G351 VanDerWaalsContact CE-O 3.27Å; K315-G351 WeakPolarHBondContact CE-O 3.31Å; K315-G351 PolarHBondContact NZ-O 2.96Å; T347-G351 PolarHBondContact O-N 2.65Å; A348-G351 PolarHBondContact O-N 3.19Å; L349-G351 PolarHBondContact O-N 3.38Å
352	L	92.4	Very high	89.6	Confident	0 Å²	0	50.1 Å²	50.1	0%	0	24%	0.237	C	C	.	.	H	α-helix	trans	-87.9	-48.3	178.5	-56.7	169.7	0	0	0	111.7	M314 K315 L322 L327 A348 L349 Q350 Y354 S355 L362	M314-L352 HydrophobicContact CB-CD1 4.4Å; M314-L352 HydrophobicContact CB-CD2 3.93Å; M314-L352 HydrophobicContact CE-CD1 4.32Å; K315-L352 HydrophobicContact CB-CD2 3.93Å; L322-L352 HydrophobicContact CD1-CD1 3.76Å; L322-L352 HydrophobicContact CD1-CD2 4.22Å; L327-L352 HydrophobicContact CD2-CD1 4.27Å; A348-L352 PolarHBondContact O-N 3.01Å; L349-L352 WeakPolarHBondContact O-CB 3.36Å; L349-L352 PolarHBondContact O-N 2.87Å; Q350-L352 PolarHBondContact O-N 3.21Å; L352-Y354 PolarHBondContact O-N 2.95Å; L352-Y354 VanDerWaalsContact O-N 3.1Å; L352-S355 PolarHBondContact O-N 2.78Å; L352-S355 VanDerWaalsContact O-N 3.11Å; L352-L362 HydrophobicContact CB-CD1 3.74Å; L352-L362 HydrophobicContact CD1-CD1 4.23Å; L352-L362 HydrophobicContact CD1-CD2 4.44Å
353	F	89.6	Confident	89.1	Confident	11 Å²	11	54.6 Å²	54.6	5%	0.048	26%	0.258	C	S	.	.	H	α-helix	trans	-62	-18.9	-179.3	-77.4	-77.4	0	0	0	114.6	L349 Q350 S355 L362 T366 L391 L394 I395	L349-F353 VanDerWaalsContact O-CD2 3.3Å; L349-F353 WeakPolarHBondContact O-CD2 3.4Å; L349-F353 PolarHBondContact O-N 3.18Å; L349-F353 VanDerWaalsContact O-N 3.11Å; Q350-F353 PolarHBondContact O-N 2.96Å; F353-S355 PolarHBondContact O-N 3.18Å; F353-S355 VanDerWaalsContact O-N 3.14Å; F353-L362 HydrophobicContact CD1-CD1 4.31Å; F353-L362 HydrophobicContact CD2-CD1 4Å; F353-L362 HydrophobicContact CE1-CB 4.1Å; F353-L362 HydrophobicContact CE1-CD1 4.05Å; F353-L362 HydrophobicContact CE2-CD1 3.73Å; F353-L362 HydrophobicContact CG-CD1 4.28Å; F353-L362 HydrophobicContact CZ-CB 3.9Å; F353-L362 HydrophobicContact CZ-CD1 3.75Å; F353-L362 HydrophobicContact CZ-CG 4.46Å; F353-T366 HydrophobicContact CZ-CG2 4.32Å; F353-T366 WeakPolarHBondContact CZ-OG1 3.4Å; F353-L391 HydrophobicContact CD2-CD1 3.48Å; F353-L391 VanDerWaalsContact CD2-CD1 3.48Å; F353-L391 HydrophobicContact CE2-CD1 3.8Å; F353-L391 HydrophobicContact CG-CD1 4.44Å; F353-L394 HydrophobicContact CB-CB 3.86Å; F353-L394 HydrophobicContact CB-CD1 4.32Å; F353-I395 HydrophobicContact CD1-CG1 4.27Å; F353-I395 HydrophobicContact CD2-CG1 4.44Å; F353-I395 HydrophobicContact CE1-CG1 3.83Å; F353-I395 HydrophobicContact CE2-CD1 4.45Å; F353-I395 HydrophobicContact CE2-CG1 4.01Å; F353-I395 HydrophobicContact CZ-CD1 4.32Å; F353-I395 HydrophobicContact CZ-CG1 3.68Å
354	Y	80.9	Confident	88.7	Confident	196 Å²	196	57.8 Å²	57.8	77%	0.769	28%	0.275	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.5	-19.4	174.1	-157.1	-87.5	0	0	0	113.2	Q350 L352	Q350-Y354 PolarHBondContact O-N 3.18Å; L352-Y354 PolarHBondContact O-N 2.95Å; L352-Y354 VanDerWaalsContact O-N 3.1Å
355	S	78.7	Confident	88.5	Confident	43 Å²	43	55.6 Å²	55.6	30%	0.301	27%	0.266	S	S	.	.	S	Bend	trans	-104.1	123.3	167.3	179	0	0	0	0	111.1	L352 F353 E357 L358 G359	L352-S355 PolarHBondContact O-N 2.78Å; L352-S355 VanDerWaalsContact O-N 3.11Å; F353-S355 PolarHBondContact O-N 3.18Å; F353-S355 VanDerWaalsContact O-N 3.14Å; S355-E357 PolarHBondContact O-N 2.92Å; S355-E357 PolarHBondContact OG-N 3.18Å; S355-L358 PolarHBondContact O-N 3.24Å; S355-L358 VanDerWaalsContact O-N 3.1Å; S355-G359 PolarHBondContact O-N 2.96Å
356	R	74.5	Confident	88.1	Confident	201 Å²	201	55.8 Å²	55.8	76%	0.758	27%	0.267	S	S	*	.	H	α-helix	trans	-58.8	-32.9	175.8	-76.4	-175.9	160.8	-171.5	-9.2	113.1	L358 G359 Q397	R356-L358 VanDerWaalsContact C-N 3.31Å; R356-L358 PolarHBondContact O-N 2.99Å; R356-G359 PolarHBondContact O-N 3.48Å; R356-Q397 PolarHBondContact NH2-O 3.5Å
357	E	79.6	Confident	87.8	Confident	157 Å²	157	59.4 Å²	59.4	73%	0.734	29%	0.292	S	S	*	.	H	α-helix	trans	-73.2	-22.5	179.1	-61.1	-179.7	169	0	0	113.2	S355	S355-E357 PolarHBondContact O-N 2.92Å; S355-E357 PolarHBondContact OG-N 3.18Å
358	L	80.8	Confident	87.7	Confident	21 Å²	21	66.2 Å²	66.2	11%	0.11	31%	0.312	C	S	.	.	H	α-helix	trans	-91	-30.3	173.7	-56	-175	0	0	0	111.5	L322 S355 R356 S360 R361 L362	L322-L358 HydrophobicContact CD2-CB 3.88Å; L322-L358 HydrophobicContact CD2-CD2 3.82Å; L322-L358 HydrophobicContact CD2-CG 4.28Å; S355-L358 PolarHBondContact O-N 3.24Å; S355-L358 VanDerWaalsContact O-N 3.1Å; R356-L358 VanDerWaalsContact C-N 3.31Å; R356-L358 PolarHBondContact O-N 2.99Å; L358-S360 PolarHBondContact O-N 3.39Å; L358-R361 WeakPolarHBondContact O-CB 3.27Å; L358-R361 PolarHBondContact O-N 2.87Å; L358-L362 PolarHBondContact O-N 2.64Å
359	G	81	Confident	87.7	Confident	3 Å²	3	67 Å²	67	3%	0.031	31%	0.313	C	S	.	.	H	α-helix	trans	-58	-43	177.8	0	0	0	0	0	113.7	S355 R356 R361 L362	S355-G359 PolarHBondContact O-N 2.96Å; R356-G359 PolarHBondContact O-N 3.48Å; G359-R361 VanDerWaalsContact C-N 3.31Å; G359-R361 PolarHBondContact O-N 3.46Å; G359-L362 WeakPolarHBondContact O-CB 3.47Å; G359-L362 PolarHBondContact O-N 3.4Å
360	S	81.9	Confident	87.7	Confident	64 Å²	64	68.2 Å²	68.2	45%	0.448	32%	0.319	S	S	.	.	G	3₁₀ helix	trans	-65.9	-31.6	177	56.6	0	0	0	0	113.2	L358 L362 E363	L358-S360 PolarHBondContact O-N 3.39Å; S360-L362 PolarHBondContact O-N 3.14Å; S360-E363 WeakPolarHBondContact CA-OE1 3.45Å; S360-E363 WeakPolarHBondContact CB-OE1 3.38Å; S360-E363 WeakPolarHBondContact O-CG 3.31Å; S360-E363 PolarHBondContact O-N 2.97Å
361	R	85.4	Confident	87.8	Confident	124 Å²	124	71.8 Å²	71.8	47%	0.468	34%	0.339	S	S	.	.	G	3₁₀ helix	trans	-68.2	-13.1	172.3	-57.5	-170.7	-171.3	-170.6	4.6	113.1	D319 L322 L358 G359	D319-R361 IonicContact OD1-CZ 3.91Å; D319-R361 IonicContact OD1-NH1 3.04Å; D319-R361 PolarHBondContact OD1-NH1 2.78Å; D319-R361 IonicContact OD1-NH2 2.72Å; D319-R361 PolarHBondContact OD1-NH2 3.02Å; L322-R361 HydrophobicContact CD2-CB 4.18Å; L358-R361 WeakPolarHBondContact O-CB 3.27Å; L358-R361 PolarHBondContact O-N 2.87Å; G359-R361 VanDerWaalsContact C-N 3.31Å; G359-R361 PolarHBondContact O-N 3.46Å
362	L	89.8	Confident	88.1	Confident	0 Å²	0	73.4 Å²	73.4	0%	0	34%	0.339	C	S	.	.	G	3₁₀ helix	trans	-96.8	-3.3	179.7	-72.3	170.4	0	0	0	114.1	L322 L327 L352 F353 L358 G359 S360 L364 F365 T366	L322-L362 HydrophobicContact CD1-CD2 3.96Å; L322-L362 HydrophobicContact CD1-CG 4.45Å; L327-L362 HydrophobicContact CD1-CD2 3.68Å; L327-L362 HydrophobicContact CD2-CD2 3.7Å; L327-L362 HydrophobicContact CG-CD2 4.37Å; L352-L362 HydrophobicContact CB-CD1 3.74Å; L352-L362 HydrophobicContact CD1-CD1 4.23Å; L352-L362 HydrophobicContact CD1-CD2 4.44Å; F353-L362 HydrophobicContact CD1-CD1 4.31Å; F353-L362 HydrophobicContact CD2-CD1 4Å; F353-L362 HydrophobicContact CE1-CB 4.1Å; F353-L362 HydrophobicContact CE1-CD1 4.05Å; F353-L362 HydrophobicContact CE2-CD1 3.73Å; F353-L362 HydrophobicContact CG-CD1 4.28Å; F353-L362 HydrophobicContact CZ-CB 3.9Å; F353-L362 HydrophobicContact CZ-CD1 3.75Å; F353-L362 HydrophobicContact CZ-CG 4.46Å; L358-L362 PolarHBondContact O-N 2.64Å; G359-L362 WeakPolarHBondContact O-CB 3.47Å; G359-L362 PolarHBondContact O-N 3.4Å; S360-L362 PolarHBondContact O-N 3.14Å; L362-L364 VanDerWaalsContact C-N 3.32Å; L362-L364 PolarHBondContact O-N 3.32Å; L362-F365 HydrophobicContact CD2-CB 4.36Å; L362-F365 PolarHBondContact O-N 3.07Å; L362-F365 VanDerWaalsContact O-N 3.1Å; L362-T366 WeakPolarHBondContact O-CB 3.38Å; L362-T366 PolarHBondContact O-N 3.02Å; L362-T366 PolarHBondContact O-OG1 2.78Å
363	E	86.6	Confident	88.3	Confident	107 Å²	107	73.5 Å²	73.5	50%	0.5	34%	0.339	S	S	.	.	H	α-helix	trans	-54.4	-42.5	-174.6	-72.4	168.4	-157.6	0	0	113.5	S360 T366 S367	S360-E363 WeakPolarHBondContact CA-OE1 3.45Å; S360-E363 WeakPolarHBondContact CB-OE1 3.38Å; S360-E363 WeakPolarHBondContact O-CG 3.31Å; S360-E363 PolarHBondContact O-N 2.97Å; E363-T366 PolarHBondContact O-N 3.36Å; E363-S367 WeakPolarHBondContact O-CB 3.08Å; E363-S367 PolarHBondContact O-N 3.5Å; E363-S367 PolarHBondContact O-OG 2.76Å
364	L	90.2	Very high	88.7	Confident	116 Å²	116	73.8 Å²	73.8	61%	0.607	34%	0.342	S	S	*	.	H	α-helix	trans	-68.2	-40	177.8	-178.1	61.6	0	0	0	112.9	L362 S367 R368	L362-L364 VanDerWaalsContact C-N 3.32Å; L362-L364 PolarHBondContact O-N 3.32Å; L364-S367 PolarHBondContact O-OG 3.47Å; L364-R368 WeakPolarHBondContact O-CB 3.46Å; L364-R368 PolarHBondContact O-N 3.01Å
365	F	94.1	Very high	89.5	Confident	9 Å²	9	67.1 Å²	67.1	4%	0.039	32%	0.324	C	S	.	.	H	α-helix	trans	-65.7	-43.7	173.9	176.3	-88.6	0	0	0	110.7	L327 M334 L349 L362 R368 F369	L327-F365 HydrophobicContact CB-CD2 3.82Å; L327-F365 HydrophobicContact CB-CE2 4.15Å; L327-F365 HydrophobicContact CD1-CB 4.36Å; L327-F365 HydrophobicContact CD2-CD2 4.5Å; L327-F365 WeakPolarHBondContact O-CE2 3.04Å; M334-F365 HydrophobicContact CE-CE1 4.26Å; M334-F365 HydrophobicContact CE-CZ 3.87Å; L349-F365 HydrophobicContact CD1-CE1 3.8Å; L349-F365 HydrophobicContact CD1-CZ 4.17Å; L349-F365 HydrophobicContact CD2-CD1 4.2Å; L349-F365 HydrophobicContact CD2-CE1 3.51Å; L349-F365 HydrophobicContact CD2-CZ 3.92Å; L349-F365 HydrophobicContact CG-CE1 4.33Å; L362-F365 HydrophobicContact CD2-CB 4.36Å; L362-F365 PolarHBondContact O-N 3.07Å; L362-F365 VanDerWaalsContact O-N 3.1Å; F365-R368 PolarHBondContact O-N 3.06Å; F365-F369 HydrophobicContact CD1-CD2 4.38Å; F365-F369 AromaticContact CD2-CD2 3.65Å; F365-F369 HydrophobicContact CD2-CD2 3.65Å; F365-F369 AromaticContact CD2-CE2 3.82Å; F365-F369 HydrophobicContact CD2-CE2 3.82Å; F365-F369 HydrophobicContact CE1-CB 4.47Å; F365-F369 HydrophobicContact CE1-CD2 4.19Å; F365-F369 AromaticContact CE2-CD2 3.46Å; F365-F369 HydrophobicContact CE2-CD2 3.46Å; F365-F369 VanDerWaalsContact CE2-CD2 3.46Å; F365-F369 AromaticContact CE2-CE2 3.59Å; F365-F369 HydrophobicContact CE2-CE2 3.59Å; F365-F369 HydrophobicContact CE2-CG 4.43Å; F365-F369 HydrophobicContact CG-CD2 4.12Å; F365-F369 AromaticContact CZ-CD2 3.75Å; F365-F369 HydrophobicContact CZ-CD2 3.75Å; F365-F369 HydrophobicContact CZ-CE2 4.27Å; F365-F369 HydrophobicContact CZ-CG 4.34Å; F365-F369 WeakPolarHBondContact O-CD2 3.35Å; F365-F369 PolarHBondContact O-N 3.49Å
366	T	91.9	Very high	90.5	Very high	3 Å²	3	65.1 Å²	65.1	2%	0.018	31%	0.31	C	S	.	.	H	α-helix	trans	-66.3	-53.6	-175.5	-47.2	0	0	0	0	110.3	F353 L362 E363 R368 F369 K370 I395 V402	F353-T366 HydrophobicContact CZ-CG2 4.32Å; F353-T366 WeakPolarHBondContact CZ-OG1 3.4Å; L362-T366 WeakPolarHBondContact O-CB 3.38Å; L362-T366 PolarHBondContact O-N 3.02Å; L362-T366 PolarHBondContact O-OG1 2.78Å; E363-T366 PolarHBondContact O-N 3.36Å; T366-R368 PolarHBondContact O-N 3.13Å; T366-F369 CarbonylContact O-C 3.57Å; T366-F369 PolarHBondContact O-N 3Å; T366-K370 WeakPolarHBondContact O-CA 3.3Å; T366-K370 VanDerWaalsContact O-CB 3.25Å; T366-K370 WeakPolarHBondContact O-CB 3.49Å; T366-K370 PolarHBondContact O-N 3.14Å; T366-I395 HydrophobicContact CG2-CD1 3.81Å; T366-I395 HydrophobicContact CG2-CG1 4.09Å; T366-I395 HydrophobicContact CG2-CG2 4.08Å; T366-V402 HydrophobicContact CG2-CG1 3.8Å
367	S	90.5	Very high	91.6	Very high	76 Å²	76	55.7 Å²	55.7	53%	0.531	27%	0.274	S	S	.	.	H	α-helix	trans	-55.9	-33.3	176	51.7	0	0	0	0	113.1	E363 L364	E363-S367 WeakPolarHBondContact O-CB 3.08Å; E363-S367 PolarHBondContact O-N 3.5Å; E363-S367 PolarHBondContact O-OG 2.76Å; L364-S367 PolarHBondContact O-OG 3.47Å
368	R	94.4	Very high	92.4	Very high	196 Å²	196	53.5 Å²	53.5	74%	0.74	27%	0.267	S	S	*	.	H	α-helix	trans	-73.3	-33.3	175.2	-174.3	178.4	-177.4	98.3	9	114.5	L364 F365 T366	L364-R368 WeakPolarHBondContact O-CB 3.46Å; L364-R368 PolarHBondContact O-N 3.01Å; F365-R368 PolarHBondContact O-N 3.06Å; T366-R368 PolarHBondContact O-N 3.13Å
369	F	96.6	Very high	93.2	Very high	26 Å²	26	53.2 Å²	53.2	11%	0.114	27%	0.266	C	S	.	.	H	α-helix	trans	-114.9	2.3	-172.9	-69.9	-73	0	0	0	114.5	G331 M334 F365 T366 D371 R372 I373	G331-F369 WeakPolarHBondContact O-CE1 3.19Å; M334-F369 HydrophobicContact CE-CB 3.83Å; M334-F369 HydrophobicContact CE-CD1 4.23Å; M334-F369 HydrophobicContact CE-CG 4.03Å; F365-F369 HydrophobicContact CD1-CD2 4.38Å; F365-F369 AromaticContact CD2-CD2 3.65Å; F365-F369 HydrophobicContact CD2-CD2 3.65Å; F365-F369 AromaticContact CD2-CE2 3.82Å; F365-F369 HydrophobicContact CD2-CE2 3.82Å; F365-F369 HydrophobicContact CE1-CB 4.47Å; F365-F369 HydrophobicContact CE1-CD2 4.19Å; F365-F369 AromaticContact CE2-CD2 3.46Å; F365-F369 HydrophobicContact CE2-CD2 3.46Å; F365-F369 VanDerWaalsContact CE2-CD2 3.46Å; F365-F369 AromaticContact CE2-CE2 3.59Å; F365-F369 HydrophobicContact CE2-CE2 3.59Å; F365-F369 HydrophobicContact CE2-CG 4.43Å; F365-F369 HydrophobicContact CG-CD2 4.12Å; F365-F369 AromaticContact CZ-CD2 3.75Å; F365-F369 HydrophobicContact CZ-CD2 3.75Å; F365-F369 HydrophobicContact CZ-CE2 4.27Å; F365-F369 HydrophobicContact CZ-CG 4.34Å; F365-F369 WeakPolarHBondContact O-CD2 3.35Å; F365-F369 PolarHBondContact O-N 3.49Å; T366-F369 CarbonylContact O-C 3.57Å; T366-F369 PolarHBondContact O-N 3Å; F369-D371 PolarHBondContact O-N 3.14Å; F369-R372 WeakPolarHBondContact O-CB 3.33Å; F369-R372 PolarHBondContact O-N 3Å; F369-I373 PolarHBondContact O-N 3.35Å
370	K	95.5	Very high	93.9	Very high	26 Å²	26	62.1 Å²	62.1	11%	0.113	30%	0.304	C	S	.	.	H	α-helix	trans	-51.3	-52.1	-178.4	-176.5	-137.4	62.5	161.5	0	111.8	T366 R372 I373 V374 V402 L403 D407	T366-K370 WeakPolarHBondContact O-CA 3.3Å; T366-K370 VanDerWaalsContact O-CB 3.25Å; T366-K370 WeakPolarHBondContact O-CB 3.49Å; T366-K370 PolarHBondContact O-N 3.14Å; K370-R372 PolarHBondContact O-N 3.44Å; K370-I373 PolarHBondContact O-N 3.06Å; K370-V374 HydrophobicContact CG-CG2 4.41Å; K370-V374 WeakPolarHBondContact O-CG2 3.35Å; K370-V374 PolarHBondContact O-N 3.47Å; K370-V402 WeakPolarHBondContact CD-O 3.4Å; K370-L403 HydrophobicContact CD-CD2 4.27Å; K370-L403 HydrophobicContact CG-CD2 4Å; K370-D407 VanDerWaalsContact CD-OD2 3.29Å; K370-D407 WeakPolarHBondContact CD-OD2 3.37Å; K370-D407 WeakPolarHBondContact CE-OD1 3.49Å; K370-D407 WeakPolarHBondContact CE-OD2 3.23Å; K370-D407 IonicContact NZ-OD1 3.7Å; K370-D407 PolarHBondContact NZ-OD1 3.39Å; K370-D407 IonicContact NZ-OD2 2.6Å; K370-D407 PolarHBondContact NZ-OD2 2.94Å
371	D	96.9	Very high	94.6	Very high	108 Å²	108	62.9 Å²	62.9	58%	0.578	30%	0.3	S	S	*	.	H	α-helix	trans	-57.9	-35.9	180	-54.1	-32.9	0	0	0	112.2	F369 S375	F369-D371 PolarHBondContact O-N 3.14Å; D371-S375 WeakPolarHBondContact O-CB 3.4Å; D371-S375 PolarHBondContact O-N 3.09Å
372	R	97.9	Very high	95.2	Very high	55 Å²	55	60.9 Å²	60.9	21%	0.208	29%	0.293	C	S	.	.	H	α-helix	trans	-68.4	-45.2	174.9	178.2	61.2	-169.3	133.2	3.4	111	M334 H335 F369 K370 V374 S375 M376	M334-R372 HydrophobicContact CB-CG 4.33Å; M334-R372 PolarHBondContact O-NE 3.26Å; M334-R372 VanDerWaalsContact O-NE 3.09Å; M334-R372 PolarHBondContact O-NH2 3.03Å; H335-R372 WeakPolarHBondContact NE2-CD 3.45Å; F369-R372 WeakPolarHBondContact O-CB 3.33Å; F369-R372 PolarHBondContact O-N 3Å; K370-R372 PolarHBondContact O-N 3.44Å; R372-V374 VanDerWaalsContact C-N 3.33Å; R372-V374 PolarHBondContact O-N 3.37Å; R372-S375 PolarHBondContact NH1-OG 3.13Å; R372-S375 PolarHBondContact O-N 3.11Å; R372-S375 PolarHBondContact O-OG 3.23Å; R372-M376 HydrophobicContact CG-SD 4.14Å; R372-M376 VanDerWaalsContact NH1-CG 3.33Å; R372-M376 VanDerWaalsContact O-CG 3.29Å; R372-M376 WeakPolarHBondContact O-CG 3.18Å; R372-M376 PolarHBondContact O-N 2.81Å; R372-M376 VanDerWaalsContact O-N 3.09Å
373	I	98.1	Very high	95.5	Very high	2 Å²	2	66.2 Å²	66.2	1%	0.01	32%	0.322	C	S	.	.	H	α-helix	trans	-62.1	-42.6	178	-61.2	166.6	0	0	0	110.5	M334 F369 K370 M376 L391 L392 I395	M334-I373 HydrophobicContact CE-CG1 4.3Å; M334-I373 HydrophobicContact SD-CG1 3.95Å; F369-I373 PolarHBondContact O-N 3.35Å; K370-I373 PolarHBondContact O-N 3.06Å; I373-M376 WeakPolarHBondContact O-CB 3.42Å; I373-M376 PolarHBondContact O-N 3.48Å; I373-M376 VanDerWaalsContact O-N 3.13Å; I373-L391 HydrophobicContact CD1-CD2 4Å; I373-L391 HydrophobicContact CG1-CD2 4.34Å; I373-L391 HydrophobicContact CG2-CD2 3.96Å; I373-L391 HydrophobicContact CG2-CG 4.31Å; I373-L392 HydrophobicContact CB-CD2 4.47Å; I373-L392 HydrophobicContact CG2-CD2 3.78Å; I373-L392 HydrophobicContact CG2-CG 3.94Å; I373-I395 HydrophobicContact CD1-CD1 4.29Å
374	V	97.8	Very high	96.1	Very high	16 Å²	16	61.1 Å²	61.1	10%	0.097	30%	0.298	C	S	.	.	H	α-helix	trans	-61.6	-45.4	174.1	175.7	0	0	0	0	111	K370 R372 M376 T377 L392 D407 S410	K370-V374 HydrophobicContact CG-CG2 4.41Å; K370-V374 WeakPolarHBondContact O-CG2 3.35Å; K370-V374 PolarHBondContact O-N 3.47Å; R372-V374 VanDerWaalsContact C-N 3.33Å; R372-V374 PolarHBondContact O-N 3.37Å; V374-M376 PolarHBondContact O-N 3.28Å; V374-M376 VanDerWaalsContact O-N 3.12Å; V374-T377 WeakPolarHBondContact O-CB 3.41Å; V374-T377 WeakPolarHBondContact O-CG2 3.06Å; V374-T377 PolarHBondContact O-N 2.92Å; V374-T377 VanDerWaalsContact O-N 3.09Å; V374-T377 PolarHBondContact O-OG1 3.16Å; V374-L392 HydrophobicContact CG2-CD1 4.13Å; V374-L392 HydrophobicContact CG2-CD2 3.85Å; V374-D407 HydrophobicContact CG2-CB 4.16Å; V374-S410 WeakPolarHBondContact CG1-OG 3.48Å
375	S	97.6	Very high	96.5	Very high	57 Å²	57	55.7 Å²	55.7	40%	0.399	27%	0.27	S	S	.	.	H	α-helix	trans	-61.2	-22.7	175.1	77.7	0	0	0	0	114.2	D371 R372 T377 L378	D371-S375 WeakPolarHBondContact O-CB 3.4Å; D371-S375 PolarHBondContact O-N 3.09Å; R372-S375 PolarHBondContact NH1-OG 3.13Å; R372-S375 PolarHBondContact O-N 3.11Å; R372-S375 PolarHBondContact O-OG 3.23Å; S375-T377 VanDerWaalsContact C-N 3.31Å; S375-L378 PolarHBondContact O-N 2.77Å
376	M	98.4	Very high	96.7	Very high	0 Å²	0	55.7 Å²	55.7	0%	0	27%	0.271	C	S	.	.	G	3₁₀ helix	trans	-80.1	-9.5	178.8	-70.3	172.1	72.1	0	0	113.1	M334 R342 L346 R372 I373 V374 L378 D379 V384 A385 A388	M334-M376 HydrophobicContact CB-SD 4.11Å; M334-M376 HydrophobicContact CG-SD 4.42Å; M334-M376 HydrophobicContact SD-SD 4.41Å; R342-M376 HydrophobicContact CB-CE 3.78Å; R342-M376 HydrophobicContact CG-CE 4.33Å; L346-M376 HydrophobicContact CD1-CE 3.77Å; L346-M376 HydrophobicContact CD2-CE 4.14Å; L346-M376 HydrophobicContact CD2-SD 4.49Å; L346-M376 HydrophobicContact CG-CE 3.94Å; R372-M376 HydrophobicContact CG-SD 4.14Å; R372-M376 VanDerWaalsContact NH1-CG 3.33Å; R372-M376 VanDerWaalsContact O-CG 3.29Å; R372-M376 WeakPolarHBondContact O-CG 3.18Å; R372-M376 PolarHBondContact O-N 2.81Å; R372-M376 VanDerWaalsContact O-N 3.09Å; I373-M376 WeakPolarHBondContact O-CB 3.42Å; I373-M376 PolarHBondContact O-N 3.48Å; I373-M376 VanDerWaalsContact O-N 3.13Å; V374-M376 PolarHBondContact O-N 3.28Å; V374-M376 VanDerWaalsContact O-N 3.12Å; M376-L378 PolarHBondContact O-N 3.38Å; M376-D379 VanDerWaalsContact O-CB 3.28Å; M376-D379 WeakPolarHBondContact O-CB 3.41Å; M376-D379 PolarHBondContact O-N 3.28Å; M376-D379 VanDerWaalsContact O-N 3.16Å; M376-V384 HydrophobicContact CE-CG1 3.55Å; M376-A385 VanDerWaalsContact O-CA 3.25Å; M376-A385 WeakPolarHBondContact O-CA 3.33Å; M376-A388 HydrophobicContact CB-CB 3.74Å
377	T	98.2	Very high	97	Very high	3 Å²	3	57.7 Å²	57.7	2%	0.018	28%	0.279	C	S	.	.	G	3₁₀ helix	trans	-67.9	-18.5	170	69.8	0	0	0	0	112.3	V374 S375 A385 A388 I389 L392 V411	V374-T377 WeakPolarHBondContact O-CB 3.41Å; V374-T377 WeakPolarHBondContact O-CG2 3.06Å; V374-T377 PolarHBondContact O-N 2.92Å; V374-T377 VanDerWaalsContact O-N 3.09Å; V374-T377 PolarHBondContact O-OG1 3.16Å; S375-T377 VanDerWaalsContact C-N 3.31Å; T377-A385 VanDerWaalsContact O-CB 3.31Å; T377-A385 WeakPolarHBondContact O-CB 3.44Å; T377-A388 HydrophobicContact CG2-CB 4.14Å; T377-I389 HydrophobicContact CG2-CG1 3.71Å; T377-L392 HydrophobicContact CG2-CD1 3.52Å; T377-V411 HydrophobicContact CG2-CG2 4.27Å
378	L	96.7	Very high	97.4	Very high	112 Å²	112	54 Å²	54	59%	0.586	25%	0.254	S	S	*	.	G	3₁₀ helix	trans	-109.4	25.6	172.4	-69.9	173.5	0	0	0	112.7	S375 M376 L414	S375-L378 PolarHBondContact O-N 2.77Å; M376-L378 PolarHBondContact O-N 3.38Å; L378-L414 HydrophobicContact CD2-CD2 3.66Å; L378-L414 HydrophobicContact CG-CD2 4.4Å
379	D	98.2	Very high	97.6	Very high	14 Å²	14	44.7 Å²	44.7	8%	0.075	22%	0.219	C	C	.	.			trans	-58	154.8	176.5	-159.6	-70.7	0	0	0	112.1	R342 M376 E381 V384 A385	R342-D379 IonicContact CZ-OD1 3.23Å; R342-D379 IonicContact CZ-OD2 3.28Å; R342-D379 IonicContact NE-OD1 3.7Å; R342-D379 IonicContact NE-OD2 2.8Å; R342-D379 PolarHBondContact NE-OD2 2.98Å; R342-D379 IonicContact NH2-OD1 2.64Å; R342-D379 PolarHBondContact NH2-OD1 2.98Å; R342-D379 IonicContact NH2-OD2 3.62Å; R342-D379 PolarHBondContact NH2-OD2 2.93Å; M376-D379 VanDerWaalsContact O-CB 3.28Å; M376-D379 WeakPolarHBondContact O-CB 3.41Å; M376-D379 PolarHBondContact O-N 3.28Å; M376-D379 VanDerWaalsContact O-N 3.16Å; D379-E381 PolarHBondContact O-N 3.43Å; D379-E381 PolarHBondContact OD1-N 3.16Å; D379-V384 HydrophobicContact CB-CB 4.06Å; D379-V384 HydrophobicContact CB-CG1 4.03Å; D379-A385 HydrophobicContact CB-CB 4.5Å
380	K	95.6	Very high	97.6	Very high	191 Å²	191	47.1 Å²	47.1	83%	0.83	23%	0.229	S	C	*	.	S	Bend	trans	-67.4	-27.5	178.7	-67.8	-173.1	177.2	-175.2	0	112.3
381	E	96.8	Very high	97.7	Very high	80 Å²	80	45.9 Å²	45.9	37%	0.374	22%	0.224	S	C	.	.	S	Bend	trans	-103.9	113.4	179.8	-70.9	164.4	-103.2	0	0	109.5	G339 R342 D379 D383 V384 A385	G339-E381 VanDerWaalsContact CA-CD 3.41Å; G339-E381 WeakPolarHBondContact CA-OE1 3.36Å; G339-E381 WeakPolarHBondContact CA-OE2 3.5Å; G339-E381 PolarHBondContact N-OE1 2.88Å; G339-E381 PolarHBondContact N-OE2 2.85Å; R342-E381 IonicContact CZ-OE1 2.9Å; R342-E381 IonicContact NH1-OE1 2.68Å; R342-E381 IonicContact NH2-OE1 3.57Å; R342-E381 PolarHBondContact NH2-OE1 3.36Å; D379-E381 PolarHBondContact O-N 3.43Å; D379-E381 PolarHBondContact OD1-N 3.16Å; E381-D383 VanDerWaalsContact C-N 3.27Å; E381-D383 PolarHBondContact O-N 3.25Å; E381-D383 VanDerWaalsContact O-N 3.17Å; E381-V384 HydrophobicContact CB-CG2 3.94Å; E381-V384 WeakPolarHBondContact O-CB 3.45Å; E381-V384 PolarHBondContact O-N 2.9Å; E381-A385 PolarHBondContact O-N 3.31Å
382	Y	96.9	Very high	97.7	Very high	82 Å²	82	40.8 Å²	40.8	32%	0.322	20%	0.197	S	C	.	.	H	α-helix	trans	-60.9	-30.6	-169.1	-63.4	-43.2	0	0	0	114.4	V384 A385 V386 H419 I422	Y382-V384 VanDerWaalsContact C-N 3.3Å; Y382-V384 PolarHBondContact O-N 2.74Å; Y382-A385 PolarHBondContact O-N 3.31Å; Y382-V386 WeakPolarHBondContact O-CG2 3.17Å; Y382-V386 PolarHBondContact O-N 2.89Å; Y382-H419 VanDerWaalsContact CB-CE1 3.44Å; Y382-H419 WeakPolarHBondContact CB-CE1 3.38Å; Y382-H419 WeakPolarHBondContact CB-ND1 3.3Å; Y382-H419 HydrophobicContact CD1-CB 4.46Å; Y382-H419 HydrophobicContact CD2-CB 4.25Å; Y382-H419 AromaticContact CD2-CD2 3.57Å; Y382-H419 AromaticContact CD2-CG 3.67Å; Y382-H419 AromaticContact CD2-ND1 3.95Å; Y382-H419 AromaticContact CD2-NE2 3.81Å; Y382-H419 HydrophobicContact CE1-CB 4.47Å; Y382-H419 HydrophobicContact CE2-CB 4.27Å; Y382-H419 HydrophobicContact CG-CB 4.35Å; Y382-H419 AromaticContact CG-CE1 3.97Å; Y382-H419 AromaticContact CG-CG 3.83Å; Y382-H419 AromaticContact CG-ND1 3.73Å; Y382-I422 HydrophobicContact CD1-CD1 3.53Å; Y382-I422 HydrophobicContact CE1-CD1 4.35Å; Y382-I422 HydrophobicContact CG-CD1 4.06Å
383	D	97.7	Very high	97.5	Very high	111 Å²	111	38.3 Å²	38.3	59%	0.594	19%	0.188	S	C	*	.	H	α-helix	trans	-64.7	-34.4	175.4	-71.3	-33.9	0	0	0	112.2	L343 E381 V386 Q387	L343-D383 HydrophobicContact CD1-CB 4.25Å; L343-D383 WeakPolarHBondContact CD1-O 3.29Å; E381-D383 VanDerWaalsContact C-N 3.27Å; E381-D383 PolarHBondContact O-N 3.25Å; E381-D383 VanDerWaalsContact O-N 3.17Å; D383-V386 PolarHBondContact O-N 2.89Å; D383-Q387 WeakPolarHBondContact O-CG 3.48Å; D383-Q387 PolarHBondContact O-N 3.47Å; D383-Q387 VanDerWaalsContact O-N 3.15Å
384	V	98.6	Very high	97.3	Very high	1 Å²	1	39.9 Å²	39.9	1%	0.006	20%	0.196	C	C	.	.	H	α-helix	trans	-66.2	-44.3	174.5	-176	0	0	0	0	109.7	G339 R342 L343 L346 M376 D379 E381 Y382 V386 Q387 A388	G339-V384 WeakPolarHBondContact O-CG2 3.44Å; R342-V384 HydrophobicContact CB-CG1 3.9Å; R342-V384 HydrophobicContact CB-CG2 4.38Å; L343-V384 HydrophobicContact CB-CG2 4.32Å; L346-V384 HydrophobicContact CD1-CG1 3.74Å; L346-V384 VanDerWaalsContact CD1-O 3.22Å; L346-V384 WeakPolarHBondContact CD1-O 3.35Å; M376-V384 HydrophobicContact CE-CG1 3.55Å; D379-V384 HydrophobicContact CB-CB 4.06Å; D379-V384 HydrophobicContact CB-CG1 4.03Å; E381-V384 HydrophobicContact CB-CG2 3.94Å; E381-V384 WeakPolarHBondContact O-CB 3.45Å; E381-V384 PolarHBondContact O-N 2.9Å; Y382-V384 VanDerWaalsContact C-N 3.3Å; Y382-V384 PolarHBondContact O-N 2.74Å; V384-V386 PolarHBondContact O-N 3.24Å; V384-Q387 PolarHBondContact O-N 2.83Å; V384-A388 PolarHBondContact O-N 2.88Å
385	A	98.5	Very high	97	Very high	1 Å²	1	39.2 Å²	39.2	1%	0.008	19%	0.192	C	C	.	.	H	α-helix	trans	-61.1	-42.8	176.2	0	0	0	0	0	113.2	M376 T377 D379 E381 Y382 Q387 A388 I389 I422	M376-A385 VanDerWaalsContact O-CA 3.25Å; M376-A385 WeakPolarHBondContact O-CA 3.33Å; T377-A385 VanDerWaalsContact O-CB 3.31Å; T377-A385 WeakPolarHBondContact O-CB 3.44Å; D379-A385 HydrophobicContact CB-CB 4.5Å; E381-A385 PolarHBondContact O-N 3.31Å; Y382-A385 PolarHBondContact O-N 3.31Å; A385-Q387 VanDerWaalsContact C-N 3.33Å; A385-Q387 PolarHBondContact O-N 3.49Å; A385-A388 PolarHBondContact O-N 3.01Å; A385-I389 WeakPolarHBondContact O-CG1 3.23Å; A385-I389 PolarHBondContact O-N 2.83Å; A385-I422 HydrophobicContact CB-CD1 3.71Å; A385-I422 HydrophobicContact CB-CG1 4.13Å
386	V	98.5	Very high	96.7	Very high	10 Å²	10	37.1 Å²	37.1	6%	0.061	18%	0.176	C	C	.	.	H	α-helix	trans	-56.9	-45.2	173.1	167.8	0	0	0	0	111.4	Y382 D383 V384 K390 P421 I422	Y382-V386 WeakPolarHBondContact O-CG2 3.17Å; Y382-V386 PolarHBondContact O-N 2.89Å; D383-V386 PolarHBondContact O-N 2.89Å; V384-V386 PolarHBondContact O-N 3.24Å; V386-K390 HydrophobicContact CG1-CD 4.13Å; V386-K390 WeakPolarHBondContact O-CB 3.38Å; V386-K390 WeakPolarHBondContact O-CG 3.5Å; V386-K390 PolarHBondContact O-N 3.34Å; V386-K390 VanDerWaalsContact O-N 3.1Å; V386-P421 HydrophobicContact CG2-CB 3.86Å; V386-I422 HydrophobicContact CG2-CG1 3.76Å
387	Q	98.3	Very high	96.1	Very high	44 Å²	44	41.2 Å²	41.2	21%	0.206	20%	0.195	C	C	.	.	H	α-helix	trans	-73.5	-26.9	179	-58.4	-47	-23.8	0	0	113.4	L343 L346 T347 Q350 D383 V384 A385 L391	L343-Q387 HydrophobicContact CD1-CB 4.2Å; L343-Q387 HydrophobicContact CD1-CG 3.43Å; L343-Q387 VanDerWaalsContact CD1-CG 3.43Å; L346-Q387 HydrophobicContact CB-CB 3.92Å; L346-Q387 HydrophobicContact CD1-CB 3.85Å; T347-Q387 HydrophobicContact CG2-CG 4.28Å; Q350-Q387 PolarHBondContact NE2-O 3.41Å; D383-Q387 WeakPolarHBondContact O-CG 3.48Å; D383-Q387 PolarHBondContact O-N 3.47Å; D383-Q387 VanDerWaalsContact O-N 3.15Å; V384-Q387 PolarHBondContact O-N 2.83Å; A385-Q387 VanDerWaalsContact C-N 3.33Å; A385-Q387 PolarHBondContact O-N 3.49Å; Q387-L391 VanDerWaalsContact O-CB 3.31Å; Q387-L391 WeakPolarHBondContact O-CB 2.9Å; Q387-L391 PolarHBondContact O-N 3.29Å
388	A	98.6	Very high	95.4	Very high	0 Å²	0	43.2 Å²	43.2	0%	0	21%	0.21	C	C	.	.	H	α-helix	trans	-67.6	-47.6	175.2	0	0	0	0	0	110.7	L346 M376 T377 V384 A385 K390 L391 L392	L346-A388 HydrophobicContact CD1-CB 4.03Å; L346-A388 HydrophobicContact CD2-CB 4.46Å; M376-A388 HydrophobicContact CB-CB 3.74Å; T377-A388 HydrophobicContact CG2-CB 4.14Å; V384-A388 PolarHBondContact O-N 2.88Å; A385-A388 PolarHBondContact O-N 3.01Å; A388-K390 PolarHBondContact O-N 2.87Å; A388-L391 WeakPolarHBondContact O-CB 3.39Å; A388-L391 PolarHBondContact O-N 3.03Å; A388-L392 WeakPolarHBondContact O-CG 3.46Å; A388-L392 PolarHBondContact O-N 2.82Å
389	I	98.5	Very high	94.5	Very high	0 Å²	0	39.5 Å²	39.5	0%	0	19%	0.193	C	C	.	.	H	α-helix	trans	-61.2	-45.6	175.8	-60.2	162	0	0	0	110.2	T377 A385 L391 L392 T393 V411 L414 I422 S425 F429	T377-I389 HydrophobicContact CG2-CG1 3.71Å; A385-I389 WeakPolarHBondContact O-CG1 3.23Å; A385-I389 PolarHBondContact O-N 2.83Å; I389-L391 VanDerWaalsContact C-N 3.29Å; I389-L391 PolarHBondContact O-N 3.31Å; I389-L392 PolarHBondContact O-N 2.91Å; I389-L392 VanDerWaalsContact O-N 3.15Å; I389-T393 PolarHBondContact O-N 3.35Å; I389-T393 PolarHBondContact O-OG1 2.95Å; I389-V411 HydrophobicContact CG2-CG1 3.96Å; I389-L414 HydrophobicContact CD1-CD1 3.78Å; I389-L414 HydrophobicContact CG1-CD1 4.18Å; I389-I422 HydrophobicContact CD1-CB 4.5Å; I389-I422 HydrophobicContact CD1-CG2 3.8Å; I389-S425 WeakPolarHBondContact CG2-O 3.32Å; I389-F429 HydrophobicContact CG2-CB 4.29Å
390	K	97.3	Very high	93.2	Very high	77 Å²	77	41.7 Å²	41.7	34%	0.335	21%	0.205	S	C	.	.	H	α-helix	trans	-63.2	-31.9	176.6	-73.7	177.3	176.8	177.9	0	113.5	V386 A388 L394 S425	V386-K390 HydrophobicContact CG1-CD 4.13Å; V386-K390 WeakPolarHBondContact O-CB 3.38Å; V386-K390 WeakPolarHBondContact O-CG 3.5Å; V386-K390 PolarHBondContact O-N 3.34Å; V386-K390 VanDerWaalsContact O-N 3.1Å; A388-K390 PolarHBondContact O-N 2.87Å; K390-L394 WeakPolarHBondContact O-CG 3.27Å; K390-L394 PolarHBondContact O-N 3.3Å; K390-L394 VanDerWaalsContact O-N 3.16Å; K390-S425 VanDerWaalsContact CE-OG 3.3Å; K390-S425 WeakPolarHBondContact CE-OG 3.44Å
391	L	96.6	Very high	92.4	Very high	0 Å²	0	41.5 Å²	41.5	0%	0	21%	0.207	C	C	.	.	H	α-helix	trans	-69.2	-43.8	172.3	-179.6	58.8	0	0	0	111.5	L346 L349 Q350 F353 I373 Q387 A388 I389 T393 L394 I395	L346-L391 HydrophobicContact CD2-CD2 3.6Å; L349-L391 HydrophobicContact CB-CD1 3.88Å; L349-L391 HydrophobicContact CB-CD2 3.85Å; L349-L391 HydrophobicContact CD1-CD2 3.86Å; Q350-L391 HydrophobicContact CG-CB 4.04Å; Q350-L391 HydrophobicContact CG-CD1 4.02Å; F353-L391 HydrophobicContact CD2-CD1 3.48Å; F353-L391 VanDerWaalsContact CD2-CD1 3.48Å; F353-L391 HydrophobicContact CE2-CD1 3.8Å; F353-L391 HydrophobicContact CG-CD1 4.44Å; I373-L391 HydrophobicContact CD1-CD2 4Å; I373-L391 HydrophobicContact CG1-CD2 4.34Å; I373-L391 HydrophobicContact CG2-CD2 3.96Å; I373-L391 HydrophobicContact CG2-CG 4.31Å; Q387-L391 VanDerWaalsContact O-CB 3.31Å; Q387-L391 WeakPolarHBondContact O-CB 2.9Å; Q387-L391 PolarHBondContact O-N 3.29Å; A388-L391 WeakPolarHBondContact O-CB 3.39Å; A388-L391 PolarHBondContact O-N 3.03Å; I389-L391 VanDerWaalsContact C-N 3.29Å; I389-L391 PolarHBondContact O-N 3.31Å; L391-T393 VanDerWaalsContact C-N 3.28Å; L391-T393 PolarHBondContact O-N 3.06Å; L391-L394 PolarHBondContact O-N 3.21Å; L391-L394 VanDerWaalsContact O-N 3.12Å; L391-I395 HydrophobicContact CD1-CD1 4.42Å; L391-I395 HydrophobicContact CG-CD1 4.03Å; L391-I395 WeakPolarHBondContact O-CG1 3.43Å; L391-I395 PolarHBondContact O-N 3.31Å
392	L	96.4	Very high	91.9	Very high	1 Å²	1	39.4 Å²	39.4	1%	0.005	20%	0.199	C	C	.	.	H	α-helix	trans	-60.8	-37.5	173.4	-65.6	169.6	0	0	0	111.7	I373 V374 T377 A388 I389 L394 I395 L396 L403 V411 F429	I373-L392 HydrophobicContact CB-CD2 4.47Å; I373-L392 HydrophobicContact CG2-CD2 3.78Å; I373-L392 HydrophobicContact CG2-CG 3.94Å; V374-L392 HydrophobicContact CG2-CD1 4.13Å; V374-L392 HydrophobicContact CG2-CD2 3.85Å; T377-L392 HydrophobicContact CG2-CD1 3.52Å; A388-L392 WeakPolarHBondContact O-CG 3.46Å; A388-L392 PolarHBondContact O-N 2.82Å; I389-L392 PolarHBondContact O-N 2.91Å; I389-L392 VanDerWaalsContact O-N 3.15Å; L392-L394 VanDerWaalsContact C-N 3.33Å; L392-L394 PolarHBondContact O-N 3.22Å; L392-I395 HydrophobicContact CD2-CD1 4.31Å; L392-I395 PolarHBondContact O-N 2.98Å; L392-L396 VanDerWaalsContact O-CB 3.28Å; L392-L396 WeakPolarHBondContact O-CB 3.44Å; L392-L396 PolarHBondContact O-N 3.06Å; L392-L403 HydrophobicContact CD2-CD2 3.87Å; L392-V411 HydrophobicContact CD1-CG2 3.74Å; L392-F429 HydrophobicContact CB-CD2 4.31Å; L392-F429 HydrophobicContact CB-CE2 4.02Å
393	T	94.6	Very high	91.6	Very high	3 Å²	3	36.1 Å²	36.1	2%	0.018	19%	0.187	C	C	.	.	H	α-helix	trans	-61.6	-37.3	173.3	-56.3	0	0	0	0	112.6	I389 L391 Q397 K432	I389-T393 PolarHBondContact O-N 3.35Å; I389-T393 PolarHBondContact O-OG1 2.95Å; L391-T393 VanDerWaalsContact C-N 3.28Å; L391-T393 PolarHBondContact O-N 3.06Å; T393-Q397 WeakPolarHBondContact O-CG 3.3Å; T393-Q397 PolarHBondContact O-N 3.12Å; T393-K432 HydrophobicContact CG2-CD 3.28Å
394	L	92.9	Very high	91.4	Very high	35 Å²	35	34 Å²	34	18%	0.183	18%	0.178	C	C	.	.	H	α-helix	trans	-74.8	-39.1	174.4	-68.5	173.6	0	0	0	112.4	Q350 F353 K390 L391 L392 L396 Q397 S398	Q350-L394 HydrophobicContact CB-CD1 3.87Å; Q350-L394 HydrophobicContact CG-CD1 4.02Å; F353-L394 HydrophobicContact CB-CB 3.86Å; F353-L394 HydrophobicContact CB-CD1 4.32Å; K390-L394 WeakPolarHBondContact O-CG 3.27Å; K390-L394 PolarHBondContact O-N 3.3Å; K390-L394 VanDerWaalsContact O-N 3.16Å; L391-L394 PolarHBondContact O-N 3.21Å; L391-L394 VanDerWaalsContact O-N 3.12Å; L392-L394 VanDerWaalsContact C-N 3.33Å; L392-L394 PolarHBondContact O-N 3.22Å; L394-L396 VanDerWaalsContact C-N 3.34Å; L394-L396 PolarHBondContact O-N 2.86Å; L394-Q397 PolarHBondContact O-N 3.43Å; L394-Q397 VanDerWaalsContact O-N 3.17Å; L394-S398 PolarHBondContact O-N 3.42Å; L394-S398 VanDerWaalsContact O-N 3.13Å
395	I	92.4	Very high	91.1	Very high	1 Å²	1	37.8 Å²	37.8	1%	0.005	21%	0.209	C	C	.	.	H	α-helix	trans	-56.8	-50.9	173.9	-71.2	162.3	0	0	0	109.4	F353 T366 I373 L391 L392 Q397 S398 S399 V402 L403	F353-I395 HydrophobicContact CD1-CG1 4.27Å; F353-I395 HydrophobicContact CD2-CG1 4.44Å; F353-I395 HydrophobicContact CE1-CG1 3.83Å; F353-I395 HydrophobicContact CE2-CD1 4.45Å; F353-I395 HydrophobicContact CE2-CG1 4.01Å; F353-I395 HydrophobicContact CZ-CD1 4.32Å; F353-I395 HydrophobicContact CZ-CG1 3.68Å; T366-I395 HydrophobicContact CG2-CD1 3.81Å; T366-I395 HydrophobicContact CG2-CG1 4.09Å; T366-I395 HydrophobicContact CG2-CG2 4.08Å; I373-I395 HydrophobicContact CD1-CD1 4.29Å; L391-I395 HydrophobicContact CD1-CD1 4.42Å; L391-I395 HydrophobicContact CG-CD1 4.03Å; L391-I395 WeakPolarHBondContact O-CG1 3.43Å; L391-I395 PolarHBondContact O-N 3.31Å; L392-I395 HydrophobicContact CD2-CD1 4.31Å; L392-I395 PolarHBondContact O-N 2.98Å; I395-Q397 VanDerWaalsContact C-N 3.28Å; I395-Q397 PolarHBondContact O-N 3.11Å; I395-S398 WeakPolarHBondContact O-CA 3.38Å; I395-S398 PolarHBondContact O-N 3.37Å; I395-S398 PolarHBondContact O-OG 2.94Å; I395-S399 PolarHBondContact O-N 3.11Å; I395-V402 HydrophobicContact CG2-CB 4.24Å; I395-V402 HydrophobicContact CG2-CG1 4.02Å; I395-L403 HydrophobicContact CG2-CD2 4.24Å; I395-L403 HydrophobicContact CG2-CG 4.29Å
396	L	90.1	Very high	90.8	Very high	14 Å²	14	44.6 Å²	44.6	7%	0.073	24%	0.241	C	C	.	.	H	α-helix	trans	-53	-40.9	174.8	176.2	63.8	0	0	0	113.1	L392 L394 S398 D400 L403 F429 K432 K433	L392-L396 VanDerWaalsContact O-CB 3.28Å; L392-L396 WeakPolarHBondContact O-CB 3.44Å; L392-L396 PolarHBondContact O-N 3.06Å; L394-L396 VanDerWaalsContact C-N 3.34Å; L394-L396 PolarHBondContact O-N 2.86Å; L396-S398 VanDerWaalsContact C-N 3.26Å; L396-S398 PolarHBondContact O-N 2.95Å; L396-D400 WeakPolarHBondContact CD1-OD1 3.35Å; L396-L403 HydrophobicContact CB-CD1 4.17Å; L396-F429 HydrophobicContact CB-CE2 4.26Å; L396-F429 HydrophobicContact CD2-CD2 4.06Å; L396-F429 HydrophobicContact CD2-CE2 3.84Å; L396-F429 HydrophobicContact CD2-CZ 4.28Å; L396-K432 HydrophobicContact CD2-CB 4.17Å; L396-K433 HydrophobicContact CD1-CD 3.55Å; L396-K433 HydrophobicContact CD2-CB 3.95Å; L396-K433 HydrophobicContact CD2-CD 4.3Å
397	Q	86.2	Confident	90.6	Very high	85 Å²	85	44.8 Å²	44.8	40%	0.397	24%	0.242	S	C	.	.	H	α-helix	trans	-76	-10.4	177.8	-70.4	-175.2	-75.2	0	0	114.3	R356 T393 L394 I395 K432	R356-Q397 PolarHBondContact NH2-O 3.5Å; T393-Q397 WeakPolarHBondContact O-CG 3.3Å; T393-Q397 PolarHBondContact O-N 3.12Å; L394-Q397 PolarHBondContact O-N 3.43Å; L394-Q397 VanDerWaalsContact O-N 3.17Å; I395-Q397 VanDerWaalsContact C-N 3.28Å; I395-Q397 PolarHBondContact O-N 3.11Å; Q397-K432 HydrophobicContact CG-CD 4.34Å
398	S	83.3	Confident	90.4	Very high	46 Å²	46	42.8 Å²	42.8	32%	0.322	23%	0.233	S	C	.	.	H	α-helix	trans	-100.5	-39.4	177.1	72.4	0	0	0	0	113.1	L394 I395 L396	L394-S398 PolarHBondContact O-N 3.42Å; L394-S398 VanDerWaalsContact O-N 3.13Å; I395-S398 WeakPolarHBondContact O-CA 3.38Å; I395-S398 PolarHBondContact O-N 3.37Å; I395-S398 PolarHBondContact O-OG 2.94Å; L396-S398 VanDerWaalsContact C-N 3.26Å; L396-S398 PolarHBondContact O-N 2.95Å
399	S	79.2	Confident	90	Very high	33 Å²	33	47.6 Å²	47.6	23%	0.231	26%	0.255	C	S	.	.			trans	-154.9	125.6	171	-179.3	0	0	0	0	110.4	I395 E401	I395-S399 PolarHBondContact O-N 3.11Å; S399-E401 VanDerWaalsContact C-N 3.31Å
400	D	69.9	Low	89.7	Confident	61 Å²	61	49.4 Å²	49.4	33%	0.326	27%	0.268	S	S	.	.	G	3₁₀ helix	trans	-75.6	-21.8	179.3	-161.8	70	0	0	0	112.4	L396 V402 K433 H437	L396-D400 WeakPolarHBondContact CD1-OD1 3.35Å; D400-V402 PolarHBondContact O-N 3.29Å; D400-K433 IonicContact OD1-NZ 3.73Å; D400-K433 PolarHBondContact OD1-NZ 2.96Å; D400-K433 IonicContact OD2-NZ 3.72Å; D400-K433 PolarHBondContact OD2-NZ 3.34Å; D400-H437 IonicContact OD1-CE1 3.89Å
401	E	79.1	Confident	89.7	Confident	187 Å²	187	45.8 Å²	45.8	87%	0.874	25%	0.252	S	S	*	.	G	3₁₀ helix	trans	-79	-13.5	-174	-59.8	-175.1	175.6	0	0	114	S399	S399-E401 VanDerWaalsContact C-N 3.31Å
402	V	86	Confident	89.6	Confident	36 Å²	36	47.5 Å²	47.5	22%	0.218	26%	0.259	C	S	.	.	G	3₁₀ helix	trans	-80.6	-23.3	-174.2	176.6	0	0	0	0	112.9	T366 K370 I395 D400	T366-V402 HydrophobicContact CG2-CG1 3.8Å; K370-V402 WeakPolarHBondContact CD-O 3.4Å; I395-V402 HydrophobicContact CG2-CB 4.24Å; I395-V402 HydrophobicContact CG2-CG1 4.02Å; D400-V402 PolarHBondContact O-N 3.29Å
403	L	91.9	Very high	89.4	Confident	12 Å²	12	50.8 Å²	50.8	6%	0.063	27%	0.274	C	S	.	.	S	Bend	trans	-106.1	125.1	-178.8	-57.2	-179	0	0	0	109.9	K370 L392 I395 L396 D407 F429	K370-L403 HydrophobicContact CD-CD2 4.27Å; K370-L403 HydrophobicContact CG-CD2 4Å; L392-L403 HydrophobicContact CD2-CD2 3.87Å; I395-L403 HydrophobicContact CG2-CD2 4.24Å; I395-L403 HydrophobicContact CG2-CG 4.29Å; L396-L403 HydrophobicContact CB-CD1 4.17Å; L403-D407 HydrophobicContact CB-CB 4.38Å; L403-F429 HydrophobicContact CD1-CE2 3.81Å; L403-F429 HydrophobicContact CD1-CZ 3.92Å
404	T	93	Very high	89.5	Confident	67 Å²	67	51.3 Å²	51.3	41%	0.411	28%	0.277	S	S	.	.			trans	-75.3	171.1	175.7	76.6	0	0	0	0	111.3	E406 D407 C408	T404-E406 VanDerWaalsContact C-N 3.33Å; T404-E406 PolarHBondContact OG1-N 3.5Å; T404-D407 WeakPolarHBondContact CB-OD2 3.23Å; T404-D407 WeakPolarHBondContact CG2-OD2 3.23Å; T404-D407 PolarHBondContact N-OD2 3.35Å; T404-D407 PolarHBondContact O-N 2.81Å; T404-D407 PolarHBondContact OG1-N 3.33Å; T404-D407 VanDerWaalsContact OG1-N 3.12Å; T404-D407 PolarHBondContact OG1-OD2 3Å; T404-C408 PolarHBondContact O-N 2.82Å; T404-C408 VanDerWaalsContact O-N 3.1Å; T404-C408 PolarHBondContact O-SG 3.41Å
405	A	91.1	Very high	89.7	Confident	80 Å²	80	49.7 Å²	49.7	66%	0.661	27%	0.268	S	S	*	.	H	α-helix	trans	-57.7	-45.7	170.3	0	0	0	0	0	111.6	D407 C408 E409	A405-D407 VanDerWaalsContact C-N 3.34Å; A405-D407 PolarHBondContact O-N 3.5Å; A405-C408 PolarHBondContact O-N 3.11Å; A405-C408 VanDerWaalsContact O-N 3.14Å; A405-E409 WeakPolarHBondContact O-CB 3.47Å; A405-E409 PolarHBondContact O-N 3.11Å
406	E	92.5	Very high	89.8	Confident	145 Å²	145	50.4 Å²	50.4	68%	0.678	27%	0.271	S	S	*	.	H	α-helix	trans	-61.7	-39	178.9	-60	176.2	-176.3	0	0	112	T404 S410	T404-E406 VanDerWaalsContact C-N 3.33Å; T404-E406 PolarHBondContact OG1-N 3.5Å; E406-S410 WeakPolarHBondContact O-CB 3.36Å; E406-S410 PolarHBondContact O-N 2.98Å
407	D	94.4	Very high	90	Very high	13 Å²	13	51.2 Å²	51.2	7%	0.07	28%	0.278	C	S	.	.	H	α-helix	trans	-61.6	-47.4	173.6	-62.5	-51.9	0	0	0	110.8	K370 V374 L403 T404 A405 S410 V411	K370-D407 VanDerWaalsContact CD-OD2 3.29Å; K370-D407 WeakPolarHBondContact CD-OD2 3.37Å; K370-D407 WeakPolarHBondContact CE-OD1 3.49Å; K370-D407 WeakPolarHBondContact CE-OD2 3.23Å; K370-D407 IonicContact NZ-OD1 3.7Å; K370-D407 PolarHBondContact NZ-OD1 3.39Å; K370-D407 IonicContact NZ-OD2 2.6Å; K370-D407 PolarHBondContact NZ-OD2 2.94Å; V374-D407 HydrophobicContact CG2-CB 4.16Å; L403-D407 HydrophobicContact CB-CB 4.38Å; T404-D407 WeakPolarHBondContact CB-OD2 3.23Å; T404-D407 WeakPolarHBondContact CG2-OD2 3.23Å; T404-D407 PolarHBondContact N-OD2 3.35Å; T404-D407 PolarHBondContact O-N 2.81Å; T404-D407 PolarHBondContact OG1-N 3.33Å; T404-D407 VanDerWaalsContact OG1-N 3.12Å; T404-D407 PolarHBondContact OG1-OD2 3Å; A405-D407 VanDerWaalsContact C-N 3.34Å; A405-D407 PolarHBondContact O-N 3.5Å; D407-S410 PolarHBondContact O-N 3.36Å; D407-S410 PolarHBondContact O-OG 3.14Å; D407-V411 PolarHBondContact O-N 2.91Å
408	C	94.1	Very high	90.2	Very high	3 Å²	3	49.1 Å²	49.1	2%	0.02	28%	0.275	C	S	.	.	H	α-helix	trans	-65.3	-45.3	-178.8	-63.6	0	0	0	0	111.7	T404 A405 S410 V411 Y412 F429	T404-C408 PolarHBondContact O-N 2.82Å; T404-C408 VanDerWaalsContact O-N 3.1Å; T404-C408 PolarHBondContact O-SG 3.41Å; A405-C408 PolarHBondContact O-N 3.11Å; A405-C408 VanDerWaalsContact O-N 3.14Å; C408-S410 VanDerWaalsContact C-N 3.31Å; C408-S410 PolarHBondContact O-N 3.24Å; C408-V411 WeakPolarHBondContact O-CB 3.41Å; C408-V411 PolarHBondContact O-N 2.9Å; C408-Y412 HydrophobicContact CB-CE1 4.11Å; C408-Y412 HydrophobicContact CB-CE2 4.27Å; C408-Y412 WeakPolarHBondContact O-CD1 3.44Å; C408-Y412 PolarHBondContact O-N 3.19Å; C408-F429 HydrophobicContact CB-CE1 4.17Å; C408-F429 HydrophobicContact CB-CZ 4.41Å
409	E	91.5	Very high	90.7	Very high	100 Å²	100	49.5 Å²	49.5	47%	0.467	27%	0.272	S	S	.	.	H	α-helix	trans	-58.1	-41.6	177.3	-171.2	-176.8	157.9	0	0	111.7	A405 V411 Y412 H413	A405-E409 WeakPolarHBondContact O-CB 3.47Å; A405-E409 PolarHBondContact O-N 3.11Å; E409-V411 PolarHBondContact O-N 3.46Å; E409-Y412 WeakPolarHBondContact O-CB 3.3Å; E409-Y412 PolarHBondContact O-N 3.3Å; E409-Y412 VanDerWaalsContact O-N 3.13Å; E409-H413 PolarHBondContact O-N 3.22Å; E409-H413 PolarHBondContact O-ND1 3.2Å; E409-H413 IonicContact OE1-CE1 2.81Å
410	S	92.1	Very high	91.5	Very high	38 Å²	38	50.1 Å²	50.1	27%	0.266	27%	0.269	S	S	.	.	H	α-helix	trans	-61	-30	175	81.1	0	0	0	0	113.7	V374 E406 D407 C408	V374-S410 WeakPolarHBondContact CG1-OG 3.48Å; E406-S410 WeakPolarHBondContact O-CB 3.36Å; E406-S410 PolarHBondContact O-N 2.98Å; D407-S410 PolarHBondContact O-N 3.36Å; D407-S410 PolarHBondContact O-OG 3.14Å; C408-S410 VanDerWaalsContact C-N 3.31Å; C408-S410 PolarHBondContact O-N 3.24Å
411	V	96.3	Very high	92.8	Very high	1 Å²	1	50.2 Å²	50.2	1%	0.006	27%	0.273	C	S	.	.	H	α-helix	trans	-82.6	-36.7	174.3	-177.7	0	0	0	0	111.2	T377 I389 L392 D407 C408 E409 H413 L414 A426 F429	T377-V411 HydrophobicContact CG2-CG2 4.27Å; I389-V411 HydrophobicContact CG2-CG1 3.96Å; L392-V411 HydrophobicContact CD1-CG2 3.74Å; D407-V411 PolarHBondContact O-N 2.91Å; C408-V411 WeakPolarHBondContact O-CB 3.41Å; C408-V411 PolarHBondContact O-N 2.9Å; E409-V411 PolarHBondContact O-N 3.46Å; V411-H413 VanDerWaalsContact C-N 3.34Å; V411-H413 PolarHBondContact O-N 3.26Å; V411-L414 VanDerWaalsContact O-CB 3.27Å; V411-L414 WeakPolarHBondContact O-CB 3.23Å; V411-L414 PolarHBondContact O-N 3.34Å; V411-A426 HydrophobicContact CG1-CB 4.32Å; V411-F429 HydrophobicContact CB-CD1 3.92Å; V411-F429 HydrophobicContact CB-CE1 3.93Å; V411-F429 HydrophobicContact CG1-CB 4.07Å; V411-F429 HydrophobicContact CG1-CD1 3.51Å; V411-F429 HydrophobicContact CG1-CD2 4.43Å; V411-F429 HydrophobicContact CG1-CE1 4.03Å; V411-F429 HydrophobicContact CG1-CG 3.75Å; V411-F429 HydrophobicContact CG2-CE1 4.41Å
412	Y	95	Very high	93.7	Very high	36 Å²	36	41.6 Å²	41.6	14%	0.141	23%	0.233	C	C	.	.	H	α-helix	trans	-57.5	-44.4	179.1	-67.3	-11.8	0	0	0	112.3	C408 E409 L414 V415 F429 L430 K433 F464	C408-Y412 HydrophobicContact CB-CE1 4.11Å; C408-Y412 HydrophobicContact CB-CE2 4.27Å; C408-Y412 WeakPolarHBondContact O-CD1 3.44Å; C408-Y412 PolarHBondContact O-N 3.19Å; E409-Y412 WeakPolarHBondContact O-CB 3.3Å; E409-Y412 PolarHBondContact O-N 3.3Å; E409-Y412 VanDerWaalsContact O-N 3.13Å; Y412-L414 PolarHBondContact O-N 3.49Å; Y412-V415 WeakPolarHBondContact O-CG1 3.49Å; Y412-V415 VanDerWaalsContact O-CG2 3.24Å; Y412-V415 WeakPolarHBondContact O-CG2 3.49Å; Y412-V415 PolarHBondContact O-N 2.73Å; Y412-V415 VanDerWaalsContact O-N 3.08Å; Y412-F429 HydrophobicContact CD1-CD1 4.21Å; Y412-F429 HydrophobicContact CD1-CE1 4.2Å; Y412-F429 HydrophobicContact CE1-CD1 4.06Å; Y412-F429 AromaticContact CE1-CE1 3.83Å; Y412-F429 HydrophobicContact CE1-CE1 3.83Å; Y412-L430 HydrophobicContact CD1-CB 4.44Å; Y412-L430 HydrophobicContact CD1-CD1 3.64Å; Y412-L430 HydrophobicContact CE1-CD1 3.65Å; Y412-L430 HydrophobicContact CG-CD1 4.13Å; Y412-K433 VanDerWaalsContact OH-CG 3.28Å; Y412-K433 WeakPolarHBondContact OH-CG 3.45Å; Y412-F464 AromaticContact CD2-CE2 3.85Å; Y412-F464 HydrophobicContact CD2-CE2 3.85Å; Y412-F464 AromaticContact CG-CE2 3.81Å; Y412-F464 HydrophobicContact CG-CE2 3.81Å; Y412-F464 HydrophobicContact CG-CZ 4.42Å
413	H	91.3	Very high	94.3	Very high	70 Å²	70	39.9 Å²	39.9	32%	0.324	22%	0.222	S	C	.	.	G	3₁₀ helix	trans	-56.9	-23.3	177	-63.1	144.7	0	0	0	113.4	E409 V411 V415 Y416 L470	E409-H413 PolarHBondContact O-N 3.22Å; E409-H413 PolarHBondContact O-ND1 3.2Å; E409-H413 IonicContact OE1-CE1 2.81Å; V411-H413 VanDerWaalsContact C-N 3.34Å; V411-H413 PolarHBondContact O-N 3.26Å; H413-V415 VanDerWaalsContact C-N 3.27Å; H413-V415 PolarHBondContact O-N 3.47Å; H413-Y416 PolarHBondContact O-N 2.95Å; H413-L470 HydrophobicContact CB-CD1 3.69Å; H413-L470 WeakPolarHBondContact CD2-CD1 3.28Å
414	L	96.6	Very high	94.5	Very high	15 Å²	15	40.2 Å²	40.2	8%	0.079	23%	0.225	C	C	.	.	G	3₁₀ helix	trans	-74.4	-12.1	-179.3	-51.5	178.1	0	0	0	113.6	L378 I389 V411 Y412 Y416 S417 I422 A423 A426	L378-L414 HydrophobicContact CD2-CD2 3.66Å; L378-L414 HydrophobicContact CG-CD2 4.4Å; I389-L414 HydrophobicContact CD1-CD1 3.78Å; I389-L414 HydrophobicContact CG1-CD1 4.18Å; V411-L414 VanDerWaalsContact O-CB 3.27Å; V411-L414 WeakPolarHBondContact O-CB 3.23Å; V411-L414 PolarHBondContact O-N 3.34Å; Y412-L414 PolarHBondContact O-N 3.49Å; L414-Y416 PolarHBondContact O-N 3.22Å; L414-Y416 VanDerWaalsContact O-N 3.16Å; L414-S417 WeakPolarHBondContact O-CB 3.45Å; L414-S417 PolarHBondContact O-N 3.29Å; L414-I422 HydrophobicContact CB-CG2 4.03Å; L414-A423 VanDerWaalsContact O-CA 3.32Å; L414-A423 WeakPolarHBondContact O-CA 3.29Å; L414-A426 HydrophobicContact CB-CB 3.8Å
415	V	97.1	Very high	94.8	Very high	0 Å²	0	37.2 Å²	37.2	0%	0	21%	0.207	C	C	.	.	G	3₁₀ helix	trans	-63	-16.2	170	-54.4	0	0	0	0	112.6	Y412 H413 A426 L430 F464 L477 S480 R538	Y412-V415 WeakPolarHBondContact O-CG1 3.49Å; Y412-V415 VanDerWaalsContact O-CG2 3.24Å; Y412-V415 WeakPolarHBondContact O-CG2 3.49Å; Y412-V415 PolarHBondContact O-N 2.73Å; Y412-V415 VanDerWaalsContact O-N 3.08Å; H413-V415 VanDerWaalsContact C-N 3.27Å; H413-V415 PolarHBondContact O-N 3.47Å; V415-A426 HydrophobicContact CG1-CB 3.82Å; V415-L430 HydrophobicContact CG1-CD2 4.01Å; V415-F464 HydrophobicContact CG2-CE1 3.98Å; V415-F464 HydrophobicContact CG2-CZ 4.14Å; V415-L477 HydrophobicContact CB-CD1 4.42Å; V415-L477 HydrophobicContact CG2-CD1 3.85Å; V415-S480 PolarHBondContact O-OG 2.96Å; V415-R538 PolarHBondContact O-NH2 3.38Å
416	Y	95.1	Very high	95.1	Very high	16 Å²	16	33.4 Å²	33.4	6%	0.063	18%	0.175	C	C	.	.	G	3₁₀ helix	trans	-93.1	-3.1	174	-62.9	-64	0	0	0	113.6	H413 L414 A418 S468 L470 H471 L477	H413-Y416 PolarHBondContact O-N 2.95Å; L414-Y416 PolarHBondContact O-N 3.22Å; L414-Y416 VanDerWaalsContact O-N 3.16Å; Y416-A418 PolarHBondContact O-N 3.12Å; Y416-S468 WeakPolarHBondContact CE2-OG 3.44Å; Y416-S468 PolarHBondContact OH-OG 3.11Å; Y416-L470 HydrophobicContact CD2-CB 3.99Å; Y416-L470 HydrophobicContact CD2-CD1 4.03Å; Y416-L470 HydrophobicContact CE2-CB 4.22Å; Y416-H471 HydrophobicContact CD1-CB 4.05Å; Y416-H471 AromaticContact CD1-CD2 3.24Å; Y416-H471 WeakPolarHBondContact CD1-CD2 3.44Å; Y416-H471 AromaticContact CD1-CG 3.77Å; Y416-H471 AromaticContact CD1-NE2 3.96Å; Y416-H471 HydrophobicContact CE1-CB 3.9Å; Y416-H471 AromaticContact CE1-CD2 3.97Å; Y416-H471 AromaticContact CG-CD2 3.41Å; Y416-H471 VanDerWaalsContact CG-CD2 3.41Å; Y416-L477 HydrophobicContact CE1-CB 4.01Å
417	S	94.1	Very high	95.3	Very high	32 Å²	32	26.5 Å²	26.5	22%	0.224	14%	0.143	C	C	.	.			trans	-55.5	135.5	-177.7	-171	0	0	0	0	113.2	L414 H419 R538	L414-S417 WeakPolarHBondContact O-CB 3.45Å; L414-S417 PolarHBondContact O-N 3.29Å; S417-H419 PolarHBondContact O-N 2.83Å; S417-H419 PolarHBondContact OG-N 2.92Å; S417-R538 PolarHBondContact O-NE 2.96Å; S417-R538 PolarHBondContact O-NH2 3Å
418	A	90.6	Very high	95.5	Very high	41 Å²	41	29 Å²	29	34%	0.339	15%	0.154	S	C	.	.	S	Bend	trans	-51.3	-37.7	169.1	0	0	0	0	0	112.5	Y416 R420 E1253	Y416-A418 PolarHBondContact O-N 3.12Å; A418-R420 PolarHBondContact O-N 2.9Å; A418-R420 VanDerWaalsContact O-N 3.12Å; A418-E1253 HydrophobicContact CB-CG 4.5Å; A418-E1253 WeakPolarHBondContact CB-OE1 3.38Å
419	H	93.9	Very high	95.6	Very high	53 Å²	53	28.9 Å²	28.9	25%	0.245	15%	0.153	C	C	.	.	S	Bend	trans	-83.6	92.1	-176.7	-171.3	-109.3	0	0	0	110.8	Y382 S417 P421 I422 A423	Y382-H419 VanDerWaalsContact CB-CE1 3.44Å; Y382-H419 WeakPolarHBondContact CB-CE1 3.38Å; Y382-H419 WeakPolarHBondContact CB-ND1 3.3Å; Y382-H419 HydrophobicContact CD1-CB 4.46Å; Y382-H419 HydrophobicContact CD2-CB 4.25Å; Y382-H419 AromaticContact CD2-CD2 3.57Å; Y382-H419 AromaticContact CD2-CG 3.67Å; Y382-H419 AromaticContact CD2-ND1 3.95Å; Y382-H419 AromaticContact CD2-NE2 3.81Å; Y382-H419 HydrophobicContact CE1-CB 4.47Å; Y382-H419 HydrophobicContact CE2-CB 4.27Å; Y382-H419 HydrophobicContact CG-CB 4.35Å; Y382-H419 AromaticContact CG-CE1 3.97Å; Y382-H419 AromaticContact CG-CG 3.83Å; Y382-H419 AromaticContact CG-ND1 3.73Å; S417-H419 PolarHBondContact O-N 2.83Å; S417-H419 PolarHBondContact OG-N 2.92Å; H419-P421 VanDerWaalsContact C-CD 3.41Å; H419-P421 VanDerWaalsContact C-N 3.31Å; H419-I422 HydrophobicContact CB-CD1 4.32Å; H419-I422 WeakPolarHBondContact O-CB 3.28Å; H419-I422 PolarHBondContact O-N 3.1Å; H419-A423 PolarHBondContact O-N 3.03Å
420	R	95.5	Very high	95.7	Very high	47 Å²	47	24.1 Å²	24.1	18%	0.177	13%	0.131	C	C	.	.	H	α-helix	trans	-42.5	-42.1	-175.2	-169.7	178.4	-171.2	-81.9	-10.7	115.8	A418 I422 A423 V424 D479 E483 R538	A418-R420 PolarHBondContact O-N 2.9Å; A418-R420 VanDerWaalsContact O-N 3.12Å; R420-I422 VanDerWaalsContact C-N 3.29Å; R420-I422 PolarHBondContact O-N 2.54Å; R420-A423 PolarHBondContact O-N 3.33Å; R420-A423 VanDerWaalsContact O-N 3.14Å; R420-V424 HydrophobicContact CG-CG2 3.93Å; R420-V424 WeakPolarHBondContact O-CG2 3.4Å; R420-V424 PolarHBondContact O-N 3.1Å; R420-D479 WeakPolarHBondContact CD-OD2 3.18Å; R420-D479 IonicContact CZ-OD1 3.27Å; R420-D479 VanDerWaalsContact CZ-OD1 3.28Å; R420-D479 IonicContact CZ-OD2 2.7Å; R420-D479 VanDerWaalsContact NE-CG 3.3Å; R420-D479 IonicContact NE-OD1 2.73Å; R420-D479 PolarHBondContact NE-OD1 3.16Å; R420-D479 IonicContact NE-OD2 3.06Å; R420-D479 PolarHBondContact NE-OD2 3.05Å; R420-D479 IonicContact NH2-OD1 3.72Å; R420-D479 PolarHBondContact NH2-OD1 3.28Å; R420-E483 IonicContact CZ-OE1 3.41Å; R420-E483 VanDerWaalsContact CZ-OE1 3.31Å; R420-E483 IonicContact NH1-OE1 3.88Å; R420-E483 PolarHBondContact NH1-OE1 2.67Å; R420-E483 IonicContact NH2-OE1 2.76Å; R420-E483 PolarHBondContact NH2-OE1 3.05Å; R420-E483 VanDerWaalsContact NH2-OE1 3.07Å; R420-R538 HydrophobicContact CB-CB 4.07Å; R420-R538 HydrophobicContact CB-CG 4.11Å; R420-R538 WeakPolarHBondContact CD-O 3.38Å; R420-R538 HydrophobicContact CG-CB 4.36Å
421	P	97.4	Very high	95.8	Very high	62 Å²	62	24.9 Å²	24.9	40%	0.403	13%	0.13	S	C	.	.	H	α-helix	trans	-59.5	-33.1	175.9	-26.9	36.2	0	0	0	115.1	V386 H419 S425	V386-P421 HydrophobicContact CG2-CB 3.86Å; H419-P421 VanDerWaalsContact C-CD 3.41Å; H419-P421 VanDerWaalsContact C-N 3.31Å; P421-S425 WeakPolarHBondContact O-CB 3.42Å; P421-S425 PolarHBondContact O-N 2.71Å; P421-S425 PolarHBondContact O-OG 2.88Å
422	I	98.1	Very high	95.5	Very high	6 Å²	6	27 Å²	27	3%	0.031	14%	0.139	C	C	.	.	H	α-helix	trans	-70.1	-49.4	172	-74.3	173.7	0	0	0	109.2	Y382 A385 V386 I389 L414 H419 R420 V424 S425 A426	Y382-I422 HydrophobicContact CD1-CD1 3.53Å; Y382-I422 HydrophobicContact CE1-CD1 4.35Å; Y382-I422 HydrophobicContact CG-CD1 4.06Å; A385-I422 HydrophobicContact CB-CD1 3.71Å; A385-I422 HydrophobicContact CB-CG1 4.13Å; V386-I422 HydrophobicContact CG2-CG1 3.76Å; I389-I422 HydrophobicContact CD1-CB 4.5Å; I389-I422 HydrophobicContact CD1-CG2 3.8Å; L414-I422 HydrophobicContact CB-CG2 4.03Å; H419-I422 HydrophobicContact CB-CD1 4.32Å; H419-I422 WeakPolarHBondContact O-CB 3.28Å; H419-I422 PolarHBondContact O-N 3.1Å; R420-I422 VanDerWaalsContact C-N 3.29Å; R420-I422 PolarHBondContact O-N 2.54Å; I422-V424 PolarHBondContact O-N 3.06Å; I422-S425 WeakPolarHBondContact O-CB 3.49Å; I422-S425 PolarHBondContact O-N 2.85Å; I422-S425 VanDerWaalsContact O-N 3.1Å; I422-A426 PolarHBondContact O-N 2.83Å
423	A	97.8	Very high	95.3	Very high	0 Å²	0	27 Å²	27	0%	0	14%	0.139	C	C	.	.	H	α-helix	trans	-62	-42.6	-174.9	0	0	0	0	0	113.4	L414 H419 R420 A426 G427 S480 R538	L414-A423 VanDerWaalsContact O-CA 3.32Å; L414-A423 WeakPolarHBondContact O-CA 3.29Å; H419-A423 PolarHBondContact O-N 3.03Å; R420-A423 PolarHBondContact O-N 3.33Å; R420-A423 VanDerWaalsContact O-N 3.14Å; A423-A426 PolarHBondContact O-N 3.15Å; A423-G427 PolarHBondContact O-N 2.82Å; A423-S480 VanDerWaalsContact CB-OG 3.29Å; A423-S480 WeakPolarHBondContact CB-OG 3.38Å; A423-S480 WeakPolarHBondContact O-CB 3.28Å; A423-S480 PolarHBondContact O-OG 3.07Å; A423-R538 VanDerWaalsContact CB-NH2 3.32Å
424	V	97.9	Very high	94.9	Very high	20 Å²	20	26.8 Å²	26.8	12%	0.121	14%	0.14	C	C	.	.	H	α-helix	trans	-68.2	-35.1	174	175.1	0	0	0	0	111.9	R420 I422 A426 G427 E428 E483	R420-V424 HydrophobicContact CG-CG2 3.93Å; R420-V424 WeakPolarHBondContact O-CG2 3.4Å; R420-V424 PolarHBondContact O-N 3.1Å; I422-V424 PolarHBondContact O-N 3.06Å; V424-A426 VanDerWaalsContact C-N 3.34Å; V424-G427 PolarHBondContact O-N 3.08Å; V424-E428 PolarHBondContact O-N 3.43Å; V424-E483 HydrophobicContact CG1-CB 4.15Å; V424-E483 HydrophobicContact CG1-CG 4.48Å
425	S	98.3	Very high	94.1	Very high	4 Å²	4	26.9 Å²	26.9	3%	0.028	14%	0.14	C	C	.	.	H	α-helix	trans	-67.1	-36.9	174.9	-57	0	0	0	0	111.7	I389 K390 P421 I422 E428 F429	I389-S425 WeakPolarHBondContact CG2-O 3.32Å; K390-S425 VanDerWaalsContact CE-OG 3.3Å; K390-S425 WeakPolarHBondContact CE-OG 3.44Å; P421-S425 WeakPolarHBondContact O-CB 3.42Å; P421-S425 PolarHBondContact O-N 2.71Å; P421-S425 PolarHBondContact O-OG 2.88Å; I422-S425 WeakPolarHBondContact O-CB 3.49Å; I422-S425 PolarHBondContact O-N 2.85Å; I422-S425 VanDerWaalsContact O-N 3.1Å; S425-E428 PolarHBondContact O-N 3.36Å; S425-F429 PolarHBondContact O-N 3.32Å; S425-F429 VanDerWaalsContact O-N 3.17Å
426	A	98.1	Very high	92.6	Very high	0 Å²	0	29.7 Å²	29.7	0%	0	16%	0.16	C	C	.	.	H	α-helix	trans	-70.1	-35.3	172.3	0	0	0	0	0	111.9	V411 L414 V415 I422 A423 V424 F429 L430	V411-A426 HydrophobicContact CG1-CB 4.32Å; L414-A426 HydrophobicContact CB-CB 3.8Å; V415-A426 HydrophobicContact CG1-CB 3.82Å; I422-A426 PolarHBondContact O-N 2.83Å; A423-A426 PolarHBondContact O-N 3.15Å; V424-A426 VanDerWaalsContact C-N 3.34Å; A426-F429 WeakPolarHBondContact O-CB 3.44Å; A426-F429 PolarHBondContact O-N 3.13Å; A426-L430 WeakPolarHBondContact O-CB 3.4Å; A426-L430 PolarHBondContact O-N 2.89Å
427	G	97.1	Very high	90.8	Very high	0 Å²	0	34.9 Å²	34.9	0%	0	18%	0.184	C	C	.	.	H	α-helix	trans	-60.5	-42.2	170.9	0	0	0	0	0	112.2	A423 V424 F429 L430 F431	A423-G427 PolarHBondContact O-N 2.82Å; V424-G427 PolarHBondContact O-N 3.08Å; G427-F429 PolarHBondContact O-N 2.99Å; G427-L430 PolarHBondContact O-N 3.42Å; G427-F431 VanDerWaalsContact O-CB 3.23Å; G427-F431 WeakPolarHBondContact O-CB 3.27Å; G427-F431 PolarHBondContact O-N 3.49Å
428	E	96.7	Very high	89	Confident	64 Å²	64	43.7 Å²	43.7	30%	0.299	21%	0.213	S	C	.	.	H	α-helix	trans	-62.8	-40.8	174.1	-161	-161.3	144.8	0	0	112.2	V424 S425 K432	V424-E428 PolarHBondContact O-N 3.43Å; S425-E428 PolarHBondContact O-N 3.36Å; E428-K432 HydrophobicContact CG-CD 4.38Å; E428-K432 WeakPolarHBondContact O-CB 3.34Å; E428-K432 WeakPolarHBondContact O-CG 3.06Å; E428-K432 PolarHBondContact O-N 3.22Å; E428-K432 WeakPolarHBondContact OE1-CE 3.29Å; E428-K432 IonicContact OE1-NZ 3.67Å; E428-K432 PolarHBondContact OE1-NZ 3.16Å
429	F	96.3	Very high	87	Confident	1 Å²	1	43.9 Å²	43.9	0%	0.004	22%	0.219	C	C	.	.	H	α-helix	trans	-63.5	-50.4	174.8	179.9	-91.6	0	0	0	111.7	I389 L392 L396 L403 C408 V411 Y412 S425 A426 G427 F431 K432 K433	I389-F429 HydrophobicContact CG2-CB 4.29Å; L392-F429 HydrophobicContact CB-CD2 4.31Å; L392-F429 HydrophobicContact CB-CE2 4.02Å; L396-F429 HydrophobicContact CB-CE2 4.26Å; L396-F429 HydrophobicContact CD2-CD2 4.06Å; L396-F429 HydrophobicContact CD2-CE2 3.84Å; L396-F429 HydrophobicContact CD2-CZ 4.28Å; L403-F429 HydrophobicContact CD1-CE2 3.81Å; L403-F429 HydrophobicContact CD1-CZ 3.92Å; C408-F429 HydrophobicContact CB-CE1 4.17Å; C408-F429 HydrophobicContact CB-CZ 4.41Å; V411-F429 HydrophobicContact CB-CD1 3.92Å; V411-F429 HydrophobicContact CB-CE1 3.93Å; V411-F429 HydrophobicContact CG1-CB 4.07Å; V411-F429 HydrophobicContact CG1-CD1 3.51Å; V411-F429 HydrophobicContact CG1-CD2 4.43Å; V411-F429 HydrophobicContact CG1-CE1 4.03Å; V411-F429 HydrophobicContact CG1-CG 3.75Å; V411-F429 HydrophobicContact CG2-CE1 4.41Å; Y412-F429 HydrophobicContact CD1-CD1 4.21Å; Y412-F429 HydrophobicContact CD1-CE1 4.2Å; Y412-F429 HydrophobicContact CE1-CD1 4.06Å; Y412-F429 AromaticContact CE1-CE1 3.83Å; Y412-F429 HydrophobicContact CE1-CE1 3.83Å; S425-F429 PolarHBondContact O-N 3.32Å; S425-F429 VanDerWaalsContact O-N 3.17Å; A426-F429 WeakPolarHBondContact O-CB 3.44Å; A426-F429 PolarHBondContact O-N 3.13Å; G427-F429 PolarHBondContact O-N 2.99Å; F429-F431 PolarHBondContact O-N 3.31Å; F429-K432 PolarHBondContact O-N 3.41Å; F429-K433 PolarHBondContact O-N 3.25Å
430	L	94.9	Very high	84.9	Confident	0 Å²	0	47.4 Å²	47.4	0%	0	25%	0.246	C	C	.	.	H	α-helix	trans	-57.7	-46.7	177.7	178.7	64.1	0	0	0	111.6	Y412 V415 A426 G427 K432 K433 L434 F435 F464 L477 L481	Y412-L430 HydrophobicContact CD1-CB 4.44Å; Y412-L430 HydrophobicContact CD1-CD1 3.64Å; Y412-L430 HydrophobicContact CE1-CD1 3.65Å; Y412-L430 HydrophobicContact CG-CD1 4.13Å; V415-L430 HydrophobicContact CG1-CD2 4.01Å; A426-L430 WeakPolarHBondContact O-CB 3.4Å; A426-L430 PolarHBondContact O-N 2.89Å; G427-L430 PolarHBondContact O-N 3.42Å; L430-K432 VanDerWaalsContact C-N 3.33Å; L430-K432 PolarHBondContact O-N 3.47Å; L430-K433 PolarHBondContact O-N 2.82Å; L430-L434 HydrophobicContact CD1-CD1 3.52Å; L430-L434 HydrophobicContact CD1-CG 4.03Å; L430-L434 PolarHBondContact O-N 3.28Å; L430-F435 HydrophobicContact CG-CE2 4.36Å; L430-F464 HydrophobicContact CD1-CD2 3.68Å; L430-F464 HydrophobicContact CD1-CE2 3.45Å; L430-F464 VanDerWaalsContact CD1-CE2 3.45Å; L430-F464 HydrophobicContact CD1-CG 4.37Å; L430-F464 HydrophobicContact CD1-CZ 4Å; L430-F464 HydrophobicContact CD2-CD1 3.98Å; L430-F464 HydrophobicContact CD2-CD2 4.25Å; L430-F464 HydrophobicContact CD2-CE1 3.64Å; L430-F464 HydrophobicContact CD2-CE2 3.91Å; L430-F464 HydrophobicContact CD2-CG 4.28Å; L430-F464 HydrophobicContact CD2-CZ 3.6Å; L430-F464 HydrophobicContact CG-CE2 4.35Å; L430-F464 HydrophobicContact CG-CZ 4.47Å; L430-L477 HydrophobicContact CD2-CD1 4.27Å; L430-L481 HydrophobicContact CD2-CD2 4.36Å
431	F	92.8	Very high	82.7	Confident	54 Å²	54	53.9 Å²	53.9	24%	0.237	28%	0.279	C	S	.	.	H	α-helix	trans	-60.1	-41.4	176.2	-172.9	-103.5	0	0	0	112.1	G427 F429 F435 S436 L481 C484 A485	G427-F431 VanDerWaalsContact O-CB 3.23Å; G427-F431 WeakPolarHBondContact O-CB 3.27Å; G427-F431 PolarHBondContact O-N 3.49Å; F429-F431 PolarHBondContact O-N 3.31Å; F431-F435 HydrophobicContact CD2-CB 3.69Å; F431-F435 HydrophobicContact CD2-CD1 4.33Å; F431-F435 HydrophobicContact CD2-CD2 4.17Å; F431-F435 AromaticContact CD2-CG 3.83Å; F431-F435 HydrophobicContact CD2-CG 3.83Å; F431-F435 HydrophobicContact CE2-CB 3.79Å; F431-F435 HydrophobicContact CE2-CD1 4.44Å; F431-F435 HydrophobicContact CE2-CG 4.19Å; F431-F435 HydrophobicContact CG-CB 4.32Å; F431-F435 HydrophobicContact CZ-CB 4.49Å; F431-F435 WeakPolarHBondContact O-CA 3.43Å; F431-F435 VanDerWaalsContact O-CB 3.28Å; F431-F435 WeakPolarHBondContact O-CB 3.46Å; F431-F435 PolarHBondContact O-N 3.46Å; F431-S436 PolarHBondContact O-N 3.14Å; F431-S436 PolarHBondContact O-OG 3.28Å; F431-L481 HydrophobicContact CB-CD2 4.43Å; F431-C484 HydrophobicContact CB-CB 4.42Å; F431-C484 HydrophobicContact CD1-CB 4.22Å; F431-C484 HydrophobicContact CG-CB 4.28Å; F431-A485 HydrophobicContact CD2-CB 3.82Å; F431-A485 HydrophobicContact CE2-CB 3.76Å
432	K	91.1	Very high	80.6	Confident	46 Å²	46	54.9 Å²	54.9	20%	0.2	28%	0.281	C	S	.	.	H	α-helix	trans	-70.2	-38.5	176.9	-78.4	167.6	171.8	-177.5	0	113.1	T393 L396 Q397 E428 F429 L430 S436	T393-K432 HydrophobicContact CG2-CD 3.28Å; L396-K432 HydrophobicContact CD2-CB 4.17Å; Q397-K432 HydrophobicContact CG-CD 4.34Å; E428-K432 HydrophobicContact CG-CD 4.38Å; E428-K432 WeakPolarHBondContact O-CB 3.34Å; E428-K432 WeakPolarHBondContact O-CG 3.06Å; E428-K432 PolarHBondContact O-N 3.22Å; E428-K432 WeakPolarHBondContact OE1-CE 3.29Å; E428-K432 IonicContact OE1-NZ 3.67Å; E428-K432 PolarHBondContact OE1-NZ 3.16Å; F429-K432 PolarHBondContact O-N 3.41Å; L430-K432 VanDerWaalsContact C-N 3.33Å; L430-K432 PolarHBondContact O-N 3.47Å; K432-S436 WeakPolarHBondContact O-CB 3.39Å
433	K	90	Very high	78.2	Confident	35 Å²	35	63.9 Å²	63.9	15%	0.152	32%	0.323	C	S	.	.	H	α-helix	trans	-71.6	-53.7	179.6	-172	65.6	178.2	-175.6	0	112.1	L396 D400 Y412 F429 L430 H437	L396-K433 HydrophobicContact CD1-CD 3.55Å; L396-K433 HydrophobicContact CD2-CB 3.95Å; L396-K433 HydrophobicContact CD2-CD 4.3Å; D400-K433 IonicContact OD1-NZ 3.73Å; D400-K433 PolarHBondContact OD1-NZ 2.96Å; D400-K433 IonicContact OD2-NZ 3.72Å; D400-K433 PolarHBondContact OD2-NZ 3.34Å; Y412-K433 VanDerWaalsContact OH-CG 3.28Å; Y412-K433 WeakPolarHBondContact OH-CG 3.45Å; F429-K433 PolarHBondContact O-N 3.25Å; L430-K433 PolarHBondContact O-N 2.82Å; K433-H437 PolarHBondContact O-ND1 3.2Å; K433-H437 VanDerWaalsContact O-ND1 3.08Å
434	L	83.9	Confident	76.2	Confident	66 Å²	66	66 Å²	66	35%	0.346	35%	0.345	S	S	.	.	H	α-helix	trans	-92.7	-31	-169.6	-58.7	-173.9	0	0	0	114.6	L430 T460 F464	L430-L434 HydrophobicContact CD1-CD1 3.52Å; L430-L434 HydrophobicContact CD1-CG 4.03Å; L430-L434 PolarHBondContact O-N 3.28Å; L434-T460 HydrophobicContact CB-CG2 4.39Å; L434-F464 HydrophobicContact CD1-CD2 4.17Å
435	F	78.4	Confident	74	Confident	18 Å²	18	72.5 Å²	72.5	8%	0.079	38%	0.378	C	S	.	.	S	Bend	trans	-104.5	-9.3	-169.1	-57.7	-109.9	0	0	0	113.6	L430 F431 L457 T460 T461 L488	L430-F435 HydrophobicContact CG-CE2 4.36Å; F431-F435 HydrophobicContact CD2-CB 3.69Å; F431-F435 HydrophobicContact CD2-CD1 4.33Å; F431-F435 HydrophobicContact CD2-CD2 4.17Å; F431-F435 AromaticContact CD2-CG 3.83Å; F431-F435 HydrophobicContact CD2-CG 3.83Å; F431-F435 HydrophobicContact CE2-CB 3.79Å; F431-F435 HydrophobicContact CE2-CD1 4.44Å; F431-F435 HydrophobicContact CE2-CG 4.19Å; F431-F435 HydrophobicContact CG-CB 4.32Å; F431-F435 HydrophobicContact CZ-CB 4.49Å; F431-F435 WeakPolarHBondContact O-CA 3.43Å; F431-F435 VanDerWaalsContact O-CB 3.28Å; F431-F435 WeakPolarHBondContact O-CB 3.46Å; F431-F435 PolarHBondContact O-N 3.46Å; F435-L457 HydrophobicContact CB-CD2 4.2Å; F435-L457 HydrophobicContact CD1-CB 4Å; F435-L457 HydrophobicContact CD1-CD2 3.87Å; F435-L457 HydrophobicContact CD1-CG 4.33Å; F435-L457 HydrophobicContact CE1-CB 4.32Å; F435-L457 WeakPolarHBondContact CE1-O 3.42Å; F435-L457 HydrophobicContact CG-CD2 4.37Å; F435-T460 HydrophobicContact CZ-CG2 4.44Å; F435-T461 VanDerWaalsContact CE1-OG1 3.31Å; F435-T461 WeakPolarHBondContact CE1-OG1 3.5Å; F435-T461 WeakPolarHBondContact CZ-OG1 3.37Å; F435-L488 HydrophobicContact CD1-CD2 3.85Å; F435-L488 HydrophobicContact CE1-CD2 3.73Å
436	S	67.6	Low	71.9	Confident	58 Å²	58	78.2 Å²	78.2	41%	0.406	42%	0.415	S	S	.	.	S	Bend	trans	-101.9	-11	-176.8	-57.3	0	0	0	0	114.7	F431 K432 R438	F431-S436 PolarHBondContact O-N 3.14Å; F431-S436 PolarHBondContact O-OG 3.28Å; K432-S436 WeakPolarHBondContact O-CB 3.39Å; S436-R438 PolarHBondContact O-N 3.19Å
437	H	57.4	Low	70.4	Confident	126 Å²	126	84.4 Å²	84.4	58%	0.583	44%	0.438	S	S	*	.			trans	-76.4	82.1	178.4	-88.6	104.1	0	0	0	112	D400 K433 G439	D400-H437 IonicContact OD1-CE1 3.89Å; K433-H437 PolarHBondContact O-ND1 3.2Å; K433-H437 VanDerWaalsContact O-ND1 3.08Å; H437-G439 PolarHBondContact O-N 2.79Å
438	R	55.6	Low	69	Low	217 Å²	217	94.1 Å²	94.1	82%	0.819	48%	0.475	S	S	*	.			trans	-74.6	115.7	175.9	-63	-176.4	-179.6	-149.4	-2.5	111.2	S436	S436-R438 PolarHBondContact O-N 3.19Å
439	G	49	Very low	68	Low	45 Å²	45	91.4 Å²	91.4	46%	0.464	46%	0.464	S	S	.	.			trans	-71.3	145.1	165.5	0	0	0	0	0	111.4	H437 E441	H437-G439 PolarHBondContact O-N 2.79Å; G439-E441 PolarHBondContact O-N 3.12Å; G439-E441 VanDerWaalsContact O-N 3.11Å
440	P	48.8	Very low	67.3	Low	127 Å²	127	92.3 Å²	92.3	83%	0.825	47%	0.468	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.5	1.5	178.3	30.8	-36.3	0	0	0	114.1
441	E	49.8	Very low	66.4	Low	183 Å²	183	96.7 Å²	96.7	86%	0.855	49%	0.488	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.9	-9.7	-178.9	-57.6	-166.6	146.1	0	0	113.7	G439	G439-E441 PolarHBondContact O-N 3.12Å; G439-E441 VanDerWaalsContact O-N 3.11Å
442	D	53.3	Low	65.9	Low	83 Å²	83	95 Å²	95	44%	0.444	48%	0.483	S	S	.	.			trans	-89.6	6.7	-175	-113.7	-15.5	0	0	0	114.9	G444 R447	D442-G444 PolarHBondContact O-N 3.31Å; D442-R447 IonicContact OD1-CZ 2.6Å; D442-R447 IonicContact OD1-NH1 3.65Å; D442-R447 PolarHBondContact OD1-NH1 3.39Å
443	E	47.1	Very low	65.4	Low	195 Å²	195	96.6 Å²	96.6	91%	0.911	49%	0.493	S	S	*	.			trans	-74	43	168	-64.6	-158.1	152.2	0	0	112.6
444	G	56	Low	65.2	Low	45 Å²	45	97.3 Å²	97.3	46%	0.464	50%	0.499	S	S	.	.			trans	-82.3	179.2	175.3	0	0	0	0	0	113.9	D442	D442-G444 PolarHBondContact O-N 3.31Å
445	L	51.7	Low	65.4	Low	156 Å²	156	94.2 Å²	94.2	82%	0.817	48%	0.483	S	S	*	.	S	Bend	trans	-53.7	149.6	170.7	-72.6	164	0	0	0	111.4	R447	L445-R447 WeakPolarHBondContact O-CG 3.49Å; L445-R447 PolarHBondContact O-N 3.49Å
446	P	54.5	Low	65.8	Low	124 Å²	124	96.6 Å²	96.6	81%	0.805	50%	0.502	S	S	*	.			trans	-65.8	92.3	-178.3	27	-35.4	0	0	0	112
447	R	67.2	Low	66.9	Low	129 Å²	129	95.2 Å²	95.2	49%	0.487	49%	0.49	S	S	.	.			trans	-70.1	150.3	173	-59.1	174.9	-170.4	142.3	0.1	110.2	D442 L445 Q451	D442-R447 IonicContact OD1-CZ 2.6Å; D442-R447 IonicContact OD1-NH1 3.65Å; D442-R447 PolarHBondContact OD1-NH1 3.39Å; L445-R447 WeakPolarHBondContact O-CG 3.49Å; L445-R447 PolarHBondContact O-N 3.49Å; R447-Q451 HydrophobicContact CB-CB 3.85Å; R447-Q451 WeakPolarHBondContact CB-O 3Å; R447-Q451 WeakPolarHBondContact CD-O 3.47Å; R447-Q451 HydrophobicContact CG-CB 4.23Å
448	R	67	Low	68.7	Low	204 Å²	204	89.4 Å²	89.4	77%	0.77	46%	0.463	S	S	*	.			trans	-132.4	163.7	179.5	-70.5	-170.4	176.8	-153.8	-1.5	111.2	R450 Q451	R448-R450 PolarHBondContact O-N 2.82Å; R448-Q451 PolarHBondContact O-N 3.39Å
449	G	75.1	Confident	70.4	Confident	8 Å²	8	81.2 Å²	81.2	8%	0.082	43%	0.433	C	S	.	.	G	3₁₀ helix	trans	51.6	-132.8	179.9	0	0	0	0	0	111.2	Q451 S452 T494	G449-Q451 PolarHBondContact O-N 3.2Å; G449-S452 VanDerWaalsContact O-CB 3.29Å; G449-S452 WeakPolarHBondContact O-CB 3.41Å; G449-S452 PolarHBondContact O-N 3.37Å; G449-S452 PolarHBondContact O-OG 2.94Å; G449-T494 WeakPolarHBondContact O-CG2 3.14Å
450	R	81.8	Confident	72.5	Confident	20 Å²	20	81 Å²	81	8%	0.075	42%	0.423	C	S	.	.	G	3₁₀ helix	trans	-43.2	-34.5	179.1	-178.1	173.1	-171.2	96.5	24.3	115.2	R448 L498 D501 E507	R448-R450 PolarHBondContact O-N 2.82Å; R450-L498 HydrophobicContact CG-CD2 4.07Å; R450-L498 PolarHBondContact NH1-O 2.7Å; R450-D501 PolarHBondContact NH1-O 2.9Å; R450-E507 IonicContact CZ-OE1 3.19Å; R450-E507 VanDerWaalsContact CZ-OE1 3.28Å; R450-E507 IonicContact CZ-OE2 2.87Å; R450-E507 VanDerWaalsContact NE-CD 3.3Å; R450-E507 IonicContact NE-OE1 3.74Å; R450-E507 PolarHBondContact NE-OE1 3.02Å; R450-E507 IonicContact NE-OE2 3.07Å; R450-E507 PolarHBondContact NE-OE2 3.48Å; R450-E507 IonicContact NH2-OE1 3.02Å; R450-E507 PolarHBondContact NH2-OE1 3.32Å
451	Q	76.3	Confident	74.7	Confident	92 Å²	92	75.3 Å²	75.3	43%	0.43	39%	0.385	S	S	.	.	G	3₁₀ helix	trans	-93.1	-3.2	-174.8	-61.7	178.5	18	0	0	113.8	R447 R448 G449 M504	R447-Q451 HydrophobicContact CB-CB 3.85Å; R447-Q451 WeakPolarHBondContact CB-O 3Å; R447-Q451 WeakPolarHBondContact CD-O 3.47Å; R447-Q451 HydrophobicContact CG-CB 4.23Å; R448-Q451 PolarHBondContact O-N 3.39Å; G449-Q451 PolarHBondContact O-N 3.2Å; Q451-M504 VanDerWaalsContact NE2-CG 3.25Å
452	S	82.1	Confident	76.9	Confident	18 Å²	18	66.8 Å²	66.8	13%	0.126	35%	0.346	C	S	.	.	S	Bend	trans	-66.6	163.4	-179.2	74.5	0	0	0	0	112.2	G449 N454 G455 S456 T494	G449-S452 VanDerWaalsContact O-CB 3.29Å; G449-S452 WeakPolarHBondContact O-CB 3.41Å; G449-S452 PolarHBondContact O-N 3.37Å; G449-S452 PolarHBondContact O-OG 2.94Å; S452-N454 PolarHBondContact O-N 2.71Å; S452-N454 PolarHBondContact OG-N 3.33Å; S452-G455 WeakPolarHBondContact O-CA 3.48Å; S452-G455 PolarHBondContact O-N 3.14Å; S452-G455 PolarHBondContact OG-N 3.31Å; S452-S456 PolarHBondContact O-N 3.22Å; S452-T494 PolarHBondContact OG-OG1 3.12Å
453	L	81.3	Confident	78.8	Confident	79 Å²	79	67.2 Å²	67.2	41%	0.414	34%	0.344	S	S	.	.	H	α-helix	trans	-55.5	-42.1	169.7	177.1	62.1	0	0	0	111	G455 S456 L457	L453-G455 PolarHBondContact O-N 2.77Å; L453-S456 WeakPolarHBondContact O-CB 3.31Å; L453-S456 PolarHBondContact O-N 3.13Å; L453-S456 VanDerWaalsContact O-N 3.13Å; L453-L457 HydrophobicContact CG-CD1 4.23Å; L453-L457 WeakPolarHBondContact O-CG 3.35Å; L453-L457 PolarHBondContact O-N 2.91Å; L453-L457 VanDerWaalsContact O-N 3.08Å
454	N	85.9	Confident	81.1	Confident	51 Å²	51	58.8 Å²	58.8	27%	0.273	30%	0.304	S	S	.	.	H	α-helix	trans	-60.4	-32.9	174.9	-69.5	-1	0	0	0	111.9	S452 S456 L457 I458 L488 D491	S452-N454 PolarHBondContact O-N 2.71Å; S452-N454 PolarHBondContact OG-N 3.33Å; N454-S456 VanDerWaalsContact C-N 3.33Å; N454-S456 PolarHBondContact O-N 2.94Å; N454-L457 PolarHBondContact O-N 2.8Å; N454-I458 VanDerWaalsContact O-CB 3.31Å; N454-I458 WeakPolarHBondContact O-CB 3.35Å; N454-I458 WeakPolarHBondContact O-CD1 3.42Å; N454-I458 VanDerWaalsContact O-CG1 3.24Å; N454-I458 WeakPolarHBondContact O-CG1 3.28Å; N454-I458 PolarHBondContact O-N 2.78Å; N454-L488 HydrophobicContact CB-CD1 3.76Å; N454-D491 VanDerWaalsContact CB-OD2 3.27Å; N454-D491 WeakPolarHBondContact CB-OD2 3.36Å; N454-D491 PolarHBondContact ND2-OD2 3.29Å
455	G	88.1	Confident	82.9	Confident	1 Å²	1	57.3 Å²	57.3	1%	0.01	29%	0.285	C	S	.	.	H	α-helix	trans	-63.3	-38.3	175.6	0	0	0	0	0	112.8	S452 L453 K459	S452-G455 WeakPolarHBondContact O-CA 3.48Å; S452-G455 PolarHBondContact O-N 3.14Å; S452-G455 PolarHBondContact OG-N 3.31Å; L453-G455 PolarHBondContact O-N 2.77Å; G455-K459 WeakPolarHBondContact O-CG 3.29Å; G455-K459 PolarHBondContact O-N 3.41Å
456	S	87.3	Confident	85	Confident	68 Å²	68	52.7 Å²	52.7	48%	0.476	26%	0.261	S	S	.	.	H	α-helix	trans	-66.4	-48.7	171.9	-164.1	0	0	0	0	111.3	S452 L453 N454 I458 K459 T460	S452-S456 PolarHBondContact O-N 3.22Å; L453-S456 WeakPolarHBondContact O-CB 3.31Å; L453-S456 PolarHBondContact O-N 3.13Å; L453-S456 VanDerWaalsContact O-N 3.13Å; N454-S456 VanDerWaalsContact C-N 3.33Å; N454-S456 PolarHBondContact O-N 2.94Å; S456-I458 PolarHBondContact O-N 3.47Å; S456-K459 WeakPolarHBondContact O-CB 3.24Å; S456-K459 PolarHBondContact O-N 3.3Å; S456-K459 VanDerWaalsContact O-N 3.14Å; S456-T460 PolarHBondContact O-N 3.12Å; S456-T460 PolarHBondContact O-OG1 3.26Å
457	L	90.7	Very high	86.8	Confident	29 Å²	29	54 Å²	54	15%	0.152	26%	0.256	C	S	.	.	H	α-helix	trans	-66.6	-33.1	-178.6	-63.7	178.8	0	0	0	113.4	F435 L453 N454 T460 T461 L488	F435-L457 HydrophobicContact CB-CD2 4.2Å; F435-L457 HydrophobicContact CD1-CB 4Å; F435-L457 HydrophobicContact CD1-CD2 3.87Å; F435-L457 HydrophobicContact CD1-CG 4.33Å; F435-L457 HydrophobicContact CE1-CB 4.32Å; F435-L457 WeakPolarHBondContact CE1-O 3.42Å; F435-L457 HydrophobicContact CG-CD2 4.37Å; L453-L457 HydrophobicContact CG-CD1 4.23Å; L453-L457 WeakPolarHBondContact O-CG 3.35Å; L453-L457 PolarHBondContact O-N 2.91Å; L453-L457 VanDerWaalsContact O-N 3.08Å; N454-L457 PolarHBondContact O-N 2.8Å; L457-T460 WeakPolarHBondContact O-CB 3.38Å; L457-T460 PolarHBondContact O-N 3.04Å; L457-T461 PolarHBondContact O-N 2.99Å; L457-T461 PolarHBondContact O-OG1 2.73Å; L457-L488 HydrophobicContact CB-CD1 3.74Å; L457-L488 HydrophobicContact CB-CD2 3.86Å; L457-L488 HydrophobicContact CB-CG 4.48Å; L457-L488 HydrophobicContact CD1-CD1 4.47Å
458	I	93.5	Very high	87.7	Confident	4 Å²	4	48.5 Å²	48.5	2%	0.021	24%	0.238	C	C	.	.	H	α-helix	trans	-64.6	-45.2	171.3	-75.2	160.2	0	0	0	109.9	N454 S456 T460 T461 V462 L488 D491 T494 M495 L498 L518	N454-I458 VanDerWaalsContact O-CB 3.31Å; N454-I458 WeakPolarHBondContact O-CB 3.35Å; N454-I458 WeakPolarHBondContact O-CD1 3.42Å; N454-I458 VanDerWaalsContact O-CG1 3.24Å; N454-I458 WeakPolarHBondContact O-CG1 3.28Å; N454-I458 PolarHBondContact O-N 2.78Å; S456-I458 PolarHBondContact O-N 3.47Å; I458-T460 VanDerWaalsContact C-N 3.32Å; I458-T460 PolarHBondContact O-N 3.39Å; I458-T461 WeakPolarHBondContact O-CB 3.5Å; I458-T461 PolarHBondContact O-N 2.85Å; I458-T461 VanDerWaalsContact O-N 3.13Å; I458-V462 WeakPolarHBondContact O-CG2 3.37Å; I458-V462 PolarHBondContact O-N 3.18Å; I458-L488 HydrophobicContact CD1-CD1 4.34Å; I458-L488 HydrophobicContact CG1-CD1 3.85Å; I458-L488 HydrophobicContact CG1-CG 4.22Å; I458-D491 HydrophobicContact CD1-CB 4.47Å; I458-T494 HydrophobicContact CD1-CG2 3.73Å; I458-M495 HydrophobicContact CD1-CE 4.16Å; I458-M495 HydrophobicContact CD1-CG 3.81Å; I458-M495 HydrophobicContact CG1-CE 4.26Å; I458-M495 HydrophobicContact CG2-CG 4.36Å; I458-L498 HydrophobicContact CB-CD1 3.99Å; I458-L498 HydrophobicContact CG2-CD1 3.56Å; I458-L518 HydrophobicContact CG2-CD1 3.43Å; I458-L518 VanDerWaalsContact CG2-CD1 3.43Å
459	K	92.6	Very high	88.6	Confident	45 Å²	45	46.7 Å²	46.7	20%	0.196	24%	0.238	C	C	.	.	H	α-helix	trans	-57.6	-44.8	171.9	-70.6	-178.4	-173.5	-173	0	111	G455 S456 T461 V462 F463 L498 E507 L510	G455-K459 WeakPolarHBondContact O-CG 3.29Å; G455-K459 PolarHBondContact O-N 3.41Å; S456-K459 WeakPolarHBondContact O-CB 3.24Å; S456-K459 PolarHBondContact O-N 3.3Å; S456-K459 VanDerWaalsContact O-N 3.14Å; K459-T461 VanDerWaalsContact C-N 3.3Å; K459-T461 PolarHBondContact O-N 3.27Å; K459-V462 WeakPolarHBondContact O-CB 3.46Å; K459-V462 PolarHBondContact O-N 2.68Å; K459-V462 VanDerWaalsContact O-N 3.12Å; K459-F463 HydrophobicContact CB-CD2 4.44Å; K459-F463 HydrophobicContact CB-CE2 4.33Å; K459-F463 WeakPolarHBondContact O-CD2 3.27Å; K459-F463 PolarHBondContact O-N 3Å; K459-L498 HydrophobicContact CD-CD2 4.41Å; K459-L498 VanDerWaalsContact CE-CD2 3.44Å; K459-L498 HydrophobicContact CG-CD2 4.2Å; K459-E507 IonicContact NZ-OE1 3.01Å; K459-E507 PolarHBondContact NZ-OE1 3.08Å; K459-L510 HydrophobicContact CD-CD2 4.29Å; K459-L510 HydrophobicContact CG-CD2 4.11Å
460	T	92.8	Very high	88.8	Confident	41 Å²	41	50.8 Å²	50.8	25%	0.252	26%	0.258	S	S	.	.	H	α-helix	trans	-58.3	-38.8	175.4	-52.8	0	0	0	0	112.7	L434 F435 S456 L457 I458 F463 F464	L434-T460 HydrophobicContact CB-CG2 4.39Å; F435-T460 HydrophobicContact CZ-CG2 4.44Å; S456-T460 PolarHBondContact O-N 3.12Å; S456-T460 PolarHBondContact O-OG1 3.26Å; L457-T460 WeakPolarHBondContact O-CB 3.38Å; L457-T460 PolarHBondContact O-N 3.04Å; I458-T460 VanDerWaalsContact C-N 3.32Å; I458-T460 PolarHBondContact O-N 3.39Å; T460-F463 PolarHBondContact O-N 3.11Å; T460-F464 WeakPolarHBondContact O-CB 3.39Å; T460-F464 PolarHBondContact O-N 3.39Å
461	T	94.1	Very high	89	Confident	6 Å²	6	52.7 Å²	52.7	4%	0.037	27%	0.267	C	S	.	.	H	α-helix	trans	-65.3	-40.9	175.2	-46.6	0	0	0	0	111.6	F435 L457 I458 K459 F464 F465 L477 L481 I521	F435-T461 VanDerWaalsContact CE1-OG1 3.31Å; F435-T461 WeakPolarHBondContact CE1-OG1 3.5Å; F435-T461 WeakPolarHBondContact CZ-OG1 3.37Å; L457-T461 PolarHBondContact O-N 2.99Å; L457-T461 PolarHBondContact O-OG1 2.73Å; I458-T461 WeakPolarHBondContact O-CB 3.5Å; I458-T461 PolarHBondContact O-N 2.85Å; I458-T461 VanDerWaalsContact O-N 3.13Å; K459-T461 VanDerWaalsContact C-N 3.3Å; K459-T461 PolarHBondContact O-N 3.27Å; T461-F464 PolarHBondContact O-N 3.12Å; T461-F465 WeakPolarHBondContact O-CB 3.35Å; T461-F465 PolarHBondContact O-N 3.22Å; T461-L477 HydrophobicContact CG2-CD2 4.35Å; T461-L481 HydrophobicContact CG2-CD1 4.25Å; T461-I521 HydrophobicContact CG2-CD1 4.29Å
462	V	95.9	Very high	89.4	Confident	4 Å²	4	57.6 Å²	57.6	2%	0.024	29%	0.29	C	S	.	.	H	α-helix	trans	-66	-42.8	176.5	169.4	0	0	0	0	111.8	I458 K459 L466 Q514 A517 L518 I521	I458-V462 WeakPolarHBondContact O-CG2 3.37Å; I458-V462 PolarHBondContact O-N 3.18Å; K459-V462 WeakPolarHBondContact O-CB 3.46Å; K459-V462 PolarHBondContact O-N 2.68Å; K459-V462 VanDerWaalsContact O-N 3.12Å; V462-L466 HydrophobicContact CG1-CD1 4.06Å; V462-L466 WeakPolarHBondContact O-CG 3.47Å; V462-L466 PolarHBondContact O-N 2.96Å; V462-L466 VanDerWaalsContact O-N 3.11Å; V462-Q514 HydrophobicContact CG1-CB 3.79Å; V462-Q514 HydrophobicContact CG1-CG 3.92Å; V462-A517 HydrophobicContact CG1-CB 3.88Å; V462-L518 HydrophobicContact CG2-CB 3.9Å; V462-L518 HydrophobicContact CG2-CD1 4.07Å; V462-I521 HydrophobicContact CG2-CD1 3.97Å
463	F	94.3	Very high	89.8	Confident	93 Å²	93	60.1 Å²	60.1	41%	0.408	30%	0.3	S	S	.	.	H	α-helix	trans	-60	-51.8	172.9	-79	-70.7	0	0	0	111	K459 T460 F465 L466 E467 Q514	K459-F463 HydrophobicContact CB-CD2 4.44Å; K459-F463 HydrophobicContact CB-CE2 4.33Å; K459-F463 WeakPolarHBondContact O-CD2 3.27Å; K459-F463 PolarHBondContact O-N 3Å; T460-F463 PolarHBondContact O-N 3.11Å; F463-F465 VanDerWaalsContact C-N 3.31Å; F463-F465 PolarHBondContact O-N 2.92Å; F463-L466 PolarHBondContact O-N 2.94Å; F463-E467 WeakPolarHBondContact O-CB 3.29Å; F463-E467 WeakPolarHBondContact O-CG 3.49Å; F463-E467 PolarHBondContact O-N 2.98Å; F463-Q514 VanDerWaalsContact CZ-NE2 3.27Å
464	F	94.6	Very high	90.3	Very high	17 Å²	17	56.4 Å²	56.4	8%	0.075	28%	0.28	C	S	.	.	H	α-helix	trans	-55.7	-44.2	179	175.8	-89.9	0	0	0	112.7	Y412 V415 L430 L434 T460 T461 S468 L477	Y412-F464 AromaticContact CD2-CE2 3.85Å; Y412-F464 HydrophobicContact CD2-CE2 3.85Å; Y412-F464 AromaticContact CG-CE2 3.81Å; Y412-F464 HydrophobicContact CG-CE2 3.81Å; Y412-F464 HydrophobicContact CG-CZ 4.42Å; V415-F464 HydrophobicContact CG2-CE1 3.98Å; V415-F464 HydrophobicContact CG2-CZ 4.14Å; L430-F464 HydrophobicContact CD1-CD2 3.68Å; L430-F464 HydrophobicContact CD1-CE2 3.45Å; L430-F464 VanDerWaalsContact CD1-CE2 3.45Å; L430-F464 HydrophobicContact CD1-CG 4.37Å; L430-F464 HydrophobicContact CD1-CZ 4Å; L430-F464 HydrophobicContact CD2-CD1 3.98Å; L430-F464 HydrophobicContact CD2-CD2 4.25Å; L430-F464 HydrophobicContact CD2-CE1 3.64Å; L430-F464 HydrophobicContact CD2-CE2 3.91Å; L430-F464 HydrophobicContact CD2-CG 4.28Å; L430-F464 HydrophobicContact CD2-CZ 3.6Å; L430-F464 HydrophobicContact CG-CE2 4.35Å; L430-F464 HydrophobicContact CG-CZ 4.47Å; L434-F464 HydrophobicContact CD1-CD2 4.17Å; T460-F464 WeakPolarHBondContact O-CB 3.39Å; T460-F464 PolarHBondContact O-N 3.39Å; T461-F464 PolarHBondContact O-N 3.12Å; F464-S468 WeakPolarHBondContact O-CB 3.35Å; F464-S468 PolarHBondContact O-N 3.41Å; F464-S468 VanDerWaalsContact O-N 3.17Å; F464-S468 PolarHBondContact O-OG 3.2Å; F464-L477 HydrophobicContact CD1-CD1 3.94Å; F464-L477 HydrophobicContact CD1-CD2 3.93Å; F464-L477 HydrophobicContact CE1-CD1 3.7Å; F464-L477 HydrophobicContact CE1-CD2 4.3Å
465	F	95.3	Very high	90.7	Very high	15 Å²	15	54.3 Å²	54.3	7%	0.066	27%	0.27	C	S	.	.	H	α-helix	trans	-59.4	-52.6	176.7	176.1	-113.9	0	0	0	111.3	T461 F463 E467 S468 H473 L477 A517 I521	T461-F465 WeakPolarHBondContact O-CB 3.35Å; T461-F465 PolarHBondContact O-N 3.22Å; F463-F465 VanDerWaalsContact C-N 3.31Å; F463-F465 PolarHBondContact O-N 2.92Å; F465-E467 PolarHBondContact O-N 2.83Å; F465-S468 PolarHBondContact O-N 3.09Å; F465-S468 PolarHBondContact O-OG 3.22Å; F465-H473 WeakPolarHBondContact CE2-O 3.48Å; F465-L477 HydrophobicContact CB-CD2 3.79Å; F465-L477 HydrophobicContact CD2-CD2 4.03Å; F465-L477 HydrophobicContact CG-CD2 4.31Å; F465-A517 HydrophobicContact CD1-CB 3.73Å; F465-A517 HydrophobicContact CE1-CB 4.04Å; F465-I521 HydrophobicContact CB-CD1 4.02Å; F465-I521 HydrophobicContact CD1-CD1 4.29Å; F465-I521 HydrophobicContact CG-CD1 4.22Å
466	L	94.1	Very high	91.1	Very high	59 Å²	59	55.7 Å²	55.7	31%	0.309	28%	0.276	S	S	.	.	H	α-helix	trans	-65.7	-35.3	-179.1	-72.2	171.7	0	0	0	114	V462 F463 S468 Q514 A517	V462-L466 HydrophobicContact CG1-CD1 4.06Å; V462-L466 WeakPolarHBondContact O-CG 3.47Å; V462-L466 PolarHBondContact O-N 2.96Å; V462-L466 VanDerWaalsContact O-N 3.11Å; F463-L466 PolarHBondContact O-N 2.94Å; L466-S468 VanDerWaalsContact C-N 3.3Å; L466-Q514 HydrophobicContact CD1-CB 4.42Å; L466-Q514 HydrophobicContact CD1-CG 3.68Å; L466-A517 HydrophobicContact CD1-CB 4.11Å; L466-A517 HydrophobicContact CD2-CB 3.98Å; L466-A517 HydrophobicContact CG-CB 3.92Å
467	E	92.3	Very high	91.6	Very high	150 Å²	150	52.5 Å²	52.5	70%	0.701	25%	0.253	S	S	*	.	H	α-helix	trans	-75	-19.7	178.5	-72.6	178.4	164	0	0	112.8	F463 F465	F463-E467 WeakPolarHBondContact O-CB 3.29Å; F463-E467 WeakPolarHBondContact O-CG 3.49Å; F463-E467 PolarHBondContact O-N 2.98Å; F465-E467 PolarHBondContact O-N 2.83Å
468	S	86.7	Confident	91.9	Very high	14 Å²	14	51.2 Å²	51.2	10%	0.098	25%	0.246	C	C	.	.	T	Hydrogen-bonded Turn	trans	-77.9	-19.1	-173	69	0	0	0	0	115.4	Y416 F464 F465 L466 L470	Y416-S468 WeakPolarHBondContact CE2-OG 3.44Å; Y416-S468 PolarHBondContact OH-OG 3.11Å; F464-S468 WeakPolarHBondContact O-CB 3.35Å; F464-S468 PolarHBondContact O-N 3.41Å; F464-S468 VanDerWaalsContact O-N 3.17Å; F464-S468 PolarHBondContact O-OG 3.2Å; F465-S468 PolarHBondContact O-N 3.09Å; F465-S468 PolarHBondContact O-OG 3.22Å; L466-S468 VanDerWaalsContact C-N 3.3Å; S468-L470 WeakPolarHBondContact O-CG 3.43Å; S468-L470 PolarHBondContact O-N 3.24Å
469	E	85.2	Confident	92.2	Very high	166 Å²	166	51 Å²	51	78%	0.776	25%	0.245	S	C	*	.			trans	46.2	13.1	177.9	-62.1	-166.9	162.5	0	0	117.3
470	L	81.1	Confident	92.4	Very high	94 Å²	94	48.9 Å²	48.9	49%	0.492	24%	0.236	S	C	.	.	S	Bend	trans	-100.6	-19.8	-174.7	-78.1	177.6	0	0	0	115	H413 Y416 S468	H413-L470 HydrophobicContact CB-CD1 3.69Å; H413-L470 WeakPolarHBondContact CD2-CD1 3.28Å; Y416-L470 HydrophobicContact CD2-CB 3.99Å; Y416-L470 HydrophobicContact CD2-CD1 4.03Å; Y416-L470 HydrophobicContact CE2-CB 4.22Å; S468-L470 WeakPolarHBondContact O-CG 3.43Å; S468-L470 PolarHBondContact O-N 3.24Å
471	H	84.4	Confident	92.6	Very high	60 Å²	60	47.1 Å²	47.1	28%	0.278	23%	0.225	S	C	.	.			trans	-146.3	141.8	178.7	-86.5	-92.9	0	0	0	110.7	Y416 H473 Y476	Y416-H471 HydrophobicContact CD1-CB 4.05Å; Y416-H471 AromaticContact CD1-CD2 3.24Å; Y416-H471 WeakPolarHBondContact CD1-CD2 3.44Å; Y416-H471 AromaticContact CD1-CG 3.77Å; Y416-H471 AromaticContact CD1-NE2 3.96Å; Y416-H471 HydrophobicContact CE1-CB 3.9Å; Y416-H471 AromaticContact CE1-CD2 3.97Å; Y416-H471 AromaticContact CG-CD2 3.41Å; Y416-H471 VanDerWaalsContact CG-CD2 3.41Å; H471-H473 AromaticContact ND1-NE2 3.67Å; H471-Y476 AromaticContact CE1-CD2 3.46Å; H471-Y476 VanDerWaalsContact CE1-CD2 3.46Å; H471-Y476 WeakPolarHBondContact CE1-CD2 3.19Å; H471-Y476 AromaticContact CE1-CE2 3.76Å; H471-Y476 AromaticContact ND1-CD2 3.72Å
472	E	84.9	Confident	92.7	Very high	195 Å²	195	48.8 Å²	48.8	91%	0.911	23%	0.231	S	C	*	.	S	Bend	trans	-86.8	-11.9	178.6	-58.4	-179.9	139	0	0	112.7
473	H	90.1	Very high	92.6	Very high	72 Å²	72	54.7 Å²	54.7	33%	0.333	26%	0.258	S	S	.	.	S	Bend	trans	-128.9	147	-178.1	69.9	82.5	0	0	0	112.9	F465 H471 A475 Y476	F465-H473 WeakPolarHBondContact CE2-O 3.48Å; H471-H473 AromaticContact ND1-NE2 3.67Å; H473-A475 WeakPolarHBondContact ND1-CB 3.41Å; H473-A475 PolarHBondContact O-N 2.92Å; H473-Y476 AromaticContact CE1-CD2 3.44Å; H473-Y476 VanDerWaalsContact CE1-CD2 3.44Å; H473-Y476 WeakPolarHBondContact CE1-CD2 3.4Å; H473-Y476 AromaticContact CE1-CE2 3.45Å; H473-Y476 VanDerWaalsContact CE1-CE2 3.45Å; H473-Y476 WeakPolarHBondContact CE1-CE2 3.36Å; H473-Y476 AromaticContact NE2-CE2 3.8Å
474	G	92.7	Very high	92.5	Very high	0 Å²	0	52.1 Å²	52.1	0%	0	25%	0.251	C	S	.	.	S	Bend	trans	-79.4	-15.6	-170.8	0	0	0	0	0	115.3	Y476 L477 V478 E520	G474-Y476 VanDerWaalsContact C-N 3.32Å; G474-Y476 PolarHBondContact O-N 3.02Å; G474-Y476 VanDerWaalsContact O-N 3.1Å; G474-L477 WeakPolarHBondContact O-CB 3.39Å; G474-L477 PolarHBondContact O-N 2.94Å; G474-V478 WeakPolarHBondContact O-CG2 3.48Å; G474-V478 PolarHBondContact O-N 2.88Å; G474-E520 WeakPolarHBondContact CA-OE1 3.46Å; G474-E520 VanDerWaalsContact N-CG 3.31Å; G474-E520 PolarHBondContact N-OE1 3.36Å
475	A	95.1	Very high	92.5	Very high	8 Å²	8	51.5 Å²	51.5	7%	0.066	25%	0.249	C	C	.	.	H	α-helix	trans	-45.8	-45.1	-171.9	0	0	0	0	0	115.8	H473 D479 E520 S524 P535	H473-A475 WeakPolarHBondContact ND1-CB 3.41Å; H473-A475 PolarHBondContact O-N 2.92Å; A475-D479 PolarHBondContact O-N 3.45Å; A475-D479 VanDerWaalsContact O-N 3.15Å; A475-E520 PolarHBondContact N-OE1 3.46Å; A475-S524 WeakPolarHBondContact CA-OG 3.32Å; A475-S524 PolarHBondContact N-OG 3.27Å; A475-P535 HydrophobicContact CB-CB 4.41Å
476	Y	96.3	Very high	92.3	Very high	30 Å²	30	52.6 Å²	52.6	12%	0.118	26%	0.259	C	S	.	.	H	α-helix	trans	-77.3	-31.4	-178.3	-67.2	-53.2	0	0	0	113.4	H471 H473 G474 S480 P535 R538	H471-Y476 AromaticContact CE1-CD2 3.46Å; H471-Y476 VanDerWaalsContact CE1-CD2 3.46Å; H471-Y476 WeakPolarHBondContact CE1-CD2 3.19Å; H471-Y476 AromaticContact CE1-CE2 3.76Å; H471-Y476 AromaticContact ND1-CD2 3.72Å; H473-Y476 AromaticContact CE1-CD2 3.44Å; H473-Y476 VanDerWaalsContact CE1-CD2 3.44Å; H473-Y476 WeakPolarHBondContact CE1-CD2 3.4Å; H473-Y476 AromaticContact CE1-CE2 3.45Å; H473-Y476 VanDerWaalsContact CE1-CE2 3.45Å; H473-Y476 WeakPolarHBondContact CE1-CE2 3.36Å; H473-Y476 AromaticContact NE2-CE2 3.8Å; G474-Y476 VanDerWaalsContact C-N 3.32Å; G474-Y476 PolarHBondContact O-N 3.02Å; G474-Y476 VanDerWaalsContact O-N 3.1Å; Y476-S480 WeakPolarHBondContact O-CB 3.45Å; Y476-S480 PolarHBondContact O-N 3.3Å; Y476-S480 VanDerWaalsContact O-N 3.16Å; Y476-S480 PolarHBondContact O-OG 2.92Å; Y476-P535 HydrophobicContact CD1-CB 4.25Å; Y476-P535 HydrophobicContact CD1-CG 3.62Å; Y476-P535 HydrophobicContact CE1-CB 3.94Å; Y476-P535 HydrophobicContact CE1-CG 3.73Å; Y476-R538 HydrophobicContact CD1-CG 4.35Å; Y476-R538 HydrophobicContact CE1-CG 4.3Å; Y476-R538 PolarHBondContact O-NH1 3.25Å
477	L	97.2	Very high	92.1	Very high	1 Å²	1	58.2 Å²	58.2	1%	0.005	28%	0.283	C	S	.	.	H	α-helix	trans	-67.8	-45	172.9	175.1	58.7	0	0	0	110.8	V415 Y416 L430 T461 F464 F465 G474 D479 S480 L481	V415-L477 HydrophobicContact CB-CD1 4.42Å; V415-L477 HydrophobicContact CG2-CD1 3.85Å; Y416-L477 HydrophobicContact CE1-CB 4.01Å; L430-L477 HydrophobicContact CD2-CD1 4.27Å; T461-L477 HydrophobicContact CG2-CD2 4.35Å; F464-L477 HydrophobicContact CD1-CD1 3.94Å; F464-L477 HydrophobicContact CD1-CD2 3.93Å; F464-L477 HydrophobicContact CE1-CD1 3.7Å; F464-L477 HydrophobicContact CE1-CD2 4.3Å; F465-L477 HydrophobicContact CB-CD2 3.79Å; F465-L477 HydrophobicContact CD2-CD2 4.03Å; F465-L477 HydrophobicContact CG-CD2 4.31Å; G474-L477 WeakPolarHBondContact O-CB 3.39Å; G474-L477 PolarHBondContact O-N 2.94Å; L477-D479 PolarHBondContact O-N 2.92Å; L477-S480 PolarHBondContact O-N 3.01Å; L477-L481 HydrophobicContact CD1-CD1 3.76Å; L477-L481 HydrophobicContact CD1-CG 4.24Å; L477-L481 HydrophobicContact CG-CD1 4.16Å; L477-L481 PolarHBondContact O-N 3.48Å
478	V	97.8	Very high	92.2	Very high	1 Å²	1	51.6 Å²	51.6	1%	0.006	25%	0.253	C	S	.	.	H	α-helix	trans	-59.7	-45.7	177.4	172.3	0	0	0	0	111.1	G474 S480 L481 W482 L489 I521 A525	G474-V478 WeakPolarHBondContact O-CG2 3.48Å; G474-V478 PolarHBondContact O-N 2.88Å; V478-S480 PolarHBondContact O-N 3.46Å; V478-L481 CarbonylContact O-C 3.58Å; V478-L481 PolarHBondContact O-N 3.46Å; V478-W482 HydrophobicContact CG1-CE3 3.89Å; V478-W482 HydrophobicContact CG1-CZ3 4.01Å; V478-W482 PolarHBondContact O-N 3.04Å; V478-L489 HydrophobicContact CG1-CD1 4.36Å; V478-I521 HydrophobicContact CG2-CG2 4.26Å; V478-A525 HydrophobicContact CG1-CB 4.06Å
479	D	97.9	Very high	92.6	Very high	0 Å²	0	51.1 Å²	51.1	0%	0	25%	0.249	C	C	.	.	H	α-helix	trans	-65.5	-37.6	177.7	173.7	62.4	0	0	0	113.5	R420 A475 L477 L481 W482 Q528 P535 R538	R420-D479 WeakPolarHBondContact CD-OD2 3.18Å; R420-D479 IonicContact CZ-OD1 3.27Å; R420-D479 VanDerWaalsContact CZ-OD1 3.28Å; R420-D479 IonicContact CZ-OD2 2.7Å; R420-D479 VanDerWaalsContact NE-CG 3.3Å; R420-D479 IonicContact NE-OD1 2.73Å; R420-D479 PolarHBondContact NE-OD1 3.16Å; R420-D479 IonicContact NE-OD2 3.06Å; R420-D479 PolarHBondContact NE-OD2 3.05Å; R420-D479 IonicContact NH2-OD1 3.72Å; R420-D479 PolarHBondContact NH2-OD1 3.28Å; A475-D479 PolarHBondContact O-N 3.45Å; A475-D479 VanDerWaalsContact O-N 3.15Å; L477-D479 PolarHBondContact O-N 2.92Å; D479-L481 VanDerWaalsContact C-N 3.31Å; D479-L481 PolarHBondContact O-N 2.82Å; D479-W482 VanDerWaalsContact O-CB 3.26Å; D479-W482 WeakPolarHBondContact O-CB 3.48Å; D479-W482 PolarHBondContact O-N 3.44Å; D479-Q528 VanDerWaalsContact CA-OE1 3.24Å; D479-Q528 PolarHBondContact OD1-NE2 3.45Å; D479-P535 HydrophobicContact CB-CG 4.07Å; D479-R538 WeakPolarHBondContact OD2-CD 3.24Å; D479-R538 IonicContact OD2-CZ 3.48Å; D479-R538 IonicContact OD2-NE 2.77Å; D479-R538 IonicContact OD2-NH1 3.19Å; D479-R538 PolarHBondContact OD2-NH1 2.92Å
480	S	97.9	Very high	93.1	Very high	0 Å²	0	44.6 Å²	44.6	0%	0	22%	0.218	C	C	.	.	H	α-helix	trans	-64.7	-36.4	176.4	-66.6	0	0	0	0	112.5	V415 A423 Y476 L477 V478 R538	V415-S480 PolarHBondContact O-OG 2.96Å; A423-S480 VanDerWaalsContact CB-OG 3.29Å; A423-S480 WeakPolarHBondContact CB-OG 3.38Å; A423-S480 WeakPolarHBondContact O-CB 3.28Å; A423-S480 PolarHBondContact O-OG 3.07Å; Y476-S480 WeakPolarHBondContact O-CB 3.45Å; Y476-S480 PolarHBondContact O-N 3.3Å; Y476-S480 VanDerWaalsContact O-N 3.16Å; Y476-S480 PolarHBondContact O-OG 2.92Å; L477-S480 PolarHBondContact O-N 3.01Å; V478-S480 PolarHBondContact O-N 3.46Å; S480-R538 PolarHBondContact OG-NH1 3.22Å
481	L	97.1	Very high	93.8	Very high	4 Å²	4	41.7 Å²	41.7	2%	0.021	20%	0.203	C	C	.	.	H	α-helix	trans	-86.4	-7.7	176.9	-69.1	173.9	0	0	0	113.2	L430 F431 T461 L477 V478 D479 E483 C484 A485 L489	L430-L481 HydrophobicContact CD2-CD2 4.36Å; F431-L481 HydrophobicContact CB-CD2 4.43Å; T461-L481 HydrophobicContact CG2-CD1 4.25Å; L477-L481 HydrophobicContact CD1-CD1 3.76Å; L477-L481 HydrophobicContact CD1-CG 4.24Å; L477-L481 HydrophobicContact CG-CD1 4.16Å; L477-L481 PolarHBondContact O-N 3.48Å; V478-L481 CarbonylContact O-C 3.58Å; V478-L481 PolarHBondContact O-N 3.46Å; D479-L481 VanDerWaalsContact C-N 3.31Å; D479-L481 PolarHBondContact O-N 2.82Å; L481-E483 VanDerWaalsContact C-N 3.32Å; L481-E483 PolarHBondContact O-N 2.72Å; L481-C484 PolarHBondContact O-N 2.77Å; L481-C484 PolarHBondContact O-SG 2.9Å; L481-A485 HydrophobicContact CB-CB 4.24Å; L481-A485 WeakPolarHBondContact O-CA 3.43Å; L481-A485 WeakPolarHBondContact O-CB 3.32Å; L481-A485 PolarHBondContact O-N 3.49Å; L481-L489 HydrophobicContact CB-CD1 3.93Å
482	W	96.4	Very high	94.4	Very high	42 Å²	42	38.9 Å²	38.9	16%	0.159	19%	0.19	C	C	.	.	H	α-helix	trans	-59.1	-38	-170.8	-162.1	-110.9	0	0	0	113.8	V478 D479 S486 L489 A525 Q528 A529	V478-W482 HydrophobicContact CG1-CE3 3.89Å; V478-W482 HydrophobicContact CG1-CZ3 4.01Å; V478-W482 PolarHBondContact O-N 3.04Å; D479-W482 VanDerWaalsContact O-CB 3.26Å; D479-W482 WeakPolarHBondContact O-CB 3.48Å; D479-W482 PolarHBondContact O-N 3.44Å; W482-S486 VanDerWaalsContact O-CB 3.32Å; W482-S486 WeakPolarHBondContact O-CB 3.42Å; W482-S486 PolarHBondContact O-N 3.49Å; W482-L489 HydrophobicContact CE3-CD1 3.88Å; W482-L489 HydrophobicContact CZ3-CB 4.3Å; W482-L489 HydrophobicContact CZ3-CD1 4.44Å; W482-A525 WeakPolarHBondContact CH2-O 3.37Å; W482-A525 HydrophobicContact CZ3-CB 4.31Å; W482-Q528 HydrophobicContact CD2-CB 4.5Å; W482-Q528 HydrophobicContact CD2-CG 3.87Å; W482-Q528 HydrophobicContact CE3-CB 4.28Å; W482-Q528 HydrophobicContact CE3-CG 4.12Å; W482-Q528 HydrophobicContact CG-CG 4.43Å; W482-Q528 HydrophobicContact CH2-CB 3.88Å; W482-Q528 HydrophobicContact CH2-CG 4.13Å; W482-Q528 HydrophobicContact CZ2-CB 4.1Å; W482-Q528 HydrophobicContact CZ2-CG 3.86Å; W482-Q528 HydrophobicContact CZ3-CB 3.98Å; W482-Q528 HydrophobicContact CZ3-CG 4.26Å; W482-A529 HydrophobicContact CH2-CB 3.97Å; W482-A529 HydrophobicContact CZ2-CB 4.33Å
483	E	92.6	Very high	94.9	Very high	127 Å²	127	35.1 Å²	35.1	59%	0.593	17%	0.173	S	C	*	.	H	α-helix	trans	-82.8	-27.7	-176.6	-73.1	175.8	-141.9	0	0	113.7	R420 V424 L481	R420-E483 IonicContact CZ-OE1 3.41Å; R420-E483 VanDerWaalsContact CZ-OE1 3.31Å; R420-E483 IonicContact NH1-OE1 3.88Å; R420-E483 PolarHBondContact NH1-OE1 2.67Å; R420-E483 IonicContact NH2-OE1 2.76Å; R420-E483 PolarHBondContact NH2-OE1 3.05Å; R420-E483 VanDerWaalsContact NH2-OE1 3.07Å; V424-E483 HydrophobicContact CG1-CB 4.15Å; V424-E483 HydrophobicContact CG1-CG 4.48Å; L481-E483 VanDerWaalsContact C-N 3.32Å; L481-E483 PolarHBondContact O-N 2.72Å
484	C	93.6	Very high	95.1	Very high	40 Å²	40	31.9 Å²	31.9	27%	0.27	16%	0.158	S	C	.	.	H	α-helix	trans	-99.9	-24	-179.1	58.7	0	0	0	0	114.1	F431 L481	F431-C484 HydrophobicContact CB-CB 4.42Å; F431-C484 HydrophobicContact CD1-CB 4.22Å; F431-C484 HydrophobicContact CG-CB 4.28Å; L481-C484 PolarHBondContact O-N 2.77Å; L481-C484 PolarHBondContact O-SG 2.9Å
485	A	93.4	Very high	95.3	Very high	4 Å²	4	32 Å²	32	3%	0.033	16%	0.158	C	C	.	.	H	α-helix	trans	-129.7	19.3	-170.6	0	0	0	0	0	114.4	F431 L481 E487 L488 L489	F431-A485 HydrophobicContact CD2-CB 3.82Å; F431-A485 HydrophobicContact CE2-CB 3.76Å; L481-A485 HydrophobicContact CB-CB 4.24Å; L481-A485 WeakPolarHBondContact O-CA 3.43Å; L481-A485 WeakPolarHBondContact O-CB 3.32Å; L481-A485 PolarHBondContact O-N 3.49Å; A485-E487 PolarHBondContact O-N 3.2Å; A485-L488 HydrophobicContact CB-CB 4.45Å; A485-L488 WeakPolarHBondContact O-CB 3.49Å; A485-L488 PolarHBondContact O-N 3.42Å; A485-L489 HydrophobicContact CB-CD1 4.5Å; A485-L489 PolarHBondContact O-N 3.49Å
486	S	91.3	Very high	95.4	Very high	38 Å²	38	32.7 Å²	32.7	27%	0.266	16%	0.161	S	C	.	.	H	α-helix	trans	-53.8	-27.3	179.8	178.6	0	0	0	0	114.4	W482 K490	W482-S486 VanDerWaalsContact O-CB 3.32Å; W482-S486 WeakPolarHBondContact O-CB 3.42Å; W482-S486 PolarHBondContact O-N 3.49Å; S486-K490 WeakPolarHBondContact O-CB 3.28Å; S486-K490 WeakPolarHBondContact O-CG 3.34Å; S486-K490 PolarHBondContact O-N 2.91Å; S486-K490 WeakPolarHBondContact OG-CE 3.21Å
487	E	90.9	Very high	95.3	Very high	176 Å²	176	32.2 Å²	32.2	82%	0.822	16%	0.162	S	C	*	.	H	α-helix	trans	-71.7	-34.5	177.2	-62.6	-171.1	162.8	0	0	112	A485	A485-E487 PolarHBondContact O-N 3.2Å
488	L	92.9	Very high	95.1	Very high	11 Å²	11	32.2 Å²	32.2	6%	0.058	16%	0.162	C	C	.	.	H	α-helix	trans	-74.5	-45.4	175.2	-175.2	67.4	0	0	0	111.1	F435 N454 L457 I458 A485 K490 D491	F435-L488 HydrophobicContact CD1-CD2 3.85Å; F435-L488 HydrophobicContact CE1-CD2 3.73Å; N454-L488 HydrophobicContact CB-CD1 3.76Å; L457-L488 HydrophobicContact CB-CD1 3.74Å; L457-L488 HydrophobicContact CB-CD2 3.86Å; L457-L488 HydrophobicContact CB-CG 4.48Å; L457-L488 HydrophobicContact CD1-CD1 4.47Å; I458-L488 HydrophobicContact CD1-CD1 4.34Å; I458-L488 HydrophobicContact CG1-CD1 3.85Å; I458-L488 HydrophobicContact CG1-CG 4.22Å; A485-L488 HydrophobicContact CB-CB 4.45Å; A485-L488 WeakPolarHBondContact O-CB 3.49Å; A485-L488 PolarHBondContact O-N 3.42Å; L488-K490 PolarHBondContact O-N 2.98Å; L488-D491 PolarHBondContact O-N 2.85Å
489	L	96	Very high	95.1	Very high	4 Å²	4	32.2 Å²	32.2	2%	0.021	16%	0.162	C	C	.	.	H	α-helix	trans	-67.7	-18.3	-178.4	-63.7	170	0	0	0	113.3	V478 L481 W482 A485 W492 A525	V478-L489 HydrophobicContact CG1-CD1 4.36Å; L481-L489 HydrophobicContact CB-CD1 3.93Å; W482-L489 HydrophobicContact CE3-CD1 3.88Å; W482-L489 HydrophobicContact CZ3-CB 4.3Å; W482-L489 HydrophobicContact CZ3-CD1 4.44Å; A485-L489 HydrophobicContact CB-CD1 4.5Å; A485-L489 PolarHBondContact O-N 3.49Å; L489-W492 PolarHBondContact O-NE1 3.47Å; L489-A525 HydrophobicContact CB-CB 4.33Å; L489-A525 VanDerWaalsContact O-CB 3.28Å; L489-A525 WeakPolarHBondContact O-CB 3.15Å
490	K	96.3	Very high	94.9	Very high	30 Å²	30	34.9 Å²	34.9	13%	0.13	18%	0.176	C	C	.	.	T	Hydrogen-bonded Turn	trans	-105.2	8.4	176.3	-63.7	-177.3	-178.5	-175.2	0	113.9	S486 L488 W492 D556	S486-K490 WeakPolarHBondContact O-CB 3.28Å; S486-K490 WeakPolarHBondContact O-CG 3.34Å; S486-K490 PolarHBondContact O-N 2.91Å; S486-K490 WeakPolarHBondContact OG-CE 3.21Å; L488-K490 PolarHBondContact O-N 2.98Å; K490-W492 HydrophobicContact CB-CZ2 4.42Å; K490-W492 HydrophobicContact CG-CZ2 4.14Å; K490-W492 PolarHBondContact O-N 2.85Å; K490-D556 IonicContact NZ-OD1 3.89Å; K490-D556 IonicContact NZ-OD2 3.14Å; K490-D556 PolarHBondContact NZ-OD2 3.03Å
491	D	95.7	Very high	94.6	Very high	32 Å²	32	38.8 Å²	38.8	17%	0.171	20%	0.197	C	C	.	.			trans	-81.2	61.2	171	-165.8	-17.3	0	0	0	110.9	N454 I458 L488 E493 T494 M495	N454-D491 VanDerWaalsContact CB-OD2 3.27Å; N454-D491 WeakPolarHBondContact CB-OD2 3.36Å; N454-D491 PolarHBondContact ND2-OD2 3.29Å; I458-D491 HydrophobicContact CD1-CB 4.47Å; L488-D491 PolarHBondContact O-N 2.85Å; D491-E493 PolarHBondContact O-N 3.2Å; D491-T494 VanDerWaalsContact CG-CB 3.46Å; D491-T494 PolarHBondContact O-N 3.27Å; D491-T494 WeakPolarHBondContact OD1-CB 3.42Å; D491-T494 PolarHBondContact OD1-N 2.83Å; D491-T494 PolarHBondContact OD1-OG1 2.88Å; D491-T494 PolarHBondContact OD2-OG1 2.37Å; D491-M495 WeakPolarHBondContact O-CG 3.5Å; D491-M495 PolarHBondContact O-N 3.26Å; D491-M495 VanDerWaalsContact O-N 3.11Å
492	W	96.5	Very high	94	Very high	1 Å²	1	47.1 Å²	47.1	0%	0.004	24%	0.235	C	C	.	.	H	α-helix	trans	-64.6	-22.3	179.1	-52.8	-42.5	0	0	0	112.4	L489 K490 M495 I496 I526 A529 D556 R559 T560 M563 F564	L489-W492 PolarHBondContact O-NE1 3.47Å; K490-W492 HydrophobicContact CB-CZ2 4.42Å; K490-W492 HydrophobicContact CG-CZ2 4.14Å; K490-W492 PolarHBondContact O-N 2.85Å; W492-M495 PolarHBondContact O-N 3Å; W492-I496 WeakPolarHBondContact O-CB 3.32Å; W492-I496 WeakPolarHBondContact O-CD1 3.3Å; W492-I496 WeakPolarHBondContact O-CG1 3.49Å; W492-I496 PolarHBondContact O-N 3.09Å; W492-I526 HydrophobicContact CD2-CG1 4.35Å; W492-I526 HydrophobicContact CZ2-CG1 4.19Å; W492-A529 HydrophobicContact CH2-CB 4.06Å; W492-A529 HydrophobicContact CZ2-CB 3.87Å; W492-D556 HydrophobicContact CH2-CB 4.32Å; W492-R559 HydrophobicContact CE3-CG 4.24Å; W492-R559 HydrophobicContact CZ3-CB 4.32Å; W492-R559 HydrophobicContact CZ3-CG 4.09Å; W492-T560 WeakPolarHBondContact CH2-OG1 3.41Å; W492-T560 WeakPolarHBondContact CZ3-OG1 3.44Å; W492-M563 HydrophobicContact CB-CE 3.91Å; W492-F564 HydrophobicContact CB-CE2 3.83Å; W492-F564 HydrophobicContact CB-CZ 4.05Å; W492-F564 HydrophobicContact CD2-CE2 4.36Å; W492-F564 HydrophobicContact CG-CE2 4.04Å; W492-F564 HydrophobicContact CG-CZ 4.45Å
493	E	95.1	Very high	93.4	Very high	117 Å²	117	47.6 Å²	47.6	55%	0.547	24%	0.244	S	C	.	.	H	α-helix	trans	-65	-47.8	175.6	-172.1	-179.1	152.3	0	0	109.4	D491 I496 S497 M563	D491-E493 PolarHBondContact O-N 3.2Å; E493-I496 PolarHBondContact O-N 3.38Å; E493-S497 WeakPolarHBondContact O-CB 3.3Å; E493-S497 PolarHBondContact O-N 2.85Å; E493-M563 HydrophobicContact CB-CE 3.74Å; E493-M563 VanDerWaalsContact N-CE 3.27Å
494	T	94.5	Very high	92.6	Very high	4 Å²	4	46.6 Å²	46.6	3%	0.025	24%	0.24	C	C	.	.	H	α-helix	trans	-66.3	-37.7	174.8	-63.2	0	0	0	0	112.5	G449 S452 I458 D491 S497 L498	G449-T494 WeakPolarHBondContact O-CG2 3.14Å; S452-T494 PolarHBondContact OG-OG1 3.12Å; I458-T494 HydrophobicContact CD1-CG2 3.73Å; D491-T494 VanDerWaalsContact CG-CB 3.46Å; D491-T494 PolarHBondContact O-N 3.27Å; D491-T494 WeakPolarHBondContact OD1-CB 3.42Å; D491-T494 PolarHBondContact OD1-N 2.83Å; D491-T494 PolarHBondContact OD1-OG1 2.88Å; D491-T494 PolarHBondContact OD2-OG1 2.37Å; T494-S497 PolarHBondContact O-N 2.71Å; T494-L498 HydrophobicContact CG2-CD1 4.1Å; T494-L498 WeakPolarHBondContact O-CB 3.49Å; T494-L498 WeakPolarHBondContact O-CG 3.29Å; T494-L498 PolarHBondContact O-N 3.21Å
495	M	96.8	Very high	91.7	Very high	2 Å²	2	50.8 Å²	50.8	1%	0.01	27%	0.267	C	S	.	.	H	α-helix	trans	-63.5	-45.4	175.3	-63	176.4	-175.1	0	0	112.1	I458 D491 W492 L498 L499 L518 M522	I458-M495 HydrophobicContact CD1-CE 4.16Å; I458-M495 HydrophobicContact CD1-CG 3.81Å; I458-M495 HydrophobicContact CG1-CE 4.26Å; I458-M495 HydrophobicContact CG2-CG 4.36Å; D491-M495 WeakPolarHBondContact O-CG 3.5Å; D491-M495 PolarHBondContact O-N 3.26Å; D491-M495 VanDerWaalsContact O-N 3.11Å; W492-M495 PolarHBondContact O-N 3Å; M495-L498 PolarHBondContact O-N 3.35Å; M495-L499 WeakPolarHBondContact O-CG 3.29Å; M495-L499 PolarHBondContact O-N 2.9Å; M495-L518 HydrophobicContact CB-CD1 4.33Å; M495-L518 HydrophobicContact CG-CD1 4.12Å; M495-M522 HydrophobicContact CB-CG 4.32Å; M495-M522 HydrophobicContact CB-SD 3.85Å; M495-M522 HydrophobicContact SD-CB 3.8Å; M495-M522 HydrophobicContact SD-CG 3.84Å
496	I	96.6	Very high	90.8	Very high	22 Å²	22	54.7 Å²	54.7	11%	0.113	31%	0.308	C	S	.	.	H	α-helix	trans	-61.9	-45.9	175.4	-69	161.9	0	0	0	110.5	W492 E493 L498 L499 L500 M522 M563 F564 A567	W492-I496 WeakPolarHBondContact O-CB 3.32Å; W492-I496 WeakPolarHBondContact O-CD1 3.3Å; W492-I496 WeakPolarHBondContact O-CG1 3.49Å; W492-I496 PolarHBondContact O-N 3.09Å; E493-I496 PolarHBondContact O-N 3.38Å; I496-L498 VanDerWaalsContact C-N 3.33Å; I496-L498 PolarHBondContact O-N 3.26Å; I496-L499 PolarHBondContact O-N 3.32Å; I496-L499 VanDerWaalsContact O-N 3.17Å; I496-L500 HydrophobicContact CG2-CD1 3.74Å; I496-L500 HydrophobicContact CG2-CG 4.33Å; I496-L500 WeakPolarHBondContact O-CB 3.47Å; I496-L500 PolarHBondContact O-N 2.84Å; I496-M522 HydrophobicContact CG1-SD 4.5Å; I496-M563 HydrophobicContact CD1-CB 4.46Å; I496-M563 HydrophobicContact CD1-CE 4.23Å; I496-F564 HydrophobicContact CD1-CD1 4.18Å; I496-F564 HydrophobicContact CD1-CE1 3.74Å; I496-F564 HydrophobicContact CD1-CE2 4.15Å; I496-F564 HydrophobicContact CD1-CZ 3.71Å; I496-F564 HydrophobicContact CG1-CE1 3.74Å; I496-F564 HydrophobicContact CG1-CZ 3.89Å; I496-A567 HydrophobicContact CD1-CB 3.85Å; I496-A567 HydrophobicContact CG1-CB 4.23Å; I496-A567 HydrophobicContact CG2-CB 3.8Å
497	S	94.5	Very high	90.2	Very high	21 Å²	21	55.4 Å²	55.4	15%	0.147	31%	0.307	C	S	.	.	H	α-helix	trans	-58.5	-40.1	174.8	-96.5	0	0	0	0	113.1	E493 T494 L499 L500 D501	E493-S497 WeakPolarHBondContact O-CB 3.3Å; E493-S497 PolarHBondContact O-N 2.85Å; T494-S497 PolarHBondContact O-N 2.71Å; S497-L499 VanDerWaalsContact C-N 3.26Å; S497-L499 PolarHBondContact O-N 3.27Å; S497-L500 PolarHBondContact O-N 2.81Å; S497-D501 WeakPolarHBondContact CA-OD2 3.06Å; S497-D501 WeakPolarHBondContact CB-OD2 3.39Å; S497-D501 VanDerWaalsContact O-CB 3.28Å; S497-D501 WeakPolarHBondContact O-CB 3.41Å; S497-D501 PolarHBondContact O-N 2.84Å; S497-D501 PolarHBondContact OG-OD2 3.19Å
498	L	94.2	Very high	89.8	Confident	1 Å²	1	55 Å²	55	1%	0.005	31%	0.305	C	S	.	.	H	α-helix	trans	-63.8	-31.1	177.6	-83.1	164.2	0	0	0	112.9	R450 I458 K459 T494 M495 I496 L510 L518	R450-L498 HydrophobicContact CG-CD2 4.07Å; R450-L498 PolarHBondContact NH1-O 2.7Å; I458-L498 HydrophobicContact CB-CD1 3.99Å; I458-L498 HydrophobicContact CG2-CD1 3.56Å; K459-L498 HydrophobicContact CD-CD2 4.41Å; K459-L498 VanDerWaalsContact CE-CD2 3.44Å; K459-L498 HydrophobicContact CG-CD2 4.2Å; T494-L498 HydrophobicContact CG2-CD1 4.1Å; T494-L498 WeakPolarHBondContact O-CB 3.49Å; T494-L498 WeakPolarHBondContact O-CG 3.29Å; T494-L498 PolarHBondContact O-N 3.21Å; M495-L498 PolarHBondContact O-N 3.35Å; I496-L498 VanDerWaalsContact C-N 3.33Å; I496-L498 PolarHBondContact O-N 3.26Å; L498-L510 HydrophobicContact CB-CD1 4.31Å; L498-L518 HydrophobicContact CB-CD2 3.65Å; L498-L518 HydrophobicContact CD1-CD2 4.23Å
499	L	96.3	Very high	89.5	Confident	1 Å²	1	57.4 Å²	57.4	1%	0.005	33%	0.327	C	S	.	.	H	α-helix	trans	-88.8	-28.6	179.2	-66.1	169.1	0	0	0	113.6	M495 I496 S497 E515 L518 V519 M522 L571 K574 Y575	M495-L499 WeakPolarHBondContact O-CG 3.29Å; M495-L499 PolarHBondContact O-N 2.9Å; I496-L499 PolarHBondContact O-N 3.32Å; I496-L499 VanDerWaalsContact O-N 3.17Å; S497-L499 VanDerWaalsContact C-N 3.26Å; S497-L499 PolarHBondContact O-N 3.27Å; L499-E515 HydrophobicContact CD2-CB 4.08Å; L499-E515 HydrophobicContact CD2-CG 4.33Å; L499-L518 HydrophobicContact CD1-CD2 4.44Å; L499-L518 HydrophobicContact CD1-CG 4.33Å; L499-L518 HydrophobicContact CD2-CB 4.27Å; L499-L518 HydrophobicContact CD2-CD2 3.81Å; L499-L518 HydrophobicContact CD2-CG 4.11Å; L499-L518 HydrophobicContact CG-CD2 3.79Å; L499-L518 HydrophobicContact CG-CG 4.17Å; L499-V519 HydrophobicContact CD1-CG2 3.79Å; L499-V519 HydrophobicContact CD2-CG2 4.09Å; L499-M522 HydrophobicContact CD1-CE 3.86Å; L499-M522 HydrophobicContact CD1-SD 4.23Å; L499-L571 HydrophobicContact CB-CD2 3.69Å; L499-L571 HydrophobicContact CD1-CD2 3.98Å; L499-L571 HydrophobicContact CG-CD2 4.48Å; L499-K574 WeakPolarHBondContact O-CD 3.27Å; L499-K574 PolarHBondContact O-NZ 3.23Å; L499-Y575 HydrophobicContact CB-CE2 4.42Å; L499-Y575 HydrophobicContact CD2-CE2 4.41Å; L499-Y575 WeakPolarHBondContact CD2-OH 3.4Å; L499-Y575 PolarHBondContact O-OH 3.04Å
500	L	94.6	Very high	89.3	Confident	55 Å²	55	58.4 Å²	58.4	29%	0.288	33%	0.332	S	S	.	.	H	α-helix	trans	-107.7	-34.7	-175.1	-66.4	-177	0	0	0	115.2	I496 S497 L570 L571	I496-L500 HydrophobicContact CG2-CD1 3.74Å; I496-L500 HydrophobicContact CG2-CG 4.33Å; I496-L500 WeakPolarHBondContact O-CB 3.47Å; I496-L500 PolarHBondContact O-N 2.84Å; S497-L500 PolarHBondContact O-N 2.81Å; L500-L570 HydrophobicContact CD1-CB 3.97Å; L500-L570 HydrophobicContact CD1-CD1 4.28Å; L500-L570 HydrophobicContact CD2-CB 4.22Å; L500-L571 HydrophobicContact CD1-CD2 4.38Å; L500-L571 HydrophobicContact CD1-CG 4.35Å; L500-L571 HydrophobicContact CD2-CD2 3.71Å; L500-L571 HydrophobicContact CD2-CG 4.13Å; L500-L571 HydrophobicContact CG-CD2 3.82Å; L500-L571 HydrophobicContact CG-CG 4.3Å
501	D	91.3	Very high	89.2	Confident	82 Å²	82	60.8 Å²	60.8	44%	0.439	35%	0.349	S	S	.	.	S	Bend	trans	-82.2	134.6	-174.8	-62.3	-38.7	0	0	0	111.7	R450 S497	R450-D501 PolarHBondContact NH1-O 2.9Å; S497-D501 WeakPolarHBondContact CA-OD2 3.06Å; S497-D501 WeakPolarHBondContact CB-OD2 3.39Å; S497-D501 VanDerWaalsContact O-CB 3.28Å; S497-D501 WeakPolarHBondContact O-CB 3.41Å; S497-D501 PolarHBondContact O-N 2.84Å; S497-D501 PolarHBondContact OG-OD2 3.19Å
502	E	84.7	Confident	89.3	Confident	179 Å²	179	63.5 Å²	63.5	84%	0.836	36%	0.364	S	S	*	.	P	Polyproline II helix	trans	-59.9	139.3	174.3	-68.7	-171.4	166.5	0	0	111.5
503	P	83.6	Confident	89.2	Confident	52 Å²	52	72.7 Å²	72.7	34%	0.338	40%	0.399	S	S	.	.	P	Polyproline II helix	trans	-66.6	143.3	176.4	28.9	-34.8	0	0	0	111.2	E507 A509	P503-E507 HydrophobicContact CB-CB 4.19Å; P503-A509 HydrophobicContact CG-CB 4.1Å
504	M	76.6	Confident	89.3	Confident	106 Å²	106	68.2 Å²	68.2	52%	0.522	38%	0.378	S	S	.	.	P	Polyproline II helix	trans	-67.5	155.5	176.7	-72	-67.7	-66.2	0	0	111.6	Q451 G506 E507	Q451-M504 VanDerWaalsContact NE2-CG 3.25Å; M504-G506 PolarHBondContact O-N 2.93Å; M504-E507 HydrophobicContact CB-CB 4.42Å; M504-E507 PolarHBondContact N-OE2 3.03Å; M504-E507 WeakPolarHBondContact O-CB 3.26Å; M504-E507 PolarHBondContact O-N 2.9Å
505	P	73.2	Confident	89.4	Confident	128 Å²	128	69.3 Å²	69.3	83%	0.831	38%	0.382	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.8	109	174.5	-25.8	35.7	0	0	0	112.3
506	G	74.6	Confident	89.4	Confident	87 Å²	87	70.4 Å²	70.4	90%	0.897	39%	0.39	S	S	*	.	T	Hydrogen-bonded Turn	trans	101.9	-3.2	-175.4	0	0	0	0	0	115.2	M504	M504-G506 PolarHBondContact O-N 2.93Å
507	E	80.2	Confident	89.5	Confident	52 Å²	52	69.5 Å²	69.5	24%	0.243	39%	0.385	C	S	.	.	S	Bend	trans	-88.5	138.2	165.5	-163.4	-152.2	146.1	0	0	109.8	R450 K459 P503 M504	R450-E507 IonicContact CZ-OE1 3.19Å; R450-E507 VanDerWaalsContact CZ-OE1 3.28Å; R450-E507 IonicContact CZ-OE2 2.87Å; R450-E507 VanDerWaalsContact NE-CD 3.3Å; R450-E507 IonicContact NE-OE1 3.74Å; R450-E507 PolarHBondContact NE-OE1 3.02Å; R450-E507 IonicContact NE-OE2 3.07Å; R450-E507 PolarHBondContact NE-OE2 3.48Å; R450-E507 IonicContact NH2-OE1 3.02Å; R450-E507 PolarHBondContact NH2-OE1 3.32Å; K459-E507 IonicContact NZ-OE1 3.01Å; K459-E507 PolarHBondContact NZ-OE1 3.08Å; P503-E507 HydrophobicContact CB-CB 4.19Å; M504-E507 HydrophobicContact CB-CB 4.42Å; M504-E507 PolarHBondContact N-OE2 3.03Å; M504-E507 WeakPolarHBondContact O-CB 3.26Å; M504-E507 PolarHBondContact O-N 2.9Å
508	E	81.5	Confident	89.6	Confident	168 Å²	168	68.6 Å²	68.6	79%	0.785	38%	0.379	S	S	*	.	P	Polyproline II helix	trans	-75.4	133.5	171.6	-63.6	-171.8	159.8	0	0	111
509	A	86.2	Confident	89.8	Confident	62 Å²	62	68.6 Å²	68.6	51%	0.512	38%	0.379	S	S	.	.	P	Polyproline II helix	trans	-64.6	157.5	171.6	0	0	0	0	0	110.6	P503	P503-A509 HydrophobicContact CG-CB 4.1Å
510	L	92.4	Very high	89.9	Confident	24 Å²	24	69.7 Å²	69.7	13%	0.126	38%	0.384	C	S	.	.	P	Polyproline II helix	trans	-68.9	139.2	165.3	-62.9	-177.1	0	0	0	108.8	K459 L498 Q514 E515 L518	K459-L510 HydrophobicContact CD-CD2 4.29Å; K459-L510 HydrophobicContact CG-CD2 4.11Å; L498-L510 HydrophobicContact CB-CD1 4.31Å; L510-Q514 HydrophobicContact CB-CB 4.28Å; L510-Q514 HydrophobicContact CD2-CB 4.34Å; L510-E515 HydrophobicContact CB-CG 3.66Å; L510-E515 HydrophobicContact CD1-CG 4.18Å; L510-L518 HydrophobicContact CD1-CD2 3.75Å
511	T	95.3	Very high	90	Very high	80 Å²	80	67.2 Å²	67.2	49%	0.491	37%	0.371	S	S	.	.	P	Polyproline II helix	trans	-75.9	155.3	165.9	62	0	0	0	0	109.8	R513 Q514 E515	T511-R513 VanDerWaalsContact C-N 3.29Å; T511-R513 PolarHBondContact O-N 3.49Å; T511-Q514 CarbonylContact O-C 3.58Å; T511-Q514 WeakPolarHBondContact O-CA 3.45Å; T511-Q514 WeakPolarHBondContact O-CB 3.45Å; T511-Q514 PolarHBondContact O-N 3.33Å; T511-Q514 VanDerWaalsContact OG1-CG 3.3Å; T511-Q514 WeakPolarHBondContact OG1-CG 2.93Å; T511-Q514 PolarHBondContact OG1-OE1 3.09Å; T511-E515 PolarHBondContact O-N 3.44Å
512	D	95.9	Very high	90.4	Very high	90 Å²	90	63.3 Å²	63.3	48%	0.481	35%	0.35	S	S	.	.	H	α-helix	trans	-51.5	-43.9	-177.9	179.6	78.5	0	0	0	113.8	Q514 E515 T516 K581	D512-Q514 VanDerWaalsContact C-N 3.32Å; D512-Q514 PolarHBondContact O-N 2.84Å; D512-E515 WeakPolarHBondContact O-CB 3.27Å; D512-E515 PolarHBondContact O-N 3.07Å; D512-E515 VanDerWaalsContact O-N 3.09Å; D512-T516 PolarHBondContact O-N 2.99Å; D512-T516 PolarHBondContact O-OG1 2.85Å; D512-K581 WeakPolarHBondContact O-CE 3.41Å; D512-K581 PolarHBondContact O-NZ 3.45Å; D512-K581 WeakPolarHBondContact OD1-CE 3.49Å; D512-K581 IonicContact OD1-NZ 2.67Å; D512-K581 PolarHBondContact OD1-NZ 2.72Å; D512-K581 IonicContact OD2-NZ 3.73Å; D512-K581 PolarHBondContact OD2-NZ 2.75Å; D512-K581 VanDerWaalsContact OD2-NZ 3.13Å
513	R	95.2	Very high	91	Very high	193 Å²	193	54.9 Å²	54.9	73%	0.728	31%	0.311	S	S	*	.	H	α-helix	trans	-61.2	-35.2	173.5	-86	-173.3	157.4	-154.1	-10	113.7	T511 A517	T511-R513 VanDerWaalsContact C-N 3.29Å; T511-R513 PolarHBondContact O-N 3.49Å; R513-A517 WeakPolarHBondContact O-CB 3.36Å; R513-A517 PolarHBondContact O-N 2.92Å
514	Q	96.3	Very high	91.7	Very high	23 Å²	23	52.5 Å²	52.5	11%	0.107	30%	0.295	C	S	.	.	H	α-helix	trans	-72.7	-30.6	174.7	-68.9	160.9	-20.3	0	0	111.6	V462 F463 L466 L510 T511 D512 L518	V462-Q514 HydrophobicContact CG1-CB 3.79Å; V462-Q514 HydrophobicContact CG1-CG 3.92Å; F463-Q514 VanDerWaalsContact CZ-NE2 3.27Å; L466-Q514 HydrophobicContact CD1-CB 4.42Å; L466-Q514 HydrophobicContact CD1-CG 3.68Å; L510-Q514 HydrophobicContact CB-CB 4.28Å; L510-Q514 HydrophobicContact CD2-CB 4.34Å; T511-Q514 CarbonylContact O-C 3.58Å; T511-Q514 WeakPolarHBondContact O-CA 3.45Å; T511-Q514 WeakPolarHBondContact O-CB 3.45Å; T511-Q514 PolarHBondContact O-N 3.33Å; T511-Q514 VanDerWaalsContact OG1-CG 3.3Å; T511-Q514 WeakPolarHBondContact OG1-CG 2.93Å; T511-Q514 PolarHBondContact OG1-OE1 3.09Å; D512-Q514 VanDerWaalsContact C-N 3.32Å; D512-Q514 PolarHBondContact O-N 2.84Å; Q514-L518 WeakPolarHBondContact O-CB 2.63Å; Q514-L518 PolarHBondContact O-N 2.76Å
515	E	97.4	Very high	92.7	Very high	27 Å²	27	47.5 Å²	47.5	13%	0.126	27%	0.271	C	S	.	.	H	α-helix	trans	-68.8	-43.1	171.8	-60.6	-168.3	113.6	0	0	111.2	L499 L510 T511 D512 L518 V519 K574 Y575	L499-E515 HydrophobicContact CD2-CB 4.08Å; L499-E515 HydrophobicContact CD2-CG 4.33Å; L510-E515 HydrophobicContact CB-CG 3.66Å; L510-E515 HydrophobicContact CD1-CG 4.18Å; T511-E515 PolarHBondContact O-N 3.44Å; D512-E515 WeakPolarHBondContact O-CB 3.27Å; D512-E515 PolarHBondContact O-N 3.07Å; D512-E515 VanDerWaalsContact O-N 3.09Å; E515-L518 PolarHBondContact O-N 2.92Å; E515-V519 WeakPolarHBondContact O-CG2 3.46Å; E515-V519 PolarHBondContact O-N 3.06Å; E515-K574 IonicContact OE1-NZ 2.8Å; E515-K574 PolarHBondContact OE1-NZ 3.46Å; E515-K574 IonicContact OE2-NZ 3.19Å; E515-Y575 HydrophobicContact CB-CE1 4.26Å; E515-Y575 VanDerWaalsContact CD-OH 3.22Å; E515-Y575 PolarHBondContact OE1-OH 2.69Å; E515-Y575 WeakPolarHBondContact OE2-CE1 3.47Å
516	T	97.3	Very high	93.9	Very high	26 Å²	26	41.4 Å²	41.4	16%	0.16	23%	0.231	C	C	.	.	H	α-helix	trans	-59.5	-51.6	173.1	-53.6	0	0	0	0	111.4	D512 L518 V519 E520 D580 K581	D512-T516 PolarHBondContact O-N 2.99Å; D512-T516 PolarHBondContact O-OG1 2.85Å; T516-L518 VanDerWaalsContact C-N 3.31Å; T516-L518 PolarHBondContact O-N 3.49Å; T516-V519 PolarHBondContact O-N 3.26Å; T516-V519 VanDerWaalsContact O-N 3.13Å; T516-E520 PolarHBondContact O-N 3.04Å; T516-D580 HydrophobicContact CG2-CB 3.64Å; T516-K581 HydrophobicContact CG2-CG 4.43Å; T516-K581 WeakPolarHBondContact OG1-CE 3.13Å; T516-K581 PolarHBondContact OG1-NZ 3.2Å
517	A	97.4	Very high	95	Very high	3 Å²	3	40.5 Å²	40.5	3%	0.025	20%	0.2	C	C	.	.	H	α-helix	trans	-60.1	-38.4	178.9	0	0	0	0	0	113.1	V462 F465 L466 R513 I521	V462-A517 HydrophobicContact CG1-CB 3.88Å; F465-A517 HydrophobicContact CD1-CB 3.73Å; F465-A517 HydrophobicContact CE1-CB 4.04Å; L466-A517 HydrophobicContact CD1-CB 4.11Å; L466-A517 HydrophobicContact CD2-CB 3.98Å; L466-A517 HydrophobicContact CG-CB 3.92Å; R513-A517 WeakPolarHBondContact O-CB 3.36Å; R513-A517 PolarHBondContact O-N 2.92Å; A517-I521 WeakPolarHBondContact O-CB 3.38Å; A517-I521 WeakPolarHBondContact O-CD1 3.38Å; A517-I521 VanDerWaalsContact O-CG1 3.27Å; A517-I521 WeakPolarHBondContact O-CG1 3.04Å; A517-I521 PolarHBondContact O-N 3.41Å
518	L	98.1	Very high	95.7	Very high	2 Å²	2	38.5 Å²	38.5	1%	0.01	19%	0.191	C	C	.	.	H	α-helix	trans	-67.2	-38.9	175.3	180	54.3	0	0	0	111.9	I458 V462 M495 L498 L499 L510 Q514 E515 T516 M522	I458-L518 HydrophobicContact CG2-CD1 3.43Å; I458-L518 VanDerWaalsContact CG2-CD1 3.43Å; V462-L518 HydrophobicContact CG2-CB 3.9Å; V462-L518 HydrophobicContact CG2-CD1 4.07Å; M495-L518 HydrophobicContact CB-CD1 4.33Å; M495-L518 HydrophobicContact CG-CD1 4.12Å; L498-L518 HydrophobicContact CB-CD2 3.65Å; L498-L518 HydrophobicContact CD1-CD2 4.23Å; L499-L518 HydrophobicContact CD1-CD2 4.44Å; L499-L518 HydrophobicContact CD1-CG 4.33Å; L499-L518 HydrophobicContact CD2-CB 4.27Å; L499-L518 HydrophobicContact CD2-CD2 3.81Å; L499-L518 HydrophobicContact CD2-CG 4.11Å; L499-L518 HydrophobicContact CG-CD2 3.79Å; L499-L518 HydrophobicContact CG-CG 4.17Å; L510-L518 HydrophobicContact CD1-CD2 3.75Å; Q514-L518 WeakPolarHBondContact O-CB 2.63Å; Q514-L518 PolarHBondContact O-N 2.76Å; E515-L518 PolarHBondContact O-N 2.92Å; T516-L518 VanDerWaalsContact C-N 3.31Å; T516-L518 PolarHBondContact O-N 3.49Å; L518-M522 WeakPolarHBondContact O-CB 3.45Å; L518-M522 PolarHBondContact O-N 3.4Å
519	V	98.3	Very high	96.4	Very high	1 Å²	1	30.5 Å²	30.5	1%	0.006	15%	0.154	C	C	.	.	H	α-helix	trans	-63.6	-44.3	175.6	167.8	0	0	0	0	111.5	L499 E515 T516 M522 L523 L585	L499-V519 HydrophobicContact CD1-CG2 3.79Å; L499-V519 HydrophobicContact CD2-CG2 4.09Å; E515-V519 WeakPolarHBondContact O-CG2 3.46Å; E515-V519 PolarHBondContact O-N 3.06Å; T516-V519 PolarHBondContact O-N 3.26Å; T516-V519 VanDerWaalsContact O-N 3.13Å; V519-M522 PolarHBondContact O-N 2.62Å; V519-L523 WeakPolarHBondContact O-CB 3.25Å; V519-L523 PolarHBondContact O-N 3.3Å; V519-L585 HydrophobicContact CG1-CD2 4.22Å; V519-L585 HydrophobicContact CG1-CG 3.96Å
520	E	97.6	Very high	96.8	Very high	23 Å²	23	28.2 Å²	28.2	11%	0.107	13%	0.134	C	C	.	.	H	α-helix	trans	-68.9	-43.3	177	163.9	45.9	-150.4	0	0	112.4	G474 A475 T516 M522 L523 S524	G474-E520 WeakPolarHBondContact CA-OE1 3.46Å; G474-E520 VanDerWaalsContact N-CG 3.31Å; G474-E520 PolarHBondContact N-OE1 3.36Å; A475-E520 PolarHBondContact N-OE1 3.46Å; T516-E520 PolarHBondContact O-N 3.04Å; E520-M522 VanDerWaalsContact C-N 3.26Å; E520-M522 PolarHBondContact O-N 3.07Å; E520-L523 PolarHBondContact O-N 3.29Å; E520-S524 WeakPolarHBondContact O-CB 3.47Å; E520-S524 PolarHBondContact O-N 3.23Å; E520-S524 PolarHBondContact OE1-OG 2.88Å
521	I	98.1	Very high	96.8	Very high	3 Å²	3	30.2 Å²	30.2	2%	0.015	14%	0.143	C	C	.	.	H	α-helix	trans	-59.2	-41.4	174.6	-71.7	165.8	0	0	0	110.6	T461 V462 F465 V478 A517 A525	T461-I521 HydrophobicContact CG2-CD1 4.29Å; V462-I521 HydrophobicContact CG2-CD1 3.97Å; F465-I521 HydrophobicContact CB-CD1 4.02Å; F465-I521 HydrophobicContact CD1-CD1 4.29Å; F465-I521 HydrophobicContact CG-CD1 4.22Å; V478-I521 HydrophobicContact CG2-CG2 4.26Å; A517-I521 WeakPolarHBondContact O-CB 3.38Å; A517-I521 WeakPolarHBondContact O-CD1 3.38Å; A517-I521 VanDerWaalsContact O-CG1 3.27Å; A517-I521 WeakPolarHBondContact O-CG1 3.04Å; A517-I521 PolarHBondContact O-N 3.41Å; I521-A525 WeakPolarHBondContact O-CB 3.26Å; I521-A525 PolarHBondContact O-N 3.25Å
522	M	98.4	Very high	96.6	Very high	0 Å²	0	28.2 Å²	28.2	0%	0	13%	0.131	C	C	.	.	H	α-helix	trans	-64.1	-47.3	175.8	-178.5	177	70.7	0	0	111.9	M495 I496 L499 L518 V519 E520 A525 I526 F564 L571 L585 I588	M495-M522 HydrophobicContact CB-CG 4.32Å; M495-M522 HydrophobicContact CB-SD 3.85Å; M495-M522 HydrophobicContact SD-CB 3.8Å; M495-M522 HydrophobicContact SD-CG 3.84Å; I496-M522 HydrophobicContact CG1-SD 4.5Å; L499-M522 HydrophobicContact CD1-CE 3.86Å; L499-M522 HydrophobicContact CD1-SD 4.23Å; L518-M522 WeakPolarHBondContact O-CB 3.45Å; L518-M522 PolarHBondContact O-N 3.4Å; V519-M522 PolarHBondContact O-N 2.62Å; E520-M522 VanDerWaalsContact C-N 3.26Å; E520-M522 PolarHBondContact O-N 3.07Å; M522-A525 PolarHBondContact O-N 2.91Å; M522-I526 HydrophobicContact CG-CD1 3.94Å; M522-I526 WeakPolarHBondContact O-CD1 3.48Å; M522-I526 VanDerWaalsContact O-CG1 3.24Å; M522-I526 WeakPolarHBondContact O-CG1 3.1Å; M522-I526 PolarHBondContact O-N 2.9Å; M522-F564 HydrophobicContact CE-CE1 3.9Å; M522-F564 HydrophobicContact CE-CZ 4.29Å; M522-F564 HydrophobicContact CG-CZ 4.01Å; M522-F564 HydrophobicContact SD-CE1 3.72Å; M522-F564 HydrophobicContact SD-CZ 3.58Å; M522-F564 VanDerWaalsContact SD-CZ 3.58Å; M522-L571 HydrophobicContact CE-CD1 4.49Å; M522-L585 HydrophobicContact CE-CD2 4.16Å; M522-I588 HydrophobicContact CE-CD1 4.28Å
523	L	98.1	Very high	96.2	Very high	3 Å²	3	28.8 Å²	28.8	2%	0.016	13%	0.131	C	C	.	.	H	α-helix	trans	-59.7	-48.7	176.4	174.4	63.5	0	0	0	111.6	V519 E520 A525 I526 R527 Q587 I588 Y591	V519-L523 WeakPolarHBondContact O-CB 3.25Å; V519-L523 PolarHBondContact O-N 3.3Å; E520-L523 PolarHBondContact O-N 3.29Å; L523-A525 VanDerWaalsContact C-N 3.31Å; L523-A525 PolarHBondContact O-N 3.13Å; L523-I526 PolarHBondContact O-N 2.92Å; L523-R527 WeakPolarHBondContact O-CB 3.43Å; L523-R527 PolarHBondContact O-N 2.94Å; L523-Q587 HydrophobicContact CD1-CB 3.79Å; L523-Q587 HydrophobicContact CD2-CB 4.19Å; L523-I588 HydrophobicContact CD1-CG1 3.99Å; L523-Y591 HydrophobicContact CD1-CE2 3.94Å
524	S	98.1	Very high	96.1	Very high	2 Å²	2	21 Å²	21	1%	0.014	11%	0.105	C	C	.	.	H	α-helix	trans	-62.9	-35.8	179.1	-88.9	0	0	0	0	112.5	A475 E520 R527 Q528	A475-S524 WeakPolarHBondContact CA-OG 3.32Å; A475-S524 PolarHBondContact N-OG 3.27Å; E520-S524 WeakPolarHBondContact O-CB 3.47Å; E520-S524 PolarHBondContact O-N 3.23Å; E520-S524 PolarHBondContact OE1-OG 2.88Å; S524-R527 PolarHBondContact OG-NH2 3.25Å; S524-Q528 PolarHBondContact O-N 2.96Å
525	A	98.1	Very high	95.8	Very high	0 Å²	0	21.1 Å²	21.1	0%	0	11%	0.108	C	C	.	.	H	α-helix	trans	-71.8	-37.6	174.1	0	0	0	0	0	113.4	V478 W482 L489 I521 M522 L523 A529	V478-A525 HydrophobicContact CG1-CB 4.06Å; W482-A525 WeakPolarHBondContact CH2-O 3.37Å; W482-A525 HydrophobicContact CZ3-CB 4.31Å; L489-A525 HydrophobicContact CB-CB 4.33Å; L489-A525 VanDerWaalsContact O-CB 3.28Å; L489-A525 WeakPolarHBondContact O-CB 3.15Å; I521-A525 WeakPolarHBondContact O-CB 3.26Å; I521-A525 PolarHBondContact O-N 3.25Å; M522-A525 PolarHBondContact O-N 2.91Å; L523-A525 VanDerWaalsContact C-N 3.31Å; L523-A525 PolarHBondContact O-N 3.13Å; A525-A529 WeakPolarHBondContact O-CB 3.36Å; A525-A529 PolarHBondContact O-N 3.11Å
526	I	98.1	Very high	95.4	Very high	0 Å²	0	24.8 Å²	24.8	0%	0	13%	0.132	C	C	.	.	H	α-helix	trans	-62.7	-47.2	172.8	-69.4	162.3	0	0	0	110.3	W492 M522 L523 A529 C530 T560 F564 I588 Y591	W492-I526 HydrophobicContact CD2-CG1 4.35Å; W492-I526 HydrophobicContact CZ2-CG1 4.19Å; M522-I526 HydrophobicContact CG-CD1 3.94Å; M522-I526 WeakPolarHBondContact O-CD1 3.48Å; M522-I526 VanDerWaalsContact O-CG1 3.24Å; M522-I526 WeakPolarHBondContact O-CG1 3.1Å; M522-I526 PolarHBondContact O-N 2.9Å; L523-I526 PolarHBondContact O-N 2.92Å; I526-A529 PolarHBondContact O-N 3.26Å; I526-C530 WeakPolarHBondContact O-CB 3.45Å; I526-C530 PolarHBondContact O-N 3.2Å; I526-C530 PolarHBondContact O-SG 3.2Å; I526-T560 HydrophobicContact CG1-CG2 4.42Å; I526-T560 HydrophobicContact CG2-CG2 3.6Å; I526-F564 HydrophobicContact CD1-CD2 4.15Å; I526-F564 HydrophobicContact CD1-CE1 4.26Å; I526-F564 HydrophobicContact CD1-CE2 3.51Å; I526-F564 HydrophobicContact CD1-CZ 3.58Å; I526-F564 HydrophobicContact CG1-CE2 4.21Å; I526-I588 HydrophobicContact CD1-CD1 4.09Å; I526-I588 HydrophobicContact CD1-CG1 4.29Å; I526-I588 HydrophobicContact CD1-CG2 4.36Å; I526-Y591 HydrophobicContact CG2-CD2 3.62Å; I526-Y591 HydrophobicContact CG2-CE2 4.25Å; I526-Y591 HydrophobicContact CG2-CG 4.14Å
527	R	96.4	Very high	94.8	Very high	68 Å²	68	25.8 Å²	25.8	26%	0.257	15%	0.148	S	C	.	.	H	α-helix	trans	-53.8	-56.4	176.1	177.1	170.8	48.3	-167.9	-12.3	111	L523 S524 A529 C530 E531 Y591	L523-R527 WeakPolarHBondContact O-CB 3.43Å; L523-R527 PolarHBondContact O-N 2.94Å; S524-R527 PolarHBondContact OG-NH2 3.25Å; R527-A529 VanDerWaalsContact C-N 3.28Å; R527-A529 PolarHBondContact O-N 3.4Å; R527-C530 PolarHBondContact O-N 3.28Å; R527-C530 VanDerWaalsContact O-N 3.16Å; R527-E531 HydrophobicContact CG-CG 4.29Å; R527-E531 WeakPolarHBondContact CG-OE1 3.44Å; R527-E531 WeakPolarHBondContact CG-OE2 3.24Å; R527-E531 WeakPolarHBondContact O-CB 3.46Å; R527-E531 PolarHBondContact O-N 2.87Å; R527-Y591 HydrophobicContact CB-CE1 4.17Å; R527-Y591 HydrophobicContact CB-CE2 4.38Å; R527-Y591 WeakPolarHBondContact CB-OH 3.18Å; R527-Y591 HydrophobicContact CG-CE1 4.14Å
528	Q	95.9	Very high	94.4	Very high	11 Å²	11	26.3 Å²	26.3	5%	0.051	15%	0.149	C	C	.	.	H	α-helix	trans	-66.5	-27.7	-176.7	-168.7	164.9	8.6	0	0	113.2	D479 W482 S524 C532	D479-Q528 VanDerWaalsContact CA-OE1 3.24Å; D479-Q528 PolarHBondContact OD1-NE2 3.45Å; W482-Q528 HydrophobicContact CD2-CB 4.5Å; W482-Q528 HydrophobicContact CD2-CG 3.87Å; W482-Q528 HydrophobicContact CE3-CB 4.28Å; W482-Q528 HydrophobicContact CE3-CG 4.12Å; W482-Q528 HydrophobicContact CG-CG 4.43Å; W482-Q528 HydrophobicContact CH2-CB 3.88Å; W482-Q528 HydrophobicContact CH2-CG 4.13Å; W482-Q528 HydrophobicContact CZ2-CB 4.1Å; W482-Q528 HydrophobicContact CZ2-CG 3.86Å; W482-Q528 HydrophobicContact CZ3-CB 3.98Å; W482-Q528 HydrophobicContact CZ3-CG 4.26Å; S524-Q528 PolarHBondContact O-N 2.96Å; Q528-C532 WeakPolarHBondContact O-CA 3.43Å; Q528-C532 PolarHBondContact O-N 3.49Å
529	A	96.3	Very high	93.7	Very high	0 Å²	0	28.1 Å²	28.1	0%	0	17%	0.168	C	C	.	.	H	α-helix	trans	-67.1	-49.1	170.4	0	0	0	0	0	112.2	W482 W492 A525 I526 R527 C532 D556	W482-A529 HydrophobicContact CH2-CB 3.97Å; W482-A529 HydrophobicContact CZ2-CB 4.33Å; W492-A529 HydrophobicContact CH2-CB 4.06Å; W492-A529 HydrophobicContact CZ2-CB 3.87Å; A525-A529 WeakPolarHBondContact O-CB 3.36Å; A525-A529 PolarHBondContact O-N 3.11Å; I526-A529 PolarHBondContact O-N 3.26Å; R527-A529 VanDerWaalsContact C-N 3.28Å; R527-A529 PolarHBondContact O-N 3.4Å; A529-C532 PolarHBondContact O-SG 3.18Å; A529-D556 HydrophobicContact CB-CB 4.29Å
530	C	94.3	Very high	92.5	Very high	13 Å²	13	32.8 Å²	32.8	9%	0.088	20%	0.201	C	C	.	.	H	α-helix	trans	-79.2	-35.6	-171.8	-62.4	0	0	0	0	113	I526 R527 Q553 Y591	I526-C530 WeakPolarHBondContact O-CB 3.45Å; I526-C530 PolarHBondContact O-N 3.2Å; I526-C530 PolarHBondContact O-SG 3.2Å; R527-C530 PolarHBondContact O-N 3.28Å; R527-C530 VanDerWaalsContact O-N 3.16Å; C530-Q553 WeakPolarHBondContact O-CG 3.46Å; C530-Q553 PolarHBondContact O-NE2 2.97Å; C530-Y591 HydrophobicContact CB-CD1 4.01Å; C530-Y591 HydrophobicContact CB-CG 4.19Å
531	E	91.5	Very high	91.1	Very high	67 Å²	67	34.8 Å²	34.8	31%	0.313	23%	0.227	S	C	.	.	H	α-helix	trans	-81.8	-29.8	177.4	-67.1	175.7	177.6	0	0	112.4	R527 H533 Y591	R527-E531 HydrophobicContact CG-CG 4.29Å; R527-E531 WeakPolarHBondContact CG-OE1 3.44Å; R527-E531 WeakPolarHBondContact CG-OE2 3.24Å; R527-E531 WeakPolarHBondContact O-CB 3.46Å; R527-E531 PolarHBondContact O-N 2.87Å; E531-H533 PolarHBondContact O-N 2.79Å; E531-H533 IonicContact OE2-CE1 3.22Å; E531-H533 PolarHBondContact OE2-CE1 3.23Å; E531-H533 IonicContact OE2-ND1 3.83Å; E531-H533 IonicContact OE2-NE2 3.09Å; E531-Y591 HydrophobicContact CG-CE1 4.34Å
532	C	91.3	Very high	89.8	Confident	37 Å²	37	45.2 Å²	45.2	25%	0.25	27%	0.273	C	S	.	.			trans	58.1	24.9	-178.7	-86.6	0	0	0	0	115.6	Q528 A529 L545 Q553	Q528-C532 WeakPolarHBondContact O-CA 3.43Å; Q528-C532 PolarHBondContact O-N 3.49Å; A529-C532 PolarHBondContact O-SG 3.18Å; C532-L545 HydrophobicContact CB-CD1 3.72Å; C532-L545 HydrophobicContact CB-CD2 3.96Å; C532-Q553 HydrophobicContact CB-CG 4.37Å
533	H	89.3	Confident	89	Confident	102 Å²	102	52.2 Å²	52.2	47%	0.472	30%	0.299	S	S	.	.	S	Bend	trans	-124.6	156.1	164.9	56.7	64.8	0	0	0	111.6	E531	E531-H533 PolarHBondContact O-N 2.79Å; E531-H533 IonicContact OE2-CE1 3.22Å; E531-H533 PolarHBondContact OE2-CE1 3.23Å; E531-H533 IonicContact OE2-ND1 3.83Å; E531-H533 IonicContact OE2-NE2 3.09Å
534	P	91.6	Very high	88.3	Confident	29 Å²	29	57.7 Å²	57.7	19%	0.188	33%	0.332	C	S	.	.	P	Polyproline II helix	trans	-59.4	167.2	168	-22.8	35.1	0	0	0	112.1	R538	P534-R538 HydrophobicContact CB-CB 3.8Å
535	P	91.1	Very high	87.8	Confident	26 Å²	26	59.3 Å²	59.3	17%	0.169	34%	0.341	C	S	.	.	P	Polyproline II helix	trans	-61.3	172.3	166.8	27.2	-35.5	0	0	0	112.5	A475 Y476 D479 R538 G539	A475-P535 HydrophobicContact CB-CB 4.41Å; Y476-P535 HydrophobicContact CD1-CB 4.25Å; Y476-P535 HydrophobicContact CD1-CG 3.62Å; Y476-P535 HydrophobicContact CE1-CB 3.94Å; Y476-P535 HydrophobicContact CE1-CG 3.73Å; D479-P535 HydrophobicContact CB-CG 4.07Å; P535-R538 HydrophobicContact CG-CB 4.44Å; P535-R538 PolarHBondContact O-N 3.25Å; P535-G539 PolarHBondContact O-N 2.93Å
536	V	87.4	Confident	87.5	Confident	105 Å²	105	62.8 Å²	62.8	64%	0.636	36%	0.362	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53	152.9	174.9	69.4	0	0	0	0	111.7	R538	V536-R538 PolarHBondContact O-N 3.05Å
537	G	85.6	Confident	87.4	Confident	47 Å²	47	67.1 Å²	67.1	49%	0.485	40%	0.398	S	S	.	.	T	Hydrogen-bonded Turn	trans	72.2	-27.8	-172.2	0	0	0	0	0	115
538	R	89.1	Confident	87.3	Confident	13 Å²	13	71.9 Å²	71.9	5%	0.049	42%	0.42	C	S	.	.	T	Hydrogen-bonded Turn	trans	-102.4	-14.6	-173.3	-69.4	-159.7	177.8	179	5.5	115.9	V415 S417 R420 A423 Y476 D479 S480 P534 P535 V536	V415-R538 PolarHBondContact O-NH2 3.38Å; S417-R538 PolarHBondContact O-NE 2.96Å; S417-R538 PolarHBondContact O-NH2 3Å; R420-R538 HydrophobicContact CB-CB 4.07Å; R420-R538 HydrophobicContact CB-CG 4.11Å; R420-R538 WeakPolarHBondContact CD-O 3.38Å; R420-R538 HydrophobicContact CG-CB 4.36Å; A423-R538 VanDerWaalsContact CB-NH2 3.32Å; Y476-R538 HydrophobicContact CD1-CG 4.35Å; Y476-R538 HydrophobicContact CE1-CG 4.3Å; Y476-R538 PolarHBondContact O-NH1 3.25Å; D479-R538 WeakPolarHBondContact OD2-CD 3.24Å; D479-R538 IonicContact OD2-CZ 3.48Å; D479-R538 IonicContact OD2-NE 2.77Å; D479-R538 IonicContact OD2-NH1 3.19Å; D479-R538 PolarHBondContact OD2-NH1 2.92Å; S480-R538 PolarHBondContact OG-NH1 3.22Å; P534-R538 HydrophobicContact CB-CB 3.8Å; P535-R538 HydrophobicContact CG-CB 4.44Å; P535-R538 PolarHBondContact O-N 3.25Å; V536-R538 PolarHBondContact O-N 3.05Å
539	G	84.2	Confident	87.1	Confident	40 Å²	40	73.9 Å²	73.9	41%	0.412	43%	0.43	S	S	.	.			trans	-75.1	133.9	177.9	0	0	0	0	0	114	P535 G541	P535-G539 PolarHBondContact O-N 2.93Å; G539-G541 PolarHBondContact O-N 2.83Å
540	S	72.1	Confident	87	Confident	100 Å²	100	79.4 Å²	79.4	70%	0.699	45%	0.454	S	S	*	.			trans	-83	55.1	178.1	48.3	0	0	0	0	113.6
541	G	68.3	Low	87.1	Confident	64 Å²	64	84.8 Å²	84.8	66%	0.66	48%	0.476	S	S	*	.	S	Bend	trans	66.1	-161.1	-178.5	0	0	0	0	0	113.6	G539 R543	G539-G541 PolarHBondContact O-N 2.83Å; G541-R543 PolarHBondContact O-N 3.26Å
542	K	70.8	Confident	87.2	Confident	222 Å²	222	84 Å²	84	97%	0.965	48%	0.476	S	S	*	.	S	Bend	trans	-75.7	65.4	179.6	-64.1	-168.4	178.7	-173.8	0	111.9
543	R	81.5	Confident	87.4	Confident	147 Å²	147	84.7 Å²	84.7	56%	0.555	48%	0.475	S	S	*	.	P	Polyproline II helix	trans	-65.8	132.3	174.6	179.1	-179.2	171.3	-142.3	-15.4	110.5	G541 E549	G541-R543 PolarHBondContact O-N 3.26Å; R543-E549 IonicContact CZ-OE1 2.76Å; R543-E549 IonicContact NH1-OE1 2.72Å; R543-E549 VanDerWaalsContact NH2-CD 3.33Å; R543-E549 IonicContact NH2-OE1 3.83Å; R543-E549 PolarHBondContact NH2-OE1 3.41Å; R543-E549 IonicContact NH2-OE2 3.87Å; R543-E549 PolarHBondContact NH2-OE2 3.06Å
544	V	83.9	Confident	87.7	Confident	118 Å²	118	84.3 Å²	84.3	72%	0.715	48%	0.476	S	S	*	.	P	Polyproline II helix	trans	-85	125.7	175.1	-177.2	0	0	0	0	110.4
545	L	87.7	Confident	87.9	Confident	37 Å²	37	86.4 Å²	86.4	19%	0.194	49%	0.486	C	S	.	.	P	Polyproline II helix	trans	-66.7	135.7	175.4	-60.6	177.7	0	0	0	112	C532 E549 K550 Q553	C532-L545 HydrophobicContact CB-CD1 3.72Å; C532-L545 HydrophobicContact CB-CD2 3.96Å; L545-E549 HydrophobicContact CB-CB 4.28Å; L545-E549 HydrophobicContact CD2-CB 4.36Å; L545-K550 HydrophobicContact CB-CD 4.49Å; L545-K550 HydrophobicContact CB-CG 3.7Å; L545-K550 HydrophobicContact CD1-CG 4.38Å; L545-K550 WeakPolarHBondContact O-CE 3.42Å; L545-Q553 VanDerWaalsContact CD1-OE1 3.31Å
546	T	91.6	Very high	88.2	Confident	72 Å²	72	85.8 Å²	85.8	44%	0.442	48%	0.481	S	S	.	.	P	Polyproline II helix	trans	-69.7	163.4	174.3	64.1	0	0	0	0	112	K548 E549 K550	T546-K548 PolarHBondContact O-N 2.86Å; T546-E549 VanDerWaalsContact CB-OE2 3.25Å; T546-E549 WeakPolarHBondContact CB-OE2 3.08Å; T546-E549 VanDerWaalsContact CG2-OE2 3.25Å; T546-E549 WeakPolarHBondContact CG2-OE2 3.24Å; T546-E549 PolarHBondContact N-OE2 2.98Å; T546-E549 PolarHBondContact O-N 3.16Å; T546-E549 VanDerWaalsContact OG1-CD 3.29Å; T546-E549 WeakPolarHBondContact OG1-CG 3.13Å; T546-E549 PolarHBondContact OG1-N 3.1Å; T546-E549 PolarHBondContact OG1-OE2 2.67Å; T546-K550 WeakPolarHBondContact O-CG 3.16Å; T546-K550 PolarHBondContact O-N 2.73Å
547	A	94.6	Very high	88.6	Confident	91 Å²	91	85.3 Å²	85.3	75%	0.752	47%	0.468	S	S	*	.	H	α-helix	trans	-61	-26.1	176.4	0	0	0	0	0	113.8	K551	A547-K551 PolarHBondContact O-N 3.1Å
548	K	94.4	Very high	89.1	Confident	168 Å²	168	85 Å²	85	73%	0.73	46%	0.457	S	S	*	.	H	α-helix	trans	-72.4	-50.6	172.4	-174.2	-172.7	174.7	-168.3	0	110.6	T546 K550 K551 T552	T546-K548 PolarHBondContact O-N 2.86Å; K548-K550 PolarHBondContact O-N 3.19Å; K548-K551 PolarHBondContact O-N 2.98Å; K548-K551 VanDerWaalsContact O-N 3.1Å; K548-T552 PolarHBondContact O-N 3.49Å; K548-T552 PolarHBondContact O-OG1 3.4Å
549	E	92.6	Very high	89.5	Confident	54 Å²	54	90.4 Å²	90.4	25%	0.252	48%	0.477	S	S	.	.	H	α-helix	trans	-60.2	-44.4	179.9	-70.2	160.2	139	0	0	111.4	R543 L545 T546 K551 T552 Q553	R543-E549 IonicContact CZ-OE1 2.76Å; R543-E549 IonicContact NH1-OE1 2.72Å; R543-E549 VanDerWaalsContact NH2-CD 3.33Å; R543-E549 IonicContact NH2-OE1 3.83Å; R543-E549 PolarHBondContact NH2-OE1 3.41Å; R543-E549 IonicContact NH2-OE2 3.87Å; R543-E549 PolarHBondContact NH2-OE2 3.06Å; L545-E549 HydrophobicContact CB-CB 4.28Å; L545-E549 HydrophobicContact CD2-CB 4.36Å; T546-E549 VanDerWaalsContact CB-OE2 3.25Å; T546-E549 WeakPolarHBondContact CB-OE2 3.08Å; T546-E549 VanDerWaalsContact CG2-OE2 3.25Å; T546-E549 WeakPolarHBondContact CG2-OE2 3.24Å; T546-E549 PolarHBondContact N-OE2 2.98Å; T546-E549 PolarHBondContact O-N 3.16Å; T546-E549 VanDerWaalsContact OG1-CD 3.29Å; T546-E549 WeakPolarHBondContact OG1-CG 3.13Å; T546-E549 PolarHBondContact OG1-N 3.1Å; T546-E549 PolarHBondContact OG1-OE2 2.67Å; E549-K551 VanDerWaalsContact C-N 3.28Å; E549-K551 PolarHBondContact O-N 2.86Å; E549-T552 PolarHBondContact O-N 3.13Å; E549-T552 VanDerWaalsContact O-N 3.15Å; E549-Q553 WeakPolarHBondContact O-CB 3.34Å; E549-Q553 PolarHBondContact O-N 3.18Å
550	K	93.9	Very high	90.1	Very high	115 Å²	115	88.5 Å²	88.5	50%	0.5	46%	0.458	S	S	.	.	H	α-helix	trans	-61.2	-32.3	174.5	-70	-170.2	177.4	-164.1	0	113.8	L545 T546 K548 L554	L545-K550 HydrophobicContact CB-CD 4.49Å; L545-K550 HydrophobicContact CB-CG 3.7Å; L545-K550 HydrophobicContact CD1-CG 4.38Å; L545-K550 WeakPolarHBondContact O-CE 3.42Å; T546-K550 WeakPolarHBondContact O-CG 3.16Å; T546-K550 PolarHBondContact O-N 2.73Å; K548-K550 PolarHBondContact O-N 3.19Å; K550-L554 PolarHBondContact O-N 2.6Å
551	K	95.9	Very high	91.3	Very high	126 Å²	126	83.8 Å²	83.8	55%	0.548	42%	0.424	S	S	.	.	H	α-helix	trans	-70.3	-48.7	172.6	-168.2	-169.4	176.9	-114.6	0	110.3	A547 K548 E549 Q553 L554 D555	A547-K551 PolarHBondContact O-N 3.1Å; K548-K551 PolarHBondContact O-N 2.98Å; K548-K551 VanDerWaalsContact O-N 3.1Å; E549-K551 VanDerWaalsContact C-N 3.28Å; E549-K551 PolarHBondContact O-N 2.86Å; K551-Q553 VanDerWaalsContact C-N 3.29Å; K551-Q553 PolarHBondContact O-N 3.3Å; K551-L554 PolarHBondContact O-N 3.08Å; K551-L554 VanDerWaalsContact O-N 3.09Å; K551-D555 VanDerWaalsContact CE-OD1 3.3Å; K551-D555 WeakPolarHBondContact CE-OD1 3.27Å; K551-D555 WeakPolarHBondContact CE-OD2 3.4Å; K551-D555 IonicContact NZ-OD1 2.66Å; K551-D555 PolarHBondContact NZ-OD1 2.96Å; K551-D555 IonicContact NZ-OD2 2.67Å; K551-D555 PolarHBondContact NZ-OD2 2.77Å; K551-D555 WeakPolarHBondContact O-CB 3.41Å; K551-D555 PolarHBondContact O-N 2.76Å
552	T	94.8	Very high	92.6	Very high	51 Å²	51	86 Å²	86	31%	0.313	42%	0.418	S	S	.	.	H	α-helix	trans	-57.9	-41.9	177.9	-64.2	0	0	0	0	111.6	K548 E549 L554 D555 D556	K548-T552 PolarHBondContact O-N 3.49Å; K548-T552 PolarHBondContact O-OG1 3.4Å; E549-T552 PolarHBondContact O-N 3.13Å; E549-T552 VanDerWaalsContact O-N 3.15Å; T552-L554 VanDerWaalsContact C-N 3.32Å; T552-L554 PolarHBondContact O-N 3.29Å; T552-D555 PolarHBondContact O-N 3.14Å; T552-D556 WeakPolarHBondContact CG2-OD2 3.34Å; T552-D556 VanDerWaalsContact O-CB 3.22Å; T552-D556 WeakPolarHBondContact O-CB 3.45Å; T552-D556 PolarHBondContact O-N 2.95Å
553	Q	95.1	Very high	93.9	Very high	52 Å²	52	77.8 Å²	77.8	24%	0.243	38%	0.383	C	S	.	.	H	α-helix	trans	-54.9	-43.9	173.3	-171	179.4	22.3	0	0	112.6	C530 C532 L545 E549 K551 R557	C530-Q553 WeakPolarHBondContact O-CG 3.46Å; C530-Q553 PolarHBondContact O-NE2 2.97Å; C532-Q553 HydrophobicContact CB-CG 4.37Å; L545-Q553 VanDerWaalsContact CD1-OE1 3.31Å; E549-Q553 WeakPolarHBondContact O-CB 3.34Å; E549-Q553 PolarHBondContact O-N 3.18Å; K551-Q553 VanDerWaalsContact C-N 3.29Å; K551-Q553 PolarHBondContact O-N 3.3Å; Q553-R557 VanDerWaalsContact O-CB 3.22Å; Q553-R557 WeakPolarHBondContact O-CB 3.15Å; Q553-R557 PolarHBondContact O-N 3.46Å
554	L	95.3	Very high	94.7	Very high	94 Å²	94	70.8 Å²	70.8	49%	0.492	36%	0.357	S	S	.	.	H	α-helix	trans	-72.9	-47.9	177.6	-176.1	63.6	0	0	0	111.9	K550 K551 T552 D556 R557 T558	K550-L554 PolarHBondContact O-N 2.6Å; K551-L554 PolarHBondContact O-N 3.08Å; K551-L554 VanDerWaalsContact O-N 3.09Å; T552-L554 VanDerWaalsContact C-N 3.32Å; T552-L554 PolarHBondContact O-N 3.29Å; L554-D556 PolarHBondContact O-N 3.23Å; L554-R557 PolarHBondContact O-N 3.34Å; L554-T558 WeakPolarHBondContact O-CB 3.47Å; L554-T558 PolarHBondContact O-N 2.85Å; L554-T558 PolarHBondContact O-OG1 3Å; L554-T558 VanDerWaalsContact O-OG1 3.09Å
555	D	96.1	Very high	95.3	Very high	73 Å²	73	65.2 Å²	65.2	39%	0.39	32%	0.323	S	S	.	.	H	α-helix	trans	-56.4	-39.5	176.9	-69.2	-17.3	0	0	0	110.9	K551 T552 R559	K551-D555 VanDerWaalsContact CE-OD1 3.3Å; K551-D555 WeakPolarHBondContact CE-OD1 3.27Å; K551-D555 WeakPolarHBondContact CE-OD2 3.4Å; K551-D555 IonicContact NZ-OD1 2.66Å; K551-D555 PolarHBondContact NZ-OD1 2.96Å; K551-D555 IonicContact NZ-OD2 2.67Å; K551-D555 PolarHBondContact NZ-OD2 2.77Å; K551-D555 WeakPolarHBondContact O-CB 3.41Å; K551-D555 PolarHBondContact O-N 2.76Å; T552-D555 PolarHBondContact O-N 3.14Å; D555-R559 PolarHBondContact O-N 3.34Å
556	D	96.4	Very high	95.8	Very high	13 Å²	13	66.1 Å²	66.1	7%	0.07	33%	0.33	C	S	.	.	H	α-helix	trans	-69.4	-50	174.6	-72.9	-29.9	0	0	0	111.6	K490 W492 A529 T552 L554 T558 R559 T560	K490-D556 IonicContact NZ-OD1 3.89Å; K490-D556 IonicContact NZ-OD2 3.14Å; K490-D556 PolarHBondContact NZ-OD2 3.03Å; W492-D556 HydrophobicContact CH2-CB 4.32Å; A529-D556 HydrophobicContact CB-CB 4.29Å; T552-D556 WeakPolarHBondContact CG2-OD2 3.34Å; T552-D556 VanDerWaalsContact O-CB 3.22Å; T552-D556 WeakPolarHBondContact O-CB 3.45Å; T552-D556 PolarHBondContact O-N 2.95Å; L554-D556 PolarHBondContact O-N 3.23Å; D556-T558 VanDerWaalsContact C-N 3.33Å; D556-T558 PolarHBondContact O-N 3.1Å; D556-R559 WeakPolarHBondContact O-CA 3.25Å; D556-R559 WeakPolarHBondContact O-CB 3.08Å; D556-R559 PolarHBondContact O-N 3.07Å; D556-R559 VanDerWaalsContact O-N 3.08Å; D556-T560 PolarHBondContact O-N 3.38Å; D556-T560 PolarHBondContact O-OG1 3.13Å; D556-T560 VanDerWaalsContact O-OG1 3.07Å
557	R	96.8	Very high	96.1	Very high	94 Å²	94	63.1 Å²	63.1	36%	0.355	31%	0.313	S	S	.	.	H	α-helix	trans	-58.7	-41.9	-179.7	-169.3	-176.8	-178.7	-178.8	-2.8	112.5	Q553 L554 T560 T561 Y591 F592 D593	Q553-R557 VanDerWaalsContact O-CB 3.22Å; Q553-R557 WeakPolarHBondContact O-CB 3.15Å; Q553-R557 PolarHBondContact O-N 3.46Å; L554-R557 PolarHBondContact O-N 3.34Å; R557-T560 PolarHBondContact O-N 2.89Å; R557-T561 PolarHBondContact O-N 3.2Å; R557-T561 PolarHBondContact O-OG1 2.99Å; R557-Y591 WeakPolarHBondContact CG-O 3.4Å; R557-Y591 PolarHBondContact NE-O 2.82Å; R557-F592 PolarHBondContact NE-O 3.31Å; R557-F592 PolarHBondContact NH2-O 2.93Å; R557-D593 HydrophobicContact CG-CB 4.43Å
558	T	96.8	Very high	96.3	Very high	42 Å²	42	58.9 Å²	58.9	26%	0.258	28%	0.277	S	S	.	.	H	α-helix	trans	-58.6	-50.3	173.1	-62.4	0	0	0	0	110.4	L554 D556 T560 T561 E562 I596	L554-T558 WeakPolarHBondContact O-CB 3.47Å; L554-T558 PolarHBondContact O-N 2.85Å; L554-T558 PolarHBondContact O-OG1 3Å; L554-T558 VanDerWaalsContact O-OG1 3.09Å; D556-T558 VanDerWaalsContact C-N 3.33Å; D556-T558 PolarHBondContact O-N 3.1Å; T558-T560 PolarHBondContact O-N 2.72Å; T558-T561 PolarHBondContact O-N 2.7Å; T558-E562 HydrophobicContact CG2-CG 4.49Å; T558-E562 WeakPolarHBondContact O-CG 3.42Å; T558-E562 PolarHBondContact O-N 3.22Å; T558-I596 HydrophobicContact CG2-CD1 3.82Å
559	R	96.5	Very high	96.4	Very high	126 Å²	126	51.2 Å²	51.2	48%	0.475	25%	0.245	S	C	.	.	H	α-helix	trans	-60.1	-46.7	178.1	178.6	-174.6	-62.7	-171.8	1.1	112.6	W492 D555 D556 T561 E562 M563	W492-R559 HydrophobicContact CE3-CG 4.24Å; W492-R559 HydrophobicContact CZ3-CB 4.32Å; W492-R559 HydrophobicContact CZ3-CG 4.09Å; D555-R559 PolarHBondContact O-N 3.34Å; D556-R559 WeakPolarHBondContact O-CA 3.25Å; D556-R559 WeakPolarHBondContact O-CB 3.08Å; D556-R559 PolarHBondContact O-N 3.07Å; D556-R559 VanDerWaalsContact O-N 3.08Å; R559-T561 PolarHBondContact O-N 2.99Å; R559-E562 PolarHBondContact O-N 3.1Å; R559-M563 HydrophobicContact CG-CG 4.38Å; R559-M563 HydrophobicContact CG-SD 3.43Å; R559-M563 WeakPolarHBondContact CG-SD 3.32Å; R559-M563 WeakPolarHBondContact O-CB 3.24Å; R559-M563 VanDerWaalsContact O-CG 3.31Å; R559-M563 WeakPolarHBondContact O-CG 3.49Å; R559-M563 PolarHBondContact O-N 2.86Å; R559-M563 VanDerWaalsContact O-N 3.09Å
560	T	96.9	Very high	96.7	Very high	0 Å²	0	53.4 Å²	53.4	0%	0	26%	0.258	C	S	.	.	H	α-helix	trans	-53.6	-47.2	175.8	-54.3	0	0	0	0	110.1	W492 I526 D556 R557 T558 F564 F592	W492-T560 WeakPolarHBondContact CH2-OG1 3.41Å; W492-T560 WeakPolarHBondContact CZ3-OG1 3.44Å; I526-T560 HydrophobicContact CG1-CG2 4.42Å; I526-T560 HydrophobicContact CG2-CG2 3.6Å; D556-T560 PolarHBondContact O-N 3.38Å; D556-T560 PolarHBondContact O-OG1 3.13Å; D556-T560 VanDerWaalsContact O-OG1 3.07Å; R557-T560 PolarHBondContact O-N 2.89Å; T558-T560 PolarHBondContact O-N 2.72Å; T560-F564 HydrophobicContact CG2-CD2 3.93Å; T560-F564 WeakPolarHBondContact O-CB 3.48Å; T560-F564 WeakPolarHBondContact O-CD2 3.46Å; T560-F564 PolarHBondContact O-N 3.02Å; T560-F592 HydrophobicContact CG2-CD1 4.4Å; T560-F592 HydrophobicContact CG2-CE1 4.25Å
561	T	97.2	Very high	96.9	Very high	0 Å²	0	48 Å²	48	0%	0	23%	0.234	C	C	.	.	H	α-helix	trans	-66	-50.5	-177.8	-48.7	0	0	0	0	111.9	R557 T558 R559 M563 A565 F592 D593 I596	R557-T561 PolarHBondContact O-N 3.2Å; R557-T561 PolarHBondContact O-OG1 2.99Å; T558-T561 PolarHBondContact O-N 2.7Å; R559-T561 PolarHBondContact O-N 2.99Å; T561-M563 VanDerWaalsContact C-N 3.27Å; T561-M563 PolarHBondContact O-N 3.14Å; T561-A565 WeakPolarHBondContact O-CB 3.26Å; T561-A565 PolarHBondContact O-N 2.96Å; T561-F592 HydrophobicContact CG2-CB 3.85Å; T561-F592 HydrophobicContact CG2-CD1 4.23Å; T561-F592 HydrophobicContact CG2-CD2 4.41Å; T561-F592 HydrophobicContact CG2-CG 3.93Å; T561-F592 WeakPolarHBondContact OG1-CA 3.43Å; T561-D593 PolarHBondContact OG1-N 3.04Å; T561-I596 HydrophobicContact CG2-CB 3.86Å; T561-I596 HydrophobicContact CG2-CD1 4.09Å; T561-I596 HydrophobicContact CG2-CG1 4.49Å; T561-I596 HydrophobicContact CG2-CG2 4.07Å
562	E	96.6	Very high	97	Very high	112 Å²	112	42 Å²	42	52%	0.523	21%	0.208	S	C	.	.	H	α-helix	trans	-58.1	-38.8	-179.5	-71.3	-177.3	148.8	0	0	112.4	T558 R559 I596	T558-E562 HydrophobicContact CG2-CG 4.49Å; T558-E562 WeakPolarHBondContact O-CG 3.42Å; T558-E562 PolarHBondContact O-N 3.22Å; R559-E562 PolarHBondContact O-N 3.1Å; E562-I596 HydrophobicContact CG-CG2 3.92Å
563	M	96.4	Very high	97.2	Very high	49 Å²	49	41.8 Å²	41.8	24%	0.241	21%	0.211	C	C	.	.	H	α-helix	trans	-79.3	-54.3	-178.6	-65.7	172.1	64.2	0	0	112.5	W492 E493 I496 R559 T561 V566 A567	W492-M563 HydrophobicContact CB-CE 3.91Å; E493-M563 HydrophobicContact CB-CE 3.74Å; E493-M563 VanDerWaalsContact N-CE 3.27Å; I496-M563 HydrophobicContact CD1-CB 4.46Å; I496-M563 HydrophobicContact CD1-CE 4.23Å; R559-M563 HydrophobicContact CG-CG 4.38Å; R559-M563 HydrophobicContact CG-SD 3.43Å; R559-M563 WeakPolarHBondContact CG-SD 3.32Å; R559-M563 WeakPolarHBondContact O-CB 3.24Å; R559-M563 VanDerWaalsContact O-CG 3.31Å; R559-M563 WeakPolarHBondContact O-CG 3.49Å; R559-M563 PolarHBondContact O-N 2.86Å; R559-M563 VanDerWaalsContact O-N 3.09Å; T561-M563 VanDerWaalsContact C-N 3.27Å; T561-M563 PolarHBondContact O-N 3.14Å; M563-V566 PolarHBondContact O-N 3.45Å; M563-A567 PolarHBondContact O-N 3Å
564	F	98.2	Very high	97.3	Very high	0 Å²	0	44.1 Å²	44.1	0%	0	22%	0.221	C	C	.	.	H	α-helix	trans	-77.6	-22.3	-174.2	-74.1	-82.3	0	0	0	113.3	W492 I496 M522 I526 T560 V566 A567 L568 L571 I588 F592	W492-F564 HydrophobicContact CB-CE2 3.83Å; W492-F564 HydrophobicContact CB-CZ 4.05Å; W492-F564 HydrophobicContact CD2-CE2 4.36Å; W492-F564 HydrophobicContact CG-CE2 4.04Å; W492-F564 HydrophobicContact CG-CZ 4.45Å; I496-F564 HydrophobicContact CD1-CD1 4.18Å; I496-F564 HydrophobicContact CD1-CE1 3.74Å; I496-F564 HydrophobicContact CD1-CE2 4.15Å; I496-F564 HydrophobicContact CD1-CZ 3.71Å; I496-F564 HydrophobicContact CG1-CE1 3.74Å; I496-F564 HydrophobicContact CG1-CZ 3.89Å; M522-F564 HydrophobicContact CE-CE1 3.9Å; M522-F564 HydrophobicContact CE-CZ 4.29Å; M522-F564 HydrophobicContact CG-CZ 4.01Å; M522-F564 HydrophobicContact SD-CE1 3.72Å; M522-F564 HydrophobicContact SD-CZ 3.58Å; M522-F564 VanDerWaalsContact SD-CZ 3.58Å; I526-F564 HydrophobicContact CD1-CD2 4.15Å; I526-F564 HydrophobicContact CD1-CE1 4.26Å; I526-F564 HydrophobicContact CD1-CE2 3.51Å; I526-F564 HydrophobicContact CD1-CZ 3.58Å; I526-F564 HydrophobicContact CG1-CE2 4.21Å; T560-F564 HydrophobicContact CG2-CD2 3.93Å; T560-F564 WeakPolarHBondContact O-CB 3.48Å; T560-F564 WeakPolarHBondContact O-CD2 3.46Å; T560-F564 PolarHBondContact O-N 3.02Å; F564-V566 PolarHBondContact O-N 3.36Å; F564-A567 PolarHBondContact O-N 3.02Å; F564-L568 WeakPolarHBondContact O-CB 3.5Å; F564-L568 PolarHBondContact O-N 3.09Å; F564-L571 HydrophobicContact CD1-CD1 4.41Å; F564-L571 HydrophobicContact CE1-CD1 4.26Å; F564-I588 HydrophobicContact CB-CG2 3.95Å; F564-I588 HydrophobicContact CD1-CD1 4.13Å; F564-I588 HydrophobicContact CD1-CG2 4.25Å; F564-I588 HydrophobicContact CD2-CG2 4.45Å; F564-I588 HydrophobicContact CE1-CD1 4.13Å; F564-I588 HydrophobicContact CG-CG2 3.97Å; F564-F592 HydrophobicContact CB-CE1 3.69Å; F564-F592 HydrophobicContact CB-CZ 3.64Å
565	A	97.4	Very high	97.4	Very high	0 Å²	0	40.1 Å²	40.1	0%	0	20%	0.199	C	C	.	.	H	α-helix	trans	-56.4	-35.1	168.1	0	0	0	0	0	111.7	T561 Y597 L602 H605	T561-A565 WeakPolarHBondContact O-CB 3.26Å; T561-A565 PolarHBondContact O-N 2.96Å; A565-Y597 HydrophobicContact CB-CE1 3.71Å; A565-Y597 HydrophobicContact CB-CE2 4.41Å; A565-L602 HydrophobicContact CB-CD1 3.84Å; A565-H605 VanDerWaalsContact O-CB 3.24Å; A565-H605 WeakPolarHBondContact O-CB 3.24Å
566	V	97.8	Very high	97.4	Very high	57 Å²	57	37.5 Å²	37.5	35%	0.345	19%	0.186	S	C	.	.	H	α-helix	trans	-85.1	-43	177	179.2	0	0	0	0	112.3	M563 F564 L602	M563-V566 PolarHBondContact O-N 3.45Å; F564-V566 PolarHBondContact O-N 3.36Å; V566-L602 HydrophobicContact CG2-CD2 4.39Å
567	A	98	Very high	97.3	Very high	9 Å²	9	42.5 Å²	42.5	7%	0.074	22%	0.217	C	C	.	.	H	α-helix	trans	-83.6	-33.8	-172.1	0	0	0	0	0	114.9	I496 M563 F564 L570 L571	I496-A567 HydrophobicContact CD1-CB 3.85Å; I496-A567 HydrophobicContact CG1-CB 4.23Å; I496-A567 HydrophobicContact CG2-CB 3.8Å; M563-A567 PolarHBondContact O-N 3Å; F564-A567 PolarHBondContact O-N 3.02Å; A567-L570 WeakPolarHBondContact O-CB 3.3Å; A567-L570 PolarHBondContact O-N 2.73Å; A567-L571 HydrophobicContact CB-CD1 4.44Å; A567-L571 PolarHBondContact O-N 2.86Å
568	L	98.2	Very high	97.3	Very high	1 Å²	1	39.5 Å²	39.5	1%	0.005	21%	0.208	C	C	.	.	H	α-helix	trans	-59.3	-41	-174.7	-179	62.3	0	0	0	113.7	F564 L570 L571 L572 L585 I588 P589 F592 L609	F564-L568 WeakPolarHBondContact O-CB 3.5Å; F564-L568 PolarHBondContact O-N 3.09Å; L568-L570 PolarHBondContact O-N 3.37Å; L568-L571 PolarHBondContact O-N 2.84Å; L568-L572 HydrophobicContact CD1-CD1 4.15Å; L568-L572 HydrophobicContact CD1-CG 4Å; L568-L572 HydrophobicContact CG-CD1 4.01Å; L568-L572 HydrophobicContact CG-CG 4.32Å; L568-L572 WeakPolarHBondContact O-CB 3.38Å; L568-L572 WeakPolarHBondContact O-CG 3.43Å; L568-L572 PolarHBondContact O-N 3.14Å; L568-L585 HydrophobicContact CD1-CB 3.85Å; L568-L585 HydrophobicContact CD1-CD2 4.02Å; L568-L585 HydrophobicContact CD1-CG 4.48Å; L568-L585 WeakPolarHBondContact CD1-O 3.5Å; L568-I588 HydrophobicContact CD2-CB 4.49Å; L568-P589 HydrophobicContact CD2-CG 3.41Å; L568-P589 VanDerWaalsContact CD2-CG 3.41Å; L568-F592 HydrophobicContact CD2-CZ 4.47Å; L568-L609 HydrophobicContact CD2-CD1 3.77Å; L568-L609 HydrophobicContact CD2-CD2 4.39Å; L568-L609 HydrophobicContact CG-CD1 3.92Å
569	P	98.3	Very high	97.3	Very high	8 Å²	8	41 Å²	41	5%	0.052	21%	0.213	C	C	.	.	H	α-helix	trans	-61.3	-29.3	173.6	-23	34.4	0	0	0	113.5	A573 A608 L609 Q612	P569-A573 VanDerWaalsContact O-CB 3.29Å; P569-A573 WeakPolarHBondContact O-CB 3.48Å; P569-A573 PolarHBondContact O-N 3.01Å; P569-A573 VanDerWaalsContact O-N 3.11Å; P569-A608 HydrophobicContact CB-CB 3.96Å; P569-A608 HydrophobicContact CG-CB 4.21Å; P569-L609 HydrophobicContact CG-CB 4.03Å; P569-Q612 HydrophobicContact CB-CG 4.46Å
570	L	98.3	Very high	97.2	Very high	100 Å²	100	39.5 Å²	39.5	52%	0.524	22%	0.215	S	C	.	.	H	α-helix	trans	-78.8	-39.4	178.3	-55.6	177.6	0	0	0	111.4	L500 A567 L568 A573 K574	L500-L570 HydrophobicContact CD1-CB 3.97Å; L500-L570 HydrophobicContact CD1-CD1 4.28Å; L500-L570 HydrophobicContact CD2-CB 4.22Å; A567-L570 WeakPolarHBondContact O-CB 3.3Å; A567-L570 PolarHBondContact O-N 2.73Å; L568-L570 PolarHBondContact O-N 3.37Å; L570-A573 PolarHBondContact O-N 3Å; L570-K574 PolarHBondContact O-N 2.75Å
571	L	98.3	Very high	97.3	Very high	0 Å²	0	39.5 Å²	39.5	0%	0	22%	0.215	C	C	.	.	H	α-helix	trans	-63.6	-48.4	174.4	-69.4	164.4	0	0	0	110.9	L499 L500 M522 F564 A567 L568 A573 K574 Y575 L585	L499-L571 HydrophobicContact CB-CD2 3.69Å; L499-L571 HydrophobicContact CD1-CD2 3.98Å; L499-L571 HydrophobicContact CG-CD2 4.48Å; L500-L571 HydrophobicContact CD1-CD2 4.38Å; L500-L571 HydrophobicContact CD1-CG 4.35Å; L500-L571 HydrophobicContact CD2-CD2 3.71Å; L500-L571 HydrophobicContact CD2-CG 4.13Å; L500-L571 HydrophobicContact CG-CD2 3.82Å; L500-L571 HydrophobicContact CG-CG 4.3Å; M522-L571 HydrophobicContact CE-CD1 4.49Å; F564-L571 HydrophobicContact CD1-CD1 4.41Å; F564-L571 HydrophobicContact CE1-CD1 4.26Å; A567-L571 HydrophobicContact CB-CD1 4.44Å; A567-L571 PolarHBondContact O-N 2.86Å; L568-L571 PolarHBondContact O-N 2.84Å; L571-A573 VanDerWaalsContact C-N 3.34Å; L571-A573 PolarHBondContact O-N 3.41Å; L571-K574 PolarHBondContact O-N 3.31Å; L571-Y575 HydrophobicContact CD2-CE2 4.02Å; L571-Y575 WeakPolarHBondContact O-CD2 3.49Å; L571-Y575 PolarHBondContact O-N 3.21Å; L571-L585 HydrophobicContact CB-CD1 3.89Å; L571-L585 HydrophobicContact CB-CD2 3.93Å; L571-L585 HydrophobicContact CD1-CD2 3.91Å; L571-L585 HydrophobicContact CG-CD2 4.44Å
572	L	98.4	Very high	97.3	Very high	0 Å²	0	39.5 Å²	39.5	0%	0	22%	0.215	C	C	.	.	H	α-helix	trans	-60	-42.6	174.6	-70.5	172.4	0	0	0	111.4	L568 K574 Y575 C576 V582 L585 L586 L609 Q612	L568-L572 HydrophobicContact CD1-CD1 4.15Å; L568-L572 HydrophobicContact CD1-CG 4Å; L568-L572 HydrophobicContact CG-CD1 4.01Å; L568-L572 HydrophobicContact CG-CG 4.32Å; L568-L572 WeakPolarHBondContact O-CB 3.38Å; L568-L572 WeakPolarHBondContact O-CG 3.43Å; L568-L572 PolarHBondContact O-N 3.14Å; L572-K574 PolarHBondContact O-N 3.35Å; L572-Y575 PolarHBondContact O-N 3.44Å; L572-C576 VanDerWaalsContact O-CA 3.25Å; L572-C576 WeakPolarHBondContact O-CA 3.38Å; L572-C576 WeakPolarHBondContact O-CB 3.19Å; L572-C576 PolarHBondContact O-N 2.83Å; L572-V582 HydrophobicContact CD2-CG1 4.23Å; L572-V582 HydrophobicContact CD2-CG2 4.49Å; L572-L585 HydrophobicContact CD2-CB 3.83Å; L572-L585 HydrophobicContact CD2-CD1 4.33Å; L572-L586 HydrophobicContact CD1-CD2 4.28Å; L572-L586 HydrophobicContact CD2-CD2 4.3Å; L572-L586 HydrophobicContact CD2-CG 4.26Å; L572-L609 HydrophobicContact CD1-CD1 3.67Å; L572-Q612 HydrophobicContact CB-CB 4.01Å; L572-Q612 HydrophobicContact CD1-CB 4.32Å
573	A	97.9	Very high	97.3	Very high	47 Å²	47	34.8 Å²	34.8	39%	0.388	19%	0.194	S	C	.	.	H	α-helix	trans	-60.8	-41.4	176.4	0	0	0	0	0	113.1	P569 L570 L571 Q612	P569-A573 VanDerWaalsContact O-CB 3.29Å; P569-A573 WeakPolarHBondContact O-CB 3.48Å; P569-A573 PolarHBondContact O-N 3.01Å; P569-A573 VanDerWaalsContact O-N 3.11Å; L570-A573 PolarHBondContact O-N 3Å; L571-A573 VanDerWaalsContact C-N 3.34Å; L571-A573 PolarHBondContact O-N 3.41Å; A573-Q612 VanDerWaalsContact CB-OE1 3.31Å
574	K	97.4	Very high	97.4	Very high	101 Å²	101	33.3 Å²	33.3	44%	0.439	19%	0.189	S	C	.	.	H	α-helix	trans	-66	-45	177	-179.8	178.1	168.5	-173.8	0	112	L499 E515 L570 L571 L572	L499-K574 WeakPolarHBondContact O-CD 3.27Å; L499-K574 PolarHBondContact O-NZ 3.23Å; E515-K574 IonicContact OE1-NZ 2.8Å; E515-K574 PolarHBondContact OE1-NZ 3.46Å; E515-K574 IonicContact OE2-NZ 3.19Å; L570-K574 PolarHBondContact O-N 2.75Å; L571-K574 PolarHBondContact O-N 3.31Å; L572-K574 PolarHBondContact O-N 3.35Å
575	Y	97.5	Very high	97.4	Very high	11 Å²	11	33.3 Å²	33.3	4%	0.043	19%	0.189	C	C	.	.	H	α-helix	trans	-102.5	11.7	-170.3	-57.5	-65.5	0	0	0	114.3	L499 E515 L571 L572 V577 D578 K581 V582 L585	L499-Y575 HydrophobicContact CB-CE2 4.42Å; L499-Y575 HydrophobicContact CD2-CE2 4.41Å; L499-Y575 WeakPolarHBondContact CD2-OH 3.4Å; L499-Y575 PolarHBondContact O-OH 3.04Å; E515-Y575 HydrophobicContact CB-CE1 4.26Å; E515-Y575 VanDerWaalsContact CD-OH 3.22Å; E515-Y575 PolarHBondContact OE1-OH 2.69Å; E515-Y575 WeakPolarHBondContact OE2-CE1 3.47Å; L571-Y575 HydrophobicContact CD2-CE2 4.02Å; L571-Y575 WeakPolarHBondContact O-CD2 3.49Å; L571-Y575 PolarHBondContact O-N 3.21Å; L572-Y575 PolarHBondContact O-N 3.44Å; Y575-V577 PolarHBondContact O-N 2.74Å; Y575-D578 WeakPolarHBondContact O-CB 3.43Å; Y575-D578 PolarHBondContact O-N 3.11Å; Y575-K581 HydrophobicContact CD1-CD 3.48Å; Y575-K581 VanDerWaalsContact CD1-CD 3.48Å; Y575-K581 HydrophobicContact CE1-CD 3.92Å; Y575-K581 HydrophobicContact CG-CB 4.4Å; Y575-K581 HydrophobicContact CG-CD 3.88Å; Y575-V582 WeakPolarHBondContact O-CG2 3.43Å; Y575-L585 HydrophobicContact CD2-CD1 4Å
576	C	95.8	Very high	97.4	Very high	18 Å²	18	33.4 Å²	33.4	12%	0.122	19%	0.189	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56.7	-7.5	-167.7	61	0	0	0	0	118.1	L572 V616 K619 H620	L572-C576 VanDerWaalsContact O-CA 3.25Å; L572-C576 WeakPolarHBondContact O-CA 3.38Å; L572-C576 WeakPolarHBondContact O-CB 3.19Å; L572-C576 PolarHBondContact O-N 2.83Å; C576-V616 HydrophobicContact CB-CG2 4.44Å; C576-K619 HydrophobicContact CB-CD 4.46Å; C576-K619 PolarHBondContact SG-NZ 3.02Å; C576-H620 PolarHBondContact O-CD2 2.79Å; C576-H620 PolarHBondContact O-NE2 2.92Å
577	V	94.5	Very high	97.4	Very high	117 Å²	117	33.6 Å²	33.6	71%	0.709	19%	0.186	S	C	*	.	T	Hydrogen-bonded Turn	trans	-108.2	-2.8	178.1	-63.1	0	0	0	0	113.6	Y575	Y575-V577 PolarHBondContact O-N 2.74Å
578	D	97.3	Very high	97.4	Very high	31 Å²	31	33.2 Å²	33.2	17%	0.166	18%	0.183	C	C	.	.			trans	-101.4	126.6	-175.3	-173.3	-79.2	0	0	0	110.7	Y575 D580 K581 V582	Y575-D578 WeakPolarHBondContact O-CB 3.43Å; Y575-D578 PolarHBondContact O-N 3.11Å; D578-D580 PolarHBondContact OD1-N 3.43Å; D578-K581 HydrophobicContact CB-CB 4.18Å; D578-K581 HydrophobicContact CB-CD 4.11Å; D578-K581 HydrophobicContact CB-CG 4.44Å; D578-K581 VanDerWaalsContact CG-NZ 3.32Å; D578-K581 WeakPolarHBondContact OD1-CB 3.25Å; D578-K581 WeakPolarHBondContact OD1-CD 3.37Å; D578-K581 WeakPolarHBondContact OD1-CG 3.23Å; D578-K581 PolarHBondContact OD1-N 3.31Å; D578-K581 IonicContact OD1-NZ 3.78Å; D578-K581 IonicContact OD2-NZ 2.68Å; D578-K581 PolarHBondContact OD2-NZ 3.2Å; D578-V582 WeakPolarHBondContact O-CB 3.43Å; D578-V582 WeakPolarHBondContact O-CG2 3.44Å; D578-V582 PolarHBondContact O-N 3.35Å
579	I	96.3	Very high	97.3	Very high	73 Å²	73	33.3 Å²	33.3	37%	0.374	18%	0.183	S	C	.	.	H	α-helix	trans	-68.8	-63.7	-173.6	-67.2	172.4	0	0	0	110	K581 V582 T583 D622 V625	I579-K581 VanDerWaalsContact C-N 3.33Å; I579-K581 PolarHBondContact O-N 3.21Å; I579-V582 PolarHBondContact O-N 3.44Å; I579-V582 VanDerWaalsContact O-N 3.11Å; I579-T583 PolarHBondContact O-N 3.17Å; I579-T583 PolarHBondContact O-OG1 2.97Å; I579-D622 HydrophobicContact CD1-CB 4.12Å; I579-D622 HydrophobicContact CG1-CB 4.34Å; I579-V625 HydrophobicContact CB-CG2 4.3Å; I579-V625 HydrophobicContact CG1-CG2 4.38Å; I579-V625 HydrophobicContact CG2-CG2 3.95Å
580	D	95.4	Very high	97.2	Very high	95 Å²	95	35.8 Å²	35.8	51%	0.508	19%	0.193	S	C	.	.	H	α-helix	trans	-53.2	-47.6	-175.1	-43	-12.1	0	0	0	112.2	T516 D578 S584	T516-D580 HydrophobicContact CG2-CB 3.64Å; D578-D580 PolarHBondContact OD1-N 3.43Å; D580-S584 VanDerWaalsContact O-CB 3.24Å; D580-S584 WeakPolarHBondContact O-CB 3.5Å; D580-S584 PolarHBondContact O-N 3.33Å; D580-S584 VanDerWaalsContact O-N 3.12Å; D580-S584 PolarHBondContact O-OG 3.26Å
581	K	97.6	Very high	97.1	Very high	0 Å²	0	31.5 Å²	31.5	0%	0	17%	0.171	C	C	.	.	H	α-helix	trans	-67.9	-41.6	-178.7	-64.6	172.5	-169.6	78	0	110.8	D512 T516 Y575 D578 I579 L585	D512-K581 WeakPolarHBondContact O-CE 3.41Å; D512-K581 PolarHBondContact O-NZ 3.45Å; D512-K581 WeakPolarHBondContact OD1-CE 3.49Å; D512-K581 IonicContact OD1-NZ 2.67Å; D512-K581 PolarHBondContact OD1-NZ 2.72Å; D512-K581 IonicContact OD2-NZ 3.73Å; D512-K581 PolarHBondContact OD2-NZ 2.75Å; D512-K581 VanDerWaalsContact OD2-NZ 3.13Å; T516-K581 HydrophobicContact CG2-CG 4.43Å; T516-K581 WeakPolarHBondContact OG1-CE 3.13Å; T516-K581 PolarHBondContact OG1-NZ 3.2Å; Y575-K581 HydrophobicContact CD1-CD 3.48Å; Y575-K581 VanDerWaalsContact CD1-CD 3.48Å; Y575-K581 HydrophobicContact CE1-CD 3.92Å; Y575-K581 HydrophobicContact CG-CB 4.4Å; Y575-K581 HydrophobicContact CG-CD 3.88Å; D578-K581 HydrophobicContact CB-CB 4.18Å; D578-K581 HydrophobicContact CB-CD 4.11Å; D578-K581 HydrophobicContact CB-CG 4.44Å; D578-K581 VanDerWaalsContact CG-NZ 3.32Å; D578-K581 WeakPolarHBondContact OD1-CB 3.25Å; D578-K581 WeakPolarHBondContact OD1-CD 3.37Å; D578-K581 WeakPolarHBondContact OD1-CG 3.23Å; D578-K581 PolarHBondContact OD1-N 3.31Å; D578-K581 IonicContact OD1-NZ 3.78Å; D578-K581 IonicContact OD2-NZ 2.68Å; D578-K581 PolarHBondContact OD2-NZ 3.2Å; I579-K581 VanDerWaalsContact C-N 3.33Å; I579-K581 PolarHBondContact O-N 3.21Å; K581-L585 VanDerWaalsContact O-CB 3.27Å; K581-L585 WeakPolarHBondContact O-CB 3.15Å; K581-L585 WeakPolarHBondContact O-CD1 3.23Å; K581-L585 WeakPolarHBondContact O-CG 3.17Å; K581-L585 PolarHBondContact O-N 3.12Å
582	V	97.7	Very high	97	Very high	0 Å²	0	31.6 Å²	31.6	0%	0	17%	0.171	C	C	.	.	H	α-helix	trans	-72.7	-46.6	-178.3	170.9	0	0	0	0	111.6	L572 Y575 D578 I579 S584 L585 L586 V616 V625	L572-V582 HydrophobicContact CD2-CG1 4.23Å; L572-V582 HydrophobicContact CD2-CG2 4.49Å; Y575-V582 WeakPolarHBondContact O-CG2 3.43Å; D578-V582 WeakPolarHBondContact O-CB 3.43Å; D578-V582 WeakPolarHBondContact O-CG2 3.44Å; D578-V582 PolarHBondContact O-N 3.35Å; I579-V582 PolarHBondContact O-N 3.44Å; I579-V582 VanDerWaalsContact O-N 3.11Å; V582-S584 PolarHBondContact O-N 2.94Å; V582-L585 PolarHBondContact O-N 2.85Å; V582-L586 HydrophobicContact CG1-CD1 3.59Å; V582-L586 HydrophobicContact CG1-CG 4.08Å; V582-L586 WeakPolarHBondContact O-CB 3.42Å; V582-L586 VanDerWaalsContact O-CG 3.23Å; V582-L586 WeakPolarHBondContact O-CG 3.27Å; V582-L586 PolarHBondContact O-N 3.27Å; V582-V616 HydrophobicContact CG1-CB 4.37Å; V582-V616 HydrophobicContact CG1-CG1 3.57Å; V582-V616 HydrophobicContact CG1-CG2 3.82Å; V582-V625 HydrophobicContact CG1-CG1 4.04Å
583	T	97.3	Very high	96.9	Very high	13 Å²	13	33.5 Å²	33.5	8%	0.08	18%	0.181	C	C	.	.	H	α-helix	trans	-54.1	-43.7	173.8	-62.7	0	0	0	0	110.8	I579 Q587 E624 V625 A628	I579-T583 PolarHBondContact O-N 3.17Å; I579-T583 PolarHBondContact O-OG1 2.97Å; T583-Q587 PolarHBondContact O-N 3.23Å; T583-E624 HydrophobicContact CG2-CB 4.02Å; T583-V625 VanDerWaalsContact OG1-CG2 3.24Å; T583-V625 WeakPolarHBondContact OG1-CG2 3.38Å; T583-V625 PolarHBondContact OG1-N 3.44Å; T583-A628 HydrophobicContact CG2-CB 4.36Å
584	S	97.3	Very high	96.8	Very high	19 Å²	19	31.9 Å²	31.9	13%	0.133	17%	0.166	C	C	.	.	H	α-helix	trans	-66.8	-47.5	177.1	-59.8	0	0	0	0	113.2	D580 V582 L586 Q587	D580-S584 VanDerWaalsContact O-CB 3.24Å; D580-S584 WeakPolarHBondContact O-CB 3.5Å; D580-S584 PolarHBondContact O-N 3.33Å; D580-S584 VanDerWaalsContact O-N 3.12Å; D580-S584 PolarHBondContact O-OG 3.26Å; V582-S584 PolarHBondContact O-N 2.94Å; S584-L586 VanDerWaalsContact C-N 3.35Å; S584-L586 PolarHBondContact O-N 3.44Å; S584-Q587 PolarHBondContact O-N 3.17Å
585	L	98.4	Very high	96.7	Very high	0 Å²	0	30.7 Å²	30.7	0%	0	16%	0.164	C	C	.	.	H	α-helix	trans	-63.8	-38.8	179.9	-76.6	168.8	0	0	0	112.3	V519 M522 L568 L571 L572 Y575 K581 V582 Q587 I588	V519-L585 HydrophobicContact CG1-CD2 4.22Å; V519-L585 HydrophobicContact CG1-CG 3.96Å; M522-L585 HydrophobicContact CE-CD2 4.16Å; L568-L585 HydrophobicContact CD1-CB 3.85Å; L568-L585 HydrophobicContact CD1-CD2 4.02Å; L568-L585 HydrophobicContact CD1-CG 4.48Å; L568-L585 WeakPolarHBondContact CD1-O 3.5Å; L571-L585 HydrophobicContact CB-CD1 3.89Å; L571-L585 HydrophobicContact CB-CD2 3.93Å; L571-L585 HydrophobicContact CD1-CD2 3.91Å; L571-L585 HydrophobicContact CG-CD2 4.44Å; L572-L585 HydrophobicContact CD2-CB 3.83Å; L572-L585 HydrophobicContact CD2-CD1 4.33Å; Y575-L585 HydrophobicContact CD2-CD1 4Å; K581-L585 VanDerWaalsContact O-CB 3.27Å; K581-L585 WeakPolarHBondContact O-CB 3.15Å; K581-L585 WeakPolarHBondContact O-CD1 3.23Å; K581-L585 WeakPolarHBondContact O-CG 3.17Å; K581-L585 PolarHBondContact O-N 3.12Å; V582-L585 PolarHBondContact O-N 2.85Å; L585-Q587 PolarHBondContact O-N 2.93Å; L585-I588 HydrophobicContact CD2-CD1 4.04Å; L585-I588 WeakPolarHBondContact O-CB 3.17Å; L585-I588 WeakPolarHBondContact O-CG1 3.19Å; L585-I588 PolarHBondContact O-N 2.83Å; L585-I588 VanDerWaalsContact O-N 3.17Å
586	L	98.2	Very high	96.6	Very high	1 Å²	1	30.8 Å²	30.8	1%	0.005	17%	0.165	C	C	.	.	H	α-helix	trans	-62.9	-24.8	176.8	-74.1	168.9	0	0	0	112.6	L572 V582 S584 I588 P589 I613 V616 A628 C629 T632	L572-L586 HydrophobicContact CD1-CD2 4.28Å; L572-L586 HydrophobicContact CD2-CD2 4.3Å; L572-L586 HydrophobicContact CD2-CG 4.26Å; V582-L586 HydrophobicContact CG1-CD1 3.59Å; V582-L586 HydrophobicContact CG1-CG 4.08Å; V582-L586 WeakPolarHBondContact O-CB 3.42Å; V582-L586 VanDerWaalsContact O-CG 3.23Å; V582-L586 WeakPolarHBondContact O-CG 3.27Å; V582-L586 PolarHBondContact O-N 3.27Å; S584-L586 VanDerWaalsContact C-N 3.35Å; S584-L586 PolarHBondContact O-N 3.44Å; L586-I588 VanDerWaalsContact C-N 3.25Å; L586-I588 PolarHBondContact O-N 3.38Å; L586-P589 WeakPolarHBondContact O-CD 3.46Å; L586-I613 HydrophobicContact CD2-CD1 4.46Å; L586-I613 HydrophobicContact CD2-CG1 3.88Å; L586-I613 HydrophobicContact CD2-CG2 4.46Å; L586-V616 HydrophobicContact CD1-CG1 4.39Å; L586-A628 HydrophobicContact CB-CB 3.83Å; L586-A628 HydrophobicContact CD1-CB 3.85Å; L586-C629 WeakPolarHBondContact CD1-SG 3.42Å; L586-T632 PolarHBondContact O-OG1 3.09Å
587	Q	97.4	Very high	96.6	Very high	61 Å²	61	29.9 Å²	29.9	29%	0.285	16%	0.159	S	C	.	.	T	Hydrogen-bonded Turn	trans	-71.1	-16.4	176.1	-71.5	-167.8	47.2	0	0	114.3	L523 T583 S584 L585 K590 Y591	L523-Q587 HydrophobicContact CD1-CB 3.79Å; L523-Q587 HydrophobicContact CD2-CB 4.19Å; T583-Q587 PolarHBondContact O-N 3.23Å; S584-Q587 PolarHBondContact O-N 3.17Å; L585-Q587 PolarHBondContact O-N 2.93Å; Q587-K590 WeakPolarHBondContact O-CE 3.24Å; Q587-K590 WeakPolarHBondContact O-CG 3.27Å; Q587-K590 PolarHBondContact O-N 2.83Å; Q587-Y591 WeakPolarHBondContact O-CE2 3.15Å
588	I	97.9	Very high	96.6	Very high	1 Å²	1	26.9 Å²	26.9	1%	0.005	14%	0.141	C	C	.	.	G	3₁₀ helix	trans	-64.5	-42	-171.8	-63.9	176.6	0	0	0	113.8	M522 L523 I526 F564 L568 L585 L586 K590 Y591 F592	M522-I588 HydrophobicContact CE-CD1 4.28Å; L523-I588 HydrophobicContact CD1-CG1 3.99Å; I526-I588 HydrophobicContact CD1-CD1 4.09Å; I526-I588 HydrophobicContact CD1-CG1 4.29Å; I526-I588 HydrophobicContact CD1-CG2 4.36Å; F564-I588 HydrophobicContact CB-CG2 3.95Å; F564-I588 HydrophobicContact CD1-CD1 4.13Å; F564-I588 HydrophobicContact CD1-CG2 4.25Å; F564-I588 HydrophobicContact CD2-CG2 4.45Å; F564-I588 HydrophobicContact CE1-CD1 4.13Å; F564-I588 HydrophobicContact CG-CG2 3.97Å; L568-I588 HydrophobicContact CD2-CB 4.49Å; L585-I588 HydrophobicContact CD2-CD1 4.04Å; L585-I588 WeakPolarHBondContact O-CB 3.17Å; L585-I588 WeakPolarHBondContact O-CG1 3.19Å; L585-I588 PolarHBondContact O-N 2.83Å; L585-I588 VanDerWaalsContact O-N 3.17Å; L586-I588 VanDerWaalsContact C-N 3.25Å; L586-I588 PolarHBondContact O-N 3.38Å; I588-K590 PolarHBondContact O-N 3.28Å; I588-K590 VanDerWaalsContact O-N 3.16Å; I588-Y591 WeakPolarHBondContact O-CD2 3.49Å; I588-Y591 PolarHBondContact O-N 3.5Å; I588-Y591 VanDerWaalsContact O-N 3.16Å; I588-F592 HydrophobicContact CG2-CE1 3.69Å; I588-F592 HydrophobicContact CG2-CZ 3.99Å
589	P	97.3	Very high	96.5	Very high	3 Å²	3	30.6 Å²	30.6	2%	0.019	17%	0.165	C	C	.	.	G	3₁₀ helix	trans	-62.1	-20.5	-179.4	-26.8	38.1	0	0	0	115.9	L568 L586 Y591 F592 L609 T632 L636	L568-P589 HydrophobicContact CD2-CG 3.41Å; L568-P589 VanDerWaalsContact CD2-CG 3.41Å; L586-P589 WeakPolarHBondContact O-CD 3.46Å; P589-Y591 PolarHBondContact O-N 3.21Å; P589-Y591 VanDerWaalsContact O-N 3.13Å; P589-F592 HydrophobicContact CB-CD2 3.81Å; P589-F592 HydrophobicContact CB-CE2 3.83Å; P589-F592 HydrophobicContact CB-CG 4.48Å; P589-F592 HydrophobicContact CB-CZ 4.49Å; P589-F592 HydrophobicContact CG-CD2 4.41Å; P589-F592 HydrophobicContact CG-CE2 3.92Å; P589-F592 HydrophobicContact CG-CZ 4.33Å; P589-F592 WeakPolarHBondContact O-CB 3.38Å; P589-F592 PolarHBondContact O-N 3.31Å; P589-L609 HydrophobicContact CG-CD2 4.26Å; P589-T632 HydrophobicContact CB-CG2 4.17Å; P589-T632 HydrophobicContact CG-CG2 4Å; P589-L636 HydrophobicContact CB-CD2 4.45Å
590	K	95.3	Very high	96.3	Very high	60 Å²	60	29.1 Å²	29.1	26%	0.261	17%	0.168	S	C	.	.	G	3₁₀ helix	trans	-57.8	-28.3	175.5	94.1	178.8	86.9	160.8	0	111.9	Q587 I588 Y635	Q587-K590 WeakPolarHBondContact O-CE 3.24Å; Q587-K590 WeakPolarHBondContact O-CG 3.27Å; Q587-K590 PolarHBondContact O-N 2.83Å; I588-K590 PolarHBondContact O-N 3.28Å; I588-K590 VanDerWaalsContact O-N 3.16Å; K590-Y635 HydrophobicContact CB-CD1 4.47Å; K590-Y635 HydrophobicContact CB-CD2 3.58Å; K590-Y635 HydrophobicContact CB-CE1 4.38Å; K590-Y635 HydrophobicContact CB-CE2 3.49Å; K590-Y635 VanDerWaalsContact CB-CE2 3.49Å; K590-Y635 HydrophobicContact CB-CG 4.11Å
591	Y	96.4	Very high	96.3	Very high	11 Å²	11	34.5 Å²	34.5	4%	0.043	18%	0.181	C	C	.	.	G	3₁₀ helix	trans	-88.5	-6.8	-178.5	-48.5	-65.5	0	0	0	113.1	L523 I526 R527 C530 E531 R557 Q587 I588 P589	L523-Y591 HydrophobicContact CD1-CE2 3.94Å; I526-Y591 HydrophobicContact CG2-CD2 3.62Å; I526-Y591 HydrophobicContact CG2-CE2 4.25Å; I526-Y591 HydrophobicContact CG2-CG 4.14Å; R527-Y591 HydrophobicContact CB-CE1 4.17Å; R527-Y591 HydrophobicContact CB-CE2 4.38Å; R527-Y591 WeakPolarHBondContact CB-OH 3.18Å; R527-Y591 HydrophobicContact CG-CE1 4.14Å; C530-Y591 HydrophobicContact CB-CD1 4.01Å; C530-Y591 HydrophobicContact CB-CG 4.19Å; E531-Y591 HydrophobicContact CG-CE1 4.34Å; R557-Y591 WeakPolarHBondContact CG-O 3.4Å; R557-Y591 PolarHBondContact NE-O 2.82Å; Q587-Y591 WeakPolarHBondContact O-CE2 3.15Å; I588-Y591 WeakPolarHBondContact O-CD2 3.49Å; I588-Y591 PolarHBondContact O-N 3.5Å; I588-Y591 VanDerWaalsContact O-N 3.16Å; P589-Y591 PolarHBondContact O-N 3.21Å; P589-Y591 VanDerWaalsContact O-N 3.13Å
592	F	96.7	Very high	96.2	Very high	2 Å²	2	35.8 Å²	35.8	1%	0.009	19%	0.188	C	C	.	.			trans	-70	151.8	-174.7	-69.6	-11.2	0	0	0	114	R557 T560 T561 F564 L568 I588 P589 L594 Y597	R557-F592 PolarHBondContact NE-O 3.31Å; R557-F592 PolarHBondContact NH2-O 2.93Å; T560-F592 HydrophobicContact CG2-CD1 4.4Å; T560-F592 HydrophobicContact CG2-CE1 4.25Å; T561-F592 HydrophobicContact CG2-CB 3.85Å; T561-F592 HydrophobicContact CG2-CD1 4.23Å; T561-F592 HydrophobicContact CG2-CD2 4.41Å; T561-F592 HydrophobicContact CG2-CG 3.93Å; T561-F592 WeakPolarHBondContact OG1-CA 3.43Å; F564-F592 HydrophobicContact CB-CE1 3.69Å; F564-F592 HydrophobicContact CB-CZ 3.64Å; L568-F592 HydrophobicContact CD2-CZ 4.47Å; I588-F592 HydrophobicContact CG2-CE1 3.69Å; I588-F592 HydrophobicContact CG2-CZ 3.99Å; P589-F592 HydrophobicContact CB-CD2 3.81Å; P589-F592 HydrophobicContact CB-CE2 3.83Å; P589-F592 HydrophobicContact CB-CG 4.48Å; P589-F592 HydrophobicContact CB-CZ 4.49Å; P589-F592 HydrophobicContact CG-CD2 4.41Å; P589-F592 HydrophobicContact CG-CE2 3.92Å; P589-F592 HydrophobicContact CG-CZ 4.33Å; P589-F592 WeakPolarHBondContact O-CB 3.38Å; P589-F592 PolarHBondContact O-N 3.31Å; F592-L594 HydrophobicContact CB-CD2 3.99Å; F592-Y597 AromaticContact CD2-CE2 3.87Å; F592-Y597 HydrophobicContact CD2-CE2 3.87Å; F592-Y597 HydrophobicContact CE2-CE2 4.29Å; F592-Y597 WeakPolarHBondContact CE2-OH 3.35Å
593	D	95.5	Very high	96.1	Very high	39 Å²	39	38.6 Å²	38.6	21%	0.209	20%	0.201	C	C	.	.			trans	-92.2	100.2	162.9	178.9	1	0	0	0	108.9	R557 T561 D595 I596	R557-D593 HydrophobicContact CG-CB 4.43Å; T561-D593 PolarHBondContact OG1-N 3.04Å; D593-D595 PolarHBondContact O-N 3.44Å; D593-I596 HydrophobicContact CB-CD1 3.81Å; D593-I596 HydrophobicContact CB-CG1 4.2Å; D593-I596 VanDerWaalsContact O-CB 3.31Å; D593-I596 WeakPolarHBondContact O-CB 3.44Å; D593-I596 WeakPolarHBondContact O-CG1 3.39Å; D593-I596 PolarHBondContact O-N 2.86Å
594	L	95.9	Very high	96.1	Very high	13 Å²	13	46 Å²	46	7%	0.068	23%	0.232	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68.9	-18.2	-164.2	-60.5	173.4	0	0	0	113.8	F592 I596 Y597 Y635 L636 F641 I643	F592-L594 HydrophobicContact CB-CD2 3.99Å; L594-I596 PolarHBondContact O-N 3.06Å; L594-Y597 HydrophobicContact CD2-CD2 4.44Å; L594-Y597 HydrophobicContact CD2-CE2 4.47Å; L594-Y597 PolarHBondContact O-N 2.75Å; L594-Y635 WeakPolarHBondContact CD1-O 3.41Å; L594-L636 HydrophobicContact CD2-CD2 3.8Å; L594-F641 HydrophobicContact CB-CB 4.28Å; L594-F641 HydrophobicContact CB-CD1 3.66Å; L594-F641 HydrophobicContact CB-CD2 4.13Å; L594-F641 HydrophobicContact CB-CE1 3.94Å; L594-F641 HydrophobicContact CB-CE2 4.39Å; L594-F641 HydrophobicContact CB-CG 3.74Å; L594-F641 HydrophobicContact CB-CZ 4.3Å; L594-F641 HydrophobicContact CD1-CD2 3.89Å; L594-F641 HydrophobicContact CD1-CE2 4.11Å; L594-F641 HydrophobicContact CD1-CG 4.29Å; L594-I643 HydrophobicContact CB-CD1 4.05Å; L594-I643 HydrophobicContact CD1-CD1 4.23Å; L594-I643 HydrophobicContact CD2-CD1 4.07Å; L594-I643 HydrophobicContact CG-CD1 4.33Å
595	D	94.9	Very high	96.1	Very high	76 Å²	76	48.3 Å²	48.3	41%	0.406	24%	0.24	S	C	.	.	H	α-helix	trans	-66.4	-21.9	172.6	-95.7	-22.8	0	0	0	112.7	D593 Y597 T598 T599 F641	D593-D595 PolarHBondContact O-N 3.44Å; D595-Y597 PolarHBondContact O-N 2.97Å; D595-T598 PolarHBondContact O-N 3.16Å; D595-T599 WeakPolarHBondContact O-CB 3.38Å; D595-T599 WeakPolarHBondContact O-CG2 3Å; D595-T599 PolarHBondContact O-N 3.31Å; D595-T599 PolarHBondContact O-OG1 3.27Å; D595-F641 HydrophobicContact CB-CD1 4.47Å; D595-F641 HydrophobicContact CB-CE1 4.45Å
596	I	96.2	Very high	96	Very high	13 Å²	13	48.3 Å²	48.3	7%	0.067	24%	0.24	C	C	.	.	H	α-helix	trans	-65.4	-28.6	176.9	-62.3	176.7	0	0	0	111.3	T558 T561 E562 D593 L594 T598 T599 G600 L602	T558-I596 HydrophobicContact CG2-CD1 3.82Å; T561-I596 HydrophobicContact CG2-CB 3.86Å; T561-I596 HydrophobicContact CG2-CD1 4.09Å; T561-I596 HydrophobicContact CG2-CG1 4.49Å; T561-I596 HydrophobicContact CG2-CG2 4.07Å; E562-I596 HydrophobicContact CG-CG2 3.92Å; D593-I596 HydrophobicContact CB-CD1 3.81Å; D593-I596 HydrophobicContact CB-CG1 4.2Å; D593-I596 VanDerWaalsContact O-CB 3.31Å; D593-I596 WeakPolarHBondContact O-CB 3.44Å; D593-I596 WeakPolarHBondContact O-CG1 3.39Å; D593-I596 PolarHBondContact O-N 2.86Å; L594-I596 PolarHBondContact O-N 3.06Å; I596-T598 VanDerWaalsContact C-N 3.35Å; I596-T598 PolarHBondContact O-N 2.81Å; I596-T599 WeakPolarHBondContact CA-OG1 3.48Å; I596-G600 VanDerWaalsContact O-CA 3.29Å; I596-G600 WeakPolarHBondContact O-CA 3.49Å; I596-G600 PolarHBondContact O-N 2.62Å; I596-L602 HydrophobicContact CG2-CD1 4.11Å
597	Y	95.8	Very high	95.9	Very high	0 Å²	0	50.6 Å²	50.6	0%	0	25%	0.253	C	S	.	.	H	α-helix	trans	-61.7	-42	176	-87.2	-74.8	0	0	0	112.7	A565 F592 L594 D595 R601 L602 M606	A565-Y597 HydrophobicContact CB-CE1 3.71Å; A565-Y597 HydrophobicContact CB-CE2 4.41Å; F592-Y597 AromaticContact CD2-CE2 3.87Å; F592-Y597 HydrophobicContact CD2-CE2 3.87Å; F592-Y597 HydrophobicContact CE2-CE2 4.29Å; F592-Y597 WeakPolarHBondContact CE2-OH 3.35Å; L594-Y597 HydrophobicContact CD2-CD2 4.44Å; L594-Y597 HydrophobicContact CD2-CE2 4.47Å; L594-Y597 PolarHBondContact O-N 2.75Å; D595-Y597 PolarHBondContact O-N 2.97Å; Y597-R601 PolarHBondContact O-N 3.1Å; Y597-L602 HydrophobicContact CD1-CB 3.8Å; Y597-L602 HydrophobicContact CE1-CB 4.3Å; Y597-L602 PolarHBondContact O-N 3.16Å; Y597-M606 HydrophobicContact CD1-CB 3.86Å; Y597-M606 HydrophobicContact CD1-CE 3.87Å; Y597-M606 HydrophobicContact CD2-CE 3.44Å; Y597-M606 VanDerWaalsContact CD2-CE 3.44Å; Y597-M606 HydrophobicContact CE1-CB 3.85Å; Y597-M606 HydrophobicContact CE1-CE 3.83Å; Y597-M606 HydrophobicContact CE2-CE 3.39Å; Y597-M606 HydrophobicContact CG-CE 3.68Å
598	T	93.9	Very high	96	Very high	54 Å²	54	48.9 Å²	48.9	33%	0.331	25%	0.249	S	C	.	.	H	α-helix	trans	-84.5	-42.8	-179.9	-57.9	0	0	0	0	111.7	D595 I596 T642	D595-T598 PolarHBondContact O-N 3.16Å; I596-T598 VanDerWaalsContact C-N 3.35Å; I596-T598 PolarHBondContact O-N 2.81Å; T598-T642 WeakPolarHBondContact CB-OG1 3.44Å; T598-T642 PolarHBondContact OG1-OG1 3.44Å
599	T	94.7	Very high	96	Very high	109 Å²	109	48.8 Å²	48.8	67%	0.669	25%	0.248	S	C	*	.	H	α-helix	trans	-74	-37.8	-177.6	57.1	0	0	0	0	112.7	D595 I596 R601	D595-T599 WeakPolarHBondContact O-CB 3.38Å; D595-T599 WeakPolarHBondContact O-CG2 3Å; D595-T599 PolarHBondContact O-N 3.31Å; D595-T599 PolarHBondContact O-OG1 3.27Å; I596-T599 WeakPolarHBondContact CA-OG1 3.48Å; T599-R601 VanDerWaalsContact C-N 3.35Å
600	G	93.5	Very high	96	Very high	41 Å²	41	49 Å²	49	42%	0.423	25%	0.249	S	C	.	.	T	Hydrogen-bonded Turn	trans	-81	-6.1	175.4	0	0	0	0	0	115	I596	I596-G600 VanDerWaalsContact O-CA 3.29Å; I596-G600 WeakPolarHBondContact O-CA 3.49Å; I596-G600 PolarHBondContact O-N 2.62Å
601	R	95.1	Very high	96.1	Very high	209 Å²	209	53.1 Å²	53.1	79%	0.789	26%	0.263	S	S	*	.	T	Hydrogen-bonded Turn	trans	60.3	42.7	-176.5	-51.4	177.4	-177.8	169.6	0.6	113.8	Y597 T599 E603	Y597-R601 PolarHBondContact O-N 3.1Å; T599-R601 VanDerWaalsContact C-N 3.35Å; R601-E603 VanDerWaalsContact C-N 3.34Å; R601-E603 WeakPolarHBondContact CA-OE2 3.2Å
602	L	96.2	Very high	96.2	Very high	27 Å²	27	53.8 Å²	53.8	14%	0.141	27%	0.267	C	S	.	.			trans	-95.2	14.3	-179	-52.8	178.2	0	0	0	112	A565 V566 I596 Y597 K604 H605 M606	A565-L602 HydrophobicContact CB-CD1 3.84Å; V566-L602 HydrophobicContact CG2-CD2 4.39Å; I596-L602 HydrophobicContact CG2-CD1 4.11Å; Y597-L602 HydrophobicContact CD1-CB 3.8Å; Y597-L602 HydrophobicContact CE1-CB 4.3Å; Y597-L602 PolarHBondContact O-N 3.16Å; L602-K604 PolarHBondContact O-N 3.47Å; L602-K604 VanDerWaalsContact O-N 3.15Å; L602-H605 WeakPolarHBondContact O-CA 3.34Å; L602-H605 WeakPolarHBondContact O-CB 3.41Å; L602-H605 PolarHBondContact O-N 3.26Å; L602-M606 PolarHBondContact O-N 2.61Å; L602-M606 VanDerWaalsContact O-N 3.14Å
603	E	95	Very high	96.3	Very high	59 Å²	59	53.7 Å²	53.7	28%	0.276	27%	0.266	S	S	.	.	H	α-helix	trans	-63.1	-28.4	-171.4	-44.2	95	135.1	0	0	112.6	R601 H605 M606 D607	R601-E603 VanDerWaalsContact C-N 3.34Å; R601-E603 WeakPolarHBondContact CA-OE2 3.2Å; E603-H605 PolarHBondContact O-N 3.39Å; E603-M606 WeakPolarHBondContact O-CB 3.26Å; E603-M606 PolarHBondContact O-N 2.72Å; E603-D607 VanDerWaalsContact O-CG 3.32Å; E603-D607 PolarHBondContact O-N 3.12Å
604	K	96.6	Very high	96.4	Very high	168 Å²	168	55.1 Å²	55.1	73%	0.73	27%	0.269	S	S	*	.	H	α-helix	trans	-63.8	-29.6	172.1	-67.3	-176.2	178.8	-179.1	0	113.3	L602 A608	L602-K604 PolarHBondContact O-N 3.47Å; L602-K604 VanDerWaalsContact O-N 3.15Å; K604-A608 PolarHBondContact O-N 2.9Å; K604-A608 VanDerWaalsContact O-N 3.16Å
605	H	97.4	Very high	96.5	Very high	67 Å²	67	58.2 Å²	58.2	31%	0.31	28%	0.283	S	S	.	.	H	α-helix	trans	-83.8	-30.8	177.1	-59.6	-90.5	0	0	0	111.2	A565 L602 E603 A608 L609	A565-H605 VanDerWaalsContact O-CB 3.24Å; A565-H605 WeakPolarHBondContact O-CB 3.24Å; L602-H605 WeakPolarHBondContact O-CA 3.34Å; L602-H605 WeakPolarHBondContact O-CB 3.41Å; L602-H605 PolarHBondContact O-N 3.26Å; E603-H605 PolarHBondContact O-N 3.39Å; H605-A608 PolarHBondContact O-N 2.8Å; H605-L609 WeakPolarHBondContact O-CB 3.49Å; H605-L609 PolarHBondContact O-N 3.33Å
606	M	96.3	Very high	96.6	Very high	0 Å²	0	54.6 Å²	54.6	0%	0	26%	0.263	C	S	.	.	H	α-helix	trans	-58.3	-50	163.1	-177.4	63.2	74.4	0	0	110.7	Y597 L602 E603 A608 L609 L610 L636 I643 V647	Y597-M606 HydrophobicContact CD1-CB 3.86Å; Y597-M606 HydrophobicContact CD1-CE 3.87Å; Y597-M606 HydrophobicContact CD2-CE 3.44Å; Y597-M606 VanDerWaalsContact CD2-CE 3.44Å; Y597-M606 HydrophobicContact CE1-CB 3.85Å; Y597-M606 HydrophobicContact CE1-CE 3.83Å; Y597-M606 HydrophobicContact CE2-CE 3.39Å; Y597-M606 HydrophobicContact CG-CE 3.68Å; L602-M606 PolarHBondContact O-N 2.61Å; L602-M606 VanDerWaalsContact O-N 3.14Å; E603-M606 WeakPolarHBondContact O-CB 3.26Å; E603-M606 PolarHBondContact O-N 2.72Å; M606-A608 PolarHBondContact O-N 3.46Å; M606-A608 VanDerWaalsContact O-N 3.15Å; M606-L609 PolarHBondContact O-N 2.95Å; M606-L609 VanDerWaalsContact O-N 3.1Å; M606-L610 HydrophobicContact CG-CD1 3.99Å; M606-L610 HydrophobicContact CG-CG 4.36Å; M606-L610 WeakPolarHBondContact O-CG 3.32Å; M606-L610 PolarHBondContact O-N 3.21Å; M606-L610 HydrophobicContact SD-CD1 4.27Å; M606-L610 HydrophobicContact SD-CD2 4.35Å; M606-L610 HydrophobicContact SD-CG 4.15Å; M606-L636 HydrophobicContact CE-CD2 3.9Å; M606-L636 HydrophobicContact SD-CD1 4.23Å; M606-L636 HydrophobicContact SD-CD2 4.36Å; M606-I643 HydrophobicContact CE-CD1 3.68Å; M606-I643 HydrophobicContact CE-CG2 4.45Å; M606-V647 HydrophobicContact SD-CG2 4.26Å
607	D	96.9	Very high	96.6	Very high	50 Å²	50	54 Å²	54	27%	0.267	26%	0.261	S	S	.	.	H	α-helix	trans	-57.6	-30.7	176.1	-69.3	-38.5	0	0	0	112.2	E603 R611 R646	E603-D607 VanDerWaalsContact O-CG 3.32Å; E603-D607 PolarHBondContact O-N 3.12Å; D607-R611 PolarHBondContact O-NH1 2.85Å; D607-R611 PolarHBondContact O-NH2 3.3Å; D607-R646 WeakPolarHBondContact OD1-CD 3.34Å; D607-R646 IonicContact OD1-CZ 2.66Å; D607-R646 IonicContact OD1-NE 3.15Å; D607-R646 PolarHBondContact OD1-NE 2.88Å; D607-R646 IonicContact OD1-NH2 2.9Å; D607-R646 PolarHBondContact OD1-NH2 3.22Å; D607-R646 IonicContact OD2-CZ 3.97Å; D607-R646 IonicContact OD2-NE 3.81Å; D607-R646 PolarHBondContact OD2-NE 3.49Å; D607-R646 IonicContact OD2-NH2 2.7Å; D607-R646 PolarHBondContact OD2-NH2 3.43Å
608	A	98.1	Very high	96.6	Very high	24 Å²	24	59.3 Å²	59.3	20%	0.198	29%	0.289	C	S	.	.	H	α-helix	trans	-77	-42.8	174.5	0	0	0	0	0	112.8	P569 K604 H605 M606 R611 Q612	P569-A608 HydrophobicContact CB-CB 3.96Å; P569-A608 HydrophobicContact CG-CB 4.21Å; K604-A608 PolarHBondContact O-N 2.9Å; K604-A608 VanDerWaalsContact O-N 3.16Å; H605-A608 PolarHBondContact O-N 2.8Å; M606-A608 PolarHBondContact O-N 3.46Å; M606-A608 VanDerWaalsContact O-N 3.15Å; A608-R611 PolarHBondContact O-N 3.02Å; A608-Q612 PolarHBondContact O-N 3.09Å; A608-Q612 VanDerWaalsContact O-N 3.09Å
609	L	98.1	Very high	96.7	Very high	0 Å²	0	61.1 Å²	61.1	0%	0	29%	0.292	C	S	.	.	H	α-helix	trans	-57.7	-51.1	177.1	-178.7	57	0	0	0	110.9	L568 P569 L572 P589 H605 M606 R611 Q612 I613 L636	L568-L609 HydrophobicContact CD2-CD1 3.77Å; L568-L609 HydrophobicContact CD2-CD2 4.39Å; L568-L609 HydrophobicContact CG-CD1 3.92Å; P569-L609 HydrophobicContact CG-CB 4.03Å; L572-L609 HydrophobicContact CD1-CD1 3.67Å; P589-L609 HydrophobicContact CG-CD2 4.26Å; H605-L609 WeakPolarHBondContact O-CB 3.49Å; H605-L609 PolarHBondContact O-N 3.33Å; M606-L609 PolarHBondContact O-N 2.95Å; M606-L609 VanDerWaalsContact O-N 3.1Å; L609-R611 VanDerWaalsContact C-N 3.28Å; L609-R611 PolarHBondContact O-N 3.09Å; L609-Q612 PolarHBondContact O-N 3.36Å; L609-I613 HydrophobicContact CD1-CD1 4.12Å; L609-I613 HydrophobicContact CD1-CG1 4.21Å; L609-I613 HydrophobicContact CG-CD1 3.93Å; L609-I613 HydrophobicContact CG-CG1 4.43Å; L609-I613 WeakPolarHBondContact O-CG1 3.28Å; L609-I613 PolarHBondContact O-N 3Å; L609-L636 HydrophobicContact CD2-CD1 4.18Å
610	L	98.1	Very high	96.8	Very high	8 Å²	8	56.6 Å²	56.6	4%	0.042	26%	0.263	C	S	.	.	H	α-helix	trans	-59.9	-37.1	-178.9	-61.8	172	0	0	0	112.3	M606 W614 Y633 L636 R646 V647 A650	M606-L610 HydrophobicContact CG-CD1 3.99Å; M606-L610 HydrophobicContact CG-CG 4.36Å; M606-L610 WeakPolarHBondContact O-CG 3.32Å; M606-L610 PolarHBondContact O-N 3.21Å; M606-L610 HydrophobicContact SD-CD1 4.27Å; M606-L610 HydrophobicContact SD-CD2 4.35Å; M606-L610 HydrophobicContact SD-CG 4.15Å; L610-W614 PolarHBondContact O-N 3.09Å; L610-Y633 HydrophobicContact CD2-CD1 4.44Å; L610-Y633 HydrophobicContact CD2-CE1 3.82Å; L610-L636 HydrophobicContact CD2-CD1 4.18Å; L610-R646 HydrophobicContact CD1-CG 4.31Å; L610-V647 HydrophobicContact CD1-CG2 4.28Å; L610-V647 HydrophobicContact CD2-CG1 3.93Å; L610-V647 HydrophobicContact CD2-CG2 4.48Å; L610-A650 HydrophobicContact CB-CB 4.3Å; L610-A650 HydrophobicContact CD1-CB 4.02Å
611	R	97.9	Very high	96.9	Very high	146 Å²	146	56.5 Å²	56.5	55%	0.551	26%	0.255	S	S	*	.	H	α-helix	trans	-67	-37.1	172.7	-75.4	-170.6	-62.1	-82.7	-5.1	113	D607 A608 L609 W614 E615	D607-R611 PolarHBondContact O-NH1 2.85Å; D607-R611 PolarHBondContact O-NH2 3.3Å; A608-R611 PolarHBondContact O-N 3.02Å; L609-R611 VanDerWaalsContact C-N 3.28Å; L609-R611 PolarHBondContact O-N 3.09Å; R611-W614 PolarHBondContact O-N 3.12Å; R611-E615 PolarHBondContact O-N 3.13Å
612	Q	98.1	Very high	97	Very high	24 Å²	24	48.5 Å²	48.5	11%	0.112	23%	0.228	C	C	.	.	H	α-helix	trans	-73.4	-35	177.6	-67.3	-53.7	-70.6	0	0	112.6	P569 L572 A573 A608 L609 W614 E615 V616	P569-Q612 HydrophobicContact CB-CG 4.46Å; L572-Q612 HydrophobicContact CB-CB 4.01Å; L572-Q612 HydrophobicContact CD1-CB 4.32Å; A573-Q612 VanDerWaalsContact CB-OE1 3.31Å; A608-Q612 PolarHBondContact O-N 3.09Å; A608-Q612 VanDerWaalsContact O-N 3.09Å; L609-Q612 PolarHBondContact O-N 3.36Å; Q612-W614 VanDerWaalsContact C-N 3.33Å; Q612-E615 PolarHBondContact NE2-OE1 2.91Å; Q612-E615 PolarHBondContact O-N 3.09Å; Q612-V616 WeakPolarHBondContact O-CG2 3.31Å; Q612-V616 PolarHBondContact O-N 2.67Å
613	I	97.9	Very high	96.9	Very high	0 Å²	0	50.4 Å²	50.4	0%	0	24%	0.24	C	C	.	.	H	α-helix	trans	-63.4	-41.7	170.9	-58.1	169.9	0	0	0	109.8	L586 L609 V616 V617 C629 T632 Y633 L636	L586-I613 HydrophobicContact CD2-CD1 4.46Å; L586-I613 HydrophobicContact CD2-CG1 3.88Å; L586-I613 HydrophobicContact CD2-CG2 4.46Å; L609-I613 HydrophobicContact CD1-CD1 4.12Å; L609-I613 HydrophobicContact CD1-CG1 4.21Å; L609-I613 HydrophobicContact CG-CD1 3.93Å; L609-I613 HydrophobicContact CG-CG1 4.43Å; L609-I613 WeakPolarHBondContact O-CG1 3.28Å; L609-I613 PolarHBondContact O-N 3Å; I613-V616 PolarHBondContact O-N 3.46Å; I613-V617 HydrophobicContact CG2-CG2 4.48Å; I613-V617 WeakPolarHBondContact O-CG2 3.19Å; I613-V617 PolarHBondContact O-N 3.4Å; I613-C629 HydrophobicContact CG2-CB 4.01Å; I613-T632 HydrophobicContact CD1-CG2 3.78Å; I613-Y633 HydrophobicContact CB-CE2 4.1Å; I613-Y633 HydrophobicContact CG2-CD2 3.8Å; I613-Y633 HydrophobicContact CG2-CE2 3.5Å; I613-Y633 VanDerWaalsContact CG2-CE2 3.5Å; I613-L636 HydrophobicContact CD1-CD1 4.43Å
614	W	97.7	Very high	96.9	Very high	69 Å²	69	53.4 Å²	53.4	26%	0.261	26%	0.255	S	S	.	.	H	α-helix	trans	-59.2	-48.9	172.4	-166.4	-45.5	0	0	0	112	L610 R611 Q612 V616 V617 D618 Q653 L654	L610-W614 PolarHBondContact O-N 3.09Å; R611-W614 PolarHBondContact O-N 3.12Å; Q612-W614 VanDerWaalsContact C-N 3.33Å; W614-V616 PolarHBondContact O-N 2.85Å; W614-V617 PolarHBondContact O-N 3.19Å; W614-V617 VanDerWaalsContact O-N 3.13Å; W614-D618 PolarHBondContact O-N 2.78Å; W614-Q653 VanDerWaalsContact CH2-C 3.45Å; W614-Q653 HydrophobicContact CH2-CB 3.74Å; W614-Q653 HydrophobicContact CZ3-CB 3.79Å; W614-L654 HydrophobicContact CD2-CB 4.19Å; W614-L654 HydrophobicContact CD2-CD1 3.89Å; W614-L654 HydrophobicContact CE3-CB 3.92Å; W614-L654 HydrophobicContact CE3-CD1 4.48Å; W614-L654 HydrophobicContact CG-CD1 4.05Å; W614-L654 HydrophobicContact CH2-CB 4.14Å; W614-L654 HydrophobicContact CZ2-CB 4.38Å; W614-L654 HydrophobicContact CZ2-CD1 4.3Å; W614-L654 HydrophobicContact CZ3-CB 3.89Å
615	E	97.4	Very high	96.9	Very high	78 Å²	78	45.4 Å²	45.4	36%	0.364	22%	0.22	S	C	.	.	H	α-helix	trans	-59.1	-33.5	176.8	-81.5	-167.5	-120.5	0	0	113.2	R611 Q612 K619	R611-E615 PolarHBondContact O-N 3.13Å; Q612-E615 PolarHBondContact NE2-OE1 2.91Å; Q612-E615 PolarHBondContact O-N 3.09Å; E615-K619 WeakPolarHBondContact O-CB 3.32Å; E615-K619 VanDerWaalsContact O-CD 3.24Å; E615-K619 WeakPolarHBondContact O-CD 3.41Å; E615-K619 WeakPolarHBondContact O-CG 3.32Å; E615-K619 PolarHBondContact O-N 3.13Å; E615-K619 IonicContact OE2-NZ 3.71Å; E615-K619 PolarHBondContact OE2-NZ 3.35Å
616	V	97.6	Very high	96.9	Very high	0 Å²	0	42.3 Å²	42.3	0%	0	21%	0.205	C	C	.	.	H	α-helix	trans	-68.6	-49.7	172.1	167	0	0	0	0	110.8	C576 V582 L586 Q612 I613 W614 D618 K619 H620 V625 C629	C576-V616 HydrophobicContact CB-CG2 4.44Å; V582-V616 HydrophobicContact CG1-CB 4.37Å; V582-V616 HydrophobicContact CG1-CG1 3.57Å; V582-V616 HydrophobicContact CG1-CG2 3.82Å; L586-V616 HydrophobicContact CD1-CG1 4.39Å; Q612-V616 WeakPolarHBondContact O-CG2 3.31Å; Q612-V616 PolarHBondContact O-N 2.67Å; I613-V616 PolarHBondContact O-N 3.46Å; W614-V616 PolarHBondContact O-N 2.85Å; V616-D618 PolarHBondContact O-N 2.88Å; V616-K619 PolarHBondContact O-N 3.04Å; V616-H620 WeakPolarHBondContact O-CB 3.25Å; V616-H620 PolarHBondContact O-CD2 3.34Å; V616-H620 PolarHBondContact O-N 3.03Å; V616-V625 HydrophobicContact CG1-CG1 3.36Å; V616-C629 VanDerWaalsContact CG1-SG 3.54Å
617	V	97.2	Very high	96.9	Very high	1 Å²	1	47.2 Å²	47.2	1%	0.006	23%	0.228	C	C	.	.	H	α-helix	trans	-59.5	-32.8	178.9	173.4	0	0	0	0	111.9	I613 W614 L626 C629 L654 L658 K690 F694	I613-V617 HydrophobicContact CG2-CG2 4.48Å; I613-V617 WeakPolarHBondContact O-CG2 3.19Å; I613-V617 PolarHBondContact O-N 3.4Å; W614-V617 PolarHBondContact O-N 3.19Å; W614-V617 VanDerWaalsContact O-N 3.13Å; V617-L626 HydrophobicContact CB-CD2 4.47Å; V617-L626 HydrophobicContact CG1-CD2 4.22Å; V617-L626 HydrophobicContact CG2-CD2 4.37Å; V617-C629 HydrophobicContact CG2-CB 3.56Å; V617-C629 VanDerWaalsContact CG2-SG 3.58Å; V617-L654 HydrophobicContact CG1-CD1 4.11Å; V617-L654 HydrophobicContact CG1-CD2 4.35Å; V617-L654 HydrophobicContact CG2-CD2 4.44Å; V617-L658 HydrophobicContact CG1-CD1 4.3Å; V617-K690 HydrophobicContact CG1-CD 4.41Å; V617-K690 HydrophobicContact CG1-CG 4.4Å; V617-K690 WeakPolarHBondContact O-CD 3.48Å; V617-K690 VanDerWaalsContact O-CE 3.3Å; V617-K690 WeakPolarHBondContact O-CE 3.34Å; V617-K690 PolarHBondContact O-NZ 3.13Å; V617-F694 HydrophobicContact CG1-CE2 4.29Å; V617-F694 HydrophobicContact CG2-CE2 3.83Å; V617-F694 HydrophobicContact CG2-CZ 3.93Å
618	D	95	Very high	96.9	Very high	111 Å²	111	45.5 Å²	45.5	59%	0.594	22%	0.221	S	C	*	.	H	α-helix	trans	-71.6	-48.7	174.3	-173	42.8	0	0	0	112.3	W614 V616 H620 K690	W614-D618 PolarHBondContact O-N 2.78Å; V616-D618 PolarHBondContact O-N 2.88Å; D618-H620 PolarHBondContact O-N 2.88Å; D618-K690 PolarHBondContact O-NZ 3.16Å
619	K	95.5	Very high	96.9	Very high	92 Å²	92	44.4 Å²	44.4	40%	0.4	21%	0.212	S	C	.	.	H	α-helix	trans	-71.7	-29.6	-175.2	-67.7	165.3	-162.8	165.6	0	114.4	C576 E615 V616	C576-K619 HydrophobicContact CB-CD 4.46Å; C576-K619 PolarHBondContact SG-NZ 3.02Å; E615-K619 WeakPolarHBondContact O-CB 3.32Å; E615-K619 VanDerWaalsContact O-CD 3.24Å; E615-K619 WeakPolarHBondContact O-CD 3.41Å; E615-K619 WeakPolarHBondContact O-CG 3.32Å; E615-K619 PolarHBondContact O-N 3.13Å; E615-K619 IonicContact OE2-NZ 3.71Å; E615-K619 PolarHBondContact OE2-NZ 3.35Å; V616-K619 PolarHBondContact O-N 3.04Å
620	H	96.8	Very high	96.9	Very high	14 Å²	14	44.4 Å²	44.4	7%	0.065	21%	0.212	C	C	.	.			trans	-99.6	153.4	-172.5	-76	-89.5	0	0	0	114.5	C576 V616 D618 V625 K690	C576-H620 PolarHBondContact O-CD2 2.79Å; C576-H620 PolarHBondContact O-NE2 2.92Å; V616-H620 WeakPolarHBondContact O-CB 3.25Å; V616-H620 PolarHBondContact O-CD2 3.34Å; V616-H620 PolarHBondContact O-N 3.03Å; D618-H620 PolarHBondContact O-N 2.88Å; H620-V625 HydrophobicContact CB-CB 4.35Å; H620-V625 HydrophobicContact CB-CG1 3.79Å; H620-K690 WeakPolarHBondContact O-CE 3.41Å; H620-K690 PolarHBondContact O-NZ 3.03Å
621	T	95.9	Very high	96.8	Very high	39 Å²	39	45.8 Å²	45.8	24%	0.239	22%	0.221	C	C	.	.			trans	-130.5	2.2	169.7	52.9	0	0	0	0	112.5	Y682 S686 K689	T621-Y682 WeakPolarHBondContact CG2-OH 3.49Å; T621-Y682 PolarHBondContact OG1-OH 3.31Å; T621-Y682 VanDerWaalsContact OG1-OH 3.13Å; T621-S686 WeakPolarHBondContact CG2-OG 3.27Å; T621-K689 WeakPolarHBondContact O-CD 3.47Å; T621-K689 WeakPolarHBondContact O-CE 3.48Å; T621-K689 PolarHBondContact O-NZ 2.87Å
622	D	96.7	Very high	96.8	Very high	42 Å²	42	39 Å²	39	23%	0.225	20%	0.196	C	C	.	.			trans	-63.9	150.5	173.8	175.7	-107.9	0	0	0	111.9	I579 E624 V625 L626	I579-D622 HydrophobicContact CD1-CB 4.12Å; I579-D622 HydrophobicContact CG1-CB 4.34Å; D622-E624 WeakPolarHBondContact OD1-CA 3.24Å; D622-E624 PolarHBondContact OD1-N 2.71Å; D622-V625 HydrophobicContact CB-CB 4.24Å; D622-V625 HydrophobicContact CB-CG2 4.11Å; D622-V625 PolarHBondContact OD1-N 3.07Å; D622-L626 WeakPolarHBondContact O-CB 3.35Å; D622-L626 VanDerWaalsContact O-CD1 3.29Å; D622-L626 WeakPolarHBondContact O-CD1 3.37Å; D622-L626 WeakPolarHBondContact O-CG 3.47Å; D622-L626 PolarHBondContact O-N 3.13Å
623	T	93.9	Very high	96.7	Very high	66 Å²	66	37.9 Å²	37.9	41%	0.405	19%	0.19	S	C	.	.	H	α-helix	trans	-74.9	-46.5	-178.3	-48.5	0	0	0	0	111.8	L626 E627 K689	T623-L626 PolarHBondContact O-N 2.68Å; T623-E627 WeakPolarHBondContact O-CB 3.49Å; T623-E627 PolarHBondContact O-N 2.74Å; T623-K689 WeakPolarHBondContact OG1-CE 3.49Å; T623-K689 PolarHBondContact OG1-NZ 2.91Å
624	E	95.1	Very high	96.6	Very high	123 Å²	123	41.2 Å²	41.2	58%	0.575	21%	0.206	S	C	*	.	H	α-helix	trans	-70.2	-39.5	-174.4	-58.4	-171.5	-177.2	0	0	111.6	T583 D622 L626 E627 A628	T583-E624 HydrophobicContact CG2-CB 4.02Å; D622-E624 WeakPolarHBondContact OD1-CA 3.24Å; D622-E624 PolarHBondContact OD1-N 2.71Å; E624-L626 VanDerWaalsContact C-N 3.32Å; E624-L626 PolarHBondContact O-N 3.31Å; E624-E627 PolarHBondContact O-N 3.17Å; E624-A628 WeakPolarHBondContact O-CB 3.23Å; E624-A628 PolarHBondContact O-N 3.4Å
625	V	97.6	Very high	96.4	Very high	0 Å²	0	42.7 Å²	42.7	0%	0	21%	0.212	C	C	.	.	H	α-helix	trans	-60.3	-43	173.8	175.2	0	0	0	0	111	I579 V582 T583 V616 H620 D622 C629	I579-V625 HydrophobicContact CB-CG2 4.3Å; I579-V625 HydrophobicContact CG1-CG2 4.38Å; I579-V625 HydrophobicContact CG2-CG2 3.95Å; V582-V625 HydrophobicContact CG1-CG1 4.04Å; T583-V625 VanDerWaalsContact OG1-CG2 3.24Å; T583-V625 WeakPolarHBondContact OG1-CG2 3.38Å; T583-V625 PolarHBondContact OG1-N 3.44Å; V616-V625 HydrophobicContact CG1-CG1 3.36Å; H620-V625 HydrophobicContact CB-CB 4.35Å; H620-V625 HydrophobicContact CB-CG1 3.79Å; D622-V625 HydrophobicContact CB-CB 4.24Å; D622-V625 HydrophobicContact CB-CG2 4.11Å; D622-V625 PolarHBondContact OD1-N 3.07Å; V625-C629 WeakPolarHBondContact O-CB 3.27Å; V625-C629 PolarHBondContact O-N 3.47Å; V625-C629 PolarHBondContact O-SG 2.84Å
626	L	97.8	Very high	96.3	Very high	1 Å²	1	39 Å²	39	1%	0.005	20%	0.195	C	C	.	.	H	α-helix	trans	-73.2	-36.7	-178.5	-69.4	176.2	0	0	0	112.5	V617 D622 T623 E624 C629 S630 K689 K690 A693	V617-L626 HydrophobicContact CB-CD2 4.47Å; V617-L626 HydrophobicContact CG1-CD2 4.22Å; V617-L626 HydrophobicContact CG2-CD2 4.37Å; D622-L626 WeakPolarHBondContact O-CB 3.35Å; D622-L626 VanDerWaalsContact O-CD1 3.29Å; D622-L626 WeakPolarHBondContact O-CD1 3.37Å; D622-L626 WeakPolarHBondContact O-CG 3.47Å; D622-L626 PolarHBondContact O-N 3.13Å; T623-L626 PolarHBondContact O-N 2.68Å; E624-L626 VanDerWaalsContact C-N 3.32Å; E624-L626 PolarHBondContact O-N 3.31Å; L626-C629 WeakPolarHBondContact O-CB 3.29Å; L626-C629 PolarHBondContact O-N 3.25Å; L626-S630 PolarHBondContact O-N 3.48Å; L626-K689 HydrophobicContact CD1-CB 4.04Å; L626-K690 HydrophobicContact CD1-CB 4.49Å; L626-K690 HydrophobicContact CD1-CG 3.71Å; L626-K690 HydrophobicContact CD2-CG 3.81Å; L626-K690 HydrophobicContact CG-CG 4.45Å; L626-A693 HydrophobicContact CB-CB 3.84Å
627	E	96.4	Very high	96.2	Very high	104 Å²	104	39.7 Å²	39.7	49%	0.486	20%	0.199	S	C	.	.	H	α-helix	trans	-63.9	-48.2	170.4	-173	177.8	150.8	0	0	110.8	T623 E624 C629 S630 T631	T623-E627 WeakPolarHBondContact O-CB 3.49Å; T623-E627 PolarHBondContact O-N 2.74Å; E624-E627 PolarHBondContact O-N 3.17Å; E627-C629 VanDerWaalsContact C-N 3.28Å; E627-C629 PolarHBondContact O-N 3.28Å; E627-S630 PolarHBondContact O-N 3.18Å; E627-T631 PolarHBondContact O-N 3.13Å; E627-T631 PolarHBondContact O-OG1 2.75Å
628	A	96.7	Very high	95.9	Very high	14 Å²	14	42.4 Å²	42.4	12%	0.116	21%	0.214	C	C	.	.	H	α-helix	trans	-58.7	-39	176.5	0	0	0	0	0	111.9	T583 L586 E624 T632	T583-A628 HydrophobicContact CG2-CB 4.36Å; L586-A628 HydrophobicContact CB-CB 3.83Å; L586-A628 HydrophobicContact CD1-CB 3.85Å; E624-A628 WeakPolarHBondContact O-CB 3.23Å; E624-A628 PolarHBondContact O-N 3.4Å; A628-T632 WeakPolarHBondContact O-CB 3.17Å; A628-T632 PolarHBondContact O-N 2.67Å; A628-T632 PolarHBondContact O-OG1 3.11Å
629	C	98.1	Very high	95.8	Very high	0 Å²	0	44.6 Å²	44.6	0%	0	22%	0.221	C	C	.	.	H	α-helix	trans	-60.9	-48.9	171.3	-79.3	0	0	0	0	112.5	L586 I613 V616 V617 V625 L626 E627 T632 Y633 F694	L586-C629 WeakPolarHBondContact CD1-SG 3.42Å; I613-C629 HydrophobicContact CG2-CB 4.01Å; V616-C629 VanDerWaalsContact CG1-SG 3.54Å; V617-C629 HydrophobicContact CG2-CB 3.56Å; V617-C629 VanDerWaalsContact CG2-SG 3.58Å; V625-C629 WeakPolarHBondContact O-CB 3.27Å; V625-C629 PolarHBondContact O-N 3.47Å; V625-C629 PolarHBondContact O-SG 2.84Å; L626-C629 WeakPolarHBondContact O-CB 3.29Å; L626-C629 PolarHBondContact O-N 3.25Å; E627-C629 VanDerWaalsContact C-N 3.28Å; E627-C629 PolarHBondContact O-N 3.28Å; C629-T632 PolarHBondContact O-N 3.38Å; C629-Y633 PolarHBondContact O-N 3Å; C629-F694 HydrophobicContact CB-CE2 4.19Å; C629-F694 HydrophobicContact CB-CZ 4.28Å
630	S	97.6	Very high	95.7	Very high	1 Å²	1	48.1 Å²	48.1	1%	0.007	24%	0.238	C	C	.	.	H	α-helix	trans	-65.9	-49	-178.9	178.5	0	0	0	0	112.2	L626 E627 T632 Y633 H634 A693 F694 H698	L626-S630 PolarHBondContact O-N 3.48Å; E627-S630 PolarHBondContact O-N 3.18Å; S630-T632 VanDerWaalsContact C-N 3.25Å; S630-T632 PolarHBondContact O-N 2.96Å; S630-Y633 CarbonylContact O-C 3.59Å; S630-Y633 WeakPolarHBondContact O-CA 3.11Å; S630-Y633 WeakPolarHBondContact O-CB 3.25Å; S630-Y633 PolarHBondContact O-N 3.47Å; S630-H634 PolarHBondContact O-N 3.2Å; S630-A693 PolarHBondContact OG-O 3.11Å; S630-F694 WeakPolarHBondContact OG-CA 3.33Å; S630-H698 PolarHBondContact O-NE2 2.67Å
631	T	96.3	Very high	95.5	Very high	36 Å²	36	49.2 Å²	49.2	22%	0.221	24%	0.243	C	C	.	.	H	α-helix	trans	-65.7	-31.4	-179.4	-45.7	0	0	0	0	111	E627 H634 Y635	E627-T631 PolarHBondContact O-N 3.13Å; E627-T631 PolarHBondContact O-OG1 2.75Å; T631-H634 WeakPolarHBondContact O-CB 3.17Å; T631-H634 PolarHBondContact O-N 2.97Å; T631-Y635 HydrophobicContact CG2-CD2 4.19Å; T631-Y635 HydrophobicContact CG2-CE2 3.55Å; T631-Y635 WeakPolarHBondContact O-CD2 3.43Å; T631-Y635 PolarHBondContact O-N 3.21Å
632	T	96.9	Very high	95.4	Very high	5 Å²	5	51.9 Å²	51.9	3%	0.031	26%	0.259	C	S	.	.	H	α-helix	trans	-66.3	-44.3	170.1	-59.1	0	0	0	0	112.2	L586 P589 I613 A628 C629 S630 H634 Y635 L636	L586-T632 PolarHBondContact O-OG1 3.09Å; P589-T632 HydrophobicContact CB-CG2 4.17Å; P589-T632 HydrophobicContact CG-CG2 4Å; I613-T632 HydrophobicContact CD1-CG2 3.78Å; A628-T632 WeakPolarHBondContact O-CB 3.17Å; A628-T632 PolarHBondContact O-N 2.67Å; A628-T632 PolarHBondContact O-OG1 3.11Å; C629-T632 PolarHBondContact O-N 3.38Å; S630-T632 VanDerWaalsContact C-N 3.25Å; S630-T632 PolarHBondContact O-N 2.96Å; T632-H634 PolarHBondContact O-N 2.95Å; T632-Y635 PolarHBondContact O-N 3.42Å; T632-L636 HydrophobicContact CG2-CD1 4.1Å; T632-L636 WeakPolarHBondContact O-CB 3.33Å; T632-L636 VanDerWaalsContact O-CG 3.27Å; T632-L636 WeakPolarHBondContact O-CG 3.21Å; T632-L636 PolarHBondContact O-N 3.01Å; T632-L636 VanDerWaalsContact O-N 3.1Å
633	Y	96.8	Very high	95.3	Very high	0 Å²	0	50.1 Å²	50.1	0%	0	25%	0.25	C	C	.	.	H	α-helix	trans	-59.4	-32.8	170.5	-98.6	-74.6	0	0	0	112	L610 I613 C629 S630 C637 V647 A650 R651 L654 F694 H698	L610-Y633 HydrophobicContact CD2-CD1 4.44Å; L610-Y633 HydrophobicContact CD2-CE1 3.82Å; I613-Y633 HydrophobicContact CB-CE2 4.1Å; I613-Y633 HydrophobicContact CG2-CD2 3.8Å; I613-Y633 HydrophobicContact CG2-CE2 3.5Å; I613-Y633 VanDerWaalsContact CG2-CE2 3.5Å; C629-Y633 PolarHBondContact O-N 3Å; S630-Y633 CarbonylContact O-C 3.59Å; S630-Y633 WeakPolarHBondContact O-CA 3.11Å; S630-Y633 WeakPolarHBondContact O-CB 3.25Å; S630-Y633 PolarHBondContact O-N 3.47Å; Y633-C637 WeakPolarHBondContact O-CB 3.44Å; Y633-C637 PolarHBondContact O-N 2.98Å; Y633-C637 PolarHBondContact O-SG 3.38Å; Y633-C637 VanDerWaalsContact O-SG 3.36Å; Y633-V647 HydrophobicContact CD1-CG1 3.86Å; Y633-V647 HydrophobicContact CE1-CG1 4.16Å; Y633-A650 HydrophobicContact CE1-CB 4.45Å; Y633-R651 HydrophobicContact CD1-CB 3.89Å; Y633-R651 HydrophobicContact CD1-CG 4.4Å; Y633-R651 HydrophobicContact CE1-CB 3.93Å; Y633-L654 HydrophobicContact CE2-CD2 3.93Å; Y633-F694 AromaticContact CD2-CE1 3.63Å; Y633-F694 HydrophobicContact CD2-CE1 3.63Å; Y633-F694 AromaticContact CD2-CZ 3.73Å; Y633-F694 HydrophobicContact CD2-CZ 3.73Å; Y633-F694 HydrophobicContact CE2-CE1 4.19Å; Y633-F694 HydrophobicContact CE2-CZ 4.17Å; Y633-F694 HydrophobicContact CG-CE1 4.08Å; Y633-H698 WeakPolarHBondContact CB-NE2 3.49Å; Y633-H698 PolarHBondContact O-NE2 3.34Å
634	H	95.4	Very high	95.4	Very high	69 Å²	69	48.6 Å²	48.6	32%	0.319	24%	0.238	S	C	.	.	H	α-helix	trans	-67.5	-53.3	178.5	178	109.9	0	0	0	110.6	S630 T631 T632 L636 C637 A697 H698	S630-H634 PolarHBondContact O-N 3.2Å; T631-H634 WeakPolarHBondContact O-CB 3.17Å; T631-H634 PolarHBondContact O-N 2.97Å; T632-H634 PolarHBondContact O-N 2.95Å; H634-L636 PolarHBondContact O-N 3.4Å; H634-C637 CarbonylContact O-C 3.59Å; H634-C637 WeakPolarHBondContact O-CA 3.44Å; H634-C637 PolarHBondContact O-N 3.17Å; H634-A697 HydrophobicContact CB-CB 3.96Å; H634-A697 PolarHBondContact ND1-O 3.19Å; H634-H698 WeakPolarHBondContact CA-NE2 3.42Å; H634-H698 WeakPolarHBondContact CB-NE2 3.4Å; H634-H698 PolarHBondContact N-NE2 3.14Å; H634-H698 AromaticContact ND1-CE1 3.71Å
635	Y	94	Very high	95.4	Very high	101 Å²	101	48.1 Å²	48.1	40%	0.396	24%	0.239	S	C	.	.	H	α-helix	trans	-57.2	-36.1	176.8	-68.3	-59.1	0	0	0	112.8	K590 L594 T631 T632	K590-Y635 HydrophobicContact CB-CD1 4.47Å; K590-Y635 HydrophobicContact CB-CD2 3.58Å; K590-Y635 HydrophobicContact CB-CE1 4.38Å; K590-Y635 HydrophobicContact CB-CE2 3.49Å; K590-Y635 VanDerWaalsContact CB-CE2 3.49Å; K590-Y635 HydrophobicContact CB-CG 4.11Å; L594-Y635 WeakPolarHBondContact CD1-O 3.41Å; T631-Y635 HydrophobicContact CG2-CD2 4.19Å; T631-Y635 HydrophobicContact CG2-CE2 3.55Å; T631-Y635 WeakPolarHBondContact O-CD2 3.43Å; T631-Y635 PolarHBondContact O-N 3.21Å; T632-Y635 PolarHBondContact O-N 3.42Å
636	L	95.3	Very high	95.3	Very high	0 Å²	0	52.6 Å²	52.6	0%	0	26%	0.256	C	S	.	.	H	α-helix	trans	-77.1	-19.6	177.1	-65.4	178.9	0	0	0	113.6	P589 L594 M606 L609 L610 I613 T632 H634 I643 V647	P589-L636 HydrophobicContact CB-CD2 4.45Å; L594-L636 HydrophobicContact CD2-CD2 3.8Å; M606-L636 HydrophobicContact CE-CD2 3.9Å; M606-L636 HydrophobicContact SD-CD1 4.23Å; M606-L636 HydrophobicContact SD-CD2 4.36Å; L609-L636 HydrophobicContact CD2-CD1 4.18Å; L610-L636 HydrophobicContact CD2-CD1 4.18Å; I613-L636 HydrophobicContact CD1-CD1 4.43Å; T632-L636 HydrophobicContact CG2-CD1 4.1Å; T632-L636 WeakPolarHBondContact O-CB 3.33Å; T632-L636 VanDerWaalsContact O-CG 3.27Å; T632-L636 WeakPolarHBondContact O-CG 3.21Å; T632-L636 PolarHBondContact O-N 3.01Å; T632-L636 VanDerWaalsContact O-N 3.1Å; H634-L636 PolarHBondContact O-N 3.4Å; L636-I643 HydrophobicContact CD2-CD1 4.37Å; L636-V647 HydrophobicContact CB-CG1 3.74Å; L636-V647 HydrophobicContact CB-CG2 4.12Å; L636-V647 WeakPolarHBondContact O-CG2 3.49Å
637	C	95	Very high	95.2	Very high	14 Å²	14	52.6 Å²	52.6	10%	0.095	26%	0.256	C	S	.	.	T	Hydrogen-bonded Turn	trans	-93.7	30.9	176.1	-81.9	0	0	0	0	113.4	Y633 H634 F644 V647 R651	Y633-C637 WeakPolarHBondContact O-CB 3.44Å; Y633-C637 PolarHBondContact O-N 2.98Å; Y633-C637 PolarHBondContact O-SG 3.38Å; Y633-C637 VanDerWaalsContact O-SG 3.36Å; H634-C637 CarbonylContact O-C 3.59Å; H634-C637 WeakPolarHBondContact O-CA 3.44Å; H634-C637 PolarHBondContact O-N 3.17Å; C637-F644 HydrophobicContact CB-CD2 4.48Å; C637-F644 HydrophobicContact CB-CE2 4.36Å; C637-F644 VanDerWaalsContact O-CD2 3.24Å; C637-F644 WeakPolarHBondContact O-CD2 3.33Å; C637-F644 VanDerWaalsContact O-CE2 3.26Å; C637-F644 WeakPolarHBondContact O-CE2 3.4Å; C637-V647 WeakPolarHBondContact SG-CG1 3.28Å; C637-R651 VanDerWaalsContact SG-CZ 3.59Å
638	N	92.3	Very high	95.2	Very high	58 Å²	58	49.2 Å²	49.2	31%	0.31	24%	0.241	S	C	.	.			trans	-76.6	121.4	171.4	-179.4	-21.5	0	0	0	111.1	E640 F641	N638-E640 VanDerWaalsContact C-N 3.26Å; N638-E640 PolarHBondContact O-N 2.91Å; N638-E640 VanDerWaalsContact OD1-CB 3.32Å; N638-E640 WeakPolarHBondContact OD1-CB 3.33Å; N638-E640 WeakPolarHBondContact OD1-CG 3.2Å; N638-E640 PolarHBondContact OD1-N 3.49Å; N638-F641 HydrophobicContact CB-CD2 4.02Å; N638-F641 PolarHBondContact O-N 2.95Å
639	E	91.6	Very high	95.2	Very high	158 Å²	158	53.3 Å²	53.3	74%	0.738	26%	0.26	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.1	-20.5	-179	-71.1	-168	-176.3	0	0	115	F641 F644	E639-F641 PolarHBondContact O-N 2.77Å; E639-F644 HydrophobicContact CB-CD2 4.36Å; E639-F644 HydrophobicContact CG-CD1 4.46Å; E639-F644 HydrophobicContact CG-CD2 3.71Å; E639-F644 HydrophobicContact CG-CE1 4.26Å; E639-F644 HydrophobicContact CG-CE2 3.46Å; E639-F644 VanDerWaalsContact CG-CE2 3.46Å; E639-F644 HydrophobicContact CG-CG 4.21Å; E639-F644 HydrophobicContact CG-CZ 3.77Å
640	E	93.6	Very high	95.2	Very high	165 Å²	165	54 Å²	54	77%	0.771	27%	0.266	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65	-24.5	176.8	-62.6	-172.3	133.2	0	0	112.2	N638	N638-E640 VanDerWaalsContact C-N 3.26Å; N638-E640 PolarHBondContact O-N 2.91Å; N638-E640 VanDerWaalsContact OD1-CB 3.32Å; N638-E640 WeakPolarHBondContact OD1-CB 3.33Å; N638-E640 WeakPolarHBondContact OD1-CG 3.2Å; N638-E640 PolarHBondContact OD1-N 3.49Å
641	F	93.1	Very high	95.1	Very high	38 Å²	38	55.7 Å²	55.7	17%	0.167	27%	0.272	C	S	.	.	S	Bend	trans	-103.3	141.5	-173.4	-64.5	-84	0	0	0	113.5	L594 D595 N638 E639 I643 F644	L594-F641 HydrophobicContact CB-CB 4.28Å; L594-F641 HydrophobicContact CB-CD1 3.66Å; L594-F641 HydrophobicContact CB-CD2 4.13Å; L594-F641 HydrophobicContact CB-CE1 3.94Å; L594-F641 HydrophobicContact CB-CE2 4.39Å; L594-F641 HydrophobicContact CB-CG 3.74Å; L594-F641 HydrophobicContact CB-CZ 4.3Å; L594-F641 HydrophobicContact CD1-CD2 3.89Å; L594-F641 HydrophobicContact CD1-CE2 4.11Å; L594-F641 HydrophobicContact CD1-CG 4.29Å; D595-F641 HydrophobicContact CB-CD1 4.47Å; D595-F641 HydrophobicContact CB-CE1 4.45Å; N638-F641 HydrophobicContact CB-CD2 4.02Å; N638-F641 PolarHBondContact O-N 2.95Å; E639-F641 PolarHBondContact O-N 2.77Å; F641-I643 HydrophobicContact CB-CG1 3.96Å; F641-I643 PolarHBondContact O-N 3.24Å; F641-F644 WeakPolarHBondContact O-CB 3.45Å; F641-F644 PolarHBondContact O-N 3.5Å
642	T	93	Very high	95.1	Very high	94 Å²	94	55.1 Å²	55.1	58%	0.577	27%	0.27	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.7	-13.6	-179.1	53.2	0	0	0	0	115	T598	T598-T642 WeakPolarHBondContact CB-OG1 3.44Å; T598-T642 PolarHBondContact OG1-OG1 3.44Å
643	I	94.2	Very high	95.1	Very high	6 Å²	6	60.1 Å²	60.1	3%	0.031	29%	0.293	C	S	.	.	T	Hydrogen-bonded Turn	trans	-74.8	-21.1	174.8	61.1	165.3	0	0	0	114	L594 M606 L636 F641 N645 R646 V647	L594-I643 HydrophobicContact CB-CD1 4.05Å; L594-I643 HydrophobicContact CD1-CD1 4.23Å; L594-I643 HydrophobicContact CD2-CD1 4.07Å; L594-I643 HydrophobicContact CG-CD1 4.33Å; M606-I643 HydrophobicContact CE-CD1 3.68Å; M606-I643 HydrophobicContact CE-CG2 4.45Å; L636-I643 HydrophobicContact CD2-CD1 4.37Å; F641-I643 HydrophobicContact CB-CG1 3.96Å; F641-I643 PolarHBondContact O-N 3.24Å; I643-N645 PolarHBondContact O-N 3.37Å; I643-R646 WeakPolarHBondContact O-CB 3.45Å; I643-R646 PolarHBondContact O-N 3.46Å; I643-V647 HydrophobicContact CD1-CG2 4.42Å; I643-V647 PolarHBondContact O-N 2.88Å
644	F	96.2	Very high	95.1	Very high	33 Å²	33	60.3 Å²	60.3	15%	0.145	29%	0.294	C	S	.	.	H	α-helix	trans	-44	-56.7	-170.3	175.8	-95.7	0	0	0	113.6	C637 E639 F641 R646 V647 D648	C637-F644 HydrophobicContact CB-CD2 4.48Å; C637-F644 HydrophobicContact CB-CE2 4.36Å; C637-F644 VanDerWaalsContact O-CD2 3.24Å; C637-F644 WeakPolarHBondContact O-CD2 3.33Å; C637-F644 VanDerWaalsContact O-CE2 3.26Å; C637-F644 WeakPolarHBondContact O-CE2 3.4Å; E639-F644 HydrophobicContact CB-CD2 4.36Å; E639-F644 HydrophobicContact CG-CD1 4.46Å; E639-F644 HydrophobicContact CG-CD2 3.71Å; E639-F644 HydrophobicContact CG-CE1 4.26Å; E639-F644 HydrophobicContact CG-CE2 3.46Å; E639-F644 VanDerWaalsContact CG-CE2 3.46Å; E639-F644 HydrophobicContact CG-CG 4.21Å; E639-F644 HydrophobicContact CG-CZ 3.77Å; F641-F644 WeakPolarHBondContact O-CB 3.45Å; F641-F644 PolarHBondContact O-N 3.5Å; F644-R646 PolarHBondContact O-N 3.39Å; F644-R646 VanDerWaalsContact O-N 3.09Å; F644-V647 PolarHBondContact O-N 3.24Å; F644-D648 HydrophobicContact CE1-CB 4.19Å; F644-D648 HydrophobicContact CZ-CB 4.25Å; F644-D648 PolarHBondContact O-N 3.1Å
645	N	95.1	Very high	95.2	Very high	114 Å²	114	57.1 Å²	57.1	61%	0.61	28%	0.279	S	S	*	.	H	α-helix	trans	-60.2	-25.8	-175.6	-64.9	-84.8	0	0	0	113.7	I643 I649	I643-N645 PolarHBondContact O-N 3.37Å; N645-I649 VanDerWaalsContact O-CD1 3.25Å; N645-I649 WeakPolarHBondContact O-CD1 3.44Å; N645-I649 VanDerWaalsContact O-CG1 3.23Å; N645-I649 WeakPolarHBondContact O-CG1 3.5Å
646	R	95.4	Very high	95.3	Very high	94 Å²	94	55.9 Å²	55.9	36%	0.355	28%	0.279	S	S	.	.	H	α-helix	trans	-77.2	-42.9	175.5	162.8	-177.1	-103.8	118.6	-14.1	110.8	D607 L610 I643 F644 A650	D607-R646 WeakPolarHBondContact OD1-CD 3.34Å; D607-R646 IonicContact OD1-CZ 2.66Å; D607-R646 IonicContact OD1-NE 3.15Å; D607-R646 PolarHBondContact OD1-NE 2.88Å; D607-R646 IonicContact OD1-NH2 2.9Å; D607-R646 PolarHBondContact OD1-NH2 3.22Å; D607-R646 IonicContact OD2-CZ 3.97Å; D607-R646 IonicContact OD2-NE 3.81Å; D607-R646 PolarHBondContact OD2-NE 3.49Å; D607-R646 IonicContact OD2-NH2 2.7Å; D607-R646 PolarHBondContact OD2-NH2 3.43Å; L610-R646 HydrophobicContact CD1-CG 4.31Å; I643-R646 WeakPolarHBondContact O-CB 3.45Å; I643-R646 PolarHBondContact O-N 3.46Å; F644-R646 PolarHBondContact O-N 3.39Å; F644-R646 VanDerWaalsContact O-N 3.09Å; R646-A650 PolarHBondContact O-N 3.4Å
647	V	96.9	Very high	95.4	Very high	0 Å²	0	61.7 Å²	61.7	0%	0	31%	0.306	C	S	.	.	H	α-helix	trans	-71.4	-42	-178.7	-173.7	0	0	0	0	110.4	M606 L610 Y633 L636 C637 I643 F644 I649 A650 R651	M606-V647 HydrophobicContact SD-CG2 4.26Å; L610-V647 HydrophobicContact CD1-CG2 4.28Å; L610-V647 HydrophobicContact CD2-CG1 3.93Å; L610-V647 HydrophobicContact CD2-CG2 4.48Å; Y633-V647 HydrophobicContact CD1-CG1 3.86Å; Y633-V647 HydrophobicContact CE1-CG1 4.16Å; L636-V647 HydrophobicContact CB-CG1 3.74Å; L636-V647 HydrophobicContact CB-CG2 4.12Å; L636-V647 WeakPolarHBondContact O-CG2 3.49Å; C637-V647 WeakPolarHBondContact SG-CG1 3.28Å; I643-V647 HydrophobicContact CD1-CG2 4.42Å; I643-V647 PolarHBondContact O-N 2.88Å; F644-V647 PolarHBondContact O-N 3.24Å; V647-I649 VanDerWaalsContact C-N 3.32Å; V647-I649 PolarHBondContact O-N 2.95Å; V647-A650 PolarHBondContact O-N 2.82Å; V647-A650 VanDerWaalsContact O-N 3.14Å; V647-R651 WeakPolarHBondContact O-CB 3.45Å; V647-R651 PolarHBondContact O-N 3.02Å
648	D	96.3	Very high	95.4	Very high	34 Å²	34	61.7 Å²	61.7	18%	0.182	31%	0.305	C	S	.	.	H	α-helix	trans	-62.7	-34.8	178.9	-175.6	52.2	0	0	0	113.2	F644 R651 S652	F644-D648 HydrophobicContact CE1-CB 4.19Å; F644-D648 HydrophobicContact CZ-CB 4.25Å; F644-D648 PolarHBondContact O-N 3.1Å; D648-R651 IonicContact OD1-CZ 2.77Å; D648-R651 IonicContact OD1-NE 3.77Å; D648-R651 PolarHBondContact OD1-NE 2.83Å; D648-R651 IonicContact OD1-NH2 2.92Å; D648-R651 PolarHBondContact OD1-NH2 3.14Å; D648-S652 VanDerWaalsContact O-CB 3.26Å; D648-S652 WeakPolarHBondContact O-CB 3.41Å; D648-S652 PolarHBondContact O-N 3.49Å; D648-S652 PolarHBondContact O-OG 3.35Å
649	I	96.7	Very high	95.6	Very high	99 Å²	99	59.1 Å²	59.1	51%	0.508	29%	0.292	S	S	.	.	H	α-helix	trans	-63.7	-47	172.9	-71.5	169	0	0	0	110.6	N645 V647 S652 Q653	N645-I649 VanDerWaalsContact O-CD1 3.25Å; N645-I649 WeakPolarHBondContact O-CD1 3.44Å; N645-I649 VanDerWaalsContact O-CG1 3.23Å; N645-I649 WeakPolarHBondContact O-CG1 3.5Å; V647-I649 VanDerWaalsContact C-N 3.32Å; V647-I649 PolarHBondContact O-N 2.95Å; I649-S652 PolarHBondContact O-N 3.1Å; I649-Q653 WeakPolarHBondContact O-CB 3.44Å; I649-Q653 VanDerWaalsContact O-CG 3.25Å; I649-Q653 WeakPolarHBondContact O-CG 3.44Å; I649-Q653 PolarHBondContact O-N 3.29Å
650	A	96.8	Very high	95.8	Very high	15 Å²	15	56.6 Å²	56.6	12%	0.124	28%	0.283	C	S	.	.	H	α-helix	trans	-65.7	-41.5	178.4	0	0	0	0	0	112	L610 Y633 R646 V647 Q653 L654	L610-A650 HydrophobicContact CB-CB 4.3Å; L610-A650 HydrophobicContact CD1-CB 4.02Å; Y633-A650 HydrophobicContact CE1-CB 4.45Å; R646-A650 PolarHBondContact O-N 3.4Å; V647-A650 PolarHBondContact O-N 2.82Å; V647-A650 VanDerWaalsContact O-N 3.14Å; A650-Q653 PolarHBondContact O-N 3.2Å; A650-L654 PolarHBondContact O-N 3.29Å; A650-L654 VanDerWaalsContact O-N 3.09Å
651	R	96.4	Very high	95.9	Very high	37 Å²	37	51.6 Å²	51.6	14%	0.14	26%	0.259	C	S	.	.	H	α-helix	trans	-59	-50	173.9	178.3	177.1	65.2	172.3	-2.6	111.3	Y633 C637 V647 D648 Q653 L654 L655 H698	Y633-R651 HydrophobicContact CD1-CB 3.89Å; Y633-R651 HydrophobicContact CD1-CG 4.4Å; Y633-R651 HydrophobicContact CE1-CB 3.93Å; C637-R651 VanDerWaalsContact SG-CZ 3.59Å; V647-R651 WeakPolarHBondContact O-CB 3.45Å; V647-R651 PolarHBondContact O-N 3.02Å; D648-R651 IonicContact OD1-CZ 2.77Å; D648-R651 IonicContact OD1-NE 3.77Å; D648-R651 PolarHBondContact OD1-NE 2.83Å; D648-R651 IonicContact OD1-NH2 2.92Å; D648-R651 PolarHBondContact OD1-NH2 3.14Å; R651-Q653 PolarHBondContact O-N 2.95Å; R651-L654 PolarHBondContact O-N 2.87Å; R651-L655 HydrophobicContact CG-CD1 3.88Å; R651-L655 VanDerWaalsContact O-CG 3.28Å; R651-L655 WeakPolarHBondContact O-CG 3.33Å; R651-L655 PolarHBondContact O-N 3.38Å; R651-H698 PolarHBondContact NH1-CE1 3.31Å; R651-H698 PolarHBondContact NH1-ND1 3.5Å
652	S	96.3	Very high	96.1	Very high	24 Å²	24	49.8 Å²	49.8	17%	0.168	25%	0.251	C	S	.	.	H	α-helix	trans	-62.4	-42.6	-178.6	-61.7	0	0	0	0	111.5	D648 I649 L654 L655 D656	D648-S652 VanDerWaalsContact O-CB 3.26Å; D648-S652 WeakPolarHBondContact O-CB 3.41Å; D648-S652 PolarHBondContact O-N 3.49Å; D648-S652 PolarHBondContact O-OG 3.35Å; I649-S652 PolarHBondContact O-N 3.1Å; S652-L654 PolarHBondContact O-N 2.96Å; S652-L655 PolarHBondContact O-N 3.45Å; S652-D656 PolarHBondContact O-N 3.31Å
653	Q	96.9	Very high	96.1	Very high	109 Å²	109	47.7 Å²	47.7	51%	0.509	24%	0.236	S	C	.	.	H	α-helix	trans	-63.2	-40.5	177.3	-72.5	172.6	-12.9	0	0	113	W614 I649 A650 R651 E657	W614-Q653 VanDerWaalsContact CH2-C 3.45Å; W614-Q653 HydrophobicContact CH2-CB 3.74Å; W614-Q653 HydrophobicContact CZ3-CB 3.79Å; I649-Q653 WeakPolarHBondContact O-CB 3.44Å; I649-Q653 VanDerWaalsContact O-CG 3.25Å; I649-Q653 WeakPolarHBondContact O-CG 3.44Å; I649-Q653 PolarHBondContact O-N 3.29Å; A650-Q653 PolarHBondContact O-N 3.2Å; R651-Q653 PolarHBondContact O-N 2.95Å; Q653-E657 PolarHBondContact O-N 2.87Å
654	L	96.9	Very high	96.1	Very high	4 Å²	4	54.4 Å²	54.4	2%	0.021	26%	0.261	C	S	.	.	H	α-helix	trans	-64.1	-41.9	175	173.8	61.2	0	0	0	111.5	W614 V617 Y633 A650 R651 S652 L658 F694	W614-L654 HydrophobicContact CD2-CB 4.19Å; W614-L654 HydrophobicContact CD2-CD1 3.89Å; W614-L654 HydrophobicContact CE3-CB 3.92Å; W614-L654 HydrophobicContact CE3-CD1 4.48Å; W614-L654 HydrophobicContact CG-CD1 4.05Å; W614-L654 HydrophobicContact CH2-CB 4.14Å; W614-L654 HydrophobicContact CZ2-CB 4.38Å; W614-L654 HydrophobicContact CZ2-CD1 4.3Å; W614-L654 HydrophobicContact CZ3-CB 3.89Å; V617-L654 HydrophobicContact CG1-CD1 4.11Å; V617-L654 HydrophobicContact CG1-CD2 4.35Å; V617-L654 HydrophobicContact CG2-CD2 4.44Å; Y633-L654 HydrophobicContact CE2-CD2 3.93Å; A650-L654 PolarHBondContact O-N 3.29Å; A650-L654 VanDerWaalsContact O-N 3.09Å; R651-L654 PolarHBondContact O-N 2.87Å; S652-L654 PolarHBondContact O-N 2.96Å; L654-L658 HydrophobicContact CD1-CD1 4.02Å; L654-L658 HydrophobicContact CD1-CG 4.28Å; L654-L658 HydrophobicContact CG-CD1 4.06Å; L654-L658 WeakPolarHBondContact O-CB 3.23Å; L654-L658 VanDerWaalsContact O-CG 3.32Å; L654-L658 WeakPolarHBondContact O-CG 3.36Å; L654-L658 PolarHBondContact O-N 3.28Å; L654-F694 HydrophobicContact CD2-CE1 3.84Å; L654-F694 HydrophobicContact CD2-CZ 3.74Å
655	L	96.6	Very high	96	Very high	3 Å²	3	54.5 Å²	54.5	2%	0.016	26%	0.263	C	S	.	.	H	α-helix	trans	-69.5	-41.1	179.5	-69.5	174.3	0	0	0	112.6	R651 S652 E657 L658 V659 F694 L700 W703	R651-L655 HydrophobicContact CG-CD1 3.88Å; R651-L655 VanDerWaalsContact O-CG 3.28Å; R651-L655 WeakPolarHBondContact O-CG 3.33Å; R651-L655 PolarHBondContact O-N 3.38Å; S652-L655 PolarHBondContact O-N 3.45Å; L655-E657 VanDerWaalsContact C-N 3.35Å; L655-E657 PolarHBondContact O-N 3.43Å; L655-L658 PolarHBondContact O-N 3.13Å; L655-V659 WeakPolarHBondContact O-CB 3.46Å; L655-V659 VanDerWaalsContact O-CG2 3.28Å; L655-V659 WeakPolarHBondContact O-CG2 3.43Å; L655-V659 PolarHBondContact O-N 2.87Å; L655-F694 HydrophobicContact CD2-CB 3.84Å; L655-F694 HydrophobicContact CD2-CD1 3.99Å; L655-F694 HydrophobicContact CD2-CG 4.15Å; L655-L700 HydrophobicContact CD1-CD1 3.68Å; L655-L700 HydrophobicContact CD1-CG 4.1Å; L655-L700 HydrophobicContact CD2-CD1 4.21Å; L655-L700 HydrophobicContact CD2-CD2 3.96Å; L655-L700 HydrophobicContact CD2-CG 4.25Å; L655-W703 HydrophobicContact CB-CH2 3.64Å; L655-W703 HydrophobicContact CB-CZ2 3.77Å; L655-W703 HydrophobicContact CB-CZ3 4.2Å; L655-W703 HydrophobicContact CD1-CH2 3.74Å; L655-W703 HydrophobicContact CD1-CZ3 3.88Å; L655-W703 HydrophobicContact CG-CH2 4.36Å
656	D	96.8	Very high	95.9	Very high	75 Å²	75	49.6 Å²	49.6	40%	0.401	24%	0.237	S	C	.	.	H	α-helix	trans	-56.5	-48	173.9	-75.8	-35.5	0	0	0	110.8	S652 V659 D660 W703	S652-D656 PolarHBondContact O-N 3.31Å; D656-V659 PolarHBondContact O-N 2.84Å; D656-D660 WeakPolarHBondContact O-CB 3.18Å; D656-D660 PolarHBondContact O-N 2.72Å; D656-W703 WeakPolarHBondContact OD1-CZ2 3.47Å; D656-W703 PolarHBondContact OD1-NE1 3.24Å
657	E	96.8	Very high	95.6	Very high	121 Å²	121	52.1 Å²	52.1	57%	0.565	25%	0.252	S	S	*	.	H	α-helix	trans	-66.5	-40.6	179.3	-173.3	169.4	168.6	0	0	112.9	Q653 L655 K661	Q653-E657 PolarHBondContact O-N 2.87Å; L655-E657 VanDerWaalsContact C-N 3.35Å; L655-E657 PolarHBondContact O-N 3.43Å; E657-K661 VanDerWaalsContact O-CB 3.3Å; E657-K661 WeakPolarHBondContact O-CB 3.33Å; E657-K661 PolarHBondContact O-N 3.43Å
658	L	96.5	Very high	95.3	Very high	15 Å²	15	57.5 Å²	57.5	8%	0.079	28%	0.281	C	S	.	.	H	α-helix	trans	-64.5	-43.5	176.9	-74.7	172.1	0	0	0	112.2	V617 L654 L655 K661 F662 T687 K690 I691	V617-L658 HydrophobicContact CG1-CD1 4.3Å; L654-L658 HydrophobicContact CD1-CD1 4.02Å; L654-L658 HydrophobicContact CD1-CG 4.28Å; L654-L658 HydrophobicContact CG-CD1 4.06Å; L654-L658 WeakPolarHBondContact O-CB 3.23Å; L654-L658 VanDerWaalsContact O-CG 3.32Å; L654-L658 WeakPolarHBondContact O-CG 3.36Å; L654-L658 PolarHBondContact O-N 3.28Å; L655-L658 PolarHBondContact O-N 3.13Å; L658-K661 PolarHBondContact O-N 3.29Å; L658-F662 WeakPolarHBondContact O-CB 3.16Å; L658-F662 PolarHBondContact O-N 3.04Å; L658-T687 HydrophobicContact CD2-CG2 4.42Å; L658-T687 WeakPolarHBondContact O-CG2 3.44Å; L658-K690 HydrophobicContact CD1-CB 4.12Å; L658-K690 HydrophobicContact CD2-CB 3.92Å; L658-K690 HydrophobicContact CD2-CD 3.85Å; L658-K690 HydrophobicContact CD2-CG 4.48Å; L658-I691 HydrophobicContact CB-CG1 4.12Å
659	V	96.2	Very high	95	Very high	4 Å²	4	57 Å²	57	2%	0.024	28%	0.277	C	S	.	.	H	α-helix	trans	-70.8	-43	180	174.3	0	0	0	0	111.3	L655 D656 K661 F662 N663 I691 W703 L705	L655-V659 WeakPolarHBondContact O-CB 3.46Å; L655-V659 VanDerWaalsContact O-CG2 3.28Å; L655-V659 WeakPolarHBondContact O-CG2 3.43Å; L655-V659 PolarHBondContact O-N 2.87Å; D656-V659 PolarHBondContact O-N 2.84Å; V659-K661 PolarHBondContact O-N 3.45Å; V659-F662 PolarHBondContact O-N 3.23Å; V659-N663 WeakPolarHBondContact CG1-ND2 3.41Å; V659-N663 PolarHBondContact O-N 3.07Å; V659-N663 PolarHBondContact O-ND2 3.5Å; V659-I691 HydrophobicContact CG2-CD1 4.22Å; V659-W703 HydrophobicContact CB-CG 4.42Å; V659-W703 HydrophobicContact CG1-CB 4.1Å; V659-W703 HydrophobicContact CG1-CG 4.16Å; V659-W703 HydrophobicContact CG2-CB 4.33Å; V659-W703 HydrophobicContact CG2-CD2 4.47Å; V659-W703 HydrophobicContact CG2-CG 4.08Å; V659-L705 HydrophobicContact CG1-CD2 4.16Å; V659-L705 HydrophobicContact CG2-CD1 4.45Å; V659-L705 HydrophobicContact CG2-CD2 4.17Å
660	D	95.6	Very high	94.6	Very high	104 Å²	104	54.5 Å²	54.5	56%	0.556	27%	0.265	S	S	*	.	H	α-helix	trans	-65.9	-27.2	174.6	-85.4	0.6	0	0	0	112.1	D656 R664	D656-D660 WeakPolarHBondContact O-CB 3.18Å; D656-D660 PolarHBondContact O-N 2.72Å; D660-R664 PolarHBondContact O-NE 2.95Å; D660-R664 PolarHBondContact O-NH2 3.18Å
661	K	95.8	Very high	94.1	Very high	61 Å²	61	59 Å²	59	27%	0.265	28%	0.283	S	S	.	.	H	α-helix	trans	-71	-48.8	168.5	-173.3	-174.3	177.4	-159.7	0	111.4	E657 L658 V659 R664 L665 T687	E657-K661 VanDerWaalsContact O-CB 3.3Å; E657-K661 WeakPolarHBondContact O-CB 3.33Å; E657-K661 PolarHBondContact O-N 3.43Å; L658-K661 PolarHBondContact O-N 3.29Å; V659-K661 PolarHBondContact O-N 3.45Å; K661-R664 PolarHBondContact O-N 2.86Å; K661-L665 HydrophobicContact CD-CD1 4.46Å; K661-L665 HydrophobicContact CG-CD1 4.04Å; K661-L665 WeakPolarHBondContact O-CG 3.32Å; K661-L665 PolarHBondContact O-N 3.21Å; K661-L665 VanDerWaalsContact O-N 3.11Å; K661-T687 HydrophobicContact CB-CG2 4.11Å; K661-T687 HydrophobicContact CD-CG2 3.96Å; K661-T687 WeakPolarHBondContact CE-OG1 3.32Å; K661-T687 HydrophobicContact CG-CG2 4.1Å; K661-T687 PolarHBondContact NZ-OG1 2.94Å
662	F	96.3	Very high	93.1	Very high	0 Å²	0	66.7 Å²	66.7	0%	0	32%	0.321	C	S	.	.	H	α-helix	trans	-61.9	-45.7	-176	178.2	-118.2	0	0	0	112.8	L658 V659 R664 L665 L666 V684 T687 L688 I691 L705	L658-F662 WeakPolarHBondContact O-CB 3.16Å; L658-F662 PolarHBondContact O-N 3.04Å; V659-F662 PolarHBondContact O-N 3.23Å; F662-R664 PolarHBondContact O-N 3.43Å; F662-L665 PolarHBondContact O-N 3.36Å; F662-L666 HydrophobicContact CE1-CD2 4.43Å; F662-L666 HydrophobicContact CZ-CD2 4.37Å; F662-L666 WeakPolarHBondContact O-CB 3.48Å; F662-L666 PolarHBondContact O-N 2.93Å; F662-V684 HydrophobicContact CE2-CG1 4.35Å; F662-T687 HydrophobicContact CB-CG2 3.87Å; F662-L688 HydrophobicContact CD2-CB 4.48Å; F662-L688 HydrophobicContact CE2-CB 3.99Å; F662-L688 HydrophobicContact CE2-CD1 4.13Å; F662-L688 HydrophobicContact CZ-CD1 4.02Å; F662-I691 HydrophobicContact CB-CD1 3.42Å; F662-I691 VanDerWaalsContact CB-CD1 3.42Å; F662-I691 HydrophobicContact CD1-CD1 3.9Å; F662-I691 HydrophobicContact CD2-CD1 4.46Å; F662-I691 HydrophobicContact CG-CD1 3.7Å; F662-L705 HydrophobicContact CD1-CD2 4.11Å; F662-L705 HydrophobicContact CE1-CD2 4.37Å
663	N	94.4	Very high	91.7	Very high	49 Å²	49	69.5 Å²	69.5	26%	0.262	35%	0.354	S	S	.	.	H	α-helix	trans	-64.5	-38.7	-179	-70.5	-36.6	0	0	0	112.3	V659 L666 E667 S708	V659-N663 WeakPolarHBondContact CG1-ND2 3.41Å; V659-N663 PolarHBondContact O-N 3.07Å; V659-N663 PolarHBondContact O-ND2 3.5Å; N663-L666 PolarHBondContact O-N 3Å; N663-E667 WeakPolarHBondContact O-CG 3.39Å; N663-E667 PolarHBondContact O-N 2.65Å; N663-S708 PolarHBondContact OD1-OG 3.17Å
664	R	93.7	Very high	90.7	Very high	148 Å²	148	70.9 Å²	70.9	56%	0.558	36%	0.36	S	S	*	.	H	α-helix	trans	-63.8	-49.3	174.6	-76.2	179.5	-71.4	141.6	-2.5	112.1	D660 K661 F662 L666 E667 D668	D660-R664 PolarHBondContact O-NE 2.95Å; D660-R664 PolarHBondContact O-NH2 3.18Å; K661-R664 PolarHBondContact O-N 2.86Å; F662-R664 PolarHBondContact O-N 3.43Å; R664-L666 PolarHBondContact O-N 3.1Å; R664-E667 PolarHBondContact O-N 3.05Å; R664-D668 PolarHBondContact O-N 2.85Å
665	L	94.3	Very high	89.8	Confident	35 Å²	35	79.9 Å²	79.9	18%	0.183	40%	0.402	C	S	.	.	H	α-helix	trans	-58.1	-34.5	175.9	-71.8	173.8	0	0	0	112	K661 F662 F669 Q683 V684 T687	K661-L665 HydrophobicContact CD-CD1 4.46Å; K661-L665 HydrophobicContact CG-CD1 4.04Å; K661-L665 WeakPolarHBondContact O-CG 3.32Å; K661-L665 PolarHBondContact O-N 3.21Å; K661-L665 VanDerWaalsContact O-N 3.11Å; F662-L665 PolarHBondContact O-N 3.36Å; L665-F669 WeakPolarHBondContact O-CB 3.11Å; L665-F669 PolarHBondContact O-N 3.24Å; L665-Q683 HydrophobicContact CD1-CB 3.92Å; L665-Q683 WeakPolarHBondContact CD1-O 3.41Å; L665-Q683 HydrophobicContact CD2-CB 3.92Å; L665-V684 HydrophobicContact CB-CG2 4.04Å; L665-T687 WeakPolarHBondContact CD1-OG1 3.38Å
666	L	92.2	Very high	89.2	Confident	11 Å²	11	82.5 Å²	82.5	6%	0.058	42%	0.42	C	S	.	.	H	α-helix	trans	-77.2	-31.2	179.3	-168.4	68.3	0	0	0	113.5	F662 N663 R664 L670 S708 L712	F662-L666 HydrophobicContact CE1-CD2 4.43Å; F662-L666 HydrophobicContact CZ-CD2 4.37Å; F662-L666 WeakPolarHBondContact O-CB 3.48Å; F662-L666 PolarHBondContact O-N 2.93Å; N663-L666 PolarHBondContact O-N 3Å; R664-L666 PolarHBondContact O-N 3.1Å; L666-L670 HydrophobicContact CD1-CD1 3.68Å; L666-L670 HydrophobicContact CD1-CG 3.83Å; L666-L670 HydrophobicContact CD2-CD1 4.46Å; L666-L670 HydrophobicContact CG-CD1 3.84Å; L666-L670 HydrophobicContact CG-CG 4.23Å; L666-L670 WeakPolarHBondContact O-CB 3.37Å; L666-L670 WeakPolarHBondContact O-CG 3.49Å; L666-L670 PolarHBondContact O-N 3.39Å; L666-S708 VanDerWaalsContact CD2-CB 3.45Å; L666-S708 WeakPolarHBondContact CD2-O 3.39Å; L666-L712 HydrophobicContact CD1-CB 4.38Å; L666-L712 HydrophobicContact CD1-CD1 3.61Å
667	E	90.1	Very high	88.7	Confident	146 Å²	146	83.3 Å²	83.3	68%	0.682	42%	0.424	S	S	*	.	H	α-helix	trans	-63.3	-44.2	171.6	-77.6	178.7	174.3	0	0	110.9	N663 R664	N663-E667 WeakPolarHBondContact O-CG 3.39Å; N663-E667 PolarHBondContact O-N 2.65Å; R664-E667 PolarHBondContact O-N 3.05Å
668	D	89.2	Confident	88.4	Confident	113 Å²	113	85.9 Å²	85.9	60%	0.604	44%	0.436	S	S	*	.	H	α-helix	trans	-69	-50.6	176	-63.4	-35.9	0	0	0	111.3	R664 L670 Q671	R664-D668 PolarHBondContact O-N 2.85Å; D668-L670 VanDerWaalsContact C-N 3.26Å; D668-L670 PolarHBondContact O-N 3.42Å; D668-Q671 WeakPolarHBondContact O-CB 3.45Å; D668-Q671 PolarHBondContact O-N 3.48Å; D668-Q671 VanDerWaalsContact O-N 3.15Å
669	F	90.6	Very high	88.1	Confident	23 Å²	23	90.9 Å²	90.9	10%	0.101	46%	0.463	C	S	.	.	H	α-helix	trans	-66.2	-17.8	-175.3	-176.1	-98.2	0	0	0	115.1	L665 P676 D680 A681 V684 L712 M722 I726	L665-F669 WeakPolarHBondContact O-CB 3.11Å; L665-F669 PolarHBondContact O-N 3.24Å; F669-P676 HydrophobicContact CD2-CB 3.41Å; F669-P676 VanDerWaalsContact CD2-CB 3.41Å; F669-P676 HydrophobicContact CD2-CG 3.83Å; F669-P676 HydrophobicContact CE2-CB 3.54Å; F669-P676 HydrophobicContact CE2-CG 3.64Å; F669-P676 HydrophobicContact CG-CB 4.31Å; F669-P676 HydrophobicContact CG-CG 4.49Å; F669-P676 HydrophobicContact CZ-CG 4.18Å; F669-D680 HydrophobicContact CD2-CB 4.21Å; F669-A681 HydrophobicContact CE2-CB 3.98Å; F669-A681 HydrophobicContact CZ-CB 4.47Å; F669-V684 HydrophobicContact CB-CG2 3.84Å; F669-V684 HydrophobicContact CD1-CG2 4.22Å; F669-V684 HydrophobicContact CD2-CG2 3.9Å; F669-V684 HydrophobicContact CG-CG2 3.75Å; F669-L712 HydrophobicContact CD1-CD1 4.14Å; F669-L712 HydrophobicContact CE1-CD1 3.92Å; F669-M722 HydrophobicContact CE1-CE 3.99Å; F669-M722 HydrophobicContact CE1-SD 3.9Å; F669-M722 HydrophobicContact CZ-SD 4.15Å; F669-I726 HydrophobicContact CZ-CD1 4.29Å
670	L	88.4	Confident	88	Confident	48 Å²	48	94.3 Å²	94.3	25%	0.251	48%	0.481	S	S	.	.	T	Hydrogen-bonded Turn	trans	-107.3	13.1	176.7	-61.6	-175.7	0	0	0	113.4	L666 D668 E672 S711 T715	L666-L670 HydrophobicContact CD1-CD1 3.68Å; L666-L670 HydrophobicContact CD1-CG 3.83Å; L666-L670 HydrophobicContact CD2-CD1 4.46Å; L666-L670 HydrophobicContact CG-CD1 3.84Å; L666-L670 HydrophobicContact CG-CG 4.23Å; L666-L670 WeakPolarHBondContact O-CB 3.37Å; L666-L670 WeakPolarHBondContact O-CG 3.49Å; L666-L670 PolarHBondContact O-N 3.39Å; D668-L670 VanDerWaalsContact C-N 3.26Å; D668-L670 PolarHBondContact O-N 3.42Å; L670-E672 PolarHBondContact O-N 2.96Å; L670-S711 WeakPolarHBondContact CD1-OG 3.22Å; L670-T715 HydrophobicContact CD2-CG2 4.18Å
671	Q	85.8	Confident	87.8	Confident	108 Å²	108	90 Å²	90	51%	0.505	46%	0.46	S	S	.	.			trans	-70.1	123.2	-177.7	-176.9	159.6	-102.8	0	0	112.6	D668 G673 E674	D668-Q671 WeakPolarHBondContact O-CB 3.45Å; D668-Q671 PolarHBondContact O-N 3.48Å; D668-Q671 VanDerWaalsContact O-N 3.15Å; Q671-G673 PolarHBondContact O-N 3.39Å; Q671-E674 PolarHBondContact NE2-OE2 3.33Å
672	E	75.2	Confident	87.8	Confident	199 Å²	199	92.3 Å²	92.3	93%	0.93	47%	0.468	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.9	102.6	178.5	-71.9	-172.4	174.6	0	0	112.3	L670	L670-E672 PolarHBondContact O-N 2.96Å
673	G	68.1	Low	87.7	Confident	83 Å²	83	95.8 Å²	95.8	86%	0.856	48%	0.484	S	S	*	.	T	Hydrogen-bonded Turn	trans	128.4	-5.2	168.5	0	0	0	0	0	115.9	Q671	Q671-G673 PolarHBondContact O-N 3.39Å
674	E	74.7	Confident	87.8	Confident	138 Å²	138	93.5 Å²	93.5	65%	0.645	47%	0.471	S	S	*	.			trans	-115.4	131	171.2	-70.3	170.9	149.7	0	0	108.1	Q671	Q671-E674 PolarHBondContact NE2-OE2 3.33Å
675	E	77.6	Confident	87.9	Confident	193 Å²	193	87.9 Å²	87.9	90%	0.902	45%	0.452	S	S	*	.			trans	-86.6	116.8	175.7	-70.2	176	170.9	0	0	107.4
676	P	84.6	Confident	88.1	Confident	59 Å²	59	86.6 Å²	86.6	38%	0.383	45%	0.447	S	S	.	.			trans	-69.9	144.5	-178.3	28.9	-34.7	0	0	0	110.9	F669 D680	F669-P676 HydrophobicContact CD2-CB 3.41Å; F669-P676 VanDerWaalsContact CD2-CB 3.41Å; F669-P676 HydrophobicContact CD2-CG 3.83Å; F669-P676 HydrophobicContact CE2-CB 3.54Å; F669-P676 HydrophobicContact CE2-CG 3.64Å; F669-P676 HydrophobicContact CG-CB 4.31Å; F669-P676 HydrophobicContact CG-CG 4.49Å; F669-P676 HydrophobicContact CZ-CG 4.18Å; P676-D680 HydrophobicContact CB-CB 4.16Å
677	D	87.5	Confident	88.3	Confident	91 Å²	91	86.1 Å²	86.1	49%	0.487	44%	0.444	S	S	.	.			trans	-93.1	-177.6	-178.7	76.5	22.2	0	0	0	113.7	D679 D680 A681	D677-D679 VanDerWaalsContact C-N 3.31Å; D677-D679 PolarHBondContact O-N 3.26Å; D677-D679 WeakPolarHBondContact OD1-CA 3.33Å; D677-D679 WeakPolarHBondContact OD1-CB 3.33Å; D677-D679 PolarHBondContact OD1-N 3.17Å; D677-D680 PolarHBondContact O-N 2.72Å; D677-D680 PolarHBondContact OD1-N 3.31Å; D677-A681 WeakPolarHBondContact O-CB 3.45Å; D677-A681 PolarHBondContact O-N 2.94Å
678	E	89.3	Confident	88.7	Confident	176 Å²	176	79.1 Å²	79.1	82%	0.822	41%	0.411	S	S	*	.	H	α-helix	trans	-67.1	-28.9	-179.4	-65.5	-174.9	168.3	0	0	112.8	Y682	E678-Y682 VanDerWaalsContact O-CB 3.29Å; E678-Y682 WeakPolarHBondContact O-CB 3.31Å; E678-Y682 PolarHBondContact O-N 3.45Å
679	D	91.4	Very high	89.1	Confident	120 Å²	120	75 Å²	75	64%	0.642	39%	0.388	S	S	*	.	H	α-helix	trans	-75.2	-42	176.7	-84.5	-26.5	0	0	0	110.4	D677 Y682 Q683	D677-D679 VanDerWaalsContact C-N 3.31Å; D677-D679 PolarHBondContact O-N 3.26Å; D677-D679 WeakPolarHBondContact OD1-CA 3.33Å; D677-D679 WeakPolarHBondContact OD1-CB 3.33Å; D677-D679 PolarHBondContact OD1-N 3.17Å; D679-Y682 PolarHBondContact O-N 3.15Å; D679-Q683 WeakPolarHBondContact O-CG 3.19Å; D679-Q683 PolarHBondContact O-N 2.74Å
680	D	92.3	Very high	89.4	Confident	75 Å²	75	74.3 Å²	74.3	40%	0.401	39%	0.385	S	S	.	.	H	α-helix	trans	-60.2	-48.7	173.1	-73.3	-34.9	0	0	0	111.2	F669 P676 D677 Y682 Q683 V684	F669-D680 HydrophobicContact CD2-CB 4.21Å; P676-D680 HydrophobicContact CB-CB 4.16Å; D677-D680 PolarHBondContact O-N 2.72Å; D677-D680 PolarHBondContact OD1-N 3.31Å; D680-Y682 VanDerWaalsContact C-N 3.27Å; D680-Y682 PolarHBondContact O-N 3.29Å; D680-Q683 PolarHBondContact O-N 3.34Å; D680-Q683 VanDerWaalsContact O-N 3.14Å; D680-V684 PolarHBondContact O-N 3.07Å
681	A	93.1	Very high	89.9	Confident	14 Å²	14	72 Å²	72	12%	0.116	37%	0.373	C	S	.	.	H	α-helix	trans	-58.3	-39.7	175	0	0	0	0	0	111.8	F669 D677 L685 P723 I726	F669-A681 HydrophobicContact CE2-CB 3.98Å; F669-A681 HydrophobicContact CZ-CB 4.47Å; D677-A681 WeakPolarHBondContact O-CB 3.45Å; D677-A681 PolarHBondContact O-N 2.94Å; A681-L685 VanDerWaalsContact O-CB 3.27Å; A681-L685 WeakPolarHBondContact O-CB 3.36Å; A681-L685 PolarHBondContact O-N 3.49Å; A681-P723 HydrophobicContact CB-CG 4.34Å; A681-I726 HydrophobicContact CB-CD1 4.21Å
682	Y	94.6	Very high	90.4	Very high	110 Å²	110	67 Å²	67	43%	0.431	35%	0.35	S	S	.	.	H	α-helix	trans	-67.2	-37.7	175.2	-177.1	-100	0	0	0	112.8	T621 E678 D679 D680 L685 S686	T621-Y682 WeakPolarHBondContact CG2-OH 3.49Å; T621-Y682 PolarHBondContact OG1-OH 3.31Å; T621-Y682 VanDerWaalsContact OG1-OH 3.13Å; E678-Y682 VanDerWaalsContact O-CB 3.29Å; E678-Y682 WeakPolarHBondContact O-CB 3.31Å; E678-Y682 PolarHBondContact O-N 3.45Å; D679-Y682 PolarHBondContact O-N 3.15Å; D680-Y682 VanDerWaalsContact C-N 3.27Å; D680-Y682 PolarHBondContact O-N 3.29Å; Y682-L685 PolarHBondContact O-N 3.16Å; Y682-S686 WeakPolarHBondContact O-CB 3.26Å; Y682-S686 PolarHBondContact O-N 2.85Å
683	Q	95.5	Very high	91.4	Very high	72 Å²	72	58.5 Å²	58.5	34%	0.336	31%	0.313	S	S	.	.	H	α-helix	trans	-66.5	-42.2	175.6	-69.7	-55.1	-41.2	0	0	112.5	L665 D679 D680 T687	L665-Q683 HydrophobicContact CD1-CB 3.92Å; L665-Q683 WeakPolarHBondContact CD1-O 3.41Å; L665-Q683 HydrophobicContact CD2-CB 3.92Å; D679-Q683 WeakPolarHBondContact O-CG 3.19Å; D679-Q683 PolarHBondContact O-N 2.74Å; D680-Q683 PolarHBondContact O-N 3.34Å; D680-Q683 VanDerWaalsContact O-N 3.14Å; Q683-T687 PolarHBondContact O-N 3.03Å; Q683-T687 VanDerWaalsContact O-N 3.11Å; Q683-T687 PolarHBondContact O-OG1 3.43Å
684	V	95.9	Very high	92.8	Very high	1 Å²	1	54.6 Å²	54.6	1%	0.006	27%	0.273	C	S	.	.	H	α-helix	trans	-61.3	-51.5	173.8	172.3	0	0	0	0	109.9	F662 L665 F669 D680 S686 T687 L688 L712 I726	F662-V684 HydrophobicContact CE2-CG1 4.35Å; L665-V684 HydrophobicContact CB-CG2 4.04Å; F669-V684 HydrophobicContact CB-CG2 3.84Å; F669-V684 HydrophobicContact CD1-CG2 4.22Å; F669-V684 HydrophobicContact CD2-CG2 3.9Å; F669-V684 HydrophobicContact CG-CG2 3.75Å; D680-V684 PolarHBondContact O-N 3.07Å; V684-S686 PolarHBondContact O-N 3.07Å; V684-T687 PolarHBondContact O-N 3.19Å; V684-L688 WeakPolarHBondContact O-CB 3.5Å; V684-L688 PolarHBondContact O-N 2.67Å; V684-L712 HydrophobicContact CG1-CD1 4.49Å; V684-I726 HydrophobicContact CG1-CD1 4.5Å
685	L	96.3	Very high	93.8	Very high	30 Å²	30	48.1 Å²	48.1	16%	0.157	24%	0.242	C	C	.	.	H	α-helix	trans	-58.9	-49.8	178.5	179.3	58.1	0	0	0	112.2	A681 Y682 T687 L688 K689 Q725 I726	A681-L685 VanDerWaalsContact O-CB 3.27Å; A681-L685 WeakPolarHBondContact O-CB 3.36Å; A681-L685 PolarHBondContact O-N 3.49Å; Y682-L685 PolarHBondContact O-N 3.16Å; L685-T687 VanDerWaalsContact C-N 3.3Å; L685-T687 PolarHBondContact O-N 3.48Å; L685-L688 PolarHBondContact O-N 3.03Å; L685-K689 HydrophobicContact CD1-CD 4.32Å; L685-K689 HydrophobicContact CD1-CG 3.94Å; L685-K689 HydrophobicContact CG-CD 4.47Å; L685-K689 HydrophobicContact CG-CG 4.37Å; L685-K689 WeakPolarHBondContact O-CG 3.41Å; L685-K689 PolarHBondContact O-N 2.8Å; L685-Q725 HydrophobicContact CD1-CB 3.81Å; L685-Q725 HydrophobicContact CD2-CB 3.7Å; L685-Q725 HydrophobicContact CG-CB 4.43Å; L685-I726 HydrophobicContact CB-CD1 4.34Å; L685-I726 HydrophobicContact CB-CG1 3.84Å; L685-I726 HydrophobicContact CD1-CG1 4.02Å; L685-I726 HydrophobicContact CG-CG1 4.37Å
686	S	96.8	Very high	94.6	Very high	9 Å²	9	40 Å²	40	6%	0.063	21%	0.205	C	C	.	.	H	α-helix	trans	-53.6	-46	178.7	170.3	0	0	0	0	111.9	T621 Y682 V684 K690	T621-S686 WeakPolarHBondContact CG2-OG 3.27Å; Y682-S686 WeakPolarHBondContact O-CB 3.26Å; Y682-S686 PolarHBondContact O-N 2.85Å; V684-S686 PolarHBondContact O-N 3.07Å; S686-K690 WeakPolarHBondContact O-CD 3.41Å; S686-K690 WeakPolarHBondContact O-CE 3.47Å; S686-K690 VanDerWaalsContact O-CG 3.28Å; S686-K690 WeakPolarHBondContact O-CG 3.33Å; S686-K690 PolarHBondContact O-N 3.06Å
687	T	97.6	Very high	95.1	Very high	0 Å²	0	37.3 Å²	37.3	0%	0	19%	0.188	C	C	.	.	H	α-helix	trans	-76.2	-36.9	-179	-44.1	0	0	0	0	111.4	L658 K661 F662 L665 Q683 V684 L685 K690 I691	L658-T687 HydrophobicContact CD2-CG2 4.42Å; L658-T687 WeakPolarHBondContact O-CG2 3.44Å; K661-T687 HydrophobicContact CB-CG2 4.11Å; K661-T687 HydrophobicContact CD-CG2 3.96Å; K661-T687 WeakPolarHBondContact CE-OG1 3.32Å; K661-T687 HydrophobicContact CG-CG2 4.1Å; K661-T687 PolarHBondContact NZ-OG1 2.94Å; F662-T687 HydrophobicContact CB-CG2 3.87Å; L665-T687 WeakPolarHBondContact CD1-OG1 3.38Å; Q683-T687 PolarHBondContact O-N 3.03Å; Q683-T687 VanDerWaalsContact O-N 3.11Å; Q683-T687 PolarHBondContact O-OG1 3.43Å; V684-T687 PolarHBondContact O-N 3.19Å; L685-T687 VanDerWaalsContact C-N 3.3Å; L685-T687 PolarHBondContact O-N 3.48Å; T687-K690 PolarHBondContact O-N 3.16Å; T687-I691 WeakPolarHBondContact O-CG1 3.35Å; T687-I691 PolarHBondContact O-N 3.16Å; T687-I691 VanDerWaalsContact O-N 3.12Å
688	L	97.4	Very high	95.4	Very high	0 Å²	0	33.2 Å²	33.2	0%	0	17%	0.166	C	C	.	.	H	α-helix	trans	-62.5	-46.4	174.8	178.1	59.2	0	0	0	111.9	F662 V684 L685 K690 I691 T692 N709 L712 I726 H729 A730 C733	F662-L688 HydrophobicContact CD2-CB 4.48Å; F662-L688 HydrophobicContact CE2-CB 3.99Å; F662-L688 HydrophobicContact CE2-CD1 4.13Å; F662-L688 HydrophobicContact CZ-CD1 4.02Å; V684-L688 WeakPolarHBondContact O-CB 3.5Å; V684-L688 PolarHBondContact O-N 2.67Å; L685-L688 PolarHBondContact O-N 3.03Å; L688-K690 VanDerWaalsContact C-N 3.29Å; L688-K690 PolarHBondContact O-N 3.29Å; L688-I691 PolarHBondContact O-N 3.46Å; L688-T692 WeakPolarHBondContact O-CB 3.49Å; L688-T692 PolarHBondContact O-N 3.43Å; L688-T692 PolarHBondContact O-OG1 2.89Å; L688-N709 WeakPolarHBondContact CD1-OD1 3.04Å; L688-L712 HydrophobicContact CD2-CD2 4.06Å; L688-I726 HydrophobicContact CD2-CG2 4.16Å; L688-H729 HydrophobicContact CD2-CB 4.03Å; L688-H729 HydrophobicContact CG-CB 3.95Å; L688-A730 HydrophobicContact CD2-CB 4.07Å; L688-C733 HydrophobicContact CD1-CB 4.41Å
689	K	97.4	Very high	95.6	Very high	27 Å²	27	27.6 Å²	27.6	12%	0.117	14%	0.142	C	C	.	.	H	α-helix	trans	-55.3	-44.1	176.4	-72.8	-164.8	72.4	-174.8	0	111.9	T621 T623 L626 L685 T692 A693 H729	T621-K689 WeakPolarHBondContact O-CD 3.47Å; T621-K689 WeakPolarHBondContact O-CE 3.48Å; T621-K689 PolarHBondContact O-NZ 2.87Å; T623-K689 WeakPolarHBondContact OG1-CE 3.49Å; T623-K689 PolarHBondContact OG1-NZ 2.91Å; L626-K689 HydrophobicContact CD1-CB 4.04Å; L685-K689 HydrophobicContact CD1-CD 4.32Å; L685-K689 HydrophobicContact CD1-CG 3.94Å; L685-K689 HydrophobicContact CG-CD 4.47Å; L685-K689 HydrophobicContact CG-CG 4.37Å; L685-K689 WeakPolarHBondContact O-CG 3.41Å; L685-K689 PolarHBondContact O-N 2.8Å; K689-T692 PolarHBondContact O-N 2.86Å; K689-A693 WeakPolarHBondContact O-CB 3.46Å; K689-A693 PolarHBondContact O-N 3.17Å; K689-H729 WeakPolarHBondContact CE-NE2 3.43Å
690	K	97.9	Very high	95.7	Very high	8 Å²	8	21.9 Å²	21.9	4%	0.035	11%	0.111	C	C	.	.	H	α-helix	trans	-61.7	-46.8	178.2	-64.4	169.3	-163.5	-143	0	111.3	V617 D618 H620 L626 L658 S686 T687 L688 F694	V617-K690 HydrophobicContact CG1-CD 4.41Å; V617-K690 HydrophobicContact CG1-CG 4.4Å; V617-K690 WeakPolarHBondContact O-CD 3.48Å; V617-K690 VanDerWaalsContact O-CE 3.3Å; V617-K690 WeakPolarHBondContact O-CE 3.34Å; V617-K690 PolarHBondContact O-NZ 3.13Å; D618-K690 PolarHBondContact O-NZ 3.16Å; H620-K690 WeakPolarHBondContact O-CE 3.41Å; H620-K690 PolarHBondContact O-NZ 3.03Å; L626-K690 HydrophobicContact CD1-CB 4.49Å; L626-K690 HydrophobicContact CD1-CG 3.71Å; L626-K690 HydrophobicContact CD2-CG 3.81Å; L626-K690 HydrophobicContact CG-CG 4.45Å; L658-K690 HydrophobicContact CD1-CB 4.12Å; L658-K690 HydrophobicContact CD2-CB 3.92Å; L658-K690 HydrophobicContact CD2-CD 3.85Å; L658-K690 HydrophobicContact CD2-CG 4.48Å; S686-K690 WeakPolarHBondContact O-CD 3.41Å; S686-K690 WeakPolarHBondContact O-CE 3.47Å; S686-K690 VanDerWaalsContact O-CG 3.28Å; S686-K690 WeakPolarHBondContact O-CG 3.33Å; S686-K690 PolarHBondContact O-N 3.06Å; T687-K690 PolarHBondContact O-N 3.16Å; L688-K690 VanDerWaalsContact C-N 3.29Å; L688-K690 PolarHBondContact O-N 3.29Å; K690-F694 WeakPolarHBondContact O-CD2 3.47Å; K690-F694 PolarHBondContact O-N 3.05Å
691	I	97.8	Very high	95.7	Very high	0 Å²	0	19.2 Å²	19.2	0%	0	10%	0.098	C	C	.	.	H	α-helix	trans	-64.3	-45	175.5	-67.9	172.9	0	0	0	111.1	L658 V659 F662 T687 L688 A693 F694 H695 L700 L705	L658-I691 HydrophobicContact CB-CG1 4.12Å; V659-I691 HydrophobicContact CG2-CD1 4.22Å; F662-I691 HydrophobicContact CB-CD1 3.42Å; F662-I691 VanDerWaalsContact CB-CD1 3.42Å; F662-I691 HydrophobicContact CD1-CD1 3.9Å; F662-I691 HydrophobicContact CD2-CD1 4.46Å; F662-I691 HydrophobicContact CG-CD1 3.7Å; T687-I691 WeakPolarHBondContact O-CG1 3.35Å; T687-I691 PolarHBondContact O-N 3.16Å; T687-I691 VanDerWaalsContact O-N 3.12Å; L688-I691 PolarHBondContact O-N 3.46Å; I691-A693 PolarHBondContact O-N 3.5Å; I691-F694 PolarHBondContact O-N 2.71Å; I691-H695 WeakPolarHBondContact O-CB 3.35Å; I691-H695 PolarHBondContact O-N 2.97Å; I691-L700 HydrophobicContact CG2-CD2 4.26Å; I691-L705 HydrophobicContact CD1-CD2 4.47Å; I691-L705 HydrophobicContact CG2-CD1 3.67Å; I691-L705 HydrophobicContact CG2-CD2 4.36Å
692	T	97	Very high	95.5	Very high	3 Å²	3	24.9 Å²	24.9	2%	0.018	12%	0.12	C	C	.	.	H	α-helix	trans	-61.7	-45	-178	-61.6	0	0	0	0	112	L688 K689 H695 N696 H729 Q732 C733 Y736	L688-T692 WeakPolarHBondContact O-CB 3.49Å; L688-T692 PolarHBondContact O-N 3.43Å; L688-T692 PolarHBondContact O-OG1 2.89Å; K689-T692 PolarHBondContact O-N 2.86Å; T692-H695 PolarHBondContact O-N 3.02Å; T692-N696 PolarHBondContact O-N 3.14Å; T692-H729 HydrophobicContact CG2-CB 4.41Å; T692-H729 PolarHBondContact OG1-O 2.97Å; T692-H729 VanDerWaalsContact OG1-O 3.06Å; T692-Q732 HydrophobicContact CG2-CB 3.59Å; T692-C733 HydrophobicContact CG2-CB 4.39Å; T692-C733 WeakPolarHBondContact OG1-CB 3.44Å; T692-Y736 HydrophobicContact CG2-CD2 4.39Å; T692-Y736 HydrophobicContact CG2-CE2 3.83Å; T692-Y736 WeakPolarHBondContact O-CE2 3.43Å
693	A	96.4	Very high	95.4	Very high	20 Å²	20	21.5 Å²	21.5	17%	0.165	11%	0.107	C	C	.	.	H	α-helix	trans	-60.8	-47.1	175.2	0	0	0	0	0	111.5	L626 S630 K689 I691 H695 N696	L626-A693 HydrophobicContact CB-CB 3.84Å; S630-A693 PolarHBondContact OG-O 3.11Å; K689-A693 WeakPolarHBondContact O-CB 3.46Å; K689-A693 PolarHBondContact O-N 3.17Å; I691-A693 PolarHBondContact O-N 3.5Å; A693-H695 PolarHBondContact O-N 3.26Å; A693-N696 WeakPolarHBondContact O-CB 3.43Å; A693-N696 PolarHBondContact O-N 3.29Å
694	F	97.1	Very high	95	Very high	0 Å²	0	22.7 Å²	22.7	0%	0	12%	0.116	C	C	.	.	H	α-helix	trans	-68.6	-31.3	179	-86	-107.1	0	0	0	114.1	V617 C629 S630 Y633 L654 L655 K690 I691 N696 H698	V617-F694 HydrophobicContact CG1-CE2 4.29Å; V617-F694 HydrophobicContact CG2-CE2 3.83Å; V617-F694 HydrophobicContact CG2-CZ 3.93Å; C629-F694 HydrophobicContact CB-CE2 4.19Å; C629-F694 HydrophobicContact CB-CZ 4.28Å; S630-F694 WeakPolarHBondContact OG-CA 3.33Å; Y633-F694 AromaticContact CD2-CE1 3.63Å; Y633-F694 HydrophobicContact CD2-CE1 3.63Å; Y633-F694 AromaticContact CD2-CZ 3.73Å; Y633-F694 HydrophobicContact CD2-CZ 3.73Å; Y633-F694 HydrophobicContact CE2-CE1 4.19Å; Y633-F694 HydrophobicContact CE2-CZ 4.17Å; Y633-F694 HydrophobicContact CG-CE1 4.08Å; L654-F694 HydrophobicContact CD2-CE1 3.84Å; L654-F694 HydrophobicContact CD2-CZ 3.74Å; L655-F694 HydrophobicContact CD2-CB 3.84Å; L655-F694 HydrophobicContact CD2-CD1 3.99Å; L655-F694 HydrophobicContact CD2-CG 4.15Å; K690-F694 WeakPolarHBondContact O-CD2 3.47Å; K690-F694 PolarHBondContact O-N 3.05Å; I691-F694 PolarHBondContact O-N 2.71Å; F694-N696 PolarHBondContact O-N 3.3Å; F694-H698 AromaticContact CD1-CD2 3.56Å; F694-H698 WeakPolarHBondContact O-CB 3.47Å; F694-H698 PolarHBondContact O-CD2 3.03Å; F694-H698 PolarHBondContact O-N 3.15Å
695	H	96.4	Very high	94.9	Very high	2 Å²	2	22.7 Å²	22.7	1%	0.009	12%	0.116	C	C	.	.	H	α-helix	trans	-72.8	-16.4	176.4	-148.5	151.8	0	0	0	112.7	I691 T692 A693 L700 Y736 I737 W740	I691-H695 WeakPolarHBondContact O-CB 3.35Å; I691-H695 PolarHBondContact O-N 2.97Å; T692-H695 PolarHBondContact O-N 3.02Å; A693-H695 PolarHBondContact O-N 3.26Å; H695-L700 HydrophobicContact CB-CD2 3.96Å; H695-Y736 HydrophobicContact CB-CD2 4.15Å; H695-I737 WeakPolarHBondContact CE1-CG1 3.4Å; H695-W740 AromaticContact CD2-CD1 3.44Å; H695-W740 VanDerWaalsContact CD2-CD1 3.44Å; H695-W740 AromaticContact CD2-NE1 3.95Å; H695-W740 AromaticContact NE2-CD1 3.79Å; H695-W740 PolarHBondContact O-NE1 3.37Å
696	N	94.9	Very high	94.9	Very high	23 Å²	23	22.2 Å²	22.2	12%	0.123	11%	0.112	C	C	.	.	H	α-helix	trans	-64.7	-60.3	172.9	-168.2	-14.9	0	0	0	110.3	T692 A693 F694 Y736 N1271 V1272 S1273	T692-N696 PolarHBondContact O-N 3.14Å; A693-N696 WeakPolarHBondContact O-CB 3.43Å; A693-N696 PolarHBondContact O-N 3.29Å; F694-N696 PolarHBondContact O-N 3.3Å; N696-Y736 HydrophobicContact CB-CD2 4.27Å; N696-Y736 HydrophobicContact CB-CE1 4.34Å; N696-Y736 HydrophobicContact CB-CE2 3.87Å; N696-N1271 PolarHBondContact ND2-O 2.8Å; N696-N1271 PolarHBondContact OD1-O 3.13Å; N696-V1272 VanDerWaalsContact OD1-CA 3.31Å; N696-V1272 WeakPolarHBondContact OD1-CA 3.25Å; N696-S1273 PolarHBondContact OD1-N 3.44Å; N696-S1273 VanDerWaalsContact OD1-N 3.15Å
697	A	94.1	Very high	94.7	Very high	3 Å²	3	25.8 Å²	25.8	3%	0.025	13%	0.134	C	C	.	.	H	α-helix	trans	-92.2	5.9	-172.7	0	0	0	0	0	115.3	H634	H634-A697 HydrophobicContact CB-CB 3.96Å; H634-A697 PolarHBondContact ND1-O 3.19Å
698	H	94	Very high	94.5	Very high	5 Å²	5	26.6 Å²	26.6	2%	0.023	14%	0.139	C	C	.	.	S	Bend	trans	-142.7	144	-178.6	-49.9	-46.6	0	0	0	114.1	S630 Y633 H634 R651 F694 L700 W740	S630-H698 PolarHBondContact O-NE2 2.67Å; Y633-H698 WeakPolarHBondContact CB-NE2 3.49Å; Y633-H698 PolarHBondContact O-NE2 3.34Å; H634-H698 WeakPolarHBondContact CA-NE2 3.42Å; H634-H698 WeakPolarHBondContact CB-NE2 3.4Å; H634-H698 PolarHBondContact N-NE2 3.14Å; H634-H698 AromaticContact ND1-CE1 3.71Å; R651-H698 PolarHBondContact NH1-CE1 3.31Å; R651-H698 PolarHBondContact NH1-ND1 3.5Å; F694-H698 AromaticContact CD1-CD2 3.56Å; F694-H698 WeakPolarHBondContact O-CB 3.47Å; F694-H698 PolarHBondContact O-CD2 3.03Å; F694-H698 PolarHBondContact O-N 3.15Å; H698-L700 HydrophobicContact CB-CD1 3.7Å; H698-L700 WeakPolarHBondContact O-CD1 3.4Å; H698-L700 PolarHBondContact O-N 2.87Å; H698-L700 VanDerWaalsContact O-N 3.13Å; H698-W740 VanDerWaalsContact C-CE2 3.49Å; H698-W740 PolarHBondContact O-NE1 2.99Å
699	D	92.9	Very high	94.4	Very high	57 Å²	57	26.6 Å²	26.6	31%	0.305	14%	0.139	S	C	.	.			trans	-68.7	104.6	168.8	-179.5	25.8	0	0	0	111.8	S701 W740	D699-S701 WeakPolarHBondContact OD1-CA 3.46Å; D699-S701 WeakPolarHBondContact OD1-CB 3.26Å; D699-S701 PolarHBondContact OD1-N 2.88Å; D699-S701 PolarHBondContact OD1-OG 2.91Å; D699-W740 HydrophobicContact CB-CD2 4.04Å; D699-W740 HydrophobicContact CB-CE3 3.68Å; D699-W740 HydrophobicContact CB-CZ3 4.06Å
700	L	95.2	Very high	94.3	Very high	0 Å²	0	29.7 Å²	29.7	0%	0	15%	0.151	C	C	.	.			trans	-97.5	14.6	171.1	-84.9	57.8	0	0	0	112.6	L655 I691 H695 H698 K702 W703 L705	L655-L700 HydrophobicContact CD1-CD1 3.68Å; L655-L700 HydrophobicContact CD1-CG 4.1Å; L655-L700 HydrophobicContact CD2-CD1 4.21Å; L655-L700 HydrophobicContact CD2-CD2 3.96Å; L655-L700 HydrophobicContact CD2-CG 4.25Å; I691-L700 HydrophobicContact CG2-CD2 4.26Å; H695-L700 HydrophobicContact CB-CD2 3.96Å; H698-L700 HydrophobicContact CB-CD1 3.7Å; H698-L700 WeakPolarHBondContact O-CD1 3.4Å; H698-L700 PolarHBondContact O-N 2.87Å; H698-L700 VanDerWaalsContact O-N 3.13Å; L700-K702 PolarHBondContact O-N 2.92Å; L700-W703 HydrophobicContact CB-CE3 3.86Å; L700-W703 HydrophobicContact CB-CZ3 4.21Å; L700-W703 HydrophobicContact CD1-CZ3 4.41Å; L700-W703 HydrophobicContact CG-CE3 3.84Å; L700-W703 HydrophobicContact CG-CZ3 3.85Å; L700-W703 PolarHBondContact O-N 3.43Å; L700-L705 HydrophobicContact CB-CD1 4.25Å; L700-L705 HydrophobicContact CD2-CD1 3.99Å
701	S	90.6	Very high	94	Very high	19 Å²	19	31.6 Å²	31.6	13%	0.133	17%	0.166	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.8	10.9	177	-47	0	0	0	0	115.1	D699 H741	D699-S701 WeakPolarHBondContact OD1-CA 3.46Å; D699-S701 WeakPolarHBondContact OD1-CB 3.26Å; D699-S701 PolarHBondContact OD1-N 2.88Å; D699-S701 PolarHBondContact OD1-OG 2.91Å; S701-H741 PolarHBondContact OG-CD2 3Å
702	K	89.6	Confident	93.8	Very high	133 Å²	133	31.7 Å²	31.7	58%	0.578	17%	0.166	S	C	*	.	T	Hydrogen-bonded Turn	trans	-83.5	-25.7	167	-62	171.3	-175.3	167	0	111.6	L700	L700-K702 PolarHBondContact O-N 2.92Å
703	W	92.3	Very high	93.8	Very high	39 Å²	39	31.7 Å²	31.7	15%	0.148	17%	0.166	C	C	.	.	S	Bend	trans	-112	132.2	-176.6	-58	-89	0	0	0	109.7	L655 D656 V659 L700 L705	L655-W703 HydrophobicContact CB-CH2 3.64Å; L655-W703 HydrophobicContact CB-CZ2 3.77Å; L655-W703 HydrophobicContact CB-CZ3 4.2Å; L655-W703 HydrophobicContact CD1-CH2 3.74Å; L655-W703 HydrophobicContact CD1-CZ3 3.88Å; L655-W703 HydrophobicContact CG-CH2 4.36Å; D656-W703 WeakPolarHBondContact OD1-CZ2 3.47Å; D656-W703 PolarHBondContact OD1-NE1 3.24Å; V659-W703 HydrophobicContact CB-CG 4.42Å; V659-W703 HydrophobicContact CG1-CB 4.1Å; V659-W703 HydrophobicContact CG1-CG 4.16Å; V659-W703 HydrophobicContact CG2-CB 4.33Å; V659-W703 HydrophobicContact CG2-CD2 4.47Å; V659-W703 HydrophobicContact CG2-CG 4.08Å; L700-W703 HydrophobicContact CB-CE3 3.86Å; L700-W703 HydrophobicContact CB-CZ3 4.21Å; L700-W703 HydrophobicContact CD1-CZ3 4.41Å; L700-W703 HydrophobicContact CG-CE3 3.84Å; L700-W703 HydrophobicContact CG-CZ3 3.85Å; L700-W703 PolarHBondContact O-N 3.43Å; W703-L705 VanDerWaalsContact C-N 3.27Å; W703-L705 HydrophobicContact CB-CG 4.33Å; W703-L705 PolarHBondContact O-N 3.48Å
704	D	87.3	Confident	93.7	Very high	98 Å²	98	31.8 Å²	31.8	52%	0.524	17%	0.165	S	C	.	.			trans	-78.4	75	179.2	-178.1	24	0	0	0	112.2	F706 T707	D704-F706 VanDerWaalsContact C-N 3.29Å; D704-F706 PolarHBondContact OD1-N 3.15Å; D704-T707 PolarHBondContact OD1-N 3.34Å; D704-T707 WeakPolarHBondContact OD2-CB 3.42Å; D704-T707 PolarHBondContact OD2-OG1 3.01Å
705	L	94.9	Very high	93.4	Very high	1 Å²	1	33.3 Å²	33.3	1%	0.005	18%	0.175	C	C	.	.	H	α-helix	trans	-78.9	-10.7	175.5	-67.4	170.6	0	0	0	112.9	V659 F662 I691 L700 W703 N709 I737	V659-L705 HydrophobicContact CG1-CD2 4.16Å; V659-L705 HydrophobicContact CG2-CD1 4.45Å; V659-L705 HydrophobicContact CG2-CD2 4.17Å; F662-L705 HydrophobicContact CD1-CD2 4.11Å; F662-L705 HydrophobicContact CE1-CD2 4.37Å; I691-L705 HydrophobicContact CD1-CD2 4.47Å; I691-L705 HydrophobicContact CG2-CD1 3.67Å; I691-L705 HydrophobicContact CG2-CD2 4.36Å; L700-L705 HydrophobicContact CB-CD1 4.25Å; L700-L705 HydrophobicContact CD2-CD1 3.99Å; W703-L705 VanDerWaalsContact C-N 3.27Å; W703-L705 HydrophobicContact CB-CG 4.33Å; W703-L705 PolarHBondContact O-N 3.48Å; L705-N709 PolarHBondContact O-N 2.99Å; L705-N709 VanDerWaalsContact O-N 3.14Å; L705-N709 PolarHBondContact O-ND2 3.28Å; L705-I737 HydrophobicContact CB-CD1 3.74Å; L705-I737 HydrophobicContact CB-CG1 4.27Å
706	F	94.9	Very high	93.2	Very high	19 Å²	19	33.5 Å²	33.5	8%	0.083	18%	0.177	C	C	.	.	H	α-helix	trans	-67.5	-49.2	179.4	-171.7	-88.6	0	0	0	111	D704 S708 N709 Y710 T734 I737 V738 Q761	D704-F706 VanDerWaalsContact C-N 3.29Å; D704-F706 PolarHBondContact OD1-N 3.15Å; F706-S708 VanDerWaalsContact C-N 3.3Å; F706-S708 PolarHBondContact O-N 3.49Å; F706-N709 PolarHBondContact O-N 2.88Å; F706-Y710 AromaticContact CE1-CD2 3.82Å; F706-Y710 HydrophobicContact CE1-CD2 3.82Å; F706-Y710 AromaticContact CE1-CG 3.87Å; F706-Y710 HydrophobicContact CE1-CG 3.87Å; F706-Y710 AromaticContact CZ-CD2 3.85Å; F706-Y710 HydrophobicContact CZ-CD2 3.85Å; F706-Y710 HydrophobicContact CZ-CG 4.32Å; F706-Y710 WeakPolarHBondContact O-CB 3.43Å; F706-Y710 PolarHBondContact O-N 3.41Å; F706-T734 HydrophobicContact CD2-CG2 4.04Å; F706-T734 HydrophobicContact CE2-CG2 3.67Å; F706-I737 HydrophobicContact CB-CG2 4.06Å; F706-I737 HydrophobicContact CD2-CG2 4.03Å; F706-V738 HydrophobicContact CE2-CG2 4.49Å; F706-Q761 HydrophobicContact CD1-CG 3.86Å; F706-Q761 HydrophobicContact CD2-CB 3.96Å; F706-Q761 HydrophobicContact CD2-CG 3.81Å; F706-Q761 HydrophobicContact CE1-CB 4.29Å; F706-Q761 HydrophobicContact CE1-CG 3.79Å; F706-Q761 HydrophobicContact CE2-CB 3.51Å; F706-Q761 HydrophobicContact CE2-CG 3.73Å; F706-Q761 HydrophobicContact CG-CG 3.89Å; F706-Q761 HydrophobicContact CZ-CB 3.7Å; F706-Q761 HydrophobicContact CZ-CG 3.72Å
707	T	92.6	Very high	93	Very high	85 Å²	85	34.9 Å²	34.9	52%	0.521	18%	0.184	S	C	.	.	H	α-helix	trans	-58.1	-45	-177.7	-59.7	0	0	0	0	111	D704 S711	D704-T707 PolarHBondContact OD1-N 3.34Å; D704-T707 WeakPolarHBondContact OD2-CB 3.42Å; D704-T707 PolarHBondContact OD2-OG1 3.01Å; T707-S711 WeakPolarHBondContact O-CB 3.38Å; T707-S711 PolarHBondContact O-N 2.83Å
708	S	93.6	Very high	92.8	Very high	16 Å²	16	41.8 Å²	41.8	11%	0.112	22%	0.216	C	C	.	.	H	α-helix	trans	-61.2	-55.1	177.9	-54.5	0	0	0	0	112.7	N663 L666 F706 Y710 S711 L712	N663-S708 PolarHBondContact OD1-OG 3.17Å; L666-S708 VanDerWaalsContact CD2-CB 3.45Å; L666-S708 WeakPolarHBondContact CD2-O 3.39Å; F706-S708 VanDerWaalsContact C-N 3.3Å; F706-S708 PolarHBondContact O-N 3.49Å; S708-Y710 PolarHBondContact O-N 3.1Å; S708-S711 PolarHBondContact O-N 3.15Å; S708-L712 PolarHBondContact O-N 3.26Å
709	N	95.8	Very high	92.4	Very high	0 Å²	0	46.5 Å²	46.5	0%	0	24%	0.241	C	C	.	.	H	α-helix	trans	-67.8	-36.8	-179.2	-73.8	-88.8	0	0	0	112.8	L688 L705 F706 S711 L712 L713 A730 T734	L688-N709 WeakPolarHBondContact CD1-OD1 3.04Å; L705-N709 PolarHBondContact O-N 2.99Å; L705-N709 VanDerWaalsContact O-N 3.14Å; L705-N709 PolarHBondContact O-ND2 3.28Å; F706-N709 PolarHBondContact O-N 2.88Å; N709-S711 VanDerWaalsContact C-N 3.32Å; N709-S711 PolarHBondContact O-N 2.9Å; N709-L712 PolarHBondContact O-N 2.9Å; N709-L713 WeakPolarHBondContact O-CB 3.35Å; N709-L713 WeakPolarHBondContact O-CG 3.47Å; N709-L713 PolarHBondContact O-N 2.98Å; N709-A730 WeakPolarHBondContact OD1-CA 3.45Å; N709-T734 VanDerWaalsContact CB-OG1 3.27Å; N709-T734 WeakPolarHBondContact CB-OG1 3.17Å
710	Y	94.6	Very high	92	Very high	92 Å²	92	47.1 Å²	47.1	36%	0.361	26%	0.261	S	S	.	.	H	α-helix	trans	-63.3	-38.7	176.3	179.8	-88.4	0	0	0	111.9	F706 S708 S714 A764 I768	F706-Y710 AromaticContact CE1-CD2 3.82Å; F706-Y710 HydrophobicContact CE1-CD2 3.82Å; F706-Y710 AromaticContact CE1-CG 3.87Å; F706-Y710 HydrophobicContact CE1-CG 3.87Å; F706-Y710 AromaticContact CZ-CD2 3.85Å; F706-Y710 HydrophobicContact CZ-CD2 3.85Å; F706-Y710 HydrophobicContact CZ-CG 4.32Å; F706-Y710 WeakPolarHBondContact O-CB 3.43Å; F706-Y710 PolarHBondContact O-N 3.41Å; S708-Y710 PolarHBondContact O-N 3.1Å; Y710-S714 WeakPolarHBondContact CE1-OG 3.17Å; Y710-S714 WeakPolarHBondContact O-CB 3.4Å; Y710-S714 PolarHBondContact O-N 3.33Å; Y710-S714 PolarHBondContact O-OG 3.07Å; Y710-A764 HydrophobicContact CE2-CB 3.83Å; Y710-I768 HydrophobicContact CD2-CD1 3.62Å; Y710-I768 HydrophobicContact CE2-CD1 3.4Å; Y710-I768 HydrophobicContact CE2-CG1 4.49Å
711	S	92.6	Very high	91.5	Very high	49 Å²	49	52.3 Å²	52.3	34%	0.343	29%	0.289	S	S	.	.	H	α-helix	trans	-61.8	-53.7	175.3	-163	0	0	0	0	110.7	L670 T707 S708 N709 L713 S714 T715	L670-S711 WeakPolarHBondContact CD1-OG 3.22Å; T707-S711 WeakPolarHBondContact O-CB 3.38Å; T707-S711 PolarHBondContact O-N 2.83Å; S708-S711 PolarHBondContact O-N 3.15Å; N709-S711 VanDerWaalsContact C-N 3.32Å; N709-S711 PolarHBondContact O-N 2.9Å; S711-L713 PolarHBondContact O-N 3.33Å; S711-S714 WeakPolarHBondContact O-CA 3.29Å; S711-S714 WeakPolarHBondContact O-CB 3.47Å; S711-S714 PolarHBondContact O-N 2.85Å; S711-T715 PolarHBondContact O-N 3.04Å; S711-T715 PolarHBondContact O-OG1 3.13Å
712	L	93.9	Very high	91.5	Very high	2 Å²	2	52.6 Å²	52.6	1%	0.01	29%	0.289	C	S	.	.	H	α-helix	trans	-53.8	-50.1	178.9	-168.4	77.5	0	0	0	112.7	L666 F669 V684 L688 S708 N709 S714 T715 G716 M722 I726 A730	L666-L712 HydrophobicContact CD1-CB 4.38Å; L666-L712 HydrophobicContact CD1-CD1 3.61Å; F669-L712 HydrophobicContact CD1-CD1 4.14Å; F669-L712 HydrophobicContact CE1-CD1 3.92Å; V684-L712 HydrophobicContact CG1-CD1 4.49Å; L688-L712 HydrophobicContact CD2-CD2 4.06Å; S708-L712 PolarHBondContact O-N 3.26Å; N709-L712 PolarHBondContact O-N 2.9Å; L712-S714 VanDerWaalsContact C-N 3.33Å; L712-S714 PolarHBondContact O-N 2.84Å; L712-T715 PolarHBondContact O-N 3.26Å; L712-G716 PolarHBondContact O-N 3.29Å; L712-M722 HydrophobicContact CD1-CE 4Å; L712-M722 HydrophobicContact CD1-SD 4.12Å; L712-M722 HydrophobicContact CG-CE 4.4Å; L712-M722 HydrophobicContact CG-SD 4.47Å; L712-I726 HydrophobicContact CD1-CG2 4.03Å; L712-I726 HydrophobicContact CD2-CG2 3.42Å; L712-I726 VanDerWaalsContact CD2-CG2 3.42Å; L712-I726 HydrophobicContact CG-CG2 3.92Å; L712-A730 HydrophobicContact CD2-CB 3.75Å
713	L	95.6	Very high	91.7	Very high	2 Å²	2	49 Å²	49	1%	0.01	28%	0.279	C	S	.	.	H	α-helix	trans	-66.3	-32.7	176.9	-69.4	170.8	0	0	0	112.7	N709 S711 L717 V727 A730 M731 F765 I768 Y772	N709-L713 WeakPolarHBondContact O-CB 3.35Å; N709-L713 WeakPolarHBondContact O-CG 3.47Å; N709-L713 PolarHBondContact O-N 2.98Å; S711-L713 PolarHBondContact O-N 3.33Å; L713-L717 WeakPolarHBondContact O-CG 3.47Å; L713-L717 PolarHBondContact O-N 3.2Å; L713-V727 HydrophobicContact CD2-CG1 4.12Å; L713-A730 HydrophobicContact CD1-CB 4.29Å; L713-A730 HydrophobicContact CD2-CB 3.88Å; L713-A730 HydrophobicContact CG-CB 3.91Å; L713-M731 HydrophobicContact CD1-CG 4.18Å; L713-M731 HydrophobicContact CD2-CG 3.73Å; L713-F765 HydrophobicContact CD1-CE2 4.38Å; L713-I768 HydrophobicContact CB-CD1 4.31Å; L713-I768 HydrophobicContact CB-CG2 3.96Å; L713-I768 HydrophobicContact CD1-CG2 4.18Å; L713-Y772 HydrophobicContact CB-CE2 4.32Å; L713-Y772 HydrophobicContact CD2-CE2 3.79Å; L713-Y772 PolarHBondContact O-OH 3.4Å; L713-Y772 VanDerWaalsContact O-OH 3.12Å
714	S	94.1	Very high	91.8	Very high	23 Å²	23	50.7 Å²	50.7	16%	0.161	29%	0.288	C	S	.	.	H	α-helix	trans	-71.9	-38.4	176.5	-63.4	0	0	0	0	112	Y710 S711 L712 Q718	Y710-S714 WeakPolarHBondContact CE1-OG 3.17Å; Y710-S714 WeakPolarHBondContact O-CB 3.4Å; Y710-S714 PolarHBondContact O-N 3.33Å; Y710-S714 PolarHBondContact O-OG 3.07Å; S711-S714 WeakPolarHBondContact O-CA 3.29Å; S711-S714 WeakPolarHBondContact O-CB 3.47Å; S711-S714 PolarHBondContact O-N 2.85Å; L712-S714 VanDerWaalsContact C-N 3.33Å; L712-S714 PolarHBondContact O-N 2.84Å; S714-Q718 WeakPolarHBondContact O-CG 3.49Å; S714-Q718 PolarHBondContact O-N 3.41Å; S714-Q718 PolarHBondContact O-NE2 2.63Å
715	T	91.8	Very high	92.1	Very high	32 Å²	32	49.3 Å²	49.3	20%	0.196	28%	0.279	C	S	.	.	H	α-helix	trans	-67.9	-43.7	175.5	-59.4	0	0	0	0	110.9	L670 S711 L712 L717 Q718 N719 M722	L670-T715 HydrophobicContact CD2-CG2 4.18Å; S711-T715 PolarHBondContact O-N 3.04Å; S711-T715 PolarHBondContact O-OG1 3.13Å; L712-T715 PolarHBondContact O-N 3.26Å; T715-L717 VanDerWaalsContact C-N 3.26Å; T715-L717 PolarHBondContact O-N 3.2Å; T715-Q718 PolarHBondContact O-N 3.49Å; T715-N719 PolarHBondContact O-N 3.06Å; T715-M722 HydrophobicContact CG2-CE 4.48Å
716	G	91.4	Very high	92.2	Very high	6 Å²	6	49.3 Å²	49.3	6%	0.062	28%	0.279	C	S	.	.	H	α-helix	trans	-59.9	-32.7	176.3	0	0	0	0	0	114.1	L712 G720	L712-G716 PolarHBondContact O-N 3.29Å; G716-G720 WeakPolarHBondContact O-CA 3.38Å; G716-G720 PolarHBondContact O-N 2.9Å; G716-G720 VanDerWaalsContact O-N 3.09Å
717	L	92.2	Very high	92.3	Very high	51 Å²	51	48.7 Å²	48.7	27%	0.267	28%	0.276	S	S	.	.	H	α-helix	trans	-77.4	-13.7	172.3	-72.9	174.9	0	0	0	114.9	L713 T715 I768 R771 Y772	L713-L717 WeakPolarHBondContact O-CG 3.47Å; L713-L717 PolarHBondContact O-N 3.2Å; T715-L717 VanDerWaalsContact C-N 3.26Å; T715-L717 PolarHBondContact O-N 3.2Å; L717-I768 HydrophobicContact CD1-CB 4.34Å; L717-I768 HydrophobicContact CD1-CG1 4.11Å; L717-I768 HydrophobicContact CD1-CG2 4.1Å; L717-R771 HydrophobicContact CD1-CB 3.98Å; L717-R771 HydrophobicContact CD2-CB 3.78Å; L717-Y772 HydrophobicContact CD1-CD2 4.26Å; L717-Y772 HydrophobicContact CD1-CE2 3.88Å; L717-Y772 HydrophobicContact CD2-CD1 3.89Å; L717-Y772 HydrophobicContact CD2-CD2 4.02Å; L717-Y772 HydrophobicContact CD2-CE1 3.66Å; L717-Y772 HydrophobicContact CD2-CE2 3.81Å; L717-Y772 HydrophobicContact CD2-CG 4.07Å; L717-Y772 HydrophobicContact CG-CD2 4.2Å; L717-Y772 HydrophobicContact CG-CE1 4.12Å; L717-Y772 HydrophobicContact CG-CE2 3.59Å
718	Q	89.6	Confident	92.5	Very high	148 Å²	148	45.2 Å²	45.2	69%	0.692	26%	0.255	S	S	*	.	H	α-helix	trans	-95.3	-42.3	178.7	-76.7	170.8	95.5	0	0	111.8	S714 T715	S714-Q718 WeakPolarHBondContact O-CG 3.49Å; S714-Q718 PolarHBondContact O-N 3.41Å; S714-Q718 PolarHBondContact O-NE2 2.63Å; T715-Q718 PolarHBondContact O-N 3.49Å
719	N	86.2	Confident	92.6	Very high	104 Å²	104	45 Å²	45	56%	0.556	25%	0.252	S	S	*	.	H	α-helix	trans	-88.7	-39.2	-177.4	-62.1	10.6	0	0	0	112.1	T715 D721	T715-N719 PolarHBondContact O-N 3.06Å; N719-D721 VanDerWaalsContact C-N 3.34Å; N719-D721 WeakPolarHBondContact CB-OD1 3.41Å; N719-D721 WeakPolarHBondContact CB-OD2 3.35Å
720	G	83.9	Confident	92.7	Very high	70 Å²	70	45 Å²	45	72%	0.722	25%	0.252	S	S	*	.	S	Bend	trans	80.6	7.7	179.8	0	0	0	0	0	115.6	G716	G716-G720 WeakPolarHBondContact O-CA 3.38Å; G716-G720 PolarHBondContact O-N 2.9Å; G716-G720 VanDerWaalsContact O-N 3.09Å
721	D	85.1	Confident	92.8	Very high	110 Å²	110	40.6 Å²	40.6	59%	0.588	23%	0.234	S	C	*	.			trans	-106.7	-15.9	-175.1	52.5	8.8	0	0	0	114.3	N719	N719-D721 VanDerWaalsContact C-N 3.34Å; N719-D721 WeakPolarHBondContact CB-OD1 3.41Å; N719-D721 WeakPolarHBondContact CB-OD2 3.35Å
722	M	90.6	Very high	93	Very high	25 Å²	25	39.9 Å²	39.9	12%	0.123	23%	0.226	C	C	.	.	S	Bend	trans	-52.5	125.9	-176.5	-173.3	68.9	61.8	0	0	112.8	F669 L712 T715 E724 I726 V727	F669-M722 HydrophobicContact CE1-CE 3.99Å; F669-M722 HydrophobicContact CE1-SD 3.9Å; F669-M722 HydrophobicContact CZ-SD 4.15Å; L712-M722 HydrophobicContact CD1-CE 4Å; L712-M722 HydrophobicContact CD1-SD 4.12Å; L712-M722 HydrophobicContact CG-CE 4.4Å; L712-M722 HydrophobicContact CG-SD 4.47Å; T715-M722 HydrophobicContact CG2-CE 4.48Å; M722-E724 PolarHBondContact O-N 3.03Å; M722-I726 HydrophobicContact CG-CB 4.47Å; M722-I726 HydrophobicContact CG-CG2 4.33Å; M722-I726 HydrophobicContact SD-CB 4.3Å; M722-I726 HydrophobicContact SD-CD1 4.46Å; M722-I726 HydrophobicContact SD-CG2 3.8Å; M722-V727 HydrophobicContact CB-CG2 4.02Å; M722-V727 HydrophobicContact CG-CG2 3.58Å
723	P	93.3	Very high	93.1	Very high	57 Å²	57	39.8 Å²	39.8	37%	0.37	23%	0.225	S	C	.	.			trans	-53.2	132.6	179.1	-30	35.8	0	0	0	113.8	A681 Q725 I726 V727	A681-P723 HydrophobicContact CB-CG 4.34Å; P723-Q725 VanDerWaalsContact C-N 3.29Å; P723-Q725 PolarHBondContact O-N 3.35Å; P723-I726 HydrophobicContact CB-CD1 4.06Å; P723-I726 HydrophobicContact CB-CG1 4.18Å; P723-I726 HydrophobicContact CG-CD1 4Å; P723-I726 WeakPolarHBondContact O-CB 3.14Å; P723-I726 PolarHBondContact O-N 2.93Å; P723-V727 PolarHBondContact O-N 2.84Å
724	E	93.6	Very high	93.2	Very high	74 Å²	74	39.7 Å²	39.7	35%	0.346	23%	0.225	S	C	.	.	H	α-helix	trans	-51	-43.5	-176.2	45.3	144.6	-104.9	0	0	113.9	M722 I726 V727 I728 N777 V780	M722-E724 PolarHBondContact O-N 3.03Å; E724-I726 VanDerWaalsContact C-N 3.31Å; E724-I726 PolarHBondContact O-N 2.89Å; E724-V727 WeakPolarHBondContact O-CB 3.42Å; E724-V727 PolarHBondContact O-N 3.3Å; E724-I728 WeakPolarHBondContact O-CB 3.47Å; E724-I728 VanDerWaalsContact O-CG1 3.3Å; E724-I728 WeakPolarHBondContact O-CG1 3.29Å; E724-I728 PolarHBondContact O-N 3.16Å; E724-N777 PolarHBondContact OE2-ND2 3.35Å; E724-V780 HydrophobicContact CB-CG2 3.84Å
725	Q	95.1	Very high	93.3	Very high	70 Å²	70	39 Å²	39	33%	0.327	22%	0.219	S	C	.	.	H	α-helix	trans	-64.5	-33.4	179.4	-66.8	-62	-43.5	0	0	112.7	L685 P723 H729	L685-Q725 HydrophobicContact CD1-CB 3.81Å; L685-Q725 HydrophobicContact CD2-CB 3.7Å; L685-Q725 HydrophobicContact CG-CB 4.43Å; P723-Q725 VanDerWaalsContact C-N 3.29Å; P723-Q725 PolarHBondContact O-N 3.35Å; Q725-H729 PolarHBondContact O-N 3.48Å; Q725-H729 VanDerWaalsContact O-N 3.12Å; Q725-H729 PolarHBondContact O-ND1 3.1Å; Q725-H729 PolarHBondContact OE1-CE1 3.47Å
726	I	96.2	Very high	93.5	Very high	1 Å²	1	38.1 Å²	38.1	1%	0.005	21%	0.212	C	C	.	.	H	α-helix	trans	-69.1	-44.1	175.5	-64.3	178.7	0	0	0	109.6	F669 A681 V684 L685 L688 L712 M722 P723 E724 A730	F669-I726 HydrophobicContact CZ-CD1 4.29Å; A681-I726 HydrophobicContact CB-CD1 4.21Å; V684-I726 HydrophobicContact CG1-CD1 4.5Å; L685-I726 HydrophobicContact CB-CD1 4.34Å; L685-I726 HydrophobicContact CB-CG1 3.84Å; L685-I726 HydrophobicContact CD1-CG1 4.02Å; L685-I726 HydrophobicContact CG-CG1 4.37Å; L688-I726 HydrophobicContact CD2-CG2 4.16Å; L712-I726 HydrophobicContact CD1-CG2 4.03Å; L712-I726 HydrophobicContact CD2-CG2 3.42Å; L712-I726 VanDerWaalsContact CD2-CG2 3.42Å; L712-I726 HydrophobicContact CG-CG2 3.92Å; M722-I726 HydrophobicContact CG-CB 4.47Å; M722-I726 HydrophobicContact CG-CG2 4.33Å; M722-I726 HydrophobicContact SD-CB 4.3Å; M722-I726 HydrophobicContact SD-CD1 4.46Å; M722-I726 HydrophobicContact SD-CG2 3.8Å; P723-I726 HydrophobicContact CB-CD1 4.06Å; P723-I726 HydrophobicContact CB-CG1 4.18Å; P723-I726 HydrophobicContact CG-CD1 4Å; P723-I726 WeakPolarHBondContact O-CB 3.14Å; P723-I726 PolarHBondContact O-N 2.93Å; E724-I726 VanDerWaalsContact C-N 3.31Å; E724-I726 PolarHBondContact O-N 2.89Å; I726-A730 VanDerWaalsContact O-CB 3.23Å; I726-A730 WeakPolarHBondContact O-CB 3.27Å; I726-A730 PolarHBondContact O-N 3.06Å
727	V	96.6	Very high	93.7	Very high	5 Å²	5	38.1 Å²	38.1	3%	0.03	21%	0.211	C	C	.	.	H	α-helix	trans	-61.3	-45.5	176	178.4	0	0	0	0	111.5	L713 M722 P723 E724 M731 Y772 V780	L713-V727 HydrophobicContact CD2-CG1 4.12Å; M722-V727 HydrophobicContact CB-CG2 4.02Å; M722-V727 HydrophobicContact CG-CG2 3.58Å; P723-V727 PolarHBondContact O-N 2.84Å; E724-V727 WeakPolarHBondContact O-CB 3.42Å; E724-V727 PolarHBondContact O-N 3.3Å; V727-M731 HydrophobicContact CG1-CE 4.05Å; V727-M731 WeakPolarHBondContact O-CG 3.44Å; V727-M731 PolarHBondContact O-N 2.86Å; V727-Y772 HydrophobicContact CB-CE1 4.49Å; V727-Y772 HydrophobicContact CG1-CD1 3.78Å; V727-Y772 HydrophobicContact CG1-CD2 4.19Å; V727-Y772 HydrophobicContact CG1-CE1 3.46Å; V727-Y772 VanDerWaalsContact CG1-CE1 3.46Å; V727-Y772 HydrophobicContact CG1-CE2 3.9Å; V727-Y772 HydrophobicContact CG1-CG 4.13Å; V727-Y772 HydrophobicContact CG2-CE1 4.18Å; V727-V780 HydrophobicContact CB-CG2 4.46Å; V727-V780 HydrophobicContact CG1-CG1 3.91Å; V727-V780 HydrophobicContact CG1-CG2 4.38Å
728	I	96.3	Very high	93.9	Very high	13 Å²	13	35.7 Å²	35.7	7%	0.067	20%	0.198	C	C	.	.	H	α-helix	trans	-58.7	-55.5	179	-74.7	164.1	0	0	0	110.9	E724 A730 M731 Q732 A779 V780 Q783	E724-I728 WeakPolarHBondContact O-CB 3.47Å; E724-I728 VanDerWaalsContact O-CG1 3.3Å; E724-I728 WeakPolarHBondContact O-CG1 3.29Å; E724-I728 PolarHBondContact O-N 3.16Å; I728-A730 VanDerWaalsContact C-N 3.34Å; I728-A730 PolarHBondContact O-N 3.01Å; I728-M731 PolarHBondContact O-N 3.34Å; I728-Q732 WeakPolarHBondContact O-CG 3.24Å; I728-Q732 PolarHBondContact O-N 3.43Å; I728-A779 HydrophobicContact CD1-CB 3.89Å; I728-V780 HydrophobicContact CD1-CG2 4.37Å; I728-V780 HydrophobicContact CG1-CG2 4.19Å; I728-Q783 HydrophobicContact CB-CG 4.46Å; I728-Q783 HydrophobicContact CG1-CB 4.22Å; I728-Q783 HydrophobicContact CG1-CG 4.41Å; I728-Q783 HydrophobicContact CG2-CG 4.11Å
729	H	96.8	Very high	94.1	Very high	10 Å²	10	29 Å²	29	5%	0.046	17%	0.167	C	C	.	.	H	α-helix	trans	-70.9	-28.1	-175.8	-67.3	90.3	0	0	0	112.9	L688 K689 T692 Q725 Q732 C733	L688-H729 HydrophobicContact CD2-CB 4.03Å; L688-H729 HydrophobicContact CG-CB 3.95Å; K689-H729 WeakPolarHBondContact CE-NE2 3.43Å; T692-H729 HydrophobicContact CG2-CB 4.41Å; T692-H729 PolarHBondContact OG1-O 2.97Å; T692-H729 VanDerWaalsContact OG1-O 3.06Å; Q725-H729 PolarHBondContact O-N 3.48Å; Q725-H729 VanDerWaalsContact O-N 3.12Å; Q725-H729 PolarHBondContact O-ND1 3.1Å; Q725-H729 PolarHBondContact OE1-CE1 3.47Å; H729-Q732 PolarHBondContact CD2-OE1 2.96Å; H729-C733 VanDerWaalsContact O-CB 3.29Å; H729-C733 WeakPolarHBondContact O-CB 3.49Å; H729-C733 PolarHBondContact O-N 3.27Å
730	A	97.4	Very high	94.4	Very high	0 Å²	0	26.1 Å²	26.1	0%	0	15%	0.148	C	C	.	.	H	α-helix	trans	-73.8	-33.6	173.3	0	0	0	0	0	112.8	L688 N709 L712 L713 I726 I728 T734	L688-A730 HydrophobicContact CD2-CB 4.07Å; N709-A730 WeakPolarHBondContact OD1-CA 3.45Å; L712-A730 HydrophobicContact CD2-CB 3.75Å; L713-A730 HydrophobicContact CD1-CB 4.29Å; L713-A730 HydrophobicContact CD2-CB 3.88Å; L713-A730 HydrophobicContact CG-CB 3.91Å; I726-A730 VanDerWaalsContact O-CB 3.23Å; I726-A730 WeakPolarHBondContact O-CB 3.27Å; I726-A730 PolarHBondContact O-N 3.06Å; I728-A730 VanDerWaalsContact C-N 3.34Å; I728-A730 PolarHBondContact O-N 3.01Å; A730-T734 VanDerWaalsContact O-CB 3.29Å; A730-T734 WeakPolarHBondContact O-CB 3.41Å; A730-T734 PolarHBondContact O-N 2.85Å; A730-T734 PolarHBondContact O-OG1 3.25Å
731	M	97.1	Very high	94.8	Very high	0 Å²	0	24.9 Å²	24.9	0%	0	12%	0.124	C	C	.	.	H	α-helix	trans	-65	-46.2	169.1	-73.3	-167.7	-60.6	0	0	111	L713 V727 I728 T734 H735 F765 Y772 V780 Q783 A784	L713-M731 HydrophobicContact CD1-CG 4.18Å; L713-M731 HydrophobicContact CD2-CG 3.73Å; V727-M731 HydrophobicContact CG1-CE 4.05Å; V727-M731 WeakPolarHBondContact O-CG 3.44Å; V727-M731 PolarHBondContact O-N 2.86Å; I728-M731 PolarHBondContact O-N 3.34Å; M731-T734 PolarHBondContact O-N 2.94Å; M731-H735 WeakPolarHBondContact O-CB 3.34Å; M731-H735 PolarHBondContact O-N 2.89Å; M731-F765 HydrophobicContact CB-CE2 4.45Å; M731-F765 HydrophobicContact CG-CE2 4.45Å; M731-F765 VanDerWaalsContact O-CZ 3.23Å; M731-F765 WeakPolarHBondContact O-CZ 3.27Å; M731-Y772 HydrophobicContact SD-CD2 3.91Å; M731-Y772 HydrophobicContact SD-CG 4.19Å; M731-V780 HydrophobicContact CE-CG1 4.3Å; M731-Q783 HydrophobicContact CE-CB 3.97Å; M731-Q783 HydrophobicContact CE-CG 3.85Å; M731-A784 HydrophobicContact CE-CB 4.04Å; M731-A784 HydrophobicContact SD-CB 3.95Å
732	Q	96.2	Very high	95.1	Very high	34 Å²	34	20.5 Å²	20.5	16%	0.159	10%	0.1	C	C	.	.	H	α-helix	trans	-57.9	-49.7	174.5	-68.9	171.1	-4.6	0	0	112	T692 I728 H729 T734 H735 Y736 Q783	T692-Q732 HydrophobicContact CG2-CB 3.59Å; I728-Q732 WeakPolarHBondContact O-CG 3.24Å; I728-Q732 PolarHBondContact O-N 3.43Å; H729-Q732 PolarHBondContact CD2-OE1 2.96Å; Q732-T734 PolarHBondContact O-N 3.3Å; Q732-H735 WeakPolarHBondContact O-CB 3.2Å; Q732-H735 PolarHBondContact O-N 2.74Å; Q732-H735 VanDerWaalsContact O-N 3.16Å; Q732-Y736 HydrophobicContact CB-CE2 4.07Å; Q732-Y736 VanDerWaalsContact O-CD2 3.23Å; Q732-Y736 WeakPolarHBondContact O-CD2 3.48Å; Q732-Y736 VanDerWaalsContact O-CG 3.29Å; Q732-Y736 PolarHBondContact O-N 3.16Å; Q732-Q783 HydrophobicContact CG-CG 4.45Å
733	C	97	Very high	95.1	Very high	0 Å²	0	20.8 Å²	20.8	0%	0	11%	0.106	C	C	.	.	H	α-helix	trans	-61	-43	178.7	-166.3	0	0	0	0	112	L688 T692 H729 H735 Y736 I737	L688-C733 HydrophobicContact CD1-CB 4.41Å; T692-C733 HydrophobicContact CG2-CB 4.39Å; T692-C733 WeakPolarHBondContact OG1-CB 3.44Å; H729-C733 VanDerWaalsContact O-CB 3.29Å; H729-C733 WeakPolarHBondContact O-CB 3.49Å; H729-C733 PolarHBondContact O-N 3.27Å; C733-H735 VanDerWaalsContact C-N 3.32Å; C733-H735 PolarHBondContact O-N 3.11Å; C733-Y736 PolarHBondContact O-N 2.89Å; C733-I737 WeakPolarHBondContact O-CD1 3.43Å; C733-I737 VanDerWaalsContact O-CG1 3.23Å; C733-I737 WeakPolarHBondContact O-CG1 3.27Å; C733-I737 PolarHBondContact O-N 3.44Å
734	T	97.5	Very high	94.8	Very high	1 Å²	1	22.7 Å²	22.7	1%	0.006	11%	0.109	C	C	.	.	H	α-helix	trans	-65.8	-33.5	176.5	-51.3	0	0	0	0	112.6	F706 N709 A730 M731 Q732 V738 F765	F706-T734 HydrophobicContact CD2-CG2 4.04Å; F706-T734 HydrophobicContact CE2-CG2 3.67Å; N709-T734 VanDerWaalsContact CB-OG1 3.27Å; N709-T734 WeakPolarHBondContact CB-OG1 3.17Å; A730-T734 VanDerWaalsContact O-CB 3.29Å; A730-T734 WeakPolarHBondContact O-CB 3.41Å; A730-T734 PolarHBondContact O-N 2.85Å; A730-T734 PolarHBondContact O-OG1 3.25Å; M731-T734 PolarHBondContact O-N 2.94Å; Q732-T734 PolarHBondContact O-N 3.3Å; T734-V738 WeakPolarHBondContact O-CG2 3.41Å; T734-V738 PolarHBondContact O-N 3.01Å; T734-V738 VanDerWaalsContact O-N 3.13Å; T734-F765 VanDerWaalsContact CB-CE2 3.48Å; T734-F765 HydrophobicContact CG2-CB 4.26Å; T734-F765 HydrophobicContact CG2-CD1 4.25Å; T734-F765 HydrophobicContact CG2-CD2 3.33Å; T734-F765 HydrophobicContact CG2-CE1 4.45Å; T734-F765 HydrophobicContact CG2-CE2 3.59Å; T734-F765 HydrophobicContact CG2-CG 3.69Å; T734-F765 HydrophobicContact CG2-CZ 4.15Å
735	H	96.4	Very high	94.4	Very high	7 Å²	7	19.5 Å²	19.5	3%	0.032	9%	0.094	C	C	.	.	H	α-helix	trans	-63	-51.5	171.4	178.1	72.8	0	0	0	110.9	M731 Q732 C733 I737 V738 L739 F765 V787 V791	M731-H735 WeakPolarHBondContact O-CB 3.34Å; M731-H735 PolarHBondContact O-N 2.89Å; Q732-H735 WeakPolarHBondContact O-CB 3.2Å; Q732-H735 PolarHBondContact O-N 2.74Å; Q732-H735 VanDerWaalsContact O-N 3.16Å; C733-H735 VanDerWaalsContact C-N 3.32Å; C733-H735 PolarHBondContact O-N 3.11Å; H735-I737 PolarHBondContact O-N 3.05Å; H735-V738 PolarHBondContact O-N 3.48Å; H735-V738 VanDerWaalsContact O-N 3.11Å; H735-L739 WeakPolarHBondContact NE2-CD1 3.38Å; H735-L739 WeakPolarHBondContact O-CG 3.17Å; H735-L739 PolarHBondContact O-N 3.08Å; H735-F765 HydrophobicContact CB-CE1 3.9Å; H735-F765 HydrophobicContact CB-CZ 4.05Å; H735-V787 HydrophobicContact CB-CG1 4.05Å; H735-V787 HydrophobicContact CB-CG2 4.25Å; H735-V791 VanDerWaalsContact ND1-CG2 3.33Å; H735-V791 WeakPolarHBondContact ND1-CG2 3.15Å
736	Y	96.1	Very high	93.8	Very high	15 Å²	15	17.8 Å²	17.8	6%	0.059	9%	0.09	C	C	.	.	H	α-helix	trans	-59.6	-41.9	177.6	-53.5	-37.2	0	0	0	112.4	T692 H695 N696 Q732 C733 V738 L739 W740 V1272	T692-Y736 HydrophobicContact CG2-CD2 4.39Å; T692-Y736 HydrophobicContact CG2-CE2 3.83Å; T692-Y736 WeakPolarHBondContact O-CE2 3.43Å; H695-Y736 HydrophobicContact CB-CD2 4.15Å; N696-Y736 HydrophobicContact CB-CD2 4.27Å; N696-Y736 HydrophobicContact CB-CE1 4.34Å; N696-Y736 HydrophobicContact CB-CE2 3.87Å; Q732-Y736 HydrophobicContact CB-CE2 4.07Å; Q732-Y736 VanDerWaalsContact O-CD2 3.23Å; Q732-Y736 WeakPolarHBondContact O-CD2 3.48Å; Q732-Y736 VanDerWaalsContact O-CG 3.29Å; Q732-Y736 PolarHBondContact O-N 3.16Å; C733-Y736 PolarHBondContact O-N 2.89Å; Y736-V738 VanDerWaalsContact C-N 3.33Å; Y736-V738 PolarHBondContact O-N 3.24Å; Y736-L739 PolarHBondContact O-N 2.94Å; Y736-L739 VanDerWaalsContact O-N 3.14Å; Y736-W740 VanDerWaalsContact O-CD1 3.3Å; Y736-W740 PolarHBondContact O-N 2.98Å; Y736-V1272 HydrophobicContact CD1-CG2 4.08Å; Y736-V1272 HydrophobicContact CE1-CG2 3.86Å
737	I	95.5	Very high	92.8	Very high	5 Å²	5	25.3 Å²	25.3	3%	0.026	13%	0.125	C	C	.	.	H	α-helix	trans	-54.1	-48.5	172.8	-68.9	156.1	0	0	0	111.4	H695 L705 F706 C733 H735 L739 H741	H695-I737 WeakPolarHBondContact CE1-CG1 3.4Å; L705-I737 HydrophobicContact CB-CD1 3.74Å; L705-I737 HydrophobicContact CB-CG1 4.27Å; F706-I737 HydrophobicContact CB-CG2 4.06Å; F706-I737 HydrophobicContact CD2-CG2 4.03Å; C733-I737 WeakPolarHBondContact O-CD1 3.43Å; C733-I737 VanDerWaalsContact O-CG1 3.23Å; C733-I737 WeakPolarHBondContact O-CG1 3.27Å; C733-I737 PolarHBondContact O-N 3.44Å; H735-I737 PolarHBondContact O-N 3.05Å; I737-L739 VanDerWaalsContact C-N 3.29Å; I737-L739 PolarHBondContact O-N 3.39Å; I737-H741 VanDerWaalsContact O-CB 3.3Å; I737-H741 WeakPolarHBondContact O-CB 3.36Å; I737-H741 VanDerWaalsContact O-CG 3.3Å; I737-H741 PolarHBondContact O-N 3.43Å
738	V	95.1	Very high	91.1	Very high	0 Å²	0	27.9 Å²	27.9	0%	0	15%	0.153	C	C	.	.	H	α-helix	trans	-66	-33.4	-179.3	167.2	0	0	0	0	111.5	F706 T734 H735 Y736 L742 L758 Q761 M762 F765 F795	F706-V738 HydrophobicContact CE2-CG2 4.49Å; T734-V738 WeakPolarHBondContact O-CG2 3.41Å; T734-V738 PolarHBondContact O-N 3.01Å; T734-V738 VanDerWaalsContact O-N 3.13Å; H735-V738 PolarHBondContact O-N 3.48Å; H735-V738 VanDerWaalsContact O-N 3.11Å; Y736-V738 VanDerWaalsContact C-N 3.33Å; Y736-V738 PolarHBondContact O-N 3.24Å; V738-L742 WeakPolarHBondContact O-CB 3.38Å; V738-L742 PolarHBondContact O-N 3.43Å; V738-L742 VanDerWaalsContact O-N 3.14Å; V738-L758 HydrophobicContact CG1-CD1 4.04Å; V738-L758 WeakPolarHBondContact O-CD1 3.41Å; V738-Q761 HydrophobicContact CG2-CB 4.48Å; V738-M762 HydrophobicContact CG1-CB 4Å; V738-M762 HydrophobicContact CG1-CG 4.45Å; V738-F765 HydrophobicContact CG2-CD1 4.45Å; V738-F795 HydrophobicContact CG1-CE2 3.69Å; V738-F795 HydrophobicContact CG1-CZ 3.63Å
739	L	94.5	Very high	89.3	Confident	7 Å²	7	31.6 Å²	31.6	4%	0.037	18%	0.18	C	C	.	.	H	α-helix	trans	-76.6	-44.9	178.5	-67.1	-168.4	0	0	0	113.6	H735 Y736 I737 H741 L742 A743 I794 F795 V1272 M1274	H735-L739 WeakPolarHBondContact NE2-CD1 3.38Å; H735-L739 WeakPolarHBondContact O-CG 3.17Å; H735-L739 PolarHBondContact O-N 3.08Å; Y736-L739 PolarHBondContact O-N 2.94Å; Y736-L739 VanDerWaalsContact O-N 3.14Å; I737-L739 VanDerWaalsContact C-N 3.29Å; I737-L739 PolarHBondContact O-N 3.39Å; L739-H741 VanDerWaalsContact C-N 3.33Å; L739-H741 PolarHBondContact O-N 3.24Å; L739-L742 CarbonylContact O-C 3.53Å; L739-L742 WeakPolarHBondContact O-CA 3.39Å; L739-L742 WeakPolarHBondContact O-CB 3.46Å; L739-L742 PolarHBondContact O-N 3.41Å; L739-A743 PolarHBondContact O-N 3.21Å; L739-I794 HydrophobicContact CD1-CD1 4.3Å; L739-I794 HydrophobicContact CD2-CD1 3.73Å; L739-I794 HydrophobicContact CD2-CG2 4.13Å; L739-F795 HydrophobicContact CD2-CE2 4.39Å; L739-V1272 HydrophobicContact CD1-CB 4.49Å; L739-V1272 HydrophobicContact CD1-CG1 4.13Å; L739-V1272 HydrophobicContact CD1-CG2 3.73Å; L739-M1274 HydrophobicContact CB-CE 3.78Å; L739-M1274 HydrophobicContact CD1-CE 4.18Å
740	W	93.1	Very high	87.6	Confident	45 Å²	45	32.7 Å²	32.7	17%	0.17	19%	0.189	C	C	.	.	H	α-helix	trans	-65.1	-37.5	175	-75.6	108.8	0	0	0	112	H695 H698 D699 Y736 L742 A743 K744 M1274	H695-W740 AromaticContact CD2-CD1 3.44Å; H695-W740 VanDerWaalsContact CD2-CD1 3.44Å; H695-W740 AromaticContact CD2-NE1 3.95Å; H695-W740 AromaticContact NE2-CD1 3.79Å; H695-W740 PolarHBondContact O-NE1 3.37Å; H698-W740 VanDerWaalsContact C-CE2 3.49Å; H698-W740 PolarHBondContact O-NE1 2.99Å; D699-W740 HydrophobicContact CB-CD2 4.04Å; D699-W740 HydrophobicContact CB-CE3 3.68Å; D699-W740 HydrophobicContact CB-CZ3 4.06Å; Y736-W740 VanDerWaalsContact O-CD1 3.3Å; Y736-W740 PolarHBondContact O-N 2.98Å; W740-L742 VanDerWaalsContact C-N 3.28Å; W740-L742 PolarHBondContact O-N 3.03Å; W740-A743 PolarHBondContact O-N 3.36Å; W740-K744 WeakPolarHBondContact O-CB 3.49Å; W740-K744 PolarHBondContact O-N 2.86Å; W740-K744 VanDerWaalsContact O-N 3.1Å; W740-M1274 HydrophobicContact CE3-SD 4.43Å; W740-M1274 HydrophobicContact CH2-CG 4.27Å; W740-M1274 HydrophobicContact CH2-SD 4.37Å; W740-M1274 HydrophobicContact CZ2-CG 4.3Å; W740-M1274 HydrophobicContact CZ3-SD 4.33Å
741	H	91.3	Very high	86.2	Confident	44 Å²	44	38.6 Å²	38.6	20%	0.204	22%	0.219	C	C	.	.	H	α-helix	trans	-59.7	-36.7	168.3	-78.1	-175.6	0	0	0	112.5	S701 I737 L739 V745 L758 Q761	S701-H741 PolarHBondContact OG-CD2 3Å; I737-H741 VanDerWaalsContact O-CB 3.3Å; I737-H741 WeakPolarHBondContact O-CB 3.36Å; I737-H741 VanDerWaalsContact O-CG 3.3Å; I737-H741 PolarHBondContact O-N 3.43Å; L739-H741 VanDerWaalsContact C-N 3.33Å; L739-H741 PolarHBondContact O-N 3.24Å; H741-V745 VanDerWaalsContact O-CB 3.29Å; H741-V745 WeakPolarHBondContact O-CB 3.46Å; H741-V745 WeakPolarHBondContact O-CG2 3.4Å; H741-V745 PolarHBondContact O-N 3.43Å; H741-V745 VanDerWaalsContact O-N 3.11Å; H741-L758 HydrophobicContact CB-CD1 3.89Å; H741-Q761 PolarHBondContact ND1-OE1 2.87Å
742	L	91.8	Very high	85.1	Confident	17 Å²	17	47.5 Å²	47.5	9%	0.089	26%	0.258	C	S	.	.	H	α-helix	trans	-70.2	-42.3	175.4	174.6	61.3	0	0	0	112.7	V738 L739 W740 V745 S746 L758 I794 F795 I799 L807 L810	V738-L742 WeakPolarHBondContact O-CB 3.38Å; V738-L742 PolarHBondContact O-N 3.43Å; V738-L742 VanDerWaalsContact O-N 3.14Å; L739-L742 CarbonylContact O-C 3.53Å; L739-L742 WeakPolarHBondContact O-CA 3.39Å; L739-L742 WeakPolarHBondContact O-CB 3.46Å; L739-L742 PolarHBondContact O-N 3.41Å; W740-L742 VanDerWaalsContact C-N 3.28Å; W740-L742 PolarHBondContact O-N 3.03Å; L742-V745 PolarHBondContact O-N 2.88Å; L742-S746 WeakPolarHBondContact O-CB 3.34Å; L742-S746 PolarHBondContact O-N 3.03Å; L742-S746 PolarHBondContact O-OG 3.14Å; L742-L758 HydrophobicContact CB-CD2 4.08Å; L742-L758 HydrophobicContact CD1-CD2 4.26Å; L742-I794 HydrophobicContact CD2-CG2 3.51Å; L742-F795 HydrophobicContact CB-CZ 4.17Å; L742-F795 HydrophobicContact CD1-CE1 4.39Å; L742-F795 HydrophobicContact CD2-CE1 4.17Å; L742-F795 HydrophobicContact CD2-CE2 4.18Å; L742-F795 HydrophobicContact CD2-CZ 3.81Å; L742-F795 HydrophobicContact CG-CZ 4.42Å; L742-I799 HydrophobicContact CD1-CD1 3.87Å; L742-I799 HydrophobicContact CD2-CD1 4.1Å; L742-L807 HydrophobicContact CD1-CD1 4.49Å; L742-L810 HydrophobicContact CD1-CD1 3.72Å
743	A	90	Very high	84.4	Confident	31 Å²	31	47.8 Å²	47.8	26%	0.256	27%	0.27	S	S	.	.	H	α-helix	trans	-56.9	-56.6	177.4	0	0	0	0	0	110.5	L739 W740 V745 S746 E747 M1274	L739-A743 PolarHBondContact O-N 3.21Å; W740-A743 PolarHBondContact O-N 3.36Å; A743-V745 VanDerWaalsContact C-N 3.26Å; A743-V745 PolarHBondContact O-N 2.74Å; A743-S746 WeakPolarHBondContact O-CB 3.45Å; A743-S746 PolarHBondContact O-N 2.85Å; A743-E747 PolarHBondContact O-N 3.1Å; A743-M1274 HydrophobicContact CB-SD 4.32Å
744	K	86.3	Confident	83.8	Confident	98 Å²	98	51 Å²	51	43%	0.426	29%	0.287	S	S	.	.	H	α-helix	trans	-56.7	-34.4	176.5	-174.7	173.9	-175.9	169.3	0	113.9	W740	W740-K744 WeakPolarHBondContact O-CB 3.49Å; W740-K744 PolarHBondContact O-N 2.86Å; W740-K744 VanDerWaalsContact O-N 3.1Å
745	V	86.5	Confident	83.3	Confident	6 Å²	6	52.3 Å²	52.3	4%	0.036	29%	0.294	C	S	.	.	H	α-helix	trans	-71.8	-36.4	174.8	161.1	0	0	0	0	112.2	H741 L742 A743 E747 G748 S750 D754 L755 L758 L807 L810	H741-V745 VanDerWaalsContact O-CB 3.29Å; H741-V745 WeakPolarHBondContact O-CB 3.46Å; H741-V745 WeakPolarHBondContact O-CG2 3.4Å; H741-V745 PolarHBondContact O-N 3.43Å; H741-V745 VanDerWaalsContact O-N 3.11Å; L742-V745 PolarHBondContact O-N 2.88Å; A743-V745 VanDerWaalsContact C-N 3.26Å; A743-V745 PolarHBondContact O-N 2.74Å; V745-E747 PolarHBondContact O-N 3.31Å; V745-G748 PolarHBondContact O-N 2.99Å; V745-S750 PolarHBondContact O-OG 2.84Å; V745-S750 VanDerWaalsContact O-OG 3.13Å; V745-D754 HydrophobicContact CG2-CB 4.23Å; V745-L755 HydrophobicContact CG1-CD2 3.45Å; V745-L755 VanDerWaalsContact CG1-CD2 3.45Å; V745-L755 HydrophobicContact CG1-CG 3.78Å; V745-L758 HydrophobicContact CB-CD2 4.3Å; V745-L758 HydrophobicContact CG1-CD2 4.48Å; V745-L758 HydrophobicContact CG2-CD2 4.17Å; V745-L807 HydrophobicContact CG1-CD2 3.95Å; V745-L810 HydrophobicContact CG1-CD1 4.44Å
746	S	82.4	Confident	83.1	Confident	35 Å²	35	55 Å²	55	25%	0.245	31%	0.31	C	S	.	.	H	α-helix	trans	-73.2	-22.8	-174.6	-60.4	0	0	0	0	114.2	L742 A743 G748	L742-S746 WeakPolarHBondContact O-CB 3.34Å; L742-S746 PolarHBondContact O-N 3.03Å; L742-S746 PolarHBondContact O-OG 3.14Å; A743-S746 WeakPolarHBondContact O-CB 3.45Å; A743-S746 PolarHBondContact O-N 2.85Å; S746-G748 PolarHBondContact O-N 2.95Å
747	E	75.6	Confident	82.9	Confident	158 Å²	158	57.6 Å²	57.6	74%	0.738	33%	0.328	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.1	-3.1	176.5	-65.9	-177.3	160.8	0	0	114	A743 V745 S749	A743-E747 PolarHBondContact O-N 3.1Å; V745-E747 PolarHBondContact O-N 3.31Å; E747-S749 PolarHBondContact O-N 3.48Å
748	G	60.4	Low	82.8	Confident	60 Å²	60	57.4 Å²	57.4	62%	0.619	33%	0.327	S	S	*	.	S	Bend	trans	75.7	5.2	174.4	0	0	0	0	0	115.3	V745 S746 S750	V745-G748 PolarHBondContact O-N 2.99Å; S746-G748 PolarHBondContact O-N 2.95Å; G748-S750 VanDerWaalsContact C-N 3.35Å
749	S	57.6	Low	82.8	Confident	90 Å²	90	60.2 Å²	60.2	63%	0.629	34%	0.338	S	S	*	.			trans	-81.5	-12.3	173.6	61.8	0	0	0	0	113.7	E747	E747-S749 PolarHBondContact O-N 3.48Å
750	S	62.5	Low	82.8	Confident	34 Å²	34	66.8 Å²	66.8	24%	0.238	37%	0.366	C	S	.	.			trans	-76.6	150.9	-167.2	59.5	0	0	0	0	115.4	V745 G748	V745-S750 PolarHBondContact O-OG 2.84Å; V745-S750 VanDerWaalsContact O-OG 3.13Å; G748-S750 VanDerWaalsContact C-N 3.35Å
751	I	67.4	Low	82.9	Confident	123 Å²	123	65.6 Å²	65.6	63%	0.631	36%	0.362	S	S	*	.			trans	-86.2	148.1	176.1	-54	178.9	0	0	0	108.5	G753 D754	I751-G753 PolarHBondContact O-N 3.47Å; I751-D754 WeakPolarHBondContact CA-OD2 3.49Å; I751-D754 WeakPolarHBondContact CB-OD2 3.33Å; I751-D754 PolarHBondContact N-OD2 2.66Å; I751-D754 WeakPolarHBondContact O-CB 3.29Å; I751-D754 PolarHBondContact O-N 2.65Å
752	K	74.6	Confident	83.1	Confident	188 Å²	188	63.5 Å²	63.5	82%	0.817	35%	0.352	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.5	-15	177.2	-70.3	-170.1	175.7	-173.1	0	115.1	V756	K752-V756 WeakPolarHBondContact O-CG2 3.49Å
753	G	80.5	Confident	83.3	Confident	39 Å²	39	68.4 Å²	68.4	40%	0.402	37%	0.37	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.7	-41.7	171.6	0	0	0	0	0	112.4	I751 L755 V756 T757	I751-G753 PolarHBondContact O-N 3.47Å; G753-L755 PolarHBondContact O-N 2.74Å; G753-V756 CarbonylContact O-C 3.47Å; G753-V756 WeakPolarHBondContact O-CA 3.34Å; G753-V756 WeakPolarHBondContact O-CB 3.3Å; G753-V756 PolarHBondContact O-N 2.76Å; G753-T757 PolarHBondContact O-N 2.87Å; G753-T757 PolarHBondContact O-OG1 2.98Å
754	D	85.3	Confident	83.6	Confident	69 Å²	69	68.3 Å²	68.3	37%	0.369	37%	0.369	S	S	.	.	H	α-helix	trans	-64.4	-44.2	-173	-43.2	-26.2	0	0	0	110.3	V745 I751 V756 T757 L758	V745-D754 HydrophobicContact CG2-CB 4.23Å; I751-D754 WeakPolarHBondContact CA-OD2 3.49Å; I751-D754 WeakPolarHBondContact CB-OD2 3.33Å; I751-D754 PolarHBondContact N-OD2 2.66Å; I751-D754 WeakPolarHBondContact O-CB 3.29Å; I751-D754 PolarHBondContact O-N 2.65Å; D754-V756 PolarHBondContact O-N 3.02Å; D754-T757 PolarHBondContact O-N 3.2Å; D754-T757 VanDerWaalsContact O-N 3.11Å; D754-L758 WeakPolarHBondContact O-CB 3.47Å; D754-L758 PolarHBondContact O-N 3.12Å
755	L	87.5	Confident	84.1	Confident	28 Å²	28	63.8 Å²	63.8	15%	0.147	35%	0.349	C	S	.	.	H	α-helix	trans	-57	-24.9	169.7	-85.6	162.5	0	0	0	114.5	V745 G753 R759 L807 L810	V745-L755 HydrophobicContact CG1-CD2 3.45Å; V745-L755 VanDerWaalsContact CG1-CD2 3.45Å; V745-L755 HydrophobicContact CG1-CG 3.78Å; G753-L755 PolarHBondContact O-N 2.74Å; L755-R759 WeakPolarHBondContact O-CB 3.3Å; L755-L807 HydrophobicContact CD2-CD2 4.2Å; L755-L810 HydrophobicContact CD2-CD1 3.98Å; L755-L810 HydrophobicContact CD2-CD2 4.06Å; L755-L810 HydrophobicContact CD2-CG 3.95Å
756	V	91	Very high	84.6	Confident	62 Å²	62	63.6 Å²	63.6	38%	0.376	35%	0.348	S	S	.	.	H	α-helix	trans	-88.5	-35.9	175.7	174.7	0	0	0	0	110.7	K752 G753 D754 K760	K752-V756 WeakPolarHBondContact O-CG2 3.49Å; G753-V756 CarbonylContact O-C 3.47Å; G753-V756 WeakPolarHBondContact O-CA 3.34Å; G753-V756 WeakPolarHBondContact O-CB 3.3Å; G753-V756 PolarHBondContact O-N 2.76Å; D754-V756 PolarHBondContact O-N 3.02Å; V756-K760 WeakPolarHBondContact O-CG 3.25Å; V756-K760 PolarHBondContact O-N 2.85Å
757	T	92.3	Very high	85.2	Confident	70 Å²	70	66 Å²	66	43%	0.429	36%	0.358	S	S	.	.	H	α-helix	trans	-64.9	-54.1	174.3	-59.1	0	0	0	0	111.1	G753 D754 R759 K760 Q761	G753-T757 PolarHBondContact O-N 2.87Å; G753-T757 PolarHBondContact O-OG1 2.98Å; D754-T757 PolarHBondContact O-N 3.2Å; D754-T757 VanDerWaalsContact O-N 3.11Å; T757-R759 VanDerWaalsContact C-N 3.3Å; T757-R759 PolarHBondContact O-N 3.3Å; T757-K760 WeakPolarHBondContact O-CB 3.41Å; T757-K760 PolarHBondContact O-N 2.96Å; T757-Q761 HydrophobicContact CG2-CG 4.31Å; T757-Q761 WeakPolarHBondContact O-CG 3.48Å; T757-Q761 PolarHBondContact O-N 2.81Å
758	L	93.3	Very high	86.2	Confident	2 Å²	2	58.9 Å²	58.9	1%	0.01	33%	0.325	C	S	.	.	H	α-helix	trans	-53.5	-45.5	176.8	173.2	56.2	0	0	0	111.9	V738 H741 L742 V745 D754 K760 Q761 M762 F795 L810	V738-L758 HydrophobicContact CG1-CD1 4.04Å; V738-L758 WeakPolarHBondContact O-CD1 3.41Å; H741-L758 HydrophobicContact CB-CD1 3.89Å; L742-L758 HydrophobicContact CB-CD2 4.08Å; L742-L758 HydrophobicContact CD1-CD2 4.26Å; V745-L758 HydrophobicContact CB-CD2 4.3Å; V745-L758 HydrophobicContact CG1-CD2 4.48Å; V745-L758 HydrophobicContact CG2-CD2 4.17Å; D754-L758 WeakPolarHBondContact O-CB 3.47Å; D754-L758 PolarHBondContact O-N 3.12Å; L758-K760 VanDerWaalsContact C-N 3.3Å; L758-K760 PolarHBondContact O-N 3.36Å; L758-Q761 PolarHBondContact O-N 3.38Å; L758-M762 WeakPolarHBondContact O-CB 3.38Å; L758-M762 PolarHBondContact O-N 3.42Å; L758-F795 HydrophobicContact CD1-CE1 4.49Å; L758-F795 HydrophobicContact CD1-CZ 4.26Å; L758-F795 HydrophobicContact CG-CE1 4.5Å; L758-L810 HydrophobicContact CB-CD2 4.48Å; L758-L810 HydrophobicContact CD2-CD1 3.75Å; L758-L810 HydrophobicContact CD2-CD2 4.17Å; L758-L810 HydrophobicContact CG-CD2 4.15Å
759	R	94.7	Very high	87.9	Confident	58 Å²	58	56 Å²	56	22%	0.219	30%	0.296	C	S	.	.	H	α-helix	trans	-63.1	-33.3	178	-159	-158	-40.6	-145.6	9.3	113.3	L755 T757 R763 N809 L810	L755-R759 WeakPolarHBondContact O-CB 3.3Å; T757-R759 VanDerWaalsContact C-N 3.3Å; T757-R759 PolarHBondContact O-N 3.3Å; R759-R763 WeakPolarHBondContact O-CB 3.38Å; R759-R763 WeakPolarHBondContact O-CD 3.45Å; R759-R763 WeakPolarHBondContact O-CG 3.34Å; R759-R763 PolarHBondContact O-N 2.95Å; R759-N809 WeakPolarHBondContact CD-O 3.46Å; R759-N809 VanDerWaalsContact CZ-OD1 3.23Å; R759-N809 PolarHBondContact NE-O 2.9Å; R759-N809 VanDerWaalsContact NE-O 3.12Å; R759-N809 PolarHBondContact NH1-O 3.38Å; R759-N809 PolarHBondContact NH1-OD1 2.81Å; R759-N809 PolarHBondContact NH2-OD1 3.19Å; R759-L810 HydrophobicContact CB-CD2 3.93Å; R759-L810 HydrophobicContact CG-CD2 4.35Å
760	K	95.1	Very high	89.7	Confident	146 Å²	146	53 Å²	53	64%	0.635	27%	0.271	S	S	*	.	H	α-helix	trans	-72.6	-47.4	174.3	-73.6	171.8	177.2	-177.9	0	110.7	V756 T757 L758 R763 A764	V756-K760 WeakPolarHBondContact O-CG 3.25Å; V756-K760 PolarHBondContact O-N 2.85Å; T757-K760 WeakPolarHBondContact O-CB 3.41Å; T757-K760 PolarHBondContact O-N 2.96Å; L758-K760 VanDerWaalsContact C-N 3.3Å; L758-K760 PolarHBondContact O-N 3.36Å; K760-R763 PolarHBondContact O-N 3.18Å; K760-A764 WeakPolarHBondContact O-CB 3.45Å; K760-A764 PolarHBondContact O-N 2.79Å
761	Q	95.3	Very high	91.2	Very high	19 Å²	19	58.5 Å²	58.5	9%	0.089	29%	0.287	C	S	.	.	H	α-helix	trans	-57.3	-55.4	179.3	-72.8	177.2	-39.4	0	0	111	F706 V738 H741 T757 L758 R763 A764 F765	F706-Q761 HydrophobicContact CD1-CG 3.86Å; F706-Q761 HydrophobicContact CD2-CB 3.96Å; F706-Q761 HydrophobicContact CD2-CG 3.81Å; F706-Q761 HydrophobicContact CE1-CB 4.29Å; F706-Q761 HydrophobicContact CE1-CG 3.79Å; F706-Q761 HydrophobicContact CE2-CB 3.51Å; F706-Q761 HydrophobicContact CE2-CG 3.73Å; F706-Q761 HydrophobicContact CG-CG 3.89Å; F706-Q761 HydrophobicContact CZ-CB 3.7Å; F706-Q761 HydrophobicContact CZ-CG 3.72Å; V738-Q761 HydrophobicContact CG2-CB 4.48Å; H741-Q761 PolarHBondContact ND1-OE1 2.87Å; T757-Q761 HydrophobicContact CG2-CG 4.31Å; T757-Q761 WeakPolarHBondContact O-CG 3.48Å; T757-Q761 PolarHBondContact O-N 2.81Å; L758-Q761 PolarHBondContact O-N 3.38Å; Q761-R763 PolarHBondContact O-N 3.36Å; Q761-A764 PolarHBondContact O-N 3.23Å; Q761-F765 VanDerWaalsContact O-CB 3.28Å; Q761-F765 WeakPolarHBondContact O-CB 3.29Å; Q761-F765 PolarHBondContact O-N 3.05Å
762	M	96	Very high	92.6	Very high	0 Å²	0	53.3 Å²	53.3	0%	0	26%	0.26	C	S	.	.	H	α-helix	trans	-55.5	-46.1	176.6	170.2	-86.7	-79.9	0	0	112.4	V738 L758 F765 C766 V791 F795 L810 Y812	V738-M762 HydrophobicContact CG1-CB 4Å; V738-M762 HydrophobicContact CG1-CG 4.45Å; L758-M762 WeakPolarHBondContact O-CB 3.38Å; L758-M762 PolarHBondContact O-N 3.42Å; M762-F765 PolarHBondContact O-N 3.43Å; M762-C766 PolarHBondContact O-N 2.95Å; M762-C766 PolarHBondContact O-SG 2.99Å; M762-V791 HydrophobicContact CG-CG1 4.13Å; M762-F795 HydrophobicContact CB-CZ 4.48Å; M762-F795 HydrophobicContact CE-CB 4.29Å; M762-F795 HydrophobicContact CE-CD1 3.72Å; M762-F795 HydrophobicContact CE-CE1 4.31Å; M762-F795 HydrophobicContact CE-CG 4.12Å; M762-F795 HydrophobicContact CG-CD1 4.15Å; M762-F795 HydrophobicContact CG-CD2 4.13Å; M762-F795 HydrophobicContact CG-CE1 4.22Å; M762-F795 HydrophobicContact CG-CE2 4.21Å; M762-F795 HydrophobicContact CG-CG 4.1Å; M762-F795 HydrophobicContact CG-CZ 4.25Å; M762-L810 WeakPolarHBondContact CE-O 3.39Å; M762-Y812 HydrophobicContact CE-CD2 4.27Å; M762-Y812 HydrophobicContact SD-CD2 3.6Å; M762-Y812 VanDerWaalsContact SD-CD2 3.6Å; M762-Y812 HydrophobicContact SD-CE2 4.37Å; M762-Y812 HydrophobicContact SD-CG 4.1Å
763	R	95.9	Very high	93.6	Very high	121 Å²	121	44.8 Å²	44.8	46%	0.457	22%	0.223	S	C	.	.	H	α-helix	trans	-68.7	-37.9	-178.4	-74.1	178.4	178.1	-155.7	-3.6	113.2	R759 K760 Q761 L767 Y812	R759-R763 WeakPolarHBondContact O-CB 3.38Å; R759-R763 WeakPolarHBondContact O-CD 3.45Å; R759-R763 WeakPolarHBondContact O-CG 3.34Å; R759-R763 PolarHBondContact O-N 2.95Å; K760-R763 PolarHBondContact O-N 3.18Å; Q761-R763 PolarHBondContact O-N 3.36Å; R763-L767 PolarHBondContact O-N 3.14Å; R763-Y812 HydrophobicContact CG-CD2 3.93Å; R763-Y812 HydrophobicContact CG-CE2 4.02Å
764	A	95.9	Very high	94	Very high	29 Å²	29	47.4 Å²	47.4	24%	0.24	23%	0.234	C	C	.	.	H	α-helix	trans	-68.5	-38.8	175.1	0	0	0	0	0	111.1	Y710 K760 Q761 L767 I768	Y710-A764 HydrophobicContact CE2-CB 3.83Å; K760-A764 WeakPolarHBondContact O-CB 3.45Å; K760-A764 PolarHBondContact O-N 2.79Å; Q761-A764 PolarHBondContact O-N 3.23Å; A764-L767 PolarHBondContact O-N 3.4Å; A764-I768 PolarHBondContact O-N 3.44Å; A764-I768 VanDerWaalsContact O-N 3.13Å
765	F	96.7	Very high	94.2	Very high	2 Å²	2	45.6 Å²	45.6	1%	0.009	23%	0.227	C	C	.	.	H	α-helix	trans	-66.4	-44.5	176.7	-176.7	-129.2	0	0	0	112.8	L713 M731 T734 H735 V738 Q761 M762 L767 I768 C769 V787 V791	L713-F765 HydrophobicContact CD1-CE2 4.38Å; M731-F765 HydrophobicContact CB-CE2 4.45Å; M731-F765 HydrophobicContact CG-CE2 4.45Å; M731-F765 VanDerWaalsContact O-CZ 3.23Å; M731-F765 WeakPolarHBondContact O-CZ 3.27Å; T734-F765 VanDerWaalsContact CB-CE2 3.48Å; T734-F765 HydrophobicContact CG2-CB 4.26Å; T734-F765 HydrophobicContact CG2-CD1 4.25Å; T734-F765 HydrophobicContact CG2-CD2 3.33Å; T734-F765 HydrophobicContact CG2-CE1 4.45Å; T734-F765 HydrophobicContact CG2-CE2 3.59Å; T734-F765 HydrophobicContact CG2-CG 3.69Å; T734-F765 HydrophobicContact CG2-CZ 4.15Å; H735-F765 HydrophobicContact CB-CE1 3.9Å; H735-F765 HydrophobicContact CB-CZ 4.05Å; V738-F765 HydrophobicContact CG2-CD1 4.45Å; Q761-F765 VanDerWaalsContact O-CB 3.28Å; Q761-F765 WeakPolarHBondContact O-CB 3.29Å; Q761-F765 PolarHBondContact O-N 3.05Å; M762-F765 PolarHBondContact O-N 3.43Å; F765-L767 VanDerWaalsContact C-N 3.26Å; F765-L767 PolarHBondContact O-N 3.3Å; F765-I768 WeakPolarHBondContact O-CB 3.36Å; F765-I768 PolarHBondContact O-N 3.46Å; F765-C769 WeakPolarHBondContact CE2-SG 3.4Å; F765-C769 VanDerWaalsContact CZ-SG 3.57Å; F765-C769 PolarHBondContact O-N 3.19Å; F765-V787 HydrophobicContact CE1-CG1 3.51Å; F765-V787 HydrophobicContact CZ-CG1 3.59Å; F765-V791 HydrophobicContact CE1-CG2 4.44Å
766	C	96.3	Very high	94.2	Very high	2 Å²	2	52.4 Å²	52.4	1%	0.014	26%	0.262	C	S	.	.	H	α-helix	trans	-54.5	-42.7	173.8	-66.6	0	0	0	0	112	M762 I768 C769 Q770 Y812	M762-C766 PolarHBondContact O-N 2.95Å; M762-C766 PolarHBondContact O-SG 2.99Å; C766-I768 VanDerWaalsContact C-N 3.35Å; C766-I768 PolarHBondContact O-N 3.36Å; C766-C769 PolarHBondContact O-N 3.17Å; C766-Q770 WeakPolarHBondContact O-CB 3.47Å; C766-Q770 PolarHBondContact O-N 3.29Å; C766-Y812 HydrophobicContact CB-CE2 4.25Å
767	L	95.3	Very high	94.3	Very high	85 Å²	85	51.9 Å²	51.9	45%	0.445	26%	0.256	S	S	.	.	H	α-helix	trans	-68.4	-31.3	178.1	-178	62.7	0	0	0	112.9	R763 A764 F765 R771	R763-L767 PolarHBondContact O-N 3.14Å; A764-L767 PolarHBondContact O-N 3.4Å; F765-L767 VanDerWaalsContact C-N 3.26Å; F765-L767 PolarHBondContact O-N 3.3Å; L767-R771 WeakPolarHBondContact O-CG 3.45Å; L767-R771 PolarHBondContact O-N 3.48Å
768	I	95.9	Very high	94.2	Very high	9 Å²	9	51.8 Å²	51.8	5%	0.046	26%	0.256	C	S	.	.	H	α-helix	trans	-69.7	-50.1	173.2	-76.7	177.8	0	0	0	110.3	Y710 L713 L717 A764 F765 C766 Q770 R771 Y772	Y710-I768 HydrophobicContact CD2-CD1 3.62Å; Y710-I768 HydrophobicContact CE2-CD1 3.4Å; Y710-I768 HydrophobicContact CE2-CG1 4.49Å; L713-I768 HydrophobicContact CB-CD1 4.31Å; L713-I768 HydrophobicContact CB-CG2 3.96Å; L713-I768 HydrophobicContact CD1-CG2 4.18Å; L717-I768 HydrophobicContact CD1-CB 4.34Å; L717-I768 HydrophobicContact CD1-CG1 4.11Å; L717-I768 HydrophobicContact CD1-CG2 4.1Å; A764-I768 PolarHBondContact O-N 3.44Å; A764-I768 VanDerWaalsContact O-N 3.13Å; F765-I768 WeakPolarHBondContact O-CB 3.36Å; F765-I768 PolarHBondContact O-N 3.46Å; C766-I768 VanDerWaalsContact C-N 3.35Å; C766-I768 PolarHBondContact O-N 3.36Å; I768-Q770 VanDerWaalsContact C-N 3.31Å; I768-Q770 PolarHBondContact O-N 2.94Å; I768-R771 WeakPolarHBondContact O-CB 3.46Å; I768-R771 PolarHBondContact O-N 2.82Å; I768-R771 VanDerWaalsContact O-N 3.09Å; I768-Y772 HydrophobicContact CG2-CD2 3.76Å; I768-Y772 HydrophobicContact CG2-CE2 3.78Å; I768-Y772 WeakPolarHBondContact O-CD2 3.48Å; I768-Y772 PolarHBondContact O-N 3.33Å
769	C	96.6	Very high	94.2	Very high	1 Å²	1	53.3 Å²	53.3	1%	0.007	27%	0.269	C	S	.	.	H	α-helix	trans	-62.7	-37.8	178.1	-63.2	0	0	0	0	111.9	F765 C766 R771 Y772 L773 A784 L788	F765-C769 WeakPolarHBondContact CE2-SG 3.4Å; F765-C769 VanDerWaalsContact CZ-SG 3.57Å; F765-C769 PolarHBondContact O-N 3.19Å; C766-C769 PolarHBondContact O-N 3.17Å; C769-R771 VanDerWaalsContact C-N 3.26Å; C769-R771 PolarHBondContact O-N 2.79Å; C769-Y772 CarbonylContact O-C 3.55Å; C769-Y772 PolarHBondContact O-N 2.82Å; C769-Y772 VanDerWaalsContact O-N 3.14Å; C769-L773 PolarHBondContact O-N 2.93Å; C769-A784 HydrophobicContact CB-CB 4.39Å; C769-L788 HydrophobicContact CB-CD1 4.01Å; C769-L788 HydrophobicContact CB-CD2 3.91Å; C769-L788 HydrophobicContact CB-CG 3.66Å
770	Q	95.7	Very high	94.2	Very high	26 Å²	26	50.8 Å²	50.8	12%	0.121	26%	0.26	C	S	.	.	H	α-helix	trans	-59.6	-35.9	174.2	-174.8	177.5	8.5	0	0	112.3	C766 I768 L773 L818 E821	C766-Q770 WeakPolarHBondContact O-CB 3.47Å; C766-Q770 PolarHBondContact O-N 3.29Å; I768-Q770 VanDerWaalsContact C-N 3.31Å; I768-Q770 PolarHBondContact O-N 2.94Å; Q770-L773 WeakPolarHBondContact O-CB 3.42Å; Q770-L818 HydrophobicContact CB-CD1 4.35Å; Q770-L818 HydrophobicContact CG-CD1 4.01Å; Q770-E821 WeakPolarHBondContact CG-OE2 3.28Å; Q770-E821 PolarHBondContact NE2-OE1 2.94Å; Q770-E821 PolarHBondContact NE2-OE2 3.32Å
771	R	95.1	Very high	94.2	Very high	149 Å²	149	46.4 Å²	46.4	56%	0.562	24%	0.241	S	C	*	.	H	α-helix	trans	-71.4	-40.3	174	-69.9	171.4	176.2	-155.8	-0.6	112.2	L717 L767 I768 C769 L773 C774	L717-R771 HydrophobicContact CD1-CB 3.98Å; L717-R771 HydrophobicContact CD2-CB 3.78Å; L767-R771 WeakPolarHBondContact O-CG 3.45Å; L767-R771 PolarHBondContact O-N 3.48Å; I768-R771 WeakPolarHBondContact O-CB 3.46Å; I768-R771 PolarHBondContact O-N 2.82Å; I768-R771 VanDerWaalsContact O-N 3.09Å; C769-R771 VanDerWaalsContact C-N 3.26Å; C769-R771 PolarHBondContact O-N 2.79Å; R771-L773 VanDerWaalsContact C-N 3.3Å; R771-L773 PolarHBondContact O-N 3.33Å; R771-C774 WeakPolarHBondContact O-CB 3.45Å; R771-C774 PolarHBondContact O-N 3.25Å; R771-C774 VanDerWaalsContact O-N 3.15Å
772	Y	96.2	Very high	94.1	Very high	15 Å²	15	46.8 Å²	46.8	6%	0.059	24%	0.243	C	C	.	.	H	α-helix	trans	-70.1	-23.2	176.5	-79.3	-61.6	0	0	0	114	L713 L717 V727 M731 I768 C769 C774 S775 V780	L713-Y772 HydrophobicContact CB-CE2 4.32Å; L713-Y772 HydrophobicContact CD2-CE2 3.79Å; L713-Y772 PolarHBondContact O-OH 3.4Å; L713-Y772 VanDerWaalsContact O-OH 3.12Å; L717-Y772 HydrophobicContact CD1-CD2 4.26Å; L717-Y772 HydrophobicContact CD1-CE2 3.88Å; L717-Y772 HydrophobicContact CD2-CD1 3.89Å; L717-Y772 HydrophobicContact CD2-CD2 4.02Å; L717-Y772 HydrophobicContact CD2-CE1 3.66Å; L717-Y772 HydrophobicContact CD2-CE2 3.81Å; L717-Y772 HydrophobicContact CD2-CG 4.07Å; L717-Y772 HydrophobicContact CG-CD2 4.2Å; L717-Y772 HydrophobicContact CG-CE1 4.12Å; L717-Y772 HydrophobicContact CG-CE2 3.59Å; V727-Y772 HydrophobicContact CB-CE1 4.49Å; V727-Y772 HydrophobicContact CG1-CD1 3.78Å; V727-Y772 HydrophobicContact CG1-CD2 4.19Å; V727-Y772 HydrophobicContact CG1-CE1 3.46Å; V727-Y772 VanDerWaalsContact CG1-CE1 3.46Å; V727-Y772 HydrophobicContact CG1-CE2 3.9Å; V727-Y772 HydrophobicContact CG1-CG 4.13Å; V727-Y772 HydrophobicContact CG2-CE1 4.18Å; M731-Y772 HydrophobicContact SD-CD2 3.91Å; M731-Y772 HydrophobicContact SD-CG 4.19Å; I768-Y772 HydrophobicContact CG2-CD2 3.76Å; I768-Y772 HydrophobicContact CG2-CE2 3.78Å; I768-Y772 WeakPolarHBondContact O-CD2 3.48Å; I768-Y772 PolarHBondContact O-N 3.33Å; C769-Y772 CarbonylContact O-C 3.55Å; C769-Y772 PolarHBondContact O-N 2.82Å; C769-Y772 VanDerWaalsContact O-N 3.14Å; Y772-C774 PolarHBondContact O-N 2.87Å; Y772-S775 WeakPolarHBondContact O-CB 3.42Å; Y772-S775 PolarHBondContact O-N 3.08Å; Y772-V780 HydrophobicContact CD1-CG1 3.64Å; Y772-V780 HydrophobicContact CE1-CG1 4.45Å; Y772-V780 HydrophobicContact CG-CG1 4.11Å
773	L	94.7	Very high	94.1	Very high	9 Å²	9	48.4 Å²	48.4	5%	0.047	25%	0.25	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59.6	-25.6	168.9	-172.8	62.9	0	0	0	112.5	C769 Q770 R771 K781 F785 L788 E821 L822 F825	C769-L773 PolarHBondContact O-N 2.93Å; Q770-L773 WeakPolarHBondContact O-CB 3.42Å; R771-L773 VanDerWaalsContact C-N 3.3Å; R771-L773 PolarHBondContact O-N 3.33Å; L773-K781 WeakPolarHBondContact O-CE 3.42Å; L773-F785 HydrophobicContact CD1-CB 3.76Å; L773-F785 HydrophobicContact CD1-CD2 4.02Å; L773-F785 HydrophobicContact CD1-CG 4.41Å; L773-L788 HydrophobicContact CB-CD1 4.45Å; L773-L788 HydrophobicContact CD2-CD1 4.15Å; L773-E821 HydrophobicContact CD2-CB 4.01Å; L773-L822 HydrophobicContact CD2-CD2 3.84Å; L773-L822 HydrophobicContact CD2-CG 4.3Å; L773-F825 HydrophobicContact CD1-CB 4.17Å; L773-F825 HydrophobicContact CD1-CD2 3.69Å; L773-F825 HydrophobicContact CD1-CE2 4.4Å; L773-F825 HydrophobicContact CD1-CG 4.06Å
774	C	89.3	Confident	94.1	Very high	93 Å²	93	42.7 Å²	42.7	63%	0.628	23%	0.229	S	C	*	.	T	Hydrogen-bonded Turn	trans	-90.6	9.1	174.1	-65.7	0	0	0	0	114	R771 Y772	R771-C774 WeakPolarHBondContact O-CB 3.45Å; R771-C774 PolarHBondContact O-N 3.25Å; R771-C774 VanDerWaalsContact O-N 3.15Å; Y772-C774 PolarHBondContact O-N 2.87Å
775	S	89.5	Confident	94.2	Very high	32 Å²	32	41.3 Å²	41.3	22%	0.224	22%	0.217	C	C	.	.			trans	-60.3	159.3	179	-175.5	0	0	0	0	112.6	Y772 N777 K781	Y772-S775 WeakPolarHBondContact O-CB 3.42Å; Y772-S775 PolarHBondContact O-N 3.08Å; S775-N777 PolarHBondContact OG-N 3.2Å; S775-K781 WeakPolarHBondContact O-CD 3.5Å; S775-K781 WeakPolarHBondContact O-CE 3.41Å; S775-K781 PolarHBondContact O-NZ 3.07Å
776	I	88.1	Confident	94.1	Very high	171 Å²	171	43.4 Å²	43.4	88%	0.877	23%	0.23	S	C	*	.	S	Bend	trans	-75.7	-32.5	169.5	-57.9	176.4	0	0	0	110
777	N	91.6	Very high	94.1	Very high	50 Å²	50	43.6 Å²	43.6	27%	0.267	23%	0.231	S	C	.	.	S	Bend	trans	-81	123.5	-176.3	-180	-72.6	0	0	0	112.1	E724 S775 A779 V780 K781	E724-N777 PolarHBondContact OE2-ND2 3.35Å; S775-N777 PolarHBondContact OG-N 3.2Å; N777-A779 PolarHBondContact OD1-N 3.19Å; N777-V780 HydrophobicContact CB-CB 4.21Å; N777-V780 HydrophobicContact CB-CG2 4.14Å; N777-V780 PolarHBondContact O-N 3.19Å; N777-V780 WeakPolarHBondContact OD1-CG2 3.46Å; N777-V780 PolarHBondContact OD1-N 3.3Å; N777-K781 VanDerWaalsContact O-CG 3.28Å; N777-K781 WeakPolarHBondContact O-CG 3.44Å; N777-K781 PolarHBondContact O-N 3.45Å
778	T	91.8	Very high	94.1	Very high	68 Å²	68	39.6 Å²	39.6	42%	0.417	21%	0.211	S	C	.	.	H	α-helix	trans	-61.8	-46.3	-177	-55.8	0	0	0	0	113.6	V780 K781 E782	T778-V780 VanDerWaalsContact C-N 3.31Å; T778-V780 PolarHBondContact O-N 2.85Å; T778-K781 WeakPolarHBondContact O-CA 3.2Å; T778-K781 WeakPolarHBondContact O-CB 3.2Å; T778-K781 PolarHBondContact O-N 2.85Å; T778-E782 HydrophobicContact CG2-CG 4.19Å; T778-E782 WeakPolarHBondContact O-CG 3.3Å; T778-E782 PolarHBondContact O-N 3.47Å
779	A	92	Very high	94.2	Very high	34 Å²	34	39.3 Å²	39.3	28%	0.281	21%	0.209	S	C	.	.	H	α-helix	trans	-62.3	-38.8	-178.5	0	0	0	0	0	112.2	I728 N777 E782 Q783	I728-A779 HydrophobicContact CD1-CB 3.89Å; N777-A779 PolarHBondContact OD1-N 3.19Å; A779-E782 WeakPolarHBondContact CA-OE2 3.39Å; A779-E782 PolarHBondContact O-N 2.94Å; A779-Q783 WeakPolarHBondContact O-CB 3.49Å; A779-Q783 PolarHBondContact O-N 2.99Å
780	V	95.4	Very high	94.1	Very high	5 Å²	5	39.7 Å²	39.7	3%	0.03	21%	0.211	C	C	.	.	H	α-helix	trans	-63.4	-39.8	173	173.4	0	0	0	0	111.5	E724 V727 I728 M731 Y772 N777 T778 A784	E724-V780 HydrophobicContact CB-CG2 3.84Å; V727-V780 HydrophobicContact CB-CG2 4.46Å; V727-V780 HydrophobicContact CG1-CG1 3.91Å; V727-V780 HydrophobicContact CG1-CG2 4.38Å; I728-V780 HydrophobicContact CD1-CG2 4.37Å; I728-V780 HydrophobicContact CG1-CG2 4.19Å; M731-V780 HydrophobicContact CE-CG1 4.3Å; Y772-V780 HydrophobicContact CD1-CG1 3.64Å; Y772-V780 HydrophobicContact CE1-CG1 4.45Å; Y772-V780 HydrophobicContact CG-CG1 4.11Å; N777-V780 HydrophobicContact CB-CB 4.21Å; N777-V780 HydrophobicContact CB-CG2 4.14Å; N777-V780 PolarHBondContact O-N 3.19Å; N777-V780 WeakPolarHBondContact OD1-CG2 3.46Å; N777-V780 PolarHBondContact OD1-N 3.3Å; T778-V780 VanDerWaalsContact C-N 3.31Å; T778-V780 PolarHBondContact O-N 2.85Å; V780-A784 VanDerWaalsContact O-CB 3.27Å; V780-A784 WeakPolarHBondContact O-CB 3.22Å; V780-A784 PolarHBondContact O-N 3.26Å
781	K	94.5	Very high	94	Very high	55 Å²	55	38.6 Å²	38.6	24%	0.239	21%	0.206	C	C	.	.	H	α-helix	trans	-66.2	-46.9	176.5	-62.4	163.7	103.4	146.4	0	111.7	L773 S775 N777 T778 Q783 A784 F785 F825	L773-K781 WeakPolarHBondContact O-CE 3.42Å; S775-K781 WeakPolarHBondContact O-CD 3.5Å; S775-K781 WeakPolarHBondContact O-CE 3.41Å; S775-K781 PolarHBondContact O-NZ 3.07Å; N777-K781 VanDerWaalsContact O-CG 3.28Å; N777-K781 WeakPolarHBondContact O-CG 3.44Å; N777-K781 PolarHBondContact O-N 3.45Å; T778-K781 WeakPolarHBondContact O-CA 3.2Å; T778-K781 WeakPolarHBondContact O-CB 3.2Å; T778-K781 PolarHBondContact O-N 2.85Å; K781-Q783 PolarHBondContact O-N 3.49Å; K781-A784 PolarHBondContact O-N 3.34Å; K781-F785 WeakPolarHBondContact O-CB 3.45Å; K781-F785 PolarHBondContact O-N 2.82Å; K781-F825 HydrophobicContact CB-CD2 4.36Å; K781-F825 HydrophobicContact CB-CE2 3.93Å
782	E	94	Very high	94.1	Very high	27 Å²	27	31.5 Å²	31.5	13%	0.126	18%	0.179	C	C	.	.	H	α-helix	trans	-61.4	-42.9	178.5	-68.1	170.4	123.9	0	0	111.6	T778 A779 F785 T786 F825 K857 L861	T778-E782 HydrophobicContact CG2-CG 4.19Å; T778-E782 WeakPolarHBondContact O-CG 3.3Å; T778-E782 PolarHBondContact O-N 3.47Å; A779-E782 WeakPolarHBondContact CA-OE2 3.39Å; A779-E782 PolarHBondContact O-N 2.94Å; E782-F785 PolarHBondContact O-N 2.87Å; E782-T786 WeakPolarHBondContact O-CB 3.31Å; E782-T786 PolarHBondContact O-N 3.12Å; E782-T786 PolarHBondContact O-OG1 3.35Å; E782-F825 HydrophobicContact CB-CZ 4.42Å; E782-F825 HydrophobicContact CG-CE2 4.33Å; E782-F825 HydrophobicContact CG-CZ 3.95Å; E782-K857 WeakPolarHBondContact OE1-CE 3.35Å; E782-K857 IonicContact OE1-NZ 4Å; E782-K857 PolarHBondContact OE1-NZ 3.41Å; E782-K857 WeakPolarHBondContact OE2-CE 3.37Å; E782-K857 IonicContact OE2-NZ 2.92Å; E782-K857 PolarHBondContact OE2-NZ 3.25Å; E782-L861 HydrophobicContact CG-CD1 4.34Å
783	Q	95.3	Very high	94	Very high	34 Å²	34	31.7 Å²	31.7	16%	0.159	18%	0.181	C	C	.	.	H	α-helix	trans	-66.1	-43.5	177	-175.7	60.7	83.7	0	0	111.8	I728 M731 Q732 A779 K781 V787	I728-Q783 HydrophobicContact CB-CG 4.46Å; I728-Q783 HydrophobicContact CG1-CB 4.22Å; I728-Q783 HydrophobicContact CG1-CG 4.41Å; I728-Q783 HydrophobicContact CG2-CG 4.11Å; M731-Q783 HydrophobicContact CE-CB 3.97Å; M731-Q783 HydrophobicContact CE-CG 3.85Å; Q732-Q783 HydrophobicContact CG-CG 4.45Å; A779-Q783 WeakPolarHBondContact O-CB 3.49Å; A779-Q783 PolarHBondContact O-N 2.99Å; K781-Q783 PolarHBondContact O-N 3.49Å; Q783-V787 WeakPolarHBondContact O-CB 3.26Å; Q783-V787 WeakPolarHBondContact O-CG2 3.14Å; Q783-V787 PolarHBondContact O-N 2.84Å; Q783-V787 VanDerWaalsContact O-N 3.17Å
784	A	97.1	Very high	94	Very high	0 Å²	0	33.4 Å²	33.4	0%	0	19%	0.19	C	C	.	.	H	α-helix	trans	-64.7	-41.6	176.2	0	0	0	0	0	111.9	M731 C769 V780 K781 L788	M731-A784 HydrophobicContact CE-CB 4.04Å; M731-A784 HydrophobicContact SD-CB 3.95Å; C769-A784 HydrophobicContact CB-CB 4.39Å; V780-A784 VanDerWaalsContact O-CB 3.27Å; V780-A784 WeakPolarHBondContact O-CB 3.22Å; V780-A784 PolarHBondContact O-N 3.26Å; K781-A784 PolarHBondContact O-N 3.34Å; A784-L788 VanDerWaalsContact O-CB 3.3Å; A784-L788 WeakPolarHBondContact O-CB 3.33Å; A784-L788 WeakPolarHBondContact O-CD1 3.15Å; A784-L788 WeakPolarHBondContact O-CG 3.27Å; A784-L788 PolarHBondContact O-N 2.79Å
785	F	97.4	Very high	94.2	Very high	0 Å²	0	29 Å²	29	0%	0	16%	0.16	C	C	.	.	H	α-helix	trans	-61.7	-48.3	177	178	-92.4	0	0	0	112.3	L773 K781 E782 L788 C789 L822 F825 I826 L861 Y865	L773-F785 HydrophobicContact CD1-CB 3.76Å; L773-F785 HydrophobicContact CD1-CD2 4.02Å; L773-F785 HydrophobicContact CD1-CG 4.41Å; K781-F785 WeakPolarHBondContact O-CB 3.45Å; K781-F785 PolarHBondContact O-N 2.82Å; E782-F785 PolarHBondContact O-N 2.87Å; F785-L788 PolarHBondContact O-N 3.03Å; F785-C789 VanDerWaalsContact CE1-SG 3.55Å; F785-C789 VanDerWaalsContact CZ-SG 3.54Å; F785-C789 PolarHBondContact O-N 3.49Å; F785-C789 PolarHBondContact O-SG 3.43Å; F785-L822 HydrophobicContact CD2-CD2 3.45Å; F785-L822 VanDerWaalsContact CD2-CD2 3.45Å; F785-L822 HydrophobicContact CE2-CB 4.05Å; F785-L822 HydrophobicContact CE2-CD2 3.58Å; F785-L822 HydrophobicContact CE2-CG 4.44Å; F785-L822 WeakPolarHBondContact CE2-O 3.4Å; F785-L822 HydrophobicContact CG-CD2 4.44Å; F785-F825 HydrophobicContact CB-CD1 4.13Å; F785-F825 HydrophobicContact CB-CD2 4.23Å; F785-F825 HydrophobicContact CB-CE1 3.89Å; F785-F825 HydrophobicContact CB-CE2 3.98Å; F785-F825 HydrophobicContact CB-CG 4.3Å; F785-F825 HydrophobicContact CB-CZ 3.82Å; F785-F825 AromaticContact CD1-CD1 3.85Å; F785-F825 HydrophobicContact CD1-CD1 3.85Å; F785-F825 AromaticContact CD1-CE1 3.49Å; F785-F825 HydrophobicContact CD1-CE1 3.49Å; F785-F825 VanDerWaalsContact CD1-CE1 3.49Å; F785-F825 HydrophobicContact CD1-CZ 4.15Å; F785-F825 HydrophobicContact CD2-CB 3.9Å; F785-F825 AromaticContact CD2-CD1 3.15Å; F785-F825 HydrophobicContact CD2-CD1 3.15Å; F785-F825 HydrophobicContact CD2-CD2 4.21Å; F785-F825 AromaticContact CD2-CE1 3.68Å; F785-F825 HydrophobicContact CD2-CE1 3.68Å; F785-F825 AromaticContact CD2-CG 3.48Å; F785-F825 HydrophobicContact CD2-CG 3.48Å; F785-F825 VanDerWaalsContact CD2-CG 3.48Å; F785-F825 HydrophobicContact CD2-CZ 4.38Å; F785-F825 HydrophobicContact CE1-CD1 4.03Å; F785-F825 AromaticContact CE1-CE1 3.89Å; F785-F825 HydrophobicContact CE1-CE1 3.89Å; F785-F825 HydrophobicContact CE2-CB 4.14Å; F785-F825 AromaticContact CE2-CD1 3.37Å; F785-F825 HydrophobicContact CE2-CD1 3.37Å; F785-F825 HydrophobicContact CE2-CE1 4.06Å; F785-F825 AromaticContact CE2-CG 3.97Å; F785-F825 HydrophobicContact CE2-CG 3.97Å; F785-F825 AromaticContact CG-CD1 3.41Å; F785-F825 HydrophobicContact CG-CD1 3.41Å; F785-F825 VanDerWaalsContact CG-CD1 3.41Å; F785-F825 HydrophobicContact CG-CD2 4.35Å; F785-F825 AromaticContact CG-CE1 3.37Å; F785-F825 HydrophobicContact CG-CE1 3.37Å; F785-F825 HydrophobicContact CG-CE2 4.3Å; F785-F825 AromaticContact CG-CG 3.94Å; F785-F825 HydrophobicContact CG-CG 3.94Å; F785-F825 AromaticContact CG-CZ 3.85Å; F785-F825 HydrophobicContact CG-CZ 3.85Å; F785-F825 AromaticContact CZ-CD1 3.81Å; F785-F825 HydrophobicContact CZ-CD1 3.81Å; F785-F825 HydrophobicContact CZ-CE1 4.16Å; F785-I826 HydrophobicContact CE1-CD1 3.99Å; F785-I826 HydrophobicContact CE2-CD1 4.33Å; F785-I826 HydrophobicContact CE2-CG1 4.11Å; F785-I826 HydrophobicContact CZ-CD1 3.53Å; F785-I826 HydrophobicContact CZ-CG1 3.7Å; F785-L861 HydrophobicContact CD1-CD2 3.65Å; F785-L861 HydrophobicContact CE1-CB 4.35Å; F785-L861 HydrophobicContact CE1-CD2 4.12Å; F785-Y865 HydrophobicContact CE2-CD2 4.43Å; F785-Y865 HydrophobicContact CZ-CD2 4.24Å
786	T	94.8	Very high	94.5	Very high	47 Å²	47	27.6 Å²	27.6	29%	0.288	15%	0.15	S	C	.	.	H	α-helix	trans	-61.8	-53.2	-178.3	-54.5	0	0	0	0	109.9	E782 L788 C789 D790	E782-T786 WeakPolarHBondContact O-CB 3.31Å; E782-T786 PolarHBondContact O-N 3.12Å; E782-T786 PolarHBondContact O-OG1 3.35Å; T786-L788 VanDerWaalsContact C-N 3.3Å; T786-L788 PolarHBondContact O-N 2.99Å; T786-C789 WeakPolarHBondContact O-CB 3.33Å; T786-C789 PolarHBondContact O-N 3.27Å; T786-D790 PolarHBondContact O-N 2.81Å
787	V	95.1	Very high	94.7	Very high	5 Å²	5	23 Å²	23	3%	0.03	13%	0.125	C	C	.	.	H	α-helix	trans	-59.2	-38.1	176.9	165.3	0	0	0	0	112.3	H735 F765 Q783 V791	H735-V787 HydrophobicContact CB-CG1 4.05Å; H735-V787 HydrophobicContact CB-CG2 4.25Å; F765-V787 HydrophobicContact CE1-CG1 3.51Å; F765-V787 HydrophobicContact CZ-CG1 3.59Å; Q783-V787 WeakPolarHBondContact O-CB 3.26Å; Q783-V787 WeakPolarHBondContact O-CG2 3.14Å; Q783-V787 PolarHBondContact O-N 2.84Å; Q783-V787 VanDerWaalsContact O-N 3.17Å; V787-V791 HydrophobicContact CG1-CG2 4.21Å; V787-V791 VanDerWaalsContact O-CB 3.3Å; V787-V791 WeakPolarHBondContact O-CB 3.07Å; V787-V791 WeakPolarHBondContact O-CG2 3.49Å; V787-V791 PolarHBondContact O-N 3.38Å
788	L	96.9	Very high	94.6	Very high	2 Å²	2	24.2 Å²	24.2	1%	0.01	13%	0.129	C	C	.	.	H	α-helix	trans	-62.2	-46	172.7	-81.3	166	0	0	0	111.5	C769 L773 A784 F785 T786 D790 L792 L818 L822	C769-L788 HydrophobicContact CB-CD1 4.01Å; C769-L788 HydrophobicContact CB-CD2 3.91Å; C769-L788 HydrophobicContact CB-CG 3.66Å; L773-L788 HydrophobicContact CB-CD1 4.45Å; L773-L788 HydrophobicContact CD2-CD1 4.15Å; A784-L788 VanDerWaalsContact O-CB 3.3Å; A784-L788 WeakPolarHBondContact O-CB 3.33Å; A784-L788 WeakPolarHBondContact O-CD1 3.15Å; A784-L788 WeakPolarHBondContact O-CG 3.27Å; A784-L788 PolarHBondContact O-N 2.79Å; F785-L788 PolarHBondContact O-N 3.03Å; T786-L788 VanDerWaalsContact C-N 3.3Å; T786-L788 PolarHBondContact O-N 2.99Å; L788-D790 PolarHBondContact O-N 3.33Å; L788-L792 WeakPolarHBondContact O-CB 3.34Å; L788-L792 WeakPolarHBondContact O-CG 3.01Å; L788-L792 PolarHBondContact O-N 2.91Å; L788-L818 HydrophobicContact CD1-CD1 4.15Å; L788-L818 HydrophobicContact CD2-CD1 4.35Å; L788-L822 HydrophobicContact CB-CD2 4.14Å; L788-L822 HydrophobicContact CD1-CD2 4.17Å
789	C	96.8	Very high	94.4	Very high	2 Å²	2	21.5 Å²	21.5	1%	0.014	11%	0.112	C	C	.	.	H	α-helix	trans	-60.4	-45.5	179.1	-67.6	0	0	0	0	111.8	F785 T786 L792 L793 A864 L868	F785-C789 VanDerWaalsContact CE1-SG 3.55Å; F785-C789 VanDerWaalsContact CZ-SG 3.54Å; F785-C789 PolarHBondContact O-N 3.49Å; F785-C789 PolarHBondContact O-SG 3.43Å; T786-C789 WeakPolarHBondContact O-CB 3.33Å; T786-C789 PolarHBondContact O-N 3.27Å; C789-L792 PolarHBondContact O-N 2.95Å; C789-L793 WeakPolarHBondContact O-CB 3.39Å; C789-L793 PolarHBondContact O-N 3.4Å; C789-A864 HydrophobicContact CB-CB 3.9Å; C789-L868 HydrophobicContact CB-CD1 4.35Å
790	D	94.4	Very high	94.2	Very high	10 Å²	10	22.7 Å²	22.7	5%	0.053	11%	0.112	C	C	.	.	H	α-helix	trans	-72.2	-41.4	-178.1	-61.2	-47.9	0	0	0	111.9	T786 L788 L792 L793 I794 K867	T786-D790 PolarHBondContact O-N 2.81Å; L788-D790 PolarHBondContact O-N 3.33Å; D790-L792 PolarHBondContact O-N 3.4Å; D790-L793 PolarHBondContact O-N 2.66Å; D790-I794 VanDerWaalsContact O-CB 3.32Å; D790-I794 WeakPolarHBondContact O-CB 3.4Å; D790-I794 WeakPolarHBondContact O-CD1 3.41Å; D790-I794 WeakPolarHBondContact O-CG1 3.49Å; D790-I794 PolarHBondContact O-N 2.81Å; D790-K867 IonicContact OD1-NZ 2.81Å
791	V	94.8	Very high	93.7	Very high	3 Å²	3	24.7 Å²	24.7	2%	0.018	13%	0.127	C	C	.	.	H	α-helix	trans	-63	-41.9	173.5	173.5	0	0	0	0	111.5	H735 M762 F765 V787 L793 F795	H735-V791 VanDerWaalsContact ND1-CG2 3.33Å; H735-V791 WeakPolarHBondContact ND1-CG2 3.15Å; M762-V791 HydrophobicContact CG-CG1 4.13Å; F765-V791 HydrophobicContact CE1-CG2 4.44Å; V787-V791 HydrophobicContact CG1-CG2 4.21Å; V787-V791 VanDerWaalsContact O-CB 3.3Å; V787-V791 WeakPolarHBondContact O-CB 3.07Å; V787-V791 WeakPolarHBondContact O-CG2 3.49Å; V787-V791 PolarHBondContact O-N 3.38Å; V791-L793 VanDerWaalsContact C-N 3.34Å; V791-L793 PolarHBondContact O-N 3.17Å; V791-F795 HydrophobicContact CG1-CD2 3.88Å; V791-F795 HydrophobicContact CG1-CE2 4.4Å; V791-F795 WeakPolarHBondContact O-CB 3.43Å; V791-F795 WeakPolarHBondContact O-CD2 3.42Å; V791-F795 PolarHBondContact O-N 3.02Å
792	L	96.1	Very high	93	Very high	0 Å²	0	28 Å²	28	0%	0	16%	0.157	C	C	.	.	H	α-helix	trans	-65.1	-36.4	176.8	-72.4	175	0	0	0	112.3	L788 C789 D790 S796 Y812 P814 L818 L822 L868 V873	L788-L792 WeakPolarHBondContact O-CB 3.34Å; L788-L792 WeakPolarHBondContact O-CG 3.01Å; L788-L792 PolarHBondContact O-N 2.91Å; C789-L792 PolarHBondContact O-N 2.95Å; D790-L792 PolarHBondContact O-N 3.4Å; L792-S796 VanDerWaalsContact O-CB 3.31Å; L792-S796 WeakPolarHBondContact O-CB 3.43Å; L792-S796 PolarHBondContact O-N 3.32Å; L792-S796 VanDerWaalsContact O-N 3.17Å; L792-Y812 HydrophobicContact CD2-CD1 3.45Å; L792-Y812 VanDerWaalsContact CD2-CD1 3.45Å; L792-Y812 HydrophobicContact CD2-CE1 3.6Å; L792-P814 HydrophobicContact CD1-CB 4.11Å; L792-P814 HydrophobicContact CD1-CG 4.36Å; L792-P814 HydrophobicContact CD2-CB 3.88Å; L792-P814 HydrophobicContact CD2-CG 4.17Å; L792-L818 HydrophobicContact CD1-CD2 4.26Å; L792-L818 HydrophobicContact CD2-CD2 4.3Å; L792-L822 HydrophobicContact CD1-CD1 3.58Å; L792-L868 HydrophobicContact CB-CD2 4.02Å; L792-L868 HydrophobicContact CD1-CD1 4.39Å; L792-V873 HydrophobicContact CB-CG1 4.11Å; L792-V873 WeakPolarHBondContact O-CG1 3.32Å
793	L	95.1	Very high	92.2	Very high	18 Å²	18	29.7 Å²	29.7	9%	0.094	18%	0.181	C	C	.	.	H	α-helix	trans	-70.8	-48	176.7	-174.6	62.2	0	0	0	111.6	C789 D790 V791 S796 K867 L868 Y871 V873	C789-L793 WeakPolarHBondContact O-CB 3.39Å; C789-L793 PolarHBondContact O-N 3.4Å; D790-L793 PolarHBondContact O-N 2.66Å; V791-L793 VanDerWaalsContact C-N 3.34Å; V791-L793 PolarHBondContact O-N 3.17Å; L793-S796 VanDerWaalsContact O-CB 3.23Å; L793-S796 WeakPolarHBondContact O-CB 3.48Å; L793-S796 PolarHBondContact O-N 3.05Å; L793-S796 PolarHBondContact O-OG 2.93Å; L793-K867 HydrophobicContact CD2-CB 4.08Å; L793-K867 HydrophobicContact CD2-CD 3.85Å; L793-K867 HydrophobicContact CD2-CG 4.48Å; L793-L868 HydrophobicContact CB-CD2 4.13Å; L793-Y871 HydrophobicContact CD1-CD2 3.81Å; L793-Y871 HydrophobicContact CD1-CG 3.91Å; L793-V873 HydrophobicContact CD1-CG2 4.21Å
794	I	93.4	Very high	91.7	Very high	46 Å²	46	33.1 Å²	33.1	24%	0.236	19%	0.193	C	C	.	.	H	α-helix	trans	-65.8	-44.6	-178	-69	166.9	0	0	0	111.5	L739 L742 D790 S796 I799	L739-I794 HydrophobicContact CD1-CD1 4.3Å; L739-I794 HydrophobicContact CD2-CD1 3.73Å; L739-I794 HydrophobicContact CD2-CG2 4.13Å; L742-I794 HydrophobicContact CD2-CG2 3.51Å; D790-I794 VanDerWaalsContact O-CB 3.32Å; D790-I794 WeakPolarHBondContact O-CB 3.4Å; D790-I794 WeakPolarHBondContact O-CD1 3.41Å; D790-I794 WeakPolarHBondContact O-CG1 3.49Å; D790-I794 PolarHBondContact O-N 2.81Å; I794-S796 VanDerWaalsContact C-N 3.3Å; I794-S796 PolarHBondContact O-N 3.18Å; I794-I799 WeakPolarHBondContact O-CB 3.36Å
795	F	94.9	Very high	91.2	Very high	0 Å²	0	40.2 Å²	40.2	0%	0	23%	0.226	C	C	.	.	T	Hydrogen-bonded Turn	trans	-90	13.7	178	-68	-92.9	0	0	0	113.5	V738 L739 L742 L758 M762 V791 I799 L810 V811 Y812	V738-F795 HydrophobicContact CG1-CE2 3.69Å; V738-F795 HydrophobicContact CG1-CZ 3.63Å; L739-F795 HydrophobicContact CD2-CE2 4.39Å; L742-F795 HydrophobicContact CB-CZ 4.17Å; L742-F795 HydrophobicContact CD1-CE1 4.39Å; L742-F795 HydrophobicContact CD2-CE1 4.17Å; L742-F795 HydrophobicContact CD2-CE2 4.18Å; L742-F795 HydrophobicContact CD2-CZ 3.81Å; L742-F795 HydrophobicContact CG-CZ 4.42Å; L758-F795 HydrophobicContact CD1-CE1 4.49Å; L758-F795 HydrophobicContact CD1-CZ 4.26Å; L758-F795 HydrophobicContact CG-CE1 4.5Å; M762-F795 HydrophobicContact CB-CZ 4.48Å; M762-F795 HydrophobicContact CE-CB 4.29Å; M762-F795 HydrophobicContact CE-CD1 3.72Å; M762-F795 HydrophobicContact CE-CE1 4.31Å; M762-F795 HydrophobicContact CE-CG 4.12Å; M762-F795 HydrophobicContact CG-CD1 4.15Å; M762-F795 HydrophobicContact CG-CD2 4.13Å; M762-F795 HydrophobicContact CG-CE1 4.22Å; M762-F795 HydrophobicContact CG-CE2 4.21Å; M762-F795 HydrophobicContact CG-CG 4.1Å; M762-F795 HydrophobicContact CG-CZ 4.25Å; V791-F795 HydrophobicContact CG1-CD2 3.88Å; V791-F795 HydrophobicContact CG1-CE2 4.4Å; V791-F795 WeakPolarHBondContact O-CB 3.43Å; V791-F795 WeakPolarHBondContact O-CD2 3.42Å; V791-F795 PolarHBondContact O-N 3.02Å; F795-I799 HydrophobicContact CD1-CD1 4.12Å; F795-L810 HydrophobicContact CD1-CB 4.07Å; F795-L810 HydrophobicContact CE1-CB 4.32Å; F795-L810 HydrophobicContact CE1-CD1 4.34Å; F795-V811 WeakPolarHBondContact O-CA 3.24Å; F795-Y812 PolarHBondContact O-N 3.36Å
796	S	94.6	Very high	90.6	Very high	2 Å²	2	44.6 Å²	44.6	1%	0.014	25%	0.246	C	C	.	.	S	Bend	trans	-66.6	177	172.5	72.4	0	0	0	0	112.3	L792 L793 I794 Q798 I799	L792-S796 VanDerWaalsContact O-CB 3.31Å; L792-S796 WeakPolarHBondContact O-CB 3.43Å; L792-S796 PolarHBondContact O-N 3.32Å; L792-S796 VanDerWaalsContact O-N 3.17Å; L793-S796 VanDerWaalsContact O-CB 3.23Å; L793-S796 WeakPolarHBondContact O-CB 3.48Å; L793-S796 PolarHBondContact O-N 3.05Å; L793-S796 PolarHBondContact O-OG 2.93Å; I794-S796 VanDerWaalsContact C-N 3.3Å; I794-S796 PolarHBondContact O-N 3.18Å; S796-Q798 PolarHBondContact O-N 3.31Å; S796-Q798 WeakPolarHBondContact OG-CB 3.36Å; S796-Q798 PolarHBondContact OG-N 2.76Å; S796-I799 WeakPolarHBondContact O-CB 3.4Å; S796-I799 VanDerWaalsContact O-CG2 3.25Å; S796-I799 WeakPolarHBondContact O-CG2 3.47Å; S796-I799 PolarHBondContact O-N 2.71Å
797	H	91.7	Very high	90.3	Very high	76 Å²	76	42.4 Å²	42.4	35%	0.352	23%	0.233	S	C	.	.	G	3₁₀ helix	trans	-56.8	-18.5	171	66.3	-91	0	0	0	113.9	I799 M800 Y871 N872	H797-I799 PolarHBondContact O-N 2.89Å; H797-M800 PolarHBondContact O-N 3.16Å; H797-Y871 PolarHBondContact CE1-O 3.27Å; H797-N872 PolarHBondContact CE1-O 2.84Å
798	Q	89.8	Confident	90.1	Very high	75 Å²	75	47.8 Å²	47.8	35%	0.35	26%	0.258	S	S	.	.	G	3₁₀ helix	trans	-69.4	-16.1	175.7	-62.2	-63.4	-25.5	0	0	113.5	S796 M800 S801 Y871	S796-Q798 PolarHBondContact O-N 3.31Å; S796-Q798 WeakPolarHBondContact OG-CB 3.36Å; S796-Q798 PolarHBondContact OG-N 2.76Å; Q798-M800 PolarHBondContact O-N 3.45Å; Q798-S801 WeakPolarHBondContact O-CB 3.44Å; Q798-S801 PolarHBondContact O-N 2.68Å; Q798-S801 PolarHBondContact O-OG 3.29Å; Q798-S801 PolarHBondContact OE1-OG 3.06Å; Q798-Y871 HydrophobicContact CG-CD1 4.49Å
799	I	88.7	Confident	89.7	Confident	10 Å²	10	51.2 Å²	51.2	5%	0.051	28%	0.276	C	S	.	.	G	3₁₀ helix	trans	-59.8	-29.8	176.3	-156.1	174.2	0	0	0	112.4	L742 I794 F795 S796 H797 S801 R804 L807 L810 V811	L742-I799 HydrophobicContact CD1-CD1 3.87Å; L742-I799 HydrophobicContact CD2-CD1 4.1Å; I794-I799 WeakPolarHBondContact O-CB 3.36Å; F795-I799 HydrophobicContact CD1-CD1 4.12Å; S796-I799 WeakPolarHBondContact O-CB 3.4Å; S796-I799 VanDerWaalsContact O-CG2 3.25Å; S796-I799 WeakPolarHBondContact O-CG2 3.47Å; S796-I799 PolarHBondContact O-N 2.71Å; H797-I799 PolarHBondContact O-N 2.89Å; I799-S801 VanDerWaalsContact C-N 3.33Å; I799-R804 WeakPolarHBondContact O-CB 3.41Å; I799-R804 PolarHBondContact O-NE 2.89Å; I799-L807 HydrophobicContact CD1-CB 4.43Å; I799-L807 HydrophobicContact CD1-CD1 4.31Å; I799-L807 HydrophobicContact CG1-CB 4.31Å; I799-L807 HydrophobicContact CG1-CD1 3.96Å; I799-L807 HydrophobicContact CG2-CB 4.3Å; I799-L810 HydrophobicContact CD1-CB 4.38Å; I799-L810 HydrophobicContact CD1-CD1 4.43Å; I799-V811 HydrophobicContact CG2-CG2 3.7Å
800	M	87.3	Confident	89.5	Confident	59 Å²	59	51.1 Å²	51.1	29%	0.291	28%	0.275	S	S	.	.	G	3₁₀ helix	trans	-78	-15.9	178.1	-65.4	169.2	67.2	0	0	113.4	H797 Q798 R804 E808 V811	H797-M800 PolarHBondContact O-N 3.16Å; Q798-M800 PolarHBondContact O-N 3.45Å; M800-R804 PolarHBondContact O-N 2.9Å; M800-R804 VanDerWaalsContact O-N 3.07Å; M800-E808 HydrophobicContact CE-CB 3.8Å; M800-E808 HydrophobicContact CE-CG 3.93Å; M800-E808 HydrophobicContact CG-CB 4.3Å; M800-E808 HydrophobicContact SD-CB 3.82Å; M800-E808 HydrophobicContact SD-CG 3.97Å; M800-V811 HydrophobicContact CG-CG2 4.24Å; M800-V811 HydrophobicContact SD-CG2 3.97Å
801	S	84.8	Confident	89.5	Confident	48 Å²	48	52.1 Å²	52.1	34%	0.336	28%	0.282	S	S	.	.	G	3₁₀ helix	trans	-59.7	155.2	-178.4	-66.3	0	0	0	0	111.7	Q798 I799 G803 R804	Q798-S801 WeakPolarHBondContact O-CB 3.44Å; Q798-S801 PolarHBondContact O-N 2.68Å; Q798-S801 PolarHBondContact O-OG 3.29Å; Q798-S801 PolarHBondContact OE1-OG 3.06Å; I799-S801 VanDerWaalsContact C-N 3.33Å; S801-G803 VanDerWaalsContact C-N 3.29Å; S801-G803 PolarHBondContact O-N 3.29Å; S801-R804 PolarHBondContact O-NE 2.98Å
802	S	80.3	Confident	89.5	Confident	125 Å²	125	53.9 Å²	53.9	87%	0.874	29%	0.288	S	S	*	.	G	3₁₀ helix	trans	61.6	29	-175	-54.8	0	0	0	0	115
803	G	77.1	Confident	89.4	Confident	62 Å²	62	59 Å²	59	64%	0.639	32%	0.319	S	S	*	.	G	3₁₀ helix	trans	90.1	13.5	171.9	0	0	0	0	0	115.2	S801 E805	S801-G803 VanDerWaalsContact C-N 3.29Å; S801-G803 PolarHBondContact O-N 3.29Å; G803-E805 PolarHBondContact O-N 3.07Å; G803-E805 VanDerWaalsContact O-N 3.14Å
804	R	85.1	Confident	89.5	Confident	105 Å²	105	58.3 Å²	58.3	40%	0.396	32%	0.316	S	S	.	.			trans	-86.5	39.2	-180	-67.2	-173.9	-69.8	-163.2	-0.8	112.9	I799 M800 S801 H806 L807	I799-R804 WeakPolarHBondContact O-CB 3.41Å; I799-R804 PolarHBondContact O-NE 2.89Å; M800-R804 PolarHBondContact O-N 2.9Å; M800-R804 VanDerWaalsContact O-N 3.07Å; S801-R804 PolarHBondContact O-NE 2.98Å; R804-H806 PolarHBondContact O-N 2.75Å; R804-L807 HydrophobicContact CB-CD1 4.02Å; R804-L807 HydrophobicContact CB-CG 4.3Å; R804-L807 WeakPolarHBondContact O-CB 3.5Å; R804-L807 PolarHBondContact O-N 3.14Å
805	E	86.3	Confident	89.5	Confident	149 Å²	149	60.2 Å²	60.2	70%	0.696	33%	0.327	S	S	*	.	G	3₁₀ helix	trans	-54.9	-29.6	-177.7	-64.3	-179.8	176.2	0	0	113.2	G803 L807 E808	G803-E805 PolarHBondContact O-N 3.07Å; G803-E805 VanDerWaalsContact O-N 3.14Å; E805-L807 PolarHBondContact O-N 3.28Å; E805-L807 VanDerWaalsContact O-N 3.13Å; E805-E808 VanDerWaalsContact O-CB 3.26Å; E805-E808 WeakPolarHBondContact O-CB 3.3Å; E805-E808 PolarHBondContact O-N 2.85Å
806	H	84.9	Confident	89.5	Confident	93 Å²	93	65.3 Å²	65.3	43%	0.431	36%	0.362	S	S	.	.	G	3₁₀ helix	trans	-61.9	-18.8	176.2	65	-89.9	0	0	0	113.9	R804	R804-H806 PolarHBondContact O-N 2.75Å
807	L	88.9	Confident	89.5	Confident	0 Å²	0	68 Å²	68	0%	0	38%	0.381	C	S	.	.	G	3₁₀ helix	trans	-87.5	-0.9	175.5	-55	-177.5	0	0	0	113.9	L742 V745 L755 I799 R804 E805 N809 L810	L742-L807 HydrophobicContact CD1-CD1 4.49Å; V745-L807 HydrophobicContact CG1-CD2 3.95Å; L755-L807 HydrophobicContact CD2-CD2 4.2Å; I799-L807 HydrophobicContact CD1-CB 4.43Å; I799-L807 HydrophobicContact CD1-CD1 4.31Å; I799-L807 HydrophobicContact CG1-CB 4.31Å; I799-L807 HydrophobicContact CG1-CD1 3.96Å; I799-L807 HydrophobicContact CG2-CB 4.3Å; R804-L807 HydrophobicContact CB-CD1 4.02Å; R804-L807 HydrophobicContact CB-CG 4.3Å; R804-L807 WeakPolarHBondContact O-CB 3.5Å; R804-L807 PolarHBondContact O-N 3.14Å; E805-L807 PolarHBondContact O-N 3.28Å; E805-L807 VanDerWaalsContact O-N 3.13Å; L807-N809 PolarHBondContact O-N 3.47Å; L807-L810 HydrophobicContact CD2-CD1 4Å; L807-L810 WeakPolarHBondContact O-CB 3.24Å; L807-L810 PolarHBondContact O-N 3.29Å
808	E	90	Very high	89.7	Confident	119 Å²	119	64.4 Å²	64.4	56%	0.556	37%	0.365	S	S	*	.	G	3₁₀ helix	trans	-44.6	-39.7	173.4	179.7	-168	-143.6	0	0	112.3	M800 E805 L810 V811	M800-E808 HydrophobicContact CE-CB 3.8Å; M800-E808 HydrophobicContact CE-CG 3.93Å; M800-E808 HydrophobicContact CG-CB 4.3Å; M800-E808 HydrophobicContact SD-CB 3.82Å; M800-E808 HydrophobicContact SD-CG 3.97Å; E805-E808 VanDerWaalsContact O-CB 3.26Å; E805-E808 WeakPolarHBondContact O-CB 3.3Å; E805-E808 PolarHBondContact O-N 2.85Å; E808-L810 PolarHBondContact O-N 3.15Å; E808-V811 WeakPolarHBondContact O-CB 3.43Å; E808-V811 WeakPolarHBondContact O-CG2 3.41Å; E808-V811 PolarHBondContact O-N 2.76Å; E808-V811 VanDerWaalsContact O-N 3.09Å
809	N	88.8	Confident	90	Very high	74 Å²	74	62.2 Å²	62.2	40%	0.396	35%	0.354	S	S	.	.	G	3₁₀ helix	trans	-62.9	-21.4	-179	-93.6	-92.1	0	0	0	114.3	R759 L807	R759-N809 WeakPolarHBondContact CD-O 3.46Å; R759-N809 VanDerWaalsContact CZ-OD1 3.23Å; R759-N809 PolarHBondContact NE-O 2.9Å; R759-N809 VanDerWaalsContact NE-O 3.12Å; R759-N809 PolarHBondContact NH1-O 3.38Å; R759-N809 PolarHBondContact NH1-OD1 2.81Å; R759-N809 PolarHBondContact NH2-OD1 3.19Å; L807-N809 PolarHBondContact O-N 3.47Å
810	L	92.3	Very high	90.3	Very high	0 Å²	0	63.8 Å²	63.8	0%	0	37%	0.369	C	S	.	.	G	3₁₀ helix	trans	-88.9	-12.9	177.6	-59.8	-178.3	0	0	0	113.2	L742 V745 L755 L758 R759 M762 F795 I799 L807 E808 Y812	L742-L810 HydrophobicContact CD1-CD1 3.72Å; V745-L810 HydrophobicContact CG1-CD1 4.44Å; L755-L810 HydrophobicContact CD2-CD1 3.98Å; L755-L810 HydrophobicContact CD2-CD2 4.06Å; L755-L810 HydrophobicContact CD2-CG 3.95Å; L758-L810 HydrophobicContact CB-CD2 4.48Å; L758-L810 HydrophobicContact CD2-CD1 3.75Å; L758-L810 HydrophobicContact CD2-CD2 4.17Å; L758-L810 HydrophobicContact CG-CD2 4.15Å; R759-L810 HydrophobicContact CB-CD2 3.93Å; R759-L810 HydrophobicContact CG-CD2 4.35Å; M762-L810 WeakPolarHBondContact CE-O 3.39Å; F795-L810 HydrophobicContact CD1-CB 4.07Å; F795-L810 HydrophobicContact CE1-CB 4.32Å; F795-L810 HydrophobicContact CE1-CD1 4.34Å; I799-L810 HydrophobicContact CD1-CB 4.38Å; I799-L810 HydrophobicContact CD1-CD1 4.43Å; L807-L810 HydrophobicContact CD2-CD1 4Å; L807-L810 WeakPolarHBondContact O-CB 3.24Å; L807-L810 PolarHBondContact O-N 3.29Å; E808-L810 PolarHBondContact O-N 3.15Å; L810-Y812 PolarHBondContact O-N 2.89Å
811	V	94.7	Very high	90.8	Very high	31 Å²	31	63 Å²	63	19%	0.188	36%	0.364	C	S	.	.			trans	-56.3	131	-175.3	176.3	0	0	0	0	111.1	F795 I799 M800 E808 V813	F795-V811 WeakPolarHBondContact O-CA 3.24Å; I799-V811 HydrophobicContact CG2-CG2 3.7Å; M800-V811 HydrophobicContact CG-CG2 4.24Å; M800-V811 HydrophobicContact SD-CG2 3.97Å; E808-V811 WeakPolarHBondContact O-CB 3.43Å; E808-V811 WeakPolarHBondContact O-CG2 3.41Å; E808-V811 PolarHBondContact O-N 2.76Å; E808-V811 VanDerWaalsContact O-N 3.09Å; V811-V813 HydrophobicContact CG1-CG2 4.36Å
812	Y	95.2	Very high	91.4	Very high	39 Å²	39	60.7 Å²	60.7	15%	0.153	35%	0.348	C	S	.	.			trans	-117.2	141.7	174.1	-166.6	-83.8	0	0	0	109	M762 R763 C766 L792 F795 L810 L818	M762-Y812 HydrophobicContact CE-CD2 4.27Å; M762-Y812 HydrophobicContact SD-CD2 3.6Å; M762-Y812 VanDerWaalsContact SD-CD2 3.6Å; M762-Y812 HydrophobicContact SD-CE2 4.37Å; M762-Y812 HydrophobicContact SD-CG 4.1Å; R763-Y812 HydrophobicContact CG-CD2 3.93Å; R763-Y812 HydrophobicContact CG-CE2 4.02Å; C766-Y812 HydrophobicContact CB-CE2 4.25Å; L792-Y812 HydrophobicContact CD2-CD1 3.45Å; L792-Y812 VanDerWaalsContact CD2-CD1 3.45Å; L792-Y812 HydrophobicContact CD2-CE1 3.6Å; F795-Y812 PolarHBondContact O-N 3.36Å; L810-Y812 PolarHBondContact O-N 2.89Å; Y812-L818 HydrophobicContact CE1-CD2 4.34Å
813	V	94.3	Very high	92.1	Very high	108 Å²	108	55.7 Å²	55.7	66%	0.655	31%	0.312	S	S	*	.			trans	-129.9	123.8	175.8	179.5	0	0	0	0	106.3	V811	V811-V813 HydrophobicContact CG1-CG2 4.36Å
814	P	95.8	Very high	93	Very high	3 Å²	3	57 Å²	57	2%	0.019	30%	0.304	C	S	.	.			trans	-68.2	135	-179.9	28.4	-32.5	0	0	0	110	L792 L818 Q819 V873 V874	L792-P814 HydrophobicContact CD1-CB 4.11Å; L792-P814 HydrophobicContact CD1-CG 4.36Å; L792-P814 HydrophobicContact CD2-CB 3.88Å; L792-P814 HydrophobicContact CD2-CG 4.17Å; P814-L818 HydrophobicContact CB-CB 4.34Å; P814-L818 HydrophobicContact CB-CD2 3.78Å; P814-L818 HydrophobicContact CB-CG 4.03Å; P814-Q819 HydrophobicContact CB-CG 3.93Å; P814-Q819 HydrophobicContact CG-CG 3.84Å; P814-Q819 PolarHBondContact O-NE2 2.9Å; P814-V873 WeakPolarHBondContact CD-O 3.3Å; P814-V873 HydrophobicContact CG-CG1 4.38Å; P814-V873 WeakPolarHBondContact CG-O 3.17Å; P814-V874 HydrophobicContact CG-CG1 4.14Å
815	D	94.1	Very high	93.5	Very high	87 Å²	87	52.5 Å²	52.5	47%	0.465	29%	0.287	S	S	.	.			trans	-73.4	172.1	175.9	75.7	20.9	0	0	0	112.1	S817 L818 Q819	D815-S817 PolarHBondContact O-N 3.09Å; D815-S817 WeakPolarHBondContact OD1-CA 3.49Å; D815-S817 VanDerWaalsContact OD1-CB 3.23Å; D815-S817 WeakPolarHBondContact OD1-CB 3.31Å; D815-S817 PolarHBondContact OD1-N 3.39Å; D815-L818 PolarHBondContact O-N 2.9Å; D815-L818 PolarHBondContact OD1-N 3.02Å; D815-Q819 WeakPolarHBondContact O-CB 3.34Å; D815-Q819 WeakPolarHBondContact O-CG 3.39Å; D815-Q819 PolarHBondContact O-N 3.39Å
816	S	94.2	Very high	94	Very high	106 Å²	106	45.4 Å²	45.4	74%	0.741	25%	0.254	S	S	*	.	H	α-helix	trans	-66.1	-16	-178.3	55.2	0	0	0	0	114.2	A820	S816-A820 WeakPolarHBondContact O-CB 3.38Å
817	S	95	Very high	94.4	Very high	60 Å²	60	43.4 Å²	43.4	42%	0.42	25%	0.248	S	C	.	.	H	α-helix	trans	-78.2	-55.2	174.1	-152.3	0	0	0	0	108.9	D815 Q819 A820 E821	D815-S817 PolarHBondContact O-N 3.09Å; D815-S817 WeakPolarHBondContact OD1-CA 3.49Å; D815-S817 VanDerWaalsContact OD1-CB 3.23Å; D815-S817 WeakPolarHBondContact OD1-CB 3.31Å; D815-S817 PolarHBondContact OD1-N 3.39Å; S817-Q819 VanDerWaalsContact C-N 3.31Å; S817-Q819 PolarHBondContact O-N 3.32Å; S817-A820 PolarHBondContact O-N 3.37Å; S817-E821 VanDerWaalsContact C-OE1 3.23Å; S817-E821 VanDerWaalsContact CB-OE1 3.25Å; S817-E821 WeakPolarHBondContact CB-OE1 3.44Å; S817-E821 VanDerWaalsContact O-CG 3.31Å; S817-E821 WeakPolarHBondContact O-CG 3.4Å; S817-E821 PolarHBondContact O-N 3.42Å; S817-E821 PolarHBondContact OG-OE1 2.94Å
818	L	95.7	Very high	94.5	Very high	0 Å²	0	48.3 Å²	48.3	0%	0	28%	0.275	C	S	.	.	H	α-helix	trans	-59.3	-39.2	178.2	178.4	56.8	0	0	0	112.3	Q770 L788 L792 Y812 P814 D815 A820 E821 L822	Q770-L818 HydrophobicContact CB-CD1 4.35Å; Q770-L818 HydrophobicContact CG-CD1 4.01Å; L788-L818 HydrophobicContact CD1-CD1 4.15Å; L788-L818 HydrophobicContact CD2-CD1 4.35Å; L792-L818 HydrophobicContact CD1-CD2 4.26Å; L792-L818 HydrophobicContact CD2-CD2 4.3Å; Y812-L818 HydrophobicContact CE1-CD2 4.34Å; P814-L818 HydrophobicContact CB-CB 4.34Å; P814-L818 HydrophobicContact CB-CD2 3.78Å; P814-L818 HydrophobicContact CB-CG 4.03Å; D815-L818 PolarHBondContact O-N 2.9Å; D815-L818 PolarHBondContact OD1-N 3.02Å; L818-A820 VanDerWaalsContact C-N 3.31Å; L818-A820 PolarHBondContact O-N 3.39Å; L818-E821 PolarHBondContact O-N 3.23Å; L818-L822 HydrophobicContact CD1-CD1 3.88Å; L818-L822 HydrophobicContact CD1-CD2 4.44Å; L818-L822 HydrophobicContact CD1-CG 3.9Å; L818-L822 HydrophobicContact CG-CD1 4Å; L818-L822 HydrophobicContact CG-CG 4.47Å; L818-L822 WeakPolarHBondContact O-CB 3.13Å; L818-L822 WeakPolarHBondContact O-CG 3.2Å; L818-L822 PolarHBondContact O-N 2.91Å
819	Q	96.9	Very high	94.6	Very high	28 Å²	28	44.8 Å²	44.8	13%	0.131	26%	0.258	C	S	.	.	H	α-helix	trans	-63.2	-34.7	175.2	-71.5	-171	52.7	0	0	113.4	P814 D815 S817 L823 Y865 V874	P814-Q819 HydrophobicContact CB-CG 3.93Å; P814-Q819 HydrophobicContact CG-CG 3.84Å; P814-Q819 PolarHBondContact O-NE2 2.9Å; D815-Q819 WeakPolarHBondContact O-CB 3.34Å; D815-Q819 WeakPolarHBondContact O-CG 3.39Å; D815-Q819 PolarHBondContact O-N 3.39Å; S817-Q819 VanDerWaalsContact C-N 3.31Å; S817-Q819 PolarHBondContact O-N 3.32Å; Q819-L823 WeakPolarHBondContact O-CB 3.33Å; Q819-L823 PolarHBondContact O-N 2.85Å; Q819-Y865 PolarHBondContact O-OH 2.75Å; Q819-V874 HydrophobicContact CG-CB 4.16Å; Q819-V874 HydrophobicContact CG-CG1 3.84Å
820	A	95.4	Very high	94.8	Very high	43 Å²	43	41.2 Å²	41.2	36%	0.355	24%	0.239	S	C	.	.	H	α-helix	trans	-78.8	-40.2	176.9	0	0	0	0	0	111.9	S816 S817 L818 L823 N824	S816-A820 WeakPolarHBondContact O-CB 3.38Å; S817-A820 PolarHBondContact O-N 3.37Å; L818-A820 VanDerWaalsContact C-N 3.31Å; L818-A820 PolarHBondContact O-N 3.39Å; A820-L823 PolarHBondContact O-N 3.45Å; A820-N824 WeakPolarHBondContact O-CB 3.33Å; A820-N824 PolarHBondContact O-N 3.2Å; A820-N824 PolarHBondContact O-ND2 2.96Å; A820-N824 PolarHBondContact O-OD1 3.24Å
821	E	96.4	Very high	94.8	Very high	42 Å²	42	42.1 Å²	42.1	20%	0.196	24%	0.243	C	C	.	.	H	α-helix	trans	-61.5	-43.9	176.5	-70.1	154.4	-141.5	0	0	111.6	Q770 L773 S817 L818 N824 F825	Q770-E821 WeakPolarHBondContact CG-OE2 3.28Å; Q770-E821 PolarHBondContact NE2-OE1 2.94Å; Q770-E821 PolarHBondContact NE2-OE2 3.32Å; L773-E821 HydrophobicContact CD2-CB 4.01Å; S817-E821 VanDerWaalsContact C-OE1 3.23Å; S817-E821 VanDerWaalsContact CB-OE1 3.25Å; S817-E821 WeakPolarHBondContact CB-OE1 3.44Å; S817-E821 VanDerWaalsContact O-CG 3.31Å; S817-E821 WeakPolarHBondContact O-CG 3.4Å; S817-E821 PolarHBondContact O-N 3.42Å; S817-E821 PolarHBondContact OG-OE1 2.94Å; L818-E821 PolarHBondContact O-N 3.23Å; E821-N824 PolarHBondContact O-N 3.21Å; E821-F825 PolarHBondContact O-N 3.06Å
822	L	97.3	Very high	94.6	Very high	0 Å²	0	43.5 Å²	43.5	0%	0	25%	0.249	C	C	.	.	H	α-helix	trans	-65.7	-35.3	173.5	-67.4	168.9	0	0	0	112.5	L773 F785 L788 L792 L818 I826 Y865 L868	L773-L822 HydrophobicContact CD2-CD2 3.84Å; L773-L822 HydrophobicContact CD2-CG 4.3Å; F785-L822 HydrophobicContact CD2-CD2 3.45Å; F785-L822 VanDerWaalsContact CD2-CD2 3.45Å; F785-L822 HydrophobicContact CE2-CB 4.05Å; F785-L822 HydrophobicContact CE2-CD2 3.58Å; F785-L822 HydrophobicContact CE2-CG 4.44Å; F785-L822 WeakPolarHBondContact CE2-O 3.4Å; F785-L822 HydrophobicContact CG-CD2 4.44Å; L788-L822 HydrophobicContact CB-CD2 4.14Å; L788-L822 HydrophobicContact CD1-CD2 4.17Å; L792-L822 HydrophobicContact CD1-CD1 3.58Å; L818-L822 HydrophobicContact CD1-CD1 3.88Å; L818-L822 HydrophobicContact CD1-CD2 4.44Å; L818-L822 HydrophobicContact CD1-CG 3.9Å; L818-L822 HydrophobicContact CG-CD1 4Å; L818-L822 HydrophobicContact CG-CG 4.47Å; L818-L822 WeakPolarHBondContact O-CB 3.13Å; L818-L822 WeakPolarHBondContact O-CG 3.2Å; L818-L822 PolarHBondContact O-N 2.91Å; L822-I826 PolarHBondContact O-N 3.23Å; L822-Y865 HydrophobicContact CB-CD2 4.09Å; L822-Y865 HydrophobicContact CB-CE2 3.66Å; L822-L868 HydrophobicContact CD1-CD1 4.47Å
823	L	96.4	Very high	93.6	Very high	20 Å²	20	44.9 Å²	44.9	11%	0.105	26%	0.259	C	S	.	.	H	α-helix	trans	-69.2	-43.4	175.9	-175.6	61.8	0	0	0	111.6	Q819 A820 F825 I826 V827 Y865 T878 D881	Q819-L823 WeakPolarHBondContact O-CB 3.33Å; Q819-L823 PolarHBondContact O-N 2.85Å; A820-L823 PolarHBondContact O-N 3.45Å; L823-F825 VanDerWaalsContact C-N 3.34Å; L823-F825 PolarHBondContact O-N 3.38Å; L823-I826 PolarHBondContact O-N 3.14Å; L823-I826 VanDerWaalsContact O-N 3.17Å; L823-V827 WeakPolarHBondContact O-CG2 3.48Å; L823-V827 PolarHBondContact O-N 3.33Å; L823-Y865 HydrophobicContact CD1-CE1 3.89Å; L823-T878 HydrophobicContact CD2-CG2 4.23Å; L823-D881 HydrophobicContact CD1-CB 4.4Å
824	N	95.4	Very high	92	Very high	91 Å²	91	45.1 Å²	45.1	49%	0.487	25%	0.253	S	S	.	.	H	α-helix	trans	-60.9	-43.7	177.5	-66.8	-13.9	0	0	0	110.6	A820 E821 I826 V827 D828	A820-N824 WeakPolarHBondContact O-CB 3.33Å; A820-N824 PolarHBondContact O-N 3.2Å; A820-N824 PolarHBondContact O-ND2 2.96Å; A820-N824 PolarHBondContact O-OD1 3.24Å; E821-N824 PolarHBondContact O-N 3.21Å; N824-I826 VanDerWaalsContact C-N 3.3Å; N824-I826 PolarHBondContact O-N 2.92Å; N824-V827 PolarHBondContact O-N 2.91Å; N824-V827 VanDerWaalsContact O-N 3.09Å; N824-D828 WeakPolarHBondContact O-CB 3.15Å; N824-D828 VanDerWaalsContact O-CG 3.22Å; N824-D828 PolarHBondContact O-N 3.16Å
825	F	95.9	Very high	90	Very high	9 Å²	9	51.4 Å²	51.4	4%	0.039	29%	0.286	C	S	.	.	H	α-helix	trans	-53.9	-44.5	173.3	175.4	-82.1	0	0	0	112.4	L773 K781 E782 F785 E821 L823 D828 Q829 L861	L773-F825 HydrophobicContact CD1-CB 4.17Å; L773-F825 HydrophobicContact CD1-CD2 3.69Å; L773-F825 HydrophobicContact CD1-CE2 4.4Å; L773-F825 HydrophobicContact CD1-CG 4.06Å; K781-F825 HydrophobicContact CB-CD2 4.36Å; K781-F825 HydrophobicContact CB-CE2 3.93Å; E782-F825 HydrophobicContact CB-CZ 4.42Å; E782-F825 HydrophobicContact CG-CE2 4.33Å; E782-F825 HydrophobicContact CG-CZ 3.95Å; F785-F825 HydrophobicContact CB-CD1 4.13Å; F785-F825 HydrophobicContact CB-CD2 4.23Å; F785-F825 HydrophobicContact CB-CE1 3.89Å; F785-F825 HydrophobicContact CB-CE2 3.98Å; F785-F825 HydrophobicContact CB-CG 4.3Å; F785-F825 HydrophobicContact CB-CZ 3.82Å; F785-F825 AromaticContact CD1-CD1 3.85Å; F785-F825 HydrophobicContact CD1-CD1 3.85Å; F785-F825 AromaticContact CD1-CE1 3.49Å; F785-F825 HydrophobicContact CD1-CE1 3.49Å; F785-F825 VanDerWaalsContact CD1-CE1 3.49Å; F785-F825 HydrophobicContact CD1-CZ 4.15Å; F785-F825 HydrophobicContact CD2-CB 3.9Å; F785-F825 AromaticContact CD2-CD1 3.15Å; F785-F825 HydrophobicContact CD2-CD1 3.15Å; F785-F825 HydrophobicContact CD2-CD2 4.21Å; F785-F825 AromaticContact CD2-CE1 3.68Å; F785-F825 HydrophobicContact CD2-CE1 3.68Å; F785-F825 AromaticContact CD2-CG 3.48Å; F785-F825 HydrophobicContact CD2-CG 3.48Å; F785-F825 VanDerWaalsContact CD2-CG 3.48Å; F785-F825 HydrophobicContact CD2-CZ 4.38Å; F785-F825 HydrophobicContact CE1-CD1 4.03Å; F785-F825 AromaticContact CE1-CE1 3.89Å; F785-F825 HydrophobicContact CE1-CE1 3.89Å; F785-F825 HydrophobicContact CE2-CB 4.14Å; F785-F825 AromaticContact CE2-CD1 3.37Å; F785-F825 HydrophobicContact CE2-CD1 3.37Å; F785-F825 HydrophobicContact CE2-CE1 4.06Å; F785-F825 AromaticContact CE2-CG 3.97Å; F785-F825 HydrophobicContact CE2-CG 3.97Å; F785-F825 AromaticContact CG-CD1 3.41Å; F785-F825 HydrophobicContact CG-CD1 3.41Å; F785-F825 VanDerWaalsContact CG-CD1 3.41Å; F785-F825 HydrophobicContact CG-CD2 4.35Å; F785-F825 AromaticContact CG-CE1 3.37Å; F785-F825 HydrophobicContact CG-CE1 3.37Å; F785-F825 HydrophobicContact CG-CE2 4.3Å; F785-F825 AromaticContact CG-CG 3.94Å; F785-F825 HydrophobicContact CG-CG 3.94Å; F785-F825 AromaticContact CG-CZ 3.85Å; F785-F825 HydrophobicContact CG-CZ 3.85Å; F785-F825 AromaticContact CZ-CD1 3.81Å; F785-F825 HydrophobicContact CZ-CD1 3.81Å; F785-F825 HydrophobicContact CZ-CE1 4.16Å; E821-F825 PolarHBondContact O-N 3.06Å; L823-F825 VanDerWaalsContact C-N 3.34Å; L823-F825 PolarHBondContact O-N 3.38Å; F825-D828 PolarHBondContact O-N 2.9Å; F825-Q829 HydrophobicContact CD2-CG 3.97Å; F825-Q829 HydrophobicContact CE1-CB 4.26Å; F825-Q829 HydrophobicContact CE1-CG 4.45Å; F825-Q829 HydrophobicContact CE2-CB 4.44Å; F825-Q829 HydrophobicContact CE2-CG 3.81Å; F825-Q829 HydrophobicContact CG-CG 4.36Å; F825-Q829 HydrophobicContact CZ-CB 4.18Å; F825-Q829 HydrophobicContact CZ-CG 4.06Å; F825-Q829 VanDerWaalsContact O-CB 3.26Å; F825-Q829 WeakPolarHBondContact O-CB 3.46Å; F825-Q829 WeakPolarHBondContact O-CG 3.41Å; F825-Q829 PolarHBondContact O-N 3.21Å; F825-L861 HydrophobicContact CE1-CB 4.48Å; F825-L861 HydrophobicContact CE1-CD1 4.1Å; F825-L861 HydrophobicContact CE1-CD2 4.04Å; F825-L861 HydrophobicContact CE1-CG 4.44Å; F825-L861 HydrophobicContact CZ-CD1 4.13Å; F825-L861 HydrophobicContact CZ-CD2 4.18Å
826	I	96.6	Very high	87.7	Confident	0 Å²	0	52.6 Å²	52.6	0%	0	29%	0.293	C	S	.	.	H	α-helix	trans	-65	-41.1	177	-71.1	-64.2	0	0	0	111.7	F785 L822 L823 N824 V830 F831 L861 L862 Y865 I882	F785-I826 HydrophobicContact CE1-CD1 3.99Å; F785-I826 HydrophobicContact CE2-CD1 4.33Å; F785-I826 HydrophobicContact CE2-CG1 4.11Å; F785-I826 HydrophobicContact CZ-CD1 3.53Å; F785-I826 HydrophobicContact CZ-CG1 3.7Å; L822-I826 PolarHBondContact O-N 3.23Å; L823-I826 PolarHBondContact O-N 3.14Å; L823-I826 VanDerWaalsContact O-N 3.17Å; N824-I826 VanDerWaalsContact C-N 3.3Å; N824-I826 PolarHBondContact O-N 2.92Å; I826-V830 HydrophobicContact CD1-CG2 3.86Å; I826-V830 HydrophobicContact CG2-CG2 4.5Å; I826-V830 VanDerWaalsContact O-CB 3.3Å; I826-V830 WeakPolarHBondContact O-CB 3.47Å; I826-V830 PolarHBondContact O-N 3.17Å; I826-V830 VanDerWaalsContact O-N 3.1Å; I826-F831 HydrophobicContact CG2-CD2 4.33Å; I826-F831 HydrophobicContact CG2-CE2 3.75Å; I826-F831 HydrophobicContact CG2-CZ 4.47Å; I826-L861 HydrophobicContact CD1-CB 4.42Å; I826-L861 WeakPolarHBondContact CD1-O 3.43Å; I826-L862 HydrophobicContact CG2-CD1 3.9Å; I826-Y865 HydrophobicContact CG1-CD2 4.19Å; I826-Y865 HydrophobicContact CG1-CG 3.92Å; I826-I882 HydrophobicContact CG2-CD1 4.42Å; I826-I882 HydrophobicContact CG2-CG1 4.37Å
827	V	93.3	Very high	85.4	Confident	51 Å²	51	51.3 Å²	51.3	31%	0.309	28%	0.278	S	S	.	.	H	α-helix	trans	-62.4	-46.2	175.8	174.3	0	0	0	0	111.1	L823 N824	L823-V827 WeakPolarHBondContact O-CG2 3.48Å; L823-V827 PolarHBondContact O-N 3.33Å; N824-V827 PolarHBondContact O-N 2.91Å; N824-V827 VanDerWaalsContact O-N 3.09Å
828	D	91.7	Very high	82.9	Confident	104 Å²	104	52.6 Å²	52.6	56%	0.556	29%	0.287	S	S	*	.	H	α-helix	trans	-78	-25.8	-173.3	-64.5	-14.5	0	0	0	113.8	N824 F825	N824-D828 WeakPolarHBondContact O-CB 3.15Å; N824-D828 VanDerWaalsContact O-CG 3.22Å; N824-D828 PolarHBondContact O-N 3.16Å; F825-D828 PolarHBondContact O-N 2.9Å
829	Q	91.1	Very high	80.1	Confident	44 Å²	44	58.4 Å²	58.4	21%	0.206	32%	0.317	C	S	.	.	H	α-helix	trans	-116.5	-17	-170.9	-56	-65.2	-95.9	0	0	114.9	F825 R858	F825-Q829 HydrophobicContact CD2-CG 3.97Å; F825-Q829 HydrophobicContact CE1-CB 4.26Å; F825-Q829 HydrophobicContact CE1-CG 4.45Å; F825-Q829 HydrophobicContact CE2-CB 4.44Å; F825-Q829 HydrophobicContact CE2-CG 3.81Å; F825-Q829 HydrophobicContact CG-CG 4.36Å; F825-Q829 HydrophobicContact CZ-CB 4.18Å; F825-Q829 HydrophobicContact CZ-CG 4.06Å; F825-Q829 VanDerWaalsContact O-CB 3.26Å; F825-Q829 WeakPolarHBondContact O-CB 3.46Å; F825-Q829 WeakPolarHBondContact O-CG 3.41Å; F825-Q829 PolarHBondContact O-N 3.21Å; Q829-R858 WeakPolarHBondContact O-CD 3.44Å
830	V	93.3	Very high	77.4	Confident	0 Å²	0	60 Å²	60	0%	0	33%	0.332	C	S	.	.	H	α-helix	trans	-105.5	-43.8	179	179.4	0	0	0	0	112.1	I826 I832 R858 L861 L862 Y893	I826-V830 HydrophobicContact CD1-CG2 3.86Å; I826-V830 HydrophobicContact CG2-CG2 4.5Å; I826-V830 VanDerWaalsContact O-CB 3.3Å; I826-V830 WeakPolarHBondContact O-CB 3.47Å; I826-V830 PolarHBondContact O-N 3.17Å; I826-V830 VanDerWaalsContact O-N 3.1Å; V830-I832 VanDerWaalsContact C-N 3.34Å; V830-I832 PolarHBondContact O-N 3.17Å; V830-R858 HydrophobicContact CG1-CB 4.49Å; V830-L861 HydrophobicContact CG2-CB 4.22Å; V830-L862 HydrophobicContact CG1-CB 4.07Å; V830-L862 HydrophobicContact CG1-CD2 4.27Å; V830-L862 HydrophobicContact CG2-CB 4.47Å; V830-Y893 HydrophobicContact CG1-CD1 4.41Å; V830-Y893 HydrophobicContact CG1-CD2 4.08Å; V830-Y893 HydrophobicContact CG1-CE1 3.88Å; V830-Y893 HydrophobicContact CG1-CE2 3.53Å; V830-Y893 VanDerWaalsContact CG1-CZ 3.42Å; V830-Y893 WeakPolarHBondContact O-CE2 3.44Å; V830-Y893 PolarHBondContact O-OH 3.1Å
831	F	93.1	Very high	74.7	Confident	19 Å²	19	64.9 Å²	64.9	8%	0.083	36%	0.357	C	S	.	.	S	Bend	trans	-95	55.2	-171.9	-59.2	-54.6	0	0	0	112.9	I826 L862 I882 Q885 Y889 Y893 I897	I826-F831 HydrophobicContact CG2-CD2 4.33Å; I826-F831 HydrophobicContact CG2-CE2 3.75Å; I826-F831 HydrophobicContact CG2-CZ 4.47Å; F831-L862 HydrophobicContact CE1-CD2 4.36Å; F831-L862 HydrophobicContact CE2-CD1 4.45Å; F831-L862 HydrophobicContact CZ-CD1 3.86Å; F831-L862 HydrophobicContact CZ-CD2 4.3Å; F831-I882 HydrophobicContact CE2-CG1 4.15Å; F831-I882 HydrophobicContact CZ-CG1 4.33Å; F831-I882 HydrophobicContact CZ-CG2 4.35Å; F831-Q885 HydrophobicContact CD1-CB 3.99Å; F831-Q885 HydrophobicContact CD1-CG 3.87Å; F831-Q885 HydrophobicContact CD2-CG 3.89Å; F831-Q885 HydrophobicContact CE1-CB 3.75Å; F831-Q885 HydrophobicContact CE1-CG 3.89Å; F831-Q885 HydrophobicContact CE2-CG 3.91Å; F831-Q885 HydrophobicContact CG-CG 3.88Å; F831-Q885 HydrophobicContact CZ-CB 4.05Å; F831-Q885 HydrophobicContact CZ-CG 3.92Å; F831-Y889 HydrophobicContact CB-CD2 4.49Å; F831-Y889 HydrophobicContact CB-CE2 3.82Å; F831-Y889 AromaticContact CD1-CD2 3.69Å; F831-Y889 HydrophobicContact CD1-CD2 3.69Å; F831-Y889 AromaticContact CD1-CE2 3.89Å; F831-Y889 HydrophobicContact CD1-CE2 3.89Å; F831-Y889 HydrophobicContact CD1-CG 4.18Å; F831-Y889 HydrophobicContact CE1-CD2 4.43Å; F831-Y889 HydrophobicContact CG-CD2 4.47Å; F831-Y889 HydrophobicContact CG-CE2 4.26Å; F831-Y889 PolarHBondContact O-OH 3.47Å; F831-Y893 AromaticContact CD1-CD2 3.89Å; F831-Y893 HydrophobicContact CD1-CD2 3.89Å; F831-Y893 AromaticContact CD1-CE2 3.96Å; F831-Y893 HydrophobicContact CD1-CE2 3.96Å; F831-Y893 AromaticContact CE1-CD2 3.66Å; F831-Y893 HydrophobicContact CE1-CD2 3.66Å; F831-Y893 HydrophobicContact CE1-CE2 4.14Å; F831-Y893 HydrophobicContact CE1-CG 4.5Å; F831-I897 HydrophobicContact CE1-CD1 4.31Å
832	I	88.6	Confident	71.9	Confident	59 Å²	59	68.9 Å²	68.9	30%	0.303	38%	0.38	S	S	.	.			trans	-92.5	137.1	179.1	-54	168.6	0	0	0	109.9	V830 Y889	V830-I832 VanDerWaalsContact C-N 3.34Å; V830-I832 PolarHBondContact O-N 3.17Å; I832-Y889 PolarHBondContact N-OH 3.31Å; I832-Y889 WeakPolarHBondContact O-CE1 3.25Å; I832-Y889 PolarHBondContact O-OH 3.1Å
833	D	76.2	Confident	69.3	Low	68 Å²	68	73.2 Å²	73.2	36%	0.364	43%	0.425	S	S	.	.			trans	-72.8	131.5	178.5	-74	-54.1	0	0	0	112.3	D835 D836 R888 Y889	D833-D835 PolarHBondContact O-N 3.45Å; D833-D835 VanDerWaalsContact O-N 3.14Å; D833-D836 PolarHBondContact O-N 2.92Å; D833-R888 IonicContact OD1-CZ 3.97Å; D833-R888 VanDerWaalsContact OD1-CZ 3.31Å; D833-R888 IonicContact OD1-NE 3.58Å; D833-R888 PolarHBondContact OD1-NE 2.64Å; D833-R888 VanDerWaalsContact OD1-NE 3.09Å; D833-R888 IonicContact OD1-NH2 2.8Å; D833-R888 PolarHBondContact OD1-NH2 3.23Å; D833-R888 IonicContact OD2-CZ 2.71Å; D833-R888 IonicContact OD2-NH2 2.66Å; D833-R888 PolarHBondContact OD2-NH2 3.29Å; D833-Y889 PolarHBondContact N-OH 2.9Å; D833-Y889 PolarHBondContact OD1-OH 3.46Å
834	Q	58.9	Low	66.8	Low	114 Å²	114	79.8 Å²	79.8	53%	0.533	46%	0.455	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.9	-15.8	-171.2	-64.2	179	-6.8	0	0	114.7	D892	Q834-D892 VanDerWaalsContact NE2-CG 3.27Å; Q834-D892 PolarHBondContact NE2-OD1 2.91Å; Q834-D892 PolarHBondContact NE2-OD2 3.4Å
835	D	53.7	Low	64.4	Low	135 Å²	135	82.8 Å²	82.8	72%	0.722	47%	0.466	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75	-29.2	179.8	-73.1	-41.4	0	0	0	112.4	D833 S838	D833-D835 PolarHBondContact O-N 3.45Å; D833-D835 VanDerWaalsContact O-N 3.14Å; D835-S838 WeakPolarHBondContact O-CB 3.32Å; D835-S838 PolarHBondContact O-N 3.26Å; D835-S838 VanDerWaalsContact O-N 3.16Å; D835-S838 PolarHBondContact O-OG 2.81Å
836	D	46.3	Very low	62.1	Low	112 Å²	112	85.8 Å²	85.8	60%	0.599	48%	0.482	S	S	*	.	G	3₁₀ helix	trans	-74.5	-27.6	-176.9	-83.7	-38.8	0	0	0	113.3	D833 S838 N839	D833-D836 PolarHBondContact O-N 2.92Å; D836-S838 PolarHBondContact O-N 3.32Å; D836-N839 PolarHBondContact O-N 3.49Å; D836-N839 VanDerWaalsContact O-N 3.14Å
837	D	46.2	Very low	60.7	Low	79 Å²	79	91.4 Å²	91.4	42%	0.422	51%	0.512	S	S	.	.	G	3₁₀ helix	trans	-60.9	-9.9	169.8	-76.3	-21.4	0	0	0	111.8	N839 R858	D837-N839 VanDerWaalsContact C-N 3.3Å; D837-N839 PolarHBondContact O-N 2.98Å; D837-R858 IonicContact OD2-NH1 3.36Å; D837-R858 IonicContact OD2-NH2 3.82Å
838	S	42.2	Very low	59.7	Low	87 Å²	87	96.5 Å²	96.5	61%	0.608	53%	0.533	S	S	*	.	G	3₁₀ helix	trans	-76.7	-8.9	174.8	-48.2	0	0	0	0	114.8	D835 D836	D835-S838 WeakPolarHBondContact O-CB 3.32Å; D835-S838 PolarHBondContact O-N 3.26Å; D835-S838 VanDerWaalsContact O-N 3.16Å; D835-S838 PolarHBondContact O-OG 2.81Å; D836-S838 PolarHBondContact O-N 3.32Å
839	N	37.1	Very low	58.7	Low	121 Å²	121	94.8 Å²	94.8	65%	0.647	53%	0.533	S	S	*	.	G	3₁₀ helix	trans	-102	18.9	-171.8	-73.2	-57.1	0	0	0	114.3	D836 D837 T841	D836-N839 PolarHBondContact O-N 3.49Å; D836-N839 VanDerWaalsContact O-N 3.14Å; D837-N839 VanDerWaalsContact C-N 3.3Å; D837-N839 PolarHBondContact O-N 2.98Å; N839-T841 PolarHBondContact O-N 3.01Å
840	S	40.5	Very low	57.9	Low	62 Å²	62	95.5 Å²	95.5	43%	0.434	54%	0.543	S	S	.	.			trans	-57.6	121	163.3	44.7	0	0	0	0	109.4	D842 D846	S840-D842 PolarHBondContact O-N 3.07Å; S840-D846 PolarHBondContact OG-OD2 3.3Å
841	T	38.3	Very low	57.3	Low	145 Å²	145	100.8 Å²	100.8	89%	0.89	57%	0.566	S	S	*	*	S	Bend	trans	-74.8	-8.6	-168.5	35.6	0	0	0	0	115.2	N839	N839-T841 PolarHBondContact O-N 3.01Å
842	D	38.7	Very low	56.4	Low	126 Å²	126	103.2 Å²	103.2	67%	0.674	58%	0.579	S	S	*	*	S	Bend	trans	-92.6	118.5	170.4	-81.5	-58.6	0	0	0	109.8	S840 Q844	S840-D842 PolarHBondContact O-N 3.07Å; D842-Q844 PolarHBondContact O-N 3.14Å
843	G	41.7	Very low	55.8	Low	91 Å²	91	107.2 Å²	107.2	94%	0.938	60%	0.597	S	S	*	*			trans	-72.9	38.1	-172.7	0	0	0	0	0	115.7
844	Q	43.6	Very low	56.1	Low	158 Å²	158	106 Å²	106	74%	0.738	60%	0.596	S	S	*	*			trans	-79.7	141.9	164.8	-67.7	178.2	-21.5	0	0	108.5	D842 D846	D842-Q844 PolarHBondContact O-N 3.14Å; Q844-D846 PolarHBondContact O-N 3.14Å
845	Q	45.2	Very low	57.3	Low	154 Å²	154	102.1 Å²	102.1	72%	0.72	58%	0.579	S	S	*	*			trans	-75.7	106.4	165	-72.4	-173.1	-116.6	0	0	107	D847	Q845-D847 PolarHBondContact O-N 3.17Å
846	D	47.7	Very low	58.7	Low	72 Å²	72	98.7 Å²	98.7	39%	0.385	56%	0.558	S	S	.	*			trans	-50.7	123.2	170.3	-79.6	-53.6	0	0	0	109.9	S840 Q844 K851	S840-D846 PolarHBondContact OG-OD2 3.3Å; Q844-D846 PolarHBondContact O-N 3.14Å; D846-K851 WeakPolarHBondContact O-CE 3.23Å
847	D	67.3	Low	60.6	Low	118 Å²	118	98.3 Å²	98.3	63%	0.631	55%	0.551	S	S	*	*			trans	-65.7	149.5	-169.2	-146.4	-33.9	0	0	0	111.6	Q845 A849 S850 K851	Q845-D847 PolarHBondContact O-N 3.17Å; D847-A849 PolarHBondContact O-N 3.19Å; D847-S850 PolarHBondContact O-N 3.15Å; D847-S850 VanDerWaalsContact O-N 3.14Å; D847-K851 PolarHBondContact O-N 2.87Å
848	E	71.6	Confident	62.7	Low	158 Å²	158	96.6 Å²	96.6	74%	0.738	54%	0.539	S	S	*	.	H	α-helix	trans	-62.8	-30.4	-176.7	-67	-171.6	158.5	0	0	110.9	K851 I852	E848-K851 PolarHBondContact O-N 3.4Å; E848-I852 VanDerWaalsContact O-CG1 3.29Å; E848-I852 WeakPolarHBondContact O-CG1 3.31Å; E848-I852 PolarHBondContact O-N 3.17Å; E848-I852 VanDerWaalsContact O-N 3.11Å
849	A	71.1	Confident	65.1	Low	68 Å²	68	93 Å²	93	56%	0.562	51%	0.512	S	S	*	.	H	α-helix	trans	-60.5	-49.3	172.4	0	0	0	0	0	113.3	D847 K851 I852 E853	D847-A849 PolarHBondContact O-N 3.19Å; A849-K851 VanDerWaalsContact C-N 3.28Å; A849-K851 PolarHBondContact O-N 2.96Å; A849-I852 WeakPolarHBondContact O-CB 3.49Å; A849-I852 PolarHBondContact O-N 2.91Å; A849-I852 VanDerWaalsContact O-N 3.11Å; A849-E853 PolarHBondContact O-N 2.95Å
850	S	75.5	Confident	67.5	Low	60 Å²	60	91.3 Å²	91.3	42%	0.42	50%	0.503	S	S	.	.	H	α-helix	trans	-59.3	-39.7	179.1	172.4	0	0	0	0	111.6	D847 I852 E853 A854	D847-S850 PolarHBondContact O-N 3.15Å; D847-S850 VanDerWaalsContact O-N 3.14Å; S850-I852 PolarHBondContact O-N 3.45Å; S850-E853 PolarHBondContact O-N 2.97Å; S850-A854 WeakPolarHBondContact O-CB 3.33Å; S850-A854 PolarHBondContact O-N 2.86Å
851	K	79.4	Confident	70	Confident	111 Å²	111	88.7 Å²	88.7	48%	0.483	48%	0.484	S	S	.	.	H	α-helix	trans	-68.4	-35.2	177.5	-61.5	-173.4	-177.6	-170.3	0	112.4	D846 D847 E848 A849 L855	D846-K851 WeakPolarHBondContact O-CE 3.23Å; D847-K851 PolarHBondContact O-N 2.87Å; E848-K851 PolarHBondContact O-N 3.4Å; A849-K851 VanDerWaalsContact C-N 3.28Å; A849-K851 PolarHBondContact O-N 2.96Å; K851-L855 VanDerWaalsContact O-CB 3.28Å; K851-L855 WeakPolarHBondContact O-CB 3.46Å; K851-L855 PolarHBondContact O-N 2.87Å
852	I	74.6	Confident	72.8	Confident	69 Å²	69	81.8 Å²	81.8	35%	0.354	44%	0.442	S	S	.	.	H	α-helix	trans	-67.5	-41.9	173.1	-68.7	165.5	0	0	0	110.6	E848 A849 S850 L855 H856	E848-I852 VanDerWaalsContact O-CG1 3.29Å; E848-I852 WeakPolarHBondContact O-CG1 3.31Å; E848-I852 PolarHBondContact O-N 3.17Å; E848-I852 VanDerWaalsContact O-N 3.11Å; A849-I852 WeakPolarHBondContact O-CB 3.49Å; A849-I852 PolarHBondContact O-N 2.91Å; A849-I852 VanDerWaalsContact O-N 3.11Å; S850-I852 PolarHBondContact O-N 3.45Å; I852-L855 PolarHBondContact O-N 3.44Å; I852-H856 PolarHBondContact O-CD2 3.5Å; I852-H856 PolarHBondContact O-N 3.26Å
853	E	75.8	Confident	75.4	Confident	144 Å²	144	75.9 Å²	75.9	67%	0.673	41%	0.41	S	S	*	.	H	α-helix	trans	-63.4	-48.4	177.1	-164.6	-164.1	152.3	0	0	111.9	A849 S850 L855 H856 K857	A849-E853 PolarHBondContact O-N 2.95Å; S850-E853 PolarHBondContact O-N 2.97Å; E853-L855 VanDerWaalsContact C-N 3.26Å; E853-L855 PolarHBondContact O-N 2.99Å; E853-H856 WeakPolarHBondContact O-CB 3.44Å; E853-H856 PolarHBondContact O-N 3.32Å; E853-K857 PolarHBondContact O-N 2.88Å
854	A	83.9	Confident	77.9	Confident	41 Å²	41	71.9 Å²	71.9	34%	0.339	37%	0.368	S	S	.	.	H	α-helix	trans	-60.5	-35.4	175.2	0	0	0	0	0	112.3	S850 R858	S850-A854 WeakPolarHBondContact O-CB 3.33Å; S850-A854 PolarHBondContact O-N 2.86Å; A854-R858 WeakPolarHBondContact O-CG 3.25Å; A854-R858 PolarHBondContact O-N 3.28Å; A854-R858 VanDerWaalsContact O-N 3.15Å; A854-R858 PolarHBondContact O-NE 3.32Å
855	L	83.8	Confident	80.4	Confident	34 Å²	34	64.4 Å²	64.4	18%	0.178	33%	0.333	C	S	.	.	H	α-helix	trans	-68.6	-40.5	172	175.1	59.5	0	0	0	112.1	K851 I852 E853 R858 R859 D892 Y893	K851-L855 VanDerWaalsContact O-CB 3.28Å; K851-L855 WeakPolarHBondContact O-CB 3.46Å; K851-L855 PolarHBondContact O-N 2.87Å; I852-L855 PolarHBondContact O-N 3.44Å; E853-L855 VanDerWaalsContact C-N 3.26Å; E853-L855 PolarHBondContact O-N 2.99Å; L855-R858 PolarHBondContact O-N 3.24Å; L855-R859 HydrophobicContact CD1-CG 4.11Å; L855-R859 HydrophobicContact CG-CG 4.42Å; L855-R859 WeakPolarHBondContact O-CB 3.28Å; L855-R859 VanDerWaalsContact O-CG 3.3Å; L855-R859 WeakPolarHBondContact O-CG 3.12Å; L855-R859 PolarHBondContact O-N 3.02Å; L855-D892 HydrophobicContact CD1-CB 3.67Å; L855-Y893 HydrophobicContact CD1-CD1 4.48Å; L855-Y893 HydrophobicContact CD1-CE1 3.77Å
856	H	82.4	Confident	82.9	Confident	63 Å²	63	57 Å²	57	29%	0.292	30%	0.299	S	S	.	.	H	α-helix	trans	-60.4	-45.9	175	-85.4	-145.2	0	0	0	111.7	I852 E853 R858 R859 N860 L1254	I852-H856 PolarHBondContact O-CD2 3.5Å; I852-H856 PolarHBondContact O-N 3.26Å; E853-H856 WeakPolarHBondContact O-CB 3.44Å; E853-H856 PolarHBondContact O-N 3.32Å; H856-R858 PolarHBondContact O-N 3.43Å; H856-R859 WeakPolarHBondContact O-CB 3.47Å; H856-R859 PolarHBondContact O-N 3.05Å; H856-N860 VanDerWaalsContact O-CG 3.24Å; H856-N860 PolarHBondContact O-N 2.81Å; H856-N860 PolarHBondContact O-OD1 3Å; H856-L1254 VanDerWaalsContact NE2-CD2 3.29Å; H856-L1254 WeakPolarHBondContact NE2-CD2 3.18Å
857	K	85.6	Confident	85.2	Confident	103 Å²	103	54.4 Å²	54.4	45%	0.448	28%	0.284	S	S	.	.	H	α-helix	trans	-57.9	-49.7	176	-161.9	-176.1	-174.1	-156.5	0	111.3	E782 E853 R859 N860 L861	E782-K857 WeakPolarHBondContact OE1-CE 3.35Å; E782-K857 IonicContact OE1-NZ 4Å; E782-K857 PolarHBondContact OE1-NZ 3.41Å; E782-K857 WeakPolarHBondContact OE2-CE 3.37Å; E782-K857 IonicContact OE2-NZ 2.92Å; E782-K857 PolarHBondContact OE2-NZ 3.25Å; E853-K857 PolarHBondContact O-N 2.88Å; K857-R859 PolarHBondContact O-N 3.17Å; K857-N860 PolarHBondContact O-N 3.4Å; K857-L861 WeakPolarHBondContact O-CG 3.39Å; K857-L861 PolarHBondContact O-N 3.13Å; K857-L861 VanDerWaalsContact O-N 3.09Å
858	R	90.8	Very high	86.6	Confident	44 Å²	44	48.8 Å²	48.8	17%	0.166	25%	0.254	C	S	.	.	H	α-helix	trans	-62.7	-38.9	175.8	-70.8	-176.5	-77.6	-156.8	1.3	112.9	Q829 V830 D837 A854 L855 H856 L862 Y893	Q829-R858 WeakPolarHBondContact O-CD 3.44Å; V830-R858 HydrophobicContact CG1-CB 4.49Å; D837-R858 IonicContact OD2-NH1 3.36Å; D837-R858 IonicContact OD2-NH2 3.82Å; A854-R858 WeakPolarHBondContact O-CG 3.25Å; A854-R858 PolarHBondContact O-N 3.28Å; A854-R858 VanDerWaalsContact O-N 3.15Å; A854-R858 PolarHBondContact O-NE 3.32Å; L855-R858 PolarHBondContact O-N 3.24Å; H856-R858 PolarHBondContact O-N 3.43Å; R858-L862 PolarHBondContact O-N 2.95Å; R858-L862 VanDerWaalsContact O-N 3.08Å; R858-Y893 HydrophobicContact CB-CE1 4.17Å; R858-Y893 VanDerWaalsContact CB-OH 3.31Å; R858-Y893 WeakPolarHBondContact CB-OH 3.49Å
859	R	92.3	Very high	87.8	Confident	11 Å²	11	41.3 Å²	41.3	4%	0.042	22%	0.219	C	C	.	.	H	α-helix	trans	-61.5	-42.7	173.1	-79.6	171.2	66.1	87.6	-4.4	112.1	L855 H856 K857 L862 A863 D892 Y893 D895 I896	L855-R859 HydrophobicContact CD1-CG 4.11Å; L855-R859 HydrophobicContact CG-CG 4.42Å; L855-R859 WeakPolarHBondContact O-CB 3.28Å; L855-R859 VanDerWaalsContact O-CG 3.3Å; L855-R859 WeakPolarHBondContact O-CG 3.12Å; L855-R859 PolarHBondContact O-N 3.02Å; H856-R859 WeakPolarHBondContact O-CB 3.47Å; H856-R859 PolarHBondContact O-N 3.05Å; K857-R859 PolarHBondContact O-N 3.17Å; R859-L862 PolarHBondContact O-N 3.42Å; R859-A863 WeakPolarHBondContact O-CB 3.35Å; R859-A863 PolarHBondContact O-N 3.32Å; R859-D892 WeakPolarHBondContact CD-O 3.42Å; R859-D892 WeakPolarHBondContact CG-O 3.36Å; R859-D892 PolarHBondContact NH1-O 3.08Å; R859-Y893 HydrophobicContact CG-CD1 3.8Å; R859-Y893 HydrophobicContact CG-CE1 3.91Å; R859-D895 IonicContact CZ-OD1 2.79Å; R859-D895 IonicContact CZ-OD2 2.66Å; R859-D895 IonicContact NH1-OD1 3.23Å; R859-D895 PolarHBondContact NH1-OD1 3.08Å; R859-D895 IonicContact NH1-OD2 2.76Å; R859-D895 PolarHBondContact NH1-OD2 3.15Å; R859-D895 IonicContact NH2-OD1 3.47Å; R859-D895 IonicContact NH2-OD2 2.74Å; R859-D895 PolarHBondContact NH2-OD2 2.96Å; R859-I896 HydrophobicContact CB-CD1 3.81Å; R859-I896 HydrophobicContact CG-CD1 3.9Å
860	N	87.1	Confident	89	Confident	85 Å²	85	38.6 Å²	38.6	46%	0.455	20%	0.195	S	C	.	.	H	α-helix	trans	-66.1	-43.8	179.3	-69.3	-1.8	0	0	0	111.7	H856 K857 L862 A863 A864 Y1258	H856-N860 VanDerWaalsContact O-CG 3.24Å; H856-N860 PolarHBondContact O-N 2.81Å; H856-N860 PolarHBondContact O-OD1 3Å; K857-N860 PolarHBondContact O-N 3.4Å; N860-L862 PolarHBondContact O-N 3.12Å; N860-A863 PolarHBondContact O-N 2.93Å; N860-A864 PolarHBondContact O-N 3.22Å; N860-Y1258 VanDerWaalsContact OD1-CE1 3.27Å; N860-Y1258 WeakPolarHBondContact OD1-CE1 3.49Å; N860-Y1258 PolarHBondContact OD1-OH 3.35Å
861	L	94	Very high	89.8	Confident	8 Å²	8	38.3 Å²	38.3	4%	0.042	19%	0.185	C	C	.	.	H	α-helix	trans	-59	-46.3	174.5	-66.1	168.6	0	0	0	111.5	E782 F785 F825 I826 V830 K857 A864 Y865	E782-L861 HydrophobicContact CG-CD1 4.34Å; F785-L861 HydrophobicContact CD1-CD2 3.65Å; F785-L861 HydrophobicContact CE1-CB 4.35Å; F785-L861 HydrophobicContact CE1-CD2 4.12Å; F825-L861 HydrophobicContact CE1-CB 4.48Å; F825-L861 HydrophobicContact CE1-CD1 4.1Å; F825-L861 HydrophobicContact CE1-CD2 4.04Å; F825-L861 HydrophobicContact CE1-CG 4.44Å; F825-L861 HydrophobicContact CZ-CD1 4.13Å; F825-L861 HydrophobicContact CZ-CD2 4.18Å; I826-L861 HydrophobicContact CD1-CB 4.42Å; I826-L861 WeakPolarHBondContact CD1-O 3.43Å; V830-L861 HydrophobicContact CG2-CB 4.22Å; K857-L861 WeakPolarHBondContact O-CG 3.39Å; K857-L861 PolarHBondContact O-N 3.13Å; K857-L861 VanDerWaalsContact O-N 3.09Å; L861-A864 WeakPolarHBondContact O-CB 3.4Å; L861-A864 PolarHBondContact O-N 3.14Å; L861-Y865 PolarHBondContact O-N 2.93Å
862	L	96.6	Very high	90.5	Very high	0 Å²	0	37.5 Å²	37.5	0%	0	19%	0.186	C	C	.	.	H	α-helix	trans	-62.9	-43	176.2	-175.4	61.3	0	0	0	112.5	I826 V830 F831 R858 R859 N860 A864 Y865 C866 I882 Y893 I896 I897	I826-L862 HydrophobicContact CG2-CD1 3.9Å; V830-L862 HydrophobicContact CG1-CB 4.07Å; V830-L862 HydrophobicContact CG1-CD2 4.27Å; V830-L862 HydrophobicContact CG2-CB 4.47Å; F831-L862 HydrophobicContact CE1-CD2 4.36Å; F831-L862 HydrophobicContact CE2-CD1 4.45Å; F831-L862 HydrophobicContact CZ-CD1 3.86Å; F831-L862 HydrophobicContact CZ-CD2 4.3Å; R858-L862 PolarHBondContact O-N 2.95Å; R858-L862 VanDerWaalsContact O-N 3.08Å; R859-L862 PolarHBondContact O-N 3.42Å; N860-L862 PolarHBondContact O-N 3.12Å; L862-A864 VanDerWaalsContact C-N 3.32Å; L862-A864 PolarHBondContact O-N 3.37Å; L862-Y865 PolarHBondContact O-N 2.7Å; L862-C866 WeakPolarHBondContact O-CB 3.36Å; L862-C866 PolarHBondContact O-N 2.91Å; L862-C866 PolarHBondContact O-SG 3.32Å; L862-I882 HydrophobicContact CD1-CD1 4.22Å; L862-I882 HydrophobicContact CD1-CG1 4.35Å; L862-I882 HydrophobicContact CD1-CG2 4.19Å; L862-Y893 HydrophobicContact CD2-CD1 3.96Å; L862-Y893 HydrophobicContact CD2-CD2 4.33Å; L862-Y893 HydrophobicContact CD2-CG 3.71Å; L862-I896 HydrophobicContact CD2-CB 4.47Å; L862-I896 HydrophobicContact CD2-CG2 4.15Å; L862-I896 HydrophobicContact CG-CG2 4.12Å; L862-I897 HydrophobicContact CD2-CG1 4.22Å
863	A	93.6	Very high	91.5	Very high	2 Å²	2	34.8 Å²	34.8	2%	0.017	17%	0.173	C	C	.	.	H	α-helix	trans	-59.5	-43.8	176.3	0	0	0	0	0	111.1	R859 N860 Y865 C866 K867 Y1258	R859-A863 WeakPolarHBondContact O-CB 3.35Å; R859-A863 PolarHBondContact O-N 3.32Å; N860-A863 PolarHBondContact O-N 2.93Å; A863-Y865 PolarHBondContact O-N 3.49Å; A863-C866 PolarHBondContact O-N 3.19Å; A863-C866 VanDerWaalsContact O-N 3.17Å; A863-K867 WeakPolarHBondContact O-CG 3.3Å; A863-K867 PolarHBondContact O-N 3.49Å; A863-Y1258 HydrophobicContact CB-CD1 3.76Å; A863-Y1258 HydrophobicContact CB-CE1 4.19Å; A863-Y1258 HydrophobicContact CB-CG 4.13Å
864	A	93.5	Very high	92.5	Very high	7 Å²	7	28.1 Å²	28.1	6%	0.058	14%	0.142	C	C	.	.	H	α-helix	trans	-57.1	-47	178	0	0	0	0	0	112.5	C789 N860 L861 L862 K867	C789-A864 HydrophobicContact CB-CB 3.9Å; N860-A864 PolarHBondContact O-N 3.22Å; L861-A864 WeakPolarHBondContact O-CB 3.4Å; L861-A864 PolarHBondContact O-N 3.14Å; L862-A864 VanDerWaalsContact C-N 3.32Å; L862-A864 PolarHBondContact O-N 3.37Å; A864-K867 WeakPolarHBondContact O-CB 3.41Å; A864-K867 PolarHBondContact O-N 3.08Å
865	Y	97.8	Very high	93.1	Very high	0 Å²	0	31.4 Å²	31.4	0%	0	15%	0.15	C	C	.	.	H	α-helix	trans	-66.8	-39.5	174.9	-164	-96.5	0	0	0	112.8	F785 Q819 L822 L823 I826 L861 L862 A863 K867 L868 I869 V874 T878 I882	F785-Y865 HydrophobicContact CE2-CD2 4.43Å; F785-Y865 HydrophobicContact CZ-CD2 4.24Å; Q819-Y865 PolarHBondContact O-OH 2.75Å; L822-Y865 HydrophobicContact CB-CD2 4.09Å; L822-Y865 HydrophobicContact CB-CE2 3.66Å; L823-Y865 HydrophobicContact CD1-CE1 3.89Å; I826-Y865 HydrophobicContact CG1-CD2 4.19Å; I826-Y865 HydrophobicContact CG1-CG 3.92Å; L861-Y865 PolarHBondContact O-N 2.93Å; L862-Y865 PolarHBondContact O-N 2.7Å; A863-Y865 PolarHBondContact O-N 3.49Å; Y865-K867 VanDerWaalsContact C-N 3.3Å; Y865-K867 PolarHBondContact O-N 3.29Å; Y865-L868 HydrophobicContact CD2-CD1 4.3Å; Y865-L868 WeakPolarHBondContact O-CB 3.39Å; Y865-L868 PolarHBondContact O-N 3.2Å; Y865-I869 HydrophobicContact CD1-CD1 3.88Å; Y865-I869 HydrophobicContact CD1-CG1 4.29Å; Y865-I869 HydrophobicContact CE1-CD1 3.79Å; Y865-I869 HydrophobicContact CE1-CG1 4.09Å; Y865-I869 PolarHBondContact O-N 3.31Å; Y865-V874 HydrophobicContact CE1-CG2 4.49Å; Y865-T878 VanDerWaalsContact OH-CB 3.27Å; Y865-T878 WeakPolarHBondContact OH-CB 3.47Å; Y865-T878 WeakPolarHBondContact OH-CG2 3.48Å; Y865-T878 PolarHBondContact OH-OG1 2.82Å; Y865-T878 VanDerWaalsContact OH-OG1 3.09Å; Y865-I882 HydrophobicContact CD1-CD1 3.55Å; Y865-I882 HydrophobicContact CE1-CD1 3.93Å
866	C	97.3	Very high	93.6	Very high	0 Å²	0	30.4 Å²	30.4	0%	0	15%	0.145	C	C	.	.	H	α-helix	trans	-63.3	-33.1	177.1	-72.7	0	0	0	0	112.5	L862 A863 L868 I869 I870 T900 F1259	L862-C866 WeakPolarHBondContact O-CB 3.36Å; L862-C866 PolarHBondContact O-N 2.91Å; L862-C866 PolarHBondContact O-SG 3.32Å; A863-C866 PolarHBondContact O-N 3.19Å; A863-C866 VanDerWaalsContact O-N 3.17Å; C866-L868 VanDerWaalsContact C-N 3.31Å; C866-L868 PolarHBondContact O-N 3.26Å; C866-I869 PolarHBondContact O-N 3.35Å; C866-I870 WeakPolarHBondContact O-CD1 3.47Å; C866-I870 VanDerWaalsContact O-CG1 3.25Å; C866-I870 WeakPolarHBondContact O-CG1 3.38Å; C866-I870 PolarHBondContact O-N 3.49Å; C866-T900 HydrophobicContact CB-CG2 4.02Å; C866-T900 WeakPolarHBondContact CB-OG1 3.22Å; C866-T900 PolarHBondContact SG-OG1 2.81Å; C866-F1259 HydrophobicContact CB-CE1 3.97Å; C866-F1259 HydrophobicContact CB-CZ 3.95Å
867	K	95.5	Very high	94.2	Very high	17 Å²	17	30.1 Å²	30.1	7%	0.074	15%	0.145	C	C	.	.	H	α-helix	trans	-55	-46.9	168.6	-62.9	171	-164.9	174.9	0	110.2	D790 L793 A863 A864 Y865 I869 I870 Y871 V1269	D790-K867 IonicContact OD1-NZ 2.81Å; L793-K867 HydrophobicContact CD2-CB 4.08Å; L793-K867 HydrophobicContact CD2-CD 3.85Å; L793-K867 HydrophobicContact CD2-CG 4.48Å; A863-K867 WeakPolarHBondContact O-CG 3.3Å; A863-K867 PolarHBondContact O-N 3.49Å; A864-K867 WeakPolarHBondContact O-CB 3.41Å; A864-K867 PolarHBondContact O-N 3.08Å; Y865-K867 VanDerWaalsContact C-N 3.3Å; Y865-K867 PolarHBondContact O-N 3.29Å; K867-I869 VanDerWaalsContact C-N 3.34Å; K867-I869 PolarHBondContact O-N 3.45Å; K867-I870 PolarHBondContact O-N 3.48Å; K867-Y871 VanDerWaalsContact O-CD2 3.3Å; K867-Y871 WeakPolarHBondContact O-CD2 3.44Å; K867-Y871 PolarHBondContact O-N 3.07Å; K867-V1269 PolarHBondContact NZ-O 3.3Å
868	L	96.8	Very high	94.7	Very high	0 Å²	0	26 Å²	26	0%	0	13%	0.129	C	C	.	.	H	α-helix	trans	-61.9	-37.4	-178.7	-58.2	-180	0	0	0	113.2	C789 L792 L793 L822 Y865 C866 N872 V873 V874	C789-L868 HydrophobicContact CB-CD1 4.35Å; L792-L868 HydrophobicContact CB-CD2 4.02Å; L792-L868 HydrophobicContact CD1-CD1 4.39Å; L793-L868 HydrophobicContact CB-CD2 4.13Å; L822-L868 HydrophobicContact CD1-CD1 4.47Å; Y865-L868 HydrophobicContact CD2-CD1 4.3Å; Y865-L868 WeakPolarHBondContact O-CB 3.39Å; Y865-L868 PolarHBondContact O-N 3.2Å; C866-L868 VanDerWaalsContact C-N 3.31Å; C866-L868 PolarHBondContact O-N 3.26Å; L868-N872 PolarHBondContact O-N 2.82Å; L868-V873 HydrophobicContact CB-CB 4.21Å; L868-V873 HydrophobicContact CD2-CB 4.01Å; L868-V873 HydrophobicContact CD2-CG1 4.05Å; L868-V873 HydrophobicContact CD2-CG2 4.25Å; L868-V873 PolarHBondContact O-N 3.45Å; L868-V874 HydrophobicContact CB-CG1 4.06Å; L868-V874 HydrophobicContact CB-CG2 3.94Å; L868-V874 HydrophobicContact CD1-CG1 4.17Å; L868-V874 PolarHBondContact O-N 2.97Å
869	I	96.5	Very high	94.9	Very high	1 Å²	1	24 Å²	24	1%	0.005	12%	0.121	C	C	.	.	H	α-helix	trans	-66.2	-48.3	174.1	-65.4	168.8	0	0	0	110.3	Y865 C866 K867 Y871 N872 V874 M876 I882 T904	Y865-I869 HydrophobicContact CD1-CD1 3.88Å; Y865-I869 HydrophobicContact CD1-CG1 4.29Å; Y865-I869 HydrophobicContact CE1-CD1 3.79Å; Y865-I869 HydrophobicContact CE1-CG1 4.09Å; Y865-I869 PolarHBondContact O-N 3.31Å; C866-I869 PolarHBondContact O-N 3.35Å; K867-I869 VanDerWaalsContact C-N 3.34Å; K867-I869 PolarHBondContact O-N 3.45Å; I869-Y871 PolarHBondContact O-N 3.09Å; I869-N872 PolarHBondContact O-N 3.34Å; I869-V874 HydrophobicContact CG1-CG2 3.73Å; I869-M876 HydrophobicContact CG2-CG 4.44Å; I869-I882 HydrophobicContact CD1-CD1 3.94Å; I869-T904 HydrophobicContact CG2-CG2 3.67Å
870	I	95.5	Very high	95.1	Very high	11 Å²	11	23.4 Å²	23.4	6%	0.056	12%	0.119	C	C	.	.	H	α-helix	trans	-66.4	-38	-175.6	-67.6	165.7	0	0	0	111.5	C866 K867 N872 T900 K903 I907 F1259	C866-I870 WeakPolarHBondContact O-CD1 3.47Å; C866-I870 VanDerWaalsContact O-CG1 3.25Å; C866-I870 WeakPolarHBondContact O-CG1 3.38Å; C866-I870 PolarHBondContact O-N 3.49Å; K867-I870 PolarHBondContact O-N 3.48Å; I870-N872 VanDerWaalsContact C-N 3.27Å; I870-N872 PolarHBondContact O-N 2.88Å; I870-T900 HydrophobicContact CD1-CG2 4.23Å; I870-T900 HydrophobicContact CG1-CG2 4.17Å; I870-K903 HydrophobicContact CD1-CB 3.98Å; I870-K903 HydrophobicContact CD1-CG 4.15Å; I870-K903 HydrophobicContact CG1-CB 3.87Å; I870-K903 HydrophobicContact CG2-CB 3.92Å; I870-K903 HydrophobicContact CG2-CD 4.41Å; I870-K903 HydrophobicContact CG2-CG 4.45Å; I870-I907 HydrophobicContact CG2-CD1 4.24Å; I870-I907 WeakPolarHBondContact O-CD1 3.17Å; I870-F1259 HydrophobicContact CD1-CD1 3.46Å; I870-F1259 VanDerWaalsContact CD1-CD1 3.46Å; I870-F1259 HydrophobicContact CD1-CE1 3.4Å; I870-F1259 VanDerWaalsContact CD1-CE1 3.4Å; I870-F1259 HydrophobicContact CD1-CG 4.33Å; I870-F1259 HydrophobicContact CD1-CZ 4.22Å
871	Y	93.3	Very high	95.6	Very high	53 Å²	53	20.1 Å²	20.1	21%	0.208	10%	0.101	C	C	.	.	T	Hydrogen-bonded Turn	trans	-89.1	12.7	177	-69.2	-73.7	0	0	0	113.6	L793 H797 Q798 K867 I869 V873 I1264	L793-Y871 HydrophobicContact CD1-CD2 3.81Å; L793-Y871 HydrophobicContact CD1-CG 3.91Å; H797-Y871 PolarHBondContact CE1-O 3.27Å; Q798-Y871 HydrophobicContact CG-CD1 4.49Å; K867-Y871 VanDerWaalsContact O-CD2 3.3Å; K867-Y871 WeakPolarHBondContact O-CD2 3.44Å; K867-Y871 PolarHBondContact O-N 3.07Å; I869-Y871 PolarHBondContact O-N 3.09Å; Y871-V873 VanDerWaalsContact C-N 3.26Å; Y871-V873 PolarHBondContact O-N 3Å; Y871-I1264 HydrophobicContact CE1-CD1 4.38Å; Y871-I1264 HydrophobicContact CE2-CD1 3.59Å; Y871-I1264 VanDerWaalsContact CZ-CD1 3.48Å; Y871-I1264 VanDerWaalsContact OH-CD1 3.23Å; Y871-I1264 WeakPolarHBondContact OH-CD1 3.09Å
872	N	93.8	Very high	95.8	Very high	95 Å²	95	19.8 Å²	19.8	51%	0.508	10%	0.1	S	C	.	.	T	Hydrogen-bonded Turn	trans	52	44	175.5	-167.9	78.6	0	0	0	112.7	H797 L868 I869 I870	H797-N872 PolarHBondContact CE1-O 2.84Å; L868-N872 PolarHBondContact O-N 2.82Å; I869-N872 PolarHBondContact O-N 3.34Å; I870-N872 VanDerWaalsContact C-N 3.27Å; I870-N872 PolarHBondContact O-N 2.88Å
873	V	96	Very high	95.8	Very high	12 Å²	12	19.8 Å²	19.8	7%	0.073	10%	0.1	C	C	.	.	S	Bend	trans	-91.6	-33.2	174.3	-169.9	0	0	0	0	110.5	L792 L793 P814 L868 Y871	L792-V873 HydrophobicContact CB-CG1 4.11Å; L792-V873 WeakPolarHBondContact O-CG1 3.32Å; L793-V873 HydrophobicContact CD1-CG2 4.21Å; P814-V873 WeakPolarHBondContact CD-O 3.3Å; P814-V873 HydrophobicContact CG-CG1 4.38Å; P814-V873 WeakPolarHBondContact CG-O 3.17Å; L868-V873 HydrophobicContact CB-CB 4.21Å; L868-V873 HydrophobicContact CD2-CB 4.01Å; L868-V873 HydrophobicContact CD2-CG1 4.05Å; L868-V873 HydrophobicContact CD2-CG2 4.25Å; L868-V873 PolarHBondContact O-N 3.45Å; Y871-V873 VanDerWaalsContact C-N 3.26Å; Y871-V873 PolarHBondContact O-N 3Å
874	V	96.8	Very high	95.9	Very high	3 Å²	3	20.6 Å²	20.6	2%	0.018	10%	0.103	C	C	.	.	S	Bend	trans	-116.7	160.9	168.5	-55.6	0	0	0	0	110.1	P814 Q819 Y865 L868 I869 M876	P814-V874 HydrophobicContact CG-CG1 4.14Å; Q819-V874 HydrophobicContact CG-CB 4.16Å; Q819-V874 HydrophobicContact CG-CG1 3.84Å; Y865-V874 HydrophobicContact CE1-CG2 4.49Å; L868-V874 HydrophobicContact CB-CG1 4.06Å; L868-V874 HydrophobicContact CB-CG2 3.94Å; L868-V874 HydrophobicContact CD1-CG1 4.17Å; L868-V874 PolarHBondContact O-N 2.97Å; I869-V874 HydrophobicContact CG1-CG2 3.73Å; V874-M876 PolarHBondContact O-N 3.3Å
875	E	95.3	Very high	96.1	Very high	111 Å²	111	21.2 Å²	21.2	52%	0.519	11%	0.105	S	C	.	.			trans	-61.8	132.9	179	-71.1	-166.3	-173.6	0	0	112.4	N877 T878	E875-N877 HydrophobicContact CB-CB 4.28Å; E875-N877 PolarHBondContact O-N 3.25Å; E875-N877 PolarHBondContact OE2-ND2 3.06Å; E875-T878 PolarHBondContact O-N 3.44Å; E875-T878 PolarHBondContact O-OG1 2.79Å; E875-T878 VanDerWaalsContact O-OG1 3.08Å
876	M	95.5	Very high	95.9	Very high	13 Å²	13	22.5 Å²	22.5	6%	0.064	11%	0.11	C	C	.	.	G	3₁₀ helix	trans	-55.4	-20	174.5	-166.7	-178.4	-66.5	0	0	113.4	I869 V874 T878 G879 T904 D908 Q911 C912 T915	I869-M876 HydrophobicContact CG2-CG 4.44Å; V874-M876 PolarHBondContact O-N 3.3Å; M876-T878 VanDerWaalsContact C-N 3.3Å; M876-T878 PolarHBondContact O-N 3.12Å; M876-G879 PolarHBondContact O-N 2.82Å; M876-T904 HydrophobicContact CE-CG2 4.13Å; M876-T904 HydrophobicContact CG-CG2 4.02Å; M876-T904 HydrophobicContact SD-CG2 4.15Å; M876-D908 HydrophobicContact CE-CB 4.35Å; M876-Q911 HydrophobicContact CB-CG 4.17Å; M876-Q911 HydrophobicContact CG-CG 4.43Å; M876-Q911 HydrophobicContact SD-CB 3.87Å; M876-Q911 HydrophobicContact SD-CG 3.85Å; M876-C912 HydrophobicContact SD-CB 4.31Å; M876-T915 WeakPolarHBondContact O-CG2 3.45Å; M876-T915 PolarHBondContact O-OG1 3.25Å
877	N	94.4	Very high	95.7	Very high	56 Å²	56	25.3 Å²	25.3	30%	0.299	12%	0.123	S	C	.	.	G	3₁₀ helix	trans	-60.4	-32.2	174.3	-62.7	-36.5	0	0	0	113.6	E875 G879 A880 Q911	E875-N877 HydrophobicContact CB-CB 4.28Å; E875-N877 PolarHBondContact O-N 3.25Å; E875-N877 PolarHBondContact OE2-ND2 3.06Å; N877-G879 PolarHBondContact O-N 2.82Å; N877-A880 VanDerWaalsContact O-CB 3.31Å; N877-A880 WeakPolarHBondContact O-CB 3.45Å; N877-A880 PolarHBondContact O-N 3.22Å; N877-A880 VanDerWaalsContact O-N 3.12Å; N877-Q911 PolarHBondContact OD1-NE2 3.28Å
878	T	95.6	Very high	95.5	Very high	18 Å²	18	31.9 Å²	31.9	11%	0.11	15%	0.148	C	C	.	.	G	3₁₀ helix	trans	-66.7	-25.7	-179.9	66.9	0	0	0	0	112.2	L823 Y865 E875 M876 A880 D881	L823-T878 HydrophobicContact CD2-CG2 4.23Å; Y865-T878 VanDerWaalsContact OH-CB 3.27Å; Y865-T878 WeakPolarHBondContact OH-CB 3.47Å; Y865-T878 WeakPolarHBondContact OH-CG2 3.48Å; Y865-T878 PolarHBondContact OH-OG1 2.82Å; Y865-T878 VanDerWaalsContact OH-OG1 3.09Å; E875-T878 PolarHBondContact O-N 3.44Å; E875-T878 PolarHBondContact O-OG1 2.79Å; E875-T878 VanDerWaalsContact O-OG1 3.08Å; M876-T878 VanDerWaalsContact C-N 3.3Å; M876-T878 PolarHBondContact O-N 3.12Å; T878-A880 PolarHBondContact O-N 3.28Å; T878-D881 PolarHBondContact O-N 3.44Å
879	G	95.9	Very high	95.3	Very high	0 Å²	0	32.2 Å²	32.2	0%	0	15%	0.149	C	C	.	.	G	3₁₀ helix	trans	-58.2	-16	172.1	0	0	0	0	0	114.2	M876 N877 D881 I882 F883	M876-G879 PolarHBondContact O-N 2.82Å; N877-G879 PolarHBondContact O-N 2.82Å; G879-D881 VanDerWaalsContact C-N 3.3Å; G879-D881 PolarHBondContact O-N 3.26Å; G879-I882 PolarHBondContact O-N 3.45Å; G879-I882 VanDerWaalsContact O-N 3.16Å; G879-F883 WeakPolarHBondContact O-CB 3.3Å; G879-F883 WeakPolarHBondContact O-CD1 3.45Å; G879-F883 WeakPolarHBondContact O-CG 3.44Å; G879-F883 PolarHBondContact O-N 2.82Å
880	A	97.3	Very high	94.9	Very high	0 Å²	0	35.5 Å²	35.5	0%	0	16%	0.162	C	C	.	.	H	α-helix	trans	-63.7	-33	177.7	0	0	0	0	0	113.4	N877 T878 I882 K884 T915 L918 S919	N877-A880 VanDerWaalsContact O-CB 3.31Å; N877-A880 WeakPolarHBondContact O-CB 3.45Å; N877-A880 PolarHBondContact O-N 3.22Å; N877-A880 VanDerWaalsContact O-N 3.12Å; T878-A880 PolarHBondContact O-N 3.28Å; A880-I882 VanDerWaalsContact C-N 3.29Å; A880-K884 PolarHBondContact O-N 3.17Å; A880-T915 HydrophobicContact CB-CG2 4Å; A880-L918 HydrophobicContact CB-CB 4.11Å; A880-L918 HydrophobicContact CB-CD2 3.85Å; A880-L918 HydrophobicContact CB-CG 3.78Å; A880-S919 WeakPolarHBondContact CA-OG 3.44Å; A880-S919 WeakPolarHBondContact O-CB 3.44Å; A880-S919 PolarHBondContact O-OG 3.03Å
881	D	96.9	Very high	94.5	Very high	15 Å²	15	40.1 Å²	40.1	8%	0.08	19%	0.187	C	C	.	.	H	α-helix	trans	-80.4	-12.4	177.3	-61.8	-78.2	0	0	0	113.5	L823 T878 G879 K884 Q885 K922	L823-D881 HydrophobicContact CD1-CB 4.4Å; T878-D881 PolarHBondContact O-N 3.44Å; G879-D881 VanDerWaalsContact C-N 3.3Å; G879-D881 PolarHBondContact O-N 3.26Å; D881-K884 WeakPolarHBondContact O-CG 3.44Å; D881-K884 IonicContact OD1-NZ 3.77Å; D881-K884 PolarHBondContact OD1-NZ 3.39Å; D881-Q885 WeakPolarHBondContact O-CG 3.25Å; D881-K922 WeakPolarHBondContact OD1-CD 3.43Å; D881-K922 IonicContact OD1-NZ 3.01Å; D881-K922 PolarHBondContact OD1-NZ 3.47Å; D881-K922 IonicContact OD2-NZ 3.6Å; D881-K922 PolarHBondContact OD2-NZ 3.27Å
882	I	97.6	Very high	94.2	Very high	1 Å²	1	38.4 Å²	38.4	1%	0.005	18%	0.181	C	C	.	.	H	α-helix	trans	-95	-46.5	175	-66.8	169.7	0	0	0	110.1	I826 F831 L862 Y865 I869 G879 A880 K884 Q885 I897	I826-I882 HydrophobicContact CG2-CD1 4.42Å; I826-I882 HydrophobicContact CG2-CG1 4.37Å; F831-I882 HydrophobicContact CE2-CG1 4.15Å; F831-I882 HydrophobicContact CZ-CG1 4.33Å; F831-I882 HydrophobicContact CZ-CG2 4.35Å; L862-I882 HydrophobicContact CD1-CD1 4.22Å; L862-I882 HydrophobicContact CD1-CG1 4.35Å; L862-I882 HydrophobicContact CD1-CG2 4.19Å; Y865-I882 HydrophobicContact CD1-CD1 3.55Å; Y865-I882 HydrophobicContact CE1-CD1 3.93Å; I869-I882 HydrophobicContact CD1-CD1 3.94Å; G879-I882 PolarHBondContact O-N 3.45Å; G879-I882 VanDerWaalsContact O-N 3.16Å; A880-I882 VanDerWaalsContact C-N 3.29Å; I882-K884 VanDerWaalsContact C-N 3.28Å; I882-K884 PolarHBondContact O-N 3.2Å; I882-Q885 WeakPolarHBondContact O-CB 3.15Å; I882-Q885 PolarHBondContact O-N 3.03Å; I882-I897 HydrophobicContact CG2-CD1 4.44Å; I882-I897 HydrophobicContact CG2-CG1 3.88Å; I882-I897 HydrophobicContact CG2-CG2 4.3Å
883	F	97.6	Very high	94.1	Very high	0 Å²	0	34 Å²	34	0%	0	16%	0.157	C	C	.	.	H	α-helix	trans	-63.9	-33.4	-179	-61.9	-10.4	0	0	0	111.9	G879 Q885 Y886 I897 T900 M901 T904 T915 L916 S919 F952	G879-F883 WeakPolarHBondContact O-CB 3.3Å; G879-F883 WeakPolarHBondContact O-CD1 3.45Å; G879-F883 WeakPolarHBondContact O-CG 3.44Å; G879-F883 PolarHBondContact O-N 2.82Å; F883-Q885 PolarHBondContact O-N 3.27Å; F883-Y886 VanDerWaalsContact O-CB 3.26Å; F883-Y886 WeakPolarHBondContact O-CB 3.48Å; F883-Y886 PolarHBondContact O-N 3.16Å; F883-I897 HydrophobicContact CD1-CG2 4.13Å; F883-T900 HydrophobicContact CE1-CG2 3.88Å; F883-T900 HydrophobicContact CZ-CG2 4.37Å; F883-M901 HydrophobicContact CB-CG 4.41Å; F883-M901 HydrophobicContact CB-SD 4.19Å; F883-M901 HydrophobicContact CD1-CG 3.39Å; F883-M901 HydrophobicContact CD1-SD 4.21Å; F883-M901 HydrophobicContact CD2-CG 3.89Å; F883-M901 HydrophobicContact CD2-SD 4.45Å; F883-M901 HydrophobicContact CE1-CB 4.39Å; F883-M901 HydrophobicContact CE1-CG 3.46Å; F883-M901 VanDerWaalsContact CE1-CG 3.46Å; F883-M901 HydrophobicContact CE2-CG 3.95Å; F883-M901 HydrophobicContact CG-CG 3.62Å; F883-M901 HydrophobicContact CG-SD 4.03Å; F883-M901 HydrophobicContact CZ-CB 4.45Å; F883-M901 HydrophobicContact CZ-CG 3.75Å; F883-T904 HydrophobicContact CZ-CG2 4.29Å; F883-T915 HydrophobicContact CD2-CG2 3.73Å; F883-T915 HydrophobicContact CE2-CG2 3.6Å; F883-L916 HydrophobicContact CB-CD2 4.49Å; F883-L916 HydrophobicContact CD2-CD2 3.85Å; F883-L916 HydrophobicContact CD2-CG 4.41Å; F883-L916 HydrophobicContact CG-CD2 4.43Å; F883-S919 WeakPolarHBondContact CB-OG 3.3Å; F883-F952 HydrophobicContact CB-CZ 4.15Å; F883-F952 WeakPolarHBondContact O-CZ 3.36Å
884	K	96	Very high	93.9	Very high	20 Å²	20	33.4 Å²	33.4	9%	0.087	15%	0.154	C	C	.	.	G	3₁₀ helix	trans	-57.8	-28.3	173.7	72.8	-176.6	-173.3	-169.2	0	113.5	A880 D881 I882 Y886 K922 L923 E926	A880-K884 PolarHBondContact O-N 3.17Å; D881-K884 WeakPolarHBondContact O-CG 3.44Å; D881-K884 IonicContact OD1-NZ 3.77Å; D881-K884 PolarHBondContact OD1-NZ 3.39Å; I882-K884 VanDerWaalsContact C-N 3.28Å; I882-K884 PolarHBondContact O-N 3.2Å; K884-Y886 VanDerWaalsContact C-N 3.34Å; K884-Y886 PolarHBondContact O-N 2.89Å; K884-K922 HydrophobicContact CD-CB 4.39Å; K884-L923 HydrophobicContact CB-CD1 3.82Å; K884-L923 HydrophobicContact CB-CD2 4.03Å; K884-L923 HydrophobicContact CB-CG 3.74Å; K884-L923 HydrophobicContact CD-CD2 4.39Å; K884-L923 HydrophobicContact CD-CG 4.5Å; K884-L923 HydrophobicContact CG-CD2 4.43Å; K884-E926 IonicContact NZ-OE1 3.72Å; K884-E926 PolarHBondContact NZ-OE1 3.5Å; K884-E926 IonicContact NZ-OE2 2.73Å
885	Q	96.1	Very high	93.5	Very high	20 Å²	20	36.3 Å²	36.3	9%	0.093	17%	0.17	C	C	.	.	G	3₁₀ helix	trans	-82.2	-8.1	-177.5	-56.4	-65	12.3	0	0	114	F831 D881 I882 F883 M887 R888 Y889 I897	F831-Q885 HydrophobicContact CD1-CB 3.99Å; F831-Q885 HydrophobicContact CD1-CG 3.87Å; F831-Q885 HydrophobicContact CD2-CG 3.89Å; F831-Q885 HydrophobicContact CE1-CB 3.75Å; F831-Q885 HydrophobicContact CE1-CG 3.89Å; F831-Q885 HydrophobicContact CE2-CG 3.91Å; F831-Q885 HydrophobicContact CG-CG 3.88Å; F831-Q885 HydrophobicContact CZ-CB 4.05Å; F831-Q885 HydrophobicContact CZ-CG 3.92Å; D881-Q885 WeakPolarHBondContact O-CG 3.25Å; I882-Q885 WeakPolarHBondContact O-CB 3.15Å; I882-Q885 PolarHBondContact O-N 3.03Å; F883-Q885 PolarHBondContact O-N 3.27Å; Q885-M887 PolarHBondContact O-N 2.9Å; Q885-R888 PolarHBondContact O-N 3.11Å; Q885-R888 VanDerWaalsContact O-N 3.09Å; Q885-Y889 HydrophobicContact CB-CD2 4.07Å; Q885-Y889 PolarHBondContact O-N 3.34Å; Q885-I897 HydrophobicContact CB-CD1 4.33Å
886	Y	95.1	Very high	93.3	Very high	26 Å²	26	31.1 Å²	31.1	10%	0.102	15%	0.146	C	C	.	.	G	3₁₀ helix	trans	-52.3	-30.2	-172.9	174.3	-121	0	0	0	115.1	F883 K884 Y890 G894 I897 K898 M901 L948 R951 F952	F883-Y886 VanDerWaalsContact O-CB 3.26Å; F883-Y886 WeakPolarHBondContact O-CB 3.48Å; F883-Y886 PolarHBondContact O-N 3.16Å; K884-Y886 VanDerWaalsContact C-N 3.34Å; K884-Y886 PolarHBondContact O-N 2.89Å; Y886-Y890 HydrophobicContact CD2-CD2 4.41Å; Y886-Y890 AromaticContact CE2-CD2 3.87Å; Y886-Y890 HydrophobicContact CE2-CD2 3.87Å; Y886-Y890 AromaticContact CE2-CE2 3.9Å; Y886-Y890 HydrophobicContact CE2-CE2 3.9Å; Y886-Y890 AromaticContact CZ-CE2 3.95Å; Y886-Y890 WeakPolarHBondContact O-CB 3.44Å; Y886-G894 WeakPolarHBondContact CE2-O 3.25Å; Y886-I897 HydrophobicContact CD2-CB 4.31Å; Y886-I897 HydrophobicContact CD2-CG2 4.17Å; Y886-I897 HydrophobicContact CG-CG2 4.41Å; Y886-K898 HydrophobicContact CE2-CB 3.95Å; Y886-M901 HydrophobicContact CD1-CE 4.07Å; Y886-M901 HydrophobicContact CD2-CE 3.88Å; Y886-M901 HydrophobicContact CE1-CE 4.33Å; Y886-M901 HydrophobicContact CE2-CE 4.17Å; Y886-M901 HydrophobicContact CG-CE 3.84Å; Y886-L948 HydrophobicContact CD1-CD1 3.82Å; Y886-R951 HydrophobicContact CE1-CB 4.41Å; Y886-F952 HydrophobicContact CD1-CE1 4.19Å
887	M	92.6	Very high	93.3	Very high	59 Å²	59	30.5 Å²	30.5	29%	0.291	14%	0.143	S	C	.	.	T	Hydrogen-bonded Turn	trans	-93.8	-36	176	-88.6	-175.7	62.7	0	0	114.7	Q885 E947 L948	Q885-M887 PolarHBondContact O-N 2.9Å; M887-E947 HydrophobicContact CE-CB 4.2Å; M887-E947 HydrophobicContact CE-CG 3.54Å; M887-E947 HydrophobicContact SD-CB 4.38Å; M887-E947 HydrophobicContact SD-CG 3.78Å; M887-L948 HydrophobicContact CB-CD1 4.3Å; M887-L948 HydrophobicContact CG-CD1 3.91Å; M887-L948 VanDerWaalsContact SD-CA 3.57Å; M887-L948 HydrophobicContact SD-CB 3.8Å; M887-L948 HydrophobicContact SD-CD1 4.13Å
888	R	91.1	Very high	93.2	Very high	155 Å²	155	33.7 Å²	33.7	59%	0.585	15%	0.154	S	C	*	.	T	Hydrogen-bonded Turn	trans	-64	-44.8	179.5	-173	174.3	-175.8	156.1	4.1	110.5	D833 Q885	D833-R888 IonicContact OD1-CZ 3.97Å; D833-R888 VanDerWaalsContact OD1-CZ 3.31Å; D833-R888 IonicContact OD1-NE 3.58Å; D833-R888 PolarHBondContact OD1-NE 2.64Å; D833-R888 VanDerWaalsContact OD1-NE 3.09Å; D833-R888 IonicContact OD1-NH2 2.8Å; D833-R888 PolarHBondContact OD1-NH2 3.23Å; D833-R888 IonicContact OD2-CZ 2.71Å; D833-R888 IonicContact OD2-NH2 2.66Å; D833-R888 PolarHBondContact OD2-NH2 3.29Å; Q885-R888 PolarHBondContact O-N 3.11Å; Q885-R888 VanDerWaalsContact O-N 3.09Å
889	Y	92.5	Very high	93.1	Very high	7 Å²	7	36 Å²	36	3%	0.027	16%	0.163	C	C	.	.	T	Hydrogen-bonded Turn	trans	-110.3	40.3	-178.3	-60.5	-83.8	0	0	0	112.5	F831 I832 D833 Q885 N891 Y893 G894	F831-Y889 HydrophobicContact CB-CD2 4.49Å; F831-Y889 HydrophobicContact CB-CE2 3.82Å; F831-Y889 AromaticContact CD1-CD2 3.69Å; F831-Y889 HydrophobicContact CD1-CD2 3.69Å; F831-Y889 AromaticContact CD1-CE2 3.89Å; F831-Y889 HydrophobicContact CD1-CE2 3.89Å; F831-Y889 HydrophobicContact CD1-CG 4.18Å; F831-Y889 HydrophobicContact CE1-CD2 4.43Å; F831-Y889 HydrophobicContact CG-CD2 4.47Å; F831-Y889 HydrophobicContact CG-CE2 4.26Å; F831-Y889 PolarHBondContact O-OH 3.47Å; I832-Y889 PolarHBondContact N-OH 3.31Å; I832-Y889 WeakPolarHBondContact O-CE1 3.25Å; I832-Y889 PolarHBondContact O-OH 3.1Å; D833-Y889 PolarHBondContact N-OH 2.9Å; D833-Y889 PolarHBondContact OD1-OH 3.46Å; Q885-Y889 HydrophobicContact CB-CD2 4.07Å; Q885-Y889 PolarHBondContact O-N 3.34Å; Y889-N891 VanDerWaalsContact C-N 3.3Å; Y889-N891 PolarHBondContact O-N 3.32Å; Y889-Y893 VanDerWaalsContact CB-CD2 3.44Å; Y889-Y893 HydrophobicContact CD1-CD2 4.18Å; Y889-Y893 AromaticContact CD1-CE2 3.89Å; Y889-Y893 HydrophobicContact CD1-CE2 3.89Å; Y889-Y893 AromaticContact CG-CD2 3.88Å; Y889-Y893 HydrophobicContact CG-CD2 3.88Å; Y889-Y893 HydrophobicContact CG-CE2 4.03Å; Y889-Y893 PolarHBondContact O-N 2.8Å; Y889-G894 PolarHBondContact O-N 3.28Å
890	Y	88.6	Confident	93	Very high	70 Å²	70	36 Å²	36	28%	0.275	16%	0.163	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.7	-28.5	-174.9	-179.5	-102	0	0	0	114.1	Y886 G894 R1251	Y886-Y890 HydrophobicContact CD2-CD2 4.41Å; Y886-Y890 AromaticContact CE2-CD2 3.87Å; Y886-Y890 HydrophobicContact CE2-CD2 3.87Å; Y886-Y890 AromaticContact CE2-CE2 3.9Å; Y886-Y890 HydrophobicContact CE2-CE2 3.9Å; Y886-Y890 AromaticContact CZ-CE2 3.95Å; Y886-Y890 WeakPolarHBondContact O-CB 3.44Å; Y890-G894 WeakPolarHBondContact O-CA 3.06Å; Y890-G894 PolarHBondContact O-N 3.17Å; Y890-R1251 PolarHBondContact O-NH2 3.21Å
891	N	85.8	Confident	92.9	Very high	108 Å²	108	36.1 Å²	36.1	58%	0.578	16%	0.164	S	C	*	.	T	Hydrogen-bonded Turn	trans	-73.4	-55.7	176.9	-65.8	-24.4	0	0	0	109.8	Y889 R1251	Y889-N891 VanDerWaalsContact C-N 3.3Å; Y889-N891 PolarHBondContact O-N 3.32Å; N891-R1251 PolarHBondContact O-NH2 2.9Å
892	D	87.1	Confident	92.6	Very high	17 Å²	17	36.5 Å²	36.5	9%	0.091	17%	0.167	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.5	-48.2	-172.4	-55.7	30.9	0	0	0	113.8	Q834 L855 R859	Q834-D892 VanDerWaalsContact NE2-CG 3.27Å; Q834-D892 PolarHBondContact NE2-OD1 2.91Å; Q834-D892 PolarHBondContact NE2-OD2 3.4Å; L855-D892 HydrophobicContact CD1-CB 3.67Å; R859-D892 WeakPolarHBondContact CD-O 3.42Å; R859-D892 WeakPolarHBondContact CG-O 3.36Å; R859-D892 PolarHBondContact NH1-O 3.08Å
893	Y	93.4	Very high	92.4	Very high	2 Å²	2	38.4 Å²	38.4	1%	0.008	18%	0.176	C	C	.	.	T	Hydrogen-bonded Turn	trans	-131.4	-2.2	-167.6	-49.9	-46.5	0	0	0	113.5	V830 F831 L855 R858 R859 L862 Y889 D895 I896 I897	V830-Y893 HydrophobicContact CG1-CD1 4.41Å; V830-Y893 HydrophobicContact CG1-CD2 4.08Å; V830-Y893 HydrophobicContact CG1-CE1 3.88Å; V830-Y893 HydrophobicContact CG1-CE2 3.53Å; V830-Y893 VanDerWaalsContact CG1-CZ 3.42Å; V830-Y893 WeakPolarHBondContact O-CE2 3.44Å; V830-Y893 PolarHBondContact O-OH 3.1Å; F831-Y893 AromaticContact CD1-CD2 3.89Å; F831-Y893 HydrophobicContact CD1-CD2 3.89Å; F831-Y893 AromaticContact CD1-CE2 3.96Å; F831-Y893 HydrophobicContact CD1-CE2 3.96Å; F831-Y893 AromaticContact CE1-CD2 3.66Å; F831-Y893 HydrophobicContact CE1-CD2 3.66Å; F831-Y893 HydrophobicContact CE1-CE2 4.14Å; F831-Y893 HydrophobicContact CE1-CG 4.5Å; L855-Y893 HydrophobicContact CD1-CD1 4.48Å; L855-Y893 HydrophobicContact CD1-CE1 3.77Å; R858-Y893 HydrophobicContact CB-CE1 4.17Å; R858-Y893 VanDerWaalsContact CB-OH 3.31Å; R858-Y893 WeakPolarHBondContact CB-OH 3.49Å; R859-Y893 HydrophobicContact CG-CD1 3.8Å; R859-Y893 HydrophobicContact CG-CE1 3.91Å; L862-Y893 HydrophobicContact CD2-CD1 3.96Å; L862-Y893 HydrophobicContact CD2-CD2 4.33Å; L862-Y893 HydrophobicContact CD2-CG 3.71Å; Y889-Y893 VanDerWaalsContact CB-CD2 3.44Å; Y889-Y893 HydrophobicContact CD1-CD2 4.18Å; Y889-Y893 AromaticContact CD1-CE2 3.89Å; Y889-Y893 HydrophobicContact CD1-CE2 3.89Å; Y889-Y893 AromaticContact CG-CD2 3.88Å; Y889-Y893 HydrophobicContact CG-CD2 3.88Å; Y889-Y893 HydrophobicContact CG-CE2 4.03Å; Y889-Y893 PolarHBondContact O-N 2.8Å; Y893-D895 PolarHBondContact O-N 3.28Å; Y893-D895 VanDerWaalsContact O-N 3.16Å; Y893-I896 PolarHBondContact O-N 2.83Å; Y893-I896 VanDerWaalsContact O-N 3.12Å; Y893-I897 WeakPolarHBondContact O-CG1 3.29Å; Y893-I897 PolarHBondContact O-N 3.4Å
894	G	90.4	Very high	92.2	Very high	1 Å²	1	38.4 Å²	38.4	1%	0.01	18%	0.176	C	C	.	.	H	α-helix	trans	-61.1	-27.2	-170.6	0	0	0	0	0	114.6	Y886 Y889 Y890 K898	Y886-G894 WeakPolarHBondContact CE2-O 3.25Å; Y889-G894 PolarHBondContact O-N 3.28Å; Y890-G894 WeakPolarHBondContact O-CA 3.06Å; Y890-G894 PolarHBondContact O-N 3.17Å; G894-K898 WeakPolarHBondContact O-CB 3.39Å; G894-K898 PolarHBondContact O-N 3.36Å; G894-K898 VanDerWaalsContact O-N 3.15Å
895	D	87.9	Confident	91.9	Very high	63 Å²	63	39.9 Å²	39.9	34%	0.337	18%	0.181	S	C	.	.	H	α-helix	trans	-72.3	-49.7	171.9	55.2	-18.9	0	0	0	112.3	R859 Y893 I897 K898 E899	R859-D895 IonicContact CZ-OD1 2.79Å; R859-D895 IonicContact CZ-OD2 2.66Å; R859-D895 IonicContact NH1-OD1 3.23Å; R859-D895 PolarHBondContact NH1-OD1 3.08Å; R859-D895 IonicContact NH1-OD2 2.76Å; R859-D895 PolarHBondContact NH1-OD2 3.15Å; R859-D895 IonicContact NH2-OD1 3.47Å; R859-D895 IonicContact NH2-OD2 2.74Å; R859-D895 PolarHBondContact NH2-OD2 2.96Å; Y893-D895 PolarHBondContact O-N 3.28Å; Y893-D895 VanDerWaalsContact O-N 3.16Å; D895-I897 PolarHBondContact O-N 3.35Å; D895-K898 PolarHBondContact O-N 3.09Å; D895-E899 PolarHBondContact O-N 2.95Å
896	I	91.3	Very high	91.7	Very high	3 Å²	3	45.1 Å²	45.1	2%	0.015	21%	0.205	C	C	.	.	H	α-helix	trans	-59.1	-47.8	178.3	-59.7	176.3	0	0	0	110.5	R859 L862 Y893 E899 T900 Y1258 F1259	R859-I896 HydrophobicContact CB-CD1 3.81Å; R859-I896 HydrophobicContact CG-CD1 3.9Å; L862-I896 HydrophobicContact CD2-CB 4.47Å; L862-I896 HydrophobicContact CD2-CG2 4.15Å; L862-I896 HydrophobicContact CG-CG2 4.12Å; Y893-I896 PolarHBondContact O-N 2.83Å; Y893-I896 VanDerWaalsContact O-N 3.12Å; I896-E899 PolarHBondContact O-N 2.81Å; I896-T900 WeakPolarHBondContact O-CB 3.46Å; I896-T900 PolarHBondContact O-N 3.37Å; I896-T900 PolarHBondContact O-OG1 3.09Å; I896-Y1258 HydrophobicContact CD1-CE2 4.25Å; I896-Y1258 HydrophobicContact CG1-CD2 4.4Å; I896-F1259 HydrophobicContact CG2-CE2 4.15Å; I896-F1259 HydrophobicContact CG2-CZ 3.89Å
897	I	96.1	Very high	91.5	Very high	0 Å²	0	48.5 Å²	48.5	0%	0	22%	0.224	C	C	.	.	H	α-helix	trans	-65.9	-40.7	179.5	-60.4	169.5	0	0	0	110.5	F831 L862 I882 F883 Q885 Y886 Y893 D895 T900 M901	F831-I897 HydrophobicContact CE1-CD1 4.31Å; L862-I897 HydrophobicContact CD2-CG1 4.22Å; I882-I897 HydrophobicContact CG2-CD1 4.44Å; I882-I897 HydrophobicContact CG2-CG1 3.88Å; I882-I897 HydrophobicContact CG2-CG2 4.3Å; F883-I897 HydrophobicContact CD1-CG2 4.13Å; Q885-I897 HydrophobicContact CB-CD1 4.33Å; Y886-I897 HydrophobicContact CD2-CB 4.31Å; Y886-I897 HydrophobicContact CD2-CG2 4.17Å; Y886-I897 HydrophobicContact CG-CG2 4.41Å; Y893-I897 WeakPolarHBondContact O-CG1 3.29Å; Y893-I897 PolarHBondContact O-N 3.4Å; D895-I897 PolarHBondContact O-N 3.35Å; I897-T900 PolarHBondContact O-N 2.84Å; I897-M901 HydrophobicContact CG2-CE 4.2Å; I897-M901 WeakPolarHBondContact O-CG 3.5Å; I897-M901 PolarHBondContact O-N 2.91Å
898	K	93	Very high	91.5	Very high	123 Å²	123	48.9 Å²	48.9	54%	0.535	23%	0.227	S	C	.	.	H	α-helix	trans	-63.9	-43.8	177.8	177.5	-177.1	173.1	-168.2	0	112.8	Y886 G894 D895 M901 S902	Y886-K898 HydrophobicContact CE2-CB 3.95Å; G894-K898 WeakPolarHBondContact O-CB 3.39Å; G894-K898 PolarHBondContact O-N 3.36Å; G894-K898 VanDerWaalsContact O-N 3.15Å; D895-K898 PolarHBondContact O-N 3.09Å; K898-M901 HydrophobicContact CB-CE 4.48Å; K898-M901 PolarHBondContact O-N 3.37Å; K898-S902 WeakPolarHBondContact O-CB 3.43Å; K898-S902 PolarHBondContact O-N 3.21Å
899	E	92.7	Very high	91.6	Very high	66 Å²	66	45.7 Å²	45.7	31%	0.308	22%	0.218	S	C	.	.	H	α-helix	trans	-73	-33.1	178.9	-170.4	53.6	-157.4	0	0	111.6	D895 I896 S902 K903 F1259	D895-E899 PolarHBondContact O-N 2.95Å; I896-E899 PolarHBondContact O-N 2.81Å; E899-S902 CarbonylContact O-C 3.58Å; E899-S902 WeakPolarHBondContact O-CA 3.48Å; E899-S902 VanDerWaalsContact O-CB 3.24Å; E899-S902 WeakPolarHBondContact O-CB 3.28Å; E899-S902 PolarHBondContact O-N 3.31Å; E899-S902 WeakPolarHBondContact OE2-CB 3.29Å; E899-K903 HydrophobicContact CG-CG 4.19Å; E899-K903 VanDerWaalsContact O-CG 3.25Å; E899-K903 WeakPolarHBondContact O-CG 3.36Å; E899-K903 PolarHBondContact O-N 2.77Å; E899-K903 WeakPolarHBondContact OE1-CE 3.48Å; E899-K903 WeakPolarHBondContact OE1-CG 3.38Å; E899-F1259 HydrophobicContact CB-CD2 3.96Å; E899-F1259 HydrophobicContact CB-CE2 4.13Å; E899-F1259 HydrophobicContact CG-CB 4.4Å; E899-F1259 HydrophobicContact CG-CD2 3.77Å; E899-F1259 HydrophobicContact CG-CE2 4.42Å; E899-F1259 HydrophobicContact CG-CG 4.33Å
900	T	94.7	Very high	91.7	Very high	0 Å²	0	47.8 Å²	47.8	0%	0	23%	0.229	C	C	.	.	H	α-helix	trans	-59.6	-48.8	170.6	-52.9	0	0	0	0	111.4	C866 I870 F883 I896 I897 S902 K903 T904	C866-T900 HydrophobicContact CB-CG2 4.02Å; C866-T900 WeakPolarHBondContact CB-OG1 3.22Å; C866-T900 PolarHBondContact SG-OG1 2.81Å; I870-T900 HydrophobicContact CD1-CG2 4.23Å; I870-T900 HydrophobicContact CG1-CG2 4.17Å; F883-T900 HydrophobicContact CE1-CG2 3.88Å; F883-T900 HydrophobicContact CZ-CG2 4.37Å; I896-T900 WeakPolarHBondContact O-CB 3.46Å; I896-T900 PolarHBondContact O-N 3.37Å; I896-T900 PolarHBondContact O-OG1 3.09Å; I897-T900 PolarHBondContact O-N 2.84Å; T900-S902 PolarHBondContact O-N 2.84Å; T900-K903 PolarHBondContact O-N 3.36Å; T900-T904 WeakPolarHBondContact O-CG2 3.49Å; T900-T904 PolarHBondContact O-N 2.91Å; T900-T904 PolarHBondContact O-OG1 2.9Å
901	M	93.8	Very high	91.9	Very high	3 Å²	3	47 Å²	47	2%	0.015	23%	0.228	C	C	.	.	H	α-helix	trans	-60.3	-28.2	171	-70.4	-173.4	-64.9	0	0	113.2	F883 Y886 I897 K898 T904 R905 L916 F952	F883-M901 HydrophobicContact CB-CG 4.41Å; F883-M901 HydrophobicContact CB-SD 4.19Å; F883-M901 HydrophobicContact CD1-CG 3.39Å; F883-M901 HydrophobicContact CD1-SD 4.21Å; F883-M901 HydrophobicContact CD2-CG 3.89Å; F883-M901 HydrophobicContact CD2-SD 4.45Å; F883-M901 HydrophobicContact CE1-CB 4.39Å; F883-M901 HydrophobicContact CE1-CG 3.46Å; F883-M901 VanDerWaalsContact CE1-CG 3.46Å; F883-M901 HydrophobicContact CE2-CG 3.95Å; F883-M901 HydrophobicContact CG-CG 3.62Å; F883-M901 HydrophobicContact CG-SD 4.03Å; F883-M901 HydrophobicContact CZ-CB 4.45Å; F883-M901 HydrophobicContact CZ-CG 3.75Å; Y886-M901 HydrophobicContact CD1-CE 4.07Å; Y886-M901 HydrophobicContact CD2-CE 3.88Å; Y886-M901 HydrophobicContact CE1-CE 4.33Å; Y886-M901 HydrophobicContact CE2-CE 4.17Å; Y886-M901 HydrophobicContact CG-CE 3.84Å; I897-M901 HydrophobicContact CG2-CE 4.2Å; I897-M901 WeakPolarHBondContact O-CG 3.5Å; I897-M901 PolarHBondContact O-N 2.91Å; K898-M901 HydrophobicContact CB-CE 4.48Å; K898-M901 PolarHBondContact O-N 3.37Å; M901-T904 PolarHBondContact O-OG1 2.93Å; M901-R905 VanDerWaalsContact O-CB 3.27Å; M901-R905 WeakPolarHBondContact O-CB 3.4Å; M901-R905 PolarHBondContact O-N 3.45Å; M901-R905 PolarHBondContact O-NH1 3.42Å; M901-R905 VanDerWaalsContact O-NH1 3.17Å; M901-L916 HydrophobicContact CG-CD2 4.23Å; M901-L916 HydrophobicContact SD-CD2 3.62Å; M901-F952 HydrophobicContact CE-CE1 4.27Å; M901-F952 HydrophobicContact SD-CD1 4.12Å; M901-F952 HydrophobicContact SD-CE1 3.59Å; M901-F952 VanDerWaalsContact SD-CE1 3.59Å; M901-F952 HydrophobicContact SD-CZ 4.28Å
902	S	91.4	Very high	92.4	Very high	22 Å²	22	42 Å²	42	15%	0.154	20%	0.201	C	C	.	.	H	α-helix	trans	-74.1	-44.1	177.9	-159.5	0	0	0	0	112	K898 E899 T900 R905 Q906	K898-S902 WeakPolarHBondContact O-CB 3.43Å; K898-S902 PolarHBondContact O-N 3.21Å; E899-S902 CarbonylContact O-C 3.58Å; E899-S902 WeakPolarHBondContact O-CA 3.48Å; E899-S902 VanDerWaalsContact O-CB 3.24Å; E899-S902 WeakPolarHBondContact O-CB 3.28Å; E899-S902 PolarHBondContact O-N 3.31Å; E899-S902 WeakPolarHBondContact OE2-CB 3.29Å; T900-S902 PolarHBondContact O-N 2.84Å; S902-R905 PolarHBondContact OG-NH2 2.81Å; S902-Q906 VanDerWaalsContact O-CG 3.3Å; S902-Q906 WeakPolarHBondContact O-CG 3.5Å; S902-Q906 PolarHBondContact O-N 2.68Å; S902-Q906 PolarHBondContact O-NE2 2.65Å; S902-Q906 PolarHBondContact OG-NE2 3.48Å
903	K	92.4	Very high	92.7	Very high	41 Å²	41	41.1 Å²	41.1	18%	0.178	20%	0.196	C	C	.	.	H	α-helix	trans	-72.8	-44.8	-178.8	-64.2	-98	176.4	158.2	0	111.1	I870 E899 T900 R905 Q906 I907 F1259	I870-K903 HydrophobicContact CD1-CB 3.98Å; I870-K903 HydrophobicContact CD1-CG 4.15Å; I870-K903 HydrophobicContact CG1-CB 3.87Å; I870-K903 HydrophobicContact CG2-CB 3.92Å; I870-K903 HydrophobicContact CG2-CD 4.41Å; I870-K903 HydrophobicContact CG2-CG 4.45Å; E899-K903 HydrophobicContact CG-CG 4.19Å; E899-K903 VanDerWaalsContact O-CG 3.25Å; E899-K903 WeakPolarHBondContact O-CG 3.36Å; E899-K903 PolarHBondContact O-N 2.77Å; E899-K903 WeakPolarHBondContact OE1-CE 3.48Å; E899-K903 WeakPolarHBondContact OE1-CG 3.38Å; T900-K903 PolarHBondContact O-N 3.36Å; K903-R905 VanDerWaalsContact C-N 3.3Å; K903-R905 PolarHBondContact O-N 2.99Å; K903-Q906 WeakPolarHBondContact O-CA 3.36Å; K903-Q906 WeakPolarHBondContact O-CB 3.41Å; K903-Q906 PolarHBondContact O-N 2.61Å; K903-I907 WeakPolarHBondContact O-CD1 3.5Å; K903-I907 WeakPolarHBondContact O-CG1 3.47Å; K903-I907 PolarHBondContact O-N 2.84Å; K903-F1259 PolarHBondContact NZ-O 3.42Å
904	T	93.7	Very high	92.8	Very high	0 Å²	0	43.7 Å²	43.7	0%	0	21%	0.207	C	C	.	.	H	α-helix	trans	-58.5	-41.2	174	54.1	0	0	0	0	112	I869 M876 F883 T900 M901 Q906 I907 D908 C912	I869-T904 HydrophobicContact CG2-CG2 3.67Å; M876-T904 HydrophobicContact CE-CG2 4.13Å; M876-T904 HydrophobicContact CG-CG2 4.02Å; M876-T904 HydrophobicContact SD-CG2 4.15Å; F883-T904 HydrophobicContact CZ-CG2 4.29Å; T900-T904 WeakPolarHBondContact O-CG2 3.49Å; T900-T904 PolarHBondContact O-N 2.91Å; T900-T904 PolarHBondContact O-OG1 2.9Å; M901-T904 PolarHBondContact O-OG1 2.93Å; T904-Q906 VanDerWaalsContact C-N 3.29Å; T904-Q906 PolarHBondContact O-N 3.3Å; T904-I907 PolarHBondContact O-N 3.49Å; T904-D908 CarbonylContact O-C 3.52Å; T904-D908 PolarHBondContact O-N 3.49Å; T904-D908 VanDerWaalsContact O-O 3.14Å; T904-C912 PolarHBondContact OG1-SG 3.34Å; T904-C912 VanDerWaalsContact OG1-SG 3.41Å
905	R	91.3	Very high	93.2	Very high	52 Å²	52	43.6 Å²	43.6	20%	0.196	21%	0.207	C	C	.	.	H	α-helix	trans	-66	-25	174.1	-169.9	-179.2	65.2	-101.1	-8.7	113.9	M901 S902 K903 K909 C912 T955	M901-R905 VanDerWaalsContact O-CB 3.27Å; M901-R905 WeakPolarHBondContact O-CB 3.4Å; M901-R905 PolarHBondContact O-N 3.45Å; M901-R905 PolarHBondContact O-NH1 3.42Å; M901-R905 VanDerWaalsContact O-NH1 3.17Å; S902-R905 PolarHBondContact OG-NH2 2.81Å; K903-R905 VanDerWaalsContact C-N 3.3Å; K903-R905 PolarHBondContact O-N 2.99Å; R905-K909 HydrophobicContact CG-CG 4.32Å; R905-K909 WeakPolarHBondContact O-CG 3.41Å; R905-C912 HydrophobicContact CB-CB 4.22Å; R905-T955 PolarHBondContact NE-O 2.9Å
906	Q	90.8	Very high	93.6	Very high	129 Å²	129	40.7 Å²	40.7	60%	0.603	19%	0.191	S	C	*	.	H	α-helix	trans	-77.1	-35	173.5	-73.5	165.7	63	0	0	111.7	S902 K903 T904	S902-Q906 VanDerWaalsContact O-CG 3.3Å; S902-Q906 WeakPolarHBondContact O-CG 3.5Å; S902-Q906 PolarHBondContact O-N 2.68Å; S902-Q906 PolarHBondContact O-NE2 2.65Å; S902-Q906 PolarHBondContact OG-NE2 3.48Å; K903-Q906 WeakPolarHBondContact O-CA 3.36Å; K903-Q906 WeakPolarHBondContact O-CB 3.41Å; K903-Q906 PolarHBondContact O-N 2.61Å; T904-Q906 VanDerWaalsContact C-N 3.29Å; T904-Q906 PolarHBondContact O-N 3.3Å
907	I	91.6	Very high	93.9	Very high	97 Å²	97	40.6 Å²	40.6	50%	0.497	19%	0.191	S	C	.	.	H	α-helix	trans	-75.9	-59.1	178.9	-63.2	156.1	0	0	0	110.9	I870 K903 T904	I870-I907 HydrophobicContact CG2-CD1 4.24Å; I870-I907 WeakPolarHBondContact O-CD1 3.17Å; K903-I907 WeakPolarHBondContact O-CD1 3.5Å; K903-I907 WeakPolarHBondContact O-CG1 3.47Å; K903-I907 PolarHBondContact O-N 2.84Å; T904-I907 PolarHBondContact O-N 3.49Å
908	D	93.1	Very high	93.9	Very high	68 Å²	68	43.1 Å²	43.1	36%	0.364	20%	0.204	S	C	.	.			trans	-140.5	108.7	174.9	-172.7	-21.4	0	0	0	110.6	M876 T904 I910 Q911 C912	M876-D908 HydrophobicContact CE-CB 4.35Å; T904-D908 CarbonylContact O-C 3.52Å; T904-D908 PolarHBondContact O-N 3.49Å; T904-D908 VanDerWaalsContact O-O 3.14Å; D908-I910 VanDerWaalsContact C-N 3.34Å; D908-I910 PolarHBondContact O-N 3.06Å; D908-I910 WeakPolarHBondContact OD1-CA 3.24Å; D908-I910 WeakPolarHBondContact OD1-CB 3.32Å; D908-I910 PolarHBondContact OD1-N 3.08Å; D908-Q911 HydrophobicContact CB-CB 4.02Å; D908-Q911 PolarHBondContact OD1-N 3.31Å; D908-Q911 WeakPolarHBondContact OD2-CB 3.35Å; D908-C912 WeakPolarHBondContact O-CB 3.45Å; D908-C912 PolarHBondContact O-N 2.93Å
909	K	92.2	Very high	94.2	Very high	87 Å²	87	37.3 Å²	37.3	38%	0.378	18%	0.179	S	C	.	.	H	α-helix	trans	-64.4	-37	177.1	-64.3	171.6	-176.5	168.6	0	112.9	R905 A913 K962 A966	R905-K909 HydrophobicContact CG-CG 4.32Å; R905-K909 WeakPolarHBondContact O-CG 3.41Å; K909-A913 VanDerWaalsContact O-CB 3.3Å; K909-A913 WeakPolarHBondContact O-CB 3.36Å; K909-A913 PolarHBondContact O-N 3.1Å; K909-K962 VanDerWaalsContact CD-O 3.31Å; K909-K962 WeakPolarHBondContact CD-O 3.44Å; K909-K962 WeakPolarHBondContact CE-O 3.09Å; K909-K962 PolarHBondContact NZ-O 3.03Å; K909-A966 HydrophobicContact CB-CB 3.98Å; K909-A966 VanDerWaalsContact O-CB 3.27Å; K909-A966 WeakPolarHBondContact O-CB 3.46Å
910	I	93.6	Very high	94.4	Very high	52 Å²	52	34.1 Å²	34.1	27%	0.267	16%	0.164	S	C	.	.	H	α-helix	trans	-75.2	-49	-175.7	-58.4	179.9	0	0	0	108.7	D908 C912 A913 K914 E965 A966 M969	D908-I910 VanDerWaalsContact C-N 3.34Å; D908-I910 PolarHBondContact O-N 3.06Å; D908-I910 WeakPolarHBondContact OD1-CA 3.24Å; D908-I910 WeakPolarHBondContact OD1-CB 3.32Å; D908-I910 PolarHBondContact OD1-N 3.08Å; I910-C912 PolarHBondContact O-N 3.19Å; I910-A913 PolarHBondContact O-N 3.47Å; I910-A913 VanDerWaalsContact O-N 3.15Å; I910-K914 WeakPolarHBondContact O-CG 3.31Å; I910-K914 PolarHBondContact O-N 3.27Å; I910-E965 HydrophobicContact CD1-CB 4.29Å; I910-A966 HydrophobicContact CG1-CB 4.23Å; I910-M969 HydrophobicContact CG2-CB 4.11Å; I910-M969 HydrophobicContact CG2-CE 4.34Å; I910-M969 HydrophobicContact CG2-CG 3.97Å
911	Q	94.6	Very high	94.6	Very high	54 Å²	54	35.4 Å²	35.4	25%	0.252	17%	0.17	S	C	.	.	H	α-helix	trans	-67.7	-35.8	178.1	-165	62.4	18.5	0	0	112.3	M876 N877 D908 A913 K914 T915	M876-Q911 HydrophobicContact CB-CG 4.17Å; M876-Q911 HydrophobicContact CG-CG 4.43Å; M876-Q911 HydrophobicContact SD-CB 3.87Å; M876-Q911 HydrophobicContact SD-CG 3.85Å; N877-Q911 PolarHBondContact OD1-NE2 3.28Å; D908-Q911 HydrophobicContact CB-CB 4.02Å; D908-Q911 PolarHBondContact OD1-N 3.31Å; D908-Q911 WeakPolarHBondContact OD2-CB 3.35Å; Q911-A913 VanDerWaalsContact C-N 3.33Å; Q911-A913 PolarHBondContact O-N 3.5Å; Q911-K914 PolarHBondContact O-N 2.89Å; Q911-T915 PolarHBondContact O-N 2.95Å; Q911-T915 PolarHBondContact O-OG1 3.41Å
912	C	94.5	Very high	94.7	Very high	1 Å²	1	38.3 Å²	38.3	1%	0.007	18%	0.182	C	C	.	.	H	α-helix	trans	-59.9	-43.3	169.9	179.7	0	0	0	0	111.4	M876 T904 R905 D908 I910 K914 T915 L916	M876-C912 HydrophobicContact SD-CB 4.31Å; T904-C912 PolarHBondContact OG1-SG 3.34Å; T904-C912 VanDerWaalsContact OG1-SG 3.41Å; R905-C912 HydrophobicContact CB-CB 4.22Å; D908-C912 WeakPolarHBondContact O-CB 3.45Å; D908-C912 PolarHBondContact O-N 2.93Å; I910-C912 PolarHBondContact O-N 3.19Å; C912-K914 PolarHBondContact O-N 3.46Å; C912-T915 PolarHBondContact O-N 3.33Å; C912-L916 VanDerWaalsContact O-CG 3.29Å; C912-L916 WeakPolarHBondContact O-CG 3.32Å; C912-L916 PolarHBondContact O-N 3.27Å
913	A	94.7	Very high	94.9	Very high	0 Å²	0	38.7 Å²	38.7	0%	0	18%	0.182	C	C	.	.	H	α-helix	trans	-66.7	-34.4	177.4	0	0	0	0	0	113	K909 I910 Q911 I917 F956 A966 L970	K909-A913 VanDerWaalsContact O-CB 3.3Å; K909-A913 WeakPolarHBondContact O-CB 3.36Å; K909-A913 PolarHBondContact O-N 3.1Å; I910-A913 PolarHBondContact O-N 3.47Å; I910-A913 VanDerWaalsContact O-N 3.15Å; Q911-A913 VanDerWaalsContact C-N 3.33Å; Q911-A913 PolarHBondContact O-N 3.5Å; A913-I917 PolarHBondContact O-N 2.91Å; A913-I917 VanDerWaalsContact O-N 3.1Å; A913-F956 HydrophobicContact CB-CE1 4.03Å; A913-F956 HydrophobicContact CB-CZ 3.86Å; A913-A966 HydrophobicContact CB-CB 3.94Å; A913-L970 HydrophobicContact CB-CB 4.25Å; A913-L970 HydrophobicContact CB-CD1 4.39Å
914	K	96.1	Very high	95	Very high	55 Å²	55	36.7 Å²	36.7	24%	0.239	17%	0.174	C	C	.	.	H	α-helix	trans	-63.2	-43.8	169.9	-71	-173	165.5	-76.3	0	112	I910 Q911 C912 I917 L918 M969 D973	I910-K914 WeakPolarHBondContact O-CG 3.31Å; I910-K914 PolarHBondContact O-N 3.27Å; Q911-K914 PolarHBondContact O-N 2.89Å; C912-K914 PolarHBondContact O-N 3.46Å; K914-I917 VanDerWaalsContact O-CG2 3.32Å; K914-I917 WeakPolarHBondContact O-CG2 3.33Å; K914-I917 PolarHBondContact O-N 2.92Å; K914-L918 VanDerWaalsContact O-CB 3.31Å; K914-L918 WeakPolarHBondContact O-CB 3.43Å; K914-L918 PolarHBondContact O-N 3.48Å; K914-M969 HydrophobicContact CG-CG 4.33Å; K914-D973 WeakPolarHBondContact CG-OD2 3.35Å; K914-D973 IonicContact NZ-OD1 3.31Å; K914-D973 PolarHBondContact NZ-OD1 3.25Å; K914-D973 IonicContact NZ-OD2 3.15Å; K914-D973 PolarHBondContact NZ-OD2 3.01Å
915	T	96.9	Very high	95.1	Very high	0 Å²	0	40.3 Å²	40.3	0%	0	19%	0.193	C	C	.	.	H	α-helix	trans	-64.9	-41.4	177.2	-51.3	0	0	0	0	111.5	M876 A880 F883 Q911 C912 L918 S919	M876-T915 WeakPolarHBondContact O-CG2 3.45Å; M876-T915 PolarHBondContact O-OG1 3.25Å; A880-T915 HydrophobicContact CB-CG2 4Å; F883-T915 HydrophobicContact CD2-CG2 3.73Å; F883-T915 HydrophobicContact CE2-CG2 3.6Å; Q911-T915 PolarHBondContact O-N 2.95Å; Q911-T915 PolarHBondContact O-OG1 3.41Å; C912-T915 PolarHBondContact O-N 3.33Å; T915-L918 PolarHBondContact O-N 3.17Å; T915-S919 PolarHBondContact O-N 3.29Å; T915-S919 PolarHBondContact O-OG 3.23Å
916	L	96.6	Very high	95.2	Very high	1 Å²	1	41.1 Å²	41.1	1%	0.005	20%	0.199	C	C	.	.	H	α-helix	trans	-62.7	-42.2	176.5	-71.5	169.9	0	0	0	112.6	F883 M901 C912 S919 L920 F952 F956	F883-L916 HydrophobicContact CB-CD2 4.49Å; F883-L916 HydrophobicContact CD2-CD2 3.85Å; F883-L916 HydrophobicContact CD2-CG 4.41Å; F883-L916 HydrophobicContact CG-CD2 4.43Å; M901-L916 HydrophobicContact CG-CD2 4.23Å; M901-L916 HydrophobicContact SD-CD2 3.62Å; C912-L916 VanDerWaalsContact O-CG 3.29Å; C912-L916 WeakPolarHBondContact O-CG 3.32Å; C912-L916 PolarHBondContact O-N 3.27Å; L916-S919 WeakPolarHBondContact O-CB 3.14Å; L916-S919 PolarHBondContact O-N 3.48Å; L916-L920 PolarHBondContact O-N 2.98Å; L916-F952 HydrophobicContact CB-CD2 4.15Å; L916-F952 HydrophobicContact CB-CE2 4.43Å; L916-F952 HydrophobicContact CD2-CD1 3.95Å; L916-F952 HydrophobicContact CD2-CD2 3.82Å; L916-F952 HydrophobicContact CD2-CE1 3.93Å; L916-F952 HydrophobicContact CD2-CE2 3.8Å; L916-F952 HydrophobicContact CD2-CG 3.9Å; L916-F952 HydrophobicContact CD2-CZ 3.85Å; L916-F956 HydrophobicContact CD1-CE2 4.49Å; L916-F956 HydrophobicContact CD1-CZ 4.17Å
917	I	97.3	Very high	95.4	Very high	1 Å²	1	35.3 Å²	35.3	1%	0.005	17%	0.172	C	C	.	.	H	α-helix	trans	-73.1	-36.2	176.6	-161.3	64.5	0	0	0	111.9	A913 K914 S919 L920 Q921 L970 D973 F996 L1000	A913-I917 PolarHBondContact O-N 2.91Å; A913-I917 VanDerWaalsContact O-N 3.1Å; K914-I917 VanDerWaalsContact O-CG2 3.32Å; K914-I917 WeakPolarHBondContact O-CG2 3.33Å; K914-I917 PolarHBondContact O-N 2.92Å; I917-S919 VanDerWaalsContact C-N 3.26Å; I917-S919 PolarHBondContact O-N 2.98Å; I917-L920 HydrophobicContact CD1-CD1 4.1Å; I917-L920 PolarHBondContact O-N 3.09Å; I917-L920 VanDerWaalsContact O-N 3.15Å; I917-Q921 VanDerWaalsContact O-CG 3.28Å; I917-Q921 WeakPolarHBondContact O-CG 3.47Å; I917-Q921 PolarHBondContact O-N 3.23Å; I917-L970 HydrophobicContact CB-CD1 4.34Å; I917-L970 HydrophobicContact CB-CG 4.04Å; I917-L970 HydrophobicContact CD1-CD2 4.42Å; I917-L970 HydrophobicContact CD1-CG 4.27Å; I917-L970 HydrophobicContact CG1-CG 4.35Å; I917-D973 HydrophobicContact CG2-CB 3.92Å; I917-F996 HydrophobicContact CD1-CE1 3.79Å; I917-F996 HydrophobicContact CD1-CZ 3.65Å; I917-F996 HydrophobicContact CG1-CE1 4.18Å; I917-F996 HydrophobicContact CG1-CZ 4.14Å; I917-L1000 HydrophobicContact CD1-CD1 3.9Å
918	L	97.6	Very high	95.3	Very high	54 Å²	54	31.2 Å²	31.2	28%	0.283	15%	0.151	S	C	.	.	H	α-helix	trans	-59.3	-37	172.2	-178.7	59.9	0	0	0	111.9	A880 K914 T915 L920 Q921 K922	A880-L918 HydrophobicContact CB-CB 4.11Å; A880-L918 HydrophobicContact CB-CD2 3.85Å; A880-L918 HydrophobicContact CB-CG 3.78Å; K914-L918 VanDerWaalsContact O-CB 3.31Å; K914-L918 WeakPolarHBondContact O-CB 3.43Å; K914-L918 PolarHBondContact O-N 3.48Å; T915-L918 PolarHBondContact O-N 3.17Å; L918-L920 PolarHBondContact O-N 3.02Å; L918-Q921 PolarHBondContact O-N 2.93Å; L918-K922 WeakPolarHBondContact O-CG 3.33Å; L918-K922 PolarHBondContact O-N 3.04Å
919	S	97.9	Very high	95.2	Very high	0 Å²	0	33 Å²	33	0%	0	17%	0.169	C	C	.	.	H	α-helix	trans	-58.6	-46	174.1	-48.5	0	0	0	0	111.8	A880 F883 T915 L916 I917 K922 L923	A880-S919 WeakPolarHBondContact CA-OG 3.44Å; A880-S919 WeakPolarHBondContact O-CB 3.44Å; A880-S919 PolarHBondContact O-OG 3.03Å; F883-S919 WeakPolarHBondContact CB-OG 3.3Å; T915-S919 PolarHBondContact O-N 3.29Å; T915-S919 PolarHBondContact O-OG 3.23Å; L916-S919 WeakPolarHBondContact O-CB 3.14Å; L916-S919 PolarHBondContact O-N 3.48Å; I917-S919 VanDerWaalsContact C-N 3.26Å; I917-S919 PolarHBondContact O-N 2.98Å; S919-K922 PolarHBondContact O-N 3.21Å; S919-L923 PolarHBondContact O-N 3.22Å; S919-L923 VanDerWaalsContact O-N 3.14Å
920	L	98	Very high	95	Very high	0 Å²	0	36.4 Å²	36.4	0%	0	19%	0.186	C	C	.	.	H	α-helix	trans	-70.7	-36.1	178.5	-64.5	169.9	0	0	0	111.8	L916 I917 L918 K922 F924 I945 L948 A949 F952 F996 I999 F1003	L916-L920 PolarHBondContact O-N 2.98Å; I917-L920 HydrophobicContact CD1-CD1 4.1Å; I917-L920 PolarHBondContact O-N 3.09Å; I917-L920 VanDerWaalsContact O-N 3.15Å; L918-L920 PolarHBondContact O-N 3.02Å; L920-K922 VanDerWaalsContact C-N 3.34Å; L920-F924 WeakPolarHBondContact O-CB 3.43Å; L920-F924 PolarHBondContact O-N 3.45Å; L920-I945 HydrophobicContact CD2-CG2 3.86Å; L920-L948 HydrophobicContact CD2-CB 4.34Å; L920-L948 HydrophobicContact CD2-CD2 4.03Å; L920-L948 HydrophobicContact CD2-CG 4.11Å; L920-A949 HydrophobicContact CD1-CB 3.68Å; L920-A949 HydrophobicContact CD2-CB 4.05Å; L920-F952 HydrophobicContact CD1-CD2 3.99Å; L920-F952 HydrophobicContact CD1-CE2 4.48Å; L920-F952 HydrophobicContact CD2-CD2 4.26Å; L920-F952 HydrophobicContact CD2-CE2 4.17Å; L920-F952 HydrophobicContact CG-CD2 4.07Å; L920-F952 HydrophobicContact CG-CE2 4.05Å; L920-F996 HydrophobicContact CB-CE2 4.01Å; L920-F996 HydrophobicContact CB-CZ 4.03Å; L920-I999 HydrophobicContact CD1-CG2 4.22Å; L920-F1003 HydrophobicContact CD1-CE2 3.71Å; L920-F1003 HydrophobicContact CD1-CZ 3.76Å
921	Q	97.5	Very high	94.7	Very high	26 Å²	26	38 Å²	38	12%	0.121	20%	0.195	C	C	.	.	H	α-helix	trans	-63.5	-39.6	173.4	-69.1	172.1	7.4	0	0	111.4	I917 L918 F924 N925 D973 F977 F996	I917-Q921 VanDerWaalsContact O-CG 3.28Å; I917-Q921 WeakPolarHBondContact O-CG 3.47Å; I917-Q921 PolarHBondContact O-N 3.23Å; L918-Q921 PolarHBondContact O-N 2.93Å; Q921-F924 PolarHBondContact O-N 3.09Å; Q921-N925 PolarHBondContact O-N 2.63Å; Q921-N925 PolarHBondContact O-ND2 3.22Å; Q921-D973 PolarHBondContact NE2-O 3.2Å; Q921-F977 HydrophobicContact CB-CD2 4.02Å; Q921-F977 HydrophobicContact CB-CE1 4.36Å; Q921-F977 HydrophobicContact CB-CE2 3.85Å; Q921-F977 HydrophobicContact CB-CG 4.36Å; Q921-F977 HydrophobicContact CB-CZ 4.02Å; Q921-F977 HydrophobicContact CG-CB 4.13Å; Q921-F977 HydrophobicContact CG-CD1 3.81Å; Q921-F977 HydrophobicContact CG-CD2 3.69Å; Q921-F977 HydrophobicContact CG-CE1 4.1Å; Q921-F977 HydrophobicContact CG-CE2 4Å; Q921-F977 HydrophobicContact CG-CG 3.59Å; Q921-F977 HydrophobicContact CG-CZ 4.18Å; Q921-F996 HydrophobicContact CG-CE1 4.11Å; Q921-F996 HydrophobicContact CG-CE2 4.12Å; Q921-F996 HydrophobicContact CG-CZ 3.62Å
922	K	96.3	Very high	94.2	Very high	64 Å²	64	36.6 Å²	36.6	28%	0.278	20%	0.195	S	C	.	.	H	α-helix	trans	-62.8	-52.9	174.8	-76.6	-166.9	169.1	-161.1	0	112	D881 K884 L918 S919 L920 F924 N925 E926	D881-K922 WeakPolarHBondContact OD1-CD 3.43Å; D881-K922 IonicContact OD1-NZ 3.01Å; D881-K922 PolarHBondContact OD1-NZ 3.47Å; D881-K922 IonicContact OD2-NZ 3.6Å; D881-K922 PolarHBondContact OD2-NZ 3.27Å; K884-K922 HydrophobicContact CD-CB 4.39Å; L918-K922 WeakPolarHBondContact O-CG 3.33Å; L918-K922 PolarHBondContact O-N 3.04Å; S919-K922 PolarHBondContact O-N 3.21Å; L920-K922 VanDerWaalsContact C-N 3.34Å; K922-F924 VanDerWaalsContact C-N 3.25Å; K922-F924 PolarHBondContact O-N 2.95Å; K922-N925 PolarHBondContact O-N 3.02Å; K922-E926 VanDerWaalsContact O-CG 3.3Å; K922-E926 WeakPolarHBondContact O-CG 3.37Å; K922-E926 PolarHBondContact O-N 3.11Å
923	L	95.9	Very high	93.4	Very high	30 Å²	30	43.6 Å²	43.6	16%	0.157	23%	0.225	C	C	.	.	H	α-helix	trans	-56.2	-39	175.1	-70.4	167.9	0	0	0	112.9	K884 S919 E926 M927 I945 L948	K884-L923 HydrophobicContact CB-CD1 3.82Å; K884-L923 HydrophobicContact CB-CD2 4.03Å; K884-L923 HydrophobicContact CB-CG 3.74Å; K884-L923 HydrophobicContact CD-CD2 4.39Å; K884-L923 HydrophobicContact CD-CG 4.5Å; K884-L923 HydrophobicContact CG-CD2 4.43Å; S919-L923 PolarHBondContact O-N 3.22Å; S919-L923 VanDerWaalsContact O-N 3.14Å; L923-E926 PolarHBondContact O-N 3.19Å; L923-M927 VanDerWaalsContact O-CB 3.3Å; L923-M927 WeakPolarHBondContact O-CB 3.38Å; L923-M927 PolarHBondContact O-N 2.94Å; L923-I945 HydrophobicContact CB-CD1 3.86Å; L923-I945 HydrophobicContact CB-CG1 3.91Å; L923-I945 HydrophobicContact CB-CG2 4.27Å; L923-I945 HydrophobicContact CD1-CG1 4.43Å; L923-I945 HydrophobicContact CD1-CG2 4.47Å; L923-L948 HydrophobicContact CD1-CD2 3.44Å; L923-L948 VanDerWaalsContact CD1-CD2 3.44Å
924	F	95.8	Very high	92.7	Very high	0 Å²	0	49.2 Å²	49.2	0%	0	26%	0.264	C	S	.	.	H	α-helix	trans	-64.7	-41.4	176.7	-175.4	-92.6	0	0	0	111.8	L920 Q921 K922 M927 M928 F935 F942 F977 N993 P995 F996 I999	L920-F924 WeakPolarHBondContact O-CB 3.43Å; L920-F924 PolarHBondContact O-N 3.45Å; Q921-F924 PolarHBondContact O-N 3.09Å; K922-F924 VanDerWaalsContact C-N 3.25Å; K922-F924 PolarHBondContact O-N 2.95Å; F924-M927 HydrophobicContact CD2-CE 3.85Å; F924-M927 HydrophobicContact CE2-CE 3.91Å; F924-M928 HydrophobicContact CD1-CG 4.03Å; F924-M928 HydrophobicContact CE1-CE 3.95Å; F924-M928 HydrophobicContact CE1-CG 3.76Å; F924-M928 HydrophobicContact CE1-SD 4.29Å; F924-M928 HydrophobicContact CZ-CE 4.17Å; F924-M928 HydrophobicContact CZ-CG 4.08Å; F924-M928 HydrophobicContact CZ-SD 4.21Å; F924-M928 VanDerWaalsContact O-CB 3.26Å; F924-M928 WeakPolarHBondContact O-CB 3.35Å; F924-M928 WeakPolarHBondContact O-CG 3.17Å; F924-M928 PolarHBondContact O-N 3.16Å; F924-F935 HydrophobicContact CE2-CE1 4.25Å; F924-F935 AromaticContact CE2-CZ 3.91Å; F924-F935 HydrophobicContact CE2-CZ 3.91Å; F924-F935 HydrophobicContact CZ-CE1 4.25Å; F924-F935 HydrophobicContact CZ-CZ 4.32Å; F924-F942 HydrophobicContact CD2-CE2 4.31Å; F924-F942 HydrophobicContact CE2-CD2 4.49Å; F924-F942 HydrophobicContact CE2-CE2 4.04Å; F924-F977 AromaticContact CD1-CE1 3.68Å; F924-F977 HydrophobicContact CD1-CE1 3.68Å; F924-F977 AromaticContact CD1-CZ 3.83Å; F924-F977 HydrophobicContact CD1-CZ 3.83Å; F924-F977 HydrophobicContact CE1-CE1 4.21Å; F924-F977 HydrophobicContact CG-CE1 4.32Å; F924-N993 HydrophobicContact CE1-CB 4.23Å; F924-P995 HydrophobicContact CE2-CB 4.1Å; F924-P995 HydrophobicContact CZ-CB 4.22Å; F924-F996 HydrophobicContact CB-CD2 3.96Å; F924-F996 HydrophobicContact CB-CE2 4.23Å; F924-F996 HydrophobicContact CD1-CD2 4.45Å; F924-F996 HydrophobicContact CD2-CD2 4.02Å; F924-F996 HydrophobicContact CE2-CB 4.42Å; F924-F996 AromaticContact CG-CD2 3.88Å; F924-F996 HydrophobicContact CG-CD2 3.88Å; F924-F996 HydrophobicContact CZ-CB 4.48Å; F924-I999 HydrophobicContact CD2-CD1 3.94Å
925	N	95.2	Very high	92.2	Very high	75 Å²	75	47.9 Å²	47.9	40%	0.401	26%	0.259	S	S	.	.	H	α-helix	trans	-69.2	-37.9	175.6	-66.3	-37.9	0	0	0	112.5	Q921 K922 M928 S929 F977	Q921-N925 PolarHBondContact O-N 2.63Å; Q921-N925 PolarHBondContact O-ND2 3.22Å; K922-N925 PolarHBondContact O-N 3.02Å; N925-M928 PolarHBondContact O-N 3.26Å; N925-S929 WeakPolarHBondContact O-CB 3.37Å; N925-S929 PolarHBondContact O-N 3.28Å; N925-F977 WeakPolarHBondContact OD1-CZ 3.31Å
926	E	93.5	Very high	91.6	Very high	70 Å²	70	52.2 Å²	52.2	33%	0.327	28%	0.282	S	S	.	.	H	α-helix	trans	-60.7	-54.8	175.6	-71.5	156.1	-163	0	0	109.8	K884 K922 L923 M928 S929 E930	K884-E926 IonicContact NZ-OE1 3.72Å; K884-E926 PolarHBondContact NZ-OE1 3.5Å; K884-E926 IonicContact NZ-OE2 2.73Å; K922-E926 VanDerWaalsContact O-CG 3.3Å; K922-E926 WeakPolarHBondContact O-CG 3.37Å; K922-E926 PolarHBondContact O-N 3.11Å; L923-E926 PolarHBondContact O-N 3.19Å; E926-M928 VanDerWaalsContact C-N 3.3Å; E926-M928 PolarHBondContact O-N 2.9Å; E926-S929 WeakPolarHBondContact O-CB 3.37Å; E926-S929 PolarHBondContact O-N 3.03Å; E926-E930 PolarHBondContact O-N 3.24Å; E926-E930 VanDerWaalsContact O-N 3.12Å
927	M	93.7	Very high	91.1	Very high	7 Å²	7	55.5 Å²	55.5	3%	0.034	29%	0.294	C	S	.	.	H	α-helix	trans	-55.1	-40.9	172.9	179.8	-158.3	72.8	0	0	113	L923 F924 S929 E930 L931 F935 A941 F942 I945	L923-M927 VanDerWaalsContact O-CB 3.3Å; L923-M927 WeakPolarHBondContact O-CB 3.38Å; L923-M927 PolarHBondContact O-N 2.94Å; F924-M927 HydrophobicContact CD2-CE 3.85Å; F924-M927 HydrophobicContact CE2-CE 3.91Å; M927-S929 VanDerWaalsContact C-N 3.31Å; M927-S929 PolarHBondContact O-N 2.64Å; M927-E930 PolarHBondContact O-N 3.11Å; M927-L931 HydrophobicContact CG-CD1 3.88Å; M927-L931 HydrophobicContact CG-CG 4.46Å; M927-L931 WeakPolarHBondContact O-CB 3.2Å; M927-L931 PolarHBondContact O-N 3.25Å; M927-F935 HydrophobicContact CE-CD1 3.93Å; M927-F935 HydrophobicContact CE-CD2 3.75Å; M927-F935 HydrophobicContact CE-CE1 3.74Å; M927-F935 HydrophobicContact CE-CE2 3.57Å; M927-F935 HydrophobicContact CE-CG 3.95Å; M927-F935 HydrophobicContact CE-CZ 3.56Å; M927-F935 HydrophobicContact SD-CD2 4.12Å; M927-F935 HydrophobicContact SD-CE2 4.2Å; M927-A941 HydrophobicContact CG-CB 4.1Å; M927-A941 HydrophobicContact SD-CB 4.37Å; M927-F942 HydrophobicContact CE-CD2 4.07Å; M927-F942 HydrophobicContact SD-CB 3.89Å; M927-F942 HydrophobicContact SD-CD2 4.04Å; M927-F942 HydrophobicContact SD-CG 4.49Å; M927-I945 HydrophobicContact CB-CD1 4.15Å; M927-I945 HydrophobicContact SD-CD1 3.92Å
928	M	90.6	Very high	90.7	Very high	11 Å²	11	59.9 Å²	59.9	5%	0.054	33%	0.325	C	S	.	.	H	α-helix	trans	-69.6	-25.8	177.3	-75.1	-83.9	-90.9	0	0	113.1	F924 N925 E926 G932 F933 F935 L992	F924-M928 HydrophobicContact CD1-CG 4.03Å; F924-M928 HydrophobicContact CE1-CE 3.95Å; F924-M928 HydrophobicContact CE1-CG 3.76Å; F924-M928 HydrophobicContact CE1-SD 4.29Å; F924-M928 HydrophobicContact CZ-CE 4.17Å; F924-M928 HydrophobicContact CZ-CG 4.08Å; F924-M928 HydrophobicContact CZ-SD 4.21Å; F924-M928 VanDerWaalsContact O-CB 3.26Å; F924-M928 WeakPolarHBondContact O-CB 3.35Å; F924-M928 WeakPolarHBondContact O-CG 3.17Å; F924-M928 PolarHBondContact O-N 3.16Å; N925-M928 PolarHBondContact O-N 3.26Å; E926-M928 VanDerWaalsContact C-N 3.3Å; E926-M928 PolarHBondContact O-N 2.9Å; M928-G932 WeakPolarHBondContact O-CA 3.47Å; M928-G932 PolarHBondContact O-N 3.42Å; M928-G932 VanDerWaalsContact O-N 3.12Å; M928-F933 HydrophobicContact CE-CD1 3.82Å; M928-F935 HydrophobicContact CG-CE1 4.48Å; M928-F935 HydrophobicContact SD-CD1 3.48Å; M928-F935 WeakPolarHBondContact SD-CD1 3.32Å; M928-F935 HydrophobicContact SD-CE1 3.44Å; M928-F935 WeakPolarHBondContact SD-CE1 3.28Å; M928-L992 HydrophobicContact CE-CG 4.11Å; M928-L992 WeakPolarHBondContact CE-O 3.18Å
929	S	90.5	Very high	90.4	Very high	105 Å²	105	58.4 Å²	58.4	73%	0.734	32%	0.319	S	S	*	.	H	α-helix	trans	-77.9	-29.7	174.3	-167.4	0	0	0	0	112.5	N925 E926 M927	N925-S929 WeakPolarHBondContact O-CB 3.37Å; N925-S929 PolarHBondContact O-N 3.28Å; E926-S929 WeakPolarHBondContact O-CB 3.37Å; E926-S929 PolarHBondContact O-N 3.03Å; M927-S929 VanDerWaalsContact C-N 3.31Å; M927-S929 PolarHBondContact O-N 2.64Å
930	E	88.7	Confident	90	Very high	158 Å²	158	63.7 Å²	63.7	74%	0.738	36%	0.356	S	S	*	.	H	α-helix	trans	-85.3	-49.4	178.9	-68	172.5	-177.4	0	0	112.6	E926 M927	E926-E930 PolarHBondContact O-N 3.24Å; E926-E930 VanDerWaalsContact O-N 3.12Å; M927-E930 PolarHBondContact O-N 3.11Å
931	L	86.8	Confident	89.6	Confident	87 Å²	87	65.6 Å²	65.6	46%	0.455	37%	0.372	S	S	.	.	H	α-helix	trans	-94.8	-11.8	-174.3	-56.6	-178.4	0	0	0	113.5	M927 F935 A941	M927-L931 HydrophobicContact CG-CD1 3.88Å; M927-L931 HydrophobicContact CG-CG 4.46Å; M927-L931 WeakPolarHBondContact O-CB 3.2Å; M927-L931 PolarHBondContact O-N 3.25Å; L931-F935 HydrophobicContact CB-CB 3.85Å; L931-F935 HydrophobicContact CD1-CB 4.22Å; L931-A941 HydrophobicContact CD1-CB 4.29Å
932	G	83.4	Confident	89.4	Confident	24 Å²	24	64.6 Å²	64.6	25%	0.247	37%	0.367	C	S	.	.			trans	74.3	175.9	-176.4	0	0	0	0	0	114.3	M928 S934 F935	M928-G932 WeakPolarHBondContact O-CA 3.47Å; M928-G932 PolarHBondContact O-N 3.42Å; M928-G932 VanDerWaalsContact O-N 3.12Å; G932-S934 PolarHBondContact O-N 2.94Å; G932-F935 PolarHBondContact O-N 3.04Å
933	F	79.5	Confident	89.3	Confident	147 Å²	147	64.5 Å²	64.5	65%	0.645	37%	0.374	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.8	-2.4	-171.1	-47.8	-65.3	0	0	0	115.7	M928 L992	M928-F933 HydrophobicContact CE-CD1 3.82Å; F933-L992 HydrophobicContact CB-CD1 3.98Å; F933-L992 HydrophobicContact CD1-CD1 3.65Å; F933-L992 HydrophobicContact CD1-CD2 3.94Å; F933-L992 HydrophobicContact CD1-CG 3.97Å; F933-L992 HydrophobicContact CE1-CD1 4.34Å; F933-L992 HydrophobicContact CE1-CD2 3.9Å; F933-L992 HydrophobicContact CE1-CG 4.44Å; F933-L992 HydrophobicContact CG-CD1 3.88Å
934	S	79.4	Confident	89.2	Confident	118 Å²	118	64.6 Å²	64.6	83%	0.825	38%	0.382	S	S	*	.	T	Hydrogen-bonded Turn	trans	-124.8	41.2	-179.3	65.1	0	0	0	0	111.9	G932	G932-S934 PolarHBondContact O-N 2.94Å
935	F	84.1	Confident	89.2	Confident	28 Å²	28	65.1 Å²	65.1	12%	0.123	39%	0.385	C	S	.	.			trans	-67.8	157.6	174.6	74.1	-83.7	0	0	0	112.1	F924 M927 M928 L931 G932 R937 F942 P995	F924-F935 HydrophobicContact CE2-CE1 4.25Å; F924-F935 AromaticContact CE2-CZ 3.91Å; F924-F935 HydrophobicContact CE2-CZ 3.91Å; F924-F935 HydrophobicContact CZ-CE1 4.25Å; F924-F935 HydrophobicContact CZ-CZ 4.32Å; M927-F935 HydrophobicContact CE-CD1 3.93Å; M927-F935 HydrophobicContact CE-CD2 3.75Å; M927-F935 HydrophobicContact CE-CE1 3.74Å; M927-F935 HydrophobicContact CE-CE2 3.57Å; M927-F935 HydrophobicContact CE-CG 3.95Å; M927-F935 HydrophobicContact CE-CZ 3.56Å; M927-F935 HydrophobicContact SD-CD2 4.12Å; M927-F935 HydrophobicContact SD-CE2 4.2Å; M928-F935 HydrophobicContact CG-CE1 4.48Å; M928-F935 HydrophobicContact SD-CD1 3.48Å; M928-F935 WeakPolarHBondContact SD-CD1 3.32Å; M928-F935 HydrophobicContact SD-CE1 3.44Å; M928-F935 WeakPolarHBondContact SD-CE1 3.28Å; L931-F935 HydrophobicContact CB-CB 3.85Å; L931-F935 HydrophobicContact CD1-CB 4.22Å; G932-F935 PolarHBondContact O-N 3.04Å; F935-R937 HydrophobicContact CE2-CG 4.09Å; F935-R937 HydrophobicContact CZ-CG 4.47Å; F935-F942 HydrophobicContact CD2-CB 4.41Å; F935-F942 HydrophobicContact CD2-CD2 4.5Å; F935-F942 HydrophobicContact CE2-CB 4.05Å; F935-F942 AromaticContact CE2-CD2 3.46Å; F935-F942 HydrophobicContact CE2-CD2 3.46Å; F935-F942 VanDerWaalsContact CE2-CD2 3.46Å; F935-F942 HydrophobicContact CE2-CE2 4.02Å; F935-F942 AromaticContact CE2-CG 3.81Å; F935-F942 HydrophobicContact CE2-CG 3.81Å; F935-F942 AromaticContact CZ-CD2 3.91Å; F935-F942 HydrophobicContact CZ-CD2 3.91Å; F935-F942 HydrophobicContact CZ-CE2 4.08Å; F935-P995 HydrophobicContact CE1-CB 4.36Å; F935-P995 HydrophobicContact CE1-CG 4.22Å; F935-P995 HydrophobicContact CZ-CB 3.71Å; F935-P995 HydrophobicContact CZ-CG 4Å
936	D	85.6	Confident	89.2	Confident	90 Å²	90	64.4 Å²	64.4	48%	0.481	38%	0.378	S	S	.	.			trans	-82.8	132.8	174.1	177	32.5	0	0	0	112.2	S938 S939	D936-S938 VanDerWaalsContact C-N 3.28Å; D936-S938 VanDerWaalsContact CG-N 3.28Å; D936-S938 PolarHBondContact O-N 3.3Å; D936-S938 PolarHBondContact OD1-N 3.12Å; D936-S938 PolarHBondContact OD1-OG 3.17Å; D936-S938 VanDerWaalsContact OD2-C 3.3Å; D936-S938 WeakPolarHBondContact OD2-CA 3.43Å; D936-S938 VanDerWaalsContact OD2-CB 3.31Å; D936-S938 WeakPolarHBondContact OD2-CB 3.44Å; D936-S938 PolarHBondContact OD2-N 3.13Å; D936-S938 PolarHBondContact OD2-OG 3.5Å; D936-S939 WeakPolarHBondContact O-CB 3.4Å; D936-S939 PolarHBondContact O-N 2.9Å; D936-S939 VanDerWaalsContact O-N 3.1Å; D936-S939 PolarHBondContact O-OG 3.05Å; D936-S939 PolarHBondContact OD2-N 3.44Å
937	R	86.9	Confident	89.3	Confident	70 Å²	70	63.5 Å²	63.5	26%	0.264	37%	0.374	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.9	-12.2	174.8	-68.9	-172.4	-64.9	125.4	6.6	113.6	F935 F942 D998 D1033	F935-R937 HydrophobicContact CE2-CG 4.09Å; F935-R937 HydrophobicContact CZ-CG 4.47Å; R937-F942 HydrophobicContact CB-CD1 4.17Å; R937-F942 HydrophobicContact CB-CE1 4.18Å; R937-F942 HydrophobicContact CG-CD1 4.48Å; R937-F942 HydrophobicContact CG-CE1 4.23Å; R937-F942 HydrophobicContact CG-CZ 4.48Å; R937-F942 VanDerWaalsContact O-CD1 3.27Å; R937-F942 WeakPolarHBondContact O-CD1 3.44Å; R937-D998 IonicContact CZ-OD2 3.88Å; R937-D998 IonicContact NH1-OD2 3.13Å; R937-D998 PolarHBondContact NH1-OD2 3.36Å; R937-D1033 PolarHBondContact NH2-O 3.09Å
938	S	87.6	Confident	89.4	Confident	93 Å²	93	63.3 Å²	63.3	65%	0.65	37%	0.373	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.3	5.4	165	29.6	0	0	0	0	114.1	D936	D936-S938 VanDerWaalsContact C-N 3.28Å; D936-S938 VanDerWaalsContact CG-N 3.28Å; D936-S938 PolarHBondContact O-N 3.3Å; D936-S938 PolarHBondContact OD1-N 3.12Å; D936-S938 PolarHBondContact OD1-OG 3.17Å; D936-S938 VanDerWaalsContact OD2-C 3.3Å; D936-S938 WeakPolarHBondContact OD2-CA 3.43Å; D936-S938 VanDerWaalsContact OD2-CB 3.31Å; D936-S938 WeakPolarHBondContact OD2-CB 3.44Å; D936-S938 PolarHBondContact OD2-N 3.13Å; D936-S938 PolarHBondContact OD2-OG 3.5Å
939	S	91.5	Very high	89.7	Confident	23 Å²	23	62.8 Å²	62.8	16%	0.161	37%	0.37	C	S	.	.	S	Bend	trans	-64.1	145.8	174.6	65.3	0	0	0	0	112.5	D936 A941 F942 C943	D936-S939 WeakPolarHBondContact O-CB 3.4Å; D936-S939 PolarHBondContact O-N 2.9Å; D936-S939 VanDerWaalsContact O-N 3.1Å; D936-S939 PolarHBondContact O-OG 3.05Å; D936-S939 PolarHBondContact OD2-N 3.44Å; S939-A941 PolarHBondContact O-N 3.26Å; S939-F942 PolarHBondContact O-N 2.88Å; S939-F942 WeakPolarHBondContact OG-CB 3.47Å; S939-F942 PolarHBondContact OG-N 3.25Å; S939-C943 WeakPolarHBondContact O-CB 3.28Å; S939-C943 PolarHBondContact O-N 3.28Å; S939-C943 PolarHBondContact O-SG 2.91Å
940	S	89.1	Confident	89.9	Confident	112 Å²	112	62.6 Å²	62.6	78%	0.783	35%	0.353	S	S	*	.	H	α-helix	trans	-56.1	-38	176.7	49.6	0	0	0	0	112.8	G944	S940-G944 PolarHBondContact O-N 3.43Å
941	A	89.8	Confident	90.1	Very high	40 Å²	40	57.5 Å²	57.5	33%	0.331	33%	0.327	S	S	.	.	H	α-helix	trans	-59.9	-54.7	175.9	0	0	0	0	0	111.8	M927 L931 S939 C943 G944 I945	M927-A941 HydrophobicContact CG-CB 4.1Å; M927-A941 HydrophobicContact SD-CB 4.37Å; L931-A941 HydrophobicContact CD1-CB 4.29Å; S939-A941 PolarHBondContact O-N 3.26Å; A941-C943 PolarHBondContact O-N 3.46Å; A941-G944 PolarHBondContact O-N 3.38Å; A941-G944 VanDerWaalsContact O-N 3.16Å; A941-I945 WeakPolarHBondContact O-CG1 3.24Å; A941-I945 PolarHBondContact O-N 2.96Å; A941-I945 VanDerWaalsContact O-N 3.11Å
942	F	94.1	Very high	90.5	Very high	4 Å²	4	53.3 Å²	53.3	2%	0.018	31%	0.306	C	S	.	.	H	α-helix	trans	-64.2	-41	179.8	-173.6	-100.9	0	0	0	112.3	F924 M927 F935 R937 S939 G944 I945 K946 P995 D998 I999	F924-F942 HydrophobicContact CD2-CE2 4.31Å; F924-F942 HydrophobicContact CE2-CD2 4.49Å; F924-F942 HydrophobicContact CE2-CE2 4.04Å; M927-F942 HydrophobicContact CE-CD2 4.07Å; M927-F942 HydrophobicContact SD-CB 3.89Å; M927-F942 HydrophobicContact SD-CD2 4.04Å; M927-F942 HydrophobicContact SD-CG 4.49Å; F935-F942 HydrophobicContact CD2-CB 4.41Å; F935-F942 HydrophobicContact CD2-CD2 4.5Å; F935-F942 HydrophobicContact CE2-CB 4.05Å; F935-F942 AromaticContact CE2-CD2 3.46Å; F935-F942 HydrophobicContact CE2-CD2 3.46Å; F935-F942 VanDerWaalsContact CE2-CD2 3.46Å; F935-F942 HydrophobicContact CE2-CE2 4.02Å; F935-F942 AromaticContact CE2-CG 3.81Å; F935-F942 HydrophobicContact CE2-CG 3.81Å; F935-F942 AromaticContact CZ-CD2 3.91Å; F935-F942 HydrophobicContact CZ-CD2 3.91Å; F935-F942 HydrophobicContact CZ-CE2 4.08Å; R937-F942 HydrophobicContact CB-CD1 4.17Å; R937-F942 HydrophobicContact CB-CE1 4.18Å; R937-F942 HydrophobicContact CG-CD1 4.48Å; R937-F942 HydrophobicContact CG-CE1 4.23Å; R937-F942 HydrophobicContact CG-CZ 4.48Å; R937-F942 VanDerWaalsContact O-CD1 3.27Å; R937-F942 WeakPolarHBondContact O-CD1 3.44Å; S939-F942 PolarHBondContact O-N 2.88Å; S939-F942 WeakPolarHBondContact OG-CB 3.47Å; S939-F942 PolarHBondContact OG-N 3.25Å; F942-G944 VanDerWaalsContact C-N 3.3Å; F942-G944 PolarHBondContact O-N 3.07Å; F942-I945 PolarHBondContact O-N 3.46Å; F942-K946 WeakPolarHBondContact O-CB 3.44Å; F942-K946 PolarHBondContact O-N 2.77Å; F942-P995 HydrophobicContact CE2-CB 4.28Å; F942-P995 HydrophobicContact CZ-CB 4.41Å; F942-P995 WeakPolarHBondContact CZ-O 3.49Å; F942-D998 HydrophobicContact CE1-CB 4.2Å; F942-D998 HydrophobicContact CZ-CB 3.98Å; F942-I999 HydrophobicContact CD2-CD1 4.12Å; F942-I999 HydrophobicContact CE2-CD1 3.52Å; F942-I999 HydrophobicContact CE2-CG1 3.82Å; F942-I999 HydrophobicContact CZ-CD1 4.09Å; F942-I999 HydrophobicContact CZ-CG1 3.84Å
943	C	93.6	Very high	90.9	Very high	63 Å²	63	52.4 Å²	52.4	43%	0.426	30%	0.295	S	S	.	.	H	α-helix	trans	-62.3	-35.7	174.5	-67.1	0	0	0	0	112.4	S939 A941 K946 E947	S939-C943 WeakPolarHBondContact O-CB 3.28Å; S939-C943 PolarHBondContact O-N 3.28Å; S939-C943 PolarHBondContact O-SG 2.91Å; A941-C943 PolarHBondContact O-N 3.46Å; C943-K946 PolarHBondContact O-N 2.89Å; C943-E947 PolarHBondContact O-N 3.17Å
944	G	93	Very high	91.4	Very high	31 Å²	31	49.4 Å²	49.4	32%	0.32	29%	0.286	S	S	.	.	H	α-helix	trans	-63.9	-46.1	174.5	0	0	0	0	0	112.8	S940 A941 F942 K946 E947 L948	S940-G944 PolarHBondContact O-N 3.43Å; A941-G944 PolarHBondContact O-N 3.38Å; A941-G944 VanDerWaalsContact O-N 3.16Å; F942-G944 VanDerWaalsContact C-N 3.3Å; F942-G944 PolarHBondContact O-N 3.07Å; G944-K946 VanDerWaalsContact C-N 3.27Å; G944-K946 PolarHBondContact O-N 3.41Å; G944-E947 PolarHBondContact O-N 3.14Å; G944-L948 PolarHBondContact O-N 3.4Å
945	I	96.2	Very high	91.6	Very high	12 Å²	12	45.6 Å²	45.6	6%	0.062	26%	0.258	C	S	.	.	H	α-helix	trans	-62.1	-37.8	174.9	-55.9	169.3	0	0	0	110.5	L920 L923 M927 A941 F942 L948 A949 I999	L920-I945 HydrophobicContact CD2-CG2 3.86Å; L923-I945 HydrophobicContact CB-CD1 3.86Å; L923-I945 HydrophobicContact CB-CG1 3.91Å; L923-I945 HydrophobicContact CB-CG2 4.27Å; L923-I945 HydrophobicContact CD1-CG1 4.43Å; L923-I945 HydrophobicContact CD1-CG2 4.47Å; M927-I945 HydrophobicContact CB-CD1 4.15Å; M927-I945 HydrophobicContact SD-CD1 3.92Å; A941-I945 WeakPolarHBondContact O-CG1 3.24Å; A941-I945 PolarHBondContact O-N 2.96Å; A941-I945 VanDerWaalsContact O-N 3.11Å; F942-I945 PolarHBondContact O-N 3.46Å; I945-L948 PolarHBondContact O-N 3.22Å; I945-A949 PolarHBondContact O-N 3.27Å; I945-I999 HydrophobicContact CB-CD1 4.29Å; I945-I999 HydrophobicContact CG2-CD1 3.7Å; I945-I999 HydrophobicContact CG2-CG1 4.4Å; I945-I999 HydrophobicContact CG2-CG2 4.3Å
946	K	95.6	Very high	91.6	Very high	60 Å²	60	44.7 Å²	44.7	26%	0.261	25%	0.254	S	S	.	.	H	α-helix	trans	-68.4	-41.4	177	-172.3	169.5	177.4	168	0	113.1	F942 C943 G944 L948 A949 R950 I999 E1002	F942-K946 WeakPolarHBondContact O-CB 3.44Å; F942-K946 PolarHBondContact O-N 2.77Å; C943-K946 PolarHBondContact O-N 2.89Å; G944-K946 VanDerWaalsContact C-N 3.27Å; G944-K946 PolarHBondContact O-N 3.41Å; K946-L948 VanDerWaalsContact C-N 3.34Å; K946-A949 WeakPolarHBondContact O-CB 3.12Å; K946-A949 PolarHBondContact O-N 2.9Å; K946-R950 PolarHBondContact O-N 3.08Å; K946-I999 HydrophobicContact CB-CG1 4.46Å; K946-E1002 WeakPolarHBondContact CE-OE1 3.31Å; K946-E1002 HydrophobicContact CG-CG 3.98Å; K946-E1002 IonicContact NZ-OE1 3.53Å
947	E	94.8	Very high	91	Very high	50 Å²	50	42 Å²	42	23%	0.234	25%	0.247	C	C	.	.	H	α-helix	trans	-64.8	-37.4	172.7	168.9	60.3	-172.4	0	0	111.6	M887 C943 G944 R950 R951	M887-E947 HydrophobicContact CE-CB 4.2Å; M887-E947 HydrophobicContact CE-CG 3.54Å; M887-E947 HydrophobicContact SD-CB 4.38Å; M887-E947 HydrophobicContact SD-CG 3.78Å; C943-E947 PolarHBondContact O-N 3.17Å; G944-E947 PolarHBondContact O-N 3.14Å; E947-R950 VanDerWaalsContact CD-NH2 3.26Å; E947-R950 WeakPolarHBondContact O-CB 3.35Å; E947-R950 PolarHBondContact O-N 3.15Å; E947-R950 IonicContact OE1-CZ 2.84Å; E947-R950 IonicContact OE1-NH2 3.8Å; E947-R950 PolarHBondContact OE1-NH2 3.35Å; E947-R950 IonicContact OE2-CZ 2.59Å; E947-R950 IonicContact OE2-NE 2.72Å; E947-R950 PolarHBondContact OE2-NE 3.08Å; E947-R950 IonicContact OE2-NH2 2.87Å; E947-R950 PolarHBondContact OE2-NH2 3.13Å; E947-R951 WeakPolarHBondContact O-CG 3.44Å; E947-R951 PolarHBondContact O-N 2.95Å; E947-R951 IonicContact OE1-CZ 3.55Å; E947-R951 VanDerWaalsContact OE1-CZ 3.28Å; E947-R951 IonicContact OE1-NE 2.71Å; E947-R951 PolarHBondContact OE1-NE 3.1Å; E947-R951 IonicContact OE1-NH2 3.5Å; E947-R951 PolarHBondContact OE1-NH2 2.68Å
948	L	96.1	Very high	90.4	Very high	4 Å²	4	46.6 Å²	46.6	2%	0.021	28%	0.276	C	S	.	.	H	α-helix	trans	-61.9	-44.3	172.5	-178.8	63.5	0	0	0	111.4	Y886 M887 L920 L923 G944 I945 K946 R950 R951 F952	Y886-L948 HydrophobicContact CD1-CD1 3.82Å; M887-L948 HydrophobicContact CB-CD1 4.3Å; M887-L948 HydrophobicContact CG-CD1 3.91Å; M887-L948 VanDerWaalsContact SD-CA 3.57Å; M887-L948 HydrophobicContact SD-CB 3.8Å; M887-L948 HydrophobicContact SD-CD1 4.13Å; L920-L948 HydrophobicContact CD2-CB 4.34Å; L920-L948 HydrophobicContact CD2-CD2 4.03Å; L920-L948 HydrophobicContact CD2-CG 4.11Å; L923-L948 HydrophobicContact CD1-CD2 3.44Å; L923-L948 VanDerWaalsContact CD1-CD2 3.44Å; G944-L948 PolarHBondContact O-N 3.4Å; I945-L948 PolarHBondContact O-N 3.22Å; K946-L948 VanDerWaalsContact C-N 3.34Å; L948-R950 VanDerWaalsContact C-N 3.35Å; L948-R950 PolarHBondContact O-N 3.42Å; L948-R951 PolarHBondContact O-N 2.9Å; L948-R951 VanDerWaalsContact O-N 3.16Å; L948-F952 HydrophobicContact CD1-CD1 4.11Å; L948-F952 HydrophobicContact CD1-CE1 3.57Å; L948-F952 HydrophobicContact CD1-CE2 4.46Å; L948-F952 HydrophobicContact CD1-CZ 3.77Å; L948-F952 HydrophobicContact CD2-CE2 4.29Å; L948-F952 HydrophobicContact CD2-CZ 4.06Å; L948-F952 HydrophobicContact CG-CD1 4.49Å; L948-F952 HydrophobicContact CG-CD2 4.5Å; L948-F952 HydrophobicContact CG-CE1 4.08Å; L948-F952 HydrophobicContact CG-CE2 4.09Å; L948-F952 HydrophobicContact CG-CZ 3.86Å; L948-F952 WeakPolarHBondContact O-CG 3.44Å; L948-F952 PolarHBondContact O-N 3.47Å
949	A	96.8	Very high	89.9	Confident	0 Å²	0	45.2 Å²	45.2	0%	0	26%	0.261	C	S	.	.	H	α-helix	trans	-60.9	-41	174.4	0	0	0	0	0	112.6	L920 I945 K946 R951 F952 S953 I999 E1002 F1003	L920-A949 HydrophobicContact CD1-CB 3.68Å; L920-A949 HydrophobicContact CD2-CB 4.05Å; I945-A949 PolarHBondContact O-N 3.27Å; K946-A949 WeakPolarHBondContact O-CB 3.12Å; K946-A949 PolarHBondContact O-N 2.9Å; A949-R951 PolarHBondContact O-N 2.91Å; A949-F952 PolarHBondContact O-N 2.71Å; A949-S953 WeakPolarHBondContact O-CB 3.31Å; A949-S953 PolarHBondContact O-N 2.71Å; A949-I999 HydrophobicContact CB-CG2 3.47Å; A949-I999 VanDerWaalsContact CB-CG2 3.47Å; A949-E1002 HydrophobicContact CB-CB 4.39Å; A949-E1002 HydrophobicContact CB-CG 4.5Å; A949-F1003 HydrophobicContact CB-CE2 3.78Å; A949-F1003 HydrophobicContact CB-CZ 4.18Å; A949-F1003 WeakPolarHBondContact O-CZ 3.34Å
950	R	94.8	Very high	89.3	Confident	100 Å²	100	47.3 Å²	47.3	38%	0.377	27%	0.269	S	S	.	.	H	α-helix	trans	-60.9	-42.6	172.5	-167.3	-171.8	67.9	85.7	5.6	111.7	K946 E947 L948 S953 L954 E1002	K946-R950 PolarHBondContact O-N 3.08Å; E947-R950 VanDerWaalsContact CD-NH2 3.26Å; E947-R950 WeakPolarHBondContact O-CB 3.35Å; E947-R950 PolarHBondContact O-N 3.15Å; E947-R950 IonicContact OE1-CZ 2.84Å; E947-R950 IonicContact OE1-NH2 3.8Å; E947-R950 PolarHBondContact OE1-NH2 3.35Å; E947-R950 IonicContact OE2-CZ 2.59Å; E947-R950 IonicContact OE2-NE 2.72Å; E947-R950 PolarHBondContact OE2-NE 3.08Å; E947-R950 IonicContact OE2-NH2 2.87Å; E947-R950 PolarHBondContact OE2-NH2 3.13Å; L948-R950 VanDerWaalsContact C-N 3.35Å; L948-R950 PolarHBondContact O-N 3.42Å; R950-S953 WeakPolarHBondContact O-CB 3.41Å; R950-S953 PolarHBondContact O-N 2.96Å; R950-L954 PolarHBondContact O-N 2.9Å; R950-E1002 HydrophobicContact CB-CB 4.37Å; R950-E1002 HydrophobicContact CB-CG 4.19Å; R950-E1002 WeakPolarHBondContact CG-OE2 3.39Å
951	R	93.1	Very high	88.8	Confident	51 Å²	51	48 Å²	48	19%	0.192	26%	0.263	C	S	.	.	H	α-helix	trans	-64.3	-42.2	174.8	-70.4	-178.7	-172.4	-147	-2.6	112.3	Y886 E947 L948 A949 L954	Y886-R951 HydrophobicContact CE1-CB 4.41Å; E947-R951 WeakPolarHBondContact O-CG 3.44Å; E947-R951 PolarHBondContact O-N 2.95Å; E947-R951 IonicContact OE1-CZ 3.55Å; E947-R951 VanDerWaalsContact OE1-CZ 3.28Å; E947-R951 IonicContact OE1-NE 2.71Å; E947-R951 PolarHBondContact OE1-NE 3.1Å; E947-R951 IonicContact OE1-NH2 3.5Å; E947-R951 PolarHBondContact OE1-NH2 2.68Å; L948-R951 PolarHBondContact O-N 2.9Å; L948-R951 VanDerWaalsContact O-N 3.16Å; A949-R951 PolarHBondContact O-N 2.91Å; R951-L954 WeakPolarHBondContact O-CB 3.38Å; R951-L954 PolarHBondContact O-N 2.84Å
952	F	94.6	Very high	88.4	Confident	0 Å²	0	52.6 Å²	52.6	0%	0	28%	0.275	C	S	.	.	H	α-helix	trans	-61.8	-41	173.3	-72.3	-6.5	0	0	0	112.1	F883 Y886 M901 L916 L920 L948 A949 L954 T955 F1003	F883-F952 HydrophobicContact CB-CZ 4.15Å; F883-F952 WeakPolarHBondContact O-CZ 3.36Å; Y886-F952 HydrophobicContact CD1-CE1 4.19Å; M901-F952 HydrophobicContact CE-CE1 4.27Å; M901-F952 HydrophobicContact SD-CD1 4.12Å; M901-F952 HydrophobicContact SD-CE1 3.59Å; M901-F952 VanDerWaalsContact SD-CE1 3.59Å; M901-F952 HydrophobicContact SD-CZ 4.28Å; L916-F952 HydrophobicContact CB-CD2 4.15Å; L916-F952 HydrophobicContact CB-CE2 4.43Å; L916-F952 HydrophobicContact CD2-CD1 3.95Å; L916-F952 HydrophobicContact CD2-CD2 3.82Å; L916-F952 HydrophobicContact CD2-CE1 3.93Å; L916-F952 HydrophobicContact CD2-CE2 3.8Å; L916-F952 HydrophobicContact CD2-CG 3.9Å; L916-F952 HydrophobicContact CD2-CZ 3.85Å; L920-F952 HydrophobicContact CD1-CD2 3.99Å; L920-F952 HydrophobicContact CD1-CE2 4.48Å; L920-F952 HydrophobicContact CD2-CD2 4.26Å; L920-F952 HydrophobicContact CD2-CE2 4.17Å; L920-F952 HydrophobicContact CG-CD2 4.07Å; L920-F952 HydrophobicContact CG-CE2 4.05Å; L948-F952 HydrophobicContact CD1-CD1 4.11Å; L948-F952 HydrophobicContact CD1-CE1 3.57Å; L948-F952 HydrophobicContact CD1-CE2 4.46Å; L948-F952 HydrophobicContact CD1-CZ 3.77Å; L948-F952 HydrophobicContact CD2-CE2 4.29Å; L948-F952 HydrophobicContact CD2-CZ 4.06Å; L948-F952 HydrophobicContact CG-CD1 4.49Å; L948-F952 HydrophobicContact CG-CD2 4.5Å; L948-F952 HydrophobicContact CG-CE1 4.08Å; L948-F952 HydrophobicContact CG-CE2 4.09Å; L948-F952 HydrophobicContact CG-CZ 3.86Å; L948-F952 WeakPolarHBondContact O-CG 3.44Å; L948-F952 PolarHBondContact O-N 3.47Å; A949-F952 PolarHBondContact O-N 2.71Å; F952-L954 VanDerWaalsContact C-N 3.26Å; F952-L954 PolarHBondContact O-N 3.26Å; F952-T955 WeakPolarHBondContact O-CB 3.48Å; F952-T955 PolarHBondContact O-N 2.75Å; F952-T955 PolarHBondContact O-OG1 2.73Å; F952-F1003 HydrophobicContact CB-CE1 3.85Å; F952-F1003 HydrophobicContact CB-CZ 3.8Å
953	S	92.6	Very high	87.9	Confident	4 Å²	4	53 Å²	53	3%	0.028	28%	0.278	C	S	.	.	H	α-helix	trans	-56.5	-38.4	175.9	-177.6	0	0	0	0	112	A949 R950 T955 F956 E1002 K1006	A949-S953 WeakPolarHBondContact O-CB 3.31Å; A949-S953 PolarHBondContact O-N 2.71Å; R950-S953 WeakPolarHBondContact O-CB 3.41Å; R950-S953 PolarHBondContact O-N 2.96Å; S953-T955 VanDerWaalsContact C-N 3.29Å; S953-T955 PolarHBondContact O-N 3.42Å; S953-F956 PolarHBondContact O-N 2.8Å; S953-E1002 WeakPolarHBondContact CB-O 2.95Å; S953-E1002 PolarHBondContact OG-O 2.58Å; S953-K1006 VanDerWaalsContact O-CE 3.22Å; S953-K1006 WeakPolarHBondContact O-CE 3.45Å; S953-K1006 WeakPolarHBondContact OG-CG 3.42Å
954	L	90.3	Very high	87.7	Confident	84 Å²	84	53.7 Å²	53.7	44%	0.44	27%	0.272	S	S	.	.	H	α-helix	trans	-64	-27.6	175.3	-63.2	176.4	0	0	0	113.8	R950 R951 F952 F956 G957	R950-L954 PolarHBondContact O-N 2.9Å; R951-L954 WeakPolarHBondContact O-CB 3.38Å; R951-L954 PolarHBondContact O-N 2.84Å; F952-L954 VanDerWaalsContact C-N 3.26Å; F952-L954 PolarHBondContact O-N 3.26Å; L954-F956 PolarHBondContact O-N 2.99Å; L954-G957 PolarHBondContact O-N 2.93Å
955	T	84.4	Confident	87.6	Confident	39 Å²	39	59 Å²	59	24%	0.239	29%	0.289	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66	-19	-176.9	72.3	0	0	0	0	114.1	R905 F952 S953 G957	R905-T955 PolarHBondContact NE-O 2.9Å; F952-T955 WeakPolarHBondContact O-CB 3.48Å; F952-T955 PolarHBondContact O-N 2.75Å; F952-T955 PolarHBondContact O-OG1 2.73Å; S953-T955 VanDerWaalsContact C-N 3.29Å; S953-T955 PolarHBondContact O-N 3.42Å; T955-G957 PolarHBondContact O-N 2.95Å
956	F	82.3	Confident	87.4	Confident	9 Å²	9	58.5 Å²	58.5	4%	0.039	29%	0.286	C	S	.	.	T	Hydrogen-bonded Turn	trans	-77.8	-3.8	174.5	-63.2	-78.8	0	0	0	113.7	A913 L916 S953 L954 T963 A966 I967 L970 F1003	A913-F956 HydrophobicContact CB-CE1 4.03Å; A913-F956 HydrophobicContact CB-CZ 3.86Å; L916-F956 HydrophobicContact CD1-CE2 4.49Å; L916-F956 HydrophobicContact CD1-CZ 4.17Å; S953-F956 PolarHBondContact O-N 2.8Å; L954-F956 PolarHBondContact O-N 2.99Å; F956-T963 HydrophobicContact CB-CG2 4.16Å; F956-T963 HydrophobicContact CD1-CG2 3.96Å; F956-A966 HydrophobicContact CE1-CB 4.29Å; F956-I967 HydrophobicContact CB-CD1 4.08Å; F956-I967 HydrophobicContact CB-CG1 4.36Å; F956-I967 HydrophobicContact CD1-CD1 4.32Å; F956-I967 HydrophobicContact CD1-CG1 3.82Å; F956-I967 HydrophobicContact CD2-CG1 4.28Å; F956-I967 HydrophobicContact CE1-CG1 4.16Å; F956-I967 HydrophobicContact CG-CD1 4.17Å; F956-I967 HydrophobicContact CG-CG1 3.89Å; F956-L970 HydrophobicContact CE2-CD1 4.24Å; F956-L970 HydrophobicContact CZ-CD1 4.14Å; F956-F1003 HydrophobicContact CE2-CD1 4.14Å; F956-F1003 HydrophobicContact CE2-CE1 4.08Å
957	G	74.9	Confident	87.3	Confident	34 Å²	34	55.7 Å²	55.7	35%	0.351	27%	0.274	S	S	.	.			trans	73.3	-151.7	173	0	0	0	0	0	114.7	L954 T955 K1006	L954-G957 PolarHBondContact O-N 2.93Å; T955-G957 PolarHBondContact O-N 2.95Å; G957-K1006 PolarHBondContact O-NZ 2.66Å
958	L	73.1	Confident	87.2	Confident	165 Å²	165	54.1 Å²	54.1	86%	0.864	27%	0.27	S	S	*	.	S	Bend	trans	-106.6	-22.8	177.1	-62.3	177.7	0	0	0	113.2	Q960	L958-Q960 VanDerWaalsContact C-N 3.31Å; L958-Q960 PolarHBondContact O-N 2.9Å
959	D	77.5	Confident	87.2	Confident	64 Å²	64	56.5 Å²	56.5	34%	0.342	28%	0.281	S	S	.	.			trans	-79.6	78.4	179	-170.6	-23.9	0	0	0	110.7	L961 K962 T963	D959-L961 PolarHBondContact O-N 2.8Å; D959-L961 PolarHBondContact OD1-N 2.76Å; D959-K962 HydrophobicContact CB-CB 4.4Å; D959-K962 PolarHBondContact O-N 3.33Å; D959-K962 VanDerWaalsContact O-N 3.15Å; D959-K962 PolarHBondContact OD1-N 2.91Å; D959-K962 VanDerWaalsContact OD1-N 3.09Å; D959-K962 VanDerWaalsContact OD2-CD 3.23Å; D959-K962 WeakPolarHBondContact OD2-CD 3.46Å; D959-K962 WeakPolarHBondContact OD2-CE 3.28Å; D959-K962 WeakPolarHBondContact OD2-CG 3.46Å; D959-K962 IonicContact OD2-NZ 3.27Å; D959-K962 PolarHBondContact OD2-NZ 3.27Å; D959-T963 PolarHBondContact O-OG1 3.05Å
960	Q	78.4	Confident	87.1	Confident	67 Å²	67	56.5 Å²	56.5	31%	0.313	28%	0.281	S	S	.	.	H	α-helix	trans	-58.3	-27.7	-179.9	-64.1	-177.6	-13.8	0	0	112.6	L958 T963 R964 L1008	L958-Q960 VanDerWaalsContact C-N 3.31Å; L958-Q960 PolarHBondContact O-N 2.9Å; Q960-T963 PolarHBondContact O-N 2.75Å; Q960-R964 WeakPolarHBondContact O-CA 3.4Å; Q960-R964 WeakPolarHBondContact O-CB 3.2Å; Q960-R964 PolarHBondContact O-N 3.12Å; Q960-L1008 HydrophobicContact CB-CD1 3.83Å; Q960-L1008 HydrophobicContact CB-CG 3.99Å
961	L	79.3	Confident	87.2	Confident	128 Å²	128	51.7 Å²	51.7	67%	0.67	26%	0.263	S	S	*	.	H	α-helix	trans	-66.8	-40.3	178.2	-70.8	168.9	0	0	0	111.4	D959 T963 L1008	D959-L961 PolarHBondContact O-N 2.8Å; D959-L961 PolarHBondContact OD1-N 2.76Å; L961-T963 VanDerWaalsContact C-N 3.27Å; L961-T963 PolarHBondContact O-N 3.31Å; L961-L1008 HydrophobicContact CD2-CD2 3.92Å
962	K	80.6	Confident	87.4	Confident	135 Å²	135	52.4 Å²	52.4	59%	0.587	27%	0.268	S	S	*	.	H	α-helix	trans	-73.4	-11.5	178.5	-74.9	-172	-173.7	109.9	0	114.6	K909 D959	K909-K962 VanDerWaalsContact CD-O 3.31Å; K909-K962 WeakPolarHBondContact CD-O 3.44Å; K909-K962 WeakPolarHBondContact CE-O 3.09Å; K909-K962 PolarHBondContact NZ-O 3.03Å; D959-K962 HydrophobicContact CB-CB 4.4Å; D959-K962 PolarHBondContact O-N 3.33Å; D959-K962 VanDerWaalsContact O-N 3.15Å; D959-K962 PolarHBondContact OD1-N 2.91Å; D959-K962 VanDerWaalsContact OD1-N 3.09Å; D959-K962 VanDerWaalsContact OD2-CD 3.23Å; D959-K962 WeakPolarHBondContact OD2-CD 3.46Å; D959-K962 WeakPolarHBondContact OD2-CE 3.28Å; D959-K962 WeakPolarHBondContact OD2-CG 3.46Å; D959-K962 IonicContact OD2-NZ 3.27Å; D959-K962 PolarHBondContact OD2-NZ 3.27Å
963	T	84.1	Confident	87.4	Confident	13 Å²	13	53.9 Å²	53.9	8%	0.08	28%	0.276	C	S	.	.	H	α-helix	trans	-123.6	-5.4	-176.8	49	0	0	0	0	114.3	F956 D959 Q960 L961 E965 A966 I967	F956-T963 HydrophobicContact CB-CG2 4.16Å; F956-T963 HydrophobicContact CD1-CG2 3.96Å; D959-T963 PolarHBondContact O-OG1 3.05Å; Q960-T963 PolarHBondContact O-N 2.75Å; L961-T963 VanDerWaalsContact C-N 3.27Å; L961-T963 PolarHBondContact O-N 3.31Å; T963-E965 PolarHBondContact O-N 3.37Å; T963-A966 WeakPolarHBondContact O-CB 3.22Å; T963-A966 PolarHBondContact O-N 3.41Å; T963-A966 VanDerWaalsContact O-N 3.11Å; T963-I967 WeakPolarHBondContact O-CG1 3.4Å; T963-I967 PolarHBondContact O-N 3.09Å; T963-I967 VanDerWaalsContact O-N 3.07Å; T963-I967 WeakPolarHBondContact OG1-CD1 3.49Å
964	R	89.8	Confident	87.6	Confident	77 Å²	77	53.7 Å²	53.7	29%	0.291	27%	0.274	S	S	.	.	H	α-helix	trans	-34.9	-60.4	179.6	-178.9	176.6	-171.4	168.7	11.1	114.9	Q960 I967 A968 L1008 D1011	Q960-R964 WeakPolarHBondContact O-CA 3.4Å; Q960-R964 WeakPolarHBondContact O-CB 3.2Å; Q960-R964 PolarHBondContact O-N 3.12Å; R964-I967 PolarHBondContact O-N 3.09Å; R964-A968 VanDerWaalsContact O-CB 3.29Å; R964-A968 WeakPolarHBondContact O-CB 3.32Å; R964-A968 PolarHBondContact O-N 2.87Å; R964-L1008 HydrophobicContact CB-CD1 4.01Å; R964-L1008 HydrophobicContact CG-CD1 3.91Å; R964-D1011 WeakPolarHBondContact CG-OD2 3.3Å; R964-D1011 IonicContact CZ-OD1 2.67Å; R964-D1011 VanDerWaalsContact CZ-OD1 3.27Å; R964-D1011 IonicContact CZ-OD2 3.28Å; R964-D1011 IonicContact NE-OD1 2.8Å; R964-D1011 PolarHBondContact NE-OD1 2.98Å; R964-D1011 IonicContact NE-OD2 2.94Å; R964-D1011 PolarHBondContact NE-OD2 2.94Å; R964-D1011 IonicContact NH2-OD1 3.03Å; R964-D1011 PolarHBondContact NH2-OD1 2.91Å; R964-D1011 IonicContact NH2-OD2 3.07Å; R964-D1011 PolarHBondContact NH2-OD2 3.25Å
965	E	90.4	Very high	87.9	Confident	143 Å²	143	49.7 Å²	49.7	67%	0.668	25%	0.253	S	S	*	.	H	α-helix	trans	-70.9	-35.4	-172.3	-62.1	-173.4	160.2	0	0	112.6	I910 T963 A968 M969	I910-E965 HydrophobicContact CD1-CB 4.29Å; T963-E965 PolarHBondContact O-N 3.37Å; E965-A968 PolarHBondContact O-N 3.5Å; E965-M969 WeakPolarHBondContact O-CB 3.27Å; E965-M969 PolarHBondContact O-N 2.88Å
966	A	92.4	Very high	88.5	Confident	2 Å²	2	51.8 Å²	51.8	2%	0.017	26%	0.26	C	S	.	.	H	α-helix	trans	-65.7	-45.2	176.4	0	0	0	0	0	111.7	K909 I910 A913 F956 T963 M969 L970	K909-A966 HydrophobicContact CB-CB 3.98Å; K909-A966 VanDerWaalsContact O-CB 3.27Å; K909-A966 WeakPolarHBondContact O-CB 3.46Å; I910-A966 HydrophobicContact CG1-CB 4.23Å; A913-A966 HydrophobicContact CB-CB 3.94Å; F956-A966 HydrophobicContact CE1-CB 4.29Å; T963-A966 WeakPolarHBondContact O-CB 3.22Å; T963-A966 PolarHBondContact O-N 3.41Å; T963-A966 VanDerWaalsContact O-N 3.11Å; A966-M969 PolarHBondContact O-N 3.37Å; A966-L970 WeakPolarHBondContact O-CB 3.39Å; A966-L970 PolarHBondContact O-N 2.89Å
967	I	92.9	Very high	89.2	Confident	0 Å²	0	52.1 Å²	52.1	0%	0	26%	0.262	C	S	.	.	H	α-helix	trans	-65.9	-43.8	175.9	-59.7	157.6	0	0	0	110.1	F956 T963 R964 M969 L970 H971 K1006 L1007	F956-I967 HydrophobicContact CB-CD1 4.08Å; F956-I967 HydrophobicContact CB-CG1 4.36Å; F956-I967 HydrophobicContact CD1-CD1 4.32Å; F956-I967 HydrophobicContact CD1-CG1 3.82Å; F956-I967 HydrophobicContact CD2-CG1 4.28Å; F956-I967 HydrophobicContact CE1-CG1 4.16Å; F956-I967 HydrophobicContact CG-CD1 4.17Å; F956-I967 HydrophobicContact CG-CG1 3.89Å; T963-I967 WeakPolarHBondContact O-CG1 3.4Å; T963-I967 PolarHBondContact O-N 3.09Å; T963-I967 VanDerWaalsContact O-N 3.07Å; T963-I967 WeakPolarHBondContact OG1-CD1 3.49Å; R964-I967 PolarHBondContact O-N 3.09Å; I967-M969 PolarHBondContact O-N 3.46Å; I967-L970 PolarHBondContact O-N 2.87Å; I967-H971 PolarHBondContact O-CD2 3.48Å; I967-H971 VanDerWaalsContact O-CD2 3.23Å; I967-H971 PolarHBondContact O-N 2.76Å; I967-K1006 HydrophobicContact CD1-CB 3.8Å; I967-K1006 HydrophobicContact CG2-CB 4.37Å; I967-L1007 HydrophobicContact CB-CD2 4.48Å; I967-L1007 HydrophobicContact CG2-CD2 3.73Å; I967-L1007 HydrophobicContact CG2-CG 3.95Å
968	A	93.6	Very high	90.1	Very high	17 Å²	17	50.5 Å²	50.5	14%	0.14	25%	0.245	C	C	.	.	H	α-helix	trans	-63.8	-27.4	176.5	0	0	0	0	0	113.3	R964 E965 K972 L1007	R964-A968 VanDerWaalsContact O-CB 3.29Å; R964-A968 WeakPolarHBondContact O-CB 3.32Å; R964-A968 PolarHBondContact O-N 2.87Å; E965-A968 PolarHBondContact O-N 3.5Å; A968-K972 WeakPolarHBondContact O-CG 3.26Å; A968-L1007 HydrophobicContact CB-CD2 4.47Å
969	M	94.4	Very high	91.1	Very high	54 Å²	54	44 Å²	44	27%	0.266	21%	0.21	S	C	.	.	H	α-helix	trans	-77.1	-46	172.7	-165.9	67.4	73.9	0	0	111.7	I910 K914 E965 A966 I967 H971 K972 D973	I910-M969 HydrophobicContact CG2-CB 4.11Å; I910-M969 HydrophobicContact CG2-CE 4.34Å; I910-M969 HydrophobicContact CG2-CG 3.97Å; K914-M969 HydrophobicContact CG-CG 4.33Å; E965-M969 WeakPolarHBondContact O-CB 3.27Å; E965-M969 PolarHBondContact O-N 2.88Å; A966-M969 PolarHBondContact O-N 3.37Å; I967-M969 PolarHBondContact O-N 3.46Å; M969-H971 PolarHBondContact O-N 3.28Å; M969-K972 WeakPolarHBondContact O-CA 3.3Å; M969-K972 WeakPolarHBondContact O-CB 3.36Å; M969-K972 PolarHBondContact O-N 3.17Å; M969-K972 HydrophobicContact SD-CD 4.18Å; M969-D973 PolarHBondContact O-N 2.68Å
970	L	96.1	Very high	91.8	Very high	0 Å²	0	47.4 Å²	47.4	0%	0	22%	0.222	C	C	.	.	H	α-helix	trans	-51.8	-40.3	173.9	174.5	149.5	0	0	0	112	A913 I917 F956 A966 I967 G974 L1000 F1003	A913-L970 HydrophobicContact CB-CB 4.25Å; A913-L970 HydrophobicContact CB-CD1 4.39Å; I917-L970 HydrophobicContact CB-CD1 4.34Å; I917-L970 HydrophobicContact CB-CG 4.04Å; I917-L970 HydrophobicContact CD1-CD2 4.42Å; I917-L970 HydrophobicContact CD1-CG 4.27Å; I917-L970 HydrophobicContact CG1-CG 4.35Å; F956-L970 HydrophobicContact CE2-CD1 4.24Å; F956-L970 HydrophobicContact CZ-CD1 4.14Å; A966-L970 WeakPolarHBondContact O-CB 3.39Å; A966-L970 PolarHBondContact O-N 2.89Å; I967-L970 PolarHBondContact O-N 2.87Å; L970-G974 PolarHBondContact O-N 3.33Å; L970-L1000 HydrophobicContact CD2-CD1 3.79Å; L970-F1003 HydrophobicContact CD1-CD1 3.88Å; L970-F1003 HydrophobicContact CD1-CE1 3.76Å; L970-F1003 HydrophobicContact CD1-CG 4.37Å; L970-F1003 HydrophobicContact CD1-CZ 4.14Å; L970-F1003 HydrophobicContact CD2-CB 3.72Å; L970-F1003 HydrophobicContact CD2-CD1 3.82Å; L970-F1003 HydrophobicContact CD2-CD2 3.77Å; L970-F1003 HydrophobicContact CD2-CE1 4.36Å; L970-F1003 HydrophobicContact CD2-CE2 4.3Å; L970-F1003 HydrophobicContact CD2-CG 3.49Å; L970-F1003 VanDerWaalsContact CD2-CG 3.49Å
971	H	96.4	Very high	92.2	Very high	0 Å²	0	47.5 Å²	47.5	0%	0	22%	0.222	C	C	.	.	H	α-helix	trans	-70	-27	175	-81.1	-74.8	0	0	0	114.7	I967 M969 I975 L1000 F1003 V1015 Y1041	I967-H971 PolarHBondContact O-CD2 3.48Å; I967-H971 VanDerWaalsContact O-CD2 3.23Å; I967-H971 PolarHBondContact O-N 2.76Å; M969-H971 PolarHBondContact O-N 3.28Å; H971-I975 WeakPolarHBondContact O-CB 3.36Å; H971-I975 VanDerWaalsContact O-CD1 3.27Å; H971-I975 WeakPolarHBondContact O-CD1 3.46Å; H971-I975 WeakPolarHBondContact O-CG1 3.42Å; H971-I975 PolarHBondContact O-N 3.43Å; H971-L1000 PolarHBondContact CE1-O 3.24Å; H971-F1003 WeakPolarHBondContact NE2-CB 3.33Å; H971-V1015 HydrophobicContact CB-CG1 3.81Å; H971-V1015 HydrophobicContact CB-CG2 3.97Å; H971-Y1041 AromaticContact CE1-CE2 3.92Å; H971-Y1041 AromaticContact ND1-CE2 3.66Å; H971-Y1041 AromaticContact ND1-CZ 3.71Å; H971-Y1041 PolarHBondContact ND1-OH 3.26Å
972	K	96.2	Very high	92.5	Very high	66 Å²	66	46.3 Å²	46.3	29%	0.287	22%	0.222	S	C	.	.	H	α-helix	trans	-73.9	-54.4	174.4	-69.8	171	-176	171.3	0	110.8	A968 M969 G974 I975 E976 Y1018	A968-K972 WeakPolarHBondContact O-CG 3.26Å; M969-K972 WeakPolarHBondContact O-CA 3.3Å; M969-K972 WeakPolarHBondContact O-CB 3.36Å; M969-K972 PolarHBondContact O-N 3.17Å; M969-K972 HydrophobicContact SD-CD 4.18Å; K972-G974 PolarHBondContact O-N 3.14Å; K972-I975 WeakPolarHBondContact O-CA 3.41Å; K972-I975 WeakPolarHBondContact O-CB 3.5Å; K972-I975 PolarHBondContact O-N 3.23Å; K972-E976 PolarHBondContact O-N 2.95Å; K972-Y1018 HydrophobicContact CB-CD1 4.18Å; K972-Y1018 HydrophobicContact CB-CE1 3.86Å; K972-Y1018 HydrophobicContact CG-CD1 3.79Å; K972-Y1018 HydrophobicContact CG-CE1 3.81Å; K972-Y1018 HydrophobicContact CG-CG 4.19Å
973	D	96.4	Very high	92.5	Very high	31 Å²	31	40.9 Å²	40.9	17%	0.166	20%	0.201	C	C	.	.	H	α-helix	trans	-55.6	-39.3	177.8	-70.4	35.7	0	0	0	111.6	K914 I917 Q921 M969 F977	K914-D973 WeakPolarHBondContact CG-OD2 3.35Å; K914-D973 IonicContact NZ-OD1 3.31Å; K914-D973 PolarHBondContact NZ-OD1 3.25Å; K914-D973 IonicContact NZ-OD2 3.15Å; K914-D973 PolarHBondContact NZ-OD2 3.01Å; I917-D973 HydrophobicContact CG2-CB 3.92Å; Q921-D973 PolarHBondContact NE2-O 3.2Å; M969-D973 PolarHBondContact O-N 2.68Å; D973-F977 WeakPolarHBondContact O-CB 3.43Å; D973-F977 PolarHBondContact O-N 2.83Å
974	G	96.8	Very high	91.9	Very high	0 Å²	0	45.1 Å²	45.1	0%	0	23%	0.229	C	C	.	.	H	α-helix	trans	-69.7	-34.8	174.7	0	0	0	0	0	114.7	L970 K972 A978	L970-G974 PolarHBondContact O-N 3.33Å; K972-G974 PolarHBondContact O-N 3.14Å; G974-A978 WeakPolarHBondContact O-CB 3.42Å; G974-A978 PolarHBondContact O-N 3.48Å; G974-A978 VanDerWaalsContact O-N 3.17Å
975	I	96.8	Very high	91	Very high	0 Å²	0	49 Å²	49	0%	0	25%	0.25	C	S	.	.	H	α-helix	trans	-67.8	-49	171.8	-75.2	166.3	0	0	0	109.8	H971 K972 F977 A978 F979 L1000 V1015 Y1018 L1019 F1022 Y1041	H971-I975 WeakPolarHBondContact O-CB 3.36Å; H971-I975 VanDerWaalsContact O-CD1 3.27Å; H971-I975 WeakPolarHBondContact O-CD1 3.46Å; H971-I975 WeakPolarHBondContact O-CG1 3.42Å; H971-I975 PolarHBondContact O-N 3.43Å; K972-I975 WeakPolarHBondContact O-CA 3.41Å; K972-I975 WeakPolarHBondContact O-CB 3.5Å; K972-I975 PolarHBondContact O-N 3.23Å; I975-F977 VanDerWaalsContact C-N 3.28Å; I975-F977 PolarHBondContact O-N 3.21Å; I975-A978 PolarHBondContact O-N 3.36Å; I975-F979 HydrophobicContact CG2-CD2 3.95Å; I975-F979 HydrophobicContact CG2-CE2 4.16Å; I975-F979 VanDerWaalsContact O-CD2 3.27Å; I975-F979 WeakPolarHBondContact O-CD2 3.36Å; I975-F979 PolarHBondContact O-N 2.98Å; I975-F979 VanDerWaalsContact O-N 3.16Å; I975-L1000 HydrophobicContact CG1-CD2 4.2Å; I975-V1015 HydrophobicContact CD1-CG1 3.87Å; I975-Y1018 HydrophobicContact CD1-CD1 4.42Å; I975-Y1018 HydrophobicContact CG2-CD1 4.38Å; I975-L1019 HydrophobicContact CD1-CB 4Å; I975-L1019 HydrophobicContact CD1-CD1 4.32Å; I975-L1019 HydrophobicContact CG1-CD1 4.23Å; I975-L1019 HydrophobicContact CG2-CD1 4.27Å; I975-F1022 HydrophobicContact CG2-CD2 3.62Å; I975-F1022 HydrophobicContact CG2-CE2 3.89Å; I975-F1022 HydrophobicContact CG2-CG 4.19Å; I975-Y1041 HydrophobicContact CD1-CE1 4.02Å; I975-Y1041 HydrophobicContact CG1-CE1 3.91Å
976	E	96.4	Very high	89.9	Confident	83 Å²	83	44 Å²	44	39%	0.388	24%	0.238	S	C	.	.	H	α-helix	trans	-57.4	-41.7	179.9	-74.8	169.9	-132.2	0	0	111.3	K972 F979 K980 Y1018 F1022	K972-E976 PolarHBondContact O-N 2.95Å; E976-F979 PolarHBondContact O-N 3.39Å; E976-K980 WeakPolarHBondContact O-CA 3.24Å; E976-K980 WeakPolarHBondContact O-CB 3.27Å; E976-K980 PolarHBondContact O-N 2.91Å; E976-Y1018 HydrophobicContact CG-CE1 4.26Å; E976-Y1018 PolarHBondContact OE1-OH 3.29Å; E976-F1022 HydrophobicContact CG-CE1 4.26Å; E976-F1022 HydrophobicContact CG-CZ 3.73Å
977	F	96.2	Very high	88.6	Confident	15 Å²	15	54 Å²	54	7%	0.066	28%	0.284	C	S	.	.	H	α-helix	trans	-63.4	-42.9	173.1	179	-96.7	0	0	0	113.7	Q921 F924 N925 D973 I975 F979 K980 N993 F996	Q921-F977 HydrophobicContact CB-CD2 4.02Å; Q921-F977 HydrophobicContact CB-CE1 4.36Å; Q921-F977 HydrophobicContact CB-CE2 3.85Å; Q921-F977 HydrophobicContact CB-CG 4.36Å; Q921-F977 HydrophobicContact CB-CZ 4.02Å; Q921-F977 HydrophobicContact CG-CB 4.13Å; Q921-F977 HydrophobicContact CG-CD1 3.81Å; Q921-F977 HydrophobicContact CG-CD2 3.69Å; Q921-F977 HydrophobicContact CG-CE1 4.1Å; Q921-F977 HydrophobicContact CG-CE2 4Å; Q921-F977 HydrophobicContact CG-CG 3.59Å; Q921-F977 HydrophobicContact CG-CZ 4.18Å; F924-F977 AromaticContact CD1-CE1 3.68Å; F924-F977 HydrophobicContact CD1-CE1 3.68Å; F924-F977 AromaticContact CD1-CZ 3.83Å; F924-F977 HydrophobicContact CD1-CZ 3.83Å; F924-F977 HydrophobicContact CE1-CE1 4.21Å; F924-F977 HydrophobicContact CG-CE1 4.32Å; N925-F977 WeakPolarHBondContact OD1-CZ 3.31Å; D973-F977 WeakPolarHBondContact O-CB 3.43Å; D973-F977 PolarHBondContact O-N 2.83Å; I975-F977 VanDerWaalsContact C-N 3.28Å; I975-F977 PolarHBondContact O-N 3.21Å; F977-F979 PolarHBondContact O-N 3.25Å; F977-K980 WeakPolarHBondContact O-CB 3.3Å; F977-K980 PolarHBondContact O-N 2.92Å; F977-N993 HydrophobicContact CD1-CB 4.3Å; F977-N993 HydrophobicContact CE1-CB 4.1Å; F977-N993 VanDerWaalsContact O-CB 3.31Å; F977-N993 WeakPolarHBondContact O-CB 3.38Å; F977-N993 PolarHBondContact O-ND2 3.1Å; F977-F996 HydrophobicContact CD1-CB 4.09Å; F977-F996 AromaticContact CD1-CD1 3.64Å; F977-F996 HydrophobicContact CD1-CD1 3.64Å; F977-F996 HydrophobicContact CD1-CD2 4.05Å; F977-F996 HydrophobicContact CD1-CE1 4.02Å; F977-F996 HydrophobicContact CD1-CE2 4.4Å; F977-F996 AromaticContact CD1-CG 3.65Å; F977-F996 HydrophobicContact CD1-CG 3.65Å; F977-F996 HydrophobicContact CD1-CZ 4.39Å; F977-F996 HydrophobicContact CE1-CB 4.11Å; F977-F996 HydrophobicContact CE1-CD1 4.24Å; F977-F996 AromaticContact CE1-CD2 3.8Å; F977-F996 HydrophobicContact CE1-CD2 3.8Å; F977-F996 HydrophobicContact CE1-CE2 4.27Å; F977-F996 AromaticContact CE1-CG 3.79Å; F977-F996 HydrophobicContact CE1-CG 3.79Å
978	A	95.2	Very high	87.4	Confident	0 Å²	0	55.6 Å²	55.6	0%	0	30%	0.3	C	S	.	.	H	α-helix	trans	-65.1	-26.1	-178.7	0	0	0	0	0	113.6	G974 I975 N993 L997	G974-A978 WeakPolarHBondContact O-CB 3.42Å; G974-A978 PolarHBondContact O-N 3.48Å; G974-A978 VanDerWaalsContact O-N 3.17Å; I975-A978 PolarHBondContact O-N 3.36Å; A978-N993 CarbonylContact O-C 3.55Å; A978-L997 HydrophobicContact CB-CD2 3.59Å; A978-L997 HydrophobicContact CB-CG 3.83Å
979	F	93.1	Very high	86.4	Confident	30 Å²	30	55.6 Å²	55.6	13%	0.132	30%	0.302	C	S	.	.	T	Hydrogen-bonded Turn	trans	-108.4	6.1	177.4	-63.6	-77	0	0	0	114.1	I975 E976 F977 P991 L994 L997 L1019 F1022 M1027 L1038	I975-F979 HydrophobicContact CG2-CD2 3.95Å; I975-F979 HydrophobicContact CG2-CE2 4.16Å; I975-F979 VanDerWaalsContact O-CD2 3.27Å; I975-F979 WeakPolarHBondContact O-CD2 3.36Å; I975-F979 PolarHBondContact O-N 2.98Å; I975-F979 VanDerWaalsContact O-N 3.16Å; E976-F979 PolarHBondContact O-N 3.39Å; F977-F979 PolarHBondContact O-N 3.25Å; F979-P991 HydrophobicContact CD1-CB 4.35Å; F979-P991 HydrophobicContact CD1-CG 3.75Å; F979-P991 HydrophobicContact CE1-CG 4.03Å; F979-L994 HydrophobicContact CE1-CD1 3.78Å; F979-L994 HydrophobicContact CZ-CD1 3.91Å; F979-L997 HydrophobicContact CE2-CD1 4.31Å; F979-L997 HydrophobicContact CZ-CD1 4.19Å; F979-L1019 HydrophobicContact CE2-CD1 3.55Å; F979-L1019 HydrophobicContact CZ-CD1 3.98Å; F979-F1022 HydrophobicContact CB-CB 4.04Å; F979-F1022 HydrophobicContact CB-CD1 3.88Å; F979-F1022 HydrophobicContact CB-CG 4.28Å; F979-F1022 HydrophobicContact CD1-CB 4.15Å; F979-F1022 HydrophobicContact CD2-CB 3.53Å; F979-F1022 HydrophobicContact CD2-CD1 4.45Å; F979-F1022 HydrophobicContact CD2-CG 4.05Å; F979-F1022 HydrophobicContact CE2-CB 4.02Å; F979-F1022 HydrophobicContact CG-CB 3.63Å; F979-F1022 HydrophobicContact CG-CD1 4.38Å; F979-F1022 HydrophobicContact CG-CG 4.28Å; F979-M1027 HydrophobicContact CD1-CE 4.15Å; F979-M1027 HydrophobicContact CE1-CE 3.65Å; F979-L1038 HydrophobicContact CZ-CD1 4.13Å
980	K	92.1	Very high	85.9	Confident	134 Å²	134	54.1 Å²	54.1	58%	0.583	30%	0.297	S	S	*	.	S	Bend	trans	-60.7	-49	-176.2	-175.4	-173.4	175.2	-114.5	0	112.8	E976 F977	E976-K980 WeakPolarHBondContact O-CA 3.24Å; E976-K980 WeakPolarHBondContact O-CB 3.27Å; E976-K980 PolarHBondContact O-N 2.91Å; F977-K980 WeakPolarHBondContact O-CB 3.3Å; F977-K980 PolarHBondContact O-N 2.92Å
981	E	87.6	Confident	85.5	Confident	70 Å²	70	54.8 Å²	54.8	33%	0.327	30%	0.301	S	S	.	.	S	Bend	trans	-103.3	123.9	-175.8	-56.8	-56.6	154.2	0	0	110.2	L992	E981-L992 HydrophobicContact CB-CB 3.86Å; E981-L992 HydrophobicContact CB-CD2 4.01Å; E981-L992 HydrophobicContact CG-CD2 4.44Å; E981-L992 PolarHBondContact O-N 3.28Å
982	P	84.2	Confident	85.1	Confident	103 Å²	103	56.8 Å²	56.8	67%	0.669	31%	0.311	S	S	*	.	P	Polyproline II helix	trans	-69.5	168.2	-175.9	30.1	-35.9	0	0	0	112.3
983	S	80.5	Confident	85	Confident	21 Å²	21	53.9 Å²	53.9	15%	0.147	30%	0.299	C	S	.	.	P	Polyproline II helix	trans	-66.9	128.6	-178.3	-165.4	0	0	0	0	112.2	Q985 G986 G989 P990	S983-Q985 PolarHBondContact O-N 3.36Å; S983-Q985 VanDerWaalsContact O-N 3.13Å; S983-Q985 PolarHBondContact OG-N 2.84Å; S983-G986 PolarHBondContact O-N 2.79Å; S983-G986 VanDerWaalsContact O-N 3.14Å; S983-G989 WeakPolarHBondContact CB-O 3.36Å; S983-G989 VanDerWaalsContact OG-C 3.23Å; S983-G989 WeakPolarHBondContact OG-CA 3.44Å; S983-P990 WeakPolarHBondContact CA-O 3.28Å; S983-P990 WeakPolarHBondContact CB-O 3.4Å; S983-P990 PolarHBondContact OG-O 3.23Å
984	P	73.2	Confident	84.8	Confident	102 Å²	102	52.5 Å²	52.5	66%	0.662	29%	0.291	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.1	-8.8	173.2	29.8	-35.4	0	0	0	112.8	L992	P984-L992 HydrophobicContact CG-CD1 3.92Å
985	Q	69.4	Low	84.6	Confident	157 Å²	157	53.6 Å²	53.6	73%	0.734	30%	0.299	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.7	-1.6	176.2	-62.2	178.6	-7.1	0	0	113.2	S983	S983-Q985 PolarHBondContact O-N 3.36Å; S983-Q985 VanDerWaalsContact O-N 3.13Å; S983-Q985 PolarHBondContact OG-N 2.84Å
986	G	68.8	Low	84.6	Confident	40 Å²	40	53.6 Å²	53.6	41%	0.412	30%	0.299	S	S	.	.			trans	93.9	-171.7	-179.6	0	0	0	0	0	114.4	S983 G988 G989	S983-G986 PolarHBondContact O-N 2.79Å; S983-G986 VanDerWaalsContact O-N 3.14Å; G986-G988 PolarHBondContact O-N 2.81Å; G986-G989 PolarHBondContact O-N 2.77Å
987	E	64.5	Low	84.6	Confident	211 Å²	211	49.6 Å²	49.6	99%	0.986	28%	0.28	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.9	119.3	-176.5	-65.9	-170.9	146.9	0	0	111.8
988	G	67	Low	84.5	Confident	33 Å²	33	49.5 Å²	49.5	34%	0.34	28%	0.28	S	S	.	.	T	Hydrogen-bonded Turn	trans	101.5	-8.6	179.8	0	0	0	0	0	115.6	G986	G986-G988 PolarHBondContact O-N 2.81Å
989	G	73.8	Confident	84.6	Confident	17 Å²	17	49.5 Å²	49.5	18%	0.175	28%	0.28	C	S	.	.	S	Bend	trans	-77	166.9	169.3	0	0	0	0	0	113.4	S983 G986 W1035	S983-G989 WeakPolarHBondContact CB-O 3.36Å; S983-G989 VanDerWaalsContact OG-C 3.23Å; S983-G989 WeakPolarHBondContact OG-CA 3.44Å; G986-G989 PolarHBondContact O-N 2.77Å; G989-W1035 VanDerWaalsContact C-CZ2 3.47Å; G989-W1035 WeakPolarHBondContact O-CH2 3.17Å
990	P	83.3	Confident	84.8	Confident	24 Å²	24	48 Å²	48	16%	0.156	27%	0.274	C	S	.	.	P	Polyproline II helix	trans	-68	134.6	177.1	27.8	-33.7	0	0	0	111.5	S983 L994 C1034 W1035	S983-P990 WeakPolarHBondContact CA-O 3.28Å; S983-P990 WeakPolarHBondContact CB-O 3.4Å; S983-P990 PolarHBondContact OG-O 3.23Å; P990-L994 HydrophobicContact CB-CD2 4.09Å; P990-C1034 HydrophobicContact CG-CB 4.44Å; P990-W1035 VanDerWaalsContact CA-CH2 3.5Å; P990-W1035 HydrophobicContact CB-CD2 4.5Å; P990-W1035 HydrophobicContact CB-CH2 4.22Å; P990-W1035 HydrophobicContact CB-CZ2 4Å
991	P	87.8	Confident	84.9	Confident	14 Å²	14	42.5 Å²	42.5	9%	0.091	25%	0.252	C	S	.	.	P	Polyproline II helix	trans	-55.8	149.4	170.3	-24.6	33.6	0	0	0	112.2	F979 N993 L994 M1027	F979-P991 HydrophobicContact CD1-CB 4.35Å; F979-P991 HydrophobicContact CD1-CG 3.75Å; F979-P991 HydrophobicContact CE1-CG 4.03Å; P991-N993 VanDerWaalsContact C-N 3.28Å; P991-N993 PolarHBondContact O-N 2.87Å; P991-L994 HydrophobicContact CB-CB 4.44Å; P991-L994 HydrophobicContact CG-CD1 4.35Å; P991-L994 VanDerWaalsContact O-CB 3.31Å; P991-L994 WeakPolarHBondContact O-CB 3.46Å; P991-L994 PolarHBondContact O-N 3Å; P991-L994 VanDerWaalsContact O-N 3.16Å; P991-M1027 HydrophobicContact CG-CE 3.85Å
992	L	88.1	Confident	85.3	Confident	41 Å²	41	41.4 Å²	41.4	22%	0.215	25%	0.247	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60	-38.4	-171.5	-161.6	70.2	0	0	0	112.8	M928 F933 E981 P984	M928-L992 HydrophobicContact CE-CG 4.11Å; M928-L992 WeakPolarHBondContact CE-O 3.18Å; F933-L992 HydrophobicContact CB-CD1 3.98Å; F933-L992 HydrophobicContact CD1-CD1 3.65Å; F933-L992 HydrophobicContact CD1-CD2 3.94Å; F933-L992 HydrophobicContact CD1-CG 3.97Å; F933-L992 HydrophobicContact CE1-CD1 4.34Å; F933-L992 HydrophobicContact CE1-CD2 3.9Å; F933-L992 HydrophobicContact CE1-CG 4.44Å; F933-L992 HydrophobicContact CG-CD1 3.88Å; E981-L992 HydrophobicContact CB-CB 3.86Å; E981-L992 HydrophobicContact CB-CD2 4.01Å; E981-L992 HydrophobicContact CG-CD2 4.44Å; E981-L992 PolarHBondContact O-N 3.28Å; P984-L992 HydrophobicContact CG-CD1 3.92Å
993	N	92.9	Very high	85.8	Confident	6 Å²	6	36.6 Å²	36.6	3%	0.032	22%	0.215	C	C	.	.	T	Hydrogen-bonded Turn	trans	-97	9.8	-175.7	-63.3	-7.8	0	0	0	113.1	F924 F977 A978 P991 P995 F996	F924-N993 HydrophobicContact CE1-CB 4.23Å; F977-N993 HydrophobicContact CD1-CB 4.3Å; F977-N993 HydrophobicContact CE1-CB 4.1Å; F977-N993 VanDerWaalsContact O-CB 3.31Å; F977-N993 WeakPolarHBondContact O-CB 3.38Å; F977-N993 PolarHBondContact O-ND2 3.1Å; A978-N993 CarbonylContact O-C 3.55Å; P991-N993 VanDerWaalsContact C-N 3.28Å; P991-N993 PolarHBondContact O-N 2.87Å; N993-P995 VanDerWaalsContact C-N 3.31Å; N993-F996 WeakPolarHBondContact O-CB 3.27Å; N993-F996 PolarHBondContact O-N 3.18Å
994	L	92.4	Very high	86.4	Confident	1 Å²	1	36 Å²	36	1%	0.005	21%	0.211	C	C	.	.	T	Hydrogen-bonded Turn	trans	-54.1	-36.4	-177.2	-164	73.2	0	0	0	114.3	F979 P990 P991 F996 L997 W1035 P1037 L1038	F979-L994 HydrophobicContact CE1-CD1 3.78Å; F979-L994 HydrophobicContact CZ-CD1 3.91Å; P990-L994 HydrophobicContact CB-CD2 4.09Å; P991-L994 HydrophobicContact CB-CB 4.44Å; P991-L994 HydrophobicContact CG-CD1 4.35Å; P991-L994 VanDerWaalsContact O-CB 3.31Å; P991-L994 WeakPolarHBondContact O-CB 3.46Å; P991-L994 PolarHBondContact O-N 3Å; P991-L994 VanDerWaalsContact O-N 3.16Å; L994-F996 PolarHBondContact O-N 2.86Å; L994-F996 VanDerWaalsContact O-N 3.13Å; L994-L997 HydrophobicContact CD1-CD1 3.83Å; L994-L997 WeakPolarHBondContact O-CB 3.41Å; L994-L997 PolarHBondContact O-N 2.96Å; L994-L997 VanDerWaalsContact O-N 3.16Å; L994-W1035 HydrophobicContact CD2-CD2 4.29Å; L994-W1035 HydrophobicContact CD2-CE3 3.59Å; L994-W1035 HydrophobicContact CD2-CZ3 3.91Å; L994-P1037 WeakPolarHBondContact O-CB 3.29Å; L994-L1038 HydrophobicContact CD1-CB 4.19Å; L994-L1038 HydrophobicContact CD2-CB 4.38Å; L994-L1038 HydrophobicContact CG-CB 4.49Å
995	P	93.7	Very high	87.2	Confident	23 Å²	23	34.7 Å²	34.7	15%	0.149	20%	0.204	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57.3	-23.2	174.4	-28.6	38.1	0	0	0	115.2	F924 F935 F942 N993 L997 D998	F924-P995 HydrophobicContact CE2-CB 4.1Å; F924-P995 HydrophobicContact CZ-CB 4.22Å; F935-P995 HydrophobicContact CE1-CB 4.36Å; F935-P995 HydrophobicContact CE1-CG 4.22Å; F935-P995 HydrophobicContact CZ-CB 3.71Å; F935-P995 HydrophobicContact CZ-CG 4Å; F942-P995 HydrophobicContact CE2-CB 4.28Å; F942-P995 HydrophobicContact CZ-CB 4.41Å; F942-P995 WeakPolarHBondContact CZ-O 3.49Å; N993-P995 VanDerWaalsContact C-N 3.31Å; P995-L997 PolarHBondContact O-N 2.86Å; P995-L997 VanDerWaalsContact O-N 3.08Å; P995-D998 PolarHBondContact O-N 3.44Å
996	F	96.1	Very high	88.2	Confident	0 Å²	0	28.4 Å²	28.4	0%	0	18%	0.175	C	C	.	.	H	α-helix	trans	-59.8	-21.5	177.2	-167.5	-103	0	0	0	113	I917 L920 Q921 F924 F977 N993 L994 D998 I999 L1000	I917-F996 HydrophobicContact CD1-CE1 3.79Å; I917-F996 HydrophobicContact CD1-CZ 3.65Å; I917-F996 HydrophobicContact CG1-CE1 4.18Å; I917-F996 HydrophobicContact CG1-CZ 4.14Å; L920-F996 HydrophobicContact CB-CE2 4.01Å; L920-F996 HydrophobicContact CB-CZ 4.03Å; Q921-F996 HydrophobicContact CG-CE1 4.11Å; Q921-F996 HydrophobicContact CG-CE2 4.12Å; Q921-F996 HydrophobicContact CG-CZ 3.62Å; F924-F996 HydrophobicContact CB-CD2 3.96Å; F924-F996 HydrophobicContact CB-CE2 4.23Å; F924-F996 HydrophobicContact CD1-CD2 4.45Å; F924-F996 HydrophobicContact CD2-CD2 4.02Å; F924-F996 HydrophobicContact CE2-CB 4.42Å; F924-F996 AromaticContact CG-CD2 3.88Å; F924-F996 HydrophobicContact CG-CD2 3.88Å; F924-F996 HydrophobicContact CZ-CB 4.48Å; F977-F996 HydrophobicContact CD1-CB 4.09Å; F977-F996 AromaticContact CD1-CD1 3.64Å; F977-F996 HydrophobicContact CD1-CD1 3.64Å; F977-F996 HydrophobicContact CD1-CD2 4.05Å; F977-F996 HydrophobicContact CD1-CE1 4.02Å; F977-F996 HydrophobicContact CD1-CE2 4.4Å; F977-F996 AromaticContact CD1-CG 3.65Å; F977-F996 HydrophobicContact CD1-CG 3.65Å; F977-F996 HydrophobicContact CD1-CZ 4.39Å; F977-F996 HydrophobicContact CE1-CB 4.11Å; F977-F996 HydrophobicContact CE1-CD1 4.24Å; F977-F996 AromaticContact CE1-CD2 3.8Å; F977-F996 HydrophobicContact CE1-CD2 3.8Å; F977-F996 HydrophobicContact CE1-CE2 4.27Å; F977-F996 AromaticContact CE1-CG 3.79Å; F977-F996 HydrophobicContact CE1-CG 3.79Å; N993-F996 WeakPolarHBondContact O-CB 3.27Å; N993-F996 PolarHBondContact O-N 3.18Å; L994-F996 PolarHBondContact O-N 2.86Å; L994-F996 VanDerWaalsContact O-N 3.13Å; F996-D998 VanDerWaalsContact C-N 3.29Å; F996-D998 PolarHBondContact O-N 2.76Å; F996-I999 HydrophobicContact CD2-CD1 3.92Å; F996-I999 HydrophobicContact CE2-CD1 4.32Å; F996-I999 HydrophobicContact CE2-CG2 4.48Å; F996-I999 WeakPolarHBondContact O-CB 3.36Å; F996-I999 PolarHBondContact O-N 3.02Å; F996-I999 VanDerWaalsContact O-N 3.15Å; F996-L1000 PolarHBondContact O-N 2.91Å
997	L	96.1	Very high	89.2	Confident	0 Å²	0	26.9 Å²	26.9	0%	0	16%	0.157	C	C	.	.	H	α-helix	trans	-65.9	-27	175.1	-61.9	-178.4	0	0	0	113.4	A978 F979 L994 P995 I999 L1000 S1001 P1037 L1038 Y1041	A978-L997 HydrophobicContact CB-CD2 3.59Å; A978-L997 HydrophobicContact CB-CG 3.83Å; F979-L997 HydrophobicContact CE2-CD1 4.31Å; F979-L997 HydrophobicContact CZ-CD1 4.19Å; L994-L997 HydrophobicContact CD1-CD1 3.83Å; L994-L997 WeakPolarHBondContact O-CB 3.41Å; L994-L997 PolarHBondContact O-N 2.96Å; L994-L997 VanDerWaalsContact O-N 3.16Å; P995-L997 PolarHBondContact O-N 2.86Å; P995-L997 VanDerWaalsContact O-N 3.08Å; L997-I999 VanDerWaalsContact C-N 3.35Å; L997-L1000 HydrophobicContact CD2-CD2 4.01Å; L997-L1000 PolarHBondContact O-N 3.48Å; L997-S1001 WeakPolarHBondContact O-CB 3.11Å; L997-S1001 PolarHBondContact O-N 2.98Å; L997-P1037 HydrophobicContact CB-CB 4.23Å; L997-L1038 HydrophobicContact CD1-CB 4.22Å; L997-L1038 HydrophobicContact CD1-CD1 3.76Å; L997-Y1041 HydrophobicContact CB-CD1 4.35Å; L997-Y1041 HydrophobicContact CB-CG 4.16Å; L997-Y1041 HydrophobicContact CD1-CD1 4.28Å; L997-Y1041 HydrophobicContact CD2-CD1 3.86Å; L997-Y1041 HydrophobicContact CD2-CE1 4.02Å; L997-Y1041 HydrophobicContact CD2-CG 4.39Å; L997-Y1041 HydrophobicContact CG-CD1 4.39Å
998	D	94.9	Very high	90.2	Very high	12 Å²	12	18.4 Å²	18.4	6%	0.064	12%	0.118	C	C	.	.	H	α-helix	trans	-68.9	-34.3	172.3	-86	-35.8	0	0	0	111.5	R937 F942 P995 F996 S1001 P1037	R937-D998 IonicContact CZ-OD2 3.88Å; R937-D998 IonicContact NH1-OD2 3.13Å; R937-D998 PolarHBondContact NH1-OD2 3.36Å; F942-D998 HydrophobicContact CE1-CB 4.2Å; F942-D998 HydrophobicContact CZ-CB 3.98Å; P995-D998 PolarHBondContact O-N 3.44Å; F996-D998 VanDerWaalsContact C-N 3.29Å; F996-D998 PolarHBondContact O-N 2.76Å; D998-S1001 PolarHBondContact O-OG 2.98Å; D998-P1037 HydrophobicContact CB-CB 4.45Å; D998-P1037 WeakPolarHBondContact OD2-CG 3.45Å
999	I	96.8	Very high	91.1	Very high	0 Å²	0	22.7 Å²	22.7	0%	0	12%	0.124	C	C	.	.	H	α-helix	trans	-71	-44.9	173.1	-61.3	164	0	0	0	110.1	L920 F924 F942 I945 K946 A949 F996 L997 S1001 E1002	L920-I999 HydrophobicContact CD1-CG2 4.22Å; F924-I999 HydrophobicContact CD2-CD1 3.94Å; F942-I999 HydrophobicContact CD2-CD1 4.12Å; F942-I999 HydrophobicContact CE2-CD1 3.52Å; F942-I999 HydrophobicContact CE2-CG1 3.82Å; F942-I999 HydrophobicContact CZ-CD1 4.09Å; F942-I999 HydrophobicContact CZ-CG1 3.84Å; I945-I999 HydrophobicContact CB-CD1 4.29Å; I945-I999 HydrophobicContact CG2-CD1 3.7Å; I945-I999 HydrophobicContact CG2-CG1 4.4Å; I945-I999 HydrophobicContact CG2-CG2 4.3Å; K946-I999 HydrophobicContact CB-CG1 4.46Å; A949-I999 HydrophobicContact CB-CG2 3.47Å; A949-I999 VanDerWaalsContact CB-CG2 3.47Å; F996-I999 HydrophobicContact CD2-CD1 3.92Å; F996-I999 HydrophobicContact CE2-CD1 4.32Å; F996-I999 HydrophobicContact CE2-CG2 4.48Å; F996-I999 WeakPolarHBondContact O-CB 3.36Å; F996-I999 PolarHBondContact O-N 3.02Å; F996-I999 VanDerWaalsContact O-N 3.15Å; L997-I999 VanDerWaalsContact C-N 3.35Å; I999-S1001 PolarHBondContact O-N 3.39Å; I999-E1002 PolarHBondContact O-N 2.99Å
1000	L	97	Very high	91.8	Very high	0 Å²	0	28.1 Å²	28.1	0%	0	15%	0.145	C	C	.	.	H	α-helix	trans	-63.3	-24.1	178.8	-168	60.1	0	0	0	112.7	I917 L970 H971 I975 F996 L997 E1002 F1003 Y1041	I917-L1000 HydrophobicContact CD1-CD1 3.9Å; L970-L1000 HydrophobicContact CD2-CD1 3.79Å; H971-L1000 PolarHBondContact CE1-O 3.24Å; I975-L1000 HydrophobicContact CG1-CD2 4.2Å; F996-L1000 PolarHBondContact O-N 2.91Å; L997-L1000 HydrophobicContact CD2-CD2 4.01Å; L997-L1000 PolarHBondContact O-N 3.48Å; L1000-E1002 VanDerWaalsContact C-N 3.26Å; L1000-E1002 PolarHBondContact O-N 3.4Å; L1000-F1003 HydrophobicContact CD1-CD2 4.39Å; L1000-F1003 PolarHBondContact O-N 3Å; L1000-Y1041 HydrophobicContact CB-CE2 4.22Å; L1000-Y1041 HydrophobicContact CD2-CE1 4.25Å; L1000-Y1041 HydrophobicContact CD2-CE2 3.92Å; L1000-Y1041 WeakPolarHBondContact CD2-OH 3.34Å; L1000-Y1041 HydrophobicContact CG-CE2 3.79Å
1001	S	95.7	Very high	92.1	Very high	18 Å²	18	27.6 Å²	27.6	13%	0.126	14%	0.141	C	C	.	.	G	3₁₀ helix	trans	-60.7	-30.1	178.4	78.4	0	0	0	0	113.5	L997 D998 I999 F1003 S1004	L997-S1001 WeakPolarHBondContact O-CB 3.11Å; L997-S1001 PolarHBondContact O-N 2.98Å; D998-S1001 PolarHBondContact O-OG 2.98Å; I999-S1001 PolarHBondContact O-N 3.39Å; S1001-F1003 PolarHBondContact O-N 3.43Å; S1001-S1004 VanDerWaalsContact O-CB 3.31Å; S1001-S1004 WeakPolarHBondContact O-CB 3.38Å; S1001-S1004 PolarHBondContact O-N 3.39Å; S1001-S1004 PolarHBondContact O-OG 3.45Å
1002	E	95.5	Very high	92.3	Very high	47 Å²	47	28.5 Å²	28.5	22%	0.22	14%	0.144	C	C	.	.	G	3₁₀ helix	trans	-62.9	-26.5	179.2	-63.9	-58.9	141.7	0	0	113.6	K946 A949 R950 S953 I999 L1000 S1005	K946-E1002 WeakPolarHBondContact CE-OE1 3.31Å; K946-E1002 HydrophobicContact CG-CG 3.98Å; K946-E1002 IonicContact NZ-OE1 3.53Å; A949-E1002 HydrophobicContact CB-CB 4.39Å; A949-E1002 HydrophobicContact CB-CG 4.5Å; R950-E1002 HydrophobicContact CB-CB 4.37Å; R950-E1002 HydrophobicContact CB-CG 4.19Å; R950-E1002 WeakPolarHBondContact CG-OE2 3.39Å; S953-E1002 WeakPolarHBondContact CB-O 2.95Å; S953-E1002 PolarHBondContact OG-O 2.58Å; I999-E1002 PolarHBondContact O-N 2.99Å; L1000-E1002 VanDerWaalsContact C-N 3.26Å; L1000-E1002 PolarHBondContact O-N 3.4Å; E1002-S1005 PolarHBondContact O-OG 3Å
1003	F	94.7	Very high	92.4	Very high	1 Å²	1	32.7 Å²	32.7	0%	0.004	16%	0.156	C	C	.	.	G	3₁₀ helix	trans	-83.3	-19.9	175.7	-60.8	-85.4	0	0	0	113.1	L920 A949 F952 F956 L970 H971 L1000 S1001 S1005 K1006	L920-F1003 HydrophobicContact CD1-CE2 3.71Å; L920-F1003 HydrophobicContact CD1-CZ 3.76Å; A949-F1003 HydrophobicContact CB-CE2 3.78Å; A949-F1003 HydrophobicContact CB-CZ 4.18Å; A949-F1003 WeakPolarHBondContact O-CZ 3.34Å; F952-F1003 HydrophobicContact CB-CE1 3.85Å; F952-F1003 HydrophobicContact CB-CZ 3.8Å; F956-F1003 HydrophobicContact CE2-CD1 4.14Å; F956-F1003 HydrophobicContact CE2-CE1 4.08Å; L970-F1003 HydrophobicContact CD1-CD1 3.88Å; L970-F1003 HydrophobicContact CD1-CE1 3.76Å; L970-F1003 HydrophobicContact CD1-CG 4.37Å; L970-F1003 HydrophobicContact CD1-CZ 4.14Å; L970-F1003 HydrophobicContact CD2-CB 3.72Å; L970-F1003 HydrophobicContact CD2-CD1 3.82Å; L970-F1003 HydrophobicContact CD2-CD2 3.77Å; L970-F1003 HydrophobicContact CD2-CE1 4.36Å; L970-F1003 HydrophobicContact CD2-CE2 4.3Å; L970-F1003 HydrophobicContact CD2-CG 3.49Å; L970-F1003 VanDerWaalsContact CD2-CG 3.49Å; H971-F1003 WeakPolarHBondContact NE2-CB 3.33Å; L1000-F1003 HydrophobicContact CD1-CD2 4.39Å; L1000-F1003 PolarHBondContact O-N 3Å; S1001-F1003 PolarHBondContact O-N 3.43Å; F1003-S1005 PolarHBondContact O-N 3.4Å; F1003-S1005 VanDerWaalsContact O-N 3.08Å; F1003-K1006 WeakPolarHBondContact O-CB 3.45Å; F1003-K1006 PolarHBondContact O-N 3.23Å
1004	S	92.8	Very high	92.3	Very high	8 Å²	8	36.3 Å²	36.3	6%	0.056	18%	0.179	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.3	-18.3	-174.9	72.2	0	0	0	0	113.9	S1001 K1006 K1012 S1044	S1001-S1004 VanDerWaalsContact O-CB 3.31Å; S1001-S1004 WeakPolarHBondContact O-CB 3.38Å; S1001-S1004 PolarHBondContact O-N 3.39Å; S1001-S1004 PolarHBondContact O-OG 3.45Å; S1004-K1006 VanDerWaalsContact C-N 3.26Å; S1004-K1006 PolarHBondContact O-N 3.19Å; S1004-K1012 WeakPolarHBondContact O-CE 3.47Å; S1004-S1044 VanDerWaalsContact CB-OG 3.27Å; S1004-S1044 WeakPolarHBondContact CB-OG 3.36Å; S1004-S1044 VanDerWaalsContact OG-CB 3.31Å; S1004-S1044 WeakPolarHBondContact OG-CB 3.45Å; S1004-S1044 PolarHBondContact OG-OG 2.8Å
1005	S	89.2	Confident	92.4	Very high	75 Å²	75	36.4 Å²	36.4	52%	0.524	18%	0.18	S	C	.	.	T	Hydrogen-bonded Turn	trans	-69	-20.2	171.6	63	0	0	0	0	113.7	E1002 F1003	E1002-S1005 PolarHBondContact O-OG 3Å; F1003-S1005 PolarHBondContact O-N 3.4Å; F1003-S1005 VanDerWaalsContact O-N 3.08Å
1006	K	90.3	Very high	92.4	Very high	26 Å²	26	36 Å²	36	11%	0.113	18%	0.176	C	C	.	.	T	Hydrogen-bonded Turn	trans	-96.8	-12.2	-178.5	-58	-64.4	-173.3	170.4	0	113.8	S953 G957 I967 F1003 S1004	S953-K1006 VanDerWaalsContact O-CE 3.22Å; S953-K1006 WeakPolarHBondContact O-CE 3.45Å; S953-K1006 WeakPolarHBondContact OG-CG 3.42Å; G957-K1006 PolarHBondContact O-NZ 2.66Å; I967-K1006 HydrophobicContact CD1-CB 3.8Å; I967-K1006 HydrophobicContact CG2-CB 4.37Å; F1003-K1006 WeakPolarHBondContact O-CB 3.45Å; F1003-K1006 PolarHBondContact O-N 3.23Å; S1004-K1006 VanDerWaalsContact C-N 3.26Å; S1004-K1006 PolarHBondContact O-N 3.19Å
1007	L	89.8	Confident	92.2	Very high	7 Å²	7	41.5 Å²	41.5	4%	0.037	20%	0.203	C	C	.	.	S	Bend	trans	-70.7	134.6	171.7	-74.4	172.2	0	0	0	111.5	I967 A968 D1011 K1012 V1015 L1045	I967-L1007 HydrophobicContact CB-CD2 4.48Å; I967-L1007 HydrophobicContact CG2-CD2 3.73Å; I967-L1007 HydrophobicContact CG2-CG 3.95Å; A968-L1007 HydrophobicContact CB-CD2 4.47Å; L1007-D1011 HydrophobicContact CD2-CB 4.01Å; L1007-K1012 HydrophobicContact CB-CG 3.69Å; L1007-K1012 HydrophobicContact CD1-CG 4.17Å; L1007-V1015 HydrophobicContact CD1-CB 4.32Å; L1007-V1015 HydrophobicContact CD1-CG1 4.5Å; L1007-V1015 HydrophobicContact CD1-CG2 4.02Å; L1007-V1015 HydrophobicContact CD2-CG2 4.2Å; L1007-L1045 HydrophobicContact CD1-CD2 3.58Å
1008	L	87.3	Confident	92.1	Very high	34 Å²	34	43.9 Å²	43.9	18%	0.178	21%	0.212	C	C	.	.			trans	-67.2	153	168.2	-59	88.6	0	0	0	110.5	Q960 L961 R964 Q1010 D1011 K1012	Q960-L1008 HydrophobicContact CB-CD1 3.83Å; Q960-L1008 HydrophobicContact CB-CG 3.99Å; L961-L1008 HydrophobicContact CD2-CD2 3.92Å; R964-L1008 HydrophobicContact CB-CD1 4.01Å; R964-L1008 HydrophobicContact CG-CD1 3.91Å; L1008-Q1010 PolarHBondContact O-N 3.4Å; L1008-D1011 PolarHBondContact O-N 3.31Å; L1008-K1012 PolarHBondContact O-N 3.42Å
1009	R	85.8	Confident	92	Very high	122 Å²	122	43.3 Å²	43.3	46%	0.46	21%	0.209	S	C	.	.	H	α-helix	trans	-52.6	-29	178.6	-179.2	170.2	165	168.2	-5.3	113.8	G1048 D1052	R1009-G1048 PolarHBondContact NE-O 3.22Å; R1009-D1052 IonicContact CZ-OD2 2.75Å; R1009-D1052 IonicContact NE-OD2 3.57Å; R1009-D1052 IonicContact NH2-OD1 3.95Å; R1009-D1052 IonicContact NH2-OD2 2.67Å; R1009-D1052 PolarHBondContact NH2-OD2 3.27Å
1010	Q	87.3	Confident	91.7	Very high	132 Å²	132	48.2 Å²	48.2	62%	0.617	23%	0.232	S	C	*	.	H	α-helix	trans	-69.7	-47.2	172.8	-67.5	-176.1	-1.2	0	0	112.3	L1008 R1013 T1014	L1008-Q1010 PolarHBondContact O-N 3.4Å; Q1010-R1013 WeakPolarHBondContact O-CB 3.31Å; Q1010-R1013 PolarHBondContact O-N 2.96Å; Q1010-T1014 PolarHBondContact O-N 3.33Å; Q1010-T1014 PolarHBondContact O-OG1 3.45Å
1011	D	90.1	Very high	91.5	Very high	13 Å²	13	57.2 Å²	57.2	7%	0.07	27%	0.266	C	S	.	.	H	α-helix	trans	-77.6	-26.2	-173.6	-53.4	-61.8	0	0	0	112.2	R964 L1007 L1008 R1013 T1014 V1015	R964-D1011 WeakPolarHBondContact CG-OD2 3.3Å; R964-D1011 IonicContact CZ-OD1 2.67Å; R964-D1011 VanDerWaalsContact CZ-OD1 3.27Å; R964-D1011 IonicContact CZ-OD2 3.28Å; R964-D1011 IonicContact NE-OD1 2.8Å; R964-D1011 PolarHBondContact NE-OD1 2.98Å; R964-D1011 IonicContact NE-OD2 2.94Å; R964-D1011 PolarHBondContact NE-OD2 2.94Å; R964-D1011 IonicContact NH2-OD1 3.03Å; R964-D1011 PolarHBondContact NH2-OD1 2.91Å; R964-D1011 IonicContact NH2-OD2 3.07Å; R964-D1011 PolarHBondContact NH2-OD2 3.25Å; L1007-D1011 HydrophobicContact CD2-CB 4.01Å; L1008-D1011 PolarHBondContact O-N 3.31Å; D1011-R1013 VanDerWaalsContact C-N 3.26Å; D1011-R1013 PolarHBondContact O-N 3.4Å; D1011-T1014 CarbonylContact O-C 3.6Å; D1011-T1014 WeakPolarHBondContact O-CB 3.48Å; D1011-T1014 PolarHBondContact O-N 3.41Å; D1011-V1015 WeakPolarHBondContact O-CG2 3.34Å; D1011-V1015 PolarHBondContact O-N 2.96Å
1012	K	92.3	Very high	91.2	Very high	33 Å²	33	59.8 Å²	59.8	14%	0.143	28%	0.275	C	S	.	.	H	α-helix	trans	-52.7	-43.7	166.2	-72.9	-168.1	172.8	-159.7	0	112.2	S1004 L1007 L1008 H1016 S1044 L1045	S1004-K1012 WeakPolarHBondContact O-CE 3.47Å; L1007-K1012 HydrophobicContact CB-CG 3.69Å; L1007-K1012 HydrophobicContact CD1-CG 4.17Å; L1008-K1012 PolarHBondContact O-N 3.42Å; K1012-H1016 WeakPolarHBondContact O-CB 3.41Å; K1012-H1016 PolarHBondContact O-N 2.95Å; K1012-S1044 PolarHBondContact NZ-O 3.27Å; K1012-L1045 HydrophobicContact CB-CD2 4.39Å; K1012-L1045 WeakPolarHBondContact CB-O 3.44Å; K1012-L1045 HydrophobicContact CG-CD2 4.28Å
1013	R	89.4	Confident	90.7	Very high	128 Å²	128	58.8 Å²	58.8	48%	0.483	27%	0.271	S	S	.	.	H	α-helix	trans	-65.1	-42.5	173.7	179.8	178.7	-76.7	175.1	-2.2	111.6	Q1010 D1011 V1015 H1016 M1017	Q1010-R1013 WeakPolarHBondContact O-CB 3.31Å; Q1010-R1013 PolarHBondContact O-N 2.96Å; D1011-R1013 VanDerWaalsContact C-N 3.26Å; D1011-R1013 PolarHBondContact O-N 3.4Å; R1013-V1015 PolarHBondContact O-N 2.96Å; R1013-H1016 PolarHBondContact O-N 3.03Å; R1013-M1017 HydrophobicContact CG-SD 4.22Å; R1013-M1017 WeakPolarHBondContact O-CG 3.46Å; R1013-M1017 PolarHBondContact O-N 2.86Å
1014	T	92	Very high	90.1	Very high	82 Å²	82	62.4 Å²	62.4	50%	0.503	29%	0.293	S	S	.	.	H	α-helix	trans	-62.4	-41.9	177.8	-53.2	0	0	0	0	112.4	Q1010 D1011 M1017 Y1018	Q1010-T1014 PolarHBondContact O-N 3.33Å; Q1010-T1014 PolarHBondContact O-OG1 3.45Å; D1011-T1014 CarbonylContact O-C 3.6Å; D1011-T1014 WeakPolarHBondContact O-CB 3.48Å; D1011-T1014 PolarHBondContact O-N 3.41Å; T1014-M1017 PolarHBondContact O-N 3.43Å; T1014-Y1018 PolarHBondContact O-N 2.83Å; T1014-Y1018 VanDerWaalsContact O-N 3.12Å
1015	V	94.3	Very high	89.4	Confident	4 Å²	4	70 Å²	70	2%	0.024	33%	0.325	C	S	.	.	H	α-helix	trans	-70.1	-38.5	176.6	173.5	0	0	0	0	110.9	H971 I975 L1007 D1011 R1013 Y1018 L1019 L1045	H971-V1015 HydrophobicContact CB-CG1 3.81Å; H971-V1015 HydrophobicContact CB-CG2 3.97Å; I975-V1015 HydrophobicContact CD1-CG1 3.87Å; L1007-V1015 HydrophobicContact CD1-CB 4.32Å; L1007-V1015 HydrophobicContact CD1-CG1 4.5Å; L1007-V1015 HydrophobicContact CD1-CG2 4.02Å; L1007-V1015 HydrophobicContact CD2-CG2 4.2Å; D1011-V1015 WeakPolarHBondContact O-CG2 3.34Å; D1011-V1015 PolarHBondContact O-N 2.96Å; R1013-V1015 PolarHBondContact O-N 2.96Å; V1015-Y1018 WeakPolarHBondContact O-CA 3.47Å; V1015-Y1018 WeakPolarHBondContact O-CB 3.38Å; V1015-Y1018 PolarHBondContact O-N 2.91Å; V1015-Y1018 VanDerWaalsContact O-N 3.08Å; V1015-L1019 PolarHBondContact O-N 3.06Å; V1015-L1045 HydrophobicContact CB-CD1 4.49Å; V1015-L1045 HydrophobicContact CB-CD2 4.23Å; V1015-L1045 HydrophobicContact CG1-CD1 3.82Å; V1015-L1045 HydrophobicContact CG1-CD2 3.95Å
1016	H	93.1	Very high	88.9	Confident	15 Å²	15	72.1 Å²	72.1	7%	0.069	33%	0.327	C	S	.	.	H	α-helix	trans	-60	-47.2	172	-171.7	-75	0	0	0	111.9	K1012 R1013 Y1018 L1019 E1020 R1042 Q1046	K1012-H1016 WeakPolarHBondContact O-CB 3.41Å; K1012-H1016 PolarHBondContact O-N 2.95Å; R1013-H1016 PolarHBondContact O-N 3.03Å; H1016-Y1018 PolarHBondContact O-N 3.3Å; H1016-Y1018 VanDerWaalsContact O-N 3.16Å; H1016-L1019 WeakPolarHBondContact O-CB 3.28Å; H1016-L1019 PolarHBondContact O-N 2.88Å; H1016-L1019 VanDerWaalsContact O-N 3.14Å; H1016-E1020 IonicContact CE1-OE1 3.55Å; H1016-E1020 PolarHBondContact CE1-OE1 3.17Å; H1016-E1020 VanDerWaalsContact CE1-OE1 3.25Å; H1016-E1020 IonicContact CE1-OE2 3.25Å; H1016-E1020 IonicContact ND1-OE1 3.59Å; H1016-E1020 IonicContact ND1-OE2 2.68Å; H1016-E1020 PolarHBondContact ND1-OE2 2.95Å; H1016-E1020 WeakPolarHBondContact O-CG 3.49Å; H1016-E1020 PolarHBondContact O-N 3.15Å; H1016-R1042 WeakPolarHBondContact NE2-CG 3.27Å; H1016-Q1046 PolarHBondContact NE2-NE2 3.11Å
1017	M	91.2	Very high	88.6	Confident	115 Å²	115	71.9 Å²	71.9	57%	0.567	33%	0.326	S	S	*	.	H	α-helix	trans	-66.8	-12.1	174.7	-69.2	-178.7	68.3	0	0	113.9	R1013 T1014 E1020	R1013-M1017 HydrophobicContact CG-SD 4.22Å; R1013-M1017 WeakPolarHBondContact O-CG 3.46Å; R1013-M1017 PolarHBondContact O-N 2.86Å; T1014-M1017 PolarHBondContact O-N 3.43Å; M1017-E1020 WeakPolarHBondContact CA-OE2 3.5Å
1018	Y	94.4	Very high	88.1	Confident	49 Å²	49	72.7 Å²	72.7	19%	0.192	33%	0.334	C	S	.	.	H	α-helix	trans	-86.1	-46.6	169.2	-157.3	-105.4	0	0	0	110.9	K972 I975 E976 T1014 V1015 H1016 E1020 R1021 F1022	K972-Y1018 HydrophobicContact CB-CD1 4.18Å; K972-Y1018 HydrophobicContact CB-CE1 3.86Å; K972-Y1018 HydrophobicContact CG-CD1 3.79Å; K972-Y1018 HydrophobicContact CG-CE1 3.81Å; K972-Y1018 HydrophobicContact CG-CG 4.19Å; I975-Y1018 HydrophobicContact CD1-CD1 4.42Å; I975-Y1018 HydrophobicContact CG2-CD1 4.38Å; E976-Y1018 HydrophobicContact CG-CE1 4.26Å; E976-Y1018 PolarHBondContact OE1-OH 3.29Å; T1014-Y1018 PolarHBondContact O-N 2.83Å; T1014-Y1018 VanDerWaalsContact O-N 3.12Å; V1015-Y1018 WeakPolarHBondContact O-CA 3.47Å; V1015-Y1018 WeakPolarHBondContact O-CB 3.38Å; V1015-Y1018 PolarHBondContact O-N 2.91Å; V1015-Y1018 VanDerWaalsContact O-N 3.08Å; H1016-Y1018 PolarHBondContact O-N 3.3Å; H1016-Y1018 VanDerWaalsContact O-N 3.16Å; Y1018-E1020 VanDerWaalsContact C-N 3.28Å; Y1018-E1020 PolarHBondContact O-N 3.11Å; Y1018-R1021 VanDerWaalsContact O-CB 3.28Å; Y1018-R1021 WeakPolarHBondContact O-CB 3.4Å; Y1018-R1021 WeakPolarHBondContact O-CG 3.45Å; Y1018-R1021 PolarHBondContact O-N 2.56Å; Y1018-F1022 AromaticContact CD1-CE2 3.96Å; Y1018-F1022 HydrophobicContact CD1-CE2 3.96Å; Y1018-F1022 AromaticContact CE1-CE2 3.64Å; Y1018-F1022 HydrophobicContact CE1-CE2 3.64Å; Y1018-F1022 HydrophobicContact CE1-CZ 4.14Å; Y1018-F1022 WeakPolarHBondContact O-CD2 3.49Å
1019	L	93.7	Very high	87.8	Confident	0 Å²	0	75.8 Å²	75.8	0%	0	35%	0.35	C	S	.	.	H	α-helix	trans	-54.8	-42.1	174	-178.4	63.4	0	0	0	112	I975 F979 V1015 H1016 R1021 F1022 M1023 L1038 Y1041 R1042 L1045	I975-L1019 HydrophobicContact CD1-CB 4Å; I975-L1019 HydrophobicContact CD1-CD1 4.32Å; I975-L1019 HydrophobicContact CG1-CD1 4.23Å; I975-L1019 HydrophobicContact CG2-CD1 4.27Å; F979-L1019 HydrophobicContact CE2-CD1 3.55Å; F979-L1019 HydrophobicContact CZ-CD1 3.98Å; V1015-L1019 PolarHBondContact O-N 3.06Å; H1016-L1019 WeakPolarHBondContact O-CB 3.28Å; H1016-L1019 PolarHBondContact O-N 2.88Å; H1016-L1019 VanDerWaalsContact O-N 3.14Å; L1019-R1021 PolarHBondContact O-N 3.42Å; L1019-F1022 PolarHBondContact O-N 3.43Å; L1019-M1023 HydrophobicContact CD2-SD 4.19Å; L1019-M1023 HydrophobicContact CG-SD 3.88Å; L1019-M1023 WeakPolarHBondContact O-CG 3.48Å; L1019-M1023 PolarHBondContact O-N 3.07Å; L1019-M1023 VanDerWaalsContact O-N 3.11Å; L1019-L1038 HydrophobicContact CD1-CD1 4.09Å; L1019-L1038 HydrophobicContact CD2-CD1 4.21Å; L1019-L1038 HydrophobicContact CG-CD1 4.49Å; L1019-Y1041 HydrophobicContact CD1-CE1 4.36Å; L1019-Y1041 HydrophobicContact CD2-CD1 3.96Å; L1019-Y1041 HydrophobicContact CD2-CE1 4.09Å; L1019-R1042 HydrophobicContact CD2-CB 4.34Å; L1019-R1042 HydrophobicContact CD2-CG 4.45Å; L1019-L1045 HydrophobicContact CD2-CD1 4.4Å
1020	E	90.7	Very high	87.6	Confident	103 Å²	103	72.5 Å²	72.5	48%	0.481	34%	0.34	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.7	-10.2	175.8	-76.7	175.2	131.2	0	0	114.9	H1016 M1017 Y1018 M1023	H1016-E1020 IonicContact CE1-OE1 3.55Å; H1016-E1020 PolarHBondContact CE1-OE1 3.17Å; H1016-E1020 VanDerWaalsContact CE1-OE1 3.25Å; H1016-E1020 IonicContact CE1-OE2 3.25Å; H1016-E1020 IonicContact ND1-OE1 3.59Å; H1016-E1020 IonicContact ND1-OE2 2.68Å; H1016-E1020 PolarHBondContact ND1-OE2 2.95Å; H1016-E1020 WeakPolarHBondContact O-CG 3.49Å; H1016-E1020 PolarHBondContact O-N 3.15Å; M1017-E1020 WeakPolarHBondContact CA-OE2 3.5Å; Y1018-E1020 VanDerWaalsContact C-N 3.28Å; Y1018-E1020 PolarHBondContact O-N 3.11Å; E1020-M1023 HydrophobicContact CG-SD 4.42Å
1021	R	91.8	Very high	87.3	Confident	190 Å²	190	73.2 Å²	73.2	72%	0.717	34%	0.337	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.6	-21.2	173.1	-57.1	177	177.7	-155.8	-5.4	113.4	Y1018 L1019	Y1018-R1021 VanDerWaalsContact O-CB 3.28Å; Y1018-R1021 WeakPolarHBondContact O-CB 3.4Å; Y1018-R1021 WeakPolarHBondContact O-CG 3.45Å; Y1018-R1021 PolarHBondContact O-N 2.56Å; L1019-R1021 PolarHBondContact O-N 3.42Å
1022	F	88.9	Confident	86.9	Confident	72 Å²	72	77.1 Å²	77.1	32%	0.316	36%	0.358	S	S	.	.	T	Hydrogen-bonded Turn	trans	-108.2	-33.8	-175.9	-60.9	-94	0	0	0	112.2	I975 E976 F979 Y1018 L1019	I975-F1022 HydrophobicContact CG2-CD2 3.62Å; I975-F1022 HydrophobicContact CG2-CE2 3.89Å; I975-F1022 HydrophobicContact CG2-CG 4.19Å; E976-F1022 HydrophobicContact CG-CE1 4.26Å; E976-F1022 HydrophobicContact CG-CZ 3.73Å; F979-F1022 HydrophobicContact CB-CB 4.04Å; F979-F1022 HydrophobicContact CB-CD1 3.88Å; F979-F1022 HydrophobicContact CB-CG 4.28Å; F979-F1022 HydrophobicContact CD1-CB 4.15Å; F979-F1022 HydrophobicContact CD2-CB 3.53Å; F979-F1022 HydrophobicContact CD2-CD1 4.45Å; F979-F1022 HydrophobicContact CD2-CG 4.05Å; F979-F1022 HydrophobicContact CE2-CB 4.02Å; F979-F1022 HydrophobicContact CG-CB 3.63Å; F979-F1022 HydrophobicContact CG-CD1 4.38Å; F979-F1022 HydrophobicContact CG-CG 4.28Å; Y1018-F1022 AromaticContact CD1-CE2 3.96Å; Y1018-F1022 HydrophobicContact CD1-CE2 3.96Å; Y1018-F1022 AromaticContact CE1-CE2 3.64Å; Y1018-F1022 HydrophobicContact CE1-CE2 3.64Å; Y1018-F1022 HydrophobicContact CE1-CZ 4.14Å; Y1018-F1022 WeakPolarHBondContact O-CD2 3.49Å; L1019-F1022 PolarHBondContact O-N 3.43Å
1023	M	84.9	Confident	86.3	Confident	26 Å²	26	81.6 Å²	81.6	13%	0.128	38%	0.384	C	S	.	.	S	Bend	trans	-79.5	129.3	174.1	63.3	-175.1	-79.2	0	0	111.7	L1019 E1020 A1028	L1019-M1023 HydrophobicContact CD2-SD 4.19Å; L1019-M1023 HydrophobicContact CG-SD 3.88Å; L1019-M1023 WeakPolarHBondContact O-CG 3.48Å; L1019-M1023 PolarHBondContact O-N 3.07Å; L1019-M1023 VanDerWaalsContact O-N 3.11Å; E1020-M1023 HydrophobicContact CG-SD 4.42Å; M1023-A1028 HydrophobicContact CE-CB 3.46Å; M1023-A1028 VanDerWaalsContact CE-CB 3.46Å
1024	T	83.2	Confident	86	Confident	77 Å²	77	78.6 Å²	78.6	47%	0.472	38%	0.381	S	S	.	.			trans	-81.2	161.9	170.1	70.7	0	0	0	0	111.5	Q1026 M1027 A1028	T1024-Q1026 PolarHBondContact O-N 3.47Å; T1024-M1027 HydrophobicContact CG2-SD 3.83Å; T1024-M1027 PolarHBondContact N-SD 3.26Å; T1024-M1027 WeakPolarHBondContact O-CB 3.22Å; T1024-M1027 PolarHBondContact O-N 3.33Å; T1024-M1027 VanDerWaalsContact O-N 3.13Å; T1024-M1027 WeakPolarHBondContact OG1-CG 3.48Å; T1024-M1027 PolarHBondContact OG1-N 3.47Å; T1024-M1027 PolarHBondContact OG1-SD 2.97Å; T1024-A1028 PolarHBondContact O-N 3.05Å; T1024-A1028 VanDerWaalsContact O-N 3.09Å
1025	F	78	Confident	85.8	Confident	167 Å²	167	74.9 Å²	74.9	73%	0.732	36%	0.358	S	S	*	.	H	α-helix	trans	-56.6	-34.9	174.1	-178	-103	0	0	0	112.8	A1028 L1029	F1025-A1028 WeakPolarHBondContact O-CB 3.4Å; F1025-A1028 PolarHBondContact O-N 3.18Å; F1025-L1029 HydrophobicContact CD1-CD1 4.06Å; F1025-L1029 HydrophobicContact CE1-CD1 3.6Å; F1025-L1029 HydrophobicContact CZ-CD1 4.02Å; F1025-L1029 PolarHBondContact O-N 3.5Å
1026	Q	78.6	Confident	85.6	Confident	119 Å²	119	78 Å²	78	56%	0.556	37%	0.374	S	S	*	.	H	α-helix	trans	-67	-44.2	176.5	-174.3	171	-17.2	0	0	111.3	T1024 A1028 L1029 Q1030	T1024-Q1026 PolarHBondContact O-N 3.47Å; Q1026-A1028 VanDerWaalsContact C-N 3.28Å; Q1026-A1028 PolarHBondContact O-N 3.08Å; Q1026-L1029 PolarHBondContact O-N 2.87Å; Q1026-L1029 VanDerWaalsContact O-N 3.1Å; Q1026-Q1030 PolarHBondContact O-N 3.06Å
1027	M	83.9	Confident	85.6	Confident	21 Å²	21	77.2 Å²	77.2	10%	0.103	37%	0.371	C	S	.	.	H	α-helix	trans	-61.6	-35.4	176.6	-61.9	159.2	76.2	0	0	112	F979 P991 T1024 L1029 Q1030 W1035 L1038	F979-M1027 HydrophobicContact CD1-CE 4.15Å; F979-M1027 HydrophobicContact CE1-CE 3.65Å; P991-M1027 HydrophobicContact CG-CE 3.85Å; T1024-M1027 HydrophobicContact CG2-SD 3.83Å; T1024-M1027 PolarHBondContact N-SD 3.26Å; T1024-M1027 WeakPolarHBondContact O-CB 3.22Å; T1024-M1027 PolarHBondContact O-N 3.33Å; T1024-M1027 VanDerWaalsContact O-N 3.13Å; T1024-M1027 WeakPolarHBondContact OG1-CG 3.48Å; T1024-M1027 PolarHBondContact OG1-N 3.47Å; T1024-M1027 PolarHBondContact OG1-SD 2.97Å; M1027-L1029 PolarHBondContact O-N 3.49Å; M1027-Q1030 PolarHBondContact O-N 3.44Å; M1027-W1035 HydrophobicContact CB-CE3 4.46Å; M1027-W1035 HydrophobicContact CB-CH2 4.11Å; M1027-W1035 HydrophobicContact CB-CZ3 3.76Å; M1027-W1035 HydrophobicContact CE-CH2 4.11Å; M1027-W1035 HydrophobicContact CE-CZ3 3.82Å; M1027-W1035 HydrophobicContact CG-CH2 3.61Å; M1027-W1035 HydrophobicContact CG-CZ3 3.72Å; M1027-L1038 HydrophobicContact CB-CD2 4.45Å
1028	A	79.1	Confident	85.6	Confident	24 Å²	24	71.9 Å²	71.9	20%	0.198	34%	0.344	C	S	.	.	H	α-helix	trans	-64.5	-24.3	176.7	0	0	0	0	0	113.9	M1023 T1024 F1025 Q1026 R1031	M1023-A1028 HydrophobicContact CE-CB 3.46Å; M1023-A1028 VanDerWaalsContact CE-CB 3.46Å; T1024-A1028 PolarHBondContact O-N 3.05Å; T1024-A1028 VanDerWaalsContact O-N 3.09Å; F1025-A1028 WeakPolarHBondContact O-CB 3.4Å; F1025-A1028 PolarHBondContact O-N 3.18Å; Q1026-A1028 VanDerWaalsContact C-N 3.28Å; Q1026-A1028 PolarHBondContact O-N 3.08Å; A1028-R1031 PolarHBondContact O-NH1 3.34Å
1029	L	81.6	Confident	85.4	Confident	99 Å²	99	70.8 Å²	70.8	52%	0.518	34%	0.342	S	S	.	.	H	α-helix	trans	-91.1	-20.8	-178.8	-69.4	172.9	0	0	0	113.8	F1025 Q1026 M1027 R1031	F1025-L1029 HydrophobicContact CD1-CD1 4.06Å; F1025-L1029 HydrophobicContact CE1-CD1 3.6Å; F1025-L1029 HydrophobicContact CZ-CD1 4.02Å; F1025-L1029 PolarHBondContact O-N 3.5Å; Q1026-L1029 PolarHBondContact O-N 2.87Å; Q1026-L1029 VanDerWaalsContact O-N 3.1Å; M1027-L1029 PolarHBondContact O-N 3.49Å; L1029-R1031 PolarHBondContact O-NH1 3.38Å
1030	Q	81.6	Confident	85.3	Confident	54 Å²	54	72.8 Å²	72.8	25%	0.252	36%	0.356	S	S	.	.			trans	-62.5	147.4	-179.8	-59.2	-67.6	36.9	0	0	112.3	Q1026 M1027 W1035	Q1026-Q1030 PolarHBondContact O-N 3.06Å; M1027-Q1030 PolarHBondContact O-N 3.44Å; Q1030-W1035 HydrophobicContact CB-CB 4.17Å; Q1030-W1035 VanDerWaalsContact CB-CD1 3.48Å; Q1030-W1035 HydrophobicContact CB-CD2 3.77Å; Q1030-W1035 HydrophobicContact CB-CG 3.53Å; Q1030-W1035 HydrophobicContact CG-CD2 4.04Å; Q1030-W1035 HydrophobicContact CG-CG 4.27Å; Q1030-W1035 HydrophobicContact CG-CZ2 4.07Å
1031	R	79.8	Confident	85.5	Confident	146 Å²	146	67.9 Å²	67.9	55%	0.551	33%	0.333	S	S	*	.			trans	-135	0.1	-175.4	-65.8	-63.4	177.5	-92.8	-3.7	115	A1028 L1029	A1028-R1031 PolarHBondContact O-NH1 3.34Å; L1029-R1031 PolarHBondContact O-NH1 3.38Å
1032	D	82.7	Confident	85.5	Confident	95 Å²	95	60.5 Å²	60.5	51%	0.508	31%	0.305	S	S	.	.	S	Bend	trans	-68.6	156.3	178.2	-40.7	-57	0	0	0	111.3	C1034 W1035	D1032-C1034 PolarHBondContact O-N 3.13Å; D1032-W1035 WeakPolarHBondContact O-CB 3.41Å; D1032-W1035 PolarHBondContact O-N 3.05Å
1033	D	79.7	Confident	85.6	Confident	128 Å²	128	60.7 Å²	60.7	68%	0.684	31%	0.309	S	S	*	.	G	3₁₀ helix	trans	-60.2	-23	-173	-65	-52.8	0	0	0	114.5	R937 W1035 L1036	R937-D1033 PolarHBondContact NH2-O 3.09Å; D1033-W1035 VanDerWaalsContact C-N 3.27Å; D1033-W1035 PolarHBondContact O-N 3.1Å; D1033-L1036 VanDerWaalsContact O-CB 3.31Å; D1033-L1036 WeakPolarHBondContact O-CB 3.48Å; D1033-L1036 PolarHBondContact O-N 3.47Å
1034	C	81.9	Confident	86	Confident	64 Å²	64	60.7 Å²	60.7	43%	0.432	31%	0.312	S	S	.	.	G	3₁₀ helix	trans	-70.4	-20.3	173.4	59.8	0	0	0	0	113.5	P990 D1032	P990-C1034 HydrophobicContact CG-CB 4.44Å; D1032-C1034 PolarHBondContact O-N 3.13Å
1035	W	88.6	Confident	86.4	Confident	5 Å²	5	57 Å²	57	2%	0.019	29%	0.289	C	S	.	.	G	3₁₀ helix	trans	-94.3	-7.4	174.7	-65.2	95.8	0	0	0	113.5	G989 P990 L994 M1027 Q1030 D1032 D1033 P1037 L1038 I1039	G989-W1035 VanDerWaalsContact C-CZ2 3.47Å; G989-W1035 WeakPolarHBondContact O-CH2 3.17Å; P990-W1035 VanDerWaalsContact CA-CH2 3.5Å; P990-W1035 HydrophobicContact CB-CD2 4.5Å; P990-W1035 HydrophobicContact CB-CH2 4.22Å; P990-W1035 HydrophobicContact CB-CZ2 4Å; L994-W1035 HydrophobicContact CD2-CD2 4.29Å; L994-W1035 HydrophobicContact CD2-CE3 3.59Å; L994-W1035 HydrophobicContact CD2-CZ3 3.91Å; M1027-W1035 HydrophobicContact CB-CE3 4.46Å; M1027-W1035 HydrophobicContact CB-CH2 4.11Å; M1027-W1035 HydrophobicContact CB-CZ3 3.76Å; M1027-W1035 HydrophobicContact CE-CH2 4.11Å; M1027-W1035 HydrophobicContact CE-CZ3 3.82Å; M1027-W1035 HydrophobicContact CG-CH2 3.61Å; M1027-W1035 HydrophobicContact CG-CZ3 3.72Å; Q1030-W1035 HydrophobicContact CB-CB 4.17Å; Q1030-W1035 VanDerWaalsContact CB-CD1 3.48Å; Q1030-W1035 HydrophobicContact CB-CD2 3.77Å; Q1030-W1035 HydrophobicContact CB-CG 3.53Å; Q1030-W1035 HydrophobicContact CG-CD2 4.04Å; Q1030-W1035 HydrophobicContact CG-CG 4.27Å; Q1030-W1035 HydrophobicContact CG-CZ2 4.07Å; D1032-W1035 WeakPolarHBondContact O-CB 3.41Å; D1032-W1035 PolarHBondContact O-N 3.05Å; D1033-W1035 VanDerWaalsContact C-N 3.27Å; D1033-W1035 PolarHBondContact O-N 3.1Å; W1035-P1037 VanDerWaalsContact C-N 3.32Å; W1035-L1038 HydrophobicContact CE3-CD2 4.1Å; W1035-L1038 HydrophobicContact CZ3-CD2 4.32Å; W1035-L1038 WeakPolarHBondContact O-CB 3.39Å; W1035-L1038 PolarHBondContact O-N 3.21Å; W1035-L1038 VanDerWaalsContact O-N 3.08Å; W1035-I1039 PolarHBondContact O-N 3.18Å
1036	L	90.3	Very high	86.7	Confident	68 Å²	68	52 Å²	52	36%	0.356	27%	0.268	S	S	.	.	H	α-helix	trans	-51.6	-38.9	179.3	-171.3	61.9	0	0	0	114.3	D1033 L1038 I1039 S1040	D1033-L1036 VanDerWaalsContact O-CB 3.31Å; D1033-L1036 WeakPolarHBondContact O-CB 3.48Å; D1033-L1036 PolarHBondContact O-N 3.47Å; L1036-L1038 VanDerWaalsContact C-N 3.3Å; L1036-L1038 PolarHBondContact O-N 3.29Å; L1036-I1039 PolarHBondContact O-N 3.47Å; L1036-I1039 VanDerWaalsContact O-N 3.12Å; L1036-S1040 WeakPolarHBondContact O-CB 3.5Å; L1036-S1040 PolarHBondContact O-N 3.09Å; L1036-S1040 PolarHBondContact O-OG 3.4Å; L1036-S1040 VanDerWaalsContact O-OG 3.12Å
1037	P	92.4	Very high	86.1	Confident	0 Å²	0	49.4 Å²	49.4	0%	0	27%	0.267	C	S	.	.	H	α-helix	trans	-58	-40.1	177.1	-22.4	31.4	0	0	0	113.3	L994 L997 D998 W1035 Y1041	L994-P1037 WeakPolarHBondContact O-CB 3.29Å; L997-P1037 HydrophobicContact CB-CB 4.23Å; D998-P1037 HydrophobicContact CB-CB 4.45Å; D998-P1037 WeakPolarHBondContact OD2-CG 3.45Å; W1035-P1037 VanDerWaalsContact C-N 3.32Å; P1037-Y1041 VanDerWaalsContact O-CB 3.24Å; P1037-Y1041 WeakPolarHBondContact O-CB 3.26Å; P1037-Y1041 PolarHBondContact O-N 3.39Å
1038	L	92	Very high	84.9	Confident	3 Å²	3	50.4 Å²	50.4	2%	0.016	28%	0.283	C	S	.	.	H	α-helix	trans	-69.2	-38.2	176.9	-179.6	58	0	0	0	111.6	F979 L994 L997 L1019 M1027 W1035 L1036 R1042	F979-L1038 HydrophobicContact CZ-CD1 4.13Å; L994-L1038 HydrophobicContact CD1-CB 4.19Å; L994-L1038 HydrophobicContact CD2-CB 4.38Å; L994-L1038 HydrophobicContact CG-CB 4.49Å; L997-L1038 HydrophobicContact CD1-CB 4.22Å; L997-L1038 HydrophobicContact CD1-CD1 3.76Å; L1019-L1038 HydrophobicContact CD1-CD1 4.09Å; L1019-L1038 HydrophobicContact CD2-CD1 4.21Å; L1019-L1038 HydrophobicContact CG-CD1 4.49Å; M1027-L1038 HydrophobicContact CB-CD2 4.45Å; W1035-L1038 HydrophobicContact CE3-CD2 4.1Å; W1035-L1038 HydrophobicContact CZ3-CD2 4.32Å; W1035-L1038 WeakPolarHBondContact O-CB 3.39Å; W1035-L1038 PolarHBondContact O-N 3.21Å; W1035-L1038 VanDerWaalsContact O-N 3.08Å; L1036-L1038 VanDerWaalsContact C-N 3.3Å; L1036-L1038 PolarHBondContact O-N 3.29Å; L1038-R1042 VanDerWaalsContact O-CB 3.24Å; L1038-R1042 WeakPolarHBondContact O-CB 3.38Å; L1038-R1042 PolarHBondContact O-N 3.04Å
1039	I	90.8	Very high	83.7	Confident	26 Å²	26	51.3 Å²	51.3	13%	0.133	28%	0.284	C	S	.	.	H	α-helix	trans	-66.9	-51	178.2	-61.5	168.9	0	0	0	109.8	W1035 L1036 Y1041 R1042 N1043	W1035-I1039 PolarHBondContact O-N 3.18Å; L1036-I1039 PolarHBondContact O-N 3.47Å; L1036-I1039 VanDerWaalsContact O-N 3.12Å; I1039-Y1041 PolarHBondContact O-N 2.9Å; I1039-R1042 PolarHBondContact O-N 2.88Å; I1039-N1043 VanDerWaalsContact O-CB 3.27Å; I1039-N1043 WeakPolarHBondContact O-CB 3.19Å; I1039-N1043 PolarHBondContact O-N 2.99Å; I1039-N1043 PolarHBondContact O-ND2 3.1Å; I1039-N1043 PolarHBondContact O-OD1 3.49Å
1040	S	90.8	Very high	82	Confident	42 Å²	42	52.1 Å²	52.1	29%	0.294	29%	0.289	S	S	.	.	H	α-helix	trans	-56.5	-50.4	177.4	-63.7	0	0	0	0	112	L1036 N1043 S1044	L1036-S1040 WeakPolarHBondContact O-CB 3.5Å; L1036-S1040 PolarHBondContact O-N 3.09Å; L1036-S1040 PolarHBondContact O-OG 3.4Å; L1036-S1040 VanDerWaalsContact O-OG 3.12Å; S1040-N1043 PolarHBondContact O-N 3.14Å; S1040-S1044 PolarHBondContact O-N 3.46Å
1041	Y	95.1	Very high	80.2	Confident	0 Å²	0	56.2 Å²	56.2	0%	0	31%	0.312	C	S	.	.	H	α-helix	trans	-65.8	-43.3	-179.7	-179	-115.5	0	0	0	112.8	H971 I975 L997 L1000 L1019 P1037 I1039 N1043 S1044 L1045	H971-Y1041 AromaticContact CE1-CE2 3.92Å; H971-Y1041 AromaticContact ND1-CE2 3.66Å; H971-Y1041 AromaticContact ND1-CZ 3.71Å; H971-Y1041 PolarHBondContact ND1-OH 3.26Å; I975-Y1041 HydrophobicContact CD1-CE1 4.02Å; I975-Y1041 HydrophobicContact CG1-CE1 3.91Å; L997-Y1041 HydrophobicContact CB-CD1 4.35Å; L997-Y1041 HydrophobicContact CB-CG 4.16Å; L997-Y1041 HydrophobicContact CD1-CD1 4.28Å; L997-Y1041 HydrophobicContact CD2-CD1 3.86Å; L997-Y1041 HydrophobicContact CD2-CE1 4.02Å; L997-Y1041 HydrophobicContact CD2-CG 4.39Å; L997-Y1041 HydrophobicContact CG-CD1 4.39Å; L1000-Y1041 HydrophobicContact CB-CE2 4.22Å; L1000-Y1041 HydrophobicContact CD2-CE1 4.25Å; L1000-Y1041 HydrophobicContact CD2-CE2 3.92Å; L1000-Y1041 WeakPolarHBondContact CD2-OH 3.34Å; L1000-Y1041 HydrophobicContact CG-CE2 3.79Å; L1019-Y1041 HydrophobicContact CD1-CE1 4.36Å; L1019-Y1041 HydrophobicContact CD2-CD1 3.96Å; L1019-Y1041 HydrophobicContact CD2-CE1 4.09Å; P1037-Y1041 VanDerWaalsContact O-CB 3.24Å; P1037-Y1041 WeakPolarHBondContact O-CB 3.26Å; P1037-Y1041 PolarHBondContact O-N 3.39Å; I1039-Y1041 PolarHBondContact O-N 2.9Å; Y1041-N1043 VanDerWaalsContact C-N 3.33Å; Y1041-N1043 PolarHBondContact O-N 3.11Å; Y1041-S1044 PolarHBondContact O-N 3.29Å; Y1041-S1044 PolarHBondContact O-OG 3.08Å; Y1041-L1045 HydrophobicContact CD1-CD1 4.34Å; Y1041-L1045 HydrophobicContact CE1-CD1 3.89Å; Y1041-L1045 HydrophobicContact CE2-CD1 4.47Å; Y1041-L1045 WeakPolarHBondContact O-CG 3.48Å; Y1041-L1045 PolarHBondContact O-N 2.87Å
1042	R	92.4	Very high	78.3	Confident	35 Å²	35	54.3 Å²	54.3	13%	0.132	31%	0.313	C	S	.	.	H	α-helix	trans	-62.7	-42.7	175.2	-167.2	-162.5	67.6	-132.3	-15.9	111	H1016 L1019 L1038 I1039 S1044 L1045 Q1046	H1016-R1042 WeakPolarHBondContact NE2-CG 3.27Å; L1019-R1042 HydrophobicContact CD2-CB 4.34Å; L1019-R1042 HydrophobicContact CD2-CG 4.45Å; L1038-R1042 VanDerWaalsContact O-CB 3.24Å; L1038-R1042 WeakPolarHBondContact O-CB 3.38Å; L1038-R1042 PolarHBondContact O-N 3.04Å; I1039-R1042 PolarHBondContact O-N 2.88Å; R1042-S1044 VanDerWaalsContact C-N 3.32Å; R1042-S1044 PolarHBondContact O-N 2.77Å; R1042-L1045 PolarHBondContact O-N 3.18Å; R1042-Q1046 HydrophobicContact CG-CG 4.37Å; R1042-Q1046 WeakPolarHBondContact O-CB 3.5Å; R1042-Q1046 WeakPolarHBondContact O-CG 3.3Å; R1042-Q1046 PolarHBondContact O-N 3.31Å
1043	N	91.2	Very high	76.2	Confident	75 Å²	75	54.2 Å²	54.2	40%	0.401	32%	0.316	S	S	.	.	H	α-helix	trans	-63.5	-36.7	178.1	-67.8	-3.6	0	0	0	111.7	I1039 S1040 Y1041 L1045 Q1046 A1047	I1039-N1043 VanDerWaalsContact O-CB 3.27Å; I1039-N1043 WeakPolarHBondContact O-CB 3.19Å; I1039-N1043 PolarHBondContact O-N 2.99Å; I1039-N1043 PolarHBondContact O-ND2 3.1Å; I1039-N1043 PolarHBondContact O-OD1 3.49Å; S1040-N1043 PolarHBondContact O-N 3.14Å; Y1041-N1043 VanDerWaalsContact C-N 3.33Å; Y1041-N1043 PolarHBondContact O-N 3.11Å; N1043-L1045 VanDerWaalsContact C-N 3.3Å; N1043-L1045 PolarHBondContact O-N 3.28Å; N1043-Q1046 PolarHBondContact O-N 2.71Å; N1043-A1047 WeakPolarHBondContact O-CB 3.43Å; N1043-A1047 PolarHBondContact O-N 2.87Å
1044	S	92.8	Very high	74.1	Confident	27 Å²	27	56 Å²	56	19%	0.189	33%	0.325	C	S	.	.	H	α-helix	trans	-68.8	-27.1	177.5	84	0	0	0	0	113.4	S1004 K1012 S1040 Y1041 R1042	S1004-S1044 VanDerWaalsContact CB-OG 3.27Å; S1004-S1044 WeakPolarHBondContact CB-OG 3.36Å; S1004-S1044 VanDerWaalsContact OG-CB 3.31Å; S1004-S1044 WeakPolarHBondContact OG-CB 3.45Å; S1004-S1044 PolarHBondContact OG-OG 2.8Å; K1012-S1044 PolarHBondContact NZ-O 3.27Å; S1040-S1044 PolarHBondContact O-N 3.46Å; Y1041-S1044 PolarHBondContact O-N 3.29Å; Y1041-S1044 PolarHBondContact O-OG 3.08Å; R1042-S1044 VanDerWaalsContact C-N 3.32Å; R1042-S1044 PolarHBondContact O-N 2.77Å
1045	L	90.3	Very high	71.8	Confident	0 Å²	0	57.9 Å²	57.9	0%	0	34%	0.338	C	S	.	.	H	α-helix	trans	-77.8	-36.4	169.6	-62.3	172.8	0	0	0	112.5	L1007 K1012 V1015 L1019 Y1041 R1042 N1043	L1007-L1045 HydrophobicContact CD1-CD2 3.58Å; K1012-L1045 HydrophobicContact CB-CD2 4.39Å; K1012-L1045 WeakPolarHBondContact CB-O 3.44Å; K1012-L1045 HydrophobicContact CG-CD2 4.28Å; V1015-L1045 HydrophobicContact CB-CD1 4.49Å; V1015-L1045 HydrophobicContact CB-CD2 4.23Å; V1015-L1045 HydrophobicContact CG1-CD1 3.82Å; V1015-L1045 HydrophobicContact CG1-CD2 3.95Å; L1019-L1045 HydrophobicContact CD2-CD1 4.4Å; Y1041-L1045 HydrophobicContact CD1-CD1 4.34Å; Y1041-L1045 HydrophobicContact CE1-CD1 3.89Å; Y1041-L1045 HydrophobicContact CE2-CD1 4.47Å; Y1041-L1045 WeakPolarHBondContact O-CG 3.48Å; Y1041-L1045 PolarHBondContact O-N 2.87Å; R1042-L1045 PolarHBondContact O-N 3.18Å; N1043-L1045 VanDerWaalsContact C-N 3.3Å; N1043-L1045 PolarHBondContact O-N 3.28Å
1046	Q	84.8	Confident	69	Low	60 Å²	60	63.6 Å²	63.6	28%	0.28	37%	0.373	S	S	.	.	H	α-helix	trans	-77.5	-23.4	179.4	-70.6	175.2	-28.6	0	0	113.4	H1016 R1042 N1043 G1048 M1049	H1016-Q1046 PolarHBondContact NE2-NE2 3.11Å; R1042-Q1046 HydrophobicContact CG-CG 4.37Å; R1042-Q1046 WeakPolarHBondContact O-CB 3.5Å; R1042-Q1046 WeakPolarHBondContact O-CG 3.3Å; R1042-Q1046 PolarHBondContact O-N 3.31Å; N1043-Q1046 PolarHBondContact O-N 2.71Å; Q1046-G1048 PolarHBondContact O-N 3.32Å; Q1046-M1049 HydrophobicContact CG-SD 4.37Å; Q1046-M1049 WeakPolarHBondContact O-CB 3.38Å; Q1046-M1049 PolarHBondContact O-N 3.03Å
1047	A	67.4	Low	66.2	Low	65 Å²	65	68.2 Å²	68.2	54%	0.537	40%	0.397	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56	108.7	178.5	0	0	0	0	0	111.9	N1043	N1043-A1047 WeakPolarHBondContact O-CB 3.43Å; N1043-A1047 PolarHBondContact O-N 2.87Å
1048	G	57.3	Low	63.2	Low	43 Å²	43	74.1 Å²	74.1	44%	0.443	44%	0.438	S	S	.	.	T	Hydrogen-bonded Turn	trans	100.7	10.6	-176.3	0	0	0	0	0	115.7	R1009 Q1046	R1009-G1048 PolarHBondContact NE-O 3.22Å; Q1046-G1048 PolarHBondContact O-N 3.32Å
1049	M	54.1	Low	60.1	Low	43 Å²	43	77.1 Å²	77.1	21%	0.212	47%	0.47	C	S	.	.			trans	-87.4	-25.2	176.9	-74.3	-177.9	44.5	0	0	115.3	Q1046 D1051	Q1046-M1049 HydrophobicContact CG-SD 4.37Å; Q1046-M1049 WeakPolarHBondContact O-CB 3.38Å; Q1046-M1049 PolarHBondContact O-N 3.03Å; M1049-D1051 PolarHBondContact O-N 3.45Å
1050	D	47.1	Very low	57.1	Low	116 Å²	116	84.1 Å²	84.1	62%	0.62	51%	0.506	S	S	*	.	G	3₁₀ helix	trans	-83.2	-8.6	-165.1	-63.4	-32.6	0	0	0	115.7	D1052 T1053	D1050-D1052 PolarHBondContact O-N 3.39Å; D1050-T1053 PolarHBondContact O-N 3.48Å; D1050-T1053 PolarHBondContact O-OG1 2.93Å
1051	D	41.8	Very low	54.1	Low	139 Å²	139	86.9 Å²	86.9	74%	0.743	53%	0.525	S	S	*	.	G	3₁₀ helix	trans	-68.7	-20.2	-179.8	-160.5	35.1	0	0	0	112.6	M1049	M1049-D1051 PolarHBondContact O-N 3.45Å
1052	D	41.7	Very low	50.8	Low	107 Å²	107	91.6 Å²	91.6	57%	0.572	56%	0.558	S	S	*	*	G	3₁₀ helix	trans	-94.2	-9.1	-178.2	-68.9	-56.7	0	0	0	114.5	R1009 D1050	R1009-D1052 IonicContact CZ-OD2 2.75Å; R1009-D1052 IonicContact NE-OD2 3.57Å; R1009-D1052 IonicContact NH2-OD1 3.95Å; R1009-D1052 IonicContact NH2-OD2 2.67Å; R1009-D1052 PolarHBondContact NH2-OD2 3.27Å; D1050-D1052 PolarHBondContact O-N 3.39Å
1053	T	37.8	Very low	47.9	Very low	93 Å²	93	101.7 Å²	101.7	57%	0.571	60%	0.596	S	S	*	*	T	Hydrogen-bonded Turn	trans	-110.7	-12.2	-164.8	48.5	0	0	0	0	116	D1050 S1055	D1050-T1053 PolarHBondContact O-N 3.48Å; D1050-T1053 PolarHBondContact O-OG1 2.93Å; T1053-S1055 PolarHBondContact O-N 3.39Å
1054	L	35.5	Very low	44.8	Very low	166 Å²	166	101.7 Å²	101.7	87%	0.869	61%	0.614	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91.7	30.1	-175.4	-84.6	172.3	0	0	0	115.9
1055	S	32.7	Very low	41.5	Very low	103 Å²	103	105.9 Å²	105.9	72%	0.72	64%	0.643	S	S	*	*	T	Hydrogen-bonded Turn	trans	-138.6	5.2	-178.3	67	0	0	0	0	118.5	T1053	T1053-S1055 PolarHBondContact O-N 3.39Å
1056	V	30.2	Very low	38.3	Very low	124 Å²	124	111.6 Å²	111.6	75%	0.752	68%	0.678	S	S	*	*			trans	-139	90	179.7	-158	0	0	0	0	114.5
1057	I	31.1	Very low	35.4	Very low	166 Å²	166	120 Å²	120	85%	0.851	71%	0.707	S	S	*	*				176	86.1	126.7	-86	154.1	0	0	0	109.7
1058	S	29.6	Very low	33.4	Very low	123 Å²	123	122 Å²	122	86%	0.86	72%	0.717	S	S	*	*			trans	173.9	126.5	134.6	59.1	0	0	0	0	109
1059	G	26.8	Very low	31.9	Very low	67 Å²	67	128.6 Å²	128.6	69%	0.691	73%	0.733	S	S	*	*			cis	176.3	147.5	-10.1	0	0	0	0	0	111
1060	I	28.7	Very low	30.5	Very low	173 Å²	173	136.4 Å²	136.4	89%	0.887	77%	0.766	S	S	*	*			trans	71.6	105.5	167.9	-50.3	170.5	0	0	0	116.7
1061	S	26.9	Very low	29.6	Very low	100 Å²	100	134.2 Å²	134.2	70%	0.699	76%	0.76	S	S	*	*			trans	69.7	109	145.5	-156.1	0	0	0	0	122.5
1062	S	27	Very low	28.7	Very low	98 Å²	98	137.4 Å²	137.4	69%	0.685	77%	0.767	S	S	*	*				77.7	125	127.2	67.3	0	0	0	0	122.4
1063	R	30.5	Very low	28	Very low	248 Å²	248	140.2 Å²	140.2	94%	0.936	78%	0.777	S	S	*	*			trans	66.6	116.1	158.7	-71.1	-178.5	167.2	166.2	-3.6	117.9
1064	G	25.6	Very low	27.2	Very low	75 Å²	75	141.8 Å²	141.8	77%	0.773	79%	0.792	S	S	*	*			trans	-78.4	-156.4	160	0	0	0	0	0	112.7
1065	S	23.6	Very low	26.8	Very low	114 Å²	114	137.7 Å²	137.7	80%	0.797	78%	0.782	S	S	*	*			cis	-158.6	164.4	11.1	-159.1	0	0	0	0	112.3
1066	V	23.2	Very low	26.6	Very low	121 Å²	121	138.9 Å²	138.9	73%	0.733	79%	0.785	S	S	*	*			trans	62.1	86.2	166.3	-169.9	0	0	0	0	117.7
1067	R	24.9	Very low	26.4	Very low	235 Å²	235	137 Å²	137	89%	0.887	78%	0.777	S	S	*	*				50.3	114.9	107.8	-170.9	-166.7	-154.1	-177	8.7	119
1068	S	24.3	Very low	26.3	Very low	107 Å²	107	137.8 Å²	137.8	75%	0.748	77%	0.774	S	S	*	*			trans	-158.9	114.1	140.5	-159.1	0	0	0	0	116.7
1069	K	26.4	Very low	26.1	Very low	182 Å²	182	142.9 Å²	142.9	79%	0.791	78%	0.775	S	S	*	*			trans	27.8	134.4	136.2	-54.2	178.2	179.8	-176.8	0	121.4
1070	K	25.6	Very low	26	Very low	207 Å²	207	149.3 Å²	149.3	90%	0.9	78%	0.784	S	S	*	*				-116.7	138.2	116.9	-73.9	-174.8	177.4	179.3	0	108.2
1071	S	26.9	Very low	25.9	Very low	71 Å²	71	149.2 Å²	149.2	50%	0.497	78%	0.784	S	S	.	*			cis	111.6	100.5	4.9	79.9	0	0	0	0	115.9
1072	K	23.4	Very low	26.4	Very low	206 Å²	206	148.9 Å²	148.9	90%	0.896	78%	0.78	S	S	*	*				-92.8	136.8	112.6	-75.3	-176.5	178.2	178.9	0	105.4
1073	Q	27.3	Very low	26.3	Very low	165 Å²	165	152.5 Å²	152.5	77%	0.771	79%	0.786	S	S	*	*			cis	64.2	120.2	30.1	-61	-171.9	-16.7	0	0	112
1074	S	21.8	Very low	26	Very low	127 Å²	127	149.3 Å²	149.3	89%	0.888	78%	0.781	S	S	*	*			cis	-90	-165.3	43.5	61.8	0	0	0	0	117.5
1075	A	25.6	Very low	25.9	Very low	80 Å²	80	153.2 Å²	153.2	66%	0.661	78%	0.779	S	S	*	*			trans	-154.5	147.5	-158.1	0	0	0	0	0	115
1076	V	28.4	Very low	26	Very low	128 Å²	128	154.1 Å²	154.1	78%	0.776	78%	0.775	S	S	*	*			trans	61.7	125	131.6	171.6	0	0	0	0	117.4
1077	S	26.6	Very low	26.3	Very low	85 Å²	85	153.4 Å²	153.4	59%	0.594	78%	0.776	S	S	*	*				-175.8	134.5	65.4	-145.3	0	0	0	0	116.3
1078	K	28.5	Very low	26.4	Very low	182 Å²	182	147.5 Å²	147.5	79%	0.791	77%	0.771	S	S	*	*			trans	55.7	156.5	132.5	-63.7	173.8	-164.4	170.9	0	120.5
1079	R	26.2	Very low	26.5	Very low	229 Å²	229	147 Å²	147	86%	0.864	77%	0.767	S	S	*	*			cis	-128.3	149.4	4.3	-88.9	120.6	177.2	-173	2.1	108
1080	K	25.8	Very low	26.8	Very low	202 Å²	202	143 Å²	143	88%	0.878	76%	0.762	S	S	*	*				79.8	102.7	53.6	-149.2	-154.2	-169.3	-151.6	0	115.3
1081	L	26.4	Very low	26.9	Very low	171 Å²	171	142.1 Å²	142.1	90%	0.895	76%	0.758	S	S	*	*			trans	-160.5	156.3	154.6	-102.5	174.4	0	0	0	109.9
1082	P	36.9	Very low	26.9	Very low	94 Å²	94	146 Å²	146	61%	0.61	77%	0.773	S	S	*	*			trans	-127.3	166.3	178.6	42.6	-29.8	0	0	0	116.4
1083	E	24.8	Very low	27	Very low	174 Å²	174	138.8 Å²	138.8	81%	0.813	76%	0.758	S	S	*	*			trans	64.4	148.1	147.3	-73.4	161.6	146.6	0	0	123
1084	E	24	Very low	26.9	Very low	180 Å²	180	137.2 Å²	137.2	84%	0.841	76%	0.759	S	S	*	*			trans	63	143.9	160.8	-72.4	170.9	-166.5	0	0	120
1085	E	24.3	Very low	27.1	Very low	157 Å²	157	141.3 Å²	141.3	73%	0.734	76%	0.756	S	S	*	*			cis	-163.4	-179	-20.9	-141.6	-173.9	-162	0	0	110.4
1086	N	24.3	Very low	27.1	Very low	133 Å²	133	144.9 Å²	144.9	71%	0.711	76%	0.76	S	S	*	*			trans	68.6	111.6	174.5	-65.9	-50.4	0	0	0	117.6
1087	S	30	Very low	27.1	Very low	106 Å²	106	146.4 Å²	146.4	74%	0.741	76%	0.764	S	S	*	*				76.5	136.4	69.4	82.2	0	0	0	0	114.1
1088	S	26	Very low	27.1	Very low	112 Å²	112	153.8 Å²	153.8	78%	0.783	78%	0.779	S	S	*	*			cis	-153.5	-176.8	12.5	62.7	0	0	0	0	110.4
1089	S	26.9	Very low	26.9	Very low	95 Å²	95	152.5 Å²	152.5	66%	0.664	78%	0.776	S	S	*	*			cis	-164	150.2	17.2	47	0	0	0	0	113.9
1090	S	32.5	Very low	26.9	Very low	99 Å²	99	149.3 Å²	149.3	69%	0.692	77%	0.771	S	S	*	*			trans	58.6	129	155.6	51	0	0	0	0	120.4
1091	F	27.7	Very low	26.8	Very low	188 Å²	188	144.7 Å²	144.7	83%	0.825	76%	0.764	S	S	*	*			cis	75.3	144.4	45.2	-74.2	-125.1	0	0	0	113.3
1092	D	26.9	Very low	26.9	Very low	152 Å²	152	143 Å²	143	81%	0.813	76%	0.761	S	S	*	*			cis	-148.4	-176.6	3.4	-135.6	-8.9	0	0	0	109.1
1093	G	25.3	Very low	26.6	Very low	56 Å²	56	144.3 Å²	144.3	58%	0.577	77%	0.769	S	S	*	*			cis	-177.6	-166.9	5.9	0	0	0	0	0	112.9
1094	V	26.3	Very low	26.7	Very low	131 Å²	131	142.2 Å²	142.2	79%	0.794	77%	0.768	S	S	*	*			trans	-144.5	170.2	-167.2	174.8	0	0	0	0	111.1
1095	W	25.4	Very low	27.1	Very low	213 Å²	213	139 Å²	139	81%	0.807	76%	0.763	S	S	*	*			trans	142.7	117.9	135.2	-80.9	73.7	0	0	0	117.9
1096	M	26.3	Very low	27.1	Very low	155 Å²	155	137.4 Å²	137.4	76%	0.764	76%	0.764	S	S	*	*			trans	80	148.8	141.3	-67.8	-62.3	173.7	0	0	125.6
1097	N	28.8	Very low	27.2	Very low	160 Å²	160	138.5 Å²	138.5	86%	0.856	77%	0.766	S	S	*	*			trans	-92.4	153.9	174.7	-69.9	-44.5	0	0	0	113.1
1098	R	24.8	Very low	26.9	Very low	241 Å²	241	139.9 Å²	139.9	91%	0.909	76%	0.763	S	S	*	*			trans	-166.2	165.9	131.3	-161.4	155.3	177.9	172.3	-1.8	112.2
1099	E	24.8	Very low	26.8	Very low	154 Å²	154	142.7 Å²	142.7	72%	0.72	76%	0.763	S	S	*	*			trans	-102.9	173.7	-168.8	-42.6	165	120	0	0	115.6
1100	Q	26.5	Very low	27	Very low	163 Å²	163	142.8 Å²	142.8	76%	0.762	76%	0.764	S	S	*	*			trans	97.3	127.2	149.3	-69.3	173.1	30.1	0	0	123
1101	S	23.2	Very low	26.8	Very low	105 Å²	105	144.2 Å²	144.2	73%	0.734	77%	0.771	S	S	*	*			trans	68.2	107.5	147.4	58.8	0	0	0	0	124.2
1102	V	28.9	Very low	26.7	Very low	136 Å²	136	143.3 Å²	143.3	82%	0.824	77%	0.769	S	S	*	*				39.7	124.8	111.8	-178.3	0	0	0	0	117.4
1103	P	31.1	Very low	26.7	Very low	121 Å²	121	143.4 Å²	143.4	79%	0.786	77%	0.768	S	S	*	*				-148.8	169.9	57.6	42.2	-23.2	0	0	0	119.6
1104	T	25.7	Very low	26.6	Very low	129 Å²	129	147.8 Å²	147.8	79%	0.791	78%	0.784	S	S	*	*			trans	-72.4	158	160	11.5	0	0	0	0	111.9
1105	P	33.3	Very low	26.7	Very low	113 Å²	113	146.4 Å²	146.4	73%	0.734	78%	0.781	S	S	*	*				-158.6	157.8	69	41.7	-19.7	0	0	0	121.1
1106	V	25.1	Very low	26.7	Very low	124 Å²	124	143.2 Å²	143.2	75%	0.752	79%	0.785	S	S	*	*			trans	76.1	112.9	135.1	168.1	0	0	0	0	123.6
1107	M	25.2	Very low	26.6	Very low	156 Å²	156	141.4 Å²	141.4	77%	0.768	78%	0.782	S	S	*	*			trans	76.2	131.7	136.9	-79.9	-174.6	143	0	0	127.2
1108	M	25	Very low	26.5	Very low	135 Å²	135	141.9 Å²	141.9	67%	0.665	78%	0.784	S	S	*	*			trans	62.8	127.7	134.3	-66.2	-71.7	-173.3	0	0	119.9
1109	H	23.3	Very low	26.5	Very low	170 Å²	170	141.4 Å²	141.4	79%	0.787	78%	0.782	S	S	*	*				-166.3	168.4	50.5	-98.8	-59.2	0	0	0	113.5
1110	S	30.6	Very low	26.6	Very low	98 Å²	98	140.9 Å²	140.9	69%	0.685	78%	0.784	S	S	*	*			trans	-80.2	167.1	172.3	-26.4	0	0	0	0	114.5
1111	P	28.4	Very low	26.7	Very low	129 Å²	129	138.3 Å²	138.3	84%	0.838	78%	0.782	S	S	*	*			trans	-123.7	150	149.3	36.7	-26.5	0	0	0	113.5
1112	H	25.4	Very low	26.7	Very low	168 Å²	168	141.8 Å²	141.8	78%	0.778	78%	0.784	S	S	*	*			trans	-122.1	149.6	176	-85.9	-74.4	0	0	0	112.2
1113	L	27.9	Very low	26.5	Very low	154 Å²	154	146.4 Å²	146.4	81%	0.806	79%	0.786	S	S	*	*			trans	44.8	137.3	140.9	-63.3	168.8	0	0	0	121.6
1114	T	23.4	Very low	26	Very low	148 Å²	148	149.3 Å²	149.3	91%	0.908	79%	0.792	S	S	*	*			trans	-137.1	159.5	141.3	29.2	0	0	0	0	110.5
1115	S	28.1	Very low	26.2	Very low	103 Å²	103	152.5 Å²	152.5	72%	0.72	79%	0.789	S	S	*	*			trans	-141.4	160.8	-168.4	169.2	0	0	0	0	111.2
1116	T	25.1	Very low	26	Very low	145 Å²	145	152.6 Å²	152.6	89%	0.89	79%	0.789	S	S	*	*			trans	-138.7	147.5	165.6	36.8	0	0	0	0	112
1117	V	24.1	Very low	25.9	Very low	117 Å²	117	153.3 Å²	153.3	71%	0.709	79%	0.785	S	S	*	*			trans	-127.6	139.6	-162.8	171.4	0	0	0	0	112
1118	L	25.6	Very low	25.8	Very low	171 Å²	171	152.5 Å²	152.5	90%	0.895	78%	0.783	S	S	*	*			trans	-141.9	108.7	152.7	-70.6	176.8	0	0	0	108
1119	R	26	Very low	25.8	Very low	231 Å²	231	149.3 Å²	149.3	87%	0.872	79%	0.786	S	S	*	*				86.8	111	68	-105.4	-169.4	177.1	-175.4	1.5	115.6
1120	D	26.5	Very low	25.9	Very low	143 Å²	143	151.1 Å²	151.1	77%	0.765	79%	0.787	S	S	*	*			trans	-48.6	154.7	165.6	-132.5	-66.1	0	0	0	114.8	K1122	D1120-K1122 PolarHBondContact OD1-N 3.22Å
1121	P	28.3	Very low	25.6	Very low	109 Å²	109	150.3 Å²	150.3	71%	0.708	79%	0.786	S	S	*	*				-152.5	125	103.2	36.1	-16.8	0	0	0	119.3
1122	K	23.4	Very low	25.5	Very low	178 Å²	178	148.5 Å²	148.5	77%	0.774	78%	0.782	S	S	*	*				63.6	119.4	124.4	-62.2	178	178.8	176.5	0	122.9	D1120	D1120-K1122 PolarHBondContact OD1-N 3.22Å
1123	R	24.7	Very low	25.5	Very low	232 Å²	232	145.9 Å²	145.9	88%	0.875	78%	0.778	S	S	*	*				43.7	129.4	127.7	-62.1	-175.8	177.5	-171.7	-1.8	121.7
1124	M	21.8	Very low	25.4	Very low	183 Å²	183	147.8 Å²	147.8	90%	0.901	78%	0.78	S	S	*	*				-169.1	154.4	110.9	-98.5	-51.2	-173.1	0	0	113.2
1125	R	28.1	Very low	25.4	Very low	195 Å²	195	145.1 Å²	145.1	74%	0.736	77%	0.768	S	S	*	*			trans	-92.4	159	158.9	-99.2	-167.6	-172.1	-168.6	7.8	108.3	E1127	R1125-E1127 IonicContact CZ-OE1 2.75Å; R1125-E1127 IonicContact NH1-OE1 3.27Å; R1125-E1127 PolarHBondContact NH1-OE1 3.09Å
1126	P	29.1	Very low	25.5	Very low	115 Å²	115	148.6 Å²	148.6	75%	0.747	78%	0.775	S	S	*	*				-121.5	177.2	50.1	11.4	14.3	0	0	0	113.7
1127	E	23.7	Very low	26.1	Very low	140 Å²	140	147.3 Å²	147.3	65%	0.654	77%	0.768	S	S	*	*			cis	97.3	145.8	21.6	-147	159.7	-108.3	0	0	115.6	R1125	R1125-E1127 IonicContact CZ-OE1 2.75Å; R1125-E1127 IonicContact NH1-OE1 3.27Å; R1125-E1127 PolarHBondContact NH1-OE1 3.09Å
1128	D	23.6	Very low	26.3	Very low	138 Å²	138	145.9 Å²	145.9	74%	0.738	77%	0.769	S	S	*	*			trans	87.4	137.3	171.9	-69.4	-34.9	0	0	0	124.3	Y1130	D1128-Y1130 HydrophobicContact CB-CD2 4.49Å; D1128-Y1130 HydrophobicContact CB-CE2 4.49Å
1129	G	24.2	Very low	26.4	Very low	69 Å²	69	145.7 Å²	145.7	71%	0.711	76%	0.764	S	S	*	*			trans	139.4	56.3	172.6	0	0	0	0	0	115.3
1130	Y	24.9	Very low	26.5	Very low	208 Å²	208	142.1 Å²	142.1	82%	0.816	76%	0.757	S	S	*	*				51.2	138.3	96.3	-78.9	-96.2	0	0	0	117.6	D1128	D1128-Y1130 HydrophobicContact CB-CD2 4.49Å; D1128-Y1130 HydrophobicContact CB-CE2 4.49Å
1131	A	26.3	Very low	26.5	Very low	81 Å²	81	143.6 Å²	143.6	67%	0.669	76%	0.759	S	S	*	*			cis	-177	171.1	-18.7	0	0	0	0	0	112.1
1132	A	25.1	Very low	26.4	Very low	90 Å²	90	144.6 Å²	144.6	74%	0.744	76%	0.757	S	S	*	*			trans	74	150.1	152.1	0	0	0	0	0	119.4
1133	T	26.2	Very low	26.5	Very low	113 Å²	113	144 Å²	144	69%	0.693	76%	0.757	S	S	*	*			cis	-164.4	161	-13.7	22.3	0	0	0	0	107.2
1134	F	25.2	Very low	26.5	Very low	194 Å²	194	141.4 Å²	141.4	85%	0.851	76%	0.755	S	S	*	*				-164.7	-167.6	58.3	-112.8	-72.5	0	0	0	111.7
1135	S	24	Very low	26.6	Very low	93 Å²	93	137.7 Å²	137.7	65%	0.65	75%	0.753	S	S	*	*			trans	-146.3	146.7	-153.8	60.2	0	0	0	0	118.7
1136	M	30.3	Very low	26.4	Very low	176 Å²	176	136.2 Å²	136.2	87%	0.867	76%	0.759	S	S	*	*			trans	71.6	164.6	152.2	-67.4	-64.6	179.4	0	0	118.6
1137	P	37.4	Very low	27.5	Very low	117 Å²	117	136.1 Å²	136.1	76%	0.76	76%	0.759	S	S	*	*			cis	-138.1	166.5	9.7	42.9	-25.4	0	0	0	120
1138	A	27.8	Very low	28.2	Very low	87 Å²	87	135 Å²	135	72%	0.719	76%	0.763	S	S	*	*			trans	57	108.6	138.3	0	0	0	0	0	126.2
1139	E	28.7	Very low	28.7	Very low	168 Å²	168	136.5 Å²	136.5	79%	0.785	77%	0.766	S	S	*	*				66.9	136.6	106.6	-133.9	-174.3	-102.8	0	0	126.3
1140	Q	27.2	Very low	29.2	Very low	156 Å²	156	139 Å²	139	73%	0.729	77%	0.77	S	S	*	*			trans	109.9	111.2	146.9	-59.1	-168.7	9.6	0	0	123
1141	H	26.8	Very low	29.1	Very low	174 Å²	174	136 Å²	136	81%	0.806	77%	0.767	S	S	*	*			trans	52.6	156.4	135.5	-81.1	-166.1	0	0	0	122.4
1142	L	25	Very low	30.5	Very low	130 Å²	130	137.7 Å²	137.7	68%	0.681	77%	0.771	S	S	*	*			cis	-164	160.4	14.1	-127.8	162.1	0	0	0	113.5
1143	Q	26.1	Very low	31.2	Very low	165 Å²	165	138 Å²	138	77%	0.771	77%	0.766	S	S	*	*			trans	85.3	170.5	146.5	-111.1	154.4	-3.4	0	0	124.5
1144	Q	25.7	Very low	31.2	Very low	178 Å²	178	140.2 Å²	140.2	83%	0.832	77%	0.768	S	S	*	*			trans	-121.2	159.3	-151.4	-50.9	154.3	-77.6	0	0	114.8
1145	A	23.8	Very low	31.4	Very low	104 Å²	104	138.5 Å²	138.5	86%	0.86	76%	0.763	S	S	*	*			trans	-176.7	166.5	139.8	0	0	0	0	0	114.9
1146	L	23.2	Very low	31.6	Very low	164 Å²	164	142.7 Å²	142.7	86%	0.859	77%	0.772	S	S	*	*			trans	-130.7	-173.3	-178.4	-81	152.8	0	0	0	109.4
1147	P	51.3	Low	31.9	Very low	114 Å²	114	143.2 Å²	143.2	74%	0.74	77%	0.772	S	S	*	*			cis	-118.2	-129.1	-30.6	30.4	-6.4	0	0	0	108.2
1148	P	39.5	Very low	31.4	Very low	116 Å²	116	142.5 Å²	142.5	75%	0.753	78%	0.776	S	S	*	*			cis	-132.1	-166.3	-28.2	40.9	-21.3	0	0	0	115.1
1149	Q	34.3	Very low	31.5	Very low	169 Å²	169	143.2 Å²	143.2	79%	0.79	78%	0.782	S	S	*	*			trans	-90.1	174.1	160.4	-58.6	178.6	-20.4	0	0	111.8
1150	P	33.5	Very low	31.8	Very low	123 Å²	123	144.2 Å²	144.2	80%	0.799	79%	0.789	S	S	*	*				-151.8	-170.5	88.1	40.8	-20.8	0	0	0	116.2
1151	L	24.5	Very low	32.3	Very low	144 Å²	144	141.9 Å²	141.9	75%	0.754	78%	0.781	S	S	*	*			trans	-89.2	-153.3	177.2	-52	90.5	0	0	0	112.6
1152	P	54.5	Low	32.7	Very low	116 Å²	116	142.3 Å²	142.3	75%	0.753	78%	0.777	S	S	*	*				-107.7	-136.3	-80.9	30.8	-9.3	0	0	0	109.8
1153	P	39.1	Very low	33.4	Very low	97 Å²	97	141.7 Å²	141.7	63%	0.63	77%	0.774	S	S	*	*			cis	-141.7	-173.2	-15.9	44.8	-26	0	0	0	117.4
1154	H	26.2	Very low	34.3	Very low	159 Å²	159	137.8 Å²	137.8	74%	0.736	76%	0.762	S	S	*	*			trans	61	122.2	151.5	-73.5	-66.8	0	0	0	124.8
1155	Q	30.9	Very low	35.1	Very low	159 Å²	159	135.2 Å²	135.2	74%	0.743	75%	0.75	S	S	*	*			trans	26	125.5	134.6	-67.2	175.6	-27.8	0	0	121.7
1156	H	26.8	Very low	36.1	Very low	181 Å²	181	133.5 Å²	133.5	84%	0.838	73%	0.729	S	S	*	*				-161.7	167.3	109.1	-110.2	69.2	0	0	0	113.5
1157	Q	38.3	Very low	37.2	Very low	186 Å²	186	129.9 Å²	129.9	87%	0.869	71%	0.713	S	S	*	*			trans	-84	160.3	-170.9	-61.6	165.1	-52.7	0	0	114.4
1158	A	26.3	Very low	36.9	Very low	102 Å²	102	132.3 Å²	132.3	84%	0.843	71%	0.708	S	S	*	*			trans	-135.4	157.6	160.8	0	0	0	0	0	110.7
1159	A	29.5	Very low	37.5	Very low	103 Å²	103	132.2 Å²	132.2	85%	0.851	70%	0.699	S	S	*	*	P	Polyproline II helix	trans	-64.9	150.9	-162	0	0	0	0	0	116.5
1160	M	35.7	Very low	38.2	Very low	189 Å²	189	129.4 Å²	129.4	93%	0.931	69%	0.689	S	S	*	*	P	Polyproline II helix	trans	-85.1	151.7	164	-78.9	-170.4	167.4	0	0	112.1
1161	D	36.5	Very low	38.9	Very low	106 Å²	106	126.8 Å²	126.8	57%	0.567	67%	0.671	S	S	*	*	P	Polyproline II helix	trans	-89.9	143.5	175.4	-171	8.8	0	0	0	112	N1163 T1164	D1161-N1163 PolarHBondContact O-N 3.07Å; D1161-T1164 PolarHBondContact O-N 2.78Å
1162	Y	36.1	Very low	40	Very low	183 Å²	183	125.1 Å²	125.1	72%	0.718	66%	0.659	S	S	*	*	H	α-helix	trans	-72.2	-27.7	-170.7	-162	-98.8	0	0	0	112.9	T1164 Q1165	Y1162-T1164 PolarHBondContact O-N 3.19Å; Y1162-Q1165 PolarHBondContact O-N 3.02Å
1163	N	40.5	Very low	39.7	Very low	117 Å²	117	127.3 Å²	127.3	63%	0.626	65%	0.652	S	S	*	*	H	α-helix	trans	-64.7	-37.5	176.8	-79.8	-45.7	0	0	0	112.7	D1161 Q1165 V1166 T1167	D1161-N1163 PolarHBondContact O-N 3.07Å; N1163-Q1165 VanDerWaalsContact C-N 3.25Å; N1163-Q1165 PolarHBondContact O-N 3.21Å; N1163-V1166 PolarHBondContact O-N 3.08Å; N1163-T1167 PolarHBondContact O-N 3.14Å; N1163-T1167 PolarHBondContact O-OG1 3.03Å
1164	T	44.3	Very low	40.2	Very low	84 Å²	84	129.4 Å²	129.4	52%	0.515	65%	0.653	S	S	.	*	H	α-helix	trans	-62	-36.4	-177.7	-40.9	0	0	0	0	111.6	D1161 Y1162 W1168	D1161-T1164 PolarHBondContact O-N 2.78Å; Y1162-T1164 PolarHBondContact O-N 3.19Å; T1164-W1168 WeakPolarHBondContact O-CB 3.2Å; T1164-W1168 PolarHBondContact O-N 3.4Å
1165	Q	41.6	Very low	41.4	Very low	123 Å²	123	126.5 Å²	126.5	58%	0.575	64%	0.64	S	S	*	*	H	α-helix	trans	-73	-34.1	-175.4	-155.7	172.1	32.4	0	0	112.9	Y1162 N1163 M1169	Y1162-Q1165 PolarHBondContact O-N 3.02Å; N1163-Q1165 VanDerWaalsContact C-N 3.25Å; N1163-Q1165 PolarHBondContact O-N 3.21Å; Q1165-M1169 HydrophobicContact CG-CE 4.46Å; Q1165-M1169 WeakPolarHBondContact O-CE 3.38Å; Q1165-M1169 PolarHBondContact O-N 2.91Å
1166	V	46.4	Very low	42.2	Very low	69 Å²	69	121.4 Å²	121.4	42%	0.418	63%	0.626	S	S	.	*	H	α-helix	trans	-69.5	-43.6	174.9	-180	0	0	0	0	110.8	N1163 M1169 L1170	N1163-V1166 PolarHBondContact O-N 3.08Å; V1166-M1169 PolarHBondContact O-N 3.07Å; V1166-L1170 HydrophobicContact CG1-CD1 4.42Å; V1166-L1170 PolarHBondContact O-N 2.81Å
1167	T	46.1	Very low	43.3	Very low	87 Å²	87	117.4 Å²	117.4	53%	0.534	61%	0.607	S	S	.	*	H	α-helix	trans	-59.8	-46	174.2	-54.5	0	0	0	0	111.1	N1163 M1169 L1170 T1171	N1163-T1167 PolarHBondContact O-N 3.14Å; N1163-T1167 PolarHBondContact O-OG1 3.03Å; T1167-M1169 VanDerWaalsContact C-N 3.34Å; T1167-M1169 PolarHBondContact O-N 3.2Å; T1167-L1170 PolarHBondContact O-N 3.35Å; T1167-L1170 VanDerWaalsContact O-N 3.14Å; T1167-T1171 PolarHBondContact O-N 2.88Å; T1167-T1171 PolarHBondContact O-OG1 3.21Å
1168	W	44.3	Very low	43.8	Very low	166 Å²	166	111.4 Å²	111.4	63%	0.629	59%	0.589	S	S	*	*	H	α-helix	trans	-58.5	-41.5	178.2	-120.4	80.3	0	0	0	113.3	T1164 T1171 Q1172	T1164-W1168 WeakPolarHBondContact O-CB 3.2Å; T1164-W1168 PolarHBondContact O-N 3.4Å; W1168-T1171 PolarHBondContact O-N 2.99Å; W1168-Q1172 HydrophobicContact CE3-CG 3.99Å; W1168-Q1172 HydrophobicContact CZ3-CG 4.04Å; W1168-Q1172 WeakPolarHBondContact O-CB 3.5Å; W1168-Q1172 PolarHBondContact O-N 3.33Å
1169	M	53.3	Low	45.1	Very low	114 Å²	114	113.9 Å²	113.9	56%	0.562	58%	0.577	S	S	*	*	H	α-helix	trans	-67.5	-33.6	177	-75.7	-174.9	-76.3	0	0	112.9	Q1165 V1166 T1167 R1173	Q1165-M1169 HydrophobicContact CG-CE 4.46Å; Q1165-M1169 WeakPolarHBondContact O-CE 3.38Å; Q1165-M1169 PolarHBondContact O-N 2.91Å; V1166-M1169 PolarHBondContact O-N 3.07Å; T1167-M1169 VanDerWaalsContact C-N 3.34Å; T1167-M1169 PolarHBondContact O-N 3.2Å; M1169-R1173 WeakPolarHBondContact O-CB 3.38Å; M1169-R1173 PolarHBondContact O-N 3.13Å; M1169-R1173 VanDerWaalsContact O-N 3.1Å
1170	L	48.7	Very low	46.1	Very low	110 Å²	110	114.3 Å²	114.3	58%	0.576	56%	0.561	S	S	*	*	H	α-helix	trans	-69.4	-44.5	173.7	-77	163.1	0	0	0	111.6	V1166 T1167 R1173 Q1174	V1166-L1170 HydrophobicContact CG1-CD1 4.42Å; V1166-L1170 PolarHBondContact O-N 2.81Å; T1167-L1170 PolarHBondContact O-N 3.35Å; T1167-L1170 VanDerWaalsContact O-N 3.14Å; L1170-R1173 PolarHBondContact O-N 3.07Å; L1170-Q1174 PolarHBondContact O-N 3.28Å
1171	T	48.2	Very low	46.8	Very low	68 Å²	68	110.8 Å²	110.8	42%	0.417	54%	0.542	S	S	.	.	H	α-helix	trans	-64.2	-43.4	176.3	-54.5	0	0	0	0	112	T1167 W1168 R1173 Q1174 Q1175	T1167-T1171 PolarHBondContact O-N 2.88Å; T1167-T1171 PolarHBondContact O-OG1 3.21Å; W1168-T1171 PolarHBondContact O-N 2.99Å; T1171-R1173 VanDerWaalsContact C-N 3.29Å; T1171-R1173 PolarHBondContact O-N 2.99Å; T1171-Q1174 PolarHBondContact O-N 3.49Å; T1171-Q1175 WeakPolarHBondContact O-CG 3.46Å; T1171-Q1175 PolarHBondContact O-N 3.33Å
1172	Q	46.6	Very low	47.5	Very low	109 Å²	109	112.1 Å²	112.1	51%	0.509	55%	0.545	S	S	.	.	H	α-helix	trans	-59.4	-39.9	173.3	-92.8	-164.6	-29.6	0	0	112.1	W1168 Q1175 A1176	W1168-Q1172 HydrophobicContact CE3-CG 3.99Å; W1168-Q1172 HydrophobicContact CZ3-CG 4.04Å; W1168-Q1172 WeakPolarHBondContact O-CB 3.5Å; W1168-Q1172 PolarHBondContact O-N 3.33Å; Q1172-Q1175 PolarHBondContact O-N 3.34Å; Q1172-A1176 WeakPolarHBondContact O-CB 3.48Å; Q1172-A1176 PolarHBondContact O-N 2.84Å
1173	R	48	Very low	48.1	Very low	162 Å²	162	109.1 Å²	109.1	61%	0.611	54%	0.538	S	S	*	.	H	α-helix	trans	-65.3	-45.1	178.9	-176.2	173.4	176.5	161.2	3.1	112.1	M1169 L1170 T1171 Q1175 A1176 E1177	M1169-R1173 WeakPolarHBondContact O-CB 3.38Å; M1169-R1173 PolarHBondContact O-N 3.13Å; M1169-R1173 VanDerWaalsContact O-N 3.1Å; L1170-R1173 PolarHBondContact O-N 3.07Å; T1171-R1173 VanDerWaalsContact C-N 3.29Å; T1171-R1173 PolarHBondContact O-N 2.99Å; R1173-Q1175 VanDerWaalsContact C-N 3.35Å; R1173-Q1175 PolarHBondContact O-N 3.48Å; R1173-A1176 PolarHBondContact O-N 3.14Å; R1173-E1177 WeakPolarHBondContact CG-OE1 3.46Å; R1173-E1177 IonicContact CZ-OE1 2.68Å; R1173-E1177 IonicContact NE-OE1 2.76Å; R1173-E1177 PolarHBondContact NE-OE1 3.43Å; R1173-E1177 IonicContact NH2-OE1 3.2Å; R1173-E1177 PolarHBondContact NH2-OE1 3.43Å; R1173-E1177 WeakPolarHBondContact O-CG 3.44Å; R1173-E1177 PolarHBondContact O-N 3.02Å
1174	Q	49.7	Very low	48.6	Very low	140 Å²	140	111.3 Å²	111.3	65%	0.654	54%	0.537	S	S	*	.	H	α-helix	trans	-63	-40.1	174.4	-76.3	-176.6	-47.6	0	0	112.1	L1170 T1171 A1176 E1177 A1178	L1170-Q1174 PolarHBondContact O-N 3.28Å; T1171-Q1174 PolarHBondContact O-N 3.49Å; Q1174-A1176 VanDerWaalsContact C-N 3.35Å; Q1174-A1176 PolarHBondContact O-N 3.01Å; Q1174-E1177 PolarHBondContact O-N 3.4Å; Q1174-A1178 VanDerWaalsContact O-CB 3.3Å; Q1174-A1178 WeakPolarHBondContact O-CB 3.36Å; Q1174-A1178 PolarHBondContact O-N 2.9Å
1175	Q	51.2	Low	48.7	Very low	98 Å²	98	110.4 Å²	110.4	46%	0.458	53%	0.529	S	S	.	.	H	α-helix	trans	-65	-35.1	174.1	-74.2	-168.8	0.6	0	0	113.2	T1171 Q1172 R1173 R1179	T1171-Q1175 WeakPolarHBondContact O-CG 3.46Å; T1171-Q1175 PolarHBondContact O-N 3.33Å; Q1172-Q1175 PolarHBondContact O-N 3.34Å; R1173-Q1175 VanDerWaalsContact C-N 3.35Å; R1173-Q1175 PolarHBondContact O-N 3.48Å; Q1175-R1179 VanDerWaalsContact O-CG 3.28Å; Q1175-R1179 WeakPolarHBondContact O-CG 3.45Å; Q1175-R1179 PolarHBondContact O-N 2.77Å
1176	A	48	Very low	48.9	Very low	53 Å²	53	108.2 Å²	108.2	44%	0.438	53%	0.526	S	S	.	.	H	α-helix	trans	-70.1	-43	176	0	0	0	0	0	111.9	Q1172 R1173 Q1174 A1178 R1179 Q1180	Q1172-A1176 WeakPolarHBondContact O-CB 3.48Å; Q1172-A1176 PolarHBondContact O-N 2.84Å; R1173-A1176 PolarHBondContact O-N 3.14Å; Q1174-A1176 VanDerWaalsContact C-N 3.35Å; Q1174-A1176 PolarHBondContact O-N 3.01Å; A1176-A1178 VanDerWaalsContact C-N 3.32Å; A1176-A1178 PolarHBondContact O-N 3.4Å; A1176-R1179 PolarHBondContact O-N 2.91Å; A1176-Q1180 PolarHBondContact O-N 2.85Å
1177	E	49.3	Very low	48.7	Very low	97 Å²	97	110.8 Å²	110.8	45%	0.453	54%	0.535	S	S	.	.	H	α-helix	trans	-65.8	-35.3	176.3	-70.6	172.5	-172.9	0	0	111.2	R1173 Q1174 H1181	R1173-E1177 WeakPolarHBondContact CG-OE1 3.46Å; R1173-E1177 IonicContact CZ-OE1 2.68Å; R1173-E1177 IonicContact NE-OE1 2.76Å; R1173-E1177 PolarHBondContact NE-OE1 3.43Å; R1173-E1177 IonicContact NH2-OE1 3.2Å; R1173-E1177 PolarHBondContact NH2-OE1 3.43Å; R1173-E1177 WeakPolarHBondContact O-CG 3.44Å; R1173-E1177 PolarHBondContact O-N 3.02Å; Q1174-E1177 PolarHBondContact O-N 3.4Å; E1177-H1181 PolarHBondContact O-N 3.47Å
1178	A	50.1	Low	48.6	Very low	59 Å²	59	112.5 Å²	112.5	49%	0.488	54%	0.537	S	S	.	.	H	α-helix	trans	-67	-46.7	171.9	0	0	0	0	0	113.3	Q1174 A1176 Q1180 H1181 Q1182	Q1174-A1178 VanDerWaalsContact O-CB 3.3Å; Q1174-A1178 WeakPolarHBondContact O-CB 3.36Å; Q1174-A1178 PolarHBondContact O-N 2.9Å; A1176-A1178 VanDerWaalsContact C-N 3.32Å; A1176-A1178 PolarHBondContact O-N 3.4Å; A1178-Q1180 VanDerWaalsContact C-N 3.34Å; A1178-Q1180 PolarHBondContact O-N 2.67Å; A1178-H1181 WeakPolarHBondContact O-CA 3.33Å; A1178-H1181 WeakPolarHBondContact O-CB 3.37Å; A1178-H1181 PolarHBondContact O-N 3.15Å; A1178-Q1182 PolarHBondContact O-N 2.98Å
1179	R	52.6	Low	48.5	Very low	154 Å²	154	111.8 Å²	111.8	58%	0.581	54%	0.535	S	S	*	.	H	α-helix	trans	-59.5	-43.5	175.7	-72.3	175.7	-148.8	-154	5.6	111.6	Q1175 A1176 H1181 Q1182 E1183	Q1175-R1179 VanDerWaalsContact O-CG 3.28Å; Q1175-R1179 WeakPolarHBondContact O-CG 3.45Å; Q1175-R1179 PolarHBondContact O-N 2.77Å; A1176-R1179 PolarHBondContact O-N 2.91Å; R1179-H1181 PolarHBondContact O-N 3.15Å; R1179-Q1182 PolarHBondContact O-N 2.74Å; R1179-Q1182 VanDerWaalsContact O-N 3.16Å; R1179-E1183 WeakPolarHBondContact O-CB 3.48Å; R1179-E1183 WeakPolarHBondContact O-CG 3.28Å; R1179-E1183 PolarHBondContact O-N 3.39Å
1180	Q	50.2	Low	47.9	Very low	113 Å²	113	108.6 Å²	108.6	53%	0.528	53%	0.527	S	S	.	.	H	α-helix	trans	-66.7	-13.5	173.9	-75.1	-166.2	-8.5	0	0	114.1	A1176 A1178 R1184	A1176-Q1180 PolarHBondContact O-N 2.85Å; A1178-Q1180 VanDerWaalsContact C-N 3.34Å; A1178-Q1180 PolarHBondContact O-N 2.67Å; Q1180-R1184 PolarHBondContact O-NE 3.42Å; Q1180-R1184 PolarHBondContact O-NH2 3.1Å
1181	H	50.9	Low	47.6	Very low	114 Å²	114	109.8 Å²	109.8	53%	0.528	53%	0.528	S	S	.	.	H	α-helix	trans	-83.6	-48.4	168.8	-162.5	45	0	0	0	110.2	E1177 A1178 R1179 E1183 R1184 I1185	E1177-H1181 PolarHBondContact O-N 3.47Å; A1178-H1181 WeakPolarHBondContact O-CA 3.33Å; A1178-H1181 WeakPolarHBondContact O-CB 3.37Å; A1178-H1181 PolarHBondContact O-N 3.15Å; R1179-H1181 PolarHBondContact O-N 3.15Å; H1181-E1183 PolarHBondContact O-N 2.81Å; H1181-R1184 PolarHBondContact O-N 3.08Å; H1181-R1184 VanDerWaalsContact O-N 3.1Å; H1181-I1185 WeakPolarHBondContact O-CG1 3.37Å; H1181-I1185 PolarHBondContact O-N 3.21Å
1182	Q	51.3	Low	47.2	Very low	135 Å²	135	110.8 Å²	110.8	63%	0.631	53%	0.529	S	S	*	.	H	α-helix	trans	-55.9	-46	176.2	-156.5	72.2	4.8	0	0	112.4	A1178 R1179 R1184 I1185 S1186	A1178-Q1182 PolarHBondContact O-N 2.98Å; R1179-Q1182 PolarHBondContact O-N 2.74Å; R1179-Q1182 VanDerWaalsContact O-N 3.16Å; Q1182-R1184 VanDerWaalsContact C-N 3.33Å; Q1182-R1184 PolarHBondContact O-N 3.4Å; Q1182-I1185 PolarHBondContact O-N 3.35Å; Q1182-S1186 WeakPolarHBondContact O-CB 3.36Å; Q1182-S1186 PolarHBondContact O-N 2.6Å
1183	E	49.3	Very low	46.8	Very low	120 Å²	120	113.5 Å²	113.5	56%	0.561	53%	0.534	S	S	*	.	H	α-helix	trans	-61.7	-37.5	176.6	-73.2	168.2	179.8	0	0	112.4	R1179 H1181 M1187	R1179-E1183 WeakPolarHBondContact O-CB 3.48Å; R1179-E1183 WeakPolarHBondContact O-CG 3.28Å; R1179-E1183 PolarHBondContact O-N 3.39Å; H1181-E1183 PolarHBondContact O-N 2.81Å; E1183-M1187 VanDerWaalsContact O-CB 3.26Å; E1183-M1187 WeakPolarHBondContact O-CB 3.41Å; E1183-M1187 VanDerWaalsContact O-CG 3.27Å; E1183-M1187 WeakPolarHBondContact O-CG 3.46Å; E1183-M1187 PolarHBondContact O-N 2.93Å
1184	R	49.8	Very low	46.3	Very low	163 Å²	163	110.2 Å²	110.2	62%	0.615	53%	0.529	S	S	*	.	H	α-helix	trans	-72.6	-34	177.2	-87.9	-179.1	-76.5	-177.7	-5.4	112.5	Q1180 H1181 Q1182 H1188	Q1180-R1184 PolarHBondContact O-NE 3.42Å; Q1180-R1184 PolarHBondContact O-NH2 3.1Å; H1181-R1184 PolarHBondContact O-N 3.08Å; H1181-R1184 VanDerWaalsContact O-N 3.1Å; Q1182-R1184 VanDerWaalsContact C-N 3.33Å; Q1182-R1184 PolarHBondContact O-N 3.4Å; R1184-H1188 PolarHBondContact O-N 3.04Å
1185	I	47.9	Very low	45.9	Very low	65 Å²	65	110 Å²	110	33%	0.333	53%	0.527	S	S	.	.	H	α-helix	trans	-69.7	-48.5	173.5	-67.9	166.2	0	0	0	109.8	H1181 Q1182 M1187 H1188 Y1189	H1181-I1185 WeakPolarHBondContact O-CG1 3.37Å; H1181-I1185 PolarHBondContact O-N 3.21Å; Q1182-I1185 PolarHBondContact O-N 3.35Å; I1185-M1187 VanDerWaalsContact C-N 3.35Å; I1185-M1187 PolarHBondContact O-N 2.66Å; I1185-H1188 WeakPolarHBondContact O-CA 3.37Å; I1185-H1188 VanDerWaalsContact O-CB 3.27Å; I1185-H1188 WeakPolarHBondContact O-CB 3.44Å; I1185-H1188 PolarHBondContact O-N 3.17Å; I1185-Y1189 HydrophobicContact CG2-CD2 3.76Å; I1185-Y1189 HydrophobicContact CG2-CE2 3.74Å; I1185-Y1189 WeakPolarHBondContact O-CD2 3.32Å; I1185-Y1189 PolarHBondContact O-N 2.78Å
1186	S	45.5	Very low	45.1	Very low	76 Å²	76	111.6 Å²	111.6	53%	0.531	54%	0.537	S	S	.	.	H	α-helix	trans	-56.2	-44.9	174.9	179.1	0	0	0	0	112.3	Q1182 H1188 Y1189 A1190	Q1182-S1186 WeakPolarHBondContact O-CB 3.36Å; Q1182-S1186 PolarHBondContact O-N 2.6Å; S1186-H1188 PolarHBondContact O-N 3.23Å; S1186-Y1189 PolarHBondContact O-N 3.39Å; S1186-A1190 WeakPolarHBondContact O-CB 3.22Å; S1186-A1190 PolarHBondContact O-N 3.2Å
1187	M	42.4	Very low	44.6	Very low	123 Å²	123	113 Å²	113	61%	0.606	53%	0.534	S	S	*	.	H	α-helix	trans	-63.8	-21.6	173.1	-81.2	-93	-84.2	0	0	114.3	E1183 I1185 K1191	E1183-M1187 VanDerWaalsContact O-CB 3.26Å; E1183-M1187 WeakPolarHBondContact O-CB 3.41Å; E1183-M1187 VanDerWaalsContact O-CG 3.27Å; E1183-M1187 WeakPolarHBondContact O-CG 3.46Å; E1183-M1187 PolarHBondContact O-N 2.93Å; I1185-M1187 VanDerWaalsContact C-N 3.35Å; I1185-M1187 PolarHBondContact O-N 2.66Å; M1187-K1191 WeakPolarHBondContact O-CG 3.44Å
1188	H	44.4	Very low	44	Very low	124 Å²	124	113.5 Å²	113.5	57%	0.574	54%	0.537	S	S	*	.	H	α-helix	trans	-80.4	-46.9	172.5	-158.1	-76.4	0	0	0	110.8	R1184 I1185 S1186 A1190 K1191 M1192	R1184-H1188 PolarHBondContact O-N 3.04Å; I1185-H1188 WeakPolarHBondContact O-CA 3.37Å; I1185-H1188 VanDerWaalsContact O-CB 3.27Å; I1185-H1188 WeakPolarHBondContact O-CB 3.44Å; I1185-H1188 PolarHBondContact O-N 3.17Å; S1186-H1188 PolarHBondContact O-N 3.23Å; H1188-A1190 PolarHBondContact O-N 2.75Å; H1188-K1191 WeakPolarHBondContact O-CB 3.34Å; H1188-K1191 PolarHBondContact O-N 3.2Å; H1188-K1191 VanDerWaalsContact O-N 3.09Å; H1188-M1192 PolarHBondContact O-N 3.49Å
1189	Y	41.8	Very low	43.4	Very low	150 Å²	150	113.8 Å²	113.8	59%	0.588	54%	0.539	S	S	*	.	H	α-helix	trans	-61.2	-41.3	175.1	-84.8	-77.8	0	0	0	112.7	I1185 S1186 K1191 M1192 R1193	I1185-Y1189 HydrophobicContact CG2-CD2 3.76Å; I1185-Y1189 HydrophobicContact CG2-CE2 3.74Å; I1185-Y1189 WeakPolarHBondContact O-CD2 3.32Å; I1185-Y1189 PolarHBondContact O-N 2.78Å; S1186-Y1189 PolarHBondContact O-N 3.39Å; Y1189-K1191 PolarHBondContact O-N 2.98Å; Y1189-M1192 HydrophobicContact CE1-CE 4.4Å; Y1189-M1192 PolarHBondContact O-N 3.43Å; Y1189-R1193 PolarHBondContact O-N 2.94Å
1190	A	39.3	Very low	42.7	Very low	47 Å²	47	112.2 Å²	112.2	39%	0.388	54%	0.54	S	S	.	.	H	α-helix	trans	-58.9	-32.8	174.2	0	0	0	0	0	112.6	S1186 H1188 N1194	S1186-A1190 WeakPolarHBondContact O-CB 3.22Å; S1186-A1190 PolarHBondContact O-N 3.2Å; H1188-A1190 PolarHBondContact O-N 2.75Å; A1190-N1194 PolarHBondContact O-N 3.02Å; A1190-N1194 PolarHBondContact O-ND2 3.3Å
1191	K	42.4	Very low	41.9	Very low	135 Å²	135	116 Å²	116	59%	0.587	55%	0.55	S	S	*	*	H	α-helix	trans	-78.6	-29.2	174.5	-73.1	177.2	179.7	-179.9	0	113.3	M1187 H1188 Y1189 H1195	M1187-K1191 WeakPolarHBondContact O-CG 3.44Å; H1188-K1191 WeakPolarHBondContact O-CB 3.34Å; H1188-K1191 PolarHBondContact O-N 3.2Å; H1188-K1191 VanDerWaalsContact O-N 3.09Å; Y1189-K1191 PolarHBondContact O-N 2.98Å; K1191-H1195 PolarHBondContact O-N 3.3Å; K1191-H1195 PolarHBondContact O-ND1 2.91Å
1192	M	40.1	Very low	41.1	Very low	90 Å²	90	120 Å²	120	44%	0.443	56%	0.56	S	S	.	*	H	α-helix	trans	-69.6	-48.5	169.5	-84.6	163.3	65.9	0	0	111.4	H1188 Y1189 N1194 H1195 M1196	H1188-M1192 PolarHBondContact O-N 3.49Å; Y1189-M1192 HydrophobicContact CE1-CE 4.4Å; Y1189-M1192 PolarHBondContact O-N 3.43Å; M1192-N1194 VanDerWaalsContact C-N 3.27Å; M1192-N1194 PolarHBondContact O-N 2.94Å; M1192-H1195 PolarHBondContact O-N 3.03Å; M1192-M1196 PolarHBondContact O-N 3.39Å
1193	R	38.4	Very low	40.2	Very low	166 Å²	166	117 Å²	117	63%	0.626	57%	0.566	S	S	*	*	H	α-helix	trans	-54.2	-43.4	177.5	-164	168.4	-177.6	152.5	-2.5	111.3	Y1189 M1196 Q1197	Y1189-R1193 PolarHBondContact O-N 2.94Å; R1193-M1196 PolarHBondContact O-N 2.79Å; R1193-Q1197 WeakPolarHBondContact O-CB 3.31Å; R1193-Q1197 VanDerWaalsContact O-CG 3.32Å; R1193-Q1197 WeakPolarHBondContact O-CG 3.32Å; R1193-Q1197 PolarHBondContact O-N 2.93Å
1194	N	37.9	Very low	39.5	Very low	92 Å²	92	116.7 Å²	116.7	49%	0.492	58%	0.577	S	S	.	*	H	α-helix	trans	-64.3	-44.8	173.5	-87.7	-87.9	0	0	0	113.8	A1190 M1192 Q1198	A1190-N1194 PolarHBondContact O-N 3.02Å; A1190-N1194 PolarHBondContact O-ND2 3.3Å; M1192-N1194 VanDerWaalsContact C-N 3.27Å; M1192-N1194 PolarHBondContact O-N 2.94Å; N1194-Q1198 WeakPolarHBondContact O-CB 3.46Å; N1194-Q1198 WeakPolarHBondContact O-CG 3.3Å; N1194-Q1198 PolarHBondContact O-N 3.47Å
1195	H	40.3	Very low	38.6	Very low	135 Å²	135	111.7 Å²	111.7	63%	0.625	58%	0.576	S	S	*	*	H	α-helix	trans	-64.4	-40.5	176.4	-83.3	101.1	0	0	0	112.3	K1191 M1192 Q1198 A1199	K1191-H1195 PolarHBondContact O-N 3.3Å; K1191-H1195 PolarHBondContact O-ND1 2.91Å; M1192-H1195 PolarHBondContact O-N 3.03Å; H1195-Q1198 PolarHBondContact O-N 2.97Å; H1195-A1199 PolarHBondContact O-N 2.81Å
1196	M	35.3	Very low	37.7	Very low	133 Å²	133	116.9 Å²	116.9	66%	0.655	60%	0.604	S	S	*	*	H	α-helix	trans	-66.7	-43.5	179.2	-164.7	177.6	-171	0	0	111.3	M1192 R1193 Q1198 A1199 I1200	M1192-M1196 PolarHBondContact O-N 3.39Å; R1193-M1196 PolarHBondContact O-N 2.79Å; M1196-Q1198 VanDerWaalsContact C-N 3.31Å; M1196-Q1198 PolarHBondContact O-N 2.73Å; M1196-A1199 PolarHBondContact O-N 3.19Å; M1196-I1200 HydrophobicContact CG-CD1 4.21Å; M1196-I1200 VanDerWaalsContact O-CG1 3.29Å; M1196-I1200 WeakPolarHBondContact O-CG1 3.47Å; M1196-I1200 PolarHBondContact O-N 2.8Å
1197	Q	36.9	Very low	37	Very low	83 Å²	83	122.3 Å²	122.3	39%	0.388	62%	0.623	S	S	.	*	H	α-helix	trans	-62.7	-35.4	172.6	-73.9	176.5	-25.8	0	0	112.5	R1193 R1201	R1193-Q1197 WeakPolarHBondContact O-CB 3.31Å; R1193-Q1197 VanDerWaalsContact O-CG 3.32Å; R1193-Q1197 WeakPolarHBondContact O-CG 3.32Å; R1193-Q1197 PolarHBondContact O-N 2.93Å; Q1197-R1201 WeakPolarHBondContact O-CB 3.43Å; Q1197-R1201 WeakPolarHBondContact O-CG 3.45Å; Q1197-R1201 PolarHBondContact O-N 3.43Å
1198	Q	37	Very low	36.6	Very low	107 Å²	107	125.1 Å²	125.1	50%	0.5	63%	0.634	S	S	.	*	H	α-helix	trans	-70.2	-35.6	172.7	-74.9	-175.9	5.4	0	0	113.1	N1194 H1195 M1196 R1202	N1194-Q1198 WeakPolarHBondContact O-CB 3.46Å; N1194-Q1198 WeakPolarHBondContact O-CG 3.3Å; N1194-Q1198 PolarHBondContact O-N 3.47Å; H1195-Q1198 PolarHBondContact O-N 2.97Å; M1196-Q1198 VanDerWaalsContact C-N 3.31Å; M1196-Q1198 PolarHBondContact O-N 2.73Å; Q1198-R1202 WeakPolarHBondContact O-CG 3.5Å; Q1198-R1202 PolarHBondContact O-N 3.3Å; Q1198-R1202 VanDerWaalsContact O-N 3.12Å
1199	A	37.8	Very low	35.9	Very low	64 Å²	64	127.8 Å²	127.8	53%	0.529	65%	0.647	S	S	.	*	H	α-helix	trans	-65.1	-46.9	173.5	0	0	0	0	0	111.3	H1195 M1196 R1201 R1202 G1203	H1195-A1199 PolarHBondContact O-N 2.81Å; M1196-A1199 PolarHBondContact O-N 3.19Å; A1199-R1201 VanDerWaalsContact C-N 3.33Å; A1199-R1201 PolarHBondContact O-N 2.73Å; A1199-R1202 PolarHBondContact O-N 3.48Å; A1199-R1202 VanDerWaalsContact O-N 3.08Å; A1199-G1203 PolarHBondContact O-N 2.88Å
1200	I	36.9	Very low	35.2	Very low	121 Å²	121	128.6 Å²	128.6	62%	0.621	66%	0.662	S	S	*	*	H	α-helix	trans	-58.9	-42.6	176.2	-68	164.2	0	0	0	111.1	M1196 R1202 G1203	M1196-I1200 HydrophobicContact CG-CD1 4.21Å; M1196-I1200 VanDerWaalsContact O-CG1 3.29Å; M1196-I1200 WeakPolarHBondContact O-CG1 3.47Å; M1196-I1200 PolarHBondContact O-N 2.8Å; I1200-R1202 VanDerWaalsContact C-N 3.31Å; I1200-R1202 PolarHBondContact O-N 3.48Å; I1200-G1203 PolarHBondContact O-N 2.9Å
1201	R	34.2	Very low	34.7	Very low	193 Å²	193	135.3 Å²	135.3	73%	0.728	69%	0.685	S	S	*	*	H	α-helix	trans	-71.8	-16.7	176.6	-74	-176.9	179.4	-175.2	2.5	114.7	Q1197 A1199	Q1197-R1201 WeakPolarHBondContact O-CB 3.43Å; Q1197-R1201 WeakPolarHBondContact O-CG 3.45Å; Q1197-R1201 PolarHBondContact O-N 3.43Å; A1199-R1201 VanDerWaalsContact C-N 3.33Å; A1199-R1201 PolarHBondContact O-N 2.73Å
1202	R	33.7	Very low	34.1	Very low	198 Å²	198	137.2 Å²	137.2	75%	0.747	70%	0.696	S	S	*	*	H	α-helix	trans	-90.7	-13.6	176.2	-77.7	-178.1	178.1	-168.2	0.3	114	Q1198 A1199 I1200 S1204	Q1198-R1202 WeakPolarHBondContact O-CG 3.5Å; Q1198-R1202 PolarHBondContact O-N 3.3Å; Q1198-R1202 VanDerWaalsContact O-N 3.12Å; A1199-R1202 PolarHBondContact O-N 3.48Å; A1199-R1202 VanDerWaalsContact O-N 3.08Å; I1200-R1202 VanDerWaalsContact C-N 3.31Å; I1200-R1202 PolarHBondContact O-N 3.48Å; R1202-S1204 PolarHBondContact O-N 3.2Å
1203	G	31.9	Very low	33.9	Very low	73 Å²	73	137.5 Å²	137.5	75%	0.753	71%	0.705	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.9	16.1	-179.1	0	0	0	0	0	116.7	A1199 I1200	A1199-G1203 PolarHBondContact O-N 2.88Å; I1200-G1203 PolarHBondContact O-N 2.9Å
1204	S	35	Very low	33.3	Very low	112 Å²	112	137.3 Å²	137.3	78%	0.783	71%	0.714	S	S	*	*	T	Hydrogen-bonded Turn	trans	-143.6	26.7	-174.5	73	0	0	0	0	115	R1202	R1202-S1204 PolarHBondContact O-N 3.2Å
1205	G	31.3	Very low	32.7	Very low	58 Å²	58	138.2 Å²	138.2	60%	0.598	72%	0.723	S	S	*	*	S	Bend	trans	-165.9	141.1	175.2	0	0	0	0	0	114.6
1206	L	28.4	Very low	32.1	Very low	174 Å²	174	139.9 Å²	139.9	91%	0.911	73%	0.731	S	S	*	*			trans	67.7	102.8	173.4	-53.8	173.1	0	0	0	116.2
1207	M	30.7	Very low	31.6	Very low	191 Å²	191	140.4 Å²	140.4	94%	0.941	74%	0.737	S	S	*	*			trans	-116.4	118.1	146.1	-71.7	-174.3	71.4	0	0	107.1
1208	E	34	Very low	31.2	Very low	181 Å²	181	143.1 Å²	143.1	85%	0.846	76%	0.758	S	S	*	*			trans	-158.4	143.9	165.6	-127.7	163.4	-152.8	0	0	108
1209	E	30.6	Very low	30.7	Very low	181 Å²	181	145.8 Å²	145.8	85%	0.846	77%	0.773	S	S	*	*			trans	55.6	97.9	172.4	-55.7	-169.5	150.8	0	0	118.5
1210	D	26.7	Very low	30.2	Very low	167 Å²	167	150.2 Å²	150.2	89%	0.893	78%	0.784	S	S	*	*				-176.4	93.7	118.6	-97.8	-14.1	0	0	0	110.4
1211	E	30.1	Very low	29.8	Very low	187 Å²	187	149.8 Å²	149.8	87%	0.874	79%	0.793	S	S	*	*			trans	-88.6	141.1	157.5	-64.4	-172.3	124.3	0	0	108.1
1212	E	28.9	Very low	29.4	Very low	175 Å²	175	145.9 Å²	145.9	82%	0.818	79%	0.794	S	S	*	*				161.9	177.8	99.9	-103.3	-156.6	-176.6	0	0	108.2
1213	P	36.5	Very low	29	Very low	96 Å²	96	145.8 Å²	145.8	62%	0.623	80%	0.803	S	S	*	*			cis	-137.2	149.8	-40.4	35.5	-20.1	0	0	0	112.9
1214	I	24.1	Very low	28.8	Very low	162 Å²	162	149.7 Å²	149.7	83%	0.831	81%	0.806	S	S	*	*			trans	-141.9	99.5	147.5	-56.9	-176.1	0	0	0	110.1
1215	V	25.3	Very low	28.4	Very low	111 Å²	111	156 Å²	156	67%	0.673	81%	0.813	S	S	*	*			trans	36.8	106.3	137.1	-162	0	0	0	0	115.9
1216	E	27.9	Very low	28.2	Very low	170 Å²	170	161.2 Å²	161.2	79%	0.794	83%	0.826	S	S	*	*				53.9	136.1	88.4	-61.7	178.8	138.7	0	0	113.5
1217	D	26.5	Very low	28.1	Very low	145 Å²	145	161.7 Å²	161.7	78%	0.775	82%	0.824	S	S	*	*			cis	-138.2	150.1	25.8	-101.8	-50.7	0	0	0	113.9
1218	V	27.7	Very low	27.8	Very low	139 Å²	139	159.9 Å²	159.9	84%	0.842	82%	0.818	S	S	*	*				150.6	102.9	125.1	170.1	0	0	0	0	108.6
1219	M	26.4	Very low	27.5	Very low	164 Å²	164	159.4 Å²	159.4	81%	0.808	82%	0.82	S	S	*	*			trans	-111.4	155.8	171.3	-71.5	-141.1	-64.9	0	0	111.9
1220	M	27.2	Very low	27.2	Very low	156 Å²	156	157.7 Å²	157.7	77%	0.768	82%	0.816	S	S	*	*				142	154.9	125	-75.2	-53.1	-70.7	0	0	114.9
1221	S	27.8	Very low	27.2	Very low	113 Å²	113	158.4 Å²	158.4	79%	0.79	81%	0.814	S	S	*	*			trans	73.3	129.4	174.7	71.7	0	0	0	0	116
1222	S	26.8	Very low	27.1	Very low	110 Å²	110	153.4 Å²	153.4	77%	0.769	81%	0.813	S	S	*	*			cis	-152.6	132.3	-4	51.5	0	0	0	0	112.5
1223	E	25.4	Very low	26.9	Very low	196 Å²	196	153.7 Å²	153.7	92%	0.916	82%	0.816	S	S	*	*			trans	-72.8	127.3	151.3	-65.7	179.2	109.4	0	0	108.9
1224	D	27.6	Very low	26.4	Very low	155 Å²	155	156.6 Å²	156.6	83%	0.829	83%	0.826	S	S	*	*			trans	-173.4	96.1	146.7	-122.6	-18.4	0	0	0	110.4
1225	R	27	Very low	26.4	Very low	244 Å²	244	157 Å²	157	92%	0.921	82%	0.823	S	S	*	*			trans	167.8	112.3	144.6	-95.5	162.8	178.9	-152.8	-6.1	113
1226	L	26.2	Very low	26.4	Very low	169 Å²	169	158.2 Å²	158.2	89%	0.885	83%	0.825	S	S	*	*			trans	-96.7	178.1	151.3	-83.2	164.1	0	0	0	109.5
1227	E	26.1	Very low	26.5	Very low	184 Å²	184	156.4 Å²	156.4	86%	0.86	83%	0.826	S	S	*	*			trans	84.9	129.5	172.4	-54.2	-172.4	163.1	0	0	117.4
1228	D	25.4	Very low	26.4	Very low	153 Å²	153	156.9 Å²	156.9	82%	0.818	83%	0.825	S	S	*	*			trans	48.9	110.6	166.2	-63.3	-6	0	0	0	121.2
1229	I	27.9	Very low	26.4	Very low	171 Å²	171	158.1 Å²	158.1	88%	0.877	82%	0.822	S	S	*	*				-154.3	142.1	101.4	-98.2	155.3	0	0	0	110.2
1230	N	23.2	Very low	26.6	Very low	145 Å²	145	156.6 Å²	156.6	78%	0.775	82%	0.816	S	S	*	*			trans	-114.2	175.6	177.1	-175.4	24.9	0	0	0	109.6
1231	E	27.6	Very low	26.5	Very low	181 Å²	181	156.8 Å²	156.8	85%	0.846	82%	0.82	S	S	*	*			trans	78	130.5	177.2	-48.7	-176.2	169.2	0	0	115.2
1232	G	26.8	Very low	26.7	Very low	82 Å²	82	155.7 Å²	155.7	85%	0.845	81%	0.805	S	S	*	*			trans	137.3	32.3	173.2	0	0	0	0	0	118.6
1233	M	26.3	Very low	26.6	Very low	181 Å²	181	156.3 Å²	156.3	89%	0.892	81%	0.806	S	S	*	*			trans	-113.9	118	170.2	-76.6	-167	174.7	0	0	112.3	F1235	M1233-F1235 PolarHBondContact O-N 2.93Å
1234	D	26.2	Very low	26.5	Very low	157 Å²	157	151.9 Å²	151.9	84%	0.84	80%	0.803	S	S	*	*			trans	-71.7	121.7	173.4	-91.8	-50.1	0	0	0	111.7	N1236	D1234-N1236 PolarHBondContact O-N 3.4Å
1235	F	24	Very low	26.5	Very low	172 Å²	172	147.6 Å²	147.6	75%	0.754	79%	0.785	S	S	*	*			trans	-78.1	82.8	175.6	-93.3	-97.1	0	0	0	111.7	M1233 M1238	M1233-F1235 PolarHBondContact O-N 2.93Å; F1235-M1238 HydrophobicContact CD1-SD 4.36Å; F1235-M1238 HydrophobicContact CE1-SD 3.81Å
1236	N	25.2	Very low	26.6	Very low	136 Å²	136	145.2 Å²	145.2	73%	0.727	78%	0.781	S	S	*	*			trans	-130.7	124.8	163.3	-81.5	-64.1	0	0	0	111.1	D1234	D1234-N1236 PolarHBondContact O-N 3.4Å
1237	T	29.6	Very low	26.9	Very low	131 Å²	131	141.4 Å²	141.4	80%	0.804	76%	0.762	S	S	*	*			trans	63.9	66.3	172.7	-37.2	0	0	0	0	115.6	E1239	T1237-E1239 PolarHBondContact O-N 2.96Å; T1237-E1239 VanDerWaalsContact O-N 3.16Å
1238	M	25.1	Very low	26.9	Very low	156 Å²	156	142.6 Å²	142.6	77%	0.768	76%	0.759	S	S	*	*			trans	-70.5	103	157.1	-70.3	-172.4	79.9	0	0	109.9	F1235	F1235-M1238 HydrophobicContact CD1-SD 4.36Å; F1235-M1238 HydrophobicContact CE1-SD 3.81Å
1239	E	26.4	Very low	27.2	Very low	164 Å²	164	141.5 Å²	141.5	77%	0.766	74%	0.743	S	S	*	*			trans	-65.1	150	148.9	-64.1	-156.3	136.3	0	0	108.9	T1237 D1241	T1237-E1239 PolarHBondContact O-N 2.96Å; T1237-E1239 VanDerWaalsContact O-N 3.16Å; E1239-D1241 PolarHBondContact O-N 3.44Å; E1239-D1241 VanDerWaalsContact O-N 3.16Å
1240	I	30.9	Very low	27.4	Very low	132 Å²	132	136.9 Å²	136.9	68%	0.677	72%	0.718	S	S	*	*			trans	-88.2	88.6	-175.7	-58.1	174.2	0	0	0	108.3	L1242	I1240-L1242 HydrophobicContact CG2-CG 4.42Å; I1240-L1242 PolarHBondContact O-N 2.88Å; I1240-L1242 VanDerWaalsContact O-N 3.09Å
1241	D	25.2	Very low	27.9	Very low	160 Å²	160	135 Å²	135	86%	0.856	70%	0.7	S	S	*	*			trans	-63	109.2	170.6	-93.6	-33.9	0	0	0	110.4	E1239	E1239-D1241 PolarHBondContact O-N 3.44Å; E1239-D1241 VanDerWaalsContact O-N 3.16Å
1242	L	31.5	Very low	28	Very low	90 Å²	90	132.8 Å²	132.8	47%	0.471	69%	0.694	S	S	.	*			trans	-103	151.5	159.8	-69.6	172.6	0	0	0	107.6	I1240 A1244	I1240-L1242 HydrophobicContact CG2-CG 4.42Å; I1240-L1242 PolarHBondContact O-N 2.88Å; I1240-L1242 VanDerWaalsContact O-N 3.09Å; L1242-A1244 PolarHBondContact O-N 3.32Å
1243	P	24.7	Very low	28.2	Very low	123 Å²	123	132.7 Å²	132.7	80%	0.799	67%	0.671	S	S	*	*			trans	-52.9	136.3	179	22.2	-34.1	0	0	0	111	S1245	P1243-S1245 PolarHBondContact O-N 3.04Å
1244	A	23.2	Very low	28.6	Very low	103 Å²	103	126.3 Å²	126.3	85%	0.851	64%	0.641	S	S	*	*			trans	-62.4	98.8	-170.3	0	0	0	0	0	112.1	L1242	L1242-A1244 PolarHBondContact O-N 3.32Å
1245	S	29	Very low	29	Very low	65 Å²	65	125.4 Å²	125.4	46%	0.455	63%	0.629	S	S	.	*			trans	-58.7	136.2	171.9	179.1	0	0	0	0	110.4	P1243 N1247 R1248	P1243-S1245 PolarHBondContact O-N 3.04Å; S1245-N1247 PolarHBondContact O-N 3.43Å; S1245-N1247 PolarHBondContact OG-N 2.91Å; S1245-R1248 PolarHBondContact O-N 2.97Å
1246	K	29.1	Very low	29.9	Very low	194 Å²	194	120.1 Å²	120.1	84%	0.843	61%	0.612	S	S	*	*	G	3₁₀ helix	trans	-58.9	-33	174.8	-67.8	-179.4	177.6	178.6	0	111.1	R1248	K1246-R1248 PolarHBondContact O-N 2.99Å; K1246-R1248 VanDerWaalsContact O-N 3.14Å
1247	N	31.7	Very low	30.6	Very low	89 Å²	89	118.5 Å²	118.5	48%	0.476	60%	0.603	S	S	.	*	G	3₁₀ helix	trans	-80.6	15.3	-172.8	-56	70.4	0	0	0	114.5	S1245 R1249 E1250	S1245-N1247 PolarHBondContact O-N 3.43Å; S1245-N1247 PolarHBondContact OG-N 2.91Å; N1247-R1249 PolarHBondContact O-N 3.23Å; N1247-E1250 VanDerWaalsContact CA-OE1 3.27Å; N1247-E1250 WeakPolarHBondContact CA-OE1 3.32Å; N1247-E1250 VanDerWaalsContact CB-OE2 3.24Å; N1247-E1250 WeakPolarHBondContact CB-OE2 3.4Å; N1247-E1250 PolarHBondContact ND2-OE2 2.93Å
1248	R	26.9	Very low	31.3	Very low	210 Å²	210	113.3 Å²	113.3	79%	0.792	57%	0.569	S	S	*	*	G	3₁₀ helix	trans	-68.4	-8	172.9	-161.4	177.6	-178.4	176.8	3.3	112.3	S1245 K1246	S1245-R1248 PolarHBondContact O-N 2.97Å; K1246-R1248 PolarHBondContact O-N 2.99Å; K1246-R1248 VanDerWaalsContact O-N 3.14Å
1249	R	30.6	Very low	32.3	Very low	130 Å²	130	107.1 Å²	107.1	49%	0.491	54%	0.538	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.2	-56.7	174.8	-74.6	-177.1	168.9	173	-2.1	111.8	N1247 R1251 N1252	N1247-R1249 PolarHBondContact O-N 3.23Å; R1249-R1251 PolarHBondContact O-N 3.17Å; R1249-R1251 VanDerWaalsContact O-N 3.16Å; R1249-N1252 PolarHBondContact O-N 2.87Å
1250	E	33.1	Very low	32.8	Very low	73 Å²	73	102.5 Å²	102.5	34%	0.341	52%	0.519	S	S	.	.	G	3₁₀ helix	trans	-56.6	-35.3	-178.6	-55.6	103.1	-98.8	0	0	113	N1247 N1252 E1253	N1247-E1250 VanDerWaalsContact CA-OE1 3.27Å; N1247-E1250 WeakPolarHBondContact CA-OE1 3.32Å; N1247-E1250 VanDerWaalsContact CB-OE2 3.24Å; N1247-E1250 WeakPolarHBondContact CB-OE2 3.4Å; N1247-E1250 PolarHBondContact ND2-OE2 2.93Å; E1250-N1252 PolarHBondContact O-N 3.24Å; E1250-E1253 PolarHBondContact O-N 3.41Å
1251	R	33.2	Very low	32.8	Very low	106 Å²	106	100.2 Å²	100.2	40%	0.4	51%	0.512	S	S	.	.	G	3₁₀ helix	trans	-64.6	-7.4	-172.1	-136.7	-179.9	-157.1	-176.1	8.1	115.8	Y890 N891 R1249	Y890-R1251 PolarHBondContact O-NH2 3.21Å; N891-R1251 PolarHBondContact O-NH2 2.9Å; R1249-R1251 PolarHBondContact O-N 3.17Å; R1249-R1251 VanDerWaalsContact O-N 3.16Å
1252	N	29.3	Very low	33	Very low	135 Å²	135	96 Å²	96	72%	0.722	50%	0.496	S	S	*	.	G	3₁₀ helix	trans	-93.6	-17.6	173.7	-77.1	-11.4	0	0	0	113.5	R1249 E1250	R1249-N1252 PolarHBondContact O-N 2.87Å; E1250-N1252 PolarHBondContact O-N 3.24Å
1253	E	32.2	Very low	33	Very low	79 Å²	79	92.3 Å²	92.3	37%	0.369	48%	0.477	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.1	-27.4	179.5	-64.3	173.3	140.9	0	0	110.7	A418 E1250 K1255	A418-E1253 HydrophobicContact CB-CG 4.5Å; A418-E1253 WeakPolarHBondContact CB-OE1 3.38Å; E1250-E1253 PolarHBondContact O-N 3.41Å; E1253-K1255 PolarHBondContact O-N 3.02Å; E1253-K1255 VanDerWaalsContact O-N 3.09Å
1254	L	33	Very low	33.2	Very low	48 Å²	48	89.3 Å²	89.3	25%	0.251	45%	0.454	S	S	.	.			trans	-85.2	79.1	-177.7	-49.8	-164.3	0	0	0	112.6	H856	H856-L1254 VanDerWaalsContact NE2-CD2 3.29Å; H856-L1254 WeakPolarHBondContact NE2-CD2 3.18Å
1255	K	34.9	Very low	33.5	Very low	138 Å²	138	89.4 Å²	89.4	60%	0.6	44%	0.438	S	S	*	.			trans	-126	117.7	167.1	-112.2	-176.2	174.9	-72.6	0	111.1	E1253 D1257	E1253-K1255 PolarHBondContact O-N 3.02Å; E1253-K1255 VanDerWaalsContact O-N 3.09Å; K1255-D1257 IonicContact NZ-OD1 3.5Å; K1255-D1257 PolarHBondContact NZ-OD1 3.41Å; K1255-D1257 IonicContact NZ-OD2 3.27Å; K1255-D1257 PolarHBondContact NZ-OD2 3.44Å
1256	P	43.3	Very low	33.3	Very low	61 Å²	61	90.3 Å²	90.3	40%	0.396	44%	0.437	S	S	.	.				-108.5	150	115.6	-12.5	29.2	0	0	0	111.5	Y1258	P1256-Y1258 HydrophobicContact CB-CD1 4.47Å; P1256-Y1258 HydrophobicContact CG-CE1 4.2Å; P1256-Y1258 HydrophobicContact CG-CE2 4.44Å; P1256-Y1258 WeakPolarHBondContact O-CD2 3.26Å; P1256-Y1258 PolarHBondContact O-N 2.85Å
1257	D	40.9	Very low	33.2	Very low	101 Å²	101	84.6 Å²	84.6	54%	0.54	42%	0.416	S	S	.	.			trans	-81.1	73.7	165.1	-80.8	-53.4	0	0	0	109.6	K1255 F1259 D1260 S1263	K1255-D1257 IonicContact NZ-OD1 3.5Å; K1255-D1257 PolarHBondContact NZ-OD1 3.41Å; K1255-D1257 IonicContact NZ-OD2 3.27Å; K1255-D1257 PolarHBondContact NZ-OD2 3.44Å; D1257-F1259 PolarHBondContact O-N 3.23Å; D1257-D1260 HydrophobicContact CB-CB 4.48Å; D1257-D1260 PolarHBondContact O-N 3.33Å; D1257-S1263 PolarHBondContact O-OG 3.36Å
1258	Y	44.1	Very low	33	Very low	23 Å²	23	84.6 Å²	84.6	9%	0.09	42%	0.423	C	S	.	.	T	Hydrogen-bonded Turn	trans	-47.1	-7.3	-176	-69.4	-75.8	0	0	0	117.6	N860 A863 I896 P1256	N860-Y1258 VanDerWaalsContact OD1-CE1 3.27Å; N860-Y1258 WeakPolarHBondContact OD1-CE1 3.49Å; N860-Y1258 PolarHBondContact OD1-OH 3.35Å; A863-Y1258 HydrophobicContact CB-CD1 3.76Å; A863-Y1258 HydrophobicContact CB-CE1 4.19Å; A863-Y1258 HydrophobicContact CB-CG 4.13Å; I896-Y1258 HydrophobicContact CD1-CE2 4.25Å; I896-Y1258 HydrophobicContact CG1-CD2 4.4Å; P1256-Y1258 HydrophobicContact CB-CD1 4.47Å; P1256-Y1258 HydrophobicContact CG-CE1 4.2Å; P1256-Y1258 HydrophobicContact CG-CE2 4.44Å; P1256-Y1258 WeakPolarHBondContact O-CD2 3.26Å; P1256-Y1258 PolarHBondContact O-N 2.85Å
1259	F	44.6	Very low	32.9	Very low	25 Å²	25	75.9 Å²	75.9	11%	0.11	39%	0.393	C	S	.	.	T	Hydrogen-bonded Turn	trans	-134.1	18.7	-173.3	-56.4	-69	0	0	0	113.6	C866 I870 I896 E899 K903 D1257	C866-F1259 HydrophobicContact CB-CE1 3.97Å; C866-F1259 HydrophobicContact CB-CZ 3.95Å; I870-F1259 HydrophobicContact CD1-CD1 3.46Å; I870-F1259 VanDerWaalsContact CD1-CD1 3.46Å; I870-F1259 HydrophobicContact CD1-CE1 3.4Å; I870-F1259 VanDerWaalsContact CD1-CE1 3.4Å; I870-F1259 HydrophobicContact CD1-CG 4.33Å; I870-F1259 HydrophobicContact CD1-CZ 4.22Å; I896-F1259 HydrophobicContact CG2-CE2 4.15Å; I896-F1259 HydrophobicContact CG2-CZ 3.89Å; E899-F1259 HydrophobicContact CB-CD2 3.96Å; E899-F1259 HydrophobicContact CB-CE2 4.13Å; E899-F1259 HydrophobicContact CG-CB 4.4Å; E899-F1259 HydrophobicContact CG-CD2 3.77Å; E899-F1259 HydrophobicContact CG-CE2 4.42Å; E899-F1259 HydrophobicContact CG-CG 4.33Å; K903-F1259 PolarHBondContact NZ-O 3.42Å; D1257-F1259 PolarHBondContact O-N 3.23Å
1260	D	38.2	Very low	32.8	Very low	67 Å²	67	71.2 Å²	71.2	36%	0.358	38%	0.378	S	S	.	.			trans	-72.6	127.7	167.9	-171.9	-12.4	0	0	0	109.3	D1257 S1262 S1263	D1257-D1260 HydrophobicContact CB-CB 4.48Å; D1257-D1260 PolarHBondContact O-N 3.33Å; D1260-S1262 VanDerWaalsContact CG-OG 3.29Å; D1260-S1262 PolarHBondContact O-N 2.69Å; D1260-S1262 VanDerWaalsContact O-N 3.12Å; D1260-S1262 VanDerWaalsContact OD1-CB 3.28Å; D1260-S1262 WeakPolarHBondContact OD1-CB 3.41Å; D1260-S1262 PolarHBondContact OD1-N 2.77Å; D1260-S1262 PolarHBondContact OD1-OG 3.06Å; D1260-S1262 WeakPolarHBondContact OD2-CB 3.46Å; D1260-S1262 PolarHBondContact OD2-OG 3.5Å; D1260-S1263 PolarHBondContact O-N 3.21Å; D1260-S1263 PolarHBondContact O-OG 2.72Å; D1260-S1263 VanDerWaalsContact O-OG 3.1Å
1261	P	31.5	Very low	32.7	Very low	84 Å²	84	73.3 Å²	73.3	55%	0.545	39%	0.392	S	S	.	.	G	3₁₀ helix	trans	-56	-22.4	169.3	-25.9	36.1	0	0	0	113.9
1262	S	28.3	Very low	32.6	Very low	73 Å²	73	68.6 Å²	68.6	51%	0.51	37%	0.374	S	S	.	.	G	3₁₀ helix	trans	-70.4	-38.5	171.1	-36.5	0	0	0	0	111.7	D1260 I1264 M1265	D1260-S1262 VanDerWaalsContact CG-OG 3.29Å; D1260-S1262 PolarHBondContact O-N 2.69Å; D1260-S1262 VanDerWaalsContact O-N 3.12Å; D1260-S1262 VanDerWaalsContact OD1-CB 3.28Å; D1260-S1262 WeakPolarHBondContact OD1-CB 3.41Å; D1260-S1262 PolarHBondContact OD1-N 2.77Å; D1260-S1262 PolarHBondContact OD1-OG 3.06Å; D1260-S1262 WeakPolarHBondContact OD2-CB 3.46Å; D1260-S1262 PolarHBondContact OD2-OG 3.5Å; S1262-I1264 PolarHBondContact O-N 3.46Å; S1262-M1265 CarbonylContact O-C 3.59Å; S1262-M1265 PolarHBondContact O-N 3.44Å
1263	S	30.8	Very low	32.3	Very low	11 Å²	11	63.4 Å²	63.4	8%	0.077	35%	0.349	C	S	.	.	G	3₁₀ helix	trans	-81.9	12.9	-178.5	81	0	0	0	0	114.2	D1257 D1260 V1269	D1257-S1263 PolarHBondContact O-OG 3.36Å; D1260-S1263 PolarHBondContact O-N 3.21Å; D1260-S1263 PolarHBondContact O-OG 2.72Å; D1260-S1263 VanDerWaalsContact O-OG 3.1Å; S1263-V1269 WeakPolarHBondContact O-CB 3.44Å
1264	I	30.7	Very low	32	Very low	60 Å²	60	62 Å²	62	31%	0.308	34%	0.343	S	S	.	.	G	3₁₀ helix	trans	-87.4	-3.9	162.1	-68.8	174.7	0	0	0	110.1	Y871 S1262	Y871-I1264 HydrophobicContact CE1-CD1 4.38Å; Y871-I1264 HydrophobicContact CE2-CD1 3.59Å; Y871-I1264 VanDerWaalsContact CZ-CD1 3.48Å; Y871-I1264 VanDerWaalsContact OH-CD1 3.23Å; Y871-I1264 WeakPolarHBondContact OH-CD1 3.09Å; S1262-I1264 PolarHBondContact O-N 3.46Å
1265	M	28.6	Very low	31.9	Very low	106 Å²	106	69.6 Å²	69.6	52%	0.522	37%	0.374	S	S	.	.	S	Bend	trans	-136.6	38.5	178.8	-58.3	-171.4	-42.7	0	0	109.8	S1262 F1275	S1262-M1265 CarbonylContact O-C 3.59Å; S1262-M1265 PolarHBondContact O-N 3.44Å; M1265-F1275 HydrophobicContact CB-CD2 3.48Å; M1265-F1275 VanDerWaalsContact CB-CD2 3.48Å; M1265-F1275 HydrophobicContact CB-CE2 4.08Å; M1265-F1275 HydrophobicContact CB-CG 4.24Å; M1265-F1275 HydrophobicContact CG-CD2 3.59Å; M1265-F1275 HydrophobicContact CG-CE2 3.62Å; M1265-F1275 HydrophobicContact SD-CD2 3.81Å; M1265-F1275 HydrophobicContact SD-CE2 3.45Å; M1265-F1275 WeakPolarHBondContact SD-CE2 3.48Å; M1265-F1275 HydrophobicContact SD-CZ 4Å
1266	D	25.1	Very low	31.7	Very low	83 Å²	83	66.2 Å²	66.2	44%	0.444	36%	0.363	S	S	.	.	S	Bend	trans	-131.9	118.5	-178.9	-173.3	-30.9	0	0	0	107.1	S1268 V1269	D1266-S1268 PolarHBondContact O-N 2.74Å; D1266-S1268 PolarHBondContact OD1-OG 3.47Å; D1266-S1268 VanDerWaalsContact OD1-OG 3.12Å; D1266-V1269 PolarHBondContact O-N 3.13Å; D1266-V1269 VanDerWaalsContact O-N 3.11Å
1267	D	27.4	Very low	31.1	Very low	74 Å²	74	66.5 Å²	66.5	40%	0.396	36%	0.361	S	S	.	.	G	3₁₀ helix	trans	-54.4	-33.1	-161.4	-59	-47.2	0	0	0	113.2	V1269 L1270 N1271 S1273 M1274	D1267-V1269 PolarHBondContact O-N 3.3Å; D1267-L1270 PolarHBondContact O-N 3.37Å; D1267-N1271 PolarHBondContact O-N 3.32Å; D1267-S1273 WeakPolarHBondContact OD1-CA 3.38Å; D1267-M1274 PolarHBondContact OD1-N 3.15Å
1268	S	25.9	Very low	30.6	Very low	90 Å²	90	64.6 Å²	64.6	63%	0.629	35%	0.351	S	S	*	.	G	3₁₀ helix	trans	-62.1	-11.8	-178.1	61.7	0	0	0	0	115.5	D1266	D1266-S1268 PolarHBondContact O-N 2.74Å; D1266-S1268 PolarHBondContact OD1-OG 3.47Å; D1266-S1268 VanDerWaalsContact OD1-OG 3.12Å
1269	V	25.8	Very low	29.8	Very low	26 Å²	26	67 Å²	67	16%	0.158	37%	0.367	C	S	.	.	G	3₁₀ helix	trans	-115.2	-6.5	-173.7	178.8	0	0	0	0	113.4	K867 S1263 D1266 D1267	K867-V1269 PolarHBondContact NZ-O 3.3Å; S1263-V1269 WeakPolarHBondContact O-CB 3.44Å; D1266-V1269 PolarHBondContact O-N 3.13Å; D1266-V1269 VanDerWaalsContact O-N 3.11Å; D1267-V1269 PolarHBondContact O-N 3.3Å
1270	L	28.8	Very low	28.9	Very low	32 Å²	32	69.6 Å²	69.6	17%	0.168	38%	0.383	C	S	.	.	T	Hydrogen-bonded Turn	trans	-118.9	-12.1	-178.5	-71.5	177.6	0	0	0	114.8	D1267 V1272	D1267-L1270 PolarHBondContact O-N 3.37Å; L1270-V1272 HydrophobicContact CB-CB 4.16Å; L1270-V1272 WeakPolarHBondContact O-CG2 3.36Å; L1270-V1272 PolarHBondContact O-N 3.05Å; L1270-V1272 VanDerWaalsContact O-N 3.08Å
1271	N	30.2	Very low	28.3	Very low	118 Å²	118	69.8 Å²	69.8	63%	0.631	38%	0.384	S	S	*	.	S	Bend	trans	54.1	18.3	-165.4	-87	28.4	0	0	0	113.7	N696 D1267	N696-N1271 PolarHBondContact ND2-O 2.8Å; N696-N1271 PolarHBondContact OD1-O 3.13Å; D1267-N1271 PolarHBondContact O-N 3.32Å
1272	V	30.3	Very low	28	Very low	6 Å²	6	68.8 Å²	68.8	4%	0.036	37%	0.373	C	S	.	.	S	Bend	trans	-128.4	120.1	-176.4	174.2	0	0	0	0	107.8	N696 Y736 L739 L1270 M1274	N696-V1272 VanDerWaalsContact OD1-CA 3.31Å; N696-V1272 WeakPolarHBondContact OD1-CA 3.25Å; Y736-V1272 HydrophobicContact CD1-CG2 4.08Å; Y736-V1272 HydrophobicContact CE1-CG2 3.86Å; L739-V1272 HydrophobicContact CD1-CB 4.49Å; L739-V1272 HydrophobicContact CD1-CG1 4.13Å; L739-V1272 HydrophobicContact CD1-CG2 3.73Å; L1270-V1272 HydrophobicContact CB-CB 4.16Å; L1270-V1272 WeakPolarHBondContact O-CG2 3.36Å; L1270-V1272 PolarHBondContact O-N 3.05Å; L1270-V1272 VanDerWaalsContact O-N 3.08Å; V1272-M1274 VanDerWaalsContact C-N 3.29Å; V1272-M1274 HydrophobicContact CG1-CB 3.96Å; V1272-M1274 HydrophobicContact CG1-CE 3.7Å; V1272-M1274 HydrophobicContact CG1-CG 3.86Å; V1272-M1274 PolarHBondContact O-N 3.24Å
1273	S	24.5	Very low	28	Very low	26 Å²	26	68.5 Å²	68.5	18%	0.182	36%	0.362	C	S	.	.			trans	-76.8	84.1	171.6	-173.8	0	0	0	0	109.8	N696 D1267	N696-S1273 PolarHBondContact OD1-N 3.44Å; N696-S1273 VanDerWaalsContact OD1-N 3.15Å; D1267-S1273 WeakPolarHBondContact OD1-CA 3.38Å
1274	M	24.9	Very low	27.8	Very low	51 Å²	51	73.3 Å²	73.3	25%	0.251	39%	0.386	S	S	.	.			trans	-146.5	77.7	172.3	-77.4	-156.5	-69.5	0	0	110.5	L739 W740 A743 D1267 V1272	L739-M1274 HydrophobicContact CB-CE 3.78Å; L739-M1274 HydrophobicContact CD1-CE 4.18Å; W740-M1274 HydrophobicContact CE3-SD 4.43Å; W740-M1274 HydrophobicContact CH2-CG 4.27Å; W740-M1274 HydrophobicContact CH2-SD 4.37Å; W740-M1274 HydrophobicContact CZ2-CG 4.3Å; W740-M1274 HydrophobicContact CZ3-SD 4.33Å; A743-M1274 HydrophobicContact CB-SD 4.32Å; D1267-M1274 PolarHBondContact OD1-N 3.15Å; V1272-M1274 VanDerWaalsContact C-N 3.29Å; V1272-M1274 HydrophobicContact CG1-CB 3.96Å; V1272-M1274 HydrophobicContact CG1-CE 3.7Å; V1272-M1274 HydrophobicContact CG1-CG 3.86Å; V1272-M1274 PolarHBondContact O-N 3.24Å
1275	F	31.1	Very low	27.5	Very low	207 Å²	207	74.5 Å²	74.5	91%	0.908	39%	0.393	S	S	*	.				-151	0	118.6	-104.5	-67	0	0	0	114.1	M1265	M1265-F1275 HydrophobicContact CB-CD2 3.48Å; M1265-F1275 VanDerWaalsContact CB-CD2 3.48Å; M1265-F1275 HydrophobicContact CB-CE2 4.08Å; M1265-F1275 HydrophobicContact CB-CG 4.24Å; M1265-F1275 HydrophobicContact CG-CD2 3.59Å; M1265-F1275 HydrophobicContact CG-CE2 3.62Å; M1265-F1275 HydrophobicContact SD-CD2 3.81Å; M1265-F1275 HydrophobicContact SD-CE2 3.45Å; M1265-F1275 WeakPolarHBondContact SD-CE2 3.48Å; M1265-F1275 HydrophobicContact SD-CZ 4Å

Retrieved 1,275 of 1,275 residues in 742.5 ms (Link to these results)

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