A0A087YQH3_POEFO Loading...

FAST kinase domains 5

AlphaFold DB , UniProt , Accession A0A087YQH3, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 804 aa.

						>A0A087YQH3_POEFO|A0A087YQH3
MATRVLCRRVCSLPGWRRSLTQGQHIHTKTREEISDQEENKNVSDVSSQSGYKLYYNPSSYHVARTSANSPCQMDSSEEEQFFSASFWQQSNHYSVSCSRHLSSSKNTLLDLALNKASETEVPSVSSYNRKPVTPDVKVDTRAFLKCRPEYASLSLDLTQRPQPVEWVELLPLLQKVSVLRGRMKPADVLQFLLELSKLHPDKMPLLQSDQRFVMLLRYSVEHLRLFSELQLLEVLQSFVWLEIPSSHTVLEVYEAELSRRANQLTLHQLLLAADLWRCIRRQVPQFLQRLFESVHLYLGQVGVPELVHLLYIIGEGRHCPKDLIYIIQPLIMRHLAQMHPEEVGVVCLGLFKAQTSLPEGAVSRIVDKAVSVVTEMGDFAMVNVLKYLRFSYLFHRTWLEAMEREVPQRAHRMGVQGLMHVTLTCSALHYRSDSILTSIAERVPSLVPHCRSKDSSKLLWAFATLGFLPAQNQSFYPSLTDALRQRKAEFQQYPEHLLTGLLGLAFVSQFPEDLVTLALSPEFVHLALRNSKLELKKDLFTLDAAVALELPQWKGPRLSGELREEVAEMLWTFAQSDVCLKPEVLEAESALQDLLGGDKFVCKRMIMPHTRSIDLEIHLDPKGQPIPVNLLCPKQNPTMVPSSQSWEKINSGVTITDNLLAQLIKGKNSTELPPATIAASSVGETPCQKLPPDEDGRVFDSVLDFTNDMIETLTKPSRNNRTHRDSVRQDIKNSVKIAVQISNRNHYCIQSQQLLGLHSMKRRHLKIAGYRVVELSHWEWFSMLRKSRAQKLAYLHCKIYDSL
					

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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	28.9	Very low	23.6	Very low	237 Å²	237	149.9 Å²	149.9	100%	1.167	78%	0.779	S	S	*	*				0	116.6	0	-62	156	-173.8	0	0	105.6
2	A	20.7	Very low	23.6	Very low	95 Å²	95	146.6 Å²	146.6	79%	0.785	78%	0.779	S	S	*	*				70	126	50.8	0	0	0	0	0	110.7
3	T	22.6	Very low	24	Very low	127 Å²	127	148.3 Å²	148.3	78%	0.779	79%	0.787	S	S	*	*			cis	-152.1	130.9	11.3	-37.8	0	0	0	0	108.5
4	R	21.9	Very low	24.6	Very low	212 Å²	212	147.1 Å²	147.1	80%	0.8	79%	0.791	S	S	*	*				33.2	134.8	97	-73.7	-178.4	177.4	178.3	1.2	115.2	L6	R4-L6 HydrophobicContact CG-CD1 4.39Å
5	V	22.6	Very low	24.5	Very low	125 Å²	125	141.3 Å²	141.3	76%	0.758	78%	0.781	S	S	*	*				-157.6	130.2	72.7	146.7	0	0	0	0	108.5
6	L	23.6	Very low	24.5	Very low	109 Å²	109	146.3 Å²	146.3	57%	0.571	78%	0.784	S	S	*	*				66.9	140.2	70.2	-73.1	162.9	0	0	0	113	R4	R4-L6 HydrophobicContact CG-CD1 4.39Å
7	C	22.4	Very low	24.5	Very low	103 Å²	103	146.2 Å²	146.2	70%	0.696	77%	0.77	S	S	*	*			cis	-141.8	157.7	15.1	-99.5	0	0	0	0	110
8	R	24.3	Very low	24.6	Very low	191 Å²	191	149.9 Å²	149.9	72%	0.721	77%	0.772	S	S	*	*			cis	103.6	119.8	24.2	-173.3	-163	-164.7	-175.2	6.5	113.1
9	R	25.1	Very low	24.6	Very low	223 Å²	223	146.6 Å²	146.6	84%	0.842	76%	0.764	S	S	*	*			trans	156.3	148.1	135.7	-90.2	-178.3	177.2	-177.3	-0	112.1
10	V	24.1	Very low	24.6	Very low	112 Å²	112	147.1 Å²	147.1	68%	0.679	77%	0.766	S	S	*	*			cis	-165.9	147.3	-18	101.2	0	0	0	0	111.5
11	C	23.2	Very low	24.7	Very low	115 Å²	115	145.3 Å²	145.3	78%	0.777	76%	0.762	S	S	*	*			trans	54.3	156.8	155.5	-65.8	0	0	0	0	121.7
12	S	23.2	Very low	24.5	Very low	110 Å²	110	143.2 Å²	143.2	77%	0.769	75%	0.749	S	S	*	*			cis	-163.7	151.6	-10.3	37.6	0	0	0	0	112.8
13	L	29.5	Very low	24.7	Very low	169 Å²	169	142.4 Å²	142.4	89%	0.885	75%	0.75	S	S	*	*			trans	-112.1	150.8	157.6	-78.3	165.9	0	0	0	108.2
14	P	31.8	Very low	24.9	Very low	131 Å²	131	144.2 Å²	144.2	85%	0.851	75%	0.75	S	S	*	*				-144.4	-178.5	82.1	37.3	-18.6	0	0	0	113.4
15	G	23.8	Very low	25.1	Very low	61 Å²	61	141.5 Å²	141.5	63%	0.629	75%	0.746	S	S	*	*			cis	-162.7	160.9	0.1	0	0	0	0	0	110.1
16	W	23.8	Very low	25.2	Very low	220 Å²	220	142.7 Å²	142.7	83%	0.833	75%	0.746	S	S	*	*				53.8	133.2	95.6	-79	16.9	0	0	0	115.3
17	R	24.8	Very low	25.5	Very low	146 Å²	146	145.7 Å²	145.7	55%	0.551	76%	0.757	S	S	*	*			cis	-169.7	154.4	9	-120.4	177	-158.9	-108.3	6.4	111
18	R	26.8	Very low	25.5	Very low	212 Å²	212	147.2 Å²	147.2	80%	0.8	76%	0.763	S	S	*	*			trans	65	159.2	153.1	-71.5	173.9	171.5	163.1	-6.9	117.8
19	S	24.3	Very low	25.8	Very low	88 Å²	88	147 Å²	147	62%	0.615	77%	0.768	S	S	*	*			cis	-174.6	156	-27	54	0	0	0	0	111.9
20	L	25.5	Very low	25.9	Very low	155 Å²	155	141.5 Å²	141.5	81%	0.812	76%	0.759	S	S	*	*			trans	80.3	149.3	153.9	-75.2	157.1	0	0	0	121.8
21	T	25.9	Very low	26.2	Very low	111 Å²	111	144.9 Å²	144.9	68%	0.681	76%	0.76	S	S	*	*			trans	63.2	100.5	154.6	44.4	0	0	0	0	122.4
22	Q	25.7	Very low	26.4	Very low	192 Å²	192	144.9 Å²	144.9	90%	0.897	75%	0.748	S	S	*	*				57	116.3	102.3	-168.7	178.2	14.3	0	0	119.4
23	G	23.8	Very low	26.6	Very low	79 Å²	79	146.4 Å²	146.4	81%	0.814	74%	0.743	S	S	*	*			trans	174.2	120.9	166.8	0	0	0	0	0	115
24	Q	26.4	Very low	26.7	Very low	165 Å²	165	145.4 Å²	145.4	77%	0.771	74%	0.737	S	S	*	*			trans	-74.5	169.3	-175.3	-53.9	158.9	-72.5	0	0	115.2
25	H	26.5	Very low	26.5	Very low	155 Å²	155	143.4 Å²	143.4	72%	0.718	73%	0.726	S	S	*	*			trans	70.6	160.4	147.4	-69.4	-46.7	0	0	0	117.6
26	I	25.4	Very low	26.6	Very low	149 Å²	149	146.8 Å²	146.8	76%	0.764	73%	0.73	S	S	*	*			cis	-145.6	168.5	2.9	-137	159.7	0	0	0	112.4
27	H	28.3	Very low	26.8	Very low	173 Å²	173	143.4 Å²	143.4	80%	0.801	72%	0.723	S	S	*	*			trans	-60.5	147.9	171.6	-100.6	-89.5	0	0	0	114
28	T	23.1	Very low	27	Very low	134 Å²	134	143.9 Å²	143.9	82%	0.822	73%	0.732	S	S	*	*			trans	-87.6	142.5	145.8	35	0	0	0	0	111.2
29	K	29.9	Very low	27	Very low	186 Å²	186	140.6 Å²	140.6	81%	0.809	73%	0.726	S	S	*	*			trans	-81.1	-171.6	170.9	-73.5	-174.8	167.2	-176.3	0	109
30	T	28.8	Very low	27.1	Very low	108 Å²	108	140.4 Å²	140.4	66%	0.663	72%	0.718	S	S	*	*			cis	-173.2	145.8	37.4	-23.4	0	0	0	0	114.6
31	R	28.8	Very low	27.1	Very low	184 Å²	184	140.5 Å²	140.5	69%	0.694	71%	0.712	S	S	*	*			trans	64.4	157	142.8	-90.2	164.3	147	-171.2	-25.6	119.2
32	E	27.3	Very low	27.1	Very low	115 Å²	115	141.6 Å²	141.6	54%	0.537	71%	0.713	S	S	.	*			cis	-143.6	134.7	-0.9	-140	124.5	-174.6	0	0	105.8
33	E	29.3	Very low	27.1	Very low	142 Å²	142	138.2 Å²	138.2	66%	0.664	71%	0.705	S	S	*	*				59.9	150.1	90.2	-56.8	175.2	-153.1	0	0	113.8
34	I	30.8	Very low	27.1	Very low	147 Å²	147	139.3 Å²	139.3	75%	0.754	70%	0.701	S	S	*	*			cis	-162.3	162.9	-0.7	-124.4	174.2	0	0	0	108
35	S	26.7	Very low	26.9	Very low	89 Å²	89	138.9 Å²	138.9	62%	0.622	70%	0.704	S	S	*	*			cis	-132.7	-111.4	-3.8	37.8	0	0	0	0	111.8
36	D	26.6	Very low	26.8	Very low	132 Å²	132	138 Å²	138	71%	0.706	71%	0.709	S	S	*	*			cis	-151.6	-172.6	0	-153.3	43.4	0	0	0	114.6
37	Q	28.4	Very low	26.9	Very low	149 Å²	149	135.7 Å²	135.7	70%	0.696	71%	0.706	S	S	*	*			trans	-96.2	168.3	-164.9	-55.8	-178.5	-88.8	0	0	113.8
38	E	27.8	Very low	26.7	Very low	156 Å²	156	133.2 Å²	133.2	73%	0.729	71%	0.708	S	S	*	*			cis	-161.7	-160.5	-20.7	-105.7	-179.2	-106	0	0	106.9
39	E	27.2	Very low	26.8	Very low	143 Å²	143	136.1 Å²	136.1	67%	0.668	71%	0.713	S	S	*	*			cis	-161.1	165.3	13.9	-150.6	-146.8	177.5	0	0	112.2
40	N	26.1	Very low	26.5	Very low	84 Å²	84	132.4 Å²	132.4	45%	0.449	71%	0.71	S	S	.	*			trans	55.6	123.5	147.1	-94.8	-27.2	0	0	0	126.6
41	K	26.9	Very low	26.3	Very low	157 Å²	157	130.8 Å²	130.8	68%	0.683	72%	0.715	S	S	*	*			trans	72.7	137	134.9	-68.8	160.8	-175.1	144	0	119.3
42	N	24.1	Very low	26	Very low	134 Å²	134	132.3 Å²	132.3	72%	0.717	72%	0.722	S	S	*	*			cis	-163.6	146.4	18.2	-121.6	-7.3	0	0	0	115.5
43	V	25.8	Very low	25.8	Very low	121 Å²	121	135.5 Å²	135.5	73%	0.733	73%	0.734	S	S	*	*			trans	79.8	138.2	139.8	173.5	0	0	0	0	123.8
44	S	24.5	Very low	25.5	Very low	102 Å²	102	136.9 Å²	136.9	71%	0.713	75%	0.745	S	S	*	*			trans	73.2	98.9	157.4	61.3	0	0	0	0	123.2
45	D	23	Very low	25.1	Very low	156 Å²	156	140.1 Å²	140.1	83%	0.834	75%	0.749	S	S	*	*				19.3	138.3	130	-63.7	-50.1	0	0	0	122.8
46	V	24.8	Very low	25	Very low	136 Å²	136	145.3 Å²	145.3	82%	0.824	76%	0.757	S	S	*	*				-164.3	145.3	101.8	141.8	0	0	0	0	112.7
47	S	26.3	Very low	24.9	Very low	102 Å²	102	144 Å²	144	71%	0.713	75%	0.75	S	S	*	*			trans	-15	134.6	-179.2	62.1	0	0	0	0	121.2
48	S	24	Very low	24.7	Very low	121 Å²	121	140.6 Å²	140.6	85%	0.846	74%	0.74	S	S	*	*			trans	-70.9	148.5	162.8	49.6	0	0	0	0	113.6
49	Q	26	Very low	24.6	Very low	195 Å²	195	137.4 Å²	137.4	91%	0.911	74%	0.736	S	S	*	*			trans	-110.1	130.4	163	-76.6	-167.4	-9.3	0	0	110.8
50	S	24	Very low	24.5	Very low	108 Å²	108	135.2 Å²	135.2	76%	0.755	74%	0.736	S	S	*	*			trans	-77.8	130.8	178.8	-173.7	0	0	0	0	111.7	Y52	S50-Y52 PolarHBondContact O-N 3.29Å; S50-Y52 VanDerWaalsContact O-N 3.15Å
51	G	24.2	Very low	24.6	Very low	74 Å²	74	139.2 Å²	139.2	76%	0.763	75%	0.746	S	S	*	*			trans	-75.8	98.3	-177.6	0	0	0	0	0	113.4	K53	G51-K53 PolarHBondContact O-N 3.22Å; G51-K53 VanDerWaalsContact O-N 3.1Å
52	Y	22.7	Very low	24.6	Very low	216 Å²	216	140.1 Å²	140.1	85%	0.847	75%	0.752	S	S	*	*			trans	-69	102.5	173.6	-94.3	-92.1	0	0	0	112.3	S50 L54	S50-Y52 PolarHBondContact O-N 3.29Å; S50-Y52 VanDerWaalsContact O-N 3.15Å; Y52-L54 PolarHBondContact O-N 3.11Å
53	K	22.2	Very low	24.6	Very low	182 Å²	182	140.8 Å²	140.8	79%	0.791	76%	0.761	S	S	*	*			trans	-75.4	111.9	164.4	-91.5	-178.1	172.7	177.1	0	110.3	G51	G51-K53 PolarHBondContact O-N 3.22Å; G51-K53 VanDerWaalsContact O-N 3.1Å
54	L	23.3	Very low	24.5	Very low	170 Å²	170	139.1 Å²	139.1	89%	0.89	76%	0.759	S	S	*	*			trans	-84.1	122.1	166.4	-82.7	166.2	0	0	0	110.3	Y52	Y52-L54 PolarHBondContact O-N 3.11Å
55	Y	23.2	Very low	24.5	Very low	216 Å²	216	146.2 Å²	146.2	85%	0.847	77%	0.771	S	S	*	*			trans	-78.8	124.6	172.1	-75.8	-93.8	0	0	0	110.2
56	Y	23.8	Very low	24.4	Very low	198 Å²	198	145.4 Å²	145.4	78%	0.776	77%	0.772	S	S	*	*			trans	-89.7	112.6	176.1	-179.4	-102.7	0	0	0	110	P58	Y56-P58 HydrophobicContact CE1-CB 3.9Å; Y56-P58 HydrophobicContact CE1-CG 4.41Å
57	N	24.3	Very low	24.5	Very low	104 Å²	104	144.6 Å²	144.6	56%	0.556	77%	0.772	S	S	*	*			trans	-108.2	111.5	173.7	-177.6	7.9	0	0	0	109.9	S59	N57-S59 PolarHBondContact ND2-OG 2.94Å; N57-S59 PolarHBondContact OD1-N 3.34Å; N57-S59 PolarHBondContact OD1-OG 3.48Å; N57-S59 VanDerWaalsContact OD1-OG 3.05Å
58	P	25	Very low	24.4	Very low	77 Å²	77	143.6 Å²	143.6	50%	0.5	77%	0.77	S	S	.	*			trans	-82.1	-6.7	-175.6	30.9	-34	0	0	0	115.2	Y56 S60	Y56-P58 HydrophobicContact CE1-CB 3.9Å; Y56-P58 HydrophobicContact CE1-CG 4.41Å; P58-S60 PolarHBondContact O-N 3.07Å
59	S	24.8	Very low	24.4	Very low	90 Å²	90	145.6 Å²	145.6	63%	0.629	77%	0.771	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.4	1.8	-167.9	64.2	0	0	0	0	116.5	N57	N57-S59 PolarHBondContact ND2-OG 2.94Å; N57-S59 PolarHBondContact OD1-N 3.34Å; N57-S59 PolarHBondContact OD1-OG 3.48Å; N57-S59 VanDerWaalsContact OD1-OG 3.05Å
60	S	25.1	Very low	24.3	Very low	96 Å²	96	141.7 Å²	141.7	67%	0.671	77%	0.766	S	S	*	*	T	Hydrogen-bonded Turn	trans	-97.4	7.7	-173.5	-48.2	0	0	0	0	115.8	P58	P58-S60 PolarHBondContact O-N 3.07Å
61	Y	29.5	Very low	24.5	Very low	168 Å²	168	142.1 Å²	142.1	66%	0.659	77%	0.765	S	S	*	*			trans	-111.1	13.1	-168	-74	-80.5	0	0	0	116.4
62	H	25.1	Very low	24.4	Very low	177 Å²	177	143.9 Å²	143.9	82%	0.819	77%	0.765	S	S	*	*			trans	-110.7	95.3	177.6	-72.7	-71.2	0	0	0	113.2
63	V	24.6	Very low	24.5	Very low	147 Å²	147	141.4 Å²	141.4	89%	0.891	76%	0.761	S	S	*	*			trans	-94.2	102.4	153.8	177.9	0	0	0	0	107.2	R65	V63-R65 PolarHBondContact O-N 2.9Å
64	A	23.5	Very low	24.5	Very low	86 Å²	86	140 Å²	140	71%	0.711	76%	0.76	S	S	*	*			trans	-69.3	128.1	177.1	0	0	0	0	0	110.5	T66	A64-T66 PolarHBondContact O-N 2.96Å
65	R	24.3	Very low	24.5	Very low	251 Å²	251	138.1 Å²	138.1	95%	0.947	75%	0.75	S	S	*	*			trans	-82.5	111	166.7	-109.3	-177	172.7	174.8	-2.1	108.7	V63 S67	V63-R65 PolarHBondContact O-N 2.9Å; R65-S67 PolarHBondContact O-N 3.28Å
66	T	22.3	Very low	24.4	Very low	140 Å²	140	132.2 Å²	132.2	86%	0.859	74%	0.74	S	S	*	*	P	Polyproline II helix	trans	-70.2	123.7	175.7	35.8	0	0	0	0	111.5	A64	A64-T66 PolarHBondContact O-N 2.96Å
67	S	26.7	Very low	24.3	Very low	119 Å²	119	128.1 Å²	128.1	83%	0.832	74%	0.741	S	S	*	*	P	Polyproline II helix	trans	-99.2	131.1	153.8	52.2	0	0	0	0	108.1	R65	R65-S67 PolarHBondContact O-N 3.28Å
68	A	23.4	Very low	24.3	Very low	81 Å²	81	132.6 Å²	132.6	67%	0.669	76%	0.758	S	S	*	*	P	Polyproline II helix	trans	-97.1	154.6	-171.7	0	0	0	0	0	113.1
69	N	24.3	Very low	24.2	Very low	163 Å²	163	138.1 Å²	138.1	87%	0.872	78%	0.778	S	S	*	*			trans	73.9	132.9	170.7	-52	-22	0	0	0	115.5
70	S	24.9	Very low	24.1	Very low	113 Å²	113	142.1 Å²	142.1	79%	0.79	79%	0.786	S	S	*	*			cis	-158.1	-178.1	-11	82.8	0	0	0	0	109.1
71	P	26.5	Very low	24	Very low	116 Å²	116	145.2 Å²	145.2	75%	0.753	79%	0.79	S	S	*	*				-125.9	160.6	-125.4	41.7	-26.8	0	0	0	118.6
72	C	23.2	Very low	23.6	Very low	112 Å²	112	146.5 Å²	146.5	76%	0.757	80%	0.799	S	S	*	*			trans	169.2	123.8	138.5	-92.2	0	0	0	0	107.6
73	Q	23.7	Very low	23.4	Very low	164 Å²	164	146.3 Å²	146.3	77%	0.766	80%	0.796	S	S	*	*				53	125.4	74.2	-67.6	-172.9	-22.2	0	0	112.7
74	M	22.8	Very low	23.4	Very low	153 Å²	153	144.6 Å²	144.6	75%	0.754	79%	0.791	S	S	*	*			cis	-162.3	162.9	7.7	-117.8	168.8	159.4	0	0	109.1
75	D	23.5	Very low	23.4	Very low	129 Å²	129	143.9 Å²	143.9	69%	0.69	79%	0.785	S	S	*	*			cis	-140.8	-114	0.4	-168.3	-101.9	0	0	0	112.2
76	S	20.9	Very low	23.7	Very low	92 Å²	92	132.9 Å²	132.9	64%	0.643	75%	0.747	S	S	*	*			trans	-145.2	150.3	-163.2	64.7	0	0	0	0	116.7
77	S	22.8	Very low	24.3	Very low	112 Å²	112	131.3 Å²	131.3	78%	0.783	73%	0.728	S	S	*	*			trans	-165.2	131.1	141.7	-23.4	0	0	0	0	112.6
78	E	24.1	Very low	24.7	Very low	198 Å²	198	128.3 Å²	128.3	93%	0.925	70%	0.699	S	S	*	*			trans	50.8	97.2	149.2	-59.1	-178.4	178.4	0	0	120.3
79	E	22.6	Very low	25.1	Very low	194 Å²	194	129.3 Å²	129.3	91%	0.907	69%	0.689	S	S	*	*			trans	-93.9	128.3	166.1	-65.3	-175.1	138.7	0	0	112.3
80	E	22.9	Very low	25.4	Very low	173 Å²	173	128.5 Å²	128.5	81%	0.808	68%	0.68	S	S	*	*			trans	-80	128.9	168.8	-70.9	-167.2	130	0	0	111.9	F82	E80-F82 PolarHBondContact O-N 3.06Å
81	Q	21.7	Very low	25.7	Very low	162 Å²	162	126.1 Å²	126.1	76%	0.757	66%	0.664	S	S	*	*			trans	-79.4	101.2	-175.1	-67.9	-178.9	-15.6	0	0	113.1	F83	Q81-F83 HydrophobicContact CB-CE2 4.19Å; Q81-F83 PolarHBondContact O-N 2.94Å
82	F	21.5	Very low	25.8	Very low	194 Å²	194	123.6 Å²	123.6	85%	0.851	64%	0.644	S	S	*	*			trans	-76.3	118.3	168.7	-82.6	-91.9	0	0	0	112	E80	E80-F82 PolarHBondContact O-N 3.06Å
83	F	22.3	Very low	26	Very low	173 Å²	173	125.6 Å²	125.6	76%	0.759	64%	0.642	S	S	*	*			trans	-88.1	138	178.6	-83.2	-94.1	0	0	0	113.4	Q81	Q81-F83 HydrophobicContact CB-CE2 4.19Å; Q81-F83 PolarHBondContact O-N 2.94Å
84	S	24.2	Very low	26.5	Very low	112 Å²	112	119 Å²	119	78%	0.783	61%	0.61	S	S	*	*			trans	48.4	104.3	161.8	61.2	0	0	0	0	118.7
85	A	23.5	Very low	26.8	Very low	70 Å²	70	111.9 Å²	111.9	58%	0.579	58%	0.575	S	S	*	*			trans	-79	147.3	147.1	0	0	0	0	0	110.1
86	S	31	Very low	27.4	Very low	20 Å²	20	107 Å²	107	14%	0.14	55%	0.55	C	S	.	.			trans	-66.3	153.8	177.9	50.8	0	0	0	0	114.8	W88 Q89 Q90 E360	S86-W88 PolarHBondContact O-N 3.31Å; S86-W88 VanDerWaalsContact O-N 3.09Å; S86-Q89 PolarHBondContact O-N 3.23Å; S86-Q90 PolarHBondContact O-N 3.43Å; S86-E360 WeakPolarHBondContact CA-OE2 3.44Å; S86-E360 VanDerWaalsContact CB-OE1 3.29Å; S86-E360 WeakPolarHBondContact CB-OE1 3.26Å; S86-E360 WeakPolarHBondContact CB-OE2 3.19Å; S86-E360 PolarHBondContact N-OE2 2.81Å; S86-E360 PolarHBondContact OG-OE1 3.28Å; S86-E360 PolarHBondContact OG-OE2 3.19Å
87	F	34.7	Very low	27.9	Very low	108 Å²	108	103.3 Å²	103.3	47%	0.474	52%	0.524	S	S	.	.	T	Hydrogen-bonded Turn	trans	-50	-25.1	162.3	-174.3	-99	0	0	0	114	Q90	F87-Q90 CarbonylContact O-C 3.59Å; F87-Q90 PolarHBondContact O-N 3.14Å
88	W	34.6	Very low	28.2	Very low	56 Å²	56	100 Å²	100	21%	0.212	50%	0.501	C	S	.	.	T	Hydrogen-bonded Turn	trans	-76.9	-31.2	176.5	-64.9	107.7	0	0	0	113.1	S86 Q90 Y393 F395 I750	S86-W88 PolarHBondContact O-N 3.31Å; S86-W88 VanDerWaalsContact O-N 3.09Å; W88-Q90 VanDerWaalsContact C-N 3.33Å; W88-Y393 WeakPolarHBondContact CB-O 3.27Å; W88-F395 HydrophobicContact CZ2-CB 3.79Å; W88-F395 HydrophobicContact CZ2-CG 4.38Å; W88-I750 HydrophobicContact CH2-CD1 3.76Å; W88-I750 HydrophobicContact CH2-CG1 4.44Å; W88-I750 HydrophobicContact CZ2-CD1 3.73Å
89	Q	32	Very low	28.5	Very low	102 Å²	102	93.3 Å²	93.3	48%	0.477	48%	0.475	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.5	-23.9	169.5	-67.8	-170.2	-18.9	0	0	112.4	S86 S91	S86-Q89 PolarHBondContact O-N 3.23Å; Q89-S91 PolarHBondContact O-N 2.89Å
90	Q	30.8	Very low	29.3	Very low	146 Å²	146	85.4 Å²	85.4	68%	0.682	44%	0.437	S	S	*	.	S	Bend	trans	-74.7	54.8	162.7	-67.6	-171.1	-18.4	0	0	111.2	S86 F87 W88 N92	S86-Q90 PolarHBondContact O-N 3.43Å; F87-Q90 CarbonylContact O-C 3.59Å; F87-Q90 PolarHBondContact O-N 3.14Å; W88-Q90 VanDerWaalsContact C-N 3.33Å; Q90-N92 PolarHBondContact O-N 3.36Å
91	S	29.8	Very low	29.9	Very low	63 Å²	63	82.4 Å²	82.4	44%	0.441	42%	0.423	S	S	.	.			trans	-67.4	94.6	-179.3	66.4	0	0	0	0	110.7	Q89 H93	Q89-S91 PolarHBondContact O-N 2.89Å; S91-H93 PolarHBondContact O-N 3.22Å
92	N	29.2	Very low	30.5	Very low	63 Å²	63	76.7 Å²	76.7	34%	0.337	40%	0.398	S	S	.	.			trans	-46	114.5	148.9	-105.7	-80.5	0	0	0	106.9	Q90 Y94 K582	Q90-N92 PolarHBondContact O-N 3.36Å; N92-Y94 PolarHBondContact O-N 3.27Å; N92-K582 PolarHBondContact OD1-NZ 2.61Å
93	H	28.6	Very low	31.1	Very low	153 Å²	153	69.3 Å²	69.3	71%	0.708	37%	0.37	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.8	17.9	-178.7	-68.6	-73.5	0	0	0	113.9	S91	S91-H93 PolarHBondContact O-N 3.22Å
94	Y	33.4	Very low	31.7	Very low	27 Å²	27	63.1 Å²	63.1	11%	0.106	35%	0.349	C	S	.	.	T	Hydrogen-bonded Turn	trans	-106.9	-2.6	-163.7	-115.3	-83.7	0	0	0	115	N92 V96 F574 D578 V579 R612	N92-Y94 PolarHBondContact O-N 3.27Å; Y94-V96 PolarHBondContact O-N 2.96Å; Y94-F574 HydrophobicContact CD2-CE1 4.5Å; Y94-F574 HydrophobicContact CE2-CD1 4.35Å; Y94-F574 AromaticContact CE2-CE1 3.58Å; Y94-F574 HydrophobicContact CE2-CE1 3.58Å; Y94-F574 HydrophobicContact CE2-CZ 4.31Å; Y94-D578 WeakPolarHBondContact CD2-OD2 3.41Å; Y94-D578 VanDerWaalsContact CE2-OD2 3.26Å; Y94-D578 WeakPolarHBondContact CE2-OD2 3.27Å; Y94-V579 HydrophobicContact CD1-CG2 4.39Å; Y94-V579 HydrophobicContact CD2-CG2 3.88Å; Y94-V579 HydrophobicContact CE1-CG2 3.77Å; Y94-V579 HydrophobicContact CE2-CG2 3.16Å; Y94-V579 HydrophobicContact CG-CG2 4.45Å; Y94-V579 WeakPolarHBondContact OH-CG2 3.42Å; Y94-R612 WeakPolarHBondContact CE1-O 3.44Å; Y94-R612 PolarHBondContact OH-O 3Å
95	S	28.4	Very low	32.2	Very low	3 Å²	3	59.1 Å²	59.1	2%	0.021	32%	0.321	C	S	.	.			trans	-72.3	111.4	160	179.9	0	0	0	0	108.2	S97 C98 S99 H430	S95-S97 PolarHBondContact O-N 3.33Å; S95-S97 VanDerWaalsContact OG-CB 3.26Å; S95-S97 WeakPolarHBondContact OG-CB 3.15Å; S95-S97 PolarHBondContact OG-N 3.01Å; S95-C98 CarbonylContact O-C 3.52Å; S95-C98 WeakPolarHBondContact O-CA 3.16Å; S95-C98 PolarHBondContact O-N 2.96Å; S95-C98 PolarHBondContact OG-N 3.3Å; S95-S99 PolarHBondContact O-N 3.09Å; S95-H430 PolarHBondContact OG-CE1 3.06Å; S95-H430 PolarHBondContact OG-NE2 3.12Å; S95-H430 VanDerWaalsContact OG-NE2 3.11Å
96	V	36.9	Very low	32.6	Very low	26 Å²	26	62.9 Å²	62.9	16%	0.158	32%	0.324	C	S	.	.	T	Hydrogen-bonded Turn	trans	-67.7	-16.8	174.4	-173.1	0	0	0	0	111	Y94 S99 R612 L758	Y94-V96 PolarHBondContact O-N 2.96Å; V96-S99 PolarHBondContact O-OG 3.32Å; V96-R612 HydrophobicContact CG2-CB 4.5Å; V96-L758 HydrophobicContact CB-CD2 3.51Å; V96-L758 HydrophobicContact CG1-CD2 3.63Å; V96-L758 HydrophobicContact CG2-CD2 3.52Å
97	S	30.7	Very low	32.7	Very low	14 Å²	14	64.2 Å²	64.2	10%	0.098	33%	0.329	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.1	-42.1	165	-146.3	0	0	0	0	111.8	S95 S427 W461	S95-S97 PolarHBondContact O-N 3.33Å; S95-S97 VanDerWaalsContact OG-CB 3.26Å; S95-S97 WeakPolarHBondContact OG-CB 3.15Å; S95-S97 PolarHBondContact OG-N 3.01Å; S97-S427 PolarHBondContact OG-O 3.29Å; S97-W461 WeakPolarHBondContact OG-CH2 3.44Å; S97-W461 WeakPolarHBondContact OG-CZ2 3.48Å
98	C	29.6	Very low	32.8	Very low	43 Å²	43	63.4 Å²	63.4	29%	0.291	33%	0.333	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.5	-19.4	179.4	-58.6	0	0	0	0	114.4	S95 R100 Y393	S95-C98 CarbonylContact O-C 3.52Å; S95-C98 WeakPolarHBondContact O-CA 3.16Å; S95-C98 PolarHBondContact O-N 2.96Å; S95-C98 PolarHBondContact OG-N 3.3Å; C98-R100 PolarHBondContact O-N 3.41Å; C98-Y393 HydrophobicContact CB-CE1 4.23Å
99	S	29.9	Very low	32.6	Very low	57 Å²	57	66 Å²	66	40%	0.399	35%	0.351	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.7	-16.1	171.5	75.6	0	0	0	0	113.1	S95 V96 H101	S95-S99 PolarHBondContact O-N 3.09Å; V96-S99 PolarHBondContact O-OG 3.32Å; S99-H101 VanDerWaalsContact C-N 3.33Å; S99-H101 PolarHBondContact O-N 3.24Å
100	R	39.5	Very low	32.7	Very low	28 Å²	28	63.1 Å²	63.1	11%	0.106	34%	0.338	C	S	.	.			trans	-77.5	75.9	172.7	-67.6	-179.4	155.5	-154.4	-2.1	112.4	C98 L102 S103 W461	C98-R100 PolarHBondContact O-N 3.41Å; R100-L102 HydrophobicContact CB-CB 4.46Å; R100-L102 PolarHBondContact O-N 3.45Å; R100-S103 PolarHBondContact O-N 3.31Å; R100-W461 VanDerWaalsContact CZ-CD1 3.45Å
101	H	35.5	Very low	32.8	Very low	110 Å²	110	58.6 Å²	58.6	51%	0.509	32%	0.319	S	S	.	.			trans	-53.5	-12.5	158	-81.9	-74.2	0	0	0	113.5	S99 S103 S104 S105	S99-H101 VanDerWaalsContact C-N 3.33Å; S99-H101 PolarHBondContact O-N 3.24Å; H101-S103 PolarHBondContact O-N 3.17Å; H101-S104 PolarHBondContact O-N 2.82Å; H101-S105 PolarHBondContact ND1-OG 3.05Å
102	L	34.4	Very low	33	Very low	42 Å²	42	60 Å²	60	22%	0.22	32%	0.321	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60.8	25.5	164.9	-52.6	178.4	0	0	0	115	R100 K458 E496 L534	R100-L102 HydrophobicContact CB-CB 4.46Å; R100-L102 PolarHBondContact O-N 3.45Å; L102-K458 PolarHBondContact O-NZ 2.72Å; L102-E496 HydrophobicContact CD1-CB 4.19Å; L102-E496 HydrophobicContact CD1-CG 4.47Å; L102-E496 HydrophobicContact CD2-CG 4.38Å; L102-L534 HydrophobicContact CD2-CD2 3.75Å
103	S	33.5	Very low	32.8	Very low	39 Å²	39	58.7 Å²	58.7	27%	0.273	32%	0.319	S	S	.	.	T	Hydrogen-bonded Turn	trans	-141	21.8	171.4	-174.2	0	0	0	0	114.8	R100 H101 R390	R100-S103 PolarHBondContact O-N 3.31Å; H101-S103 PolarHBondContact O-N 3.17Å; S103-R390 PolarHBondContact OG-NE 3.02Å; S103-R390 VanDerWaalsContact OG-NE 3.12Å; S103-R390 PolarHBondContact OG-NH2 3.31Å
104	S	35.8	Very low	33	Very low	44 Å²	44	54.7 Å²	54.7	31%	0.308	30%	0.302	S	S	.	.	T	Hydrogen-bonded Turn	trans	-173.3	-39	150.3	52.9	0	0	0	0	114.6	H101	H101-S104 PolarHBondContact O-N 2.82Å
105	S	34.6	Very low	32.7	Very low	28 Å²	28	58.2 Å²	58.2	20%	0.196	32%	0.323	C	S	.	.	T	Hydrogen-bonded Turn	trans	-94.2	-29.9	-138.7	-4.2	0	0	0	0	116.9	H101 Q355	H101-S105 PolarHBondContact ND1-OG 3.05Å; S105-Q355 VanDerWaalsContact CA-OE1 3.25Å; S105-Q355 VanDerWaalsContact CB-OE1 3.32Å; S105-Q355 PolarHBondContact O-NE2 2.8Å; S105-Q355 PolarHBondContact O-OE1 2.97Å
106	K	31	Very low	32.7	Very low	149 Å²	149	66.1 Å²	66.1	65%	0.648	36%	0.357	S	S	*	.	S	Bend	trans	-120.7	6.2	-168.2	-69.2	-172.3	177.2	178.4	0	116.5	T108	K106-T108 PolarHBondContact O-N 2.79Å
107	N	34.8	Very low	32.1	Very low	48 Å²	48	68.4 Å²	68.4	26%	0.257	38%	0.379	S	S	.	.			trans	-95.9	30.7	180	-83.4	15.2	0	0	0	114.3	L109 L110 D111	N107-L109 PolarHBondContact O-N 3.11Å; N107-L109 VanDerWaalsContact O-N 3.13Å; N107-L110 HydrophobicContact CB-CB 4.29Å; N107-L110 HydrophobicContact CB-CD1 4.5Å; N107-L110 PolarHBondContact O-N 2.94Å; N107-D111 PolarHBondContact O-N 3.07Å
108	T	36.3	Very low	31.9	Very low	91 Å²	91	71.6 Å²	71.6	56%	0.558	40%	0.401	S	S	*	.	H	α-helix	trans	-55.5	-29.8	-179.8	39.2	0	0	0	0	114.4	K106	K106-T108 PolarHBondContact O-N 2.79Å
109	L	31	Very low	31.9	Very low	110 Å²	110	79.1 Å²	79.1	58%	0.576	43%	0.432	S	S	*	.	H	α-helix	trans	-86.3	-10.5	175.9	-84.9	162.3	0	0	0	114.9	N107 L112	N107-L109 PolarHBondContact O-N 3.11Å; N107-L109 VanDerWaalsContact O-N 3.13Å; L109-L112 HydrophobicContact CD2-CD1 4.08Å
110	L	33.3	Very low	31.6	Very low	41 Å²	41	81.5 Å²	81.5	22%	0.215	44%	0.444	C	S	.	.	H	α-helix	trans	-98.7	-30.4	178.9	-76.7	164.7	0	0	0	112.6	N107 L112 A113 L114 Y494	N107-L110 HydrophobicContact CB-CB 4.29Å; N107-L110 HydrophobicContact CB-CD1 4.5Å; N107-L110 PolarHBondContact O-N 2.94Å; L110-L112 PolarHBondContact O-N 2.65Å; L110-A113 WeakPolarHBondContact O-CB 3.43Å; L110-A113 PolarHBondContact O-N 2.62Å; L110-L114 PolarHBondContact O-N 3Å; L110-Y494 HydrophobicContact CD2-CE1 4.01Å
111	D	33.4	Very low	30.9	Very low	51 Å²	51	88.9 Å²	88.9	27%	0.273	48%	0.48	S	S	.	.	H	α-helix	trans	-66.1	-26.3	168.8	-90.7	14.1	0	0	0	111.8	N107 A113 L114 N115 R318	N107-D111 PolarHBondContact O-N 3.07Å; D111-A113 PolarHBondContact O-N 3.3Å; D111-L114 PolarHBondContact O-N 2.94Å; D111-L114 VanDerWaalsContact O-N 3.16Å; D111-N115 PolarHBondContact O-N 3.07Å; D111-N115 VanDerWaalsContact O-N 3.13Å; D111-R318 IonicContact OD2-CZ 3.81Å; D111-R318 IonicContact OD2-NH1 2.8Å; D111-R318 PolarHBondContact OD2-NH1 3.33Å; D111-R318 IonicContact OD2-NH2 3.85Å; D111-R318 PolarHBondContact OD2-NH2 2.81Å
112	L	32.3	Very low	30.6	Very low	94 Å²	94	89.1 Å²	89.1	49%	0.492	49%	0.489	S	S	.	.	H	α-helix	trans	-61.1	-26	167.8	-91.4	166.9	0	0	0	113.6	L109 L110	L109-L112 HydrophobicContact CD2-CD1 4.08Å; L110-L112 PolarHBondContact O-N 2.65Å
113	A	27	Very low	30.2	Very low	35 Å²	35	92.8 Å²	92.8	29%	0.289	52%	0.515	S	S	.	.	H	α-helix	trans	-81.9	-32.3	173.1	0	0	0	0	0	112.1	L110 D111 K116	L110-A113 WeakPolarHBondContact O-CB 3.43Å; L110-A113 PolarHBondContact O-N 2.62Å; D111-A113 PolarHBondContact O-N 3.3Å; A113-K116 CarbonylContact O-C 3.58Å; A113-K116 WeakPolarHBondContact O-CA 3.44Å; A113-K116 WeakPolarHBondContact O-CB 3.48Å; A113-K116 PolarHBondContact O-N 3.34Å
114	L	31.2	Very low	30	Very low	68 Å²	68	96.1 Å²	96.1	36%	0.356	54%	0.538	S	S	.	.	H	α-helix	trans	-72	-32.4	179	-66.9	175.7	0	0	0	112.8	L110 D111 K116	L110-L114 PolarHBondContact O-N 3Å; D111-L114 PolarHBondContact O-N 2.94Å; D111-L114 VanDerWaalsContact O-N 3.16Å; L114-K116 PolarHBondContact O-N 3.08Å
115	N	28.6	Very low	30	Very low	102 Å²	102	101 Å²	101	55%	0.545	57%	0.566	S	S	.	*	T	Hydrogen-bonded Turn	trans	-73.3	-9	167.1	-77.5	-7.5	0	0	0	113.2	D111	D111-N115 PolarHBondContact O-N 3.07Å; D111-N115 VanDerWaalsContact O-N 3.13Å
116	K	27.3	Very low	29.8	Very low	168 Å²	168	104.1 Å²	104.1	73%	0.73	59%	0.588	S	S	*	*	T	Hydrogen-bonded Turn	trans	-94.2	12.2	178.3	-133.7	-178.7	-175.1	-172.5	0	113.4	A113 L114 S118	A113-K116 CarbonylContact O-C 3.58Å; A113-K116 WeakPolarHBondContact O-CA 3.44Å; A113-K116 WeakPolarHBondContact O-CB 3.48Å; A113-K116 PolarHBondContact O-N 3.34Å; L114-K116 PolarHBondContact O-N 3.08Å; K116-S118 PolarHBondContact O-N 3.04Å
117	A	24.4	Very low	30	Very low	74 Å²	74	102.7 Å²	102.7	61%	0.612	60%	0.597	S	S	*	*			trans	-69.4	71.8	168.1	0	0	0	0	0	111.1
118	S	26.2	Very low	29.9	Very low	82 Å²	82	110.2 Å²	110.2	57%	0.573	62%	0.623	S	S	*	*			trans	-75.1	138.9	140.3	49.8	0	0	0	0	107.8	K116 T120	K116-S118 PolarHBondContact O-N 3.04Å; S118-T120 PolarHBondContact O-N 2.71Å
119	E	29.3	Very low	30	Very low	200 Å²	200	113.7 Å²	113.7	94%	0.935	64%	0.638	S	S	*	*			trans	-71.9	82	172	-69.5	174.5	142.6	0	0	109.2	E121	E119-E121 PolarHBondContact O-N 2.83Å
120	T	24.6	Very low	30.2	Very low	107 Å²	107	119.9 Å²	119.9	66%	0.656	65%	0.654	S	S	*	*			trans	-84.9	95.5	167.3	-50.4	0	0	0	0	107.3	S118 V122	S118-T120 PolarHBondContact O-N 2.71Å; T120-V122 VanDerWaalsContact C-N 3.33Å; T120-V122 PolarHBondContact O-N 3.46Å
121	E	25.6	Very low	30.6	Very low	183 Å²	183	126.8 Å²	126.8	86%	0.855	68%	0.682	S	S	*	*			trans	-62.2	93.6	172.6	-68.7	-164	128.5	0	0	110.1	E119 P123	E119-E121 PolarHBondContact O-N 2.83Å; E121-P123 WeakPolarHBondContact O-CD 3.25Å
122	V	27.7	Very low	31.2	Very low	115 Å²	115	130.6 Å²	130.6	70%	0.697	71%	0.71	S	S	*	*			trans	-71	118.3	162.4	-177.1	0	0	0	0	106.3	T120 S124	T120-V122 VanDerWaalsContact C-N 3.33Å; T120-V122 PolarHBondContact O-N 3.46Å; V122-S124 PolarHBondContact O-N 3.5Å
123	P	25.9	Very low	32.3	Very low	119 Å²	119	130.1 Å²	130.1	77%	0.773	71%	0.711	S	S	*	*			trans	-66.5	100.8	-173.4	25.5	-33.9	0	0	0	110.3	E121	E121-P123 WeakPolarHBondContact O-CD 3.25Å
124	S	29.2	Very low	34	Very low	109 Å²	109	133.7 Å²	133.7	76%	0.762	73%	0.729	S	S	*	*			trans	-88.6	116.8	-178.1	46.7	0	0	0	0	110.6	V122 S126	V122-S124 PolarHBondContact O-N 3.5Å; S124-S126 PolarHBondContact O-N 3Å
125	V	35.7	Very low	35.4	Very low	148 Å²	148	136.1 Å²	136.1	90%	0.897	75%	0.749	S	S	*	*	S	Bend	trans	-77	86.9	-175.3	-177.9	0	0	0	0	110.8
126	S	31.1	Very low	37.7	Very low	92 Å²	92	133.1 Å²	133.1	64%	0.643	73%	0.733	S	S	*	*			trans	-171.1	93.2	150.9	44	0	0	0	0	111.9	S124 Y128	S124-S126 PolarHBondContact O-N 3Å; S126-Y128 PolarHBondContact O-N 3.05Å
127	S	34.2	Very low	40.3	Very low	120 Å²	120	128.2 Å²	128.2	84%	0.839	72%	0.717	S	S	*	*			trans	-80.4	80.5	179.3	53.3	0	0	0	0	112.7
128	Y	33.2	Very low	43	Very low	205 Å²	205	134.4 Å²	134.4	80%	0.804	73%	0.73	S	S	*	*			trans	-125.2	100.9	172.1	-73.9	-70.6	0	0	0	112.7	S126 R130	S126-Y128 PolarHBondContact O-N 3.05Å; Y128-R130 PolarHBondContact O-N 2.84Å
129	N	37.8	Very low	45.8	Very low	164 Å²	164	134 Å²	134	88%	0.877	72%	0.724	S	S	*	*			trans	30.4	59.8	156.4	-69.1	-12.9	0	0	0	118.1	K131	N129-K131 PolarHBondContact O-N 2.73Å
130	R	37.1	Very low	48.5	Very low	241 Å²	241	127.8 Å²	127.8	91%	0.909	70%	0.697	S	S	*	*			trans	-69.8	110.1	157	-77.2	-173.7	174.7	177.6	-0.5	109	Y128	Y128-R130 PolarHBondContact O-N 2.84Å
131	K	40.9	Very low	51.6	Low	185 Å²	185	125.9 Å²	125.9	80%	0.804	69%	0.685	S	S	*	*	P	Polyproline II helix	trans	-56.1	141.3	161.2	-67.3	-177	178.9	-178.8	0	108.4	N129 V133	N129-K131 PolarHBondContact O-N 2.73Å; K131-V133 PolarHBondContact O-N 2.92Å; K131-V133 VanDerWaalsContact O-N 3.08Å
132	P	45	Very low	54.8	Low	131 Å²	131	118.2 Å²	118.2	85%	0.851	65%	0.648	S	S	*	*	P	Polyproline II helix	trans	-61	116.6	177.9	25	-33.4	0	0	0	109.6	T134	P132-T134 PolarHBondContact O-N 3.14Å
133	V	57.1	Low	58	Low	85 Å²	85	113.9 Å²	113.9	52%	0.515	63%	0.625	S	S	.	*	P	Polyproline II helix	trans	-81.1	117.6	177.9	-176.1	0	0	0	0	107.5	K131 P449 H450	K131-V133 PolarHBondContact O-N 2.92Å; K131-V133 VanDerWaalsContact O-N 3.08Å; V133-P449 HydrophobicContact CG1-CB 3.73Å; V133-P449 HydrophobicContact CG1-CG 4.45Å; V133-P449 HydrophobicContact CG2-CB 4.35Å; V133-H450 WeakPolarHBondContact CG1-NE2 3.5Å
134	T	63	Low	61.3	Low	109 Å²	109	108.2 Å²	108.2	67%	0.669	59%	0.588	S	S	*	*	P	Polyproline II helix	trans	-55	135.7	172.7	50.6	0	0	0	0	109.9	P132 H450	P132-T134 PolarHBondContact O-N 3.14Å; T134-H450 PolarHBondContact O-CE1 2.9Å; T134-H450 PolarHBondContact O-NE2 3.38Å
135	P	60.3	Low	64.5	Low	120 Å²	120	104.3 Å²	104.3	78%	0.779	56%	0.558	S	S	*	*	P	Polyproline II helix	trans	-60.5	151.2	-175.5	24.4	-34.3	0	0	0	112.9
136	D	76.5	Confident	67.2	Low	39 Å²	39	103.5 Å²	103.5	21%	0.209	54%	0.543	C	S	.	.	P	Polyproline II helix	trans	-66.1	165.2	170.7	-165.8	15.3	0	0	0	110.4	K138 G415 V416 H450	D136-K138 PolarHBondContact O-N 3.09Å; D136-G415 WeakPolarHBondContact OD1-CA 3.38Å; D136-V416 PolarHBondContact OD2-N 2.66Å; D136-H450 HydrophobicContact CB-CB 3.98Å; D136-H450 PolarHBondContact N-CD2 3.15Å
137	V	82.6	Confident	70.3	Confident	64 Å²	64	101 Å²	101	39%	0.388	53%	0.525	S	S	.	.			trans	-55.7	110.2	-178.6	-176	0	0	0	0	110.6	V139 R413	V137-V139 PolarHBondContact O-N 2.96Å; V137-V139 VanDerWaalsContact O-N 3.16Å; V137-R413 WeakPolarHBondContact CG2-O 3.37Å
138	K	80.9	Confident	73.3	Confident	205 Å²	205	97.2 Å²	97.2	89%	0.891	49%	0.492	S	S	*	.			trans	-68.9	110.7	179.6	-174.9	179.2	-179.5	179.6	0	110.2	D136	D136-K138 PolarHBondContact O-N 3.09Å
139	V	83.7	Confident	76.2	Confident	74 Å²	74	92.7 Å²	92.7	45%	0.448	49%	0.488	S	S	.	.			trans	-90.7	124.5	178.5	178.1	0	0	0	0	110.9	V137 T141 F380	V137-V139 PolarHBondContact O-N 2.96Å; V137-V139 VanDerWaalsContact O-N 3.16Å; V139-T141 HydrophobicContact CG1-CG2 4.48Å; V139-T141 PolarHBondContact O-N 2.93Å; V139-F380 HydrophobicContact CG1-CB 3.63Å; V139-F380 HydrophobicContact CG1-CD1 4.47Å; V139-F380 HydrophobicContact CG1-CD2 3.55Å; V139-F380 HydrophobicContact CG1-CE2 4.3Å; V139-F380 HydrophobicContact CG1-CG 3.64Å
140	D	86.9	Confident	79	Confident	68 Å²	68	88.8 Å²	88.8	36%	0.364	46%	0.464	S	S	.	.			trans	-78.2	104	168.1	-175.2	-6.9	0	0	0	109.9	R142 A143 K146	D140-R142 PolarHBondContact O-N 2.94Å; D140-R142 WeakPolarHBondContact OD1-CA 3.18Å; D140-R142 PolarHBondContact OD1-N 3.27Å; D140-A143 HydrophobicContact CB-CB 4.35Å; D140-A143 PolarHBondContact OD1-N 3.34Å; D140-K146 IonicContact OD2-NZ 2.86Å; D140-K146 PolarHBondContact OD2-NZ 3.45Å
141	T	89.5	Confident	81.8	Confident	68 Å²	68	77.4 Å²	77.4	42%	0.417	42%	0.422	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.9	-2.9	-179.5	59.2	0	0	0	0	113.8	V139 F380	V139-T141 HydrophobicContact CG1-CG2 4.48Å; V139-T141 PolarHBondContact O-N 2.93Å; T141-F380 HydrophobicContact CG2-CE1 4.4Å; T141-F380 HydrophobicContact CG2-CE2 4.01Å; T141-F380 HydrophobicContact CG2-CZ 3.81Å
142	R	93.2	Very high	84.4	Confident	21 Å²	21	72.7 Å²	72.7	8%	0.079	42%	0.417	C	S	.	.	T	Hydrogen-bonded Turn	trans	-123.5	19.7	-179.4	-62.6	179.3	74.9	-142.8	9.5	112.4	D140 F144 L145 L156 D275 R278 Y312	D140-R142 PolarHBondContact O-N 2.94Å; D140-R142 WeakPolarHBondContact OD1-CA 3.18Å; D140-R142 PolarHBondContact OD1-N 3.27Å; R142-F144 HydrophobicContact CB-CE1 4.42Å; R142-F144 PolarHBondContact O-N 3.13Å; R142-L145 HydrophobicContact CB-CD1 4Å; R142-L145 HydrophobicContact CB-CG 4.36Å; R142-L145 VanDerWaalsContact NH2-CD1 3.32Å; R142-L145 WeakPolarHBondContact O-CB 3.31Å; R142-L145 WeakPolarHBondContact O-CG 3.32Å; R142-L145 PolarHBondContact O-N 3.21Å; R142-L156 PolarHBondContact NH1-O 2.9Å; R142-L156 PolarHBondContact NH2-O 3.34Å; R142-D275 IonicContact CZ-OD1 2.75Å; R142-D275 IonicContact CZ-OD2 3.66Å; R142-D275 IonicContact NE-OD1 2.9Å; R142-D275 IonicContact NH2-OD1 3.26Å; R142-D275 PolarHBondContact NH2-OD1 3.43Å; R142-D275 IonicContact NH2-OD2 3.58Å; R142-D275 PolarHBondContact NH2-OD2 2.74Å; R142-R278 VanDerWaalsContact NH2-NH2 3.12Å; R142-Y312 WeakPolarHBondContact CG-OH 3.34Å
143	A	93.4	Very high	86.7	Confident	24 Å²	24	69 Å²	69	20%	0.198	39%	0.394	C	S	.	.	G	3₁₀ helix	trans	-51.3	-33.7	-179.6	0	0	0	0	0	113.8	D140 L145 K146 E342	D140-A143 HydrophobicContact CB-CB 4.35Å; D140-A143 PolarHBondContact OD1-N 3.34Å; A143-L145 PolarHBondContact O-N 3.31Å; A143-L145 VanDerWaalsContact O-N 3.11Å; A143-K146 WeakPolarHBondContact O-CB 3.32Å; A143-K146 PolarHBondContact O-N 2.73Å; A143-E342 HydrophobicContact CB-CG 4.17Å
144	F	96	Very high	88.5	Confident	1 Å²	1	64.9 Å²	64.9	0%	0.004	37%	0.369	C	S	.	.	G	3₁₀ helix	trans	-54.3	-28.3	176.5	79.5	-76.9	0	0	0	114.7	R142 K146 C147 Y151 V308 Y312 E342 E343 V346	R142-F144 HydrophobicContact CB-CE1 4.42Å; R142-F144 PolarHBondContact O-N 3.13Å; F144-K146 PolarHBondContact O-N 2.87Å; F144-C147 VanDerWaalsContact O-CB 3.27Å; F144-C147 WeakPolarHBondContact O-CB 3.23Å; F144-C147 PolarHBondContact O-N 3.49Å; F144-Y151 AromaticContact CD2-CE1 3.98Å; F144-Y151 HydrophobicContact CD2-CE1 3.98Å; F144-Y151 HydrophobicContact CD2-CE2 4.37Å; F144-Y151 AromaticContact CD2-CZ 3.83Å; F144-Y151 HydrophobicContact CE2-CD1 4.41Å; F144-Y151 AromaticContact CE2-CE1 3.85Å; F144-Y151 HydrophobicContact CE2-CE1 3.85Å; F144-Y151 VanDerWaalsContact O-CE2 3.28Å; F144-Y151 WeakPolarHBondContact O-CE2 3.39Å; F144-V308 HydrophobicContact CD2-CG1 3.69Å; F144-V308 HydrophobicContact CE2-CG1 3.95Å; F144-Y312 HydrophobicContact CE1-CD1 4.2Å; F144-Y312 HydrophobicContact CE1-CD2 4.15Å; F144-Y312 HydrophobicContact CE1-CE1 4.39Å; F144-Y312 HydrophobicContact CE1-CE2 4.37Å; F144-Y312 HydrophobicContact CE1-CG 4.07Å; F144-Y312 AromaticContact CZ-CD1 3.73Å; F144-Y312 HydrophobicContact CZ-CD1 3.73Å; F144-Y312 HydrophobicContact CZ-CD2 4.26Å; F144-Y312 HydrophobicContact CZ-CE1 4.27Å; F144-Y312 AromaticContact CZ-CG 3.72Å; F144-Y312 HydrophobicContact CZ-CG 3.72Å; F144-E342 HydrophobicContact CB-CB 3.86Å; F144-E343 HydrophobicContact CB-CG 4.45Å; F144-V346 HydrophobicContact CB-CG2 3.93Å; F144-V346 HydrophobicContact CD1-CB 4.45Å; F144-V346 HydrophobicContact CD1-CG1 4.35Å; F144-V346 HydrophobicContact CD1-CG2 3.59Å; F144-V346 HydrophobicContact CD2-CG1 4.33Å; F144-V346 HydrophobicContact CE1-CG1 4.29Å; F144-V346 HydrophobicContact CE1-CG2 4.17Å; F144-V346 HydrophobicContact CE2-CG1 4.27Å; F144-V346 HydrophobicContact CG-CB 4.32Å; F144-V346 HydrophobicContact CG-CG1 4.35Å; F144-V346 HydrophobicContact CG-CG2 3.78Å; F144-V346 HydrophobicContact CZ-CG1 4.24Å
145	L	95.6	Very high	90.1	Very high	27 Å²	27	60.2 Å²	60.2	14%	0.141	34%	0.341	C	S	.	.	G	3₁₀ helix	trans	-65.4	-19.3	178.1	-59	-178.2	0	0	0	112.8	R142 A143 C147 Y151 S155	R142-L145 HydrophobicContact CB-CD1 4Å; R142-L145 HydrophobicContact CB-CG 4.36Å; R142-L145 VanDerWaalsContact NH2-CD1 3.32Å; R142-L145 WeakPolarHBondContact O-CB 3.31Å; R142-L145 WeakPolarHBondContact O-CG 3.32Å; R142-L145 PolarHBondContact O-N 3.21Å; A143-L145 PolarHBondContact O-N 3.31Å; A143-L145 VanDerWaalsContact O-N 3.11Å; L145-C147 VanDerWaalsContact C-N 3.34Å; L145-Y151 HydrophobicContact CB-CG 4.5Å; L145-Y151 HydrophobicContact CD2-CD1 3.61Å; L145-Y151 HydrophobicContact CD2-CD2 4.45Å; L145-Y151 HydrophobicContact CD2-CE1 4.23Å; L145-Y151 HydrophobicContact CD2-CG 3.76Å; L145-S155 WeakPolarHBondContact CD2-OG 3.36Å
146	K	93.9	Very high	91.7	Very high	131 Å²	131	55.1 Å²	55.1	57%	0.57	31%	0.307	S	S	*	.	G	3₁₀ helix	trans	-85.6	-6.3	176.7	-63.4	161.9	-179.4	165.4	0	112.7	D140 A143 F144 R148	D140-K146 IonicContact OD2-NZ 2.86Å; D140-K146 PolarHBondContact OD2-NZ 3.45Å; A143-K146 WeakPolarHBondContact O-CB 3.32Å; A143-K146 PolarHBondContact O-N 2.73Å; F144-K146 PolarHBondContact O-N 2.87Å; K146-R148 VanDerWaalsContact C-N 3.34Å
147	C	95.6	Very high	92.4	Very high	40 Å²	40	55.6 Å²	55.6	27%	0.27	31%	0.31	S	S	.	.	G	3₁₀ helix	trans	-75.4	-19.7	179.1	-62.9	0	0	0	0	113.7	F144 L145 H340 E343	F144-C147 VanDerWaalsContact O-CB 3.27Å; F144-C147 WeakPolarHBondContact O-CB 3.23Å; F144-C147 PolarHBondContact O-N 3.49Å; L145-C147 VanDerWaalsContact C-N 3.34Å; C147-H340 HydrophobicContact CB-CB 4.02Å; C147-H340 PolarHBondContact O-CE1 3Å; C147-E343 HydrophobicContact CB-CG 4.39Å
148	R	96.3	Very high	92.6	Very high	39 Å²	39	56.4 Å²	56.4	15%	0.147	31%	0.311	C	S	.	.			trans	-152.3	136.4	-174.9	-61.2	-177	-164.7	-83.5	-9.1	111.9	K146 E150 Y151 Q338 H340 E343	K146-R148 VanDerWaalsContact C-N 3.34Å; R148-E150 WeakPolarHBondContact CB-OE2 3.33Å; R148-E150 PolarHBondContact O-N 2.64Å; R148-Y151 HydrophobicContact CB-CD2 3.73Å; R148-Y151 HydrophobicContact CB-CE2 3.84Å; R148-Y151 HydrophobicContact CG-CD2 4.46Å; R148-Y151 HydrophobicContact CG-CE2 4.07Å; R148-Y151 WeakPolarHBondContact O-CD2 3.48Å; R148-Y151 PolarHBondContact O-N 2.73Å; R148-Q338 PolarHBondContact NH2-O 3.1Å; R148-H340 VanDerWaalsContact CZ-CE1 3.44Å; R148-H340 PolarHBondContact NH2-CE1 3.11Å; R148-H340 PolarHBondContact NH2-ND1 2.89Å; R148-H340 VanDerWaalsContact NH2-ND1 3.15Å; R148-E343 WeakPolarHBondContact CD-OE1 3.21Å; R148-E343 IonicContact CZ-OE1 2.83Å; R148-E343 IonicContact CZ-OE2 3.85Å; R148-E343 IonicContact NE-OE1 3.41Å; R148-E343 PolarHBondContact NE-OE1 3.46Å; R148-E343 IonicContact NE-OE2 3.38Å; R148-E343 PolarHBondContact NE-OE2 2.52Å; R148-E343 IonicContact NH2-OE1 3.23Å; R148-E343 IonicContact NH2-OE2 2.72Å; R148-E343 PolarHBondContact NH2-OE2 2.85Å
149	P	95.8	Very high	92.8	Very high	111 Å²	111	51.6 Å²	51.6	72%	0.721	30%	0.299	S	S	*	.	G	3₁₀ helix	trans	-63.7	-25.7	173.2	26	-33.8	0	0	0	113.5	Y151 A152	P149-Y151 PolarHBondContact O-N 3.48Å; P149-Y151 VanDerWaalsContact O-N 3.1Å; P149-A152 WeakPolarHBondContact O-CB 3.49Å; P149-A152 PolarHBondContact O-N 2.97Å
150	E	96	Very high	92.9	Very high	81 Å²	81	54.9 Å²	54.9	38%	0.379	31%	0.31	S	S	.	.	G	3₁₀ helix	trans	-53.2	-32.9	178.4	-61.5	92.6	104.3	0	0	113	R148 A152 S153 P305	R148-E150 WeakPolarHBondContact CB-OE2 3.33Å; R148-E150 PolarHBondContact O-N 2.64Å; E150-A152 PolarHBondContact O-N 3.2Å; E150-A152 VanDerWaalsContact O-N 3.16Å; E150-S153 WeakPolarHBondContact O-CB 3.38Å; E150-S153 PolarHBondContact O-N 3.24Å; E150-S153 PolarHBondContact O-OG 3.49Å; E150-P305 HydrophobicContact CB-CB 4.05Å; E150-P305 HydrophobicContact CB-CG 3.63Å; E150-P305 HydrophobicContact CG-CG 4.04Å
151	Y	96.5	Very high	92.8	Very high	3 Å²	3	55.2 Å²	55.2	1%	0.012	31%	0.306	C	S	.	.	G	3₁₀ helix	trans	-60.8	-22.2	178.6	-74.2	-61.1	0	0	0	114.1	F144 L145 R148 P149 S153 L154 S155 P305 V308 H309 E343	F144-Y151 AromaticContact CD2-CE1 3.98Å; F144-Y151 HydrophobicContact CD2-CE1 3.98Å; F144-Y151 HydrophobicContact CD2-CE2 4.37Å; F144-Y151 AromaticContact CD2-CZ 3.83Å; F144-Y151 HydrophobicContact CE2-CD1 4.41Å; F144-Y151 AromaticContact CE2-CE1 3.85Å; F144-Y151 HydrophobicContact CE2-CE1 3.85Å; F144-Y151 VanDerWaalsContact O-CE2 3.28Å; F144-Y151 WeakPolarHBondContact O-CE2 3.39Å; L145-Y151 HydrophobicContact CB-CG 4.5Å; L145-Y151 HydrophobicContact CD2-CD1 3.61Å; L145-Y151 HydrophobicContact CD2-CD2 4.45Å; L145-Y151 HydrophobicContact CD2-CE1 4.23Å; L145-Y151 HydrophobicContact CD2-CG 3.76Å; R148-Y151 HydrophobicContact CB-CD2 3.73Å; R148-Y151 HydrophobicContact CB-CE2 3.84Å; R148-Y151 HydrophobicContact CG-CD2 4.46Å; R148-Y151 HydrophobicContact CG-CE2 4.07Å; R148-Y151 WeakPolarHBondContact O-CD2 3.48Å; R148-Y151 PolarHBondContact O-N 2.73Å; P149-Y151 PolarHBondContact O-N 3.48Å; P149-Y151 VanDerWaalsContact O-N 3.1Å; Y151-S153 PolarHBondContact O-N 3.07Å; Y151-L154 HydrophobicContact CD1-CD1 4.24Å; Y151-L154 PolarHBondContact O-N 2.89Å; Y151-S155 WeakPolarHBondContact O-CB 3.42Å; Y151-S155 PolarHBondContact O-N 3.32Å; Y151-S155 PolarHBondContact O-OG 2.72Å; Y151-P305 HydrophobicContact CD1-CB 4.16Å; Y151-P305 HydrophobicContact CE1-CB 3.86Å; Y151-P305 WeakPolarHBondContact CE1-O 3.42Å; Y151-V308 WeakPolarHBondContact OH-CB 3.35Å; Y151-H309 HydrophobicContact CE1-CB 4.35Å; Y151-E343 WeakPolarHBondContact CE2-OE1 3.42Å; Y151-E343 PolarHBondContact OH-OE1 3.01Å
152	A	93.8	Very high	92.6	Very high	85 Å²	85	53.9 Å²	53.9	70%	0.702	30%	0.299	S	S	*	.	G	3₁₀ helix	trans	-65.1	-18.8	174.2	0	0	0	0	0	113.1	P149 E150	P149-A152 WeakPolarHBondContact O-CB 3.49Å; P149-A152 PolarHBondContact O-N 2.97Å; E150-A152 PolarHBondContact O-N 3.2Å; E150-A152 VanDerWaalsContact O-N 3.16Å
153	S	93.9	Very high	92.2	Very high	53 Å²	53	61.2 Å²	61.2	37%	0.371	33%	0.334	S	S	.	.	G	3₁₀ helix	trans	-87.1	-12.4	172.1	73.4	0	0	0	0	114.1	E150 Y151 H268	E150-S153 WeakPolarHBondContact O-CB 3.38Å; E150-S153 PolarHBondContact O-N 3.24Å; E150-S153 PolarHBondContact O-OG 3.49Å; Y151-S153 PolarHBondContact O-N 3.07Å; S153-H268 PolarHBondContact OG-ND1 3.48Å
154	L	95.1	Very high	92	Very high	0 Å²	0	64 Å²	64	0%	0	35%	0.35	C	S	.	.	T	Hydrogen-bonded Turn	trans	-113.4	-11.9	-172.3	-58.7	-178.3	0	0	0	113.3	Y151 H268 L271 L272 P305 E306 H309	Y151-L154 HydrophobicContact CD1-CD1 4.24Å; Y151-L154 PolarHBondContact O-N 2.89Å; L154-H268 HydrophobicContact CD2-CB 3.8Å; L154-H268 VanDerWaalsContact CD2-ND1 3.3Å; L154-H268 WeakPolarHBondContact CD2-ND1 3.36Å; L154-L271 HydrophobicContact CD1-CD1 4.48Å; L154-L271 HydrophobicContact CD2-CB 4.15Å; L154-L271 HydrophobicContact CD2-CD1 3.9Å; L154-L272 WeakPolarHBondContact O-CA 3.29Å; L154-L272 PolarHBondContact O-N 3.36Å; L154-P305 HydrophobicContact CD1-CB 3.76Å; L154-E306 HydrophobicContact CD1-CG 4.29Å; L154-E306 HydrophobicContact CD2-CG 4.49Å; L154-H309 HydrophobicContact CD1-CB 4.23Å; L154-H309 PolarHBondContact O-CE1 3.22Å
155	S	95.8	Very high	91.8	Very high	10 Å²	10	65.3 Å²	65.3	7%	0.07	36%	0.358	C	S	.	.			trans	-150.2	148.3	-162.5	-19.5	0	0	0	0	111.9	L145 Y151 D275 H309	L145-S155 WeakPolarHBondContact CD2-OG 3.36Å; Y151-S155 WeakPolarHBondContact O-CB 3.42Å; Y151-S155 PolarHBondContact O-N 3.32Å; Y151-S155 PolarHBondContact O-OG 2.72Å; S155-D275 WeakPolarHBondContact CA-OD2 3.44Å; S155-H309 PolarHBondContact OG-CE1 2.92Å; S155-H309 PolarHBondContact OG-ND1 3.22Å
156	L	94.6	Very high	91.5	Very high	14 Å²	14	68.3 Å²	68.3	7%	0.073	37%	0.371	C	S	.	.			trans	-88.2	120.4	164.8	-174.7	64.7	0	0	0	110.4	R142 L158 Q237 V240 W241 D275 L276	R142-L156 PolarHBondContact NH1-O 2.9Å; R142-L156 PolarHBondContact NH2-O 3.34Å; L156-L158 HydrophobicContact CD2-CD2 4.11Å; L156-L158 HydrophobicContact CG-CD2 4.42Å; L156-L158 PolarHBondContact O-N 3.16Å; L156-Q237 HydrophobicContact CD1-CG 3.96Å; L156-Q237 HydrophobicContact CD2-CG 4.29Å; L156-V240 HydrophobicContact CD2-CB 3.9Å; L156-V240 HydrophobicContact CD2-CG1 3.74Å; L156-V240 HydrophobicContact CD2-CG2 4.01Å; L156-W241 HydrophobicContact CD1-CZ2 3.77Å; L156-W241 HydrophobicContact CD2-CZ2 3.95Å; L156-W241 HydrophobicContact CG-CZ2 3.97Å; L156-D275 PolarHBondContact N-OD2 2.92Å; L156-L276 HydrophobicContact CB-CD2 3.81Å; L156-L276 HydrophobicContact CD2-CD2 3.76Å; L156-L276 HydrophobicContact CG-CD2 4.32Å
157	D	90.4	Very high	91.3	Very high	49 Å²	49	64.4 Å²	64.4	26%	0.262	35%	0.353	S	S	.	.			trans	-78.2	109.1	169.7	-174	-8.9	0	0	0	110.1	T159 Q160	D157-T159 VanDerWaalsContact CG-OG1 3.23Å; D157-T159 PolarHBondContact O-N 2.93Å; D157-T159 WeakPolarHBondContact OD1-CB 3.49Å; D157-T159 PolarHBondContact OD1-N 2.95Å; D157-T159 PolarHBondContact OD1-OG1 3.01Å; D157-T159 PolarHBondContact OD2-OG1 3.42Å; D157-T159 VanDerWaalsContact OD2-OG1 3.14Å; D157-Q160 HydrophobicContact CB-CB 4.31Å; D157-Q160 HydrophobicContact CB-CG 4.16Å; D157-Q160 PolarHBondContact O-N 2.88Å; D157-Q160 VanDerWaalsContact O-N 3.11Å; D157-Q160 PolarHBondContact OD2-NE2 3.04Å
158	L	87.8	Confident	91	Very high	80 Å²	80	67.6 Å²	67.6	42%	0.419	37%	0.371	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.8	-10.3	-179.2	-64.2	175.2	0	0	0	113.4	L156 V240 W241	L156-L158 HydrophobicContact CD2-CD2 4.11Å; L156-L158 HydrophobicContact CG-CD2 4.42Å; L156-L158 PolarHBondContact O-N 3.16Å; L158-V240 HydrophobicContact CD2-CG1 3.95Å; L158-W241 HydrophobicContact CD2-CH2 4.23Å; L158-W241 HydrophobicContact CD2-CZ3 4.16Å
159	T	84.7	Confident	90.6	Very high	104 Å²	104	72.1 Å²	72.1	64%	0.638	39%	0.394	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.2	-20.3	171.8	70	0	0	0	0	112.6	D157 R161	D157-T159 VanDerWaalsContact CG-OG1 3.23Å; D157-T159 PolarHBondContact O-N 2.93Å; D157-T159 WeakPolarHBondContact OD1-CB 3.49Å; D157-T159 PolarHBondContact OD1-N 2.95Å; D157-T159 PolarHBondContact OD1-OG1 3.01Å; D157-T159 PolarHBondContact OD2-OG1 3.42Å; D157-T159 VanDerWaalsContact OD2-OG1 3.14Å; T159-R161 VanDerWaalsContact C-N 3.31Å; T159-R161 PolarHBondContact O-N 3.38Å
160	Q	85.3	Confident	90.2	Very high	144 Å²	144	67.2 Å²	67.2	67%	0.673	36%	0.362	S	S	*	.	S	Bend	trans	-94.7	48.7	177.8	-62.3	179.8	51	0	0	111.2	D157	D157-Q160 HydrophobicContact CB-CB 4.31Å; D157-Q160 HydrophobicContact CB-CG 4.16Å; D157-Q160 PolarHBondContact O-N 2.88Å; D157-Q160 VanDerWaalsContact O-N 3.11Å; D157-Q160 PolarHBondContact OD2-NE2 3.04Å
161	R	85.1	Confident	89.9	Confident	74 Å²	74	65.8 Å²	65.8	28%	0.279	36%	0.356	S	S	.	.	P	Polyproline II helix	trans	-62.7	137	173.5	-170.6	167.5	-173.1	143.8	-0.9	109.4	T159 W241 E243	T159-R161 VanDerWaalsContact C-N 3.31Å; T159-R161 PolarHBondContact O-N 3.38Å; R161-W241 VanDerWaalsContact CA-CH2 3.42Å; R161-W241 HydrophobicContact CB-CE3 4.13Å; R161-W241 HydrophobicContact CB-CH2 3.79Å; R161-W241 HydrophobicContact CB-CZ3 3.55Å; R161-W241 HydrophobicContact CG-CD2 4.28Å; R161-W241 HydrophobicContact CG-CE3 3.63Å; R161-W241 HydrophobicContact CG-CH2 4.21Å; R161-W241 HydrophobicContact CG-CZ3 3.6Å; R161-W241 PolarHBondContact NH2-O 3.01Å; R161-E243 IonicContact CZ-OE1 2.71Å; R161-E243 VanDerWaalsContact CZ-OE1 3.26Å; R161-E243 IonicContact NH1-OE1 2.79Å; R161-E243 PolarHBondContact NH1-OE1 3.17Å; R161-E243 IonicContact NH2-OE1 2.73Å; R161-E243 PolarHBondContact NH2-OE1 3.44Å
162	P	85.2	Confident	89.7	Confident	41 Å²	41	68.6 Å²	68.6	27%	0.266	38%	0.375	S	S	.	.	P	Polyproline II helix	trans	-51.6	149	172.2	-28	35.7	0	0	0	112	P164 K198	P162-P164 WeakPolarHBondContact O-CD 3.3Å; P162-K198 HydrophobicContact CB-CB 4.44Å; P162-K198 HydrophobicContact CB-CG 3.94Å
163	Q	86.5	Confident	89.6	Confident	175 Å²	175	65.7 Å²	65.7	82%	0.818	35%	0.347	S	S	*	.	P	Polyproline II helix	trans	-54.5	125.1	178.5	-73.8	-175.6	-18.8	0	0	110.3	V165	Q163-V165 PolarHBondContact O-N 3.17Å
164	P	88.6	Confident	89.5	Confident	81 Å²	81	63.2 Å²	63.2	53%	0.526	33%	0.33	S	S	.	.	P	Polyproline II helix	trans	-61	132.6	-177.8	-26.8	35.8	0	0	0	112.8	P162 K198 H200	P162-P164 WeakPolarHBondContact O-CD 3.3Å; P164-K198 CarbonylContact C-O 3.59Å; P164-K198 VanDerWaalsContact CA-O 3.29Å; P164-K198 WeakPolarHBondContact CA-O 3.44Å; P164-H200 HydrophobicContact CB-CB 4.35Å
165	V	91.3	Very high	89.3	Confident	29 Å²	29	68.6 Å²	68.6	18%	0.176	36%	0.355	C	S	.	.	B	Isolated β-bridge	trans	-107.8	139.7	175.6	178.9	0	0	0	0	109.2	Q163 E169 L170 K198 H200	Q163-V165 PolarHBondContact O-N 3.17Å; V165-E169 HydrophobicContact CG1-CB 3.82Å; V165-L170 HydrophobicContact CB-CD1 4.25Å; V165-L170 HydrophobicContact CB-CG 4.47Å; V165-L170 HydrophobicContact CG1-CD1 4.11Å; V165-L170 HydrophobicContact CG1-CD2 4.06Å; V165-L170 HydrophobicContact CG1-CG 3.8Å; V165-K198 HydrophobicContact CB-CB 4.26Å; V165-K198 HydrophobicContact CG2-CB 3.73Å; V165-K198 HydrophobicContact CG2-CD 4.21Å; V165-K198 PolarHBondContact N-O 3.27Å; V165-H200 PolarHBondContact O-N 3.06Å
166	E	89.8	Confident	89.1	Confident	91 Å²	91	73.9 Å²	73.9	43%	0.425	38%	0.377	S	S	.	.			trans	-74.1	150.7	-179.2	-88.7	-57.6	149.7	0	0	113.6	V168 E169 L170	E166-V168 PolarHBondContact O-N 3.25Å; E166-V168 VanDerWaalsContact O-N 3.16Å; E166-E169 PolarHBondContact O-N 3.37Å; E166-E169 VanDerWaalsContact O-N 3.08Å; E166-L170 PolarHBondContact O-N 3.42Å
167	W	89.5	Confident	88.9	Confident	48 Å²	48	73.2 Å²	73.2	18%	0.182	37%	0.373	C	S	.	.	H	α-helix	trans	-57.5	-35.2	-176.6	174.5	-104.9	0	0	0	112.9	E169 L170 L171 L174 L199 K203 L206 L207	W167-E169 VanDerWaalsContact C-N 3.31Å; W167-E169 PolarHBondContact O-N 2.83Å; W167-L170 PolarHBondContact O-N 3.18Å; W167-L171 HydrophobicContact CZ2-CD2 3.86Å; W167-L171 PolarHBondContact O-N 3.35Å; W167-L171 VanDerWaalsContact O-N 3.13Å; W167-L174 HydrophobicContact CH2-CD1 3.8Å; W167-L174 HydrophobicContact CZ2-CD1 4.48Å; W167-L174 HydrophobicContact CZ3-CD1 4.13Å; W167-L199 HydrophobicContact CB-CD1 4.29Å; W167-L199 HydrophobicContact CE3-CD1 4Å; W167-L199 HydrophobicContact CE3-CD2 3.97Å; W167-L199 HydrophobicContact CZ3-CD2 4.14Å; W167-K203 HydrophobicContact CB-CG 4.27Å; W167-L206 HydrophobicContact CH2-CB 4.32Å; W167-L206 HydrophobicContact CZ3-CB 4.45Å; W167-L207 HydrophobicContact CZ3-CB 4Å; W167-L207 HydrophobicContact CZ3-CD1 4.13Å
168	V	89.6	Confident	88.9	Confident	107 Å²	107	73.3 Å²	73.3	65%	0.648	38%	0.377	S	S	*	.	H	α-helix	trans	-63.8	-35.7	-179.5	-177.3	0	0	0	0	111.9	E166 L170 P172	E166-V168 PolarHBondContact O-N 3.25Å; E166-V168 VanDerWaalsContact O-N 3.16Å; V168-L170 VanDerWaalsContact C-N 3.34Å; V168-P172 WeakPolarHBondContact O-CD 3.38Å
169	E	87.8	Confident	89	Confident	135 Å²	135	75.1 Å²	75.1	63%	0.631	39%	0.392	S	S	*	.	H	α-helix	trans	-75	-25.7	-179	-64.3	175.3	-143.5	0	0	112.4	V165 E166 W167 P172	V165-E169 HydrophobicContact CG1-CB 3.82Å; E166-E169 PolarHBondContact O-N 3.37Å; E166-E169 VanDerWaalsContact O-N 3.08Å; W167-E169 VanDerWaalsContact C-N 3.31Å; W167-E169 PolarHBondContact O-N 2.83Å; E169-P172 WeakPolarHBondContact O-CD 3.25Å
170	L	88.1	Confident	89.2	Confident	8 Å²	8	72.9 Å²	72.9	4%	0.042	38%	0.375	C	S	.	.	H	α-helix	trans	-92	-13.3	178.5	-62.9	175.4	0	0	0	113.6	V165 E166 W167 V168 L173 L174 L196 L199	V165-L170 HydrophobicContact CB-CD1 4.25Å; V165-L170 HydrophobicContact CB-CG 4.47Å; V165-L170 HydrophobicContact CG1-CD1 4.11Å; V165-L170 HydrophobicContact CG1-CD2 4.06Å; V165-L170 HydrophobicContact CG1-CG 3.8Å; E166-L170 PolarHBondContact O-N 3.42Å; W167-L170 PolarHBondContact O-N 3.18Å; V168-L170 VanDerWaalsContact C-N 3.34Å; L170-L173 HydrophobicContact CD2-CD2 4.1Å; L170-L173 WeakPolarHBondContact O-CA 3.37Å; L170-L173 VanDerWaalsContact O-CB 3.24Å; L170-L173 WeakPolarHBondContact O-CB 3.43Å; L170-L173 PolarHBondContact O-N 2.86Å; L170-L174 PolarHBondContact O-N 3.36Å; L170-L174 VanDerWaalsContact O-N 3.1Å; L170-L196 HydrophobicContact CB-CD2 4.17Å; L170-L196 HydrophobicContact CD1-CD2 4.34Å; L170-L199 HydrophobicContact CD1-CB 3.75Å; L170-L199 HydrophobicContact CD1-CD1 3.85Å; L170-L199 HydrophobicContact CD1-CG 4.35Å
171	L	88.3	Confident	89.3	Confident	51 Å²	51	74.3 Å²	74.3	27%	0.267	38%	0.375	S	S	.	.	H	α-helix	trans	-57.2	-44.1	173.4	-82.6	175.6	0	0	0	113.8	W167 L173 L174 Q175	W167-L171 HydrophobicContact CZ2-CD2 3.86Å; W167-L171 PolarHBondContact O-N 3.35Å; W167-L171 VanDerWaalsContact O-N 3.13Å; L171-L173 PolarHBondContact O-N 2.98Å; L171-L174 PolarHBondContact O-N 2.84Å; L171-Q175 WeakPolarHBondContact O-CG 3.28Å; L171-Q175 PolarHBondContact O-N 2.96Å
172	P	92.5	Very high	89.3	Confident	62 Å²	62	73.7 Å²	73.7	40%	0.403	39%	0.391	S	S	.	.	H	α-helix	trans	-60.7	-29.6	171.9	-25.4	34.9	0	0	0	113.7	V168 E169 Q175 K176	V168-P172 WeakPolarHBondContact O-CD 3.38Å; E169-P172 WeakPolarHBondContact O-CD 3.25Å; P172-Q175 PolarHBondContact O-N 3.43Å; P172-K176 WeakPolarHBondContact O-CG 3.46Å; P172-K176 PolarHBondContact O-N 2.63Å
173	L	91.6	Very high	89.5	Confident	24 Å²	24	81.4 Å²	81.4	13%	0.126	42%	0.415	C	S	.	.	H	α-helix	trans	-69.9	-47.1	177.5	-161.2	73.9	0	0	0	110.9	L170 L171 Q175 K176 V177 F192 E195 L196	L170-L173 HydrophobicContact CD2-CD2 4.1Å; L170-L173 WeakPolarHBondContact O-CA 3.37Å; L170-L173 VanDerWaalsContact O-CB 3.24Å; L170-L173 WeakPolarHBondContact O-CB 3.43Å; L170-L173 PolarHBondContact O-N 2.86Å; L171-L173 PolarHBondContact O-N 2.98Å; L173-Q175 VanDerWaalsContact C-N 3.26Å; L173-Q175 PolarHBondContact O-N 3.27Å; L173-K176 WeakPolarHBondContact O-CB 3.48Å; L173-K176 PolarHBondContact O-N 2.8Å; L173-K176 VanDerWaalsContact O-N 3.07Å; L173-V177 PolarHBondContact O-N 3.33Å; L173-F192 HydrophobicContact CD1-CD1 3.6Å; L173-F192 HydrophobicContact CD1-CE1 3.79Å; L173-F192 HydrophobicContact CD2-CD1 4.32Å; L173-F192 HydrophobicContact CG-CD1 3.79Å; L173-F192 HydrophobicContact CG-CE1 4.31Å; L173-E195 HydrophobicContact CD2-CB 3.53Å; L173-E195 HydrophobicContact CD2-CG 4.45Å; L173-L196 HydrophobicContact CD2-CD2 4.18Å; L173-L196 HydrophobicContact CD2-CG 4.02Å
174	L	91.3	Very high	89.7	Confident	0 Å²	0	73.6 Å²	73.6	0%	0	38%	0.379	C	S	.	.	H	α-helix	trans	-64.4	-30.8	173.9	-64.9	170.9	0	0	0	112.1	W167 L170 L171 V177 S178 L196 L207 R212 F213	W167-L174 HydrophobicContact CH2-CD1 3.8Å; W167-L174 HydrophobicContact CZ2-CD1 4.48Å; W167-L174 HydrophobicContact CZ3-CD1 4.13Å; L170-L174 PolarHBondContact O-N 3.36Å; L170-L174 VanDerWaalsContact O-N 3.1Å; L171-L174 PolarHBondContact O-N 2.84Å; L174-V177 PolarHBondContact O-N 3.32Å; L174-S178 PolarHBondContact O-N 3.17Å; L174-S178 PolarHBondContact O-OG 3.43Å; L174-L196 HydrophobicContact CD2-CD1 3.82Å; L174-L196 HydrophobicContact CD2-CD2 3.96Å; L174-L196 HydrophobicContact CG-CD2 4.11Å; L174-L207 HydrophobicContact CD1-CD1 4Å; L174-L207 HydrophobicContact CD2-CD1 4.01Å; L174-R212 HydrophobicContact CB-CB 4.36Å; L174-R212 HydrophobicContact CD2-CB 4.39Å; L174-R212 WeakPolarHBondContact O-CD 3.37Å; L174-F213 HydrophobicContact CD2-CB 4.47Å
175	Q	91.6	Very high	89.9	Confident	114 Å²	114	76.4 Å²	76.4	53%	0.533	38%	0.382	S	S	.	.	H	α-helix	trans	-64.6	-43.9	169	-72.3	171.8	-5.6	0	0	111.7	L171 P172 L173 V177 S178 V179	L171-Q175 WeakPolarHBondContact O-CG 3.28Å; L171-Q175 PolarHBondContact O-N 2.96Å; P172-Q175 PolarHBondContact O-N 3.43Å; L173-Q175 VanDerWaalsContact C-N 3.26Å; L173-Q175 PolarHBondContact O-N 3.27Å; Q175-V177 VanDerWaalsContact C-N 3.33Å; Q175-V177 PolarHBondContact O-N 2.7Å; Q175-S178 WeakPolarHBondContact O-CA 3.39Å; Q175-S178 VanDerWaalsContact O-CB 3.25Å; Q175-S178 WeakPolarHBondContact O-CB 3.36Å; Q175-S178 PolarHBondContact O-N 3Å; Q175-V179 PolarHBondContact O-N 2.82Å
176	K	91	Very high	90	Very high	121 Å²	121	76.4 Å²	76.4	53%	0.526	38%	0.383	S	S	.	.	H	α-helix	trans	-59	-40.7	173.9	-71.4	169.4	-177.1	176.9	0	112.6	P172 L173 S178 V179 L180 F192	P172-K176 WeakPolarHBondContact O-CG 3.46Å; P172-K176 PolarHBondContact O-N 2.63Å; L173-K176 WeakPolarHBondContact O-CB 3.48Å; L173-K176 PolarHBondContact O-N 2.8Å; L173-K176 VanDerWaalsContact O-N 3.07Å; K176-S178 PolarHBondContact O-N 3.25Å; K176-V179 PolarHBondContact O-N 2.57Å; K176-V179 VanDerWaalsContact O-N 3.14Å; K176-L180 WeakPolarHBondContact O-CB 3.38Å; K176-L180 WeakPolarHBondContact O-CG 3.13Å; K176-L180 PolarHBondContact O-N 3.27Å; K176-F192 HydrophobicContact CB-CE1 4.41Å; K176-F192 HydrophobicContact CB-CZ 4.24Å
177	V	91.5	Very high	90.2	Very high	0 Å²	0	74.8 Å²	74.8	0%	0	39%	0.385	C	S	.	.	H	α-helix	trans	-56.5	-34.2	172.3	174.6	0	0	0	0	111.7	L173 L174 Q175 M184 F192 R212 M215 L216	L173-V177 PolarHBondContact O-N 3.33Å; L174-V177 PolarHBondContact O-N 3.32Å; Q175-V177 VanDerWaalsContact C-N 3.33Å; Q175-V177 PolarHBondContact O-N 2.7Å; V177-M184 HydrophobicContact CG1-CE 4.07Å; V177-M184 HydrophobicContact CG1-SD 4.24Å; V177-M184 WeakPolarHBondContact O-CE 3.21Å; V177-F192 HydrophobicContact CG2-CB 4.22Å; V177-F192 HydrophobicContact CG2-CD1 4.44Å; V177-F192 HydrophobicContact CG2-CD2 3.5Å; V177-F192 HydrophobicContact CG2-CE2 3.91Å; V177-F192 HydrophobicContact CG2-CG 3.81Å; V177-R212 WeakPolarHBondContact CG1-O 3.46Å; V177-M215 HydrophobicContact CG1-CE 3.85Å; V177-M215 WeakPolarHBondContact O-CE 3.43Å; V177-L216 HydrophobicContact CG1-CB 4.26Å; V177-L216 HydrophobicContact CG2-CD1 4.37Å
178	S	89.6	Confident	90.4	Very high	50 Å²	50	74.8 Å²	74.8	35%	0.35	39%	0.389	S	S	.	.	H	α-helix	trans	-74.1	-41.4	176.7	-49.8	0	0	0	0	112.4	L174 Q175 K176 R181 R212	L174-S178 PolarHBondContact O-N 3.17Å; L174-S178 PolarHBondContact O-OG 3.43Å; Q175-S178 WeakPolarHBondContact O-CA 3.39Å; Q175-S178 VanDerWaalsContact O-CB 3.25Å; Q175-S178 WeakPolarHBondContact O-CB 3.36Å; Q175-S178 PolarHBondContact O-N 3Å; K176-S178 PolarHBondContact O-N 3.25Å; S178-R181 WeakPolarHBondContact O-CB 3.21Å; S178-R181 PolarHBondContact O-N 2.85Å; S178-R212 WeakPolarHBondContact OG-CD 3.36Å; S178-R212 WeakPolarHBondContact OG-CG 3.43Å
179	V	91.1	Very high	90.7	Very high	119 Å²	119	69.7 Å²	69.7	72%	0.721	36%	0.358	S	S	*	.	H	α-helix	trans	-67.5	-34.6	178	174.8	0	0	0	0	112.1	Q175 K176 R181	Q175-V179 PolarHBondContact O-N 2.82Å; K176-V179 PolarHBondContact O-N 2.57Å; K176-V179 VanDerWaalsContact O-N 3.14Å; V179-R181 VanDerWaalsContact C-N 3.33Å
180	L	89.1	Confident	91.1	Very high	56 Å²	56	64 Å²	64	29%	0.293	33%	0.332	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.7	12.3	179.8	-61.3	174.9	0	0	0	113.9	K176 G182 R183 M184 F192	K176-L180 WeakPolarHBondContact O-CB 3.38Å; K176-L180 WeakPolarHBondContact O-CG 3.13Å; K176-L180 PolarHBondContact O-N 3.27Å; L180-G182 PolarHBondContact O-N 3.14Å; L180-R183 CarbonylContact O-C 3.55Å; L180-R183 PolarHBondContact O-N 2.87Å; L180-M184 HydrophobicContact CB-CG 3.6Å; L180-M184 HydrophobicContact CD1-CG 4.42Å; L180-M184 PolarHBondContact O-N 2.97Å; L180-F192 HydrophobicContact CD1-CE2 4.04Å; L180-F192 HydrophobicContact CD1-CZ 3.8Å
181	R	87	Confident	91.4	Very high	175 Å²	175	68 Å²	68	66%	0.66	35%	0.35	S	S	*	.	T	Hydrogen-bonded Turn	trans	-50.4	127.1	172.8	172.2	179.6	-88.6	-162.8	-5.1	110.4	S178 V179 R183 M215	S178-R181 WeakPolarHBondContact O-CB 3.21Å; S178-R181 PolarHBondContact O-N 2.85Å; V179-R181 VanDerWaalsContact C-N 3.33Å; R181-R183 PolarHBondContact O-N 3.48Å; R181-M215 HydrophobicContact CB-CE 4.24Å; R181-M215 HydrophobicContact CB-SD 4.37Å; R181-M215 HydrophobicContact CG-SD 4.2Å; R181-M215 PolarHBondContact NE-SD 3.28Å; R181-M215 PolarHBondContact NH2-SD 3.22Å; R181-M215 VanDerWaalsContact NH2-SD 3.45Å
182	G	84.1	Confident	91.8	Very high	60 Å²	60	66.4 Å²	66.4	62%	0.619	34%	0.341	S	S	*	.	T	Hydrogen-bonded Turn	trans	71	7.3	-177.8	0	0	0	0	0	115.5	L180 Y219	L180-G182 PolarHBondContact O-N 3.14Å; G182-Y219 PolarHBondContact N-OH 2.84Å
183	R	90	Very high	91.9	Very high	204 Å²	204	63.4 Å²	63.4	77%	0.77	32%	0.322	S	S	*	.	T	Hydrogen-bonded Turn	trans	-135.2	-5	-179.5	-63.8	-173.7	-179.9	-177.4	0.8	114.7	L180 R181	L180-R183 CarbonylContact O-C 3.55Å; L180-R183 PolarHBondContact O-N 2.87Å; R181-R183 PolarHBondContact O-N 3.48Å
184	M	91.7	Very high	92.1	Very high	11 Å²	11	64.5 Å²	64.5	5%	0.054	33%	0.327	C	S	.	.			trans	-57.7	141.1	173.3	-81.4	175.6	-86.6	0	0	111.3	V177 L180 D188 V189 F192 M215 L216 Y219 H223	V177-M184 HydrophobicContact CG1-CE 4.07Å; V177-M184 HydrophobicContact CG1-SD 4.24Å; V177-M184 WeakPolarHBondContact O-CE 3.21Å; L180-M184 HydrophobicContact CB-CG 3.6Å; L180-M184 HydrophobicContact CD1-CG 4.42Å; L180-M184 PolarHBondContact O-N 2.97Å; M184-D188 HydrophobicContact CB-CB 4.48Å; M184-D188 HydrophobicContact CG-CB 4.32Å; M184-V189 HydrophobicContact CB-CG2 4.1Å; M184-V189 HydrophobicContact SD-CG2 4.22Å; M184-F192 HydrophobicContact CG-CE2 4.25Å; M184-F192 HydrophobicContact SD-CD2 4.12Å; M184-F192 HydrophobicContact SD-CE2 3.98Å; M184-M215 HydrophobicContact CE-CE 4.34Å; M184-L216 HydrophobicContact SD-CD1 4.32Å; M184-Y219 HydrophobicContact CE-CD2 3.31Å; M184-Y219 HydrophobicContact CE-CE2 3.41Å; M184-Y219 VanDerWaalsContact CE-CE2 3.41Å; M184-Y219 HydrophobicContact CE-CG 4.1Å; M184-Y219 HydrophobicContact SD-CD2 4.28Å; M184-H223 PolarHBondContact O-NE2 3.5Å
185	K	92.8	Very high	92.2	Very high	139 Å²	139	67 Å²	67	60%	0.604	34%	0.339	S	S	*	.			trans	-99.1	163.5	169.2	-59.4	172.2	-176.3	173.6	0	109.2	A187 D188 V189	K185-A187 PolarHBondContact O-N 2.93Å; K185-D188 WeakPolarHBondContact CB-OD2 3.44Å; K185-D188 PolarHBondContact N-OD2 2.97Å; K185-D188 WeakPolarHBondContact O-CB 3.38Å; K185-D188 PolarHBondContact O-N 3.12Å; K185-V189 PolarHBondContact O-N 2.76Å; K185-V189 VanDerWaalsContact O-N 3.17Å
186	P	92.9	Very high	92.4	Very high	29 Å²	29	61.6 Å²	61.6	19%	0.188	31%	0.314	C	S	.	.	H	α-helix	trans	-52.8	-42	174.2	-23.9	31.7	0	0	0	112.7	D188 V189 L190 H223 L226 F227	P186-D188 PolarHBondContact O-N 3.39Å; P186-V189 PolarHBondContact O-N 3.48Å; P186-L190 WeakPolarHBondContact O-CB 3.45Å; P186-L190 PolarHBondContact O-N 3.26Å; P186-H223 HydrophobicContact CB-CB 4.24Å; P186-H223 HydrophobicContact CG-CB 4.02Å; P186-L226 HydrophobicContact CG-CB 3.71Å; P186-L226 HydrophobicContact CG-CD1 4.03Å; P186-F227 HydrophobicContact CB-CD1 3.95Å; P186-F227 HydrophobicContact CB-CE1 3.75Å; P186-F227 HydrophobicContact CB-CZ 4.38Å; P186-F227 VanDerWaalsContact O-CE1 3.3Å; P186-F227 WeakPolarHBondContact O-CE1 3.47Å
187	A	93.8	Very high	92.5	Very high	57 Å²	57	56.1 Å²	56.1	47%	0.471	29%	0.291	S	S	.	.	H	α-helix	trans	-62.1	-37.4	177.2	0	0	0	0	0	113.6	K185 Q191	K185-A187 PolarHBondContact O-N 2.93Å; A187-Q191 WeakPolarHBondContact O-CB 3.36Å; A187-Q191 PolarHBondContact O-N 3.21Å
188	D	93.9	Very high	92.6	Very high	49 Å²	49	59 Å²	59	26%	0.262	30%	0.303	S	S	.	.	H	α-helix	trans	-65.9	-44.3	176.9	-53.7	-43	0	0	0	109.9	M184 K185 P186 Q191 F192	M184-D188 HydrophobicContact CB-CB 4.48Å; M184-D188 HydrophobicContact CG-CB 4.32Å; K185-D188 WeakPolarHBondContact CB-OD2 3.44Å; K185-D188 PolarHBondContact N-OD2 2.97Å; K185-D188 WeakPolarHBondContact O-CB 3.38Å; K185-D188 PolarHBondContact O-N 3.12Å; P186-D188 PolarHBondContact O-N 3.39Å; D188-Q191 PolarHBondContact O-N 3.37Å; D188-F192 HydrophobicContact CB-CD2 4.45Å; D188-F192 HydrophobicContact CB-CE2 3.94Å; D188-F192 HydrophobicContact CB-CZ 4.4Å; D188-F192 WeakPolarHBondContact O-CB 3.49Å; D188-F192 WeakPolarHBondContact O-CD2 3.44Å; D188-F192 WeakPolarHBondContact O-CG 3.27Å; D188-F192 PolarHBondContact O-N 3.34Å
189	V	95	Very high	92.7	Very high	0 Å²	0	56.6 Å²	56.6	0%	0	29%	0.287	C	S	.	.	H	α-helix	trans	-63	-45.3	178.9	174.6	0	0	0	0	111.9	M184 K185 P186 F192 L193 L216 F227	M184-V189 HydrophobicContact CB-CG2 4.1Å; M184-V189 HydrophobicContact SD-CG2 4.22Å; K185-V189 PolarHBondContact O-N 2.76Å; K185-V189 VanDerWaalsContact O-N 3.17Å; P186-V189 PolarHBondContact O-N 3.48Å; V189-F192 PolarHBondContact O-N 2.73Å; V189-L193 HydrophobicContact CG1-CD1 3.99Å; V189-L193 WeakPolarHBondContact O-CG 3.24Å; V189-L193 PolarHBondContact O-N 3.49Å; V189-L216 HydrophobicContact CB-CD1 4.2Å; V189-L216 HydrophobicContact CG1-CD1 3.88Å; V189-L216 HydrophobicContact CG2-CD1 4.16Å; V189-F227 HydrophobicContact CB-CZ 4.42Å; V189-F227 HydrophobicContact CG1-CZ 4.21Å
190	L	95.7	Very high	92.6	Very high	14 Å²	14	53.7 Å²	53.7	7%	0.073	27%	0.265	C	S	.	.	H	α-helix	trans	-58.7	-50	174.7	172.2	62.9	0	0	0	111.1	P186 F192 L193 L194 F227 Q231 E234 V235	P186-L190 WeakPolarHBondContact O-CB 3.45Å; P186-L190 PolarHBondContact O-N 3.26Å; L190-F192 VanDerWaalsContact C-N 3.32Å; L190-F192 PolarHBondContact O-N 3.21Å; L190-L193 PolarHBondContact O-N 2.93Å; L190-L194 HydrophobicContact CD1-CD1 3.78Å; L190-L194 HydrophobicContact CD1-CG 4.03Å; L190-L194 HydrophobicContact CG-CD1 3.85Å; L190-L194 HydrophobicContact CG-CG 4.49Å; L190-L194 WeakPolarHBondContact O-CB 3.34Å; L190-L194 WeakPolarHBondContact O-CG 3.42Å; L190-L194 PolarHBondContact O-N 3.1Å; L190-F227 HydrophobicContact CB-CE1 4.13Å; L190-Q231 HydrophobicContact CD2-CB 4.17Å; L190-Q231 HydrophobicContact CD2-CG 3.74Å; L190-E234 HydrophobicContact CD1-CB 3.73Å; L190-V235 HydrophobicContact CD1-CG2 3.81Å
191	Q	95.7	Very high	92.5	Very high	94 Å²	94	53 Å²	53	44%	0.439	26%	0.264	S	S	.	.	H	α-helix	trans	-61.2	-41	179.3	-170.8	65.4	45.7	0	0	111.8	A187 D188 L194 E195	A187-Q191 WeakPolarHBondContact O-CB 3.36Å; A187-Q191 PolarHBondContact O-N 3.21Å; D188-Q191 PolarHBondContact O-N 3.37Å; Q191-L194 PolarHBondContact O-N 3.18Å; Q191-E195 HydrophobicContact CG-CG 4.49Å; Q191-E195 PolarHBondContact NE2-OE1 2.89Å; Q191-E195 WeakPolarHBondContact O-CB 3.41Å; Q191-E195 WeakPolarHBondContact O-CG 3.38Å; Q191-E195 PolarHBondContact O-N 2.95Å
192	F	95.8	Very high	92.6	Very high	16 Å²	16	50.2 Å²	50.2	7%	0.07	26%	0.262	C	S	.	.	H	α-helix	trans	-66.1	-40	177	-62.3	-33.8	0	0	0	112.4	L173 K176 V177 L180 M184 D188 V189 L190 L196 L216	L173-F192 HydrophobicContact CD1-CD1 3.6Å; L173-F192 HydrophobicContact CD1-CE1 3.79Å; L173-F192 HydrophobicContact CD2-CD1 4.32Å; L173-F192 HydrophobicContact CG-CD1 3.79Å; L173-F192 HydrophobicContact CG-CE1 4.31Å; K176-F192 HydrophobicContact CB-CE1 4.41Å; K176-F192 HydrophobicContact CB-CZ 4.24Å; V177-F192 HydrophobicContact CG2-CB 4.22Å; V177-F192 HydrophobicContact CG2-CD1 4.44Å; V177-F192 HydrophobicContact CG2-CD2 3.5Å; V177-F192 HydrophobicContact CG2-CE2 3.91Å; V177-F192 HydrophobicContact CG2-CG 3.81Å; L180-F192 HydrophobicContact CD1-CE2 4.04Å; L180-F192 HydrophobicContact CD1-CZ 3.8Å; M184-F192 HydrophobicContact CG-CE2 4.25Å; M184-F192 HydrophobicContact SD-CD2 4.12Å; M184-F192 HydrophobicContact SD-CE2 3.98Å; D188-F192 HydrophobicContact CB-CD2 4.45Å; D188-F192 HydrophobicContact CB-CE2 3.94Å; D188-F192 HydrophobicContact CB-CZ 4.4Å; D188-F192 WeakPolarHBondContact O-CB 3.49Å; D188-F192 WeakPolarHBondContact O-CD2 3.44Å; D188-F192 WeakPolarHBondContact O-CG 3.27Å; D188-F192 PolarHBondContact O-N 3.34Å; V189-F192 PolarHBondContact O-N 2.73Å; L190-F192 VanDerWaalsContact C-N 3.32Å; L190-F192 PolarHBondContact O-N 3.21Å; F192-L196 VanDerWaalsContact O-CB 3.28Å; F192-L196 WeakPolarHBondContact O-CB 3.18Å; F192-L196 WeakPolarHBondContact O-CD1 3.26Å; F192-L196 WeakPolarHBondContact O-CG 3.14Å; F192-L196 PolarHBondContact O-N 3.16Å; F192-L216 HydrophobicContact CB-CD1 3.88Å; F192-L216 HydrophobicContact CB-CD2 3.72Å; F192-L216 HydrophobicContact CB-CG 4.48Å; F192-L216 HydrophobicContact CD2-CD1 3.99Å; F192-L216 HydrophobicContact CG-CD1 4.45Å
193	L	95.9	Very high	92.9	Very high	0 Å²	0	50.7 Å²	50.7	0%	0	25%	0.247	C	C	.	.	H	α-helix	trans	-66.7	-42.1	175.4	-70.7	169.8	0	0	0	111.8	V189 L190 L196 S197 F213 L216 L217 V235 F239 L242	V189-L193 HydrophobicContact CG1-CD1 3.99Å; V189-L193 WeakPolarHBondContact O-CG 3.24Å; V189-L193 PolarHBondContact O-N 3.49Å; L190-L193 PolarHBondContact O-N 2.93Å; L193-L196 PolarHBondContact O-N 3.15Å; L193-S197 WeakPolarHBondContact O-CB 3.36Å; L193-S197 PolarHBondContact O-N 3.38Å; L193-F213 HydrophobicContact CD2-CE2 4.2Å; L193-L216 HydrophobicContact CD2-CD2 3.67Å; L193-L216 HydrophobicContact CD2-CG 4.01Å; L193-L216 HydrophobicContact CG-CD2 3.9Å; L193-L216 HydrophobicContact CG-CG 4.12Å; L193-L217 HydrophobicContact CD2-CD2 4.17Å; L193-V235 HydrophobicContact CD1-CG1 3.86Å; L193-V235 HydrophobicContact CD1-CG2 4.12Å; L193-F239 HydrophobicContact CD1-CE1 4.24Å; L193-F239 HydrophobicContact CD2-CE1 4.36Å; L193-L242 HydrophobicContact CD2-CD1 3.86Å
194	L	94.4	Very high	92.9	Very high	46 Å²	46	41.1 Å²	41.1	24%	0.241	21%	0.211	C	C	.	.	H	α-helix	trans	-62.6	-45.3	176.8	-76.1	168.8	0	0	0	112.5	L190 Q191 S197 S238	L190-L194 HydrophobicContact CD1-CD1 3.78Å; L190-L194 HydrophobicContact CD1-CG 4.03Å; L190-L194 HydrophobicContact CG-CD1 3.85Å; L190-L194 HydrophobicContact CG-CG 4.49Å; L190-L194 WeakPolarHBondContact O-CB 3.34Å; L190-L194 WeakPolarHBondContact O-CG 3.42Å; L190-L194 PolarHBondContact O-N 3.1Å; Q191-L194 PolarHBondContact O-N 3.18Å; L194-S197 WeakPolarHBondContact O-CB 3.05Å; L194-S197 PolarHBondContact O-N 3.24Å; L194-S197 PolarHBondContact O-OG 3.48Å; L194-S238 WeakPolarHBondContact CD2-OG 3.5Å
195	E	94.3	Very high	92.9	Very high	54 Å²	54	44.5 Å²	44.5	25%	0.252	23%	0.234	S	C	.	.	H	α-helix	trans	-69.9	-40.7	177.9	-68.3	-54.2	131.1	0	0	112.3	L173 Q191 S197 K198	L173-E195 HydrophobicContact CD2-CB 3.53Å; L173-E195 HydrophobicContact CD2-CG 4.45Å; Q191-E195 HydrophobicContact CG-CG 4.49Å; Q191-E195 PolarHBondContact NE2-OE1 2.89Å; Q191-E195 WeakPolarHBondContact O-CB 3.41Å; Q191-E195 WeakPolarHBondContact O-CG 3.38Å; Q191-E195 PolarHBondContact O-N 2.95Å; E195-S197 PolarHBondContact O-N 3.2Å; E195-K198 WeakPolarHBondContact O-CB 3.25Å; E195-K198 PolarHBondContact O-N 3.35Å; E195-K198 IonicContact OE1-NZ 2.7Å; E195-K198 PolarHBondContact OE1-NZ 2.87Å; E195-K198 WeakPolarHBondContact OE2-CE 3.41Å; E195-K198 IonicContact OE2-NZ 3.37Å; E195-K198 PolarHBondContact OE2-NZ 3.19Å
196	L	94.4	Very high	92.8	Very high	0 Å²	0	42.3 Å²	42.3	0%	0	23%	0.228	C	C	.	.	H	α-helix	trans	-65.6	-27.4	174.6	-69.4	171.3	0	0	0	112.7	L170 L173 L174 F192 L193 K198 L199 L207 F213 L216 L242	L170-L196 HydrophobicContact CB-CD2 4.17Å; L170-L196 HydrophobicContact CD1-CD2 4.34Å; L173-L196 HydrophobicContact CD2-CD2 4.18Å; L173-L196 HydrophobicContact CD2-CG 4.02Å; L174-L196 HydrophobicContact CD2-CD1 3.82Å; L174-L196 HydrophobicContact CD2-CD2 3.96Å; L174-L196 HydrophobicContact CG-CD2 4.11Å; F192-L196 VanDerWaalsContact O-CB 3.28Å; F192-L196 WeakPolarHBondContact O-CB 3.18Å; F192-L196 WeakPolarHBondContact O-CD1 3.26Å; F192-L196 WeakPolarHBondContact O-CG 3.14Å; F192-L196 PolarHBondContact O-N 3.16Å; L193-L196 PolarHBondContact O-N 3.15Å; L196-K198 PolarHBondContact O-N 2.75Å; L196-K198 VanDerWaalsContact O-N 3.14Å; L196-L199 VanDerWaalsContact O-CB 3.26Å; L196-L199 WeakPolarHBondContact O-CB 3.29Å; L196-L199 PolarHBondContact O-N 3.11Å; L196-L207 HydrophobicContact CB-CD2 4.22Å; L196-L207 HydrophobicContact CD1-CD1 4.32Å; L196-L207 HydrophobicContact CD2-CD1 4.01Å; L196-L207 HydrophobicContact CD2-CD2 4.5Å; L196-F213 HydrophobicContact CD1-CD2 3.94Å; L196-F213 HydrophobicContact CD1-CE2 4.37Å; L196-L216 HydrophobicContact CD1-CD2 3.64Å; L196-L242 HydrophobicContact CB-CD2 3.88Å
197	S	93.8	Very high	92.8	Very high	5 Å²	5	40.9 Å²	40.9	4%	0.035	22%	0.219	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62	-18.2	176.3	86.4	0	0	0	0	113.6	L193 L194 E195 W241	L193-S197 WeakPolarHBondContact O-CB 3.36Å; L193-S197 PolarHBondContact O-N 3.38Å; L194-S197 WeakPolarHBondContact O-CB 3.05Å; L194-S197 PolarHBondContact O-N 3.24Å; L194-S197 PolarHBondContact O-OG 3.48Å; E195-S197 PolarHBondContact O-N 3.2Å; S197-W241 WeakPolarHBondContact O-CB 3.18Å
198	K	93.4	Very high	92.6	Very high	61 Å²	61	41.3 Å²	41.3	27%	0.265	21%	0.212	S	C	.	.	T	Hydrogen-bonded Turn	trans	-83.3	-5.4	176	-49.3	177.9	-171.2	167.9	0	113.4	P162 P164 V165 E195 L196	P162-K198 HydrophobicContact CB-CB 4.44Å; P162-K198 HydrophobicContact CB-CG 3.94Å; P164-K198 CarbonylContact C-O 3.59Å; P164-K198 VanDerWaalsContact CA-O 3.29Å; P164-K198 WeakPolarHBondContact CA-O 3.44Å; V165-K198 HydrophobicContact CB-CB 4.26Å; V165-K198 HydrophobicContact CG2-CB 3.73Å; V165-K198 HydrophobicContact CG2-CD 4.21Å; V165-K198 PolarHBondContact N-O 3.27Å; E195-K198 WeakPolarHBondContact O-CB 3.25Å; E195-K198 PolarHBondContact O-N 3.35Å; E195-K198 IonicContact OE1-NZ 2.7Å; E195-K198 PolarHBondContact OE1-NZ 2.87Å; E195-K198 WeakPolarHBondContact OE2-CE 3.41Å; E195-K198 IonicContact OE2-NZ 3.37Å; E195-K198 PolarHBondContact OE2-NZ 3.19Å; L196-K198 PolarHBondContact O-N 2.75Å; L196-K198 VanDerWaalsContact O-N 3.14Å
199	L	92.6	Very high	92.5	Very high	0 Å²	0	43.3 Å²	43.3	0%	0	23%	0.229	C	C	.	.	B	Isolated β-bridge	trans	-58.3	143.6	-179.1	178.8	65.9	0	0	0	111.6	W167 L170 L196 K203 M204 L207	W167-L199 HydrophobicContact CB-CD1 4.29Å; W167-L199 HydrophobicContact CE3-CD1 4Å; W167-L199 HydrophobicContact CE3-CD2 3.97Å; W167-L199 HydrophobicContact CZ3-CD2 4.14Å; L170-L199 HydrophobicContact CD1-CB 3.75Å; L170-L199 HydrophobicContact CD1-CD1 3.85Å; L170-L199 HydrophobicContact CD1-CG 4.35Å; L196-L199 VanDerWaalsContact O-CB 3.26Å; L196-L199 WeakPolarHBondContact O-CB 3.29Å; L196-L199 PolarHBondContact O-N 3.11Å; L199-K203 HydrophobicContact CD1-CB 3.81Å; L199-K203 HydrophobicContact CD1-CG 4.34Å; L199-K203 HydrophobicContact CD2-CB 3.95Å; L199-K203 HydrophobicContact CG-CB 3.95Å; L199-M204 HydrophobicContact CB-CE 3.75Å; L199-M204 HydrophobicContact CB-SD 4.47Å; L199-M204 HydrophobicContact CD2-CE 4.46Å; L199-M204 HydrophobicContact CD2-SD 4.15Å; L199-M204 HydrophobicContact CG-CE 4.3Å; L199-M204 VanDerWaalsContact O-CE 3.28Å; L199-M204 WeakPolarHBondContact O-CE 3.33Å; L199-L207 HydrophobicContact CD2-CB 3.77Å; L199-L207 HydrophobicContact CD2-CD2 3.84Å; L199-L207 HydrophobicContact CD2-CG 4.33Å
200	H	89.4	Confident	92.4	Very high	57 Å²	57	44.5 Å²	44.5	26%	0.264	24%	0.236	S	C	.	.			trans	-59.8	134.2	174.5	-165	-84.2	0	0	0	111.9	P164 V165 D202 K203	P164-H200 HydrophobicContact CB-CB 4.35Å; V165-H200 PolarHBondContact O-N 3.06Å; H200-D202 VanDerWaalsContact C-N 3.31Å; H200-D202 IonicContact CE1-OD1 3.18Å; H200-D202 PolarHBondContact CE1-OD1 3Å; H200-D202 VanDerWaalsContact CE1-OD1 3.23Å; H200-D202 IonicContact CE1-OD2 3.21Å; H200-D202 PolarHBondContact CE1-OD2 3.34Å; H200-D202 VanDerWaalsContact ND1-CG 3.35Å; H200-D202 IonicContact ND1-OD1 2.7Å; H200-D202 PolarHBondContact ND1-OD1 2.87Å; H200-D202 IonicContact ND1-OD2 3.54Å; H200-D202 PolarHBondContact O-N 3.16Å; H200-D202 VanDerWaalsContact O-N 3.15Å; H200-K203 PolarHBondContact O-N 2.99Å
201	P	86.6	Confident	92.3	Very high	42 Å²	42	50.5 Å²	50.5	27%	0.273	26%	0.263	S	S	.	.	G	3₁₀ helix	trans	-48.5	-46.4	-174.2	-29.1	32.9	0	0	0	114.5	K203 M204	P201-K203 PolarHBondContact O-N 3.01Å; P201-M204 WeakPolarHBondContact O-CB 3.48Å; P201-M204 WeakPolarHBondContact O-CG 3.47Å; P201-M204 PolarHBondContact O-N 3.49Å
202	D	88.8	Confident	92.2	Very high	116 Å²	116	48.4 Å²	48.4	62%	0.62	25%	0.251	S	S	*	.	G	3₁₀ helix	trans	-55.5	-15.8	-179.7	-52.5	14.2	0	0	0	114.6	H200	H200-D202 VanDerWaalsContact C-N 3.31Å; H200-D202 IonicContact CE1-OD1 3.18Å; H200-D202 PolarHBondContact CE1-OD1 3Å; H200-D202 VanDerWaalsContact CE1-OD1 3.23Å; H200-D202 IonicContact CE1-OD2 3.21Å; H200-D202 PolarHBondContact CE1-OD2 3.34Å; H200-D202 VanDerWaalsContact ND1-CG 3.35Å; H200-D202 IonicContact ND1-OD1 2.7Å; H200-D202 PolarHBondContact ND1-OD1 2.87Å; H200-D202 IonicContact ND1-OD2 3.54Å; H200-D202 PolarHBondContact O-N 3.16Å; H200-D202 VanDerWaalsContact O-N 3.15Å
203	K	89.9	Confident	92.2	Very high	70 Å²	70	47.9 Å²	47.9	30%	0.304	25%	0.249	S	C	.	.	G	3₁₀ helix	trans	-105.5	-5.6	-180	-49.1	-55.8	177.9	-164.5	0	112.9	W167 L199 H200 P201 P205 L206 L207	W167-K203 HydrophobicContact CB-CG 4.27Å; L199-K203 HydrophobicContact CD1-CB 3.81Å; L199-K203 HydrophobicContact CD1-CG 4.34Å; L199-K203 HydrophobicContact CD2-CB 3.95Å; L199-K203 HydrophobicContact CG-CB 3.95Å; H200-K203 PolarHBondContact O-N 2.99Å; P201-K203 PolarHBondContact O-N 3.01Å; K203-P205 VanDerWaalsContact C-CD 3.48Å; K203-L206 HydrophobicContact CD-CD1 4.19Å; K203-L206 WeakPolarHBondContact O-CB 3.49Å; K203-L206 PolarHBondContact O-N 3.37Å; K203-L207 PolarHBondContact O-N 3.45Å
204	M	90.3	Very high	92.1	Very high	3 Å²	3	49.7 Å²	49.7	2%	0.015	26%	0.26	C	S	.	.	H	α-helix	trans	-55.5	-39.9	177.1	-69.5	-63.9	172.5	0	0	113.8	L199 P201 L206 L207 Q208 W241	L199-M204 HydrophobicContact CB-CE 3.75Å; L199-M204 HydrophobicContact CB-SD 4.47Å; L199-M204 HydrophobicContact CD2-CE 4.46Å; L199-M204 HydrophobicContact CD2-SD 4.15Å; L199-M204 HydrophobicContact CG-CE 4.3Å; L199-M204 VanDerWaalsContact O-CE 3.28Å; L199-M204 WeakPolarHBondContact O-CE 3.33Å; P201-M204 WeakPolarHBondContact O-CB 3.48Å; P201-M204 WeakPolarHBondContact O-CG 3.47Å; P201-M204 PolarHBondContact O-N 3.49Å; M204-L206 PolarHBondContact O-N 2.94Å; M204-L207 PolarHBondContact O-N 3.06Å; M204-L207 VanDerWaalsContact O-N 3.14Å; M204-L207 HydrophobicContact SD-CD2 4.2Å; M204-Q208 WeakPolarHBondContact O-CB 3.47Å; M204-Q208 WeakPolarHBondContact O-CG 3.48Å; M204-Q208 PolarHBondContact O-N 2.97Å; M204-W241 WeakPolarHBondContact CE-O 3.4Å
205	P	90.9	Very high	92.1	Very high	83 Å²	83	48.4 Å²	48.4	54%	0.539	25%	0.253	S	S	.	.	H	α-helix	trans	-61.7	-29.9	175.8	-25	35.9	0	0	0	113.9	K203 S209	K203-P205 VanDerWaalsContact C-CD 3.48Å; P205-S209 WeakPolarHBondContact O-CB 3.38Å; P205-S209 PolarHBondContact O-N 3.47Å; P205-S209 PolarHBondContact O-OG 2.99Å
206	L	91.5	Very high	92.1	Very high	92 Å²	92	45.9 Å²	45.9	48%	0.482	24%	0.241	S	C	.	.	H	α-helix	trans	-71.9	-44	174.8	-56.6	175.3	0	0	0	110.6	W167 K203 M204 S209 D210	W167-L206 HydrophobicContact CH2-CB 4.32Å; W167-L206 HydrophobicContact CZ3-CB 4.45Å; K203-L206 HydrophobicContact CD-CD1 4.19Å; K203-L206 WeakPolarHBondContact O-CB 3.49Å; K203-L206 PolarHBondContact O-N 3.37Å; M204-L206 PolarHBondContact O-N 2.94Å; L206-S209 PolarHBondContact O-N 3.26Å; L206-D210 PolarHBondContact O-N 3.45Å
207	L	92.9	Very high	92.2	Very high	0 Å²	0	46.4 Å²	46.4	0%	0	24%	0.244	C	C	.	.	H	α-helix	trans	-62.4	-46.1	176.5	-176	62.7	0	0	0	111.9	W167 L174 L196 L199 K203 M204 S209 D210 F213 L242	W167-L207 HydrophobicContact CZ3-CB 4Å; W167-L207 HydrophobicContact CZ3-CD1 4.13Å; L174-L207 HydrophobicContact CD1-CD1 4Å; L174-L207 HydrophobicContact CD2-CD1 4.01Å; L196-L207 HydrophobicContact CB-CD2 4.22Å; L196-L207 HydrophobicContact CD1-CD1 4.32Å; L196-L207 HydrophobicContact CD2-CD1 4.01Å; L196-L207 HydrophobicContact CD2-CD2 4.5Å; L199-L207 HydrophobicContact CD2-CB 3.77Å; L199-L207 HydrophobicContact CD2-CD2 3.84Å; L199-L207 HydrophobicContact CD2-CG 4.33Å; K203-L207 PolarHBondContact O-N 3.45Å; M204-L207 PolarHBondContact O-N 3.06Å; M204-L207 VanDerWaalsContact O-N 3.14Å; M204-L207 HydrophobicContact SD-CD2 4.2Å; L207-S209 PolarHBondContact O-N 3.37Å; L207-D210 WeakPolarHBondContact O-CB 3.47Å; L207-D210 PolarHBondContact O-N 3.1Å; L207-F213 HydrophobicContact CD1-CB 3.82Å; L207-F213 HydrophobicContact CD1-CD1 4.49Å; L207-F213 HydrophobicContact CD1-CD2 3.89Å; L207-F213 HydrophobicContact CD1-CG 3.83Å; L207-F213 HydrophobicContact CD2-CD2 4.19Å; L207-F213 HydrophobicContact CD2-CE2 4.05Å; L207-F213 HydrophobicContact CD2-CZ 4.28Å; L207-F213 HydrophobicContact CG-CB 4.27Å; L207-F213 HydrophobicContact CG-CD1 4.02Å; L207-F213 HydrophobicContact CG-CD2 3.93Å; L207-F213 HydrophobicContact CG-CE1 4.28Å; L207-F213 HydrophobicContact CG-CE2 4.2Å; L207-F213 HydrophobicContact CG-CG 3.81Å; L207-F213 HydrophobicContact CG-CZ 4.36Å; L207-F213 WeakPolarHBondContact O-CB 3.49Å; L207-F213 VanDerWaalsContact O-CD1 3.26Å; L207-F213 WeakPolarHBondContact O-CD1 3.07Å; L207-L242 HydrophobicContact CD2-CD2 3.56Å
208	Q	89.8	Confident	92.2	Very high	66 Å²	66	53.6 Å²	53.6	31%	0.308	27%	0.27	S	S	.	.	H	α-helix	trans	-63.8	-23	178.9	-68.8	-179.4	9.7	0	0	112.8	M204 F213 L242 E243	M204-Q208 WeakPolarHBondContact O-CB 3.47Å; M204-Q208 WeakPolarHBondContact O-CG 3.48Å; M204-Q208 PolarHBondContact O-N 2.97Å; Q208-F213 HydrophobicContact CG-CE1 4.35Å; Q208-L242 PolarHBondContact NE2-O 2.87Å; Q208-E243 PolarHBondContact NE2-O 3.41Å
209	S	90.8	Very high	92.3	Very high	91 Å²	91	52.1 Å²	52.1	64%	0.636	26%	0.263	S	S	*	.	H	α-helix	trans	-86.2	-12.4	174.3	-57.1	0	0	0	0	113.8	P205 L206 L207	P205-S209 WeakPolarHBondContact O-CB 3.38Å; P205-S209 PolarHBondContact O-N 3.47Å; P205-S209 PolarHBondContact O-OG 2.99Å; L206-S209 PolarHBondContact O-N 3.26Å; L207-S209 PolarHBondContact O-N 3.37Å
210	D	93.3	Very high	92.5	Very high	25 Å²	25	52.1 Å²	52.1	13%	0.134	26%	0.263	C	S	.	.			trans	-80.5	122.1	-172.5	-163.6	-51.9	0	0	0	112.2	L206 L207 R212 F213 V214	L206-D210 PolarHBondContact O-N 3.45Å; L207-D210 WeakPolarHBondContact O-CB 3.47Å; L207-D210 PolarHBondContact O-N 3.1Å; D210-R212 PolarHBondContact O-N 2.72Å; D210-R212 VanDerWaalsContact O-N 3.08Å; D210-R212 WeakPolarHBondContact OD1-CA 3.42Å; D210-R212 WeakPolarHBondContact OD1-CB 3.41Å; D210-R212 WeakPolarHBondContact OD1-CG 3.32Å; D210-R212 IonicContact OD1-CZ 3.06Å; D210-R212 PolarHBondContact OD1-N 2.85Å; D210-R212 IonicContact OD1-NE 3.66Å; D210-R212 PolarHBondContact OD1-NE 3.08Å; D210-R212 IonicContact OD1-NH2 2.75Å; D210-R212 IonicContact OD2-CZ 3.49Å; D210-R212 VanDerWaalsContact OD2-CZ 3.28Å; D210-R212 IonicContact OD2-NE 2.76Å; D210-R212 PolarHBondContact OD2-NE 3.48Å; D210-R212 VanDerWaalsContact OD2-NE 3.1Å; D210-R212 IonicContact OD2-NH2 3.37Å; D210-R212 PolarHBondContact OD2-NH2 3.45Å; D210-F213 HydrophobicContact CB-CB 4.26Å; D210-F213 WeakPolarHBondContact O-CB 3.47Å; D210-F213 PolarHBondContact O-N 3.2Å; D210-V214 PolarHBondContact O-N 3.09Å
211	Q	93.4	Very high	92.8	Very high	139 Å²	139	51.8 Å²	51.8	65%	0.65	27%	0.265	S	S	*	.	H	α-helix	trans	-59	-24.2	179.4	-63.4	-59.2	-52.5	0	0	113.5	M215	Q211-M215 VanDerWaalsContact O-CB 3.31Å; Q211-M215 WeakPolarHBondContact O-CB 3.45Å; Q211-M215 PolarHBondContact O-N 3.29Å
212	R	94.6	Very high	93.2	Very high	51 Å²	51	55.8 Å²	55.8	19%	0.192	28%	0.28	C	S	.	.	H	α-helix	trans	-75.2	-36.9	177.5	-52.7	170.8	-68.7	166.6	-1.5	110.5	L174 V177 S178 D210 M215 L216	L174-R212 HydrophobicContact CB-CB 4.36Å; L174-R212 HydrophobicContact CD2-CB 4.39Å; L174-R212 WeakPolarHBondContact O-CD 3.37Å; V177-R212 WeakPolarHBondContact CG1-O 3.46Å; S178-R212 WeakPolarHBondContact OG-CD 3.36Å; S178-R212 WeakPolarHBondContact OG-CG 3.43Å; D210-R212 PolarHBondContact O-N 2.72Å; D210-R212 VanDerWaalsContact O-N 3.08Å; D210-R212 WeakPolarHBondContact OD1-CA 3.42Å; D210-R212 WeakPolarHBondContact OD1-CB 3.41Å; D210-R212 WeakPolarHBondContact OD1-CG 3.32Å; D210-R212 IonicContact OD1-CZ 3.06Å; D210-R212 PolarHBondContact OD1-N 2.85Å; D210-R212 IonicContact OD1-NE 3.66Å; D210-R212 PolarHBondContact OD1-NE 3.08Å; D210-R212 IonicContact OD1-NH2 2.75Å; D210-R212 IonicContact OD2-CZ 3.49Å; D210-R212 VanDerWaalsContact OD2-CZ 3.28Å; D210-R212 IonicContact OD2-NE 2.76Å; D210-R212 PolarHBondContact OD2-NE 3.48Å; D210-R212 VanDerWaalsContact OD2-NE 3.1Å; D210-R212 IonicContact OD2-NH2 3.37Å; D210-R212 PolarHBondContact OD2-NH2 3.45Å; R212-M215 PolarHBondContact O-N 3.15Å; R212-L216 PolarHBondContact O-N 3.46Å
213	F	95.2	Very high	93.5	Very high	4 Å²	4	51.6 Å²	51.6	2%	0.018	26%	0.257	C	S	.	.	H	α-helix	trans	-71.3	-42.8	171.8	-179.2	-115	0	0	0	111.9	L174 L193 L196 L207 Q208 D210 M215 L216 L217 L242 I244	L174-F213 HydrophobicContact CD2-CB 4.47Å; L193-F213 HydrophobicContact CD2-CE2 4.2Å; L196-F213 HydrophobicContact CD1-CD2 3.94Å; L196-F213 HydrophobicContact CD1-CE2 4.37Å; L207-F213 HydrophobicContact CD1-CB 3.82Å; L207-F213 HydrophobicContact CD1-CD1 4.49Å; L207-F213 HydrophobicContact CD1-CD2 3.89Å; L207-F213 HydrophobicContact CD1-CG 3.83Å; L207-F213 HydrophobicContact CD2-CD2 4.19Å; L207-F213 HydrophobicContact CD2-CE2 4.05Å; L207-F213 HydrophobicContact CD2-CZ 4.28Å; L207-F213 HydrophobicContact CG-CB 4.27Å; L207-F213 HydrophobicContact CG-CD1 4.02Å; L207-F213 HydrophobicContact CG-CD2 3.93Å; L207-F213 HydrophobicContact CG-CE1 4.28Å; L207-F213 HydrophobicContact CG-CE2 4.2Å; L207-F213 HydrophobicContact CG-CG 3.81Å; L207-F213 HydrophobicContact CG-CZ 4.36Å; L207-F213 WeakPolarHBondContact O-CB 3.49Å; L207-F213 VanDerWaalsContact O-CD1 3.26Å; L207-F213 WeakPolarHBondContact O-CD1 3.07Å; Q208-F213 HydrophobicContact CG-CE1 4.35Å; D210-F213 HydrophobicContact CB-CB 4.26Å; D210-F213 WeakPolarHBondContact O-CB 3.47Å; D210-F213 PolarHBondContact O-N 3.2Å; F213-M215 PolarHBondContact O-N 3.18Å; F213-L216 HydrophobicContact CD2-CD2 4.45Å; F213-L216 WeakPolarHBondContact O-CB 3.42Å; F213-L216 PolarHBondContact O-N 3.44Å; F213-L217 HydrophobicContact CD1-CD1 4.26Å; F213-L217 HydrophobicContact CE1-CD1 3.85Å; F213-L217 HydrophobicContact CE1-CG 4.39Å; F213-L217 HydrophobicContact CE2-CD2 4.5Å; F213-L217 HydrophobicContact CZ-CD1 4.16Å; F213-L217 HydrophobicContact CZ-CD2 4.3Å; F213-L217 HydrophobicContact CZ-CG 4.33Å; F213-L217 PolarHBondContact O-N 2.86Å; F213-L242 HydrophobicContact CE2-CD1 4.03Å; F213-L242 HydrophobicContact CE2-CD2 3.99Å; F213-L242 HydrophobicContact CZ-CB 4.48Å; F213-L242 HydrophobicContact CZ-CD1 4.15Å; F213-L242 HydrophobicContact CZ-CD2 4.12Å; F213-I244 HydrophobicContact CE1-CD1 4.19Å; F213-I244 HydrophobicContact CZ-CD1 3.87Å
214	V	93.5	Very high	93.7	Very high	39 Å²	39	48.7 Å²	48.7	24%	0.236	25%	0.245	C	C	.	.	H	α-helix	trans	-58	-38.3	171.9	175.8	0	0	0	0	111.3	D210 R218	D210-V214 PolarHBondContact O-N 3.09Å; V214-R218 WeakPolarHBondContact O-CG 3.41Å; V214-R218 PolarHBondContact O-N 3.46Å
215	M	94.2	Very high	93.9	Very high	19 Å²	19	58 Å²	58	9%	0.094	28%	0.28	C	S	.	.	H	α-helix	trans	-67.4	-39	173.5	-173.4	173.4	72.5	0	0	112.6	V177 R181 M184 Q211 R212 F213 R218 Y219	V177-M215 HydrophobicContact CG1-CE 3.85Å; V177-M215 WeakPolarHBondContact O-CE 3.43Å; R181-M215 HydrophobicContact CB-CE 4.24Å; R181-M215 HydrophobicContact CB-SD 4.37Å; R181-M215 HydrophobicContact CG-SD 4.2Å; R181-M215 PolarHBondContact NE-SD 3.28Å; R181-M215 PolarHBondContact NH2-SD 3.22Å; R181-M215 VanDerWaalsContact NH2-SD 3.45Å; M184-M215 HydrophobicContact CE-CE 4.34Å; Q211-M215 VanDerWaalsContact O-CB 3.31Å; Q211-M215 WeakPolarHBondContact O-CB 3.45Å; Q211-M215 PolarHBondContact O-N 3.29Å; R212-M215 PolarHBondContact O-N 3.15Å; F213-M215 PolarHBondContact O-N 3.18Å; M215-R218 WeakPolarHBondContact O-CB 3.44Å; M215-R218 PolarHBondContact O-N 3.18Å; M215-Y219 HydrophobicContact CG-CD2 3.89Å; M215-Y219 HydrophobicContact CG-CE2 3.63Å; M215-Y219 VanDerWaalsContact O-CD2 3.29Å; M215-Y219 WeakPolarHBondContact O-CD2 3.47Å; M215-Y219 PolarHBondContact O-N 3.2Å; M215-Y219 HydrophobicContact SD-CE2 4.1Å
216	L	95.7	Very high	94.1	Very high	0 Å²	0	59.7 Å²	59.7	0%	0	28%	0.283	C	S	.	.	H	α-helix	trans	-62	-42.3	175.2	-175.1	64.4	0	0	0	112	V177 M184 V189 F192 L193 L196 R212 F213 R218 Y219 S220	V177-L216 HydrophobicContact CG1-CB 4.26Å; V177-L216 HydrophobicContact CG2-CD1 4.37Å; M184-L216 HydrophobicContact SD-CD1 4.32Å; V189-L216 HydrophobicContact CB-CD1 4.2Å; V189-L216 HydrophobicContact CG1-CD1 3.88Å; V189-L216 HydrophobicContact CG2-CD1 4.16Å; F192-L216 HydrophobicContact CB-CD1 3.88Å; F192-L216 HydrophobicContact CB-CD2 3.72Å; F192-L216 HydrophobicContact CB-CG 4.48Å; F192-L216 HydrophobicContact CD2-CD1 3.99Å; F192-L216 HydrophobicContact CG-CD1 4.45Å; L193-L216 HydrophobicContact CD2-CD2 3.67Å; L193-L216 HydrophobicContact CD2-CG 4.01Å; L193-L216 HydrophobicContact CG-CD2 3.9Å; L193-L216 HydrophobicContact CG-CG 4.12Å; L196-L216 HydrophobicContact CD1-CD2 3.64Å; R212-L216 PolarHBondContact O-N 3.46Å; F213-L216 HydrophobicContact CD2-CD2 4.45Å; F213-L216 WeakPolarHBondContact O-CB 3.42Å; F213-L216 PolarHBondContact O-N 3.44Å; L216-R218 VanDerWaalsContact C-N 3.3Å; L216-R218 PolarHBondContact O-N 2.86Å; L216-Y219 PolarHBondContact O-N 3.47Å; L216-S220 PolarHBondContact O-N 3.18Å
217	L	95.9	Very high	94.4	Very high	11 Å²	11	55.4 Å²	55.4	6%	0.058	26%	0.261	C	S	.	.	H	α-helix	trans	-62.9	-35.2	174.8	-66.5	177.8	0	0	0	112.1	L193 F213 S220 V221 F239 I244	L193-L217 HydrophobicContact CD2-CD2 4.17Å; F213-L217 HydrophobicContact CD1-CD1 4.26Å; F213-L217 HydrophobicContact CE1-CD1 3.85Å; F213-L217 HydrophobicContact CE1-CG 4.39Å; F213-L217 HydrophobicContact CE2-CD2 4.5Å; F213-L217 HydrophobicContact CZ-CD1 4.16Å; F213-L217 HydrophobicContact CZ-CD2 4.3Å; F213-L217 HydrophobicContact CZ-CG 4.33Å; F213-L217 PolarHBondContact O-N 2.86Å; L217-S220 PolarHBondContact O-N 2.94Å; L217-S220 PolarHBondContact O-OG 2.85Å; L217-V221 PolarHBondContact O-N 3.38Å; L217-F239 HydrophobicContact CD2-CD1 4.49Å; L217-F239 HydrophobicContact CD2-CE1 3.63Å; L217-F239 HydrophobicContact CD2-CZ 4.13Å; L217-I244 HydrophobicContact CD1-CD1 4.37Å; L217-I244 HydrophobicContact CD2-CD1 4.44Å
218	R	94.2	Very high	94.5	Very high	156 Å²	156	57.7 Å²	57.7	59%	0.589	28%	0.277	S	S	*	.	H	α-helix	trans	-65.2	-46.6	172.1	-67.9	174.6	-168.5	-171.6	3.7	111.7	V214 M215 L216 S220 V221 E222	V214-R218 WeakPolarHBondContact O-CG 3.41Å; V214-R218 PolarHBondContact O-N 3.46Å; M215-R218 WeakPolarHBondContact O-CB 3.44Å; M215-R218 PolarHBondContact O-N 3.18Å; L216-R218 VanDerWaalsContact C-N 3.3Å; L216-R218 PolarHBondContact O-N 2.86Å; R218-S220 VanDerWaalsContact C-N 3.25Å; R218-S220 PolarHBondContact O-N 3.09Å; R218-V221 WeakPolarHBondContact O-CA 3.48Å; R218-V221 WeakPolarHBondContact O-CB 3.22Å; R218-V221 PolarHBondContact O-N 3.36Å; R218-E222 PolarHBondContact O-N 3.45Å
219	Y	95.2	Very high	94.7	Very high	31 Å²	31	56.8 Å²	56.8	12%	0.122	27%	0.273	C	S	.	.	H	α-helix	trans	-62.1	-31.4	175.3	-79.2	-63.8	0	0	0	113.1	G182 M184 M215 L216 V221 E222 H223	G182-Y219 PolarHBondContact N-OH 2.84Å; M184-Y219 HydrophobicContact CE-CD2 3.31Å; M184-Y219 HydrophobicContact CE-CE2 3.41Å; M184-Y219 VanDerWaalsContact CE-CE2 3.41Å; M184-Y219 HydrophobicContact CE-CG 4.1Å; M184-Y219 HydrophobicContact SD-CD2 4.28Å; M215-Y219 HydrophobicContact CG-CD2 3.89Å; M215-Y219 HydrophobicContact CG-CE2 3.63Å; M215-Y219 VanDerWaalsContact O-CD2 3.29Å; M215-Y219 WeakPolarHBondContact O-CD2 3.47Å; M215-Y219 PolarHBondContact O-N 3.2Å; M215-Y219 HydrophobicContact SD-CE2 4.1Å; L216-Y219 PolarHBondContact O-N 3.47Å; Y219-V221 VanDerWaalsContact C-N 3.28Å; Y219-V221 PolarHBondContact O-N 2.81Å; Y219-E222 WeakPolarHBondContact CD1-OE2 3.37Å; Y219-E222 VanDerWaalsContact CE1-OE2 3.25Å; Y219-E222 WeakPolarHBondContact CE1-OE2 3.39Å; Y219-E222 PolarHBondContact O-N 3.43Å; Y219-H223 AromaticContact CD1-NE2 3.91Å; Y219-H223 WeakPolarHBondContact O-CB 3.22Å; Y219-H223 PolarHBondContact O-CD2 3.27Å; Y219-H223 PolarHBondContact O-N 3.23Å
220	S	96.4	Very high	94.9	Very high	0 Å²	0	57.4 Å²	57.4	0%	0	27%	0.268	C	S	.	.	H	α-helix	trans	-64.7	-31.7	172.7	84.4	0	0	0	0	112.9	L216 L217 R218 L224 Y254	L216-S220 PolarHBondContact O-N 3.18Å; L217-S220 PolarHBondContact O-N 2.94Å; L217-S220 PolarHBondContact O-OG 2.85Å; R218-S220 VanDerWaalsContact C-N 3.25Å; R218-S220 PolarHBondContact O-N 3.09Å; S220-L224 WeakPolarHBondContact O-CA 3.27Å; S220-L224 PolarHBondContact O-N 3.04Å; S220-Y254 VanDerWaalsContact CB-OH 3.3Å; S220-Y254 WeakPolarHBondContact CB-OH 3.42Å; S220-Y254 PolarHBondContact O-OH 3.05Å; S220-Y254 PolarHBondContact OG-OH 3Å
221	V	96.4	Very high	95.1	Very high	50 Å²	50	58.6 Å²	58.6	30%	0.303	27%	0.273	S	S	.	.	H	α-helix	trans	-78.3	-41.7	172.9	175.4	0	0	0	0	111.9	L217 R218 Y219 H223 L224 V250 V253 Y254	L217-V221 PolarHBondContact O-N 3.38Å; R218-V221 WeakPolarHBondContact O-CA 3.48Å; R218-V221 WeakPolarHBondContact O-CB 3.22Å; R218-V221 PolarHBondContact O-N 3.36Å; Y219-V221 VanDerWaalsContact C-N 3.28Å; Y219-V221 PolarHBondContact O-N 2.81Å; V221-H223 VanDerWaalsContact C-N 3.29Å; V221-H223 PolarHBondContact O-N 2.88Å; V221-L224 WeakPolarHBondContact O-CB 3.27Å; V221-L224 PolarHBondContact O-N 3.48Å; V221-L224 VanDerWaalsContact O-N 3.15Å; V221-V250 HydrophobicContact CG2-CG2 3.66Å; V221-V253 HydrophobicContact CG1-CG1 4.16Å; V221-V253 HydrophobicContact CG1-CG2 4.45Å; V221-Y254 HydrophobicContact CG2-CE2 4.4Å
222	E	94.6	Very high	95.2	Very high	126 Å²	126	52 Å²	52	59%	0.589	24%	0.242	S	C	*	.	H	α-helix	trans	-61.5	-38.3	177	-70.2	172.6	-149.9	0	0	111.8	R218 Y219	R218-E222 PolarHBondContact O-N 3.45Å; Y219-E222 WeakPolarHBondContact CD1-OE2 3.37Å; Y219-E222 VanDerWaalsContact CE1-OE2 3.25Å; Y219-E222 WeakPolarHBondContact CE1-OE2 3.39Å; Y219-E222 PolarHBondContact O-N 3.43Å
223	H	94.8	Very high	95.3	Very high	27 Å²	27	50 Å²	50	13%	0.125	24%	0.235	C	C	.	.	T	Hydrogen-bonded Turn	trans	-90.4	5.6	176.4	-62.1	-47.1	0	0	0	114.4	M184 P186 Y219 V221 R225 L226 F227	M184-H223 PolarHBondContact O-NE2 3.5Å; P186-H223 HydrophobicContact CB-CB 4.24Å; P186-H223 HydrophobicContact CG-CB 4.02Å; Y219-H223 AromaticContact CD1-NE2 3.91Å; Y219-H223 WeakPolarHBondContact O-CB 3.22Å; Y219-H223 PolarHBondContact O-CD2 3.27Å; Y219-H223 PolarHBondContact O-N 3.23Å; V221-H223 VanDerWaalsContact C-N 3.29Å; V221-H223 PolarHBondContact O-N 2.88Å; H223-R225 VanDerWaalsContact C-N 3.25Å; H223-R225 PolarHBondContact O-N 3.12Å; H223-R225 VanDerWaalsContact O-N 3.11Å; H223-L226 WeakPolarHBondContact O-CA 3.46Å; H223-L226 WeakPolarHBondContact O-CB 3.34Å; H223-L226 PolarHBondContact O-N 3.12Å; H223-F227 HydrophobicContact CB-CE2 4.29Å; H223-F227 HydrophobicContact CB-CZ 4.45Å; H223-F227 PolarHBondContact O-N 2.75Å
224	L	94.8	Very high	95.4	Very high	10 Å²	10	53.7 Å²	53.7	5%	0.052	25%	0.253	C	S	.	.	T	Hydrogen-bonded Turn	trans	-55.1	-37.5	-171.3	-174.6	63.4	0	0	0	113.8	S220 V221 L226 L232 V253 Y254 E257 R261	S220-L224 WeakPolarHBondContact O-CA 3.27Å; S220-L224 PolarHBondContact O-N 3.04Å; V221-L224 WeakPolarHBondContact O-CB 3.27Å; V221-L224 PolarHBondContact O-N 3.48Å; V221-L224 VanDerWaalsContact O-N 3.15Å; L224-L226 VanDerWaalsContact C-N 3.31Å; L224-L226 PolarHBondContact O-N 3.25Å; L224-L232 HydrophobicContact CD1-CD2 3.57Å; L224-V253 HydrophobicContact CD2-CB 4.17Å; L224-V253 HydrophobicContact CD2-CG1 3.58Å; L224-Y254 HydrophobicContact CD1-CD1 3.93Å; L224-Y254 HydrophobicContact CD1-CD2 3.93Å; L224-Y254 HydrophobicContact CD1-CE1 3.65Å; L224-Y254 HydrophobicContact CD1-CE2 3.68Å; L224-Y254 HydrophobicContact CD1-CG 4.05Å; L224-E257 HydrophobicContact CD1-CB 4.36Å; L224-E257 HydrophobicContact CD1-CG 4.34Å; L224-E257 HydrophobicContact CD2-CB 3.79Å; L224-E257 HydrophobicContact CD2-CG 4.28Å; L224-E257 HydrophobicContact CG-CB 3.98Å; L224-E257 HydrophobicContact CG-CG 3.93Å; L224-R261 PolarHBondContact O-NH2 3.46Å; L224-R261 VanDerWaalsContact O-NH2 3.16Å
225	R	94.6	Very high	95.6	Very high	199 Å²	199	51.9 Å²	51.9	75%	0.751	24%	0.241	S	C	*	.	T	Hydrogen-bonded Turn	trans	-77.8	-11.9	177.2	-67.8	-175.4	179.8	176.5	2	114.4	H223 R261	H223-R225 VanDerWaalsContact C-N 3.25Å; H223-R225 PolarHBondContact O-N 3.12Å; H223-R225 VanDerWaalsContact O-N 3.11Å; R225-R261 PolarHBondContact O-NH2 3.46Å
226	L	95.6	Very high	95.7	Very high	117 Å²	117	51 Å²	51	61%	0.613	24%	0.237	S	C	*	.	T	Hydrogen-bonded Turn	trans	-97.8	-18.4	-177.6	-54.6	-179.8	0	0	0	112.9	P186 H223 L224	P186-L226 HydrophobicContact CG-CB 3.71Å; P186-L226 HydrophobicContact CG-CD1 4.03Å; H223-L226 WeakPolarHBondContact O-CA 3.46Å; H223-L226 WeakPolarHBondContact O-CB 3.34Å; H223-L226 PolarHBondContact O-N 3.12Å; L224-L226 VanDerWaalsContact C-N 3.31Å; L224-L226 PolarHBondContact O-N 3.25Å
227	F	96.4	Very high	95.8	Very high	3 Å²	3	54.3 Å²	54.3	1%	0.013	25%	0.253	C	S	.	.	S	Bend	trans	-65.3	144	169.5	-69.4	-57.9	0	0	0	111.2	P186 V189 L190 H223 Q231 L232 V235 R261	P186-F227 HydrophobicContact CB-CD1 3.95Å; P186-F227 HydrophobicContact CB-CE1 3.75Å; P186-F227 HydrophobicContact CB-CZ 4.38Å; P186-F227 VanDerWaalsContact O-CE1 3.3Å; P186-F227 WeakPolarHBondContact O-CE1 3.47Å; V189-F227 HydrophobicContact CB-CZ 4.42Å; V189-F227 HydrophobicContact CG1-CZ 4.21Å; L190-F227 HydrophobicContact CB-CE1 4.13Å; H223-F227 HydrophobicContact CB-CE2 4.29Å; H223-F227 HydrophobicContact CB-CZ 4.45Å; H223-F227 PolarHBondContact O-N 2.75Å; F227-Q231 HydrophobicContact CB-CB 3.97Å; F227-Q231 HydrophobicContact CD1-CB 3.78Å; F227-Q231 HydrophobicContact CG-CB 4.23Å; F227-L232 HydrophobicContact CB-CD2 3.77Å; F227-L232 HydrophobicContact CB-CG 3.94Å; F227-L232 HydrophobicContact CD2-CD2 4.03Å; F227-L232 HydrophobicContact CG-CD2 4.3Å; F227-V235 HydrophobicContact CZ-CG2 4.32Å; F227-R261 PolarHBondContact O-NH1 3.15Å; F227-R261 PolarHBondContact O-NH2 3.41Å; F227-R261 VanDerWaalsContact O-NH2 3.08Å
228	S	95.4	Very high	95.8	Very high	47 Å²	47	53.9 Å²	53.9	33%	0.329	25%	0.25	S	S	.	.			trans	-75.2	168.4	163.7	73.5	0	0	0	0	111.6	L230 Q231 L232	S228-L230 VanDerWaalsContact C-N 3.28Å; S228-L230 PolarHBondContact O-N 2.92Å; S228-Q231 PolarHBondContact O-N 3.15Å; S228-Q231 VanDerWaalsContact O-N 3.08Å; S228-Q231 WeakPolarHBondContact OG-CG 2.97Å; S228-Q231 PolarHBondContact OG-N 3.02Å; S228-L232 WeakPolarHBondContact O-CG 3.46Å; S228-L232 PolarHBondContact O-N 2.83Å
229	E	94.8	Very high	95.9	Very high	48 Å²	48	46.4 Å²	46.4	22%	0.224	22%	0.222	C	C	.	.	H	α-helix	trans	-57	-40.9	-179.7	-71.9	59.4	-128.2	0	0	111.8	L233 R261 Q264 L265	E229-L233 WeakPolarHBondContact O-CG 3.21Å; E229-L233 PolarHBondContact O-N 2.97Å; E229-R261 WeakPolarHBondContact OE1-CD 3.39Å; E229-R261 IonicContact OE1-CZ 2.76Å; E229-R261 IonicContact OE1-NE 3.71Å; E229-R261 IonicContact OE1-NH1 3.79Å; E229-R261 PolarHBondContact OE1-NH1 3.05Å; E229-Q264 HydrophobicContact CG-CB 4.49Å; E229-L265 HydrophobicContact CB-CD2 3.61Å; E229-L265 HydrophobicContact CG-CD2 3.68Å
230	L	94.8	Very high	95.9	Very high	104 Å²	104	45.7 Å²	45.7	55%	0.545	22%	0.221	S	C	.	.	H	α-helix	trans	-66	-44.4	174.7	-67.9	173.1	0	0	0	111.5	S228 L232 L233 E234	S228-L230 VanDerWaalsContact C-N 3.28Å; S228-L230 PolarHBondContact O-N 2.92Å; L230-L232 VanDerWaalsContact C-N 3.3Å; L230-L232 PolarHBondContact O-N 2.65Å; L230-L233 WeakPolarHBondContact O-CA 3.5Å; L230-L233 WeakPolarHBondContact O-CB 3.13Å; L230-L233 PolarHBondContact O-N 2.83Å; L230-E234 WeakPolarHBondContact O-CG 3.3Å; L230-E234 PolarHBondContact O-N 2.97Å
231	Q	96	Very high	95.8	Very high	49 Å²	49	46.2 Å²	46.2	23%	0.229	22%	0.223	C	C	.	.	H	α-helix	trans	-65.7	-32.2	-179.2	-65.9	176.9	-34.7	0	0	112.7	L190 F227 S228 L233 E234 V235	L190-Q231 HydrophobicContact CD2-CB 4.17Å; L190-Q231 HydrophobicContact CD2-CG 3.74Å; F227-Q231 HydrophobicContact CB-CB 3.97Å; F227-Q231 HydrophobicContact CD1-CB 3.78Å; F227-Q231 HydrophobicContact CG-CB 4.23Å; S228-Q231 PolarHBondContact O-N 3.15Å; S228-Q231 VanDerWaalsContact O-N 3.08Å; S228-Q231 WeakPolarHBondContact OG-CG 2.97Å; S228-Q231 PolarHBondContact OG-N 3.02Å; Q231-L233 VanDerWaalsContact C-N 3.31Å; Q231-E234 WeakPolarHBondContact CA-OE2 3.44Å; Q231-E234 PolarHBondContact O-N 2.82Å; Q231-V235 WeakPolarHBondContact O-CG2 3.37Å; Q231-V235 PolarHBondContact O-N 3.29Å
232	L	96.6	Very high	95.7	Very high	1 Å²	1	43.9 Å²	43.9	1%	0.005	21%	0.209	C	C	.	.	H	α-helix	trans	-62.9	-38.1	171	-68.5	175.5	0	0	0	111.9	L224 F227 S228 L230 L236 Y254 E257 L258	L224-L232 HydrophobicContact CD1-CD2 3.57Å; F227-L232 HydrophobicContact CB-CD2 3.77Å; F227-L232 HydrophobicContact CB-CG 3.94Å; F227-L232 HydrophobicContact CD2-CD2 4.03Å; F227-L232 HydrophobicContact CG-CD2 4.3Å; S228-L232 WeakPolarHBondContact O-CG 3.46Å; S228-L232 PolarHBondContact O-N 2.83Å; L230-L232 VanDerWaalsContact C-N 3.3Å; L230-L232 PolarHBondContact O-N 2.65Å; L232-L236 WeakPolarHBondContact O-CB 3.37Å; L232-L236 PolarHBondContact O-N 2.91Å; L232-Y254 HydrophobicContact CD2-CE1 4.15Å; L232-E257 HydrophobicContact CD1-CG 4.2Å; L232-L258 HydrophobicContact CB-CD2 4Å; L232-L258 HydrophobicContact CD1-CD2 4.07Å
233	L	97.1	Very high	95.7	Very high	9 Å²	9	42 Å²	42	5%	0.047	20%	0.2	C	C	.	.	H	α-helix	trans	-72.4	-40	175.8	-60.6	170.5	0	0	0	111.8	E229 L230 Q231 V235 L236 Q237 Q269 A273	E229-L233 WeakPolarHBondContact O-CG 3.21Å; E229-L233 PolarHBondContact O-N 2.97Å; L230-L233 WeakPolarHBondContact O-CA 3.5Å; L230-L233 WeakPolarHBondContact O-CB 3.13Å; L230-L233 PolarHBondContact O-N 2.83Å; Q231-L233 VanDerWaalsContact C-N 3.31Å; L233-V235 VanDerWaalsContact C-N 3.35Å; L233-V235 PolarHBondContact O-N 3.46Å; L233-L236 PolarHBondContact O-N 2.99Å; L233-Q237 WeakPolarHBondContact O-CB 3.49Å; L233-Q237 PolarHBondContact O-N 2.96Å; L233-Q269 HydrophobicContact CD1-CB 3.89Å; L233-Q269 HydrophobicContact CD1-CG 3.79Å; L233-A273 HydrophobicContact CD2-CB 3.71Å
234	E	96.5	Very high	95.6	Very high	82 Å²	82	41 Å²	41	38%	0.383	20%	0.196	S	C	.	.	H	α-helix	trans	-62.7	-39.3	175.4	-67.5	172.8	131.6	0	0	111.9	L190 L230 Q231 S238	L190-E234 HydrophobicContact CD1-CB 3.73Å; L230-E234 WeakPolarHBondContact O-CG 3.3Å; L230-E234 PolarHBondContact O-N 2.97Å; Q231-E234 WeakPolarHBondContact CA-OE2 3.44Å; Q231-E234 PolarHBondContact O-N 2.82Å; E234-S238 WeakPolarHBondContact O-CB 3.47Å; E234-S238 PolarHBondContact O-N 3.41Å; E234-S238 PolarHBondContact O-OG 2.73Å
235	V	97.1	Very high	95.6	Very high	0 Å²	0	43 Å²	43	0%	0	21%	0.209	C	C	.	.	H	α-helix	trans	-67.4	-43.1	171.5	172.8	0	0	0	0	111.5	L190 L193 F227 Q231 L233 Q237 S238 F239 Y254	L190-V235 HydrophobicContact CD1-CG2 3.81Å; L193-V235 HydrophobicContact CD1-CG1 3.86Å; L193-V235 HydrophobicContact CD1-CG2 4.12Å; F227-V235 HydrophobicContact CZ-CG2 4.32Å; Q231-V235 WeakPolarHBondContact O-CG2 3.37Å; Q231-V235 PolarHBondContact O-N 3.29Å; L233-V235 VanDerWaalsContact C-N 3.35Å; L233-V235 PolarHBondContact O-N 3.46Å; V235-Q237 VanDerWaalsContact C-N 3.31Å; V235-Q237 PolarHBondContact O-N 3.21Å; V235-S238 CarbonylContact O-C 3.55Å; V235-S238 WeakPolarHBondContact O-CA 3.39Å; V235-S238 VanDerWaalsContact O-CB 3.31Å; V235-S238 WeakPolarHBondContact O-CB 3.47Å; V235-S238 PolarHBondContact O-N 3.31Å; V235-S238 VanDerWaalsContact O-N 3.12Å; V235-F239 HydrophobicContact CG1-CD1 4.17Å; V235-F239 HydrophobicContact CG1-CD2 4.39Å; V235-F239 HydrophobicContact CG1-CE1 3.6Å; V235-F239 HydrophobicContact CG1-CE2 3.86Å; V235-F239 HydrophobicContact CG1-CZ 3.43Å; V235-F239 VanDerWaalsContact CG1-CZ 3.43Å; V235-F239 WeakPolarHBondContact O-CG 3.38Å; V235-F239 PolarHBondContact O-N 3.07Å; V235-Y254 HydrophobicContact CB-CE1 4.13Å; V235-Y254 HydrophobicContact CG1-CE1 3.62Å; V235-Y254 WeakPolarHBondContact CG1-OH 3.4Å
236	L	97.2	Very high	95.5	Very high	0 Å²	0	36 Å²	36	0%	0	19%	0.191	C	C	.	.	H	α-helix	trans	-64.7	-35.4	178.3	-168	68.7	0	0	0	112.1	L232 L233 F239 V240 L258 L276 W277 I280	L232-L236 WeakPolarHBondContact O-CB 3.37Å; L232-L236 PolarHBondContact O-N 2.91Å; L233-L236 PolarHBondContact O-N 2.99Å; L236-F239 HydrophobicContact CD1-CD2 4.3Å; L236-F239 WeakPolarHBondContact O-CB 3.49Å; L236-F239 PolarHBondContact O-N 3.34Å; L236-V240 PolarHBondContact O-N 2.93Å; L236-L258 HydrophobicContact CD2-CD1 3.98Å; L236-L276 HydrophobicContact CB-CD1 4.19Å; L236-L276 HydrophobicContact CD2-CB 3.72Å; L236-L276 HydrophobicContact CD2-CD1 4.15Å; L236-L276 HydrophobicContact CG-CB 3.92Å; L236-L276 HydrophobicContact CG-CD1 4.27Å; L236-W277 HydrophobicContact CD1-CD2 4.05Å; L236-W277 HydrophobicContact CD1-CE3 3.92Å; L236-W277 HydrophobicContact CD1-CH2 3.65Å; L236-W277 HydrophobicContact CD1-CZ2 3.78Å; L236-W277 HydrophobicContact CD1-CZ3 3.72Å; L236-W277 HydrophobicContact CD2-CD2 4.08Å; L236-W277 HydrophobicContact CD2-CG 4.3Å; L236-W277 HydrophobicContact CD2-CZ2 4.25Å; L236-I280 HydrophobicContact CD1-CD1 3.5Å; L236-I280 VanDerWaalsContact CD1-CD1 3.5Å; L236-I280 HydrophobicContact CG-CD1 4.05Å
237	Q	96.9	Very high	95.4	Very high	71 Å²	71	35 Å²	35	33%	0.332	19%	0.193	S	C	.	.	H	α-helix	trans	-66.9	-40.4	170.6	178.1	168.7	-42.7	0	0	111.8	L156 L233 V235 F239 V240 W241 L276	L156-Q237 HydrophobicContact CD1-CG 3.96Å; L156-Q237 HydrophobicContact CD2-CG 4.29Å; L233-Q237 WeakPolarHBondContact O-CB 3.49Å; L233-Q237 PolarHBondContact O-N 2.96Å; V235-Q237 VanDerWaalsContact C-N 3.31Å; V235-Q237 PolarHBondContact O-N 3.21Å; Q237-F239 VanDerWaalsContact C-N 3.28Å; Q237-F239 PolarHBondContact O-N 3.15Å; Q237-V240 WeakPolarHBondContact O-CB 3.44Å; Q237-V240 PolarHBondContact O-N 3.33Å; Q237-W241 VanDerWaalsContact O-CD1 3.31Å; Q237-W241 PolarHBondContact O-N 2.96Å; Q237-L276 HydrophobicContact CB-CD1 4.11Å; Q237-L276 HydrophobicContact CB-CD2 3.96Å; Q237-L276 HydrophobicContact CG-CD2 4.32Å
238	S	96.1	Very high	95.3	Very high	1 Å²	1	38 Å²	38	1%	0.007	21%	0.208	C	C	.	.	H	α-helix	trans	-59.2	-40.1	171.5	-55.8	0	0	0	0	111.2	L194 E234 V235 V240 W241 L242	L194-S238 WeakPolarHBondContact CD2-OG 3.5Å; E234-S238 WeakPolarHBondContact O-CB 3.47Å; E234-S238 PolarHBondContact O-N 3.41Å; E234-S238 PolarHBondContact O-OG 2.73Å; V235-S238 CarbonylContact O-C 3.55Å; V235-S238 WeakPolarHBondContact O-CA 3.39Å; V235-S238 VanDerWaalsContact O-CB 3.31Å; V235-S238 WeakPolarHBondContact O-CB 3.47Å; V235-S238 PolarHBondContact O-N 3.31Å; V235-S238 VanDerWaalsContact O-N 3.12Å; S238-V240 VanDerWaalsContact C-N 3.29Å; S238-V240 PolarHBondContact O-N 3.03Å; S238-W241 PolarHBondContact O-N 3.29Å; S238-L242 VanDerWaalsContact O-CB 3.27Å; S238-L242 WeakPolarHBondContact O-CB 3.24Å; S238-L242 WeakPolarHBondContact O-CD1 3.26Å; S238-L242 WeakPolarHBondContact O-CG 3.36Å; S238-L242 PolarHBondContact O-N 2.81Å
239	F	96.6	Very high	95.3	Very high	0 Å²	0	40.4 Å²	40.4	0%	0	22%	0.22	C	C	.	.	H	α-helix	trans	-64.2	-27	177	-67.6	-12.1	0	0	0	114.1	L193 L217 V235 L236 Q237 L242 E243 I244 V250 L251 Y254 I280	L193-F239 HydrophobicContact CD1-CE1 4.24Å; L193-F239 HydrophobicContact CD2-CE1 4.36Å; L217-F239 HydrophobicContact CD2-CD1 4.49Å; L217-F239 HydrophobicContact CD2-CE1 3.63Å; L217-F239 HydrophobicContact CD2-CZ 4.13Å; V235-F239 HydrophobicContact CG1-CD1 4.17Å; V235-F239 HydrophobicContact CG1-CD2 4.39Å; V235-F239 HydrophobicContact CG1-CE1 3.6Å; V235-F239 HydrophobicContact CG1-CE2 3.86Å; V235-F239 HydrophobicContact CG1-CZ 3.43Å; V235-F239 VanDerWaalsContact CG1-CZ 3.43Å; V235-F239 WeakPolarHBondContact O-CG 3.38Å; V235-F239 PolarHBondContact O-N 3.07Å; L236-F239 HydrophobicContact CD1-CD2 4.3Å; L236-F239 WeakPolarHBondContact O-CB 3.49Å; L236-F239 PolarHBondContact O-N 3.34Å; Q237-F239 VanDerWaalsContact C-N 3.28Å; Q237-F239 PolarHBondContact O-N 3.15Å; F239-L242 HydrophobicContact CD1-CD1 4.36Å; F239-E243 PolarHBondContact O-N 3.28Å; F239-I244 HydrophobicContact CB-CB 4.26Å; F239-I244 HydrophobicContact CB-CG1 3.74Å; F239-I244 HydrophobicContact CD1-CD1 4.45Å; F239-I244 HydrophobicContact CD1-CG1 3.89Å; F239-I244 HydrophobicContact CG-CG1 3.92Å; F239-I244 WeakPolarHBondContact O-CG1 3.27Å; F239-I244 PolarHBondContact O-N 2.79Å; F239-V250 HydrophobicContact CE2-CG1 4.12Å; F239-V250 HydrophobicContact CE2-CG2 4.36Å; F239-V250 HydrophobicContact CZ-CG1 4.33Å; F239-V250 HydrophobicContact CZ-CG2 4.16Å; F239-L251 HydrophobicContact CD2-CD2 3.9Å; F239-L251 HydrophobicContact CE2-CD2 4.44Å; F239-Y254 HydrophobicContact CE2-CD1 4.18Å; F239-Y254 HydrophobicContact CE2-CD2 4.01Å; F239-Y254 HydrophobicContact CE2-CE1 4.13Å; F239-Y254 AromaticContact CE2-CE2 3.94Å; F239-Y254 HydrophobicContact CE2-CE2 3.94Å; F239-Y254 HydrophobicContact CE2-CG 4.13Å; F239-Y254 HydrophobicContact CZ-CE1 4.46Å; F239-Y254 HydrophobicContact CZ-CE2 4.01Å; F239-Y254 AromaticContact CZ-CZ 4Å; F239-I280 HydrophobicContact CB-CD1 4Å
240	V	95.9	Very high	95.4	Very high	16 Å²	16	38.4 Å²	38.4	10%	0.097	21%	0.211	C	C	.	.	H	α-helix	trans	-65	-52.1	171	178.8	0	0	0	0	110.5	L156 L158 L236 Q237 S238 E243 L276 C279 I280	L156-V240 HydrophobicContact CD2-CB 3.9Å; L156-V240 HydrophobicContact CD2-CG1 3.74Å; L156-V240 HydrophobicContact CD2-CG2 4.01Å; L158-V240 HydrophobicContact CD2-CG1 3.95Å; L236-V240 PolarHBondContact O-N 2.93Å; Q237-V240 WeakPolarHBondContact O-CB 3.44Å; Q237-V240 PolarHBondContact O-N 3.33Å; S238-V240 VanDerWaalsContact C-N 3.29Å; S238-V240 PolarHBondContact O-N 3.03Å; V240-E243 PolarHBondContact O-N 3.13Å; V240-E243 VanDerWaalsContact O-N 3.12Å; V240-L276 HydrophobicContact CG2-CD2 3.88Å; V240-C279 HydrophobicContact CB-CB 4.35Å; V240-C279 HydrophobicContact CG1-CB 3.7Å; V240-C279 HydrophobicContact CG2-CB 3.61Å; V240-I280 HydrophobicContact CG2-CD1 4.36Å; V240-I280 HydrophobicContact CG2-CG1 3.79Å
241	W	94.8	Very high	95.4	Very high	11 Å²	11	33.5 Å²	33.5	4%	0.042	19%	0.185	C	C	.	.	H	α-helix	trans	-75.5	-27	-175.4	-57.5	125.1	0	0	0	113.4	L156 L158 R161 S197 M204 Q237 S238 E243	L156-W241 HydrophobicContact CD1-CZ2 3.77Å; L156-W241 HydrophobicContact CD2-CZ2 3.95Å; L156-W241 HydrophobicContact CG-CZ2 3.97Å; L158-W241 HydrophobicContact CD2-CH2 4.23Å; L158-W241 HydrophobicContact CD2-CZ3 4.16Å; R161-W241 VanDerWaalsContact CA-CH2 3.42Å; R161-W241 HydrophobicContact CB-CE3 4.13Å; R161-W241 HydrophobicContact CB-CH2 3.79Å; R161-W241 HydrophobicContact CB-CZ3 3.55Å; R161-W241 HydrophobicContact CG-CD2 4.28Å; R161-W241 HydrophobicContact CG-CE3 3.63Å; R161-W241 HydrophobicContact CG-CH2 4.21Å; R161-W241 HydrophobicContact CG-CZ3 3.6Å; R161-W241 PolarHBondContact NH2-O 3.01Å; S197-W241 WeakPolarHBondContact O-CB 3.18Å; M204-W241 WeakPolarHBondContact CE-O 3.4Å; Q237-W241 VanDerWaalsContact O-CD1 3.31Å; Q237-W241 PolarHBondContact O-N 2.96Å; S238-W241 PolarHBondContact O-N 3.29Å; W241-E243 PolarHBondContact O-N 3.16Å
242	L	94.1	Very high	95.4	Very high	0 Å²	0	35.4 Å²	35.4	0%	0	19%	0.194	C	C	.	.	T	Hydrogen-bonded Turn	trans	-73.4	-2.8	168.3	-70.7	166.7	0	0	0	113.3	L193 L196 L207 Q208 F213 S238 F239 I244	L193-L242 HydrophobicContact CD2-CD1 3.86Å; L196-L242 HydrophobicContact CB-CD2 3.88Å; L207-L242 HydrophobicContact CD2-CD2 3.56Å; Q208-L242 PolarHBondContact NE2-O 2.87Å; F213-L242 HydrophobicContact CE2-CD1 4.03Å; F213-L242 HydrophobicContact CE2-CD2 3.99Å; F213-L242 HydrophobicContact CZ-CB 4.48Å; F213-L242 HydrophobicContact CZ-CD1 4.15Å; F213-L242 HydrophobicContact CZ-CD2 4.12Å; S238-L242 VanDerWaalsContact O-CB 3.27Å; S238-L242 WeakPolarHBondContact O-CB 3.24Å; S238-L242 WeakPolarHBondContact O-CD1 3.26Å; S238-L242 WeakPolarHBondContact O-CG 3.36Å; S238-L242 PolarHBondContact O-N 2.81Å; F239-L242 HydrophobicContact CD1-CD1 4.36Å; L242-I244 HydrophobicContact CB-CD1 4.12Å; L242-I244 HydrophobicContact CB-CG1 4.1Å; L242-I244 PolarHBondContact O-N 3.3Å
243	E	93.3	Very high	95.4	Very high	87 Å²	87	38.1 Å²	38.1	41%	0.407	21%	0.211	S	C	.	.	T	Hydrogen-bonded Turn	trans	53.3	41.3	176.4	-66.9	167.8	-139.1	0	0	112.3	R161 Q208 F239 V240 W241 P245	R161-E243 IonicContact CZ-OE1 2.71Å; R161-E243 VanDerWaalsContact CZ-OE1 3.26Å; R161-E243 IonicContact NH1-OE1 2.79Å; R161-E243 PolarHBondContact NH1-OE1 3.17Å; R161-E243 IonicContact NH2-OE1 2.73Å; R161-E243 PolarHBondContact NH2-OE1 3.44Å; Q208-E243 PolarHBondContact NE2-O 3.41Å; F239-E243 PolarHBondContact O-N 3.28Å; V240-E243 PolarHBondContact O-N 3.13Å; V240-E243 VanDerWaalsContact O-N 3.12Å; W241-E243 PolarHBondContact O-N 3.16Å; E243-P245 WeakPolarHBondContact O-CD 3.47Å
244	I	94.1	Very high	95.4	Very high	7 Å²	7	37.7 Å²	37.7	4%	0.036	21%	0.209	C	C	.	.			trans	-58.8	123.3	-179	-61.6	-64.3	0	0	0	109.5	F213 L217 F239 L242 S246 H248 V250 L251	F213-I244 HydrophobicContact CE1-CD1 4.19Å; F213-I244 HydrophobicContact CZ-CD1 3.87Å; L217-I244 HydrophobicContact CD1-CD1 4.37Å; L217-I244 HydrophobicContact CD2-CD1 4.44Å; F239-I244 HydrophobicContact CB-CB 4.26Å; F239-I244 HydrophobicContact CB-CG1 3.74Å; F239-I244 HydrophobicContact CD1-CD1 4.45Å; F239-I244 HydrophobicContact CD1-CG1 3.89Å; F239-I244 HydrophobicContact CG-CG1 3.92Å; F239-I244 WeakPolarHBondContact O-CG1 3.27Å; F239-I244 PolarHBondContact O-N 2.79Å; L242-I244 HydrophobicContact CB-CD1 4.12Å; L242-I244 HydrophobicContact CB-CG1 4.1Å; L242-I244 PolarHBondContact O-N 3.3Å; I244-S246 PolarHBondContact O-N 3.14Å; I244-H248 HydrophobicContact CG2-CB 3.87Å; I244-V250 HydrophobicContact CG2-CG1 4.3Å; I244-L251 HydrophobicContact CG2-CD1 4.26Å; I244-L251 HydrophobicContact CG2-CD2 4Å; I244-L251 HydrophobicContact CG2-CG 4.21Å
245	P	93.6	Very high	95.4	Very high	52 Å²	52	34.3 Å²	34.3	34%	0.338	19%	0.193	S	C	.	.			trans	-57.7	136.3	179.9	-26.9	35.2	0	0	0	112.2	E243 S247 H248 L251	E243-P245 WeakPolarHBondContact O-CD 3.47Å; P245-S247 PolarHBondContact O-N 2.91Å; P245-H248 WeakPolarHBondContact O-CB 3.27Å; P245-H248 PolarHBondContact O-N 3.34Å; P245-L251 WeakPolarHBondContact O-CD1 3.22Å
246	S	93.4	Very high	95.4	Very high	52 Å²	52	36.7 Å²	36.7	36%	0.364	21%	0.213	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.7	-13.7	-177.8	61.4	0	0	0	0	114.6	I244 I280 R281 R282	I244-S246 PolarHBondContact O-N 3.14Å; S246-I280 WeakPolarHBondContact CB-O 3.34Å; S246-R281 WeakPolarHBondContact CB-O 3.36Å; S246-R282 WeakPolarHBondContact O-CD 3.48Å; S246-R282 PolarHBondContact O-NH1 2.65Å
247	S	93.9	Very high	95.4	Very high	95 Å²	95	37.3 Å²	37.3	66%	0.664	22%	0.215	S	C	*	.	T	Hydrogen-bonded Turn	trans	-87.9	-3.6	171.1	52.8	0	0	0	0	114.6	P245 T249	P245-S247 PolarHBondContact O-N 2.91Å; S247-T249 PolarHBondContact O-N 2.77Å
248	H	94.4	Very high	95.4	Very high	67 Å²	67	34 Å²	34	31%	0.31	20%	0.2	S	C	.	.			trans	-74.2	126.3	-176	-166.7	-89.5	0	0	0	111.5	I244 P245 V250 L251	I244-H248 HydrophobicContact CG2-CB 3.87Å; P245-H248 WeakPolarHBondContact O-CB 3.27Å; P245-H248 PolarHBondContact O-N 3.34Å; H248-V250 WeakPolarHBondContact ND1-CB 3.47Å; H248-V250 WeakPolarHBondContact ND1-CG1 3.35Å; H248-V250 PolarHBondContact ND1-N 2.7Å; H248-V250 PolarHBondContact O-N 2.68Å; H248-V250 VanDerWaalsContact O-N 3.08Å; H248-L251 WeakPolarHBondContact O-CB 3.37Å; H248-L251 WeakPolarHBondContact O-CG 3.47Å; H248-L251 PolarHBondContact O-N 2.86Å
249	T	94.6	Very high	95.4	Very high	96 Å²	96	34.6 Å²	34.6	59%	0.589	20%	0.204	S	C	*	.	T	Hydrogen-bonded Turn	trans	-62.4	-21.9	-169.8	53.2	0	0	0	0	114.7	S247 L251 E252	S247-T249 PolarHBondContact O-N 2.77Å; T249-L251 PolarHBondContact O-N 3.43Å; T249-L251 VanDerWaalsContact O-N 3.16Å; T249-E252 PolarHBondContact O-N 3.47Å; T249-E252 VanDerWaalsContact O-N 3.12Å
250	V	95.8	Very high	95.3	Very high	7 Å²	7	40.7 Å²	40.7	4%	0.042	23%	0.227	C	C	.	.	H	α-helix	trans	-52.4	-36.8	172.6	80.7	0	0	0	0	111.8	V221 F239 I244 H248 E252 V253 Y254	V221-V250 HydrophobicContact CG2-CG2 3.66Å; F239-V250 HydrophobicContact CE2-CG1 4.12Å; F239-V250 HydrophobicContact CE2-CG2 4.36Å; F239-V250 HydrophobicContact CZ-CG1 4.33Å; F239-V250 HydrophobicContact CZ-CG2 4.16Å; I244-V250 HydrophobicContact CG2-CG1 4.3Å; H248-V250 WeakPolarHBondContact ND1-CB 3.47Å; H248-V250 WeakPolarHBondContact ND1-CG1 3.35Å; H248-V250 PolarHBondContact ND1-N 2.7Å; H248-V250 PolarHBondContact O-N 2.68Å; H248-V250 VanDerWaalsContact O-N 3.08Å; V250-E252 VanDerWaalsContact C-N 3.27Å; V250-E252 PolarHBondContact O-N 3.47Å; V250-V253 PolarHBondContact O-N 2.96Å; V250-Y254 HydrophobicContact CG2-CD2 4.03Å; V250-Y254 HydrophobicContact CG2-CE2 3.93Å; V250-Y254 WeakPolarHBondContact O-CD2 3.06Å; V250-Y254 PolarHBondContact O-N 3.31Å
251	L	96.8	Very high	95.3	Very high	0 Å²	0	40.6 Å²	40.6	0%	0	23%	0.225	C	C	.	.	H	α-helix	trans	-66.4	-29.1	-175.7	-59.3	-179.3	0	0	0	112.2	F239 I244 P245 H248 T249 Y254 E255 W277 I280 R282	F239-L251 HydrophobicContact CD2-CD2 3.9Å; F239-L251 HydrophobicContact CE2-CD2 4.44Å; I244-L251 HydrophobicContact CG2-CD1 4.26Å; I244-L251 HydrophobicContact CG2-CD2 4Å; I244-L251 HydrophobicContact CG2-CG 4.21Å; P245-L251 WeakPolarHBondContact O-CD1 3.22Å; H248-L251 WeakPolarHBondContact O-CB 3.37Å; H248-L251 WeakPolarHBondContact O-CG 3.47Å; H248-L251 PolarHBondContact O-N 2.86Å; T249-L251 PolarHBondContact O-N 3.43Å; T249-L251 VanDerWaalsContact O-N 3.16Å; L251-Y254 PolarHBondContact O-N 3.48Å; L251-E255 PolarHBondContact O-N 3.48Å; L251-W277 HydrophobicContact CB-CH2 4.36Å; L251-W277 HydrophobicContact CB-CZ3 3.93Å; L251-W277 HydrophobicContact CD2-CZ3 3.96Å; L251-W277 HydrophobicContact CG-CZ3 4.41Å; L251-W277 VanDerWaalsContact O-CH2 3.24Å; L251-W277 WeakPolarHBondContact O-CH2 3.49Å; L251-I280 HydrophobicContact CD1-CG2 3.62Å; L251-I280 HydrophobicContact CD2-CD1 4.36Å; L251-I280 HydrophobicContact CD2-CG2 4.22Å; L251-R282 HydrophobicContact CB-CG 4.45Å; L251-R282 HydrophobicContact CD1-CB 4.34Å; L251-R282 HydrophobicContact CD1-CG 4.39Å
252	E	95.2	Very high	95.3	Very high	89 Å²	89	40.3 Å²	40.3	42%	0.416	23%	0.225	S	C	.	.	H	α-helix	trans	-72.5	-36.3	179	-74.4	158	-169.4	0	0	111.7	T249 V250 A256 R282	T249-E252 PolarHBondContact O-N 3.47Å; T249-E252 VanDerWaalsContact O-N 3.12Å; V250-E252 VanDerWaalsContact C-N 3.27Å; V250-E252 PolarHBondContact O-N 3.47Å; E252-A256 WeakPolarHBondContact O-CB 3.44Å; E252-A256 PolarHBondContact O-N 2.91Å; E252-R282 IonicContact OE1-CZ 2.72Å; E252-R282 VanDerWaalsContact OE1-CZ 3.26Å; E252-R282 IonicContact OE1-NH1 3.8Å; E252-R282 PolarHBondContact OE1-NH1 3.14Å; E252-R282 IonicContact OE1-NH2 2.77Å; E252-R282 PolarHBondContact OE1-NH2 3.39Å
253	V	96	Very high	95.3	Very high	58 Å²	58	46.5 Å²	46.5	35%	0.352	26%	0.258	S	S	.	.	H	α-helix	trans	-71.5	-37.3	175.9	-152.7	0	0	0	0	110.9	V221 L224 V250 A256 E257	V221-V253 HydrophobicContact CG1-CG1 4.16Å; V221-V253 HydrophobicContact CG1-CG2 4.45Å; L224-V253 HydrophobicContact CD2-CB 4.17Å; L224-V253 HydrophobicContact CD2-CG1 3.58Å; V250-V253 PolarHBondContact O-N 2.96Å; V253-A256 PolarHBondContact O-N 3.04Å; V253-E257 PolarHBondContact O-N 2.56Å
254	Y	97.3	Very high	95.4	Very high	1 Å²	1	47.6 Å²	47.6	0%	0.004	26%	0.263	C	S	.	.	H	α-helix	trans	-69.6	-38.2	174.4	-86.6	-104.7	0	0	0	112.7	S220 V221 L224 L232 V235 F239 V250 L251 L258	S220-Y254 VanDerWaalsContact CB-OH 3.3Å; S220-Y254 WeakPolarHBondContact CB-OH 3.42Å; S220-Y254 PolarHBondContact O-OH 3.05Å; S220-Y254 PolarHBondContact OG-OH 3Å; V221-Y254 HydrophobicContact CG2-CE2 4.4Å; L224-Y254 HydrophobicContact CD1-CD1 3.93Å; L224-Y254 HydrophobicContact CD1-CD2 3.93Å; L224-Y254 HydrophobicContact CD1-CE1 3.65Å; L224-Y254 HydrophobicContact CD1-CE2 3.68Å; L224-Y254 HydrophobicContact CD1-CG 4.05Å; L232-Y254 HydrophobicContact CD2-CE1 4.15Å; V235-Y254 HydrophobicContact CB-CE1 4.13Å; V235-Y254 HydrophobicContact CG1-CE1 3.62Å; V235-Y254 WeakPolarHBondContact CG1-OH 3.4Å; F239-Y254 HydrophobicContact CE2-CD1 4.18Å; F239-Y254 HydrophobicContact CE2-CD2 4.01Å; F239-Y254 HydrophobicContact CE2-CE1 4.13Å; F239-Y254 AromaticContact CE2-CE2 3.94Å; F239-Y254 HydrophobicContact CE2-CE2 3.94Å; F239-Y254 HydrophobicContact CE2-CG 4.13Å; F239-Y254 HydrophobicContact CZ-CE1 4.46Å; F239-Y254 HydrophobicContact CZ-CE2 4.01Å; F239-Y254 AromaticContact CZ-CZ 4Å; V250-Y254 HydrophobicContact CG2-CD2 4.03Å; V250-Y254 HydrophobicContact CG2-CE2 3.93Å; V250-Y254 WeakPolarHBondContact O-CD2 3.06Å; V250-Y254 PolarHBondContact O-N 3.31Å; L251-Y254 PolarHBondContact O-N 3.48Å; Y254-L258 WeakPolarHBondContact O-CB 3.39Å; Y254-L258 PolarHBondContact O-N 3.12Å
255	E	96.8	Very high	95.4	Very high	10 Å²	10	47.4 Å²	47.4	5%	0.047	26%	0.262	C	S	.	.	H	α-helix	trans	-60.1	-47	171.2	-177.7	-177.3	179.5	0	0	110.3	L251 S259 W277 V284 Q286 F287	L251-E255 PolarHBondContact O-N 3.48Å; E255-S259 WeakPolarHBondContact O-CB 3.4Å; E255-S259 PolarHBondContact O-N 3.17Å; E255-S259 PolarHBondContact O-OG 3.35Å; E255-W277 HydrophobicContact CB-CH2 4.33Å; E255-W277 HydrophobicContact CB-CZ2 4.14Å; E255-V284 HydrophobicContact CB-CG1 4.17Å; E255-V284 VanDerWaalsContact CD-CA 3.46Å; E255-V284 HydrophobicContact CG-CB 3.95Å; E255-V284 HydrophobicContact CG-CG1 3.9Å; E255-V284 WeakPolarHBondContact OE1-CA 3.43Å; E255-Q286 WeakPolarHBondContact OE1-CB 3.43Å; E255-Q286 PolarHBondContact OE1-N 3.33Å; E255-F287 HydrophobicContact CG-CB 4.18Å; E255-F287 PolarHBondContact OE1-N 3.13Å
256	A	96.7	Very high	95.4	Very high	51 Å²	51	48.1 Å²	48.1	42%	0.421	27%	0.266	S	S	.	.	H	α-helix	trans	-62.3	-44.4	-179.2	0	0	0	0	0	112.6	E252 V253 R260	E252-A256 WeakPolarHBondContact O-CB 3.44Å; E252-A256 PolarHBondContact O-N 2.91Å; V253-A256 PolarHBondContact O-N 3.04Å; A256-R260 WeakPolarHBondContact O-CB 3.4Å; A256-R260 PolarHBondContact O-N 2.97Å
257	E	96.8	Very high	95.5	Very high	12 Å²	12	45.8 Å²	45.8	6%	0.056	25%	0.249	C	C	.	.	H	α-helix	trans	-69.4	-44.4	178.5	-178.7	73.6	171.8	0	0	112.2	L224 L232 V253 S259 R260 R261	L224-E257 HydrophobicContact CD1-CB 4.36Å; L224-E257 HydrophobicContact CD1-CG 4.34Å; L224-E257 HydrophobicContact CD2-CB 3.79Å; L224-E257 HydrophobicContact CD2-CG 4.28Å; L224-E257 HydrophobicContact CG-CB 3.98Å; L224-E257 HydrophobicContact CG-CG 3.93Å; L232-E257 HydrophobicContact CD1-CG 4.2Å; V253-E257 PolarHBondContact O-N 2.56Å; E257-S259 VanDerWaalsContact C-N 3.31Å; E257-S259 PolarHBondContact O-N 3.41Å; E257-R260 VanDerWaalsContact CD-NH2 3.27Å; E257-R260 WeakPolarHBondContact O-CB 3Å; E257-R260 PolarHBondContact O-N 3.5Å; E257-R260 VanDerWaalsContact O-N 3.12Å; E257-R260 IonicContact OE1-CZ 2.75Å; E257-R260 IonicContact OE1-NE 2.74Å; E257-R260 IonicContact OE1-NH2 3.2Å; E257-R260 PolarHBondContact OE1-NH2 3.21Å; E257-R260 IonicContact OE2-CZ 3.57Å; E257-R260 IonicContact OE2-NE 2.77Å; E257-R260 PolarHBondContact OE2-NE 3.33Å; E257-R260 IonicContact OE2-NH2 3.55Å; E257-R260 PolarHBondContact OE2-NH2 2.99Å; E257-R261 WeakPolarHBondContact O-CG 3.32Å; E257-R261 PolarHBondContact O-N 2.86Å; E257-R261 IonicContact OE1-CZ 3.63Å; E257-R261 VanDerWaalsContact OE1-CZ 3.26Å; E257-R261 IonicContact OE1-NE 3.8Å; E257-R261 PolarHBondContact OE1-NE 2.93Å; E257-R261 IonicContact OE1-NH2 2.75Å; E257-R261 PolarHBondContact OE1-NH2 3.05Å
258	L	96.7	Very high	95.6	Very high	1 Å²	1	44.2 Å²	44.2	1%	0.005	23%	0.231	C	C	.	.	H	α-helix	trans	-64.5	-36.2	176.1	-76.4	171.7	0	0	0	111.7	L232 L236 Y254 R260 R261 A262 L265 W277 F287	L232-L258 HydrophobicContact CB-CD2 4Å; L232-L258 HydrophobicContact CD1-CD2 4.07Å; L236-L258 HydrophobicContact CD2-CD1 3.98Å; Y254-L258 WeakPolarHBondContact O-CB 3.39Å; Y254-L258 PolarHBondContact O-N 3.12Å; L258-R260 VanDerWaalsContact C-N 3.32Å; L258-R260 PolarHBondContact O-N 2.88Å; L258-R261 CarbonylContact O-C 3.57Å; L258-R261 PolarHBondContact O-N 3.09Å; L258-A262 PolarHBondContact O-N 3.12Å; L258-L265 HydrophobicContact CD2-CD1 4.35Å; L258-W277 HydrophobicContact CD1-CZ2 4Å; L258-F287 HydrophobicContact CB-CD2 3.93Å; L258-F287 HydrophobicContact CB-CE2 3.94Å
259	S	96.6	Very high	95.7	Very high	14 Å²	14	42.7 Å²	42.7	10%	0.098	22%	0.224	C	C	.	.	H	α-helix	trans	-67.2	-32.4	173	-57.1	0	0	0	0	112.5	E255 E257 F287	E255-S259 WeakPolarHBondContact O-CB 3.4Å; E255-S259 PolarHBondContact O-N 3.17Å; E255-S259 PolarHBondContact O-OG 3.35Å; E257-S259 VanDerWaalsContact C-N 3.31Å; E257-S259 PolarHBondContact O-N 3.41Å; S259-F287 WeakPolarHBondContact OG-CA 3.49Å; S259-F287 PolarHBondContact OG-N 2.91Å
260	R	95.7	Very high	95.8	Very high	129 Å²	129	38.1 Å²	38.1	49%	0.487	20%	0.196	S	C	.	.	H	α-helix	trans	-71	-32.4	173.9	-168.5	-166.7	64.2	68.7	-6.1	112.5	A256 E257 L258	A256-R260 WeakPolarHBondContact O-CB 3.4Å; A256-R260 PolarHBondContact O-N 2.97Å; E257-R260 VanDerWaalsContact CD-NH2 3.27Å; E257-R260 WeakPolarHBondContact O-CB 3Å; E257-R260 PolarHBondContact O-N 3.5Å; E257-R260 VanDerWaalsContact O-N 3.12Å; E257-R260 IonicContact OE1-CZ 2.75Å; E257-R260 IonicContact OE1-NE 2.74Å; E257-R260 IonicContact OE1-NH2 3.2Å; E257-R260 PolarHBondContact OE1-NH2 3.21Å; E257-R260 IonicContact OE2-CZ 3.57Å; E257-R260 IonicContact OE2-NE 2.77Å; E257-R260 PolarHBondContact OE2-NE 3.33Å; E257-R260 IonicContact OE2-NH2 3.55Å; E257-R260 PolarHBondContact OE2-NH2 2.99Å; L258-R260 VanDerWaalsContact C-N 3.32Å; L258-R260 PolarHBondContact O-N 2.88Å
261	R	95.6	Very high	95.9	Very high	14 Å²	14	37.8 Å²	37.8	5%	0.053	19%	0.194	C	C	.	.	S	Bend	trans	-97.2	5.2	179.2	-57.7	-158.5	-159.3	-177.4	13	114.5	L224 R225 F227 E229 E257 L258 N263 Q264	L224-R261 PolarHBondContact O-NH2 3.46Å; L224-R261 VanDerWaalsContact O-NH2 3.16Å; R225-R261 PolarHBondContact O-NH2 3.46Å; F227-R261 PolarHBondContact O-NH1 3.15Å; F227-R261 PolarHBondContact O-NH2 3.41Å; F227-R261 VanDerWaalsContact O-NH2 3.08Å; E229-R261 WeakPolarHBondContact OE1-CD 3.39Å; E229-R261 IonicContact OE1-CZ 2.76Å; E229-R261 IonicContact OE1-NE 3.71Å; E229-R261 IonicContact OE1-NH1 3.79Å; E229-R261 PolarHBondContact OE1-NH1 3.05Å; E257-R261 WeakPolarHBondContact O-CG 3.32Å; E257-R261 PolarHBondContact O-N 2.86Å; E257-R261 IonicContact OE1-CZ 3.63Å; E257-R261 VanDerWaalsContact OE1-CZ 3.26Å; E257-R261 IonicContact OE1-NE 3.8Å; E257-R261 PolarHBondContact OE1-NE 2.93Å; E257-R261 IonicContact OE1-NH2 2.75Å; E257-R261 PolarHBondContact OE1-NH2 3.05Å; L258-R261 CarbonylContact O-C 3.57Å; L258-R261 PolarHBondContact O-N 3.09Å; R261-N263 PolarHBondContact O-N 2.9Å; R261-Q264 VanDerWaalsContact CG-OE1 3.27Å; R261-Q264 WeakPolarHBondContact O-CA 3.45Å; R261-Q264 WeakPolarHBondContact O-CB 3.32Å; R261-Q264 PolarHBondContact O-N 3.31Å
262	A	95.1	Very high	96	Very high	5 Å²	5	39.1 Å²	39.1	4%	0.041	20%	0.201	C	C	.	.	G	3₁₀ helix	trans	-56.9	-30.2	-171.5	0	0	0	0	0	114.3	L258 Q264 L270 R290	L258-A262 PolarHBondContact O-N 3.12Å; A262-Q264 VanDerWaalsContact C-N 3.29Å; A262-Q264 PolarHBondContact O-N 3.4Å; A262-L270 HydrophobicContact CB-CD2 4.08Å; A262-R290 HydrophobicContact CB-CB 3.68Å; A262-R290 HydrophobicContact CB-CG 4.22Å
263	N	93.5	Very high	96.1	Very high	130 Å²	130	34.9 Å²	34.9	70%	0.695	18%	0.182	S	C	*	.	G	3₁₀ helix	trans	-79.3	-3.5	175.3	68.2	-35.2	0	0	0	114.8	R261	R261-N263 PolarHBondContact O-N 2.9Å
264	Q	94.4	Very high	96.2	Very high	109 Å²	109	32.3 Å²	32.3	51%	0.509	17%	0.166	S	C	.	.	G	3₁₀ helix	trans	-100.6	-12	175.9	-50.1	-177.3	-75.6	0	0	111.7	E229 R261 A262	E229-Q264 HydrophobicContact CG-CB 4.49Å; R261-Q264 VanDerWaalsContact CG-OE1 3.27Å; R261-Q264 WeakPolarHBondContact O-CA 3.45Å; R261-Q264 WeakPolarHBondContact O-CB 3.32Å; R261-Q264 PolarHBondContact O-N 3.31Å; A262-Q264 VanDerWaalsContact C-N 3.29Å; A262-Q264 PolarHBondContact O-N 3.4Å
265	L	94.6	Very high	96.2	Very high	4 Å²	4	32.2 Å²	32.2	2%	0.021	17%	0.166	C	C	.	.	S	Bend	trans	-87.8	153.3	-179.9	-61.6	177.4	0	0	0	111.4	E229 L258 Q269 L270 F287 Y298	E229-L265 HydrophobicContact CB-CD2 3.61Å; E229-L265 HydrophobicContact CG-CD2 3.68Å; L258-L265 HydrophobicContact CD2-CD1 4.35Å; L265-Q269 HydrophobicContact CB-CB 4.06Å; L265-Q269 HydrophobicContact CD2-CB 4.17Å; L265-L270 HydrophobicContact CB-CD1 4.46Å; L265-L270 HydrophobicContact CB-CD2 3.93Å; L265-L270 HydrophobicContact CB-CG 3.76Å; L265-L270 HydrophobicContact CD1-CD2 3.72Å; L265-L270 HydrophobicContact CD1-CG 4.31Å; L265-L270 HydrophobicContact CG-CD2 4.41Å; L265-F287 HydrophobicContact CD1-CE2 4.44Å; L265-Y298 PolarHBondContact O-OH 2.71Å
266	T	94.6	Very high	96.3	Very high	67 Å²	67	31.8 Å²	31.8	41%	0.411	16%	0.164	S	C	.	.			trans	-79.4	162.5	166.7	70.7	0	0	0	0	111	H268 Q269 L270	T266-H268 PolarHBondContact O-N 2.79Å; T266-Q269 PolarHBondContact O-N 2.99Å; T266-Q269 VanDerWaalsContact O-N 3.09Å; T266-Q269 WeakPolarHBondContact OG1-CG 3.32Å; T266-Q269 PolarHBondContact OG1-N 2.87Å; T266-L270 WeakPolarHBondContact O-CG 3.47Å; T266-L270 PolarHBondContact O-N 2.89Å
267	L	94.8	Very high	96.3	Very high	3 Å²	3	29.4 Å²	29.4	2%	0.016	14%	0.144	C	C	.	.	H	α-helix	trans	-53.7	-39.7	174.1	-179.9	62.1	0	0	0	112.4	L270 L271 Y298 V302 E306	L267-L270 PolarHBondContact O-N 3.18Å; L267-L271 HydrophobicContact CD1-CD1 4.19Å; L267-L271 HydrophobicContact CD1-CG 4.32Å; L267-L271 HydrophobicContact CG-CD1 4.09Å; L267-L271 WeakPolarHBondContact O-CB 3.25Å; L267-L271 WeakPolarHBondContact O-CG 3.24Å; L267-L271 PolarHBondContact O-N 3.13Å; L267-Y298 HydrophobicContact CB-CD1 4.18Å; L267-Y298 HydrophobicContact CB-CD2 4.31Å; L267-Y298 HydrophobicContact CB-CG 3.98Å; L267-Y298 HydrophobicContact CD1-CD2 4.44Å; L267-V302 HydrophobicContact CD2-CG2 3.87Å; L267-E306 HydrophobicContact CD2-CB 4.08Å; L267-E306 HydrophobicContact CD2-CG 4.06Å
268	H	95.9	Very high	96.2	Very high	61 Å²	61	31.2 Å²	31.2	28%	0.282	15%	0.15	S	C	.	.	H	α-helix	trans	-65.5	-43.4	177.9	-66.7	-113.7	0	0	0	111.5	S153 L154 T266 L271 L272 E306	S153-H268 PolarHBondContact OG-ND1 3.48Å; L154-H268 HydrophobicContact CD2-CB 3.8Å; L154-H268 VanDerWaalsContact CD2-ND1 3.3Å; L154-H268 WeakPolarHBondContact CD2-ND1 3.36Å; T266-H268 PolarHBondContact O-N 2.79Å; H268-L271 PolarHBondContact O-N 2.62Å; H268-L272 VanDerWaalsContact O-CB 3.3Å; H268-L272 WeakPolarHBondContact O-CB 3.41Å; H268-L272 PolarHBondContact O-N 3.08Å; H268-E306 IonicContact CE1-OE1 2.84Å; H268-E306 PolarHBondContact CE1-OE1 2.8Å; H268-E306 IonicContact NE2-OE1 3.26Å
269	Q	96.6	Very high	96.1	Very high	35 Å²	35	32 Å²	32	16%	0.164	16%	0.156	C	C	.	.	H	α-helix	trans	-65.1	-37.4	176.1	-72.9	171.4	-28	0	0	112.5	L233 L265 T266 A273	L233-Q269 HydrophobicContact CD1-CB 3.89Å; L233-Q269 HydrophobicContact CD1-CG 3.79Å; L265-Q269 HydrophobicContact CB-CB 4.06Å; L265-Q269 HydrophobicContact CD2-CB 4.17Å; T266-Q269 PolarHBondContact O-N 2.99Å; T266-Q269 VanDerWaalsContact O-N 3.09Å; T266-Q269 WeakPolarHBondContact OG1-CG 3.32Å; T266-Q269 PolarHBondContact OG1-N 2.87Å; Q269-A273 VanDerWaalsContact O-CB 3.31Å; Q269-A273 WeakPolarHBondContact O-CB 3.48Å; Q269-A273 PolarHBondContact O-N 3.4Å
270	L	97.3	Very high	96	Very high	0 Å²	0	32 Å²	32	0%	0	15%	0.154	C	C	.	.	H	α-helix	trans	-67	-42.3	176	-71.5	164.9	0	0	0	112.1	A262 L265 T266 L267 A274 F287 L291 Y298	A262-L270 HydrophobicContact CB-CD2 4.08Å; L265-L270 HydrophobicContact CB-CD1 4.46Å; L265-L270 HydrophobicContact CB-CD2 3.93Å; L265-L270 HydrophobicContact CB-CG 3.76Å; L265-L270 HydrophobicContact CD1-CD2 3.72Å; L265-L270 HydrophobicContact CD1-CG 4.31Å; L265-L270 HydrophobicContact CG-CD2 4.41Å; T266-L270 WeakPolarHBondContact O-CG 3.47Å; T266-L270 PolarHBondContact O-N 2.89Å; L267-L270 PolarHBondContact O-N 3.18Å; L270-A274 PolarHBondContact O-N 2.94Å; L270-A274 VanDerWaalsContact O-N 3.12Å; L270-F287 HydrophobicContact CD2-CE2 4.12Å; L270-F287 HydrophobicContact CD2-CZ 3.84Å; L270-L291 HydrophobicContact CB-CD1 3.89Å; L270-Y298 HydrophobicContact CD1-CE2 4.14Å
271	L	97.4	Very high	95.9	Very high	0 Å²	0	34 Å²	34	0%	0	16%	0.162	C	C	.	.	H	α-helix	trans	-67.4	-45.5	175.5	-71.7	171.1	0	0	0	111.5	L154 L267 H268 A273 A274 D275 L291 E306 L310	L154-L271 HydrophobicContact CD1-CD1 4.48Å; L154-L271 HydrophobicContact CD2-CB 4.15Å; L154-L271 HydrophobicContact CD2-CD1 3.9Å; L267-L271 HydrophobicContact CD1-CD1 4.19Å; L267-L271 HydrophobicContact CD1-CG 4.32Å; L267-L271 HydrophobicContact CG-CD1 4.09Å; L267-L271 WeakPolarHBondContact O-CB 3.25Å; L267-L271 WeakPolarHBondContact O-CG 3.24Å; L267-L271 PolarHBondContact O-N 3.13Å; H268-L271 PolarHBondContact O-N 2.62Å; L271-A273 PolarHBondContact O-N 3.39Å; L271-A274 WeakPolarHBondContact O-CB 3.38Å; L271-A274 PolarHBondContact O-N 2.98Å; L271-A274 VanDerWaalsContact O-N 3.13Å; L271-D275 PolarHBondContact O-N 2.84Å; L271-L291 HydrophobicContact CD2-CD1 4.26Å; L271-L291 HydrophobicContact CD2-CD2 4.47Å; L271-E306 HydrophobicContact CD1-CB 4.01Å; L271-E306 HydrophobicContact CD1-CG 4.31Å; L271-L310 HydrophobicContact CD2-CB 4.14Å; L271-L310 HydrophobicContact CD2-CD1 4.37Å
272	L	98	Very high	95.7	Very high	29 Å²	29	35.4 Å²	35.4	15%	0.152	17%	0.167	C	C	.	.	H	α-helix	trans	-59.3	-44.9	175.4	178.5	61	0	0	0	111.7	L154 H268 A274 D275 L276	L154-L272 WeakPolarHBondContact O-CA 3.29Å; L154-L272 PolarHBondContact O-N 3.36Å; H268-L272 VanDerWaalsContact O-CB 3.3Å; H268-L272 WeakPolarHBondContact O-CB 3.41Å; H268-L272 PolarHBondContact O-N 3.08Å; L272-A274 VanDerWaalsContact C-N 3.33Å; L272-A274 PolarHBondContact O-N 3.19Å; L272-D275 PolarHBondContact O-N 3.05Å; L272-L276 HydrophobicContact CD1-CD1 4.31Å; L272-L276 HydrophobicContact CD1-CG 4.17Å; L272-L276 HydrophobicContact CG-CD1 4.12Å; L272-L276 HydrophobicContact CG-CG 4.42Å; L272-L276 WeakPolarHBondContact O-CB 3.49Å; L272-L276 VanDerWaalsContact O-CG 3.25Å; L272-L276 WeakPolarHBondContact O-CG 3.06Å; L272-L276 PolarHBondContact O-N 2.65Å
273	A	97.9	Very high	95.6	Very high	0 Å²	0	39.6 Å²	39.6	0%	0	19%	0.186	C	C	.	.	H	α-helix	trans	-56.7	-45.8	173.9	0	0	0	0	0	111.9	L233 Q269 L271 D275 L276 W277 F287	L233-A273 HydrophobicContact CD2-CB 3.71Å; Q269-A273 VanDerWaalsContact O-CB 3.31Å; Q269-A273 WeakPolarHBondContact O-CB 3.48Å; Q269-A273 PolarHBondContact O-N 3.4Å; L271-A273 PolarHBondContact O-N 3.39Å; A273-D275 PolarHBondContact O-N 3.4Å; A273-L276 PolarHBondContact O-N 3.31Å; A273-W277 PolarHBondContact O-N 3.32Å; A273-F287 HydrophobicContact CB-CE1 3.65Å; A273-F287 HydrophobicContact CB-CE2 4.33Å; A273-F287 HydrophobicContact CB-CZ 3.42Å; A273-F287 VanDerWaalsContact CB-CZ 3.42Å
274	A	97.8	Very high	95.6	Very high	3 Å²	3	33.7 Å²	33.7	3%	0.025	15%	0.154	C	C	.	.	H	α-helix	trans	-64.1	-38.5	177.7	0	0	0	0	0	112.6	L270 L271 L272 W277 R278 F287 L288 L291 I313	L270-A274 PolarHBondContact O-N 2.94Å; L270-A274 VanDerWaalsContact O-N 3.12Å; L271-A274 WeakPolarHBondContact O-CB 3.38Å; L271-A274 PolarHBondContact O-N 2.98Å; L271-A274 VanDerWaalsContact O-N 3.13Å; L272-A274 VanDerWaalsContact C-N 3.33Å; L272-A274 PolarHBondContact O-N 3.19Å; A274-W277 PolarHBondContact O-N 2.86Å; A274-R278 VanDerWaalsContact O-CB 3.29Å; A274-R278 WeakPolarHBondContact O-CB 3.3Å; A274-R278 PolarHBondContact O-N 2.9Å; A274-F287 HydrophobicContact CB-CE1 4.23Å; A274-L288 HydrophobicContact CB-CD2 4.04Å; A274-L291 HydrophobicContact CB-CD2 3.98Å; A274-I313 HydrophobicContact CB-CD1 3.91Å; A274-I313 HydrophobicContact CB-CG1 4.15Å; A274-I313 HydrophobicContact CB-CG2 3.86Å
275	D	97.6	Very high	95.5	Very high	0 Å²	0	32.6 Å²	32.6	0%	0	16%	0.157	C	C	.	.	H	α-helix	trans	-68	-37.3	175.6	-171.2	62.5	0	0	0	112.9	R142 S155 L156 L271 L272 A273 R278 C279 H309	R142-D275 IonicContact CZ-OD1 2.75Å; R142-D275 IonicContact CZ-OD2 3.66Å; R142-D275 IonicContact NE-OD1 2.9Å; R142-D275 IonicContact NH2-OD1 3.26Å; R142-D275 PolarHBondContact NH2-OD1 3.43Å; R142-D275 IonicContact NH2-OD2 3.58Å; R142-D275 PolarHBondContact NH2-OD2 2.74Å; S155-D275 WeakPolarHBondContact CA-OD2 3.44Å; L156-D275 PolarHBondContact N-OD2 2.92Å; L271-D275 PolarHBondContact O-N 2.84Å; L272-D275 PolarHBondContact O-N 3.05Å; A273-D275 PolarHBondContact O-N 3.4Å; D275-R278 WeakPolarHBondContact O-CB 3.44Å; D275-R278 PolarHBondContact O-N 3Å; D275-R278 PolarHBondContact O-NH2 3.34Å; D275-R278 IonicContact OD1-CZ 3.09Å; D275-R278 IonicContact OD1-NE 3.35Å; D275-R278 PolarHBondContact OD1-NE 2.94Å; D275-R278 IonicContact OD1-NH2 3.31Å; D275-R278 PolarHBondContact OD1-NH2 3.38Å; D275-R278 IonicContact OD2-NH2 2.76Å; D275-C279 PolarHBondContact O-N 3.33Å; D275-C279 PolarHBondContact O-SG 2.9Å; D275-H309 IonicContact OD1-CE1 3.66Å; D275-H309 IonicContact OD1-NE2 3.98Å
276	L	97.7	Very high	95.4	Very high	0 Å²	0	38.2 Å²	38.2	0%	0	18%	0.183	C	C	.	.	H	α-helix	trans	-65.9	-45.8	173.4	-69.4	174.9	0	0	0	111.3	L156 L236 Q237 V240 L272 A273 R278 C279 I280	L156-L276 HydrophobicContact CB-CD2 3.81Å; L156-L276 HydrophobicContact CD2-CD2 3.76Å; L156-L276 HydrophobicContact CG-CD2 4.32Å; L236-L276 HydrophobicContact CB-CD1 4.19Å; L236-L276 HydrophobicContact CD2-CB 3.72Å; L236-L276 HydrophobicContact CD2-CD1 4.15Å; L236-L276 HydrophobicContact CG-CB 3.92Å; L236-L276 HydrophobicContact CG-CD1 4.27Å; Q237-L276 HydrophobicContact CB-CD1 4.11Å; Q237-L276 HydrophobicContact CB-CD2 3.96Å; Q237-L276 HydrophobicContact CG-CD2 4.32Å; V240-L276 HydrophobicContact CG2-CD2 3.88Å; L272-L276 HydrophobicContact CD1-CD1 4.31Å; L272-L276 HydrophobicContact CD1-CG 4.17Å; L272-L276 HydrophobicContact CG-CD1 4.12Å; L272-L276 HydrophobicContact CG-CG 4.42Å; L272-L276 WeakPolarHBondContact O-CB 3.49Å; L272-L276 VanDerWaalsContact O-CG 3.25Å; L272-L276 WeakPolarHBondContact O-CG 3.06Å; L272-L276 PolarHBondContact O-N 2.65Å; A273-L276 PolarHBondContact O-N 3.31Å; L276-R278 VanDerWaalsContact C-N 3.29Å; L276-R278 PolarHBondContact O-N 3.46Å; L276-C279 WeakPolarHBondContact O-CA 3.11Å; L276-C279 WeakPolarHBondContact O-CB 3.3Å; L276-C279 PolarHBondContact O-N 2.73Å; L276-I280 WeakPolarHBondContact O-CG1 3.35Å; L276-I280 PolarHBondContact O-N 3.42Å
277	W	97.1	Very high	95.5	Very high	1 Å²	1	35 Å²	35	0%	0.004	16%	0.164	C	C	.	.	H	α-helix	trans	-57.8	-41.9	173.1	-74.3	126.2	0	0	0	112.6	L236 L251 E255 L258 A273 A274 I280 R281 R282 V284 F287	L236-W277 HydrophobicContact CD1-CD2 4.05Å; L236-W277 HydrophobicContact CD1-CE3 3.92Å; L236-W277 HydrophobicContact CD1-CH2 3.65Å; L236-W277 HydrophobicContact CD1-CZ2 3.78Å; L236-W277 HydrophobicContact CD1-CZ3 3.72Å; L236-W277 HydrophobicContact CD2-CD2 4.08Å; L236-W277 HydrophobicContact CD2-CG 4.3Å; L236-W277 HydrophobicContact CD2-CZ2 4.25Å; L251-W277 HydrophobicContact CB-CH2 4.36Å; L251-W277 HydrophobicContact CB-CZ3 3.93Å; L251-W277 HydrophobicContact CD2-CZ3 3.96Å; L251-W277 HydrophobicContact CG-CZ3 4.41Å; L251-W277 VanDerWaalsContact O-CH2 3.24Å; L251-W277 WeakPolarHBondContact O-CH2 3.49Å; E255-W277 HydrophobicContact CB-CH2 4.33Å; E255-W277 HydrophobicContact CB-CZ2 4.14Å; L258-W277 HydrophobicContact CD1-CZ2 4Å; A273-W277 PolarHBondContact O-N 3.32Å; A274-W277 PolarHBondContact O-N 2.86Å; W277-I280 HydrophobicContact CE3-CD1 4.17Å; W277-I280 HydrophobicContact CZ3-CD1 4.39Å; W277-I280 PolarHBondContact O-N 2.9Å; W277-R281 PolarHBondContact O-N 2.89Å; W277-R281 VanDerWaalsContact O-N 3.09Å; W277-R282 HydrophobicContact CE3-CB 3.97Å; W277-R282 HydrophobicContact CE3-CG 4.09Å; W277-R282 HydrophobicContact CZ3-CB 4.39Å; W277-R282 HydrophobicContact CZ3-CG 4.18Å; W277-R282 PolarHBondContact O-N 2.96Å; W277-R282 VanDerWaalsContact O-N 3.16Å; W277-V284 HydrophobicContact CB-CG1 4.29Å; W277-V284 HydrophobicContact CB-CG2 3.61Å; W277-V284 HydrophobicContact CD2-CB 4.47Å; W277-V284 HydrophobicContact CD2-CG1 3.57Å; W277-V284 HydrophobicContact CD2-CG2 4.27Å; W277-V284 HydrophobicContact CE3-CG1 3.71Å; W277-V284 HydrophobicContact CG-CB 4.32Å; W277-V284 HydrophobicContact CG-CG1 3.85Å; W277-V284 HydrophobicContact CG-CG2 3.63Å; W277-V284 HydrophobicContact CZ2-CG1 4.47Å; W277-V284 HydrophobicContact CZ3-CG1 4.22Å; W277-F287 AromaticContact CD1-CD1 3.89Å
278	R	94.6	Very high	95.5	Very high	50 Å²	50	36 Å²	36	19%	0.189	17%	0.168	C	C	.	.	H	α-helix	trans	-64.6	-36.1	173.7	-175.1	-151.7	56.6	61.2	8.1	112	R142 A274 D275 L276 R281 Y312 E316	R142-R278 VanDerWaalsContact NH2-NH2 3.12Å; A274-R278 VanDerWaalsContact O-CB 3.29Å; A274-R278 WeakPolarHBondContact O-CB 3.3Å; A274-R278 PolarHBondContact O-N 2.9Å; D275-R278 WeakPolarHBondContact O-CB 3.44Å; D275-R278 PolarHBondContact O-N 3Å; D275-R278 PolarHBondContact O-NH2 3.34Å; D275-R278 IonicContact OD1-CZ 3.09Å; D275-R278 IonicContact OD1-NE 3.35Å; D275-R278 PolarHBondContact OD1-NE 2.94Å; D275-R278 IonicContact OD1-NH2 3.31Å; D275-R278 PolarHBondContact OD1-NH2 3.38Å; D275-R278 IonicContact OD2-NH2 2.76Å; L276-R278 VanDerWaalsContact C-N 3.29Å; L276-R278 PolarHBondContact O-N 3.46Å; R278-R281 PolarHBondContact O-N 3.45Å; R278-Y312 WeakPolarHBondContact CD-OH 3.31Å; R278-Y312 PolarHBondContact NE-OH 3.04Å; R278-E316 HydrophobicContact CG-CB 4.23Å; R278-E316 HydrophobicContact CG-CG 4.33Å
279	C	94.8	Very high	95.5	Very high	18 Å²	18	38.4 Å²	38.4	12%	0.122	18%	0.18	C	C	.	.	H	α-helix	trans	-64.8	-43.9	172.2	-70.2	0	0	0	0	112.4	V240 D275 L276 R281	V240-C279 HydrophobicContact CB-CB 4.35Å; V240-C279 HydrophobicContact CG1-CB 3.7Å; V240-C279 HydrophobicContact CG2-CB 3.61Å; D275-C279 PolarHBondContact O-N 3.33Å; D275-C279 PolarHBondContact O-SG 2.9Å; L276-C279 WeakPolarHBondContact O-CA 3.11Å; L276-C279 WeakPolarHBondContact O-CB 3.3Å; L276-C279 PolarHBondContact O-N 2.73Å; C279-R281 PolarHBondContact O-N 3.38Å
280	I	95	Very high	95.4	Very high	13 Å²	13	42.5 Å²	42.5	7%	0.067	19%	0.194	C	C	.	.	H	α-helix	trans	-65.3	-14.4	174.1	-61.3	167.1	0	0	0	111.4	L236 F239 V240 S246 L251 L276 W277 R282	L236-I280 HydrophobicContact CD1-CD1 3.5Å; L236-I280 VanDerWaalsContact CD1-CD1 3.5Å; L236-I280 HydrophobicContact CG-CD1 4.05Å; F239-I280 HydrophobicContact CB-CD1 4Å; V240-I280 HydrophobicContact CG2-CD1 4.36Å; V240-I280 HydrophobicContact CG2-CG1 3.79Å; S246-I280 WeakPolarHBondContact CB-O 3.34Å; L251-I280 HydrophobicContact CD1-CG2 3.62Å; L251-I280 HydrophobicContact CD2-CD1 4.36Å; L251-I280 HydrophobicContact CD2-CG2 4.22Å; L276-I280 WeakPolarHBondContact O-CG1 3.35Å; L276-I280 PolarHBondContact O-N 3.42Å; W277-I280 HydrophobicContact CE3-CD1 4.17Å; W277-I280 HydrophobicContact CZ3-CD1 4.39Å; W277-I280 PolarHBondContact O-N 2.9Å; I280-R282 HydrophobicContact CG2-CB 4.13Å; I280-R282 PolarHBondContact O-N 3.34Å
281	R	93.2	Very high	95.3	Very high	171 Å²	171	42.5 Å²	42.5	65%	0.645	19%	0.194	S	C	*	.	T	Hydrogen-bonded Turn	trans	61.3	25.5	-174.1	-40.3	-177.1	-164.4	-178.7	6.7	112.7	S246 W277 R278 C279	S246-R281 WeakPolarHBondContact CB-O 3.36Å; W277-R281 PolarHBondContact O-N 2.89Å; W277-R281 VanDerWaalsContact O-N 3.09Å; R278-R281 PolarHBondContact O-N 3.45Å; C279-R281 PolarHBondContact O-N 3.38Å
282	R	92.4	Very high	95.2	Very high	45 Å²	45	43.1 Å²	43.1	17%	0.17	20%	0.196	C	C	.	.			trans	-84.4	134.9	173.2	-178.8	70.4	-161.8	-159.5	-1.6	109.2	S246 L251 E252 W277 I280 V284	S246-R282 WeakPolarHBondContact O-CD 3.48Å; S246-R282 PolarHBondContact O-NH1 2.65Å; L251-R282 HydrophobicContact CB-CG 4.45Å; L251-R282 HydrophobicContact CD1-CB 4.34Å; L251-R282 HydrophobicContact CD1-CG 4.39Å; E252-R282 IonicContact OE1-CZ 2.72Å; E252-R282 VanDerWaalsContact OE1-CZ 3.26Å; E252-R282 IonicContact OE1-NH1 3.8Å; E252-R282 PolarHBondContact OE1-NH1 3.14Å; E252-R282 IonicContact OE1-NH2 2.77Å; E252-R282 PolarHBondContact OE1-NH2 3.39Å; W277-R282 HydrophobicContact CE3-CB 3.97Å; W277-R282 HydrophobicContact CE3-CG 4.09Å; W277-R282 HydrophobicContact CZ3-CB 4.39Å; W277-R282 HydrophobicContact CZ3-CG 4.18Å; W277-R282 PolarHBondContact O-N 2.96Å; W277-R282 VanDerWaalsContact O-N 3.16Å; I280-R282 HydrophobicContact CG2-CB 4.13Å; I280-R282 PolarHBondContact O-N 3.34Å; R282-V284 HydrophobicContact CB-CG1 4.38Å; R282-V284 HydrophobicContact CG-CG1 3.67Å
283	Q	91.4	Very high	94.9	Very high	93 Å²	93	45.5 Å²	45.5	44%	0.435	21%	0.207	S	C	.	.			trans	-82.6	125	166.7	-69.4	-64.7	-36.3	0	0	108.5
284	V	93.7	Very high	94.6	Very high	5 Å²	5	46 Å²	46	3%	0.03	21%	0.21	C	C	.	.			trans	-128.9	65.8	-174.8	-70.7	0	0	0	0	111.7	E255 W277 R282 Q286 F287 L288	E255-V284 HydrophobicContact CB-CG1 4.17Å; E255-V284 VanDerWaalsContact CD-CA 3.46Å; E255-V284 HydrophobicContact CG-CB 3.95Å; E255-V284 HydrophobicContact CG-CG1 3.9Å; E255-V284 WeakPolarHBondContact OE1-CA 3.43Å; W277-V284 HydrophobicContact CB-CG1 4.29Å; W277-V284 HydrophobicContact CB-CG2 3.61Å; W277-V284 HydrophobicContact CD2-CB 4.47Å; W277-V284 HydrophobicContact CD2-CG1 3.57Å; W277-V284 HydrophobicContact CD2-CG2 4.27Å; W277-V284 HydrophobicContact CE3-CG1 3.71Å; W277-V284 HydrophobicContact CG-CB 4.32Å; W277-V284 HydrophobicContact CG-CG1 3.85Å; W277-V284 HydrophobicContact CG-CG2 3.63Å; W277-V284 HydrophobicContact CZ2-CG1 4.47Å; W277-V284 HydrophobicContact CZ3-CG1 4.22Å; R282-V284 HydrophobicContact CB-CG1 4.38Å; R282-V284 HydrophobicContact CG-CG1 3.67Å; V284-Q286 VanDerWaalsContact C-N 3.26Å; V284-Q286 PolarHBondContact O-N 3.35Å; V284-F287 HydrophobicContact CB-CB 4.15Å; V284-F287 HydrophobicContact CG2-CB 4.34Å; V284-F287 PolarHBondContact O-N 2.93Å; V284-L288 HydrophobicContact CG2-CG 4.27Å; V284-L288 WeakPolarHBondContact O-CG 3.23Å; V284-L288 PolarHBondContact O-N 2.93Å
285	P	92.3	Very high	94.2	Very high	87 Å²	87	45.9 Å²	45.9	57%	0.565	21%	0.209	S	C	*	.	H	α-helix	trans	-64.4	-28.5	-171.9	28	-35.3	0	0	0	113.2	Q289	P285-Q289 WeakPolarHBondContact O-CB 3.2Å; P285-Q289 PolarHBondContact O-N 3.04Å
286	Q	93.4	Very high	93.8	Very high	122 Å²	122	50 Å²	50	57%	0.57	23%	0.228	S	C	*	.	H	α-helix	trans	-72	-43.5	179.5	-53.7	-175.7	26.9	0	0	110.1	E255 V284 Q289 R290	E255-Q286 WeakPolarHBondContact OE1-CB 3.43Å; E255-Q286 PolarHBondContact OE1-N 3.33Å; V284-Q286 VanDerWaalsContact C-N 3.26Å; V284-Q286 PolarHBondContact O-N 3.35Å; Q286-Q289 PolarHBondContact O-N 3.09Å; Q286-R290 PolarHBondContact O-N 2.97Å
287	F	96.3	Very high	93.4	Very high	0 Å²	0	56.4 Å²	56.4	0%	0	26%	0.262	C	S	.	.	H	α-helix	trans	-66.6	-43.8	177.2	-174.7	-99.2	0	0	0	112	E255 L258 S259 L265 L270 A273 A274 W277 V284 Q289 R290 L291	E255-F287 HydrophobicContact CG-CB 4.18Å; E255-F287 PolarHBondContact OE1-N 3.13Å; L258-F287 HydrophobicContact CB-CD2 3.93Å; L258-F287 HydrophobicContact CB-CE2 3.94Å; S259-F287 WeakPolarHBondContact OG-CA 3.49Å; S259-F287 PolarHBondContact OG-N 2.91Å; L265-F287 HydrophobicContact CD1-CE2 4.44Å; L270-F287 HydrophobicContact CD2-CE2 4.12Å; L270-F287 HydrophobicContact CD2-CZ 3.84Å; A273-F287 HydrophobicContact CB-CE1 3.65Å; A273-F287 HydrophobicContact CB-CE2 4.33Å; A273-F287 HydrophobicContact CB-CZ 3.42Å; A273-F287 VanDerWaalsContact CB-CZ 3.42Å; A274-F287 HydrophobicContact CB-CE1 4.23Å; W277-F287 AromaticContact CD1-CD1 3.89Å; V284-F287 HydrophobicContact CB-CB 4.15Å; V284-F287 HydrophobicContact CG2-CB 4.34Å; V284-F287 PolarHBondContact O-N 2.93Å; F287-Q289 VanDerWaalsContact C-N 3.34Å; F287-Q289 PolarHBondContact O-N 2.79Å; F287-R290 PolarHBondContact O-N 2.86Å; F287-R290 VanDerWaalsContact O-N 3.16Å; F287-L291 PolarHBondContact O-N 3.46Å
288	L	95.8	Very high	93.1	Very high	22 Å²	22	57.8 Å²	57.8	12%	0.115	27%	0.267	C	S	.	.	H	α-helix	trans	-63.5	-38.8	177.3	-69.9	178.1	0	0	0	112.2	A274 V284 R290 L291 F292 I313	A274-L288 HydrophobicContact CB-CD2 4.04Å; V284-L288 HydrophobicContact CG2-CG 4.27Å; V284-L288 WeakPolarHBondContact O-CG 3.23Å; V284-L288 PolarHBondContact O-N 2.93Å; L288-R290 VanDerWaalsContact C-N 3.34Å; L288-R290 PolarHBondContact O-N 2.97Å; L288-L291 HydrophobicContact CD2-CD2 4.13Å; L288-L291 PolarHBondContact O-N 3.2Å; L288-F292 HydrophobicContact CB-CE2 4.03Å; L288-F292 HydrophobicContact CB-CZ 4.16Å; L288-F292 HydrophobicContact CD2-CZ 4.37Å; L288-F292 WeakPolarHBondContact O-CB 3.18Å; L288-F292 WeakPolarHBondContact O-CD2 3.42Å; L288-F292 WeakPolarHBondContact O-CG 3.41Å; L288-F292 PolarHBondContact O-N 2.86Å; L288-I313 HydrophobicContact CD2-CG2 3.54Å
289	Q	94.5	Very high	92.7	Very high	112 Å²	112	58.7 Å²	58.7	52%	0.523	28%	0.275	S	S	.	.	H	α-helix	trans	-58	-46.6	172.2	178.6	177	-17.2	0	0	111.2	P285 Q286 F287 F292 E293	P285-Q289 WeakPolarHBondContact O-CB 3.2Å; P285-Q289 PolarHBondContact O-N 3.04Å; Q286-Q289 PolarHBondContact O-N 3.09Å; F287-Q289 VanDerWaalsContact C-N 3.34Å; F287-Q289 PolarHBondContact O-N 2.79Å; Q289-F292 PolarHBondContact O-N 2.87Å; Q289-E293 HydrophobicContact CG-CG 4.33Å; Q289-E293 WeakPolarHBondContact CG-OE1 3.43Å; Q289-E293 PolarHBondContact NE2-OE1 3.46Å; Q289-E293 WeakPolarHBondContact O-CB 3.49Å; Q289-E293 VanDerWaalsContact O-CG 3.31Å; Q289-E293 WeakPolarHBondContact O-CG 3.28Å; Q289-E293 PolarHBondContact O-N 3.08Å
290	R	95.3	Very high	92.1	Very high	122 Å²	122	61.8 Å²	61.8	46%	0.46	31%	0.311	S	S	.	.	H	α-helix	trans	-63.1	-42	177.4	-67.5	-50.1	-163.4	-169.1	1.5	113.3	A262 Q286 F287 L288 E293 S294	A262-R290 HydrophobicContact CB-CB 3.68Å; A262-R290 HydrophobicContact CB-CG 4.22Å; Q286-R290 PolarHBondContact O-N 2.97Å; F287-R290 PolarHBondContact O-N 2.86Å; F287-R290 VanDerWaalsContact O-N 3.16Å; L288-R290 VanDerWaalsContact C-N 3.34Å; L288-R290 PolarHBondContact O-N 2.97Å; R290-E293 VanDerWaalsContact CD-OE2 3.23Å; R290-E293 WeakPolarHBondContact CD-OE2 3.46Å; R290-E293 IonicContact CZ-OE2 3.21Å; R290-E293 IonicContact NE-OE2 3.2Å; R290-E293 IonicContact NH1-OE1 2.71Å; R290-E293 IonicContact NH1-OE2 3.69Å; R290-E293 PolarHBondContact NH1-OE2 3.44Å; R290-S294 VanDerWaalsContact O-CB 3.31Å; R290-S294 WeakPolarHBondContact O-CB 3.36Å; R290-S294 PolarHBondContact O-N 2.72Å; R290-S294 PolarHBondContact O-OG 3.48Å
291	L	95.4	Very high	91.7	Very high	0 Å²	0	66.4 Å²	66.4	0%	0	33%	0.332	C	S	.	.	H	α-helix	trans	-54.9	-52.8	171.9	163.8	62.9	0	0	0	110.2	L270 L271 A274 F287 L288 S294 V295 L310 I313	L270-L291 HydrophobicContact CB-CD1 3.89Å; L271-L291 HydrophobicContact CD2-CD1 4.26Å; L271-L291 HydrophobicContact CD2-CD2 4.47Å; A274-L291 HydrophobicContact CB-CD2 3.98Å; F287-L291 PolarHBondContact O-N 3.46Å; L288-L291 HydrophobicContact CD2-CD2 4.13Å; L288-L291 PolarHBondContact O-N 3.2Å; L291-S294 PolarHBondContact O-N 3.03Å; L291-S294 VanDerWaalsContact O-N 3.13Å; L291-S294 PolarHBondContact O-OG 3.12Å; L291-V295 WeakPolarHBondContact O-CG2 3.08Å; L291-V295 PolarHBondContact O-N 2.97Å; L291-L310 HydrophobicContact CD2-CD1 4.45Å; L291-L310 HydrophobicContact CG-CD1 4.45Å; L291-I313 HydrophobicContact CD2-CG2 4.04Å
292	F	94.5	Very high	91.7	Very high	12 Å²	12	58.6 Å²	58.6	5%	0.053	30%	0.304	C	S	.	.	H	α-helix	trans	-66.4	-39.6	-176.3	-59.4	-24.8	0	0	0	113.4	L288 Q289 S294 L310 I313 I314 P321 L324	L288-F292 HydrophobicContact CB-CE2 4.03Å; L288-F292 HydrophobicContact CB-CZ 4.16Å; L288-F292 HydrophobicContact CD2-CZ 4.37Å; L288-F292 WeakPolarHBondContact O-CB 3.18Å; L288-F292 WeakPolarHBondContact O-CD2 3.42Å; L288-F292 WeakPolarHBondContact O-CG 3.41Å; L288-F292 PolarHBondContact O-N 2.86Å; Q289-F292 PolarHBondContact O-N 2.87Å; F292-S294 VanDerWaalsContact C-N 3.29Å; F292-S294 PolarHBondContact O-N 2.81Å; F292-L310 HydrophobicContact CD1-CD1 4.08Å; F292-L310 HydrophobicContact CE1-CD1 4.07Å; F292-I313 HydrophobicContact CE1-CG2 4.49Å; F292-I314 HydrophobicContact CD1-CG1 4.22Å; F292-I314 HydrophobicContact CE1-CD1 4.26Å; F292-I314 HydrophobicContact CE1-CG1 3.45Å; F292-I314 VanDerWaalsContact CE1-CG1 3.45Å; F292-I314 HydrophobicContact CZ-CG1 3.64Å; F292-P321 HydrophobicContact CB-CG 3.87Å; F292-P321 HydrophobicContact CD2-CG 3.59Å; F292-P321 HydrophobicContact CE2-CG 4.49Å; F292-P321 HydrophobicContact CG-CG 4.05Å; F292-L324 HydrophobicContact CB-CD2 4.06Å; F292-L324 HydrophobicContact CD1-CD2 4.14Å; F292-L324 HydrophobicContact CG-CD2 4.17Å
293	E	91.9	Very high	91.8	Very high	79 Å²	79	57.5 Å²	57.5	37%	0.369	31%	0.306	S	S	.	.	H	α-helix	trans	-57.1	-44.2	170.4	-74.6	169.7	179.7	0	0	110.8	Q289 R290 V295 H296	Q289-E293 HydrophobicContact CG-CG 4.33Å; Q289-E293 WeakPolarHBondContact CG-OE1 3.43Å; Q289-E293 PolarHBondContact NE2-OE1 3.46Å; Q289-E293 WeakPolarHBondContact O-CB 3.49Å; Q289-E293 VanDerWaalsContact O-CG 3.31Å; Q289-E293 WeakPolarHBondContact O-CG 3.28Å; Q289-E293 PolarHBondContact O-N 3.08Å; R290-E293 VanDerWaalsContact CD-OE2 3.23Å; R290-E293 WeakPolarHBondContact CD-OE2 3.46Å; R290-E293 IonicContact CZ-OE2 3.21Å; R290-E293 IonicContact NE-OE2 3.2Å; R290-E293 IonicContact NH1-OE1 2.71Å; R290-E293 IonicContact NH1-OE2 3.69Å; R290-E293 PolarHBondContact NH1-OE2 3.44Å; E293-V295 PolarHBondContact O-N 3.14Å; E293-H296 PolarHBondContact O-ND1 2.68Å
294	S	91.6	Very high	92.1	Very high	11 Å²	11	53.5 Å²	53.5	8%	0.077	29%	0.288	C	S	.	.	H	α-helix	trans	-70.8	-22.1	-173.4	79.6	0	0	0	0	115.6	R290 L291 F292 H296 L297 Y298	R290-S294 VanDerWaalsContact O-CB 3.31Å; R290-S294 WeakPolarHBondContact O-CB 3.36Å; R290-S294 PolarHBondContact O-N 2.72Å; R290-S294 PolarHBondContact O-OG 3.48Å; L291-S294 PolarHBondContact O-N 3.03Å; L291-S294 VanDerWaalsContact O-N 3.13Å; L291-S294 PolarHBondContact O-OG 3.12Å; F292-S294 VanDerWaalsContact C-N 3.29Å; F292-S294 PolarHBondContact O-N 2.81Å; S294-H296 PolarHBondContact O-N 2.76Å; S294-L297 WeakPolarHBondContact O-CB 3.4Å; S294-L297 PolarHBondContact O-N 2.93Å; S294-Y298 VanDerWaalsContact O-CD2 3.22Å; S294-Y298 WeakPolarHBondContact O-CD2 3.39Å
295	V	90.8	Very high	92.3	Very high	0 Å²	0	53.7 Å²	53.7	0%	0	29%	0.289	C	S	.	.	G	3₁₀ helix	trans	-54	-35.3	-175	-177.8	0	0	0	0	112.3	L291 E293 L297 Y298 L299 V302 L310 L324	L291-V295 WeakPolarHBondContact O-CG2 3.08Å; L291-V295 PolarHBondContact O-N 2.97Å; E293-V295 PolarHBondContact O-N 3.14Å; V295-L297 PolarHBondContact O-N 2.91Å; V295-L297 VanDerWaalsContact O-N 3.13Å; V295-Y298 PolarHBondContact O-N 3.16Å; V295-L299 HydrophobicContact CG1-CD2 4.25Å; V295-L299 WeakPolarHBondContact O-CD2 3.35Å; V295-L299 PolarHBondContact O-N 3.13Å; V295-V302 HydrophobicContact CG1-CG2 4.48Å; V295-L310 HydrophobicContact CG1-CD2 4.04Å; V295-L310 HydrophobicContact CG2-CD1 4.28Å; V295-L310 HydrophobicContact CG2-CD2 3.9Å; V295-L324 HydrophobicContact CB-CD1 3.9Å; V295-L324 HydrophobicContact CG1-CD1 4.07Å; V295-L324 HydrophobicContact CG2-CD1 4.16Å
296	H	88.8	Confident	92.5	Very high	86 Å²	86	50.2 Å²	50.2	40%	0.398	27%	0.265	S	S	.	.	G	3₁₀ helix	trans	-53.8	-28.8	175.4	-57.8	84.3	0	0	0	114	E293 S294 L299 I327	E293-H296 PolarHBondContact O-ND1 2.68Å; S294-H296 PolarHBondContact O-N 2.76Å; H296-L299 WeakPolarHBondContact O-CG 3.49Å; H296-I327 WeakPolarHBondContact CD2-CD1 3.45Å; H296-I327 VanDerWaalsContact NE2-CD1 3.35Å; H296-I327 WeakPolarHBondContact NE2-CD1 3.17Å
297	L	89.4	Confident	92.7	Very high	135 Å²	135	44.4 Å²	44.4	71%	0.707	24%	0.238	S	C	*	.	G	3₁₀ helix	trans	-83.5	-21.3	-178.8	-53.2	178.2	0	0	0	112.6	S294 V295	S294-L297 WeakPolarHBondContact O-CB 3.4Å; S294-L297 PolarHBondContact O-N 2.93Å; V295-L297 PolarHBondContact O-N 2.91Å; V295-L297 VanDerWaalsContact O-N 3.13Å
298	Y	90	Very high	92.8	Very high	31 Å²	31	44.4 Å²	44.4	12%	0.122	24%	0.238	C	C	.	.			trans	-111.3	14.8	-172.6	-54.2	-79.4	0	0	0	113.5	L265 L267 L270 S294 V295 G300 Q301 V302	L265-Y298 PolarHBondContact O-OH 2.71Å; L267-Y298 HydrophobicContact CB-CD1 4.18Å; L267-Y298 HydrophobicContact CB-CD2 4.31Å; L267-Y298 HydrophobicContact CB-CG 3.98Å; L267-Y298 HydrophobicContact CD1-CD2 4.44Å; L270-Y298 HydrophobicContact CD1-CE2 4.14Å; S294-Y298 VanDerWaalsContact O-CD2 3.22Å; S294-Y298 WeakPolarHBondContact O-CD2 3.39Å; V295-Y298 PolarHBondContact O-N 3.16Å; Y298-G300 PolarHBondContact O-N 3.2Å; Y298-Q301 WeakPolarHBondContact O-CA 3.48Å; Y298-Q301 WeakPolarHBondContact O-CB 3.44Å; Y298-Q301 PolarHBondContact O-N 2.9Å; Y298-V302 PolarHBondContact O-N 3.32Å
299	L	85.6	Confident	92.9	Very high	68 Å²	68	43.4 Å²	43.4	36%	0.356	23%	0.233	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56.5	-27.3	-174.8	-59.9	-179.6	0	0	0	114.8	V295 H296 Q301 I327 L331	V295-L299 HydrophobicContact CG1-CD2 4.25Å; V295-L299 WeakPolarHBondContact O-CD2 3.35Å; V295-L299 PolarHBondContact O-N 3.13Å; H296-L299 WeakPolarHBondContact O-CG 3.49Å; L299-Q301 VanDerWaalsContact C-N 3.27Å; L299-Q301 PolarHBondContact O-N 2.98Å; L299-I327 HydrophobicContact CD2-CG2 3.43Å; L299-I327 VanDerWaalsContact CD2-CG2 3.43Å; L299-L331 HydrophobicContact CD2-CD1 4.43Å
300	G	83.7	Confident	93.1	Very high	84 Å²	84	38.3 Å²	38.3	87%	0.866	21%	0.209	S	C	*	.	T	Hydrogen-bonded Turn	trans	-76.8	-8.6	173.2	0	0	0	0	0	114.9	Y298	Y298-G300 PolarHBondContact O-N 3.2Å
301	Q	86.1	Confident	93.2	Very high	109 Å²	109	32.6 Å²	32.6	51%	0.509	19%	0.188	S	C	.	.	T	Hydrogen-bonded Turn	trans	-114.7	-9.8	-176.3	-55.6	176.2	15.7	0	0	112.8	Y298 L299 G303	Y298-Q301 WeakPolarHBondContact O-CA 3.48Å; Y298-Q301 WeakPolarHBondContact O-CB 3.44Å; Y298-Q301 PolarHBondContact O-N 2.9Å; L299-Q301 VanDerWaalsContact C-N 3.27Å; L299-Q301 PolarHBondContact O-N 2.98Å; Q301-G303 PolarHBondContact O-N 3.37Å; Q301-G303 VanDerWaalsContact O-N 3.11Å
302	V	92.9	Very high	93.3	Very high	8 Å²	8	32.9 Å²	32.9	5%	0.048	19%	0.189	C	C	.	.			trans	-74.5	100.7	176.8	-177.2	0	0	0	0	109.6	L267 V295 Y298 E306 L307 L331	L267-V302 HydrophobicContact CD2-CG2 3.87Å; V295-V302 HydrophobicContact CG1-CG2 4.48Å; Y298-V302 PolarHBondContact O-N 3.32Å; V302-E306 HydrophobicContact CG1-CB 4.28Å; V302-L307 HydrophobicContact CG1-CB 3.85Å; V302-L307 HydrophobicContact CG1-CD1 4.5Å; V302-L331 HydrophobicContact CB-CD1 4.35Å; V302-L331 HydrophobicContact CG1-CD1 4.1Å
303	G	94.9	Very high	93.4	Very high	21 Å²	21	32.5 Å²	32.5	22%	0.216	19%	0.188	C	C	.	.			trans	-90.3	-163.3	169.1	0	0	0	0	0	112.4	Q301 E306 L307	Q301-G303 PolarHBondContact O-N 3.37Å; Q301-G303 VanDerWaalsContact O-N 3.11Å; G303-E306 WeakPolarHBondContact CA-OE2 3.44Å; G303-E306 PolarHBondContact N-OE2 2.87Å; G303-L307 WeakPolarHBondContact O-CB 3.23Å; G303-L307 PolarHBondContact O-N 2.91Å; G303-L307 VanDerWaalsContact O-N 3.13Å
304	V	97.3	Very high	93.6	Very high	10 Å²	10	28.8 Å²	28.8	6%	0.061	17%	0.17	C	C	.	.	H	α-helix	trans	-64.8	-48.6	176.2	-163.5	0	0	0	0	112.1	E306 L307 V308 H335 Q338 M339	V304-E306 PolarHBondContact O-N 3.11Å; V304-L307 PolarHBondContact O-N 3.27Å; V304-V308 HydrophobicContact CG1-CG2 4.12Å; V304-V308 WeakPolarHBondContact O-CB 3.01Å; V304-V308 VanDerWaalsContact O-CG2 3.22Å; V304-V308 WeakPolarHBondContact O-CG2 3.21Å; V304-V308 PolarHBondContact O-N 2.9Å; V304-H335 HydrophobicContact CG2-CB 4.2Å; V304-Q338 HydrophobicContact CG2-CB 3.95Å; V304-M339 HydrophobicContact CG1-CG 3.83Å
305	P	97.7	Very high	93.7	Very high	9 Å²	9	28.3 Å²	28.3	6%	0.058	17%	0.167	C	C	.	.	H	α-helix	trans	-60.7	-44.8	-179.1	-15.7	26.3	0	0	0	112.2	E150 Y151 L154 V308 H309	E150-P305 HydrophobicContact CB-CB 4.05Å; E150-P305 HydrophobicContact CB-CG 3.63Å; E150-P305 HydrophobicContact CG-CG 4.04Å; Y151-P305 HydrophobicContact CD1-CB 4.16Å; Y151-P305 HydrophobicContact CE1-CB 3.86Å; Y151-P305 WeakPolarHBondContact CE1-O 3.42Å; L154-P305 HydrophobicContact CD1-CB 3.76Å; P305-V308 PolarHBondContact O-N 2.56Å; P305-H309 WeakPolarHBondContact O-CB 3.16Å; P305-H309 PolarHBondContact O-N 3.34Å
306	E	97.4	Very high	93.8	Very high	14 Å²	14	30.1 Å²	30.1	7%	0.065	18%	0.175	C	C	.	.	H	α-helix	trans	-67.9	-40.8	-176.3	-59.2	66.6	-135.9	0	0	110.9	L154 L267 H268 L271 V302 G303 V304 L310	L154-E306 HydrophobicContact CD1-CG 4.29Å; L154-E306 HydrophobicContact CD2-CG 4.49Å; L267-E306 HydrophobicContact CD2-CB 4.08Å; L267-E306 HydrophobicContact CD2-CG 4.06Å; H268-E306 IonicContact CE1-OE1 2.84Å; H268-E306 PolarHBondContact CE1-OE1 2.8Å; H268-E306 IonicContact NE2-OE1 3.26Å; L271-E306 HydrophobicContact CD1-CB 4.01Å; L271-E306 HydrophobicContact CD1-CG 4.31Å; V302-E306 HydrophobicContact CG1-CB 4.28Å; G303-E306 WeakPolarHBondContact CA-OE2 3.44Å; G303-E306 PolarHBondContact N-OE2 2.87Å; V304-E306 PolarHBondContact O-N 3.11Å; E306-L310 WeakPolarHBondContact O-CB 3.19Å; E306-L310 PolarHBondContact O-N 3.21Å
307	L	97.6	Very high	93.8	Very high	0 Å²	0	27 Å²	27	0%	0	17%	0.167	C	C	.	.	H	α-helix	trans	-65.6	-46.7	176.9	179.4	63.7	0	0	0	112.4	V302 G303 V304 L310 L311 L331 I332 H335 M339	V302-L307 HydrophobicContact CG1-CB 3.85Å; V302-L307 HydrophobicContact CG1-CD1 4.5Å; G303-L307 WeakPolarHBondContact O-CB 3.23Å; G303-L307 PolarHBondContact O-N 2.91Å; G303-L307 VanDerWaalsContact O-N 3.13Å; V304-L307 PolarHBondContact O-N 3.27Å; L307-L310 PolarHBondContact O-N 3.09Å; L307-L311 HydrophobicContact CD1-CD1 4.06Å; L307-L311 HydrophobicContact CG-CD1 4.1Å; L307-L311 WeakPolarHBondContact O-CB 3.17Å; L307-L311 WeakPolarHBondContact O-CG 3.21Å; L307-L311 PolarHBondContact O-N 2.78Å; L307-L331 HydrophobicContact CD1-CB 3.93Å; L307-L331 HydrophobicContact CD2-CB 4Å; L307-I332 HydrophobicContact CD1-CG1 4.47Å; L307-I332 HydrophobicContact CD2-CG1 4.2Å; L307-H335 HydrophobicContact CD2-CB 4.22Å; L307-M339 HydrophobicContact CD2-CE 3.92Å
308	V	98.3	Very high	93.8	Very high	0 Å²	0	24.9 Å²	24.9	0%	0	15%	0.149	C	C	.	.	H	α-helix	trans	-67.8	-41	-179.2	175.3	0	0	0	0	110.2	F144 Y151 V304 P305 L311 Y312 M339 E343 V346 V347	F144-V308 HydrophobicContact CD2-CG1 3.69Å; F144-V308 HydrophobicContact CE2-CG1 3.95Å; Y151-V308 WeakPolarHBondContact OH-CB 3.35Å; V304-V308 HydrophobicContact CG1-CG2 4.12Å; V304-V308 WeakPolarHBondContact O-CB 3.01Å; V304-V308 VanDerWaalsContact O-CG2 3.22Å; V304-V308 WeakPolarHBondContact O-CG2 3.21Å; V304-V308 PolarHBondContact O-N 2.9Å; P305-V308 PolarHBondContact O-N 2.56Å; V308-L311 PolarHBondContact O-N 2.93Å; V308-Y312 WeakPolarHBondContact O-CB 3.45Å; V308-Y312 PolarHBondContact O-N 3.49Å; V308-M339 HydrophobicContact CG2-CE 4.22Å; V308-E343 HydrophobicContact CG1-CB 4.07Å; V308-E343 HydrophobicContact CG1-CG 4.26Å; V308-E343 HydrophobicContact CG2-CB 4Å; V308-E343 HydrophobicContact CG2-CG 4.46Å; V308-V346 HydrophobicContact CG1-CB 4.25Å; V308-V346 HydrophobicContact CG1-CG1 3.88Å; V308-V347 HydrophobicContact CG2-CG2 4.18Å
309	H	97.8	Very high	93.8	Very high	0 Å²	0	28.8 Å²	28.8	0%	0	17%	0.168	C	C	.	.	H	α-helix	trans	-67.2	-41.8	175.6	-158.2	116.8	0	0	0	111.7	Y151 L154 S155 D275 P305 L311 Y312 I313	Y151-H309 HydrophobicContact CE1-CB 4.35Å; L154-H309 HydrophobicContact CD1-CB 4.23Å; L154-H309 PolarHBondContact O-CE1 3.22Å; S155-H309 PolarHBondContact OG-CE1 2.92Å; S155-H309 PolarHBondContact OG-ND1 3.22Å; D275-H309 IonicContact OD1-CE1 3.66Å; D275-H309 IonicContact OD1-NE2 3.98Å; P305-H309 WeakPolarHBondContact O-CB 3.16Å; P305-H309 PolarHBondContact O-N 3.34Å; H309-L311 VanDerWaalsContact C-N 3.34Å; H309-L311 PolarHBondContact O-N 3.39Å; H309-Y312 WeakPolarHBondContact O-CB 3.45Å; H309-Y312 PolarHBondContact O-N 3.04Å; H309-I313 WeakPolarHBondContact O-CG1 3.44Å; H309-I313 PolarHBondContact O-N 3.24Å
310	L	97.3	Very high	94.1	Very high	5 Å²	5	26.3 Å²	26.3	3%	0.026	16%	0.156	C	C	.	.	H	α-helix	trans	-58.7	-44.6	174	177.1	62.1	0	0	0	111.6	L271 L291 F292 V295 E306 L307 I313 I314 I328	L271-L310 HydrophobicContact CD2-CB 4.14Å; L271-L310 HydrophobicContact CD2-CD1 4.37Å; L291-L310 HydrophobicContact CD2-CD1 4.45Å; L291-L310 HydrophobicContact CG-CD1 4.45Å; F292-L310 HydrophobicContact CD1-CD1 4.08Å; F292-L310 HydrophobicContact CE1-CD1 4.07Å; V295-L310 HydrophobicContact CG1-CD2 4.04Å; V295-L310 HydrophobicContact CG2-CD1 4.28Å; V295-L310 HydrophobicContact CG2-CD2 3.9Å; E306-L310 WeakPolarHBondContact O-CB 3.19Å; E306-L310 PolarHBondContact O-N 3.21Å; L307-L310 PolarHBondContact O-N 3.09Å; L310-I313 PolarHBondContact O-N 3.12Å; L310-I314 HydrophobicContact CD1-CD1 4.07Å; L310-I314 HydrophobicContact CD1-CG1 4.38Å; L310-I314 HydrophobicContact CG-CD1 3.89Å; L310-I314 WeakPolarHBondContact O-CB 3.44Å; L310-I314 VanDerWaalsContact O-CG1 3.3Å; L310-I314 WeakPolarHBondContact O-CG1 3.2Å; L310-I314 PolarHBondContact O-N 2.61Å; L310-I328 HydrophobicContact CD2-CD1 4.13Å; L310-I328 HydrophobicContact CD2-CG1 4.5Å; L310-I328 HydrophobicContact CG-CD1 4.5Å
311	L	97.5	Very high	94.5	Very high	2 Å²	2	23.9 Å²	23.9	1%	0.01	13%	0.125	C	C	.	.	H	α-helix	trans	-65.5	-35.8	176.3	-81.7	161.2	0	0	0	113	L307 V308 H309 G315 I328 I332 V347 G350 L351	L307-L311 HydrophobicContact CD1-CD1 4.06Å; L307-L311 HydrophobicContact CG-CD1 4.1Å; L307-L311 WeakPolarHBondContact O-CB 3.17Å; L307-L311 WeakPolarHBondContact O-CG 3.21Å; L307-L311 PolarHBondContact O-N 2.78Å; V308-L311 PolarHBondContact O-N 2.93Å; H309-L311 VanDerWaalsContact C-N 3.34Å; H309-L311 PolarHBondContact O-N 3.39Å; L311-G315 PolarHBondContact O-N 3.4Å; L311-I328 HydrophobicContact CD1-CG2 4.3Å; L311-I328 HydrophobicContact CD2-CD1 4.5Å; L311-I328 HydrophobicContact CD2-CG2 3.87Å; L311-I328 HydrophobicContact CG-CG2 4.32Å; L311-I332 HydrophobicContact CD1-CD1 3.82Å; L311-I332 HydrophobicContact CD1-CG1 3.83Å; L311-V347 HydrophobicContact CD1-CB 4.44Å; L311-V347 HydrophobicContact CD1-CG1 4.18Å; L311-V347 HydrophobicContact CD1-CG2 3.88Å; L311-G350 VanDerWaalsContact O-CA 3.27Å; L311-G350 WeakPolarHBondContact O-CA 3.27Å; L311-L351 HydrophobicContact CD2-CD2 3.95Å; L311-L351 HydrophobicContact CD2-CG 4.18Å
312	Y	97.4	Very high	94.6	Very high	7 Å²	7	27 Å²	27	3%	0.027	14%	0.137	C	C	.	.	H	α-helix	trans	-61.1	-48.9	170.8	175.5	-117.9	0	0	0	111.5	R142 F144 R278 V308 H309 G315 E316 V346	R142-Y312 WeakPolarHBondContact CG-OH 3.34Å; F144-Y312 HydrophobicContact CE1-CD1 4.2Å; F144-Y312 HydrophobicContact CE1-CD2 4.15Å; F144-Y312 HydrophobicContact CE1-CE1 4.39Å; F144-Y312 HydrophobicContact CE1-CE2 4.37Å; F144-Y312 HydrophobicContact CE1-CG 4.07Å; F144-Y312 AromaticContact CZ-CD1 3.73Å; F144-Y312 HydrophobicContact CZ-CD1 3.73Å; F144-Y312 HydrophobicContact CZ-CD2 4.26Å; F144-Y312 HydrophobicContact CZ-CE1 4.27Å; F144-Y312 AromaticContact CZ-CG 3.72Å; F144-Y312 HydrophobicContact CZ-CG 3.72Å; R278-Y312 WeakPolarHBondContact CD-OH 3.31Å; R278-Y312 PolarHBondContact NE-OH 3.04Å; V308-Y312 WeakPolarHBondContact O-CB 3.45Å; V308-Y312 PolarHBondContact O-N 3.49Å; H309-Y312 WeakPolarHBondContact O-CB 3.45Å; H309-Y312 PolarHBondContact O-N 3.04Å; Y312-G315 CarbonylContact O-C 3.49Å; Y312-G315 WeakPolarHBondContact O-CA 3.21Å; Y312-G315 PolarHBondContact O-N 3.41Å; Y312-G315 VanDerWaalsContact O-N 3.13Å; Y312-E316 HydrophobicContact CD2-CG 4.26Å; Y312-E316 HydrophobicContact CE2-CG 3.83Å; Y312-E316 WeakPolarHBondContact CE2-OE1 3.46Å; Y312-E316 PolarHBondContact O-N 3.47Å; Y312-V346 HydrophobicContact CD2-CG1 4.24Å; Y312-V346 HydrophobicContact CG-CG1 4.36Å
313	I	97	Very high	94.4	Very high	4 Å²	4	32.2 Å²	32.2	2%	0.021	17%	0.165	C	C	.	.	H	α-helix	trans	-63.7	-43.7	178.4	-68.5	-64.5	0	0	0	112.1	A274 L288 L291 F292 H309 L310 G315 E316 G317	A274-I313 HydrophobicContact CB-CD1 3.91Å; A274-I313 HydrophobicContact CB-CG1 4.15Å; A274-I313 HydrophobicContact CB-CG2 3.86Å; L288-I313 HydrophobicContact CD2-CG2 3.54Å; L291-I313 HydrophobicContact CD2-CG2 4.04Å; F292-I313 HydrophobicContact CE1-CG2 4.49Å; H309-I313 WeakPolarHBondContact O-CG1 3.44Å; H309-I313 PolarHBondContact O-N 3.24Å; L310-I313 PolarHBondContact O-N 3.12Å; I313-G315 VanDerWaalsContact C-N 3.25Å; I313-G315 PolarHBondContact O-N 3.16Å; I313-E316 PolarHBondContact O-N 3.37Å; I313-G317 PolarHBondContact O-N 3.05Å
314	I	95.6	Very high	94.3	Very high	1 Å²	1	31.3 Å²	31.3	1%	0.005	16%	0.155	C	C	.	.	H	α-helix	trans	-55.8	-42.9	171.4	-75.4	167.4	0	0	0	110.7	F292 L310 R318 H319 C320 L324 I328 A354	F292-I314 HydrophobicContact CD1-CG1 4.22Å; F292-I314 HydrophobicContact CE1-CD1 4.26Å; F292-I314 HydrophobicContact CE1-CG1 3.45Å; F292-I314 VanDerWaalsContact CE1-CG1 3.45Å; F292-I314 HydrophobicContact CZ-CG1 3.64Å; L310-I314 HydrophobicContact CD1-CD1 4.07Å; L310-I314 HydrophobicContact CD1-CG1 4.38Å; L310-I314 HydrophobicContact CG-CD1 3.89Å; L310-I314 WeakPolarHBondContact O-CB 3.44Å; L310-I314 VanDerWaalsContact O-CG1 3.3Å; L310-I314 WeakPolarHBondContact O-CG1 3.2Å; L310-I314 PolarHBondContact O-N 2.61Å; I314-R318 PolarHBondContact O-N 3.01Å; I314-H319 PolarHBondContact O-N 3.34Å; I314-C320 HydrophobicContact CG2-CB 3.7Å; I314-L324 HydrophobicContact CD1-CD2 3.86Å; I314-I328 HydrophobicContact CD1-CD1 3.42Å; I314-I328 VanDerWaalsContact CD1-CD1 3.42Å; I314-A354 HydrophobicContact CG2-CB 3.56Å
315	G	94.6	Very high	94	Very high	0 Å²	0	32 Å²	32	0%	0	16%	0.158	C	C	.	.	H	α-helix	trans	-60.4	-50.7	174.4	0	0	0	0	0	113.3	L311 Y312 I313 G317 R318 K353	L311-G315 PolarHBondContact O-N 3.4Å; Y312-G315 CarbonylContact O-C 3.49Å; Y312-G315 WeakPolarHBondContact O-CA 3.21Å; Y312-G315 PolarHBondContact O-N 3.41Å; Y312-G315 VanDerWaalsContact O-N 3.13Å; I313-G315 VanDerWaalsContact C-N 3.25Å; I313-G315 PolarHBondContact O-N 3.16Å; G315-G317 VanDerWaalsContact C-N 3.35Å; G315-G317 PolarHBondContact O-N 3.35Å; G315-R318 VanDerWaalsContact O-CD 3.26Å; G315-R318 WeakPolarHBondContact O-CD 3.48Å; G315-R318 PolarHBondContact O-N 3.1Å; G315-R318 VanDerWaalsContact O-N 3.12Å; G315-K353 VanDerWaalsContact O-CB 3.23Å; G315-K353 WeakPolarHBondContact O-CB 3.3Å
316	E	92.3	Very high	93.6	Very high	39 Å²	39	39.9 Å²	39.9	18%	0.182	19%	0.188	C	C	.	.	H	α-helix	trans	-70.9	-30.5	-179.2	-58.7	-56.7	165.1	0	0	113.1	R278 Y312 I313 R318 K353	R278-E316 HydrophobicContact CG-CB 4.23Å; R278-E316 HydrophobicContact CG-CG 4.33Å; Y312-E316 HydrophobicContact CD2-CG 4.26Å; Y312-E316 HydrophobicContact CE2-CG 3.83Å; Y312-E316 WeakPolarHBondContact CE2-OE1 3.46Å; Y312-E316 PolarHBondContact O-N 3.47Å; I313-E316 PolarHBondContact O-N 3.37Å; E316-R318 VanDerWaalsContact C-N 3.25Å; E316-R318 PolarHBondContact O-N 3.29Å; E316-K353 IonicContact OE1-NZ 3.94Å; E316-K353 PolarHBondContact OE1-NZ 3.06Å; E316-K353 IonicContact OE2-NZ 3.68Å; E316-K353 PolarHBondContact OE2-NZ 2.96Å
317	G	90.1	Very high	93.4	Very high	21 Å²	21	40.9 Å²	40.9	22%	0.216	19%	0.193	C	C	.	.	T	Hydrogen-bonded Turn	trans	-73.6	-9.2	169.4	0	0	0	0	0	114.7	I313 G315 H319	I313-G317 PolarHBondContact O-N 3.05Å; G315-G317 VanDerWaalsContact C-N 3.35Å; G315-G317 PolarHBondContact O-N 3.35Å; G317-H319 PolarHBondContact O-N 3.44Å; G317-H319 VanDerWaalsContact O-N 3.11Å
318	R	89.9	Confident	93.1	Very high	89 Å²	89	40.9 Å²	40.9	34%	0.336	19%	0.193	S	C	.	.	T	Hydrogen-bonded Turn	trans	57.6	19.8	178.4	-57.2	-63.5	179.2	109.1	16.4	115.4	D111 I314 G315 E316 K353	D111-R318 IonicContact OD2-CZ 3.81Å; D111-R318 IonicContact OD2-NH1 2.8Å; D111-R318 PolarHBondContact OD2-NH1 3.33Å; D111-R318 IonicContact OD2-NH2 3.85Å; D111-R318 PolarHBondContact OD2-NH2 2.81Å; I314-R318 PolarHBondContact O-N 3.01Å; G315-R318 VanDerWaalsContact O-CD 3.26Å; G315-R318 WeakPolarHBondContact O-CD 3.48Å; G315-R318 PolarHBondContact O-N 3.1Å; G315-R318 VanDerWaalsContact O-N 3.12Å; E316-R318 VanDerWaalsContact C-N 3.25Å; E316-R318 PolarHBondContact O-N 3.29Å; R318-K353 WeakPolarHBondContact CD-O 3.45Å
319	H	89.1	Confident	93	Very high	114 Å²	114	43.5 Å²	43.5	53%	0.528	21%	0.206	S	C	.	.			trans	-148.9	129.2	-176.3	178.7	67.6	0	0	0	111.1	I314 G317	I314-H319 PolarHBondContact O-N 3.34Å; G317-H319 PolarHBondContact O-N 3.44Å; G317-H319 VanDerWaalsContact O-N 3.11Å
320	C	92	Very high	92.9	Very high	16 Å²	16	47 Å²	47	11%	0.108	23%	0.229	C	C	.	.			trans	-114.6	125.9	167	-170.4	0	0	0	0	108.4	I314 A354 T356	I314-C320 HydrophobicContact CG2-CB 3.7Å; C320-A354 HydrophobicContact CB-CB 4.29Å; C320-T356 HydrophobicContact CB-CG2 4.27Å; C320-T356 VanDerWaalsContact CB-OG1 3.23Å; C320-T356 WeakPolarHBondContact CB-OG1 3.35Å
321	P	91.9	Very high	92.8	Very high	33 Å²	33	47.6 Å²	47.6	21%	0.214	23%	0.232	C	C	.	.			trans	-60.2	143.3	170.6	-26.2	37.2	0	0	0	111.7	F292 D323 L324	F292-P321 HydrophobicContact CB-CG 3.87Å; F292-P321 HydrophobicContact CD2-CG 3.59Å; F292-P321 HydrophobicContact CE2-CG 4.49Å; F292-P321 HydrophobicContact CG-CG 4.05Å; P321-D323 VanDerWaalsContact C-N 3.32Å; P321-D323 PolarHBondContact O-N 3.24Å; P321-L324 HydrophobicContact CB-CB 4.26Å; P321-L324 PolarHBondContact O-N 2.56Å
322	K	88	Confident	92.8	Very high	174 Å²	174	47.5 Å²	47.5	76%	0.757	23%	0.231	S	C	*	.	H	α-helix	trans	-60.6	-39.2	-174.9	-72.9	-174.6	176.6	-177.9	0	113.1	L324 I325 Y326	K322-L324 VanDerWaalsContact C-N 3.33Å; K322-I325 WeakPolarHBondContact O-CG2 3.32Å; K322-Y326 WeakPolarHBondContact O-CD2 3.29Å; K322-Y326 WeakPolarHBondContact O-CE2 3.18Å
323	D	89.4	Confident	92.8	Very high	117 Å²	117	49.7 Å²	49.7	63%	0.626	24%	0.242	S	C	*	.	H	α-helix	trans	-74.9	-29.7	-174.9	-46.4	-58.6	0	0	0	111.4	P321 I325 Y326	P321-D323 VanDerWaalsContact C-N 3.32Å; P321-D323 PolarHBondContact O-N 3.24Å; D323-I325 VanDerWaalsContact C-N 3.31Å; D323-I325 PolarHBondContact O-N 3.45Å; D323-Y326 PolarHBondContact O-N 3.33Å
324	L	92.1	Very high	92.8	Very high	2 Å²	2	57.4 Å²	57.4	1%	0.01	27%	0.271	C	S	.	.	H	α-helix	trans	-67.1	-26.8	-179.8	-172.8	63.8	0	0	0	112.9	F292 V295 I314 P321 K322 Y326 I327 I328	F292-L324 HydrophobicContact CB-CD2 4.06Å; F292-L324 HydrophobicContact CD1-CD2 4.14Å; F292-L324 HydrophobicContact CG-CD2 4.17Å; V295-L324 HydrophobicContact CB-CD1 3.9Å; V295-L324 HydrophobicContact CG1-CD1 4.07Å; V295-L324 HydrophobicContact CG2-CD1 4.16Å; I314-L324 HydrophobicContact CD1-CD2 3.86Å; P321-L324 HydrophobicContact CB-CB 4.26Å; P321-L324 PolarHBondContact O-N 2.56Å; K322-L324 VanDerWaalsContact C-N 3.33Å; L324-Y326 VanDerWaalsContact C-N 3.32Å; L324-Y326 PolarHBondContact O-N 3.36Å; L324-I327 PolarHBondContact O-N 2.81Å; L324-I327 VanDerWaalsContact O-N 3.16Å; L324-I328 HydrophobicContact CD1-CD1 4.35Å; L324-I328 HydrophobicContact CD1-CG1 4.36Å; L324-I328 HydrophobicContact CD2-CD1 3.83Å; L324-I328 HydrophobicContact CG-CD1 3.68Å; L324-I328 HydrophobicContact CG-CG1 4.07Å; L324-I328 PolarHBondContact O-N 2.97Å
325	I	90.8	Very high	92.8	Very high	25 Å²	25	58.1 Å²	58.1	13%	0.128	27%	0.274	C	S	.	.	H	α-helix	trans	-68.3	-32.1	-178.8	-159.6	49.4	0	0	0	112.8	K322 D323 I327 I328 Q329 L351 T356 L358	K322-I325 WeakPolarHBondContact O-CG2 3.32Å; D323-I325 VanDerWaalsContact C-N 3.31Å; D323-I325 PolarHBondContact O-N 3.45Å; I325-I327 PolarHBondContact O-N 3.37Å; I325-I328 HydrophobicContact CD1-CB 4.23Å; I325-I328 HydrophobicContact CD1-CG2 4.01Å; I325-I328 PolarHBondContact O-N 3.42Å; I325-Q329 VanDerWaalsContact O-CB 3.3Å; I325-Q329 WeakPolarHBondContact O-CB 3.26Å; I325-Q329 PolarHBondContact O-N 2.95Å; I325-L351 HydrophobicContact CD1-CD2 4.32Å; I325-T356 HydrophobicContact CB-CG2 4.45Å; I325-T356 HydrophobicContact CD1-CG2 3.35Å; I325-T356 HydrophobicContact CG1-CG2 3.67Å; I325-L358 HydrophobicContact CD1-CD2 3.69Å; I325-L358 HydrophobicContact CG1-CD2 3.89Å
326	Y	90.6	Very high	93	Very high	174 Å²	174	58.9 Å²	58.9	68%	0.682	28%	0.278	S	S	*	.	H	α-helix	trans	-65.6	-18.5	176	-61.9	-78.9	0	0	0	112.8	K322 D323 L324 P330	K322-Y326 WeakPolarHBondContact O-CD2 3.29Å; K322-Y326 WeakPolarHBondContact O-CE2 3.18Å; D323-Y326 PolarHBondContact O-N 3.33Å; L324-Y326 VanDerWaalsContact C-N 3.32Å; L324-Y326 PolarHBondContact O-N 3.36Å; Y326-P330 WeakPolarHBondContact O-CD 3.11Å; Y326-P330 VanDerWaalsContact O-CG 3.29Å; Y326-P330 WeakPolarHBondContact O-CG 3.48Å
327	I	91.6	Very high	93.2	Very high	35 Å²	35	60.8 Å²	60.8	18%	0.179	30%	0.301	C	S	.	.	H	α-helix	trans	-95.4	-46.6	175.3	-71.8	171.7	0	0	0	110.9	H296 L299 L324 I325 Q329 P330 L331	H296-I327 WeakPolarHBondContact CD2-CD1 3.45Å; H296-I327 VanDerWaalsContact NE2-CD1 3.35Å; H296-I327 WeakPolarHBondContact NE2-CD1 3.17Å; L299-I327 HydrophobicContact CD2-CG2 3.43Å; L299-I327 VanDerWaalsContact CD2-CG2 3.43Å; L324-I327 PolarHBondContact O-N 2.81Å; L324-I327 VanDerWaalsContact O-N 3.16Å; I325-I327 PolarHBondContact O-N 3.37Å; I327-Q329 PolarHBondContact O-N 3.18Å; I327-P330 WeakPolarHBondContact O-CD 3.24Å; I327-L331 HydrophobicContact CG2-CD1 3.89Å; I327-L331 WeakPolarHBondContact O-CG 3.45Å; I327-L331 PolarHBondContact O-N 3.43Å
328	I	93	Very high	93.6	Very high	0 Å²	0	64.7 Å²	64.7	0%	0	31%	0.313	C	S	.	.	H	α-helix	trans	-62.8	-39.8	-179.8	-78.1	-178.6	0	0	0	111.5	L310 L311 I314 L324 I325 L331 I332	L310-I328 HydrophobicContact CD2-CD1 4.13Å; L310-I328 HydrophobicContact CD2-CG1 4.5Å; L310-I328 HydrophobicContact CG-CD1 4.5Å; L311-I328 HydrophobicContact CD1-CG2 4.3Å; L311-I328 HydrophobicContact CD2-CD1 4.5Å; L311-I328 HydrophobicContact CD2-CG2 3.87Å; L311-I328 HydrophobicContact CG-CG2 4.32Å; I314-I328 HydrophobicContact CD1-CD1 3.42Å; I314-I328 VanDerWaalsContact CD1-CD1 3.42Å; L324-I328 HydrophobicContact CD1-CD1 4.35Å; L324-I328 HydrophobicContact CD1-CG1 4.36Å; L324-I328 HydrophobicContact CD2-CD1 3.83Å; L324-I328 HydrophobicContact CG-CD1 3.68Å; L324-I328 HydrophobicContact CG-CG1 4.07Å; L324-I328 PolarHBondContact O-N 2.97Å; I325-I328 HydrophobicContact CD1-CB 4.23Å; I325-I328 HydrophobicContact CD1-CG2 4.01Å; I325-I328 PolarHBondContact O-N 3.42Å; I328-L331 PolarHBondContact O-N 2.88Å; I328-I332 HydrophobicContact CG2-CD1 3.6Å; I328-I332 HydrophobicContact CG2-CG1 4.11Å; I328-I332 VanDerWaalsContact O-CG1 3.32Å; I328-I332 WeakPolarHBondContact O-CG1 3.38Å; I328-I332 PolarHBondContact O-N 3.35Å
329	Q	95.1	Very high	94	Very high	56 Å²	56	60.6 Å²	60.6	26%	0.262	30%	0.298	S	S	.	.	H	α-helix	trans	-60.6	-52.7	-179.1	172	-172.6	-40.3	0	0	112.7	I325 I327 L331 I332 M333 L358	I325-Q329 VanDerWaalsContact O-CB 3.3Å; I325-Q329 WeakPolarHBondContact O-CB 3.26Å; I325-Q329 PolarHBondContact O-N 2.95Å; I327-Q329 PolarHBondContact O-N 3.18Å; Q329-L331 VanDerWaalsContact C-N 3.3Å; Q329-L331 PolarHBondContact O-N 2.84Å; Q329-I332 PolarHBondContact O-N 3Å; Q329-M333 WeakPolarHBondContact O-CG 3.33Å; Q329-M333 PolarHBondContact O-N 3.45Å; Q329-L358 HydrophobicContact CB-CD2 3.84Å; Q329-L358 HydrophobicContact CG-CD2 4.07Å
330	P	95.1	Very high	94.4	Very high	74 Å²	74	58.5 Å²	58.5	48%	0.481	29%	0.288	S	S	.	.	H	α-helix	trans	-55.9	-39.9	171.8	-28.8	35.3	0	0	0	114	Y326 I327 M333 R334	Y326-P330 WeakPolarHBondContact O-CD 3.11Å; Y326-P330 VanDerWaalsContact O-CG 3.29Å; Y326-P330 WeakPolarHBondContact O-CG 3.48Å; I327-P330 WeakPolarHBondContact O-CD 3.24Å; P330-M333 PolarHBondContact O-N 3.19Å; P330-R334 WeakPolarHBondContact O-CB 3.3Å; P330-R334 PolarHBondContact O-N 2.88Å
331	L	95.9	Very high	94.7	Very high	17 Å²	17	58.5 Å²	58.5	9%	0.089	29%	0.288	C	S	.	.	H	α-helix	trans	-66.2	-42.5	178.4	-69.3	172	0	0	0	111.9	L299 V302 L307 I327 I328 Q329 R334 H335	L299-L331 HydrophobicContact CD2-CD1 4.43Å; V302-L331 HydrophobicContact CB-CD1 4.35Å; V302-L331 HydrophobicContact CG1-CD1 4.1Å; L307-L331 HydrophobicContact CD1-CB 3.93Å; L307-L331 HydrophobicContact CD2-CB 4Å; I327-L331 HydrophobicContact CG2-CD1 3.89Å; I327-L331 WeakPolarHBondContact O-CG 3.45Å; I327-L331 PolarHBondContact O-N 3.43Å; I328-L331 PolarHBondContact O-N 2.88Å; Q329-L331 VanDerWaalsContact C-N 3.3Å; Q329-L331 PolarHBondContact O-N 2.84Å; L331-R334 PolarHBondContact O-N 3.07Å; L331-H335 WeakPolarHBondContact O-CB 3.16Å; L331-H335 PolarHBondContact O-CD2 2.85Å; L331-H335 VanDerWaalsContact O-CD2 3.26Å; L331-H335 PolarHBondContact O-N 3.07Å
332	I	97.3	Very high	95	Very high	0 Å²	0	58.1 Å²	58.1	0%	0	28%	0.284	C	S	.	.	H	α-helix	trans	-57.8	-52.3	171.8	-63.8	164.3	0	0	0	109.1	L307 L311 I328 Q329 R334 H335 L336 V347 L351 L358 I366	L307-I332 HydrophobicContact CD1-CG1 4.47Å; L307-I332 HydrophobicContact CD2-CG1 4.2Å; L311-I332 HydrophobicContact CD1-CD1 3.82Å; L311-I332 HydrophobicContact CD1-CG1 3.83Å; I328-I332 HydrophobicContact CG2-CD1 3.6Å; I328-I332 HydrophobicContact CG2-CG1 4.11Å; I328-I332 VanDerWaalsContact O-CG1 3.32Å; I328-I332 WeakPolarHBondContact O-CG1 3.38Å; I328-I332 PolarHBondContact O-N 3.35Å; Q329-I332 PolarHBondContact O-N 3Å; I332-R334 VanDerWaalsContact C-N 3.27Å; I332-R334 PolarHBondContact O-N 3.38Å; I332-H335 PolarHBondContact O-N 3.19Å; I332-H335 VanDerWaalsContact O-N 3.16Å; I332-L336 WeakPolarHBondContact O-CA 3.46Å; I332-L336 VanDerWaalsContact O-CB 3.23Å; I332-L336 WeakPolarHBondContact O-CB 3.27Å; I332-L336 PolarHBondContact O-N 2.96Å; I332-V347 HydrophobicContact CD1-CG1 4.21Å; I332-V347 HydrophobicContact CG2-CG1 4.36Å; I332-L351 HydrophobicContact CD1-CD1 4.26Å; I332-L358 HydrophobicContact CD1-CD1 4.36Å; I332-I366 HydrophobicContact CG2-CD1 3.97Å; I332-I366 HydrophobicContact CG2-CG1 4.05Å
333	M	97.4	Very high	95.5	Very high	53 Å²	53	49.9 Å²	49.9	26%	0.261	25%	0.248	S	C	.	.	H	α-helix	trans	-58.8	-35.3	-179.2	-65.6	-65.6	98.6	0	0	113.3	Q329 P330 L336 A362 R365 I366	Q329-M333 WeakPolarHBondContact O-CG 3.33Å; Q329-M333 PolarHBondContact O-N 3.45Å; P330-M333 PolarHBondContact O-N 3.19Å; M333-L336 HydrophobicContact CE-CD2 4.18Å; M333-A362 HydrophobicContact CE-CB 3.88Å; M333-A362 HydrophobicContact SD-CB 3.99Å; M333-R365 HydrophobicContact CE-CB 4.39Å; M333-R365 HydrophobicContact SD-CB 4.35Å; M333-I366 HydrophobicContact CE-CD1 4.24Å; M333-I366 HydrophobicContact CE-CG1 3.96Å
334	R	96.3	Very high	96	Very high	166 Å²	166	44.3 Å²	44.3	63%	0.626	22%	0.218	S	C	*	.	H	α-helix	trans	-69.1	-39.9	176.5	179.7	-178.5	179.6	-169.5	-1.7	113	P330 L331 I332	P330-R334 WeakPolarHBondContact O-CB 3.3Å; P330-R334 PolarHBondContact O-N 2.88Å; L331-R334 PolarHBondContact O-N 3.07Å; I332-R334 VanDerWaalsContact C-N 3.27Å; I332-R334 PolarHBondContact O-N 3.38Å
335	H	97.3	Very high	96.3	Very high	16 Å²	16	44.2 Å²	44.2	7%	0.074	22%	0.218	C	C	.	.	H	α-helix	trans	-100	-12.3	-171.2	-71.6	-67.4	0	0	0	114.4	V304 L307 L331 I332 A337 Q338 M339	V304-H335 HydrophobicContact CG2-CB 4.2Å; L307-H335 HydrophobicContact CD2-CB 4.22Å; L331-H335 WeakPolarHBondContact O-CB 3.16Å; L331-H335 PolarHBondContact O-CD2 2.85Å; L331-H335 VanDerWaalsContact O-CD2 3.26Å; L331-H335 PolarHBondContact O-N 3.07Å; I332-H335 PolarHBondContact O-N 3.19Å; I332-H335 VanDerWaalsContact O-N 3.16Å; H335-A337 VanDerWaalsContact C-N 3.28Å; H335-A337 PolarHBondContact O-N 2.84Å; H335-A337 VanDerWaalsContact O-N 3.12Å; H335-Q338 PolarHBondContact ND1-OE1 3.32Å; H335-Q338 WeakPolarHBondContact O-CB 3.39Å; H335-Q338 PolarHBondContact O-N 3.17Å; H335-M339 HydrophobicContact CB-CE 4.2Å
336	L	97.8	Very high	96.6	Very high	15 Å²	15	43.2 Å²	43.2	8%	0.079	21%	0.212	C	C	.	.	G	3₁₀ helix	trans	-50.4	-41.5	-173.3	-175.5	61.6	0	0	0	114.5	I332 M333 Q338 M339 R365 I366 K369	I332-L336 WeakPolarHBondContact O-CA 3.46Å; I332-L336 VanDerWaalsContact O-CB 3.23Å; I332-L336 WeakPolarHBondContact O-CB 3.27Å; I332-L336 PolarHBondContact O-N 2.96Å; M333-L336 HydrophobicContact CE-CD2 4.18Å; L336-Q338 VanDerWaalsContact C-N 3.25Å; L336-Q338 PolarHBondContact O-N 2.92Å; L336-M339 HydrophobicContact CD1-SD 4.05Å; L336-M339 PolarHBondContact O-N 3.22Å; L336-R365 HydrophobicContact CD2-CB 4.08Å; L336-R365 WeakPolarHBondContact CD2-O 3.38Å; L336-I366 HydrophobicContact CD1-CG1 4.15Å; L336-I366 HydrophobicContact CD2-CG1 4.25Å; L336-K369 HydrophobicContact CD1-CB 3.84Å; L336-K369 HydrophobicContact CD1-CG 3.71Å; L336-K369 HydrophobicContact CD2-CB 4.12Å; L336-K369 HydrophobicContact CG-CB 3.78Å; L336-K369 HydrophobicContact CG-CG 3.85Å; L336-K369 WeakPolarHBondContact O-CD 3.37Å; L336-K369 WeakPolarHBondContact O-CE 3.28Å
337	A	97.4	Very high	97	Very high	80 Å²	80	34.9 Å²	34.9	66%	0.661	18%	0.18	S	C	*	.	G	3₁₀ helix	trans	-59.7	-36.6	178.9	0	0	0	0	0	112.5	H335 K369	H335-A337 VanDerWaalsContact C-N 3.28Å; H335-A337 PolarHBondContact O-N 2.84Å; H335-A337 VanDerWaalsContact O-N 3.12Å; A337-K369 PolarHBondContact O-NZ 3.21Å
338	Q	97.8	Very high	97.3	Very high	102 Å²	102	33.2 Å²	33.2	48%	0.477	17%	0.171	S	C	.	.	G	3₁₀ helix	trans	-81.9	-10.4	-175.1	-60.9	136.4	29.5	0	0	113.6	R148 V304 H335 L336	R148-Q338 PolarHBondContact NH2-O 3.1Å; V304-Q338 HydrophobicContact CG2-CB 3.95Å; H335-Q338 PolarHBondContact ND1-OE1 3.32Å; H335-Q338 WeakPolarHBondContact O-CB 3.39Å; H335-Q338 PolarHBondContact O-N 3.17Å; L336-Q338 VanDerWaalsContact C-N 3.25Å; L336-Q338 PolarHBondContact O-N 2.92Å
339	M	98.3	Very high	97.5	Very high	3 Å²	3	33.6 Å²	33.6	2%	0.015	17%	0.173	C	C	.	.			trans	-72.7	138.7	-176.7	-66.6	177.4	179.1	0	0	112.1	V304 L307 V308 H335 L336 E343 V344 V347 K369	V304-M339 HydrophobicContact CG1-CG 3.83Å; L307-M339 HydrophobicContact CD2-CE 3.92Å; V308-M339 HydrophobicContact CG2-CE 4.22Å; H335-M339 HydrophobicContact CB-CE 4.2Å; L336-M339 HydrophobicContact CD1-SD 4.05Å; L336-M339 PolarHBondContact O-N 3.22Å; M339-E343 WeakPolarHBondContact CA-OE2 3.16Å; M339-E343 HydrophobicContact CB-CB 4.17Å; M339-V344 HydrophobicContact CB-CG2 3.74Å; M339-V347 HydrophobicContact CE-CG2 4.09Å; M339-V347 HydrophobicContact SD-CG2 3.98Å; M339-K369 WeakPolarHBondContact O-CE 3.44Å; M339-K369 PolarHBondContact O-NZ 3.16Å
340	H	98.3	Very high	97.6	Very high	71 Å²	71	31 Å²	31	33%	0.329	16%	0.161	S	C	.	.			trans	-77.5	166.3	170.2	-62.7	110	0	0	0	111.6	C147 R148 E342 E343 V344	C147-H340 HydrophobicContact CB-CB 4.02Å; C147-H340 PolarHBondContact O-CE1 3Å; R148-H340 VanDerWaalsContact CZ-CE1 3.44Å; R148-H340 PolarHBondContact NH2-CE1 3.11Å; R148-H340 PolarHBondContact NH2-ND1 2.89Å; R148-H340 VanDerWaalsContact NH2-ND1 3.15Å; H340-E342 PolarHBondContact O-N 3.26Å; H340-E343 HydrophobicContact CB-CG 4.09Å; H340-E343 WeakPolarHBondContact CB-OE2 3.31Å; H340-E343 IonicContact CG-OE2 3.84Å; H340-E343 PolarHBondContact N-OE2 3.24Å; H340-E343 IonicContact ND1-OE1 3.66Å; H340-E343 IonicContact ND1-OE2 3.88Å; H340-E343 PolarHBondContact ND1-OE2 3.35Å; H340-E343 WeakPolarHBondContact O-CB 3.42Å; H340-E343 PolarHBondContact O-N 3.15Å; H340-E343 VanDerWaalsContact O-N 3.1Å; H340-V344 PolarHBondContact O-N 3.12Å; H340-V344 VanDerWaalsContact O-N 3.1Å
341	P	98.3	Very high	97.7	Very high	16 Å²	16	27.5 Å²	27.5	10%	0.104	14%	0.139	C	C	.	.	H	α-helix	trans	-56.1	-48.6	-175.2	-22.7	30.3	0	0	0	114.1	E343 V344 G345 V373 E376 M377	P341-E343 VanDerWaalsContact C-N 3.3Å; P341-E343 PolarHBondContact O-N 2.94Å; P341-V344 PolarHBondContact O-N 2.68Å; P341-G345 PolarHBondContact O-N 3.07Å; P341-G345 VanDerWaalsContact O-N 3.11Å; P341-V373 HydrophobicContact CB-CB 4.48Å; P341-V373 HydrophobicContact CB-CG2 3.98Å; P341-V373 HydrophobicContact CG-CB 4.1Å; P341-V373 HydrophobicContact CG-CG2 4.1Å; P341-E376 HydrophobicContact CG-CB 3.81Å; P341-M377 HydrophobicContact CB-CB 3.7Å; P341-M377 HydrophobicContact CB-CG 3.89Å
342	E	98.2	Very high	97.7	Very high	25 Å²	25	28.1 Å²	28.1	12%	0.117	14%	0.141	C	C	.	.	H	α-helix	trans	-66.5	-31.4	178.6	-64.5	-57.2	119.3	0	0	112.5	A143 F144 H340 G345 V346 G378 A381	A143-E342 HydrophobicContact CB-CG 4.17Å; F144-E342 HydrophobicContact CB-CB 3.86Å; H340-E342 PolarHBondContact O-N 3.26Å; E342-G345 PolarHBondContact O-N 2.9Å; E342-V346 WeakPolarHBondContact O-CB 3.44Å; E342-V346 WeakPolarHBondContact O-CG2 3.43Å; E342-V346 PolarHBondContact O-N 2.98Å; E342-G378 VanDerWaalsContact OE1-CA 3.23Å; E342-G378 WeakPolarHBondContact OE1-CA 3.39Å; E342-G378 PolarHBondContact OE1-N 2.9Å; E342-A381 VanDerWaalsContact OE1-CB 3.31Å; E342-A381 WeakPolarHBondContact OE1-CB 3.43Å; E342-A381 WeakPolarHBondContact OE2-CB 3.37Å
343	E	98.6	Very high	97.5	Very high	0 Å²	0	30 Å²	30	0%	0	15%	0.149	C	C	.	.	H	α-helix	trans	-66	-42.4	176.4	-61.5	-177.8	135.9	0	0	111.1	F144 C147 R148 Y151 V308 M339 H340 P341 G345 V346 V347	F144-E343 HydrophobicContact CB-CG 4.45Å; C147-E343 HydrophobicContact CB-CG 4.39Å; R148-E343 WeakPolarHBondContact CD-OE1 3.21Å; R148-E343 IonicContact CZ-OE1 2.83Å; R148-E343 IonicContact CZ-OE2 3.85Å; R148-E343 IonicContact NE-OE1 3.41Å; R148-E343 PolarHBondContact NE-OE1 3.46Å; R148-E343 IonicContact NE-OE2 3.38Å; R148-E343 PolarHBondContact NE-OE2 2.52Å; R148-E343 IonicContact NH2-OE1 3.23Å; R148-E343 IonicContact NH2-OE2 2.72Å; R148-E343 PolarHBondContact NH2-OE2 2.85Å; Y151-E343 WeakPolarHBondContact CE2-OE1 3.42Å; Y151-E343 PolarHBondContact OH-OE1 3.01Å; V308-E343 HydrophobicContact CG1-CB 4.07Å; V308-E343 HydrophobicContact CG1-CG 4.26Å; V308-E343 HydrophobicContact CG2-CB 4Å; V308-E343 HydrophobicContact CG2-CG 4.46Å; M339-E343 WeakPolarHBondContact CA-OE2 3.16Å; M339-E343 HydrophobicContact CB-CB 4.17Å; H340-E343 HydrophobicContact CB-CG 4.09Å; H340-E343 WeakPolarHBondContact CB-OE2 3.31Å; H340-E343 IonicContact CG-OE2 3.84Å; H340-E343 PolarHBondContact N-OE2 3.24Å; H340-E343 IonicContact ND1-OE1 3.66Å; H340-E343 IonicContact ND1-OE2 3.88Å; H340-E343 PolarHBondContact ND1-OE2 3.35Å; H340-E343 WeakPolarHBondContact O-CB 3.42Å; H340-E343 PolarHBondContact O-N 3.15Å; H340-E343 VanDerWaalsContact O-N 3.1Å; P341-E343 VanDerWaalsContact C-N 3.3Å; P341-E343 PolarHBondContact O-N 2.94Å; E343-G345 VanDerWaalsContact C-N 3.34Å; E343-G345 PolarHBondContact O-N 3Å; E343-V346 PolarHBondContact O-N 2.95Å; E343-V347 WeakPolarHBondContact O-CG2 3.49Å; E343-V347 PolarHBondContact O-N 3.17Å
344	V	98.6	Very high	97.3	Very high	1 Å²	1	27.9 Å²	27.9	1%	0.006	14%	0.14	C	C	.	.	H	α-helix	trans	-62.6	-42.1	173.9	179.7	0	0	0	0	110.8	M339 H340 P341 V346 V347 C348 I366 K369 A370	M339-V344 HydrophobicContact CB-CG2 3.74Å; H340-V344 PolarHBondContact O-N 3.12Å; H340-V344 VanDerWaalsContact O-N 3.1Å; P341-V344 PolarHBondContact O-N 2.68Å; V344-V346 VanDerWaalsContact C-N 3.3Å; V344-V346 PolarHBondContact O-N 2.8Å; V344-V347 PolarHBondContact O-N 3.31Å; V344-C348 PolarHBondContact O-N 2.7Å; V344-C348 PolarHBondContact O-SG 3.09Å; V344-I366 HydrophobicContact CG1-CG2 4.31Å; V344-K369 HydrophobicContact CG2-CG 3.86Å; V344-A370 HydrophobicContact CG1-CB 3.91Å
345	G	98.3	Very high	97.1	Very high	0 Å²	0	23.6 Å²	23.6	0%	0	13%	0.127	C	C	.	.	H	α-helix	trans	-61.1	-35.8	173.8	0	0	0	0	0	113.6	P341 E342 E343 L349 N384	P341-G345 PolarHBondContact O-N 3.07Å; P341-G345 VanDerWaalsContact O-N 3.11Å; E342-G345 PolarHBondContact O-N 2.9Å; E343-G345 VanDerWaalsContact C-N 3.34Å; E343-G345 PolarHBondContact O-N 3Å; G345-L349 WeakPolarHBondContact O-CB 3.47Å; G345-L349 PolarHBondContact O-N 3.2Å; G345-N384 WeakPolarHBondContact O-CB 3.41Å
346	V	98.3	Very high	96.8	Very high	3 Å²	3	23.5 Å²	23.5	2%	0.018	13%	0.127	C	C	.	.	H	α-helix	trans	-77.9	-36.3	178.6	166.7	0	0	0	0	112.5	F144 V308 Y312 E342 E343 V344 C348 L349 G350	F144-V346 HydrophobicContact CB-CG2 3.93Å; F144-V346 HydrophobicContact CD1-CB 4.45Å; F144-V346 HydrophobicContact CD1-CG1 4.35Å; F144-V346 HydrophobicContact CD1-CG2 3.59Å; F144-V346 HydrophobicContact CD2-CG1 4.33Å; F144-V346 HydrophobicContact CE1-CG1 4.29Å; F144-V346 HydrophobicContact CE1-CG2 4.17Å; F144-V346 HydrophobicContact CE2-CG1 4.27Å; F144-V346 HydrophobicContact CG-CB 4.32Å; F144-V346 HydrophobicContact CG-CG1 4.35Å; F144-V346 HydrophobicContact CG-CG2 3.78Å; F144-V346 HydrophobicContact CZ-CG1 4.24Å; V308-V346 HydrophobicContact CG1-CB 4.25Å; V308-V346 HydrophobicContact CG1-CG1 3.88Å; Y312-V346 HydrophobicContact CD2-CG1 4.24Å; Y312-V346 HydrophobicContact CG-CG1 4.36Å; E342-V346 WeakPolarHBondContact O-CB 3.44Å; E342-V346 WeakPolarHBondContact O-CG2 3.43Å; E342-V346 PolarHBondContact O-N 2.98Å; E343-V346 PolarHBondContact O-N 2.95Å; V344-V346 VanDerWaalsContact C-N 3.3Å; V344-V346 PolarHBondContact O-N 2.8Å; V346-C348 VanDerWaalsContact C-N 3.34Å; V346-C348 PolarHBondContact O-N 2.85Å; V346-L349 PolarHBondContact O-N 2.75Å; V346-G350 PolarHBondContact O-N 3Å
347	V	98.5	Very high	96.4	Very high	0 Å²	0	26.2 Å²	26.2	0%	0	15%	0.148	C	C	.	.	H	α-helix	trans	-57.1	-48.6	168.1	168.1	0	0	0	0	110.4	V308 L311 I332 M339 E343 V344 L349 G350 L351	V308-V347 HydrophobicContact CG2-CG2 4.18Å; L311-V347 HydrophobicContact CD1-CB 4.44Å; L311-V347 HydrophobicContact CD1-CG1 4.18Å; L311-V347 HydrophobicContact CD1-CG2 3.88Å; I332-V347 HydrophobicContact CD1-CG1 4.21Å; I332-V347 HydrophobicContact CG2-CG1 4.36Å; M339-V347 HydrophobicContact CE-CG2 4.09Å; M339-V347 HydrophobicContact SD-CG2 3.98Å; E343-V347 WeakPolarHBondContact O-CG2 3.49Å; E343-V347 PolarHBondContact O-N 3.17Å; V344-V347 PolarHBondContact O-N 3.31Å; V347-L349 VanDerWaalsContact C-N 3.35Å; V347-L349 PolarHBondContact O-N 2.75Å; V347-G350 PolarHBondContact O-N 3.23Å; V347-L351 HydrophobicContact CG1-CD1 3.91Å; V347-L351 WeakPolarHBondContact O-CG 3.4Å; V347-L351 PolarHBondContact O-N 2.82Å; V347-L351 VanDerWaalsContact O-N 3.13Å
348	C	98.5	Very high	96.2	Very high	0 Å²	0	22.7 Å²	22.7	0%	0	12%	0.118	C	C	.	.	H	α-helix	trans	-60.9	-41	175.1	-68.5	0	0	0	0	112.5	V344 V346 F352 V385 Y388	V344-C348 PolarHBondContact O-N 2.7Å; V344-C348 PolarHBondContact O-SG 3.09Å; V346-C348 VanDerWaalsContact C-N 3.34Å; V346-C348 PolarHBondContact O-N 2.85Å; C348-F352 WeakPolarHBondContact O-CB 3.39Å; C348-F352 PolarHBondContact O-N 3.45Å; C348-V385 HydrophobicContact CB-CG2 4.37Å; C348-Y388 HydrophobicContact CB-CD1 4.44Å; C348-Y388 HydrophobicContact CB-CG 4.29Å
349	L	97.3	Very high	96	Very high	7 Å²	7	21 Å²	21	4%	0.037	12%	0.116	C	C	.	.	H	α-helix	trans	-64.3	-42.8	177.3	-175.5	60.9	0	0	0	112.3	G345 V346 V347 K353 F380 N384	G345-L349 WeakPolarHBondContact O-CB 3.47Å; G345-L349 PolarHBondContact O-N 3.2Å; V346-L349 PolarHBondContact O-N 2.75Å; V347-L349 VanDerWaalsContact C-N 3.35Å; V347-L349 PolarHBondContact O-N 2.75Å; L349-K353 HydrophobicContact CD1-CD 4.12Å; L349-K353 HydrophobicContact CD1-CG 4.04Å; L349-K353 HydrophobicContact CG-CD 4.13Å; L349-K353 HydrophobicContact CG-CG 4.37Å; L349-K353 VanDerWaalsContact O-CB 3.27Å; L349-K353 WeakPolarHBondContact O-CB 3.24Å; L349-K353 WeakPolarHBondContact O-CG 3.45Å; L349-K353 PolarHBondContact O-N 2.84Å; L349-F380 HydrophobicContact CD2-CE1 4.11Å; L349-F380 HydrophobicContact CD2-CZ 3.77Å; L349-N384 HydrophobicContact CB-CB 4.05Å
350	G	96.9	Very high	95.8	Very high	1 Å²	1	23.6 Å²	23.6	1%	0.01	13%	0.128	C	C	.	.	H	α-helix	trans	-61.3	-55.3	179.9	0	0	0	0	0	111.7	L311 V346 V347 F352 K353 A354	L311-G350 VanDerWaalsContact O-CA 3.27Å; L311-G350 WeakPolarHBondContact O-CA 3.27Å; V346-G350 PolarHBondContact O-N 3Å; V347-G350 PolarHBondContact O-N 3.23Å; G350-F352 VanDerWaalsContact C-N 3.34Å; G350-F352 PolarHBondContact O-N 3.31Å; G350-K353 PolarHBondContact O-N 3.02Å; G350-A354 WeakPolarHBondContact O-CB 3.26Å; G350-A354 PolarHBondContact O-N 3.31Å
351	L	96.5	Very high	95.7	Very high	2 Å²	2	22.5 Å²	22.5	1%	0.01	14%	0.136	C	C	.	.	H	α-helix	trans	-59.8	-42.9	178.4	-63.6	166.7	0	0	0	111.8	L311 I325 I332 V347 Q355 T356 L358 I366 Y388	L311-L351 HydrophobicContact CD2-CD2 3.95Å; L311-L351 HydrophobicContact CD2-CG 4.18Å; I325-L351 HydrophobicContact CD1-CD2 4.32Å; I332-L351 HydrophobicContact CD1-CD1 4.26Å; V347-L351 HydrophobicContact CG1-CD1 3.91Å; V347-L351 WeakPolarHBondContact O-CG 3.4Å; V347-L351 PolarHBondContact O-N 2.82Å; V347-L351 VanDerWaalsContact O-N 3.13Å; L351-Q355 PolarHBondContact O-N 3.24Å; L351-T356 HydrophobicContact CD2-CG2 3.86Å; L351-T356 PolarHBondContact O-N 3.29Å; L351-L358 HydrophobicContact CD1-CD1 3.76Å; L351-L358 HydrophobicContact CD1-CG 4.45Å; L351-L358 HydrophobicContact CD2-CD1 4.43Å; L351-L358 HydrophobicContact CD2-CG 4.46Å; L351-I366 HydrophobicContact CD1-CD1 4.4Å; L351-Y388 HydrophobicContact CB-CD2 3.88Å; L351-Y388 HydrophobicContact CB-CE2 3.38Å; L351-Y388 HydrophobicContact CD1-CE1 4.04Å; L351-Y388 HydrophobicContact CD1-CE2 4.2Å; L351-Y388 HydrophobicContact CG-CE2 4.4Å
352	F	95.6	Very high	95.7	Very high	30 Å²	30	22 Å²	22	13%	0.132	13%	0.133	C	C	.	.	H	α-helix	trans	-60.8	-51.4	174.1	171.1	-98.5	0	0	0	112.6	C348 G350 A354 Q355 K387 Y388 F391	C348-F352 WeakPolarHBondContact O-CB 3.39Å; C348-F352 PolarHBondContact O-N 3.45Å; G350-F352 VanDerWaalsContact C-N 3.34Å; G350-F352 PolarHBondContact O-N 3.31Å; F352-A354 PolarHBondContact O-N 2.96Å; F352-Q355 PolarHBondContact O-N 3.3Å; F352-K387 HydrophobicContact CD1-CB 4.13Å; F352-K387 HydrophobicContact CD1-CD 4.25Å; F352-K387 HydrophobicContact CD2-CB 3.85Å; F352-K387 WeakPolarHBondContact CD2-O 3.48Å; F352-K387 HydrophobicContact CE1-CB 4.3Å; F352-K387 HydrophobicContact CE1-CD 4.14Å; F352-K387 HydrophobicContact CE1-CG 4.42Å; F352-K387 HydrophobicContact CE2-CB 4.03Å; F352-K387 HydrophobicContact CG-CB 3.92Å; F352-K387 HydrophobicContact CZ-CB 4.26Å; F352-K387 HydrophobicContact CZ-CG 4.44Å; F352-Y388 HydrophobicContact CB-CD2 4.29Å; F352-F391 HydrophobicContact CD2-CB 3.71Å; F352-F391 HydrophobicContact CD2-CG 4.31Å; F352-F391 HydrophobicContact CE2-CB 4.17Å
353	K	94.3	Very high	95.6	Very high	39 Å²	39	21 Å²	21	17%	0.17	13%	0.128	C	C	.	.	H	α-helix	trans	-65.9	-37	-175.8	-84.2	-172.2	171.1	-177.7	0	112.5	G315 E316 R318 L349 G350 Q355	G315-K353 VanDerWaalsContact O-CB 3.23Å; G315-K353 WeakPolarHBondContact O-CB 3.3Å; E316-K353 IonicContact OE1-NZ 3.94Å; E316-K353 PolarHBondContact OE1-NZ 3.06Å; E316-K353 IonicContact OE2-NZ 3.68Å; E316-K353 PolarHBondContact OE2-NZ 2.96Å; R318-K353 WeakPolarHBondContact CD-O 3.45Å; L349-K353 HydrophobicContact CD1-CD 4.12Å; L349-K353 HydrophobicContact CD1-CG 4.04Å; L349-K353 HydrophobicContact CG-CD 4.13Å; L349-K353 HydrophobicContact CG-CG 4.37Å; L349-K353 VanDerWaalsContact O-CB 3.27Å; L349-K353 WeakPolarHBondContact O-CB 3.24Å; L349-K353 WeakPolarHBondContact O-CG 3.45Å; L349-K353 PolarHBondContact O-N 2.84Å; G350-K353 PolarHBondContact O-N 3.02Å; K353-Q355 VanDerWaalsContact C-N 3.28Å; K353-Q355 PolarHBondContact O-N 3.22Å
354	A	93.2	Very high	95.6	Very high	9 Å²	9	22.1 Å²	22.1	7%	0.074	14%	0.137	C	C	.	.	T	Hydrogen-bonded Turn	trans	-86.4	9.4	176.8	0	0	0	0	0	113.8	I314 C320 G350 F352 T356	I314-A354 HydrophobicContact CG2-CB 3.56Å; C320-A354 HydrophobicContact CB-CB 4.29Å; G350-A354 WeakPolarHBondContact O-CB 3.26Å; G350-A354 PolarHBondContact O-N 3.31Å; F352-A354 PolarHBondContact O-N 2.96Å; A354-T356 WeakPolarHBondContact CB-OG1 3.31Å; A354-T356 PolarHBondContact O-N 3.11Å; A354-T356 VanDerWaalsContact O-N 3.11Å; A354-T356 PolarHBondContact O-OG1 3.46Å
355	Q	91.8	Very high	95.6	Very high	75 Å²	75	29.6 Å²	29.6	35%	0.35	17%	0.165	S	C	.	.	T	Hydrogen-bonded Turn	trans	50.9	35.5	-179.5	-51.4	-173.9	44.2	0	0	113.4	S105 L351 F352 K353 F391	S105-Q355 VanDerWaalsContact CA-OE1 3.25Å; S105-Q355 VanDerWaalsContact CB-OE1 3.32Å; S105-Q355 PolarHBondContact O-NE2 2.8Å; S105-Q355 PolarHBondContact O-OE1 2.97Å; L351-Q355 PolarHBondContact O-N 3.24Å; F352-Q355 PolarHBondContact O-N 3.3Å; K353-Q355 VanDerWaalsContact C-N 3.28Å; K353-Q355 PolarHBondContact O-N 3.22Å; Q355-F391 HydrophobicContact CB-CE2 4.13Å; Q355-F391 HydrophobicContact CB-CZ 4.32Å; Q355-F391 WeakPolarHBondContact O-CZ 3.11Å
356	T	90.4	Very high	95.6	Very high	14 Å²	14	29.6 Å²	29.6	9%	0.086	17%	0.165	C	C	.	.			trans	-96	103.3	-170.8	-57.4	0	0	0	0	109.7	C320 I325 L351 A354	C320-T356 HydrophobicContact CB-CG2 4.27Å; C320-T356 VanDerWaalsContact CB-OG1 3.23Å; C320-T356 WeakPolarHBondContact CB-OG1 3.35Å; I325-T356 HydrophobicContact CB-CG2 4.45Å; I325-T356 HydrophobicContact CD1-CG2 3.35Å; I325-T356 HydrophobicContact CG1-CG2 3.67Å; L351-T356 HydrophobicContact CD2-CG2 3.86Å; L351-T356 PolarHBondContact O-N 3.29Å; A354-T356 WeakPolarHBondContact CB-OG1 3.31Å; A354-T356 PolarHBondContact O-N 3.11Å; A354-T356 VanDerWaalsContact O-N 3.11Å; A354-T356 PolarHBondContact O-OG1 3.46Å
357	S	89.1	Confident	95.6	Very high	73 Å²	73	29.4 Å²	29.4	51%	0.51	16%	0.164	S	C	.	.			trans	-76.4	142.9	176.3	-164	0	0	0	0	111.2
358	L	93.6	Very high	95.6	Very high	5 Å²	5	33.1 Å²	33.1	3%	0.026	18%	0.184	C	C	.	.			trans	-115.6	157.7	169.5	-68.8	-179.2	0	0	0	109.2	I325 Q329 I332 L351 A362 V363 I366 Y388	I325-L358 HydrophobicContact CD1-CD2 3.69Å; I325-L358 HydrophobicContact CG1-CD2 3.89Å; Q329-L358 HydrophobicContact CB-CD2 3.84Å; Q329-L358 HydrophobicContact CG-CD2 4.07Å; I332-L358 HydrophobicContact CD1-CD1 4.36Å; L351-L358 HydrophobicContact CD1-CD1 3.76Å; L351-L358 HydrophobicContact CD1-CG 4.45Å; L351-L358 HydrophobicContact CD2-CD1 4.43Å; L351-L358 HydrophobicContact CD2-CG 4.46Å; L358-A362 HydrophobicContact CB-CB 4.29Å; L358-A362 HydrophobicContact CD1-CB 4.47Å; L358-V363 HydrophobicContact CB-CG2 3.96Å; L358-I366 HydrophobicContact CD1-CD1 3.75Å; L358-Y388 WeakPolarHBondContact CG-OH 3.37Å
359	P	94.1	Very high	95.6	Very high	68 Å²	68	34.8 Å²	34.8	44%	0.442	19%	0.191	S	C	.	.			trans	-54.7	142.1	168.1	-24.1	35.1	0	0	0	110.9	G361 A362 V363	P359-G361 VanDerWaalsContact C-N 3.32Å; P359-G361 PolarHBondContact O-N 3.39Å; P359-A362 WeakPolarHBondContact O-CA 3.4Å; P359-A362 WeakPolarHBondContact O-CB 3.22Å; P359-A362 PolarHBondContact O-N 2.97Å; P359-V363 PolarHBondContact O-N 3.47Å
360	E	94.1	Very high	95.6	Very high	56 Å²	56	34.4 Å²	34.4	26%	0.262	19%	0.189	S	C	.	.	H	α-helix	trans	-51.2	-46.6	-173.2	-178.7	-175	165.9	0	0	113.4	S86 A362 V363 S364 L394	S86-E360 WeakPolarHBondContact CA-OE2 3.44Å; S86-E360 VanDerWaalsContact CB-OE1 3.29Å; S86-E360 WeakPolarHBondContact CB-OE1 3.26Å; S86-E360 WeakPolarHBondContact CB-OE2 3.19Å; S86-E360 PolarHBondContact N-OE2 2.81Å; S86-E360 PolarHBondContact OG-OE1 3.28Å; S86-E360 PolarHBondContact OG-OE2 3.19Å; E360-A362 PolarHBondContact O-N 3.42Å; E360-A362 VanDerWaalsContact O-N 3.15Å; E360-V363 CarbonylContact O-C 3.58Å; E360-V363 WeakPolarHBondContact O-CA 3.46Å; E360-V363 WeakPolarHBondContact O-CB 3.46Å; E360-V363 PolarHBondContact O-N 3.02Å; E360-S364 PolarHBondContact O-N 3.46Å; E360-S364 PolarHBondContact O-OG 2.91Å; E360-L394 HydrophobicContact CG-CD1 4.14Å
361	G	96.2	Very high	95.7	Very high	48 Å²	48	36.2 Å²	36.2	50%	0.495	20%	0.2	S	C	.	.	H	α-helix	trans	-61.5	-22.7	178.7	0	0	0	0	0	114.5	P359 R365	P359-G361 VanDerWaalsContact C-N 3.32Å; P359-G361 PolarHBondContact O-N 3.39Å; G361-R365 WeakPolarHBondContact O-CD 3.47Å; G361-R365 VanDerWaalsContact O-CG 3.24Å; G361-R365 WeakPolarHBondContact O-CG 3.35Å; G361-R365 PolarHBondContact O-N 3.24Å
362	A	96.7	Very high	95.8	Very high	7 Å²	7	40.2 Å²	40.2	6%	0.058	23%	0.228	C	C	.	.	H	α-helix	trans	-80.9	-38.6	170.6	0	0	0	0	0	111.6	M333 L358 P359 E360 R365 I366	M333-A362 HydrophobicContact CE-CB 3.88Å; M333-A362 HydrophobicContact SD-CB 3.99Å; L358-A362 HydrophobicContact CB-CB 4.29Å; L358-A362 HydrophobicContact CD1-CB 4.47Å; P359-A362 WeakPolarHBondContact O-CA 3.4Å; P359-A362 WeakPolarHBondContact O-CB 3.22Å; P359-A362 PolarHBondContact O-N 2.97Å; E360-A362 PolarHBondContact O-N 3.42Å; E360-A362 VanDerWaalsContact O-N 3.15Å; A362-R365 PolarHBondContact O-N 3.23Å; A362-I366 WeakPolarHBondContact O-CD1 3.28Å; A362-I366 VanDerWaalsContact O-CG1 3.28Å; A362-I366 WeakPolarHBondContact O-CG1 3.25Å; A362-I366 PolarHBondContact O-N 2.97Å; A362-I366 VanDerWaalsContact O-N 3.11Å
363	V	97.1	Very high	95.9	Very high	2 Å²	2	39.5 Å²	39.5	1%	0.012	23%	0.226	C	C	.	.	H	α-helix	trans	-61.7	-49.6	173.7	-174.1	0	0	0	0	110.5	L358 P359 E360 R365 I366 V367 Y388 L394	L358-V363 HydrophobicContact CB-CG2 3.96Å; P359-V363 PolarHBondContact O-N 3.47Å; E360-V363 CarbonylContact O-C 3.58Å; E360-V363 WeakPolarHBondContact O-CA 3.46Å; E360-V363 WeakPolarHBondContact O-CB 3.46Å; E360-V363 PolarHBondContact O-N 3.02Å; V363-R365 PolarHBondContact O-N 3.45Å; V363-I366 PolarHBondContact O-N 2.96Å; V363-I366 VanDerWaalsContact O-N 3.17Å; V363-V367 HydrophobicContact CG1-CG2 4.48Å; V363-V367 VanDerWaalsContact O-CG2 3.32Å; V363-V367 WeakPolarHBondContact O-CG2 3.34Å; V363-V367 PolarHBondContact O-N 2.93Å; V363-Y388 HydrophobicContact CB-CE1 4.43Å; V363-Y388 HydrophobicContact CG1-CD1 4.22Å; V363-Y388 HydrophobicContact CG1-CE1 3.83Å; V363-Y388 HydrophobicContact CG2-CE1 4.15Å; V363-L394 HydrophobicContact CB-CD2 3.99Å; V363-L394 HydrophobicContact CG1-CB 4.48Å; V363-L394 HydrophobicContact CG1-CD2 3.54Å
364	S	97.9	Very high	96	Very high	25 Å²	25	38.1 Å²	38.1	18%	0.175	22%	0.221	C	C	.	.	H	α-helix	trans	-57.3	-47.2	178.1	-56.4	0	0	0	0	111.3	E360 I366 V367 D368	E360-S364 PolarHBondContact O-N 3.46Å; E360-S364 PolarHBondContact O-OG 2.91Å; S364-I366 VanDerWaalsContact C-N 3.34Å; S364-I366 PolarHBondContact O-N 2.91Å; S364-V367 CarbonylContact O-C 3.59Å; S364-V367 WeakPolarHBondContact O-CA 3.42Å; S364-V367 PolarHBondContact O-N 3.46Å; S364-D368 PolarHBondContact O-N 2.77Å
365	R	98.3	Very high	96.2	Very high	157 Å²	157	42.2 Å²	42.2	59%	0.592	25%	0.245	S	C	*	.	H	α-helix	trans	-57.7	-42.2	176.1	-76.2	173.9	-178.2	-162	1.6	113.2	M333 L336 G361 A362 V363 V367 D368 K369	M333-R365 HydrophobicContact CE-CB 4.39Å; M333-R365 HydrophobicContact SD-CB 4.35Å; L336-R365 HydrophobicContact CD2-CB 4.08Å; L336-R365 WeakPolarHBondContact CD2-O 3.38Å; G361-R365 WeakPolarHBondContact O-CD 3.47Å; G361-R365 VanDerWaalsContact O-CG 3.24Å; G361-R365 WeakPolarHBondContact O-CG 3.35Å; G361-R365 PolarHBondContact O-N 3.24Å; A362-R365 PolarHBondContact O-N 3.23Å; V363-R365 PolarHBondContact O-N 3.45Å; R365-V367 VanDerWaalsContact C-N 3.26Å; R365-V367 PolarHBondContact O-N 3.23Å; R365-D368 PolarHBondContact O-N 2.74Å; R365-K369 PolarHBondContact O-N 3.28Å
366	I	98.6	Very high	96.4	Very high	0 Å²	0	45.9 Å²	45.9	0%	0	26%	0.262	C	S	.	.	H	α-helix	trans	-61.4	-38.7	175.8	-67	161.9	0	0	0	110.4	I332 M333 L336 V344 L351 L358 A362 V363 S364 A370	I332-I366 HydrophobicContact CG2-CD1 3.97Å; I332-I366 HydrophobicContact CG2-CG1 4.05Å; M333-I366 HydrophobicContact CE-CD1 4.24Å; M333-I366 HydrophobicContact CE-CG1 3.96Å; L336-I366 HydrophobicContact CD1-CG1 4.15Å; L336-I366 HydrophobicContact CD2-CG1 4.25Å; V344-I366 HydrophobicContact CG1-CG2 4.31Å; L351-I366 HydrophobicContact CD1-CD1 4.4Å; L358-I366 HydrophobicContact CD1-CD1 3.75Å; A362-I366 WeakPolarHBondContact O-CD1 3.28Å; A362-I366 VanDerWaalsContact O-CG1 3.28Å; A362-I366 WeakPolarHBondContact O-CG1 3.25Å; A362-I366 PolarHBondContact O-N 2.97Å; A362-I366 VanDerWaalsContact O-N 3.11Å; V363-I366 PolarHBondContact O-N 2.96Å; V363-I366 VanDerWaalsContact O-N 3.17Å; S364-I366 VanDerWaalsContact C-N 3.34Å; S364-I366 PolarHBondContact O-N 2.91Å; I366-A370 PolarHBondContact O-N 3.39Å
367	V	98.3	Very high	96.7	Very high	0 Å²	0	45.3 Å²	45.3	0%	0	26%	0.259	C	S	.	.	H	α-helix	trans	-75.8	-36.4	179.1	-178.7	0	0	0	0	111.9	V363 S364 R365 K369 A370 V371 V385 L389 H396 W399	V363-V367 HydrophobicContact CG1-CG2 4.48Å; V363-V367 VanDerWaalsContact O-CG2 3.32Å; V363-V367 WeakPolarHBondContact O-CG2 3.34Å; V363-V367 PolarHBondContact O-N 2.93Å; S364-V367 CarbonylContact O-C 3.59Å; S364-V367 WeakPolarHBondContact O-CA 3.42Å; S364-V367 PolarHBondContact O-N 3.46Å; R365-V367 VanDerWaalsContact C-N 3.26Å; R365-V367 PolarHBondContact O-N 3.23Å; V367-K369 VanDerWaalsContact C-N 3.32Å; V367-K369 PolarHBondContact O-N 2.93Å; V367-A370 CarbonylContact O-C 3.48Å; V367-A370 WeakPolarHBondContact O-CA 3.49Å; V367-A370 WeakPolarHBondContact O-CB 3.06Å; V367-A370 PolarHBondContact O-N 3.07Å; V367-V371 WeakPolarHBondContact O-CG2 3.48Å; V367-V371 PolarHBondContact O-N 3.16Å; V367-V385 HydrophobicContact CG1-CG1 4.5Å; V367-V385 HydrophobicContact CG2-CG1 4.32Å; V367-L389 HydrophobicContact CB-CD2 4.5Å; V367-L389 HydrophobicContact CG1-CD1 4.18Å; V367-L389 HydrophobicContact CG1-CD2 4.21Å; V367-L389 HydrophobicContact CG2-CD1 4.43Å; V367-L389 HydrophobicContact CG2-CD2 3.66Å; V367-L389 HydrophobicContact CG2-CG 3.95Å; V367-H396 HydrophobicContact CG1-CB 3.97Å; V367-H396 WeakPolarHBondContact CG1-ND1 3.44Å; V367-W399 HydrophobicContact CG1-CB 3.65Å; V367-W399 HydrophobicContact CG1-CD2 4.14Å; V367-W399 HydrophobicContact CG1-CE3 4.24Å; V367-W399 HydrophobicContact CG1-CG 3.89Å
368	D	98.5	Very high	97	Very high	78 Å²	78	43.1 Å²	43.1	42%	0.417	25%	0.247	S	C	.	.	H	α-helix	trans	-59.5	-42.1	170.4	-73.2	-46.4	0	0	0	111.5	S364 R365 A370 V371 S372 H396	S364-D368 PolarHBondContact O-N 2.77Å; R365-D368 PolarHBondContact O-N 2.74Å; D368-A370 VanDerWaalsContact C-N 3.3Å; D368-A370 PolarHBondContact O-N 2.96Å; D368-V371 PolarHBondContact O-N 3.36Å; D368-S372 PolarHBondContact O-N 2.97Å; D368-S372 PolarHBondContact O-OG 3.01Å; D368-H396 IonicContact OD1-CE1 3.12Å; D368-H396 PolarHBondContact OD1-CE1 3.17Å; D368-H396 VanDerWaalsContact OD1-CE1 3.23Å; D368-H396 IonicContact OD1-NE2 3.86Å
369	K	98.5	Very high	97.1	Very high	34 Å²	34	44.5 Å²	44.5	15%	0.148	26%	0.255	C	S	.	.	H	α-helix	trans	-65.4	-33.1	171.5	172.1	62.9	-173.8	-175.5	0	111.8	L336 A337 M339 V344 R365 V367 S372 V373	L336-K369 HydrophobicContact CD1-CB 3.84Å; L336-K369 HydrophobicContact CD1-CG 3.71Å; L336-K369 HydrophobicContact CD2-CB 4.12Å; L336-K369 HydrophobicContact CG-CB 3.78Å; L336-K369 HydrophobicContact CG-CG 3.85Å; L336-K369 WeakPolarHBondContact O-CD 3.37Å; L336-K369 WeakPolarHBondContact O-CE 3.28Å; A337-K369 PolarHBondContact O-NZ 3.21Å; M339-K369 WeakPolarHBondContact O-CE 3.44Å; M339-K369 PolarHBondContact O-NZ 3.16Å; V344-K369 HydrophobicContact CG2-CG 3.86Å; R365-K369 PolarHBondContact O-N 3.28Å; V367-K369 VanDerWaalsContact C-N 3.32Å; V367-K369 PolarHBondContact O-N 2.93Å; K369-S372 PolarHBondContact O-OG 3.3Å; K369-V373 WeakPolarHBondContact O-CG2 3.14Å
370	A	98.6	Very high	97.1	Very high	0 Å²	0	43.1 Å²	43.1	0%	0	24%	0.242	C	C	.	.	H	α-helix	trans	-70.1	-39	173.2	0	0	0	0	0	112.3	V344 I366 V367 D368 V373 V374 M377 V385 W399	V344-A370 HydrophobicContact CG1-CB 3.91Å; I366-A370 PolarHBondContact O-N 3.39Å; V367-A370 CarbonylContact O-C 3.48Å; V367-A370 WeakPolarHBondContact O-CA 3.49Å; V367-A370 WeakPolarHBondContact O-CB 3.06Å; V367-A370 PolarHBondContact O-N 3.07Å; D368-A370 VanDerWaalsContact C-N 3.3Å; D368-A370 PolarHBondContact O-N 2.96Å; A370-V373 PolarHBondContact O-N 3.44Å; A370-V374 WeakPolarHBondContact O-CA 3.19Å; A370-V374 WeakPolarHBondContact O-CB 3.07Å; A370-V374 PolarHBondContact O-N 3.46Å; A370-V374 VanDerWaalsContact O-N 3.08Å; A370-M377 HydrophobicContact CB-CE 4.34Å; A370-V385 HydrophobicContact CB-CG1 3.99Å; A370-V385 HydrophobicContact CB-CG2 3.87Å; A370-W399 HydrophobicContact CB-CE3 4Å; A370-W399 HydrophobicContact CB-CH2 4.38Å; A370-W399 HydrophobicContact CB-CZ3 3.57Å
371	V	98.5	Very high	97.3	Very high	39 Å²	39	40.4 Å²	40.4	24%	0.236	23%	0.229	C	C	.	.	H	α-helix	trans	-60.2	-46.2	174.7	172	0	0	0	0	110.6	V367 D368 V373 V374 W399	V367-V371 WeakPolarHBondContact O-CG2 3.48Å; V367-V371 PolarHBondContact O-N 3.16Å; D368-V371 PolarHBondContact O-N 3.36Å; V371-V373 PolarHBondContact O-N 3.14Å; V371-V373 VanDerWaalsContact O-N 3.12Å; V371-V374 WeakPolarHBondContact O-CG1 3.44Å; V371-V374 PolarHBondContact O-N 2.97Å; V371-W399 HydrophobicContact CG2-CB 3.84Å; V371-W399 HydrophobicContact CG2-CE3 3.82Å
372	S	97.9	Very high	97.4	Very high	86 Å²	86	38.1 Å²	38.1	60%	0.601	21%	0.206	S	C	*	.	T	Hydrogen-bonded Turn	trans	-69.9	-6.1	-177	57.7	0	0	0	0	115.1	D368 K369	D368-S372 PolarHBondContact O-N 2.97Å; D368-S372 PolarHBondContact O-OG 3.01Å; K369-S372 PolarHBondContact O-OG 3.3Å
373	V	97.8	Very high	97.4	Very high	15 Å²	15	38 Å²	38	9%	0.091	20%	0.204	C	C	.	.	T	Hydrogen-bonded Turn	trans	-129.2	12.1	176.6	-50.6	0	0	0	0	113.6	P341 K369 A370 V371 T375 E376 M377	P341-V373 HydrophobicContact CB-CB 4.48Å; P341-V373 HydrophobicContact CB-CG2 3.98Å; P341-V373 HydrophobicContact CG-CB 4.1Å; P341-V373 HydrophobicContact CG-CG2 4.1Å; K369-V373 WeakPolarHBondContact O-CG2 3.14Å; A370-V373 PolarHBondContact O-N 3.44Å; V371-V373 PolarHBondContact O-N 3.14Å; V371-V373 VanDerWaalsContact O-N 3.12Å; V373-T375 VanDerWaalsContact C-N 3.3Å; V373-T375 PolarHBondContact O-N 2.96Å; V373-E376 PolarHBondContact O-N 2.98Å; V373-M377 PolarHBondContact O-N 3.25Å
374	V	97.6	Very high	97.4	Very high	10 Å²	10	38 Å²	38	6%	0.061	20%	0.204	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.6	-32.3	-168	73	0	0	0	0	113.8	A370 V371 M377 W399 A402 M403 E406 R410	A370-V374 WeakPolarHBondContact O-CA 3.19Å; A370-V374 WeakPolarHBondContact O-CB 3.07Å; A370-V374 PolarHBondContact O-N 3.46Å; A370-V374 VanDerWaalsContact O-N 3.08Å; V371-V374 WeakPolarHBondContact O-CG1 3.44Å; V371-V374 PolarHBondContact O-N 2.97Å; V374-M377 HydrophobicContact CB-CE 4.45Å; V374-M377 HydrophobicContact CG2-CE 4.1Å; V374-M377 WeakPolarHBondContact O-CB 3.41Å; V374-M377 PolarHBondContact O-N 2.94Å; V374-W399 HydrophobicContact CB-CZ3 4.28Å; V374-W399 HydrophobicContact CG2-CH2 3.88Å; V374-W399 HydrophobicContact CG2-CZ3 3.75Å; V374-A402 HydrophobicContact CG1-CB 4.38Å; V374-M403 HydrophobicContact CG2-CE 3.68Å; V374-E406 HydrophobicContact CG1-CG 4.25Å; V374-E406 HydrophobicContact CG2-CG 4.2Å; V374-R410 PolarHBondContact O-NH2 2.98Å; V374-R410 VanDerWaalsContact O-NH2 3.08Å
375	T	96.5	Very high	97.4	Very high	95 Å²	95	36.8 Å²	36.8	58%	0.583	20%	0.196	S	C	*	.	T	Hydrogen-bonded Turn	trans	-63.8	-40.4	178	44	0	0	0	0	112.3	V373 R410	V373-T375 VanDerWaalsContact C-N 3.3Å; V373-T375 PolarHBondContact O-N 2.96Å; T375-R410 PolarHBondContact O-NH2 2.81Å; T375-R410 VanDerWaalsContact O-NH2 3.11Å
376	E	96.3	Very high	97.4	Very high	152 Å²	152	29.5 Å²	29.5	71%	0.71	17%	0.169	S	C	*	.	T	Hydrogen-bonded Turn	trans	-81.5	-15.3	178.1	-66.4	170.4	-142.1	0	0	112.9	P341 V373	P341-E376 HydrophobicContact CG-CB 3.81Å; V373-E376 PolarHBondContact O-N 2.98Å
377	M	96.3	Very high	97.2	Very high	2 Å²	2	30.5 Å²	30.5	1%	0.01	17%	0.173	C	C	.	.	S	Bend	trans	-74.1	137.7	-175.3	-166	157.9	39.3	0	0	112.5	P341 A370 V373 V374 A381 M382 V385 W399 R410	P341-M377 HydrophobicContact CB-CB 3.7Å; P341-M377 HydrophobicContact CB-CG 3.89Å; A370-M377 HydrophobicContact CB-CE 4.34Å; V373-M377 PolarHBondContact O-N 3.25Å; V374-M377 HydrophobicContact CB-CE 4.45Å; V374-M377 HydrophobicContact CG2-CE 4.1Å; V374-M377 WeakPolarHBondContact O-CB 3.41Å; V374-M377 PolarHBondContact O-N 2.94Å; M377-A381 HydrophobicContact CG-CB 3.4Å; M377-A381 VanDerWaalsContact CG-CB 3.4Å; M377-A381 HydrophobicContact SD-CB 3.61Å; M377-M382 HydrophobicContact CE-CB 4.29Å; M377-V385 HydrophobicContact CE-CG2 4.31Å; M377-V385 HydrophobicContact SD-CG2 4.34Å; M377-W399 HydrophobicContact CE-CH2 3.54Å; M377-W399 HydrophobicContact CE-CZ3 3.82Å; M377-R410 PolarHBondContact O-NH1 3.44Å; M377-R410 PolarHBondContact O-NH2 3.06Å
378	G	95.3	Very high	97.1	Very high	27 Å²	27	30.5 Å²	30.5	28%	0.278	17%	0.173	S	C	.	.			trans	-70.9	152.7	172.3	0	0	0	0	0	112.4	E342 F380 A381 M382	E342-G378 VanDerWaalsContact OE1-CA 3.23Å; E342-G378 WeakPolarHBondContact OE1-CA 3.39Å; E342-G378 PolarHBondContact OE1-N 2.9Å; G378-F380 PolarHBondContact O-N 2.8Å; G378-F380 VanDerWaalsContact O-N 3.07Å; G378-A381 PolarHBondContact O-N 3.46Å; G378-A381 VanDerWaalsContact O-N 3.07Å; G378-M382 PolarHBondContact O-N 3.37Å
379	D	95.5	Very high	96.8	Very high	34 Å²	34	26.8 Å²	26.8	18%	0.182	15%	0.153	C	C	.	.	H	α-helix	trans	-60.5	-25.7	-174.8	-58.1	-20	0	0	0	112.3	V383 R410 R413 M414	D379-V383 VanDerWaalsContact O-CB 3.24Å; D379-V383 WeakPolarHBondContact O-CB 3.29Å; D379-V383 WeakPolarHBondContact O-CG2 3.47Å; D379-V383 PolarHBondContact O-N 2.99Å; D379-V383 VanDerWaalsContact O-N 3.07Å; D379-R410 VanDerWaalsContact OD1-CD 3.31Å; D379-R410 WeakPolarHBondContact OD1-CD 3.14Å; D379-R410 IonicContact OD1-CZ 3.98Å; D379-R410 IonicContact OD1-NE 2.67Å; D379-R410 IonicContact OD1-NH1 3.88Å; D379-R410 PolarHBondContact OD1-NH1 3.44Å; D379-R413 IonicContact OD2-NE 2.66Å; D379-M414 HydrophobicContact CB-CE 4.39Å; D379-M414 HydrophobicContact CB-CG 4.11Å; D379-M414 WeakPolarHBondContact OD2-CG 3.33Å
380	F	95.1	Very high	96.4	Very high	38 Å²	38	26 Å²	26	17%	0.167	15%	0.149	C	C	.	.	H	α-helix	trans	-68.8	-50.5	173.3	-178.6	-117	0	0	0	112.7	V139 T141 L349 G378 V383 N384	V139-F380 HydrophobicContact CG1-CB 3.63Å; V139-F380 HydrophobicContact CG1-CD1 4.47Å; V139-F380 HydrophobicContact CG1-CD2 3.55Å; V139-F380 HydrophobicContact CG1-CE2 4.3Å; V139-F380 HydrophobicContact CG1-CG 3.64Å; T141-F380 HydrophobicContact CG2-CE1 4.4Å; T141-F380 HydrophobicContact CG2-CE2 4.01Å; T141-F380 HydrophobicContact CG2-CZ 3.81Å; L349-F380 HydrophobicContact CD2-CE1 4.11Å; L349-F380 HydrophobicContact CD2-CZ 3.77Å; G378-F380 PolarHBondContact O-N 2.8Å; G378-F380 VanDerWaalsContact O-N 3.07Å; F380-V383 PolarHBondContact O-N 2.96Å; F380-N384 WeakPolarHBondContact CD1-ND2 3.44Å; F380-N384 WeakPolarHBondContact CE1-ND2 3.24Å; F380-N384 WeakPolarHBondContact CZ-ND2 3.36Å; F380-N384 PolarHBondContact O-N 3.1Å; F380-N384 PolarHBondContact O-ND2 2.79Å; F380-N384 VanDerWaalsContact O-ND2 3.17Å; F380-N384 PolarHBondContact O-OD1 2.9Å
381	A	97.8	Very high	96	Very high	0 Å²	0	27.5 Å²	27.5	0%	0	16%	0.156	C	C	.	.	H	α-helix	trans	-64	-42.9	178.4	0	0	0	0	0	111.7	E342 M377 G378 V383 N384 V385	E342-A381 VanDerWaalsContact OE1-CB 3.31Å; E342-A381 WeakPolarHBondContact OE1-CB 3.43Å; E342-A381 WeakPolarHBondContact OE2-CB 3.37Å; M377-A381 HydrophobicContact CG-CB 3.4Å; M377-A381 VanDerWaalsContact CG-CB 3.4Å; M377-A381 HydrophobicContact SD-CB 3.61Å; G378-A381 PolarHBondContact O-N 3.46Å; G378-A381 VanDerWaalsContact O-N 3.07Å; A381-V383 VanDerWaalsContact C-N 3.34Å; A381-V383 PolarHBondContact O-N 3.34Å; A381-N384 WeakPolarHBondContact O-CA 3.45Å; A381-N384 WeakPolarHBondContact O-CB 3.45Å; A381-N384 PolarHBondContact O-N 3.42Å; A381-V385 PolarHBondContact O-N 3.38Å
382	M	97.8	Very high	95.5	Very high	0 Å²	0	26.7 Å²	26.7	0%	0	15%	0.152	C	C	.	.	H	α-helix	trans	-55.7	-46.5	171.5	-176.6	-175	73.5	0	0	111.9	M377 G378 N384 V385 L386 W399 M403 E406 V407 M414	M377-M382 HydrophobicContact CE-CB 4.29Å; G378-M382 PolarHBondContact O-N 3.37Å; M382-N384 VanDerWaalsContact C-N 3.25Å; M382-N384 PolarHBondContact O-N 3.34Å; M382-V385 PolarHBondContact O-N 3.19Å; M382-L386 WeakPolarHBondContact O-CG 3.33Å; M382-L386 PolarHBondContact O-N 3.17Å; M382-L386 VanDerWaalsContact O-N 3.08Å; M382-W399 HydrophobicContact CG-CH2 3.96Å; M382-W399 HydrophobicContact CG-CZ2 3.93Å; M382-M403 HydrophobicContact CG-CE 3.85Å; M382-M403 HydrophobicContact CG-SD 3.82Å; M382-M403 HydrophobicContact SD-CE 3.77Å; M382-M403 HydrophobicContact SD-SD 3.78Å; M382-E406 HydrophobicContact SD-CB 4.39Å; M382-V407 HydrophobicContact CE-CG2 4.41Å; M382-M414 HydrophobicContact CE-CE 3.94Å; M382-M414 HydrophobicContact CE-SD 4.23Å
383	V	96.9	Very high	94.9	Very high	5 Å²	5	27.4 Å²	27.4	3%	0.03	14%	0.142	C	C	.	.	H	α-helix	trans	-65.6	-26.2	175.5	161.2	0	0	0	0	112.6	D379 F380 A381 K387 M414 H421 V422	D379-V383 VanDerWaalsContact O-CB 3.24Å; D379-V383 WeakPolarHBondContact O-CB 3.29Å; D379-V383 WeakPolarHBondContact O-CG2 3.47Å; D379-V383 PolarHBondContact O-N 2.99Å; D379-V383 VanDerWaalsContact O-N 3.07Å; F380-V383 PolarHBondContact O-N 2.96Å; A381-V383 VanDerWaalsContact C-N 3.34Å; A381-V383 PolarHBondContact O-N 3.34Å; V383-K387 VanDerWaalsContact O-CG 3.29Å; V383-K387 WeakPolarHBondContact O-CG 3.38Å; V383-K387 PolarHBondContact O-N 3.19Å; V383-M414 HydrophobicContact CG2-CE 4.01Å; V383-H421 HydrophobicContact CG1-CB 3.72Å; V383-V422 HydrophobicContact CG2-CG2 4.36Å
384	N	98	Very high	94.5	Very high	0 Å²	0	27.1 Å²	27.1	0%	0	14%	0.14	C	C	.	.	H	α-helix	trans	-77.4	-36.9	176	-63	-26	0	0	0	112.6	G345 L349 F380 A381 M382 L386 K387 Y388	G345-N384 WeakPolarHBondContact O-CB 3.41Å; L349-N384 HydrophobicContact CB-CB 4.05Å; F380-N384 WeakPolarHBondContact CD1-ND2 3.44Å; F380-N384 WeakPolarHBondContact CE1-ND2 3.24Å; F380-N384 WeakPolarHBondContact CZ-ND2 3.36Å; F380-N384 PolarHBondContact O-N 3.1Å; F380-N384 PolarHBondContact O-ND2 2.79Å; F380-N384 VanDerWaalsContact O-ND2 3.17Å; F380-N384 PolarHBondContact O-OD1 2.9Å; A381-N384 WeakPolarHBondContact O-CA 3.45Å; A381-N384 WeakPolarHBondContact O-CB 3.45Å; A381-N384 PolarHBondContact O-N 3.42Å; M382-N384 VanDerWaalsContact C-N 3.25Å; M382-N384 PolarHBondContact O-N 3.34Å; N384-L386 VanDerWaalsContact C-N 3.33Å; N384-K387 WeakPolarHBondContact O-CB 3.26Å; N384-K387 PolarHBondContact O-N 3.11Å; N384-K387 PolarHBondContact OD1-NZ 2.76Å; N384-Y388 PolarHBondContact O-N 3.06Å
385	V	98.4	Very high	94.1	Very high	1 Å²	1	28.8 Å²	28.8	1%	0.006	15%	0.146	C	C	.	.	H	α-helix	trans	-59.7	-45.4	168	179.6	0	0	0	0	110.2	C348 V367 A370 M377 A381 M382 K387 Y388 L389 W399	C348-V385 HydrophobicContact CB-CG2 4.37Å; V367-V385 HydrophobicContact CG1-CG1 4.5Å; V367-V385 HydrophobicContact CG2-CG1 4.32Å; A370-V385 HydrophobicContact CB-CG1 3.99Å; A370-V385 HydrophobicContact CB-CG2 3.87Å; M377-V385 HydrophobicContact CE-CG2 4.31Å; M377-V385 HydrophobicContact SD-CG2 4.34Å; A381-V385 PolarHBondContact O-N 3.38Å; M382-V385 PolarHBondContact O-N 3.19Å; V385-K387 VanDerWaalsContact C-N 3.33Å; V385-K387 PolarHBondContact O-N 3.32Å; V385-Y388 PolarHBondContact O-N 2.82Å; V385-Y388 VanDerWaalsContact O-N 3.15Å; V385-L389 HydrophobicContact CG1-CD1 4.19Å; V385-L389 PolarHBondContact O-N 3.19Å; V385-W399 HydrophobicContact CB-CH2 3.84Å; V385-W399 HydrophobicContact CB-CZ2 3.79Å; V385-W399 HydrophobicContact CB-CZ3 4.46Å; V385-W399 HydrophobicContact CG1-CD2 4.05Å; V385-W399 HydrophobicContact CG1-CE3 4.11Å; V385-W399 HydrophobicContact CG1-CH2 3.79Å; V385-W399 HydrophobicContact CG1-CZ2 3.67Å; V385-W399 HydrophobicContact CG1-CZ3 4Å; V385-W399 HydrophobicContact CG2-CH2 4.22Å
386	L	96.9	Very high	94	Very high	4 Å²	4	25.1 Å²	25.1	2%	0.021	12%	0.122	C	C	.	.	H	α-helix	trans	-61.5	-33.7	175.3	-74	166.1	0	0	0	113.9	M382 N384 R390 W399 M403 V422 T425	M382-L386 WeakPolarHBondContact O-CG 3.33Å; M382-L386 PolarHBondContact O-N 3.17Å; M382-L386 VanDerWaalsContact O-N 3.08Å; N384-L386 VanDerWaalsContact C-N 3.33Å; L386-R390 PolarHBondContact O-N 3.45Å; L386-W399 VanDerWaalsContact CD2-NE1 3.26Å; L386-W399 HydrophobicContact CG-CZ2 4.11Å; L386-M403 HydrophobicContact CD1-SD 3.91Å; L386-M403 HydrophobicContact CD2-CG 4.17Å; L386-M403 HydrophobicContact CD2-SD 4.23Å; L386-M403 HydrophobicContact CG-SD 4.29Å; L386-V422 HydrophobicContact CD1-CB 4.47Å; L386-V422 HydrophobicContact CD1-CG2 3.82Å; L386-T425 HydrophobicContact CB-CG2 4.37Å; L386-T425 HydrophobicContact CD2-CG2 3.64Å; L386-T425 PolarHBondContact O-OG1 3.02Å
387	K	95.1	Very high	93.9	Very high	20 Å²	20	24.7 Å²	24.7	9%	0.087	11%	0.114	C	C	.	.	H	α-helix	trans	-67.6	-44.1	172.1	-73.4	164.8	-164.6	156.7	0	111.3	F352 V383 N384 V385 R390 F391 H421	F352-K387 HydrophobicContact CD1-CB 4.13Å; F352-K387 HydrophobicContact CD1-CD 4.25Å; F352-K387 HydrophobicContact CD2-CB 3.85Å; F352-K387 WeakPolarHBondContact CD2-O 3.48Å; F352-K387 HydrophobicContact CE1-CB 4.3Å; F352-K387 HydrophobicContact CE1-CD 4.14Å; F352-K387 HydrophobicContact CE1-CG 4.42Å; F352-K387 HydrophobicContact CE2-CB 4.03Å; F352-K387 HydrophobicContact CG-CB 3.92Å; F352-K387 HydrophobicContact CZ-CB 4.26Å; F352-K387 HydrophobicContact CZ-CG 4.44Å; V383-K387 VanDerWaalsContact O-CG 3.29Å; V383-K387 WeakPolarHBondContact O-CG 3.38Å; V383-K387 PolarHBondContact O-N 3.19Å; N384-K387 WeakPolarHBondContact O-CB 3.26Å; N384-K387 PolarHBondContact O-N 3.11Å; N384-K387 PolarHBondContact OD1-NZ 2.76Å; V385-K387 VanDerWaalsContact C-N 3.33Å; V385-K387 PolarHBondContact O-N 3.32Å; K387-R390 PolarHBondContact O-N 3.06Å; K387-F391 PolarHBondContact O-N 3.22Å; K387-F391 VanDerWaalsContact O-N 3.09Å; K387-H421 WeakPolarHBondContact CE-CD2 3.42Å; K387-H421 WeakPolarHBondContact CE-NE2 3.36Å
388	Y	95.2	Very high	93.9	Very high	0 Å²	0	27.7 Å²	27.7	0%	0	13%	0.133	C	C	.	.	H	α-helix	trans	-68.1	-45.4	-178.1	-169.9	-125.4	0	0	0	111.8	C348 L351 F352 L358 V363 N384 V385 R390 F391 S392	C348-Y388 HydrophobicContact CB-CD1 4.44Å; C348-Y388 HydrophobicContact CB-CG 4.29Å; L351-Y388 HydrophobicContact CB-CD2 3.88Å; L351-Y388 HydrophobicContact CB-CE2 3.38Å; L351-Y388 HydrophobicContact CD1-CE1 4.04Å; L351-Y388 HydrophobicContact CD1-CE2 4.2Å; L351-Y388 HydrophobicContact CG-CE2 4.4Å; F352-Y388 HydrophobicContact CB-CD2 4.29Å; L358-Y388 WeakPolarHBondContact CG-OH 3.37Å; V363-Y388 HydrophobicContact CB-CE1 4.43Å; V363-Y388 HydrophobicContact CG1-CD1 4.22Å; V363-Y388 HydrophobicContact CG1-CE1 3.83Å; V363-Y388 HydrophobicContact CG2-CE1 4.15Å; N384-Y388 PolarHBondContact O-N 3.06Å; V385-Y388 PolarHBondContact O-N 2.82Å; V385-Y388 VanDerWaalsContact O-N 3.15Å; Y388-R390 VanDerWaalsContact C-N 3.29Å; Y388-R390 PolarHBondContact O-N 3.47Å; Y388-F391 AromaticContact CD2-CD1 3.93Å; Y388-F391 HydrophobicContact CD2-CD1 3.93Å; Y388-F391 AromaticContact CE2-CD1 3.83Å; Y388-F391 HydrophobicContact CE2-CD1 3.83Å; Y388-F391 HydrophobicContact CE2-CE1 4.14Å; Y388-F391 PolarHBondContact O-N 3.08Å; Y388-S392 PolarHBondContact O-N 3.47Å; Y388-S392 PolarHBondContact O-OG 2.82Å
389	L	91.9	Very high	94	Very high	1 Å²	1	26.4 Å²	26.4	1%	0.005	12%	0.12	C	C	.	.	H	α-helix	trans	-51.1	-45.9	171.1	-81.8	169.6	0	0	0	113	V367 V385 F391 S392 Y393 L394 H396 W399	V367-L389 HydrophobicContact CB-CD2 4.5Å; V367-L389 HydrophobicContact CG1-CD1 4.18Å; V367-L389 HydrophobicContact CG1-CD2 4.21Å; V367-L389 HydrophobicContact CG2-CD1 4.43Å; V367-L389 HydrophobicContact CG2-CD2 3.66Å; V367-L389 HydrophobicContact CG2-CG 3.95Å; V385-L389 HydrophobicContact CG1-CD1 4.19Å; V385-L389 PolarHBondContact O-N 3.19Å; L389-F391 VanDerWaalsContact C-N 3.32Å; L389-F391 PolarHBondContact O-N 3.41Å; L389-S392 PolarHBondContact O-N 2.96Å; L389-Y393 PolarHBondContact O-N 3.34Å; L389-Y393 VanDerWaalsContact O-N 3.09Å; L389-L394 HydrophobicContact CD2-CB 3.93Å; L389-L394 HydrophobicContact CD2-CD2 3.97Å; L389-L394 HydrophobicContact CD2-CG 4Å; L389-L394 PolarHBondContact O-N 3.45Å; L389-L394 VanDerWaalsContact O-N 3.14Å; L389-H396 HydrophobicContact CD2-CB 3.83Å; L389-W399 HydrophobicContact CD1-CD2 4.29Å; L389-W399 HydrophobicContact CD1-CG 3.76Å
390	R	92	Very high	94	Very high	17 Å²	17	24.9 Å²	24.9	6%	0.064	11%	0.112	C	C	.	.	H	α-helix	trans	-67.5	-30	178.1	-173.2	170.8	74.9	-107.6	-0.9	113.1	S103 L386 K387 Y388 L424 T425 A428	S103-R390 PolarHBondContact OG-NE 3.02Å; S103-R390 VanDerWaalsContact OG-NE 3.12Å; S103-R390 PolarHBondContact OG-NH2 3.31Å; L386-R390 PolarHBondContact O-N 3.45Å; K387-R390 PolarHBondContact O-N 3.06Å; Y388-R390 VanDerWaalsContact C-N 3.29Å; Y388-R390 PolarHBondContact O-N 3.47Å; R390-L424 WeakPolarHBondContact CD-O 3.17Å; R390-T425 PolarHBondContact NH1-OG1 2.8Å; R390-A428 VanDerWaalsContact CD-CB 3.41Å; R390-A428 HydrophobicContact CG-CB 3.62Å
391	F	89.7	Confident	94	Very high	32 Å²	32	26.4 Å²	26.4	14%	0.14	12%	0.119	C	C	.	.	H	α-helix	trans	-78.1	-38	175.9	163.4	-97.4	0	0	0	112.5	F352 Q355 K387 Y388 L389 Y393	F352-F391 HydrophobicContact CD2-CB 3.71Å; F352-F391 HydrophobicContact CD2-CG 4.31Å; F352-F391 HydrophobicContact CE2-CB 4.17Å; Q355-F391 HydrophobicContact CB-CE2 4.13Å; Q355-F391 HydrophobicContact CB-CZ 4.32Å; Q355-F391 WeakPolarHBondContact O-CZ 3.11Å; K387-F391 PolarHBondContact O-N 3.22Å; K387-F391 VanDerWaalsContact O-N 3.09Å; Y388-F391 AromaticContact CD2-CD1 3.93Å; Y388-F391 HydrophobicContact CD2-CD1 3.93Å; Y388-F391 AromaticContact CE2-CD1 3.83Å; Y388-F391 HydrophobicContact CE2-CD1 3.83Å; Y388-F391 HydrophobicContact CE2-CE1 4.14Å; Y388-F391 PolarHBondContact O-N 3.08Å; L389-F391 VanDerWaalsContact C-N 3.32Å; L389-F391 PolarHBondContact O-N 3.41Å; F391-Y393 VanDerWaalsContact C-N 3.25Å; F391-Y393 WeakPolarHBondContact O-CD2 3.43Å; F391-Y393 WeakPolarHBondContact O-CE2 3.49Å; F391-Y393 PolarHBondContact O-N 3.06Å
392	S	88.3	Confident	94	Very high	21 Å²	21	27.1 Å²	27.1	15%	0.147	13%	0.125	C	C	.	.	T	Hydrogen-bonded Turn	trans	-80.2	-1.3	176.1	-59.7	0	0	0	0	114	Y388 L389 L394	Y388-S392 PolarHBondContact O-N 3.47Å; Y388-S392 PolarHBondContact O-OG 2.82Å; L389-S392 PolarHBondContact O-N 2.96Å; S392-L394 PolarHBondContact O-N 2.79Å; S392-L394 VanDerWaalsContact O-N 3.15Å
393	Y	85.1	Confident	94	Very high	102 Å²	102	27.3 Å²	27.3	40%	0.4	13%	0.126	S	C	.	.	T	Hydrogen-bonded Turn	trans	53.2	26.3	-174.4	-58.7	-84.9	0	0	0	114.5	W88 C98 L389 F391	W88-Y393 WeakPolarHBondContact CB-O 3.27Å; C98-Y393 HydrophobicContact CB-CE1 4.23Å; L389-Y393 PolarHBondContact O-N 3.34Å; L389-Y393 VanDerWaalsContact O-N 3.09Å; F391-Y393 VanDerWaalsContact C-N 3.25Å; F391-Y393 WeakPolarHBondContact O-CD2 3.43Å; F391-Y393 WeakPolarHBondContact O-CE2 3.49Å; F391-Y393 PolarHBondContact O-N 3.06Å
394	L	88.8	Confident	94	Very high	9 Å²	9	30.4 Å²	30.4	5%	0.047	14%	0.14	C	C	.	.			trans	-87.3	118	-173.5	178.7	59.5	0	0	0	111.3	E360 V363 L389 S392 H396	E360-L394 HydrophobicContact CG-CD1 4.14Å; V363-L394 HydrophobicContact CB-CD2 3.99Å; V363-L394 HydrophobicContact CG1-CB 4.48Å; V363-L394 HydrophobicContact CG1-CD2 3.54Å; L389-L394 HydrophobicContact CD2-CB 3.93Å; L389-L394 HydrophobicContact CD2-CD2 3.97Å; L389-L394 HydrophobicContact CD2-CG 4Å; L389-L394 PolarHBondContact O-N 3.45Å; L389-L394 VanDerWaalsContact O-N 3.14Å; S392-L394 PolarHBondContact O-N 2.79Å; S392-L394 VanDerWaalsContact O-N 3.15Å; L394-H396 HydrophobicContact CG-CB 4.35Å; L394-H396 PolarHBondContact O-N 2.95Å
395	F	90.2	Very high	93.9	Very high	45 Å²	45	39.4 Å²	39.4	20%	0.197	17%	0.174	C	C	.	.			trans	-79.7	103.5	163.8	177.5	-99.5	0	0	0	110.1	W88 R397 L400 Y431 I750	W88-F395 HydrophobicContact CZ2-CB 3.79Å; W88-F395 HydrophobicContact CZ2-CG 4.38Å; F395-R397 HydrophobicContact CE1-CB 3.98Å; F395-R397 HydrophobicContact CZ-CB 4.4Å; F395-L400 HydrophobicContact CD2-CD1 3.46Å; F395-L400 VanDerWaalsContact CD2-CD1 3.46Å; F395-L400 HydrophobicContact CE2-CD1 3.3Å; F395-L400 HydrophobicContact CG-CD1 4.45Å; F395-L400 HydrophobicContact CZ-CD1 4.19Å; F395-Y431 HydrophobicContact CE2-CD2 4.37Å; F395-I750 HydrophobicContact CB-CD1 4.44Å; F395-I750 HydrophobicContact CD2-CD1 3.25Å; F395-I750 HydrophobicContact CD2-CG2 4.49Å; F395-I750 HydrophobicContact CE2-CB 4.38Å; F395-I750 HydrophobicContact CE2-CD1 3.55Å; F395-I750 HydrophobicContact CE2-CG2 3.77Å; F395-I750 HydrophobicContact CG-CD1 3.89Å; F395-I750 HydrophobicContact CZ-CD1 4.4Å; F395-I750 HydrophobicContact CZ-CG2 3.81Å
396	H	94.6	Very high	93.9	Very high	17 Å²	17	40.5 Å²	40.5	8%	0.079	18%	0.179	C	C	.	.			trans	-107.5	95.9	179.5	-154.9	-88.7	0	0	0	111.1	V367 D368 L389 L394 T398 W399 L400	V367-H396 HydrophobicContact CG1-CB 3.97Å; V367-H396 WeakPolarHBondContact CG1-ND1 3.44Å; D368-H396 IonicContact OD1-CE1 3.12Å; D368-H396 PolarHBondContact OD1-CE1 3.17Å; D368-H396 VanDerWaalsContact OD1-CE1 3.23Å; D368-H396 IonicContact OD1-NE2 3.86Å; L389-H396 HydrophobicContact CD2-CB 3.83Å; L394-H396 HydrophobicContact CG-CB 4.35Å; L394-H396 PolarHBondContact O-N 2.95Å; H396-T398 PolarHBondContact CE1-OG1 3.35Å; H396-T398 VanDerWaalsContact CE1-OG1 3.29Å; H396-T398 PolarHBondContact ND1-OG1 3.24Å; H396-T398 PolarHBondContact O-N 2.92Å; H396-W399 HydrophobicContact CB-CB 4.13Å; H396-W399 PolarHBondContact O-N 3.04Å; H396-W399 VanDerWaalsContact O-N 3.17Å; H396-L400 PolarHBondContact O-N 3.35Å; H396-L400 VanDerWaalsContact O-N 3.11Å
397	R	93.8	Very high	93.9	Very high	143 Å²	143	40.3 Å²	40.3	54%	0.54	18%	0.178	S	C	.	.	H	α-helix	trans	-52.2	-55	-169.8	-175.9	-173.6	164.8	165.5	1.7	113.1	F395 W399 L400 E401	F395-R397 HydrophobicContact CE1-CB 3.98Å; F395-R397 HydrophobicContact CZ-CB 4.4Å; R397-W399 PolarHBondContact O-N 2.97Å; R397-L400 PolarHBondContact O-N 3.17Å; R397-L400 VanDerWaalsContact O-N 3.09Å; R397-E401 HydrophobicContact CG-CG 4.36Å; R397-E401 IonicContact CZ-OE1 2.71Å; R397-E401 VanDerWaalsContact NE-CD 3.34Å; R397-E401 IonicContact NE-OE1 2.71Å; R397-E401 PolarHBondContact NE-OE1 2.74Å; R397-E401 IonicContact NE-OE2 2.88Å; R397-E401 PolarHBondContact NE-OE2 3.49Å; R397-E401 IonicContact NH2-OE1 3.85Å; R397-E401 PolarHBondContact NH2-OE1 2.71Å; R397-E401 WeakPolarHBondContact O-CG 3.33Å; R397-E401 PolarHBondContact O-N 3.16Å
398	T	96.6	Very high	94	Very high	65 Å²	65	41.5 Å²	41.5	40%	0.399	19%	0.188	S	C	.	.	H	α-helix	trans	-62.8	-28.2	-176.5	49.9	0	0	0	0	113.4	H396 A402	H396-T398 PolarHBondContact CE1-OG1 3.35Å; H396-T398 VanDerWaalsContact CE1-OG1 3.29Å; H396-T398 PolarHBondContact ND1-OG1 3.24Å; H396-T398 PolarHBondContact O-N 2.92Å; T398-A402 WeakPolarHBondContact O-CB 3.3Å; T398-A402 PolarHBondContact O-N 3.38Å; T398-A402 VanDerWaalsContact O-N 3.16Å
399	W	97.2	Very high	94.1	Very high	0 Å²	0	47.1 Å²	47.1	0%	0	21%	0.214	C	C	.	.	H	α-helix	trans	-74.8	-42.6	174.5	173.9	-89.3	0	0	0	111.2	V367 A370 V371 V374 M377 M382 V385 L386 L389 H396 R397 A402 M403	V367-W399 HydrophobicContact CG1-CB 3.65Å; V367-W399 HydrophobicContact CG1-CD2 4.14Å; V367-W399 HydrophobicContact CG1-CE3 4.24Å; V367-W399 HydrophobicContact CG1-CG 3.89Å; A370-W399 HydrophobicContact CB-CE3 4Å; A370-W399 HydrophobicContact CB-CH2 4.38Å; A370-W399 HydrophobicContact CB-CZ3 3.57Å; V371-W399 HydrophobicContact CG2-CB 3.84Å; V371-W399 HydrophobicContact CG2-CE3 3.82Å; V374-W399 HydrophobicContact CB-CZ3 4.28Å; V374-W399 HydrophobicContact CG2-CH2 3.88Å; V374-W399 HydrophobicContact CG2-CZ3 3.75Å; M377-W399 HydrophobicContact CE-CH2 3.54Å; M377-W399 HydrophobicContact CE-CZ3 3.82Å; M382-W399 HydrophobicContact CG-CH2 3.96Å; M382-W399 HydrophobicContact CG-CZ2 3.93Å; V385-W399 HydrophobicContact CB-CH2 3.84Å; V385-W399 HydrophobicContact CB-CZ2 3.79Å; V385-W399 HydrophobicContact CB-CZ3 4.46Å; V385-W399 HydrophobicContact CG1-CD2 4.05Å; V385-W399 HydrophobicContact CG1-CE3 4.11Å; V385-W399 HydrophobicContact CG1-CH2 3.79Å; V385-W399 HydrophobicContact CG1-CZ2 3.67Å; V385-W399 HydrophobicContact CG1-CZ3 4Å; V385-W399 HydrophobicContact CG2-CH2 4.22Å; L386-W399 VanDerWaalsContact CD2-NE1 3.26Å; L386-W399 HydrophobicContact CG-CZ2 4.11Å; L389-W399 HydrophobicContact CD1-CD2 4.29Å; L389-W399 HydrophobicContact CD1-CG 3.76Å; H396-W399 HydrophobicContact CB-CB 4.13Å; H396-W399 PolarHBondContact O-N 3.04Å; H396-W399 VanDerWaalsContact O-N 3.17Å; R397-W399 PolarHBondContact O-N 2.97Å; W399-A402 WeakPolarHBondContact O-CB 3.49Å; W399-A402 PolarHBondContact O-N 2.94Å; W399-M403 HydrophobicContact CD2-CE 4.27Å; W399-M403 HydrophobicContact CH2-CE 3.75Å; W399-M403 HydrophobicContact CZ2-CE 3.48Å; W399-M403 VanDerWaalsContact CZ2-CE 3.48Å; W399-M403 HydrophobicContact CZ2-SD 3.7Å; W399-M403 HydrophobicContact CZ3-CE 4.26Å; W399-M403 WeakPolarHBondContact O-CG 3.18Å; W399-M403 PolarHBondContact O-N 3.41Å
400	L	95.1	Very high	94.3	Very high	3 Å²	3	47.5 Å²	47.5	2%	0.016	22%	0.216	C	C	.	.	H	α-helix	trans	-65.9	-42.6	178	-66.9	171.5	0	0	0	111.5	F395 H396 R397 A402 M403 E404 L429 Y431	F395-L400 HydrophobicContact CD2-CD1 3.46Å; F395-L400 VanDerWaalsContact CD2-CD1 3.46Å; F395-L400 HydrophobicContact CE2-CD1 3.3Å; F395-L400 HydrophobicContact CG-CD1 4.45Å; F395-L400 HydrophobicContact CZ-CD1 4.19Å; H396-L400 PolarHBondContact O-N 3.35Å; H396-L400 VanDerWaalsContact O-N 3.11Å; R397-L400 PolarHBondContact O-N 3.17Å; R397-L400 VanDerWaalsContact O-N 3.09Å; L400-A402 VanDerWaalsContact C-N 3.26Å; L400-A402 PolarHBondContact O-N 3.06Å; L400-M403 WeakPolarHBondContact O-CB 3.44Å; L400-M403 PolarHBondContact O-N 2.65Å; L400-E404 PolarHBondContact O-N 2.99Å; L400-E404 VanDerWaalsContact O-N 3.17Å; L400-L429 HydrophobicContact CD1-CD1 4.35Å; L400-L429 HydrophobicContact CD2-CD1 4.23Å; L400-Y431 HydrophobicContact CB-CD1 4.09Å; L400-Y431 HydrophobicContact CB-CE1 3.72Å; L400-Y431 HydrophobicContact CB-CE2 4.23Å; L400-Y431 HydrophobicContact CB-CG 4.45Å; L400-Y431 HydrophobicContact CD1-CD1 4.32Å; L400-Y431 HydrophobicContact CD1-CD2 4.22Å; L400-Y431 HydrophobicContact CD1-CG 4.02Å; L400-Y431 HydrophobicContact CD2-CD1 3.87Å; L400-Y431 HydrophobicContact CD2-CE1 4.24Å; L400-Y431 HydrophobicContact CD2-CG 4.33Å; L400-Y431 HydrophobicContact CG-CD1 4.31Å; L400-Y431 HydrophobicContact CG-CE1 4.43Å
401	E	94.9	Very high	94.5	Very high	69 Å²	69	46.8 Å²	46.8	32%	0.322	21%	0.214	S	C	.	.	H	α-helix	trans	-61	-32.3	171.8	-69.9	172	146.6	0	0	112.5	R397	R397-E401 HydrophobicContact CG-CG 4.36Å; R397-E401 IonicContact CZ-OE1 2.71Å; R397-E401 VanDerWaalsContact NE-CD 3.34Å; R397-E401 IonicContact NE-OE1 2.71Å; R397-E401 PolarHBondContact NE-OE1 2.74Å; R397-E401 IonicContact NE-OE2 2.88Å; R397-E401 PolarHBondContact NE-OE2 3.49Å; R397-E401 IonicContact NH2-OE1 3.85Å; R397-E401 PolarHBondContact NH2-OE1 2.71Å; R397-E401 WeakPolarHBondContact O-CG 3.33Å; R397-E401 PolarHBondContact O-N 3.16Å
402	A	97.3	Very high	94.6	Very high	16 Å²	16	50.9 Å²	50.9	13%	0.132	23%	0.233	C	C	.	.	H	α-helix	trans	-69.8	-39	171	0	0	0	0	0	112.2	V374 T398 W399 L400 E404 R405 E406	V374-A402 HydrophobicContact CG1-CB 4.38Å; T398-A402 WeakPolarHBondContact O-CB 3.3Å; T398-A402 PolarHBondContact O-N 3.38Å; T398-A402 VanDerWaalsContact O-N 3.16Å; W399-A402 WeakPolarHBondContact O-CB 3.49Å; W399-A402 PolarHBondContact O-N 2.94Å; L400-A402 VanDerWaalsContact C-N 3.26Å; L400-A402 PolarHBondContact O-N 3.06Å; A402-E404 VanDerWaalsContact C-N 3.28Å; A402-E404 PolarHBondContact O-N 2.87Å; A402-R405 PolarHBondContact O-N 2.99Å; A402-E406 WeakPolarHBondContact O-CG 3.31Å; A402-E406 PolarHBondContact O-N 2.95Å
403	M	97.8	Very high	94.8	Very high	3 Å²	3	55.7 Å²	55.7	2%	0.015	25%	0.248	C	C	.	.	H	α-helix	trans	-63.2	-30.9	177	-63.8	-61.7	93	0	0	113.1	V374 M382 L386 W399 L400 R405 E406 V407 I436	V374-M403 HydrophobicContact CG2-CE 3.68Å; M382-M403 HydrophobicContact CG-CE 3.85Å; M382-M403 HydrophobicContact CG-SD 3.82Å; M382-M403 HydrophobicContact SD-CE 3.77Å; M382-M403 HydrophobicContact SD-SD 3.78Å; L386-M403 HydrophobicContact CD1-SD 3.91Å; L386-M403 HydrophobicContact CD2-CG 4.17Å; L386-M403 HydrophobicContact CD2-SD 4.23Å; L386-M403 HydrophobicContact CG-SD 4.29Å; W399-M403 HydrophobicContact CD2-CE 4.27Å; W399-M403 HydrophobicContact CH2-CE 3.75Å; W399-M403 HydrophobicContact CZ2-CE 3.48Å; W399-M403 VanDerWaalsContact CZ2-CE 3.48Å; W399-M403 HydrophobicContact CZ2-SD 3.7Å; W399-M403 HydrophobicContact CZ3-CE 4.26Å; W399-M403 WeakPolarHBondContact O-CG 3.18Å; W399-M403 PolarHBondContact O-N 3.41Å; L400-M403 WeakPolarHBondContact O-CB 3.44Å; L400-M403 PolarHBondContact O-N 2.65Å; M403-R405 PolarHBondContact O-N 2.61Å; M403-E406 HydrophobicContact CE-CB 4.35Å; M403-V407 HydrophobicContact CB-CG2 4.1Å; M403-V407 WeakPolarHBondContact O-CB 3.45Å; M403-V407 WeakPolarHBondContact O-CG2 3.31Å; M403-V407 PolarHBondContact O-N 3.24Å; M403-V407 HydrophobicContact SD-CG2 4.19Å; M403-I436 HydrophobicContact CB-CD1 4.02Å
404	E	96.5	Very high	95.3	Very high	71 Å²	71	51 Å²	51	33%	0.332	23%	0.23	S	C	.	.	H	α-helix	trans	-62.6	-24.2	174.3	-57.7	-161.2	106.6	0	0	113.1	L400 A402 P408 Y431 S433 I436	L400-E404 PolarHBondContact O-N 2.99Å; L400-E404 VanDerWaalsContact O-N 3.17Å; A402-E404 VanDerWaalsContact C-N 3.28Å; A402-E404 PolarHBondContact O-N 2.87Å; E404-P408 WeakPolarHBondContact O-CD 3.33Å; E404-P408 WeakPolarHBondContact O-CG 3.36Å; E404-Y431 HydrophobicContact CG-CE1 4.25Å; E404-Y431 WeakPolarHBondContact CG-OH 3.47Å; E404-Y431 PolarHBondContact OE1-OH 2.92Å; E404-Y431 PolarHBondContact OE2-OH 2.92Å; E404-S433 WeakPolarHBondContact CG-OG 3.36Å; E404-S433 WeakPolarHBondContact OE1-CB 3.36Å; E404-S433 PolarHBondContact OE1-OG 3.48Å; E404-I436 HydrophobicContact CG-CD1 4.19Å
405	R	96.4	Very high	95.5	Very high	188 Å²	188	51 Å²	51	71%	0.709	23%	0.232	S	C	*	.	H	α-helix	trans	-95.2	-45.7	179.5	-50.6	179.6	84.8	171.5	5.6	110.6	A402 M403 Q409	A402-R405 PolarHBondContact O-N 2.99Å; M403-R405 PolarHBondContact O-N 2.61Å; R405-Q409 WeakPolarHBondContact O-CG 3.06Å; R405-Q409 PolarHBondContact O-NE2 2.84Å
406	E	97.9	Very high	95.7	Very high	24 Å²	24	48.9 Å²	48.9	11%	0.112	22%	0.222	C	C	.	.	H	α-helix	trans	-75.4	-43.1	-174.8	-69.3	-58.9	121.3	0	0	113.3	V374 M382 A402 M403 Q409 R410	V374-E406 HydrophobicContact CG1-CG 4.25Å; V374-E406 HydrophobicContact CG2-CG 4.2Å; M382-E406 HydrophobicContact SD-CB 4.39Å; A402-E406 WeakPolarHBondContact O-CG 3.31Å; A402-E406 PolarHBondContact O-N 2.95Å; M403-E406 HydrophobicContact CE-CB 4.35Å; E406-Q409 PolarHBondContact O-N 2.82Å; E406-R410 WeakPolarHBondContact O-CB 3.22Å; E406-R410 VanDerWaalsContact O-CD 3.3Å; E406-R410 WeakPolarHBondContact O-CD 3.39Å; E406-R410 VanDerWaalsContact O-CG 3.23Å; E406-R410 WeakPolarHBondContact O-CG 3.38Å; E406-R410 PolarHBondContact O-N 2.84Å; E406-R410 VanDerWaalsContact O-N 3.1Å; E406-R410 IonicContact OE2-CZ 2.73Å; E406-R410 IonicContact OE2-NE 2.75Å; E406-R410 PolarHBondContact OE2-NE 3.34Å; E406-R410 IonicContact OE2-NH2 3.34Å; E406-R410 PolarHBondContact OE2-NH2 3.11Å
407	V	97.9	Very high	95.6	Very high	0 Å²	0	52.3 Å²	52.3	0%	0	24%	0.239	C	C	.	.	H	α-helix	trans	-65.2	-46.6	-173.1	177.8	0	0	0	0	112.5	M382 M403 Q409 R410 A411 V422 I436 I440	M382-V407 HydrophobicContact CE-CG2 4.41Å; M403-V407 HydrophobicContact CB-CG2 4.1Å; M403-V407 WeakPolarHBondContact O-CB 3.45Å; M403-V407 WeakPolarHBondContact O-CG2 3.31Å; M403-V407 PolarHBondContact O-N 3.24Å; M403-V407 HydrophobicContact SD-CG2 4.19Å; V407-Q409 VanDerWaalsContact C-N 3.27Å; V407-Q409 PolarHBondContact O-N 3.11Å; V407-R410 CarbonylContact O-C 3.58Å; V407-R410 PolarHBondContact O-N 2.68Å; V407-A411 WeakPolarHBondContact O-CB 3.31Å; V407-A411 PolarHBondContact O-N 3.47Å; V407-V422 HydrophobicContact CG1-CG1 4.2Å; V407-V422 HydrophobicContact CG2-CG1 3.97Å; V407-V422 HydrophobicContact CG2-CG2 4.32Å; V407-I436 HydrophobicContact CB-CG1 4.38Å; V407-I436 HydrophobicContact CG1-CG2 4.14Å; V407-I440 HydrophobicContact CG1-CD1 4.43Å; V407-I440 HydrophobicContact CG1-CG1 4.45Å
408	P	97.5	Very high	95.6	Very high	45 Å²	45	46.2 Å²	46.2	29%	0.292	22%	0.22	S	C	.	.	H	α-helix	trans	-60.8	-35.7	178.5	-25.2	36.5	0	0	0	113.2	E404 R410	E404-P408 WeakPolarHBondContact O-CD 3.33Å; E404-P408 WeakPolarHBondContact O-CG 3.36Å; P408-R410 VanDerWaalsContact C-N 3.29Å; P408-R410 PolarHBondContact O-N 3.33Å
409	Q	96.6	Very high	95.7	Very high	118 Å²	118	43.1 Å²	43.1	55%	0.551	20%	0.201	S	C	*	.	H	α-helix	trans	-68.6	-26.7	175.3	-67.8	-179.7	76.6	0	0	113.1	R405 E406 V407 H412	R405-Q409 WeakPolarHBondContact O-CG 3.06Å; R405-Q409 PolarHBondContact O-NE2 2.84Å; E406-Q409 PolarHBondContact O-N 2.82Å; V407-Q409 VanDerWaalsContact C-N 3.27Å; V407-Q409 PolarHBondContact O-N 3.11Å; Q409-H412 PolarHBondContact O-CE1 3.44Å; Q409-H412 PolarHBondContact O-ND1 3.01Å
410	R	95.7	Very high	95.6	Very high	10 Å²	10	43.3 Å²	43.3	4%	0.038	20%	0.202	C	C	.	.	H	α-helix	trans	-98.8	-26.9	-176.1	-68.3	163.9	-176.8	-100.9	6.3	113.5	V374 T375 M377 D379 E406 V407 P408 H412 R413 M414	V374-R410 PolarHBondContact O-NH2 2.98Å; V374-R410 VanDerWaalsContact O-NH2 3.08Å; T375-R410 PolarHBondContact O-NH2 2.81Å; T375-R410 VanDerWaalsContact O-NH2 3.11Å; M377-R410 PolarHBondContact O-NH1 3.44Å; M377-R410 PolarHBondContact O-NH2 3.06Å; D379-R410 VanDerWaalsContact OD1-CD 3.31Å; D379-R410 WeakPolarHBondContact OD1-CD 3.14Å; D379-R410 IonicContact OD1-CZ 3.98Å; D379-R410 IonicContact OD1-NE 2.67Å; D379-R410 IonicContact OD1-NH1 3.88Å; D379-R410 PolarHBondContact OD1-NH1 3.44Å; E406-R410 WeakPolarHBondContact O-CB 3.22Å; E406-R410 VanDerWaalsContact O-CD 3.3Å; E406-R410 WeakPolarHBondContact O-CD 3.39Å; E406-R410 VanDerWaalsContact O-CG 3.23Å; E406-R410 WeakPolarHBondContact O-CG 3.38Å; E406-R410 PolarHBondContact O-N 2.84Å; E406-R410 VanDerWaalsContact O-N 3.1Å; E406-R410 IonicContact OE2-CZ 2.73Å; E406-R410 IonicContact OE2-NE 2.75Å; E406-R410 PolarHBondContact OE2-NE 3.34Å; E406-R410 IonicContact OE2-NH2 3.34Å; E406-R410 PolarHBondContact OE2-NH2 3.11Å; V407-R410 CarbonylContact O-C 3.58Å; V407-R410 PolarHBondContact O-N 2.68Å; P408-R410 VanDerWaalsContact C-N 3.29Å; P408-R410 PolarHBondContact O-N 3.33Å; R410-H412 VanDerWaalsContact C-N 3.3Å; R410-H412 PolarHBondContact O-N 2.93Å; R410-H412 VanDerWaalsContact O-N 3.09Å; R410-R413 WeakPolarHBondContact O-CG 3.19Å; R410-R413 PolarHBondContact O-N 3.36Å; R410-M414 HydrophobicContact CB-CG 4.14Å; R410-M414 HydrophobicContact CB-SD 3.85Å; R410-M414 WeakPolarHBondContact O-CG 3.42Å; R410-M414 PolarHBondContact O-N 3.02Å
411	A	95.8	Very high	95.7	Very high	2 Å²	2	44.9 Å²	44.9	2%	0.017	21%	0.209	C	C	.	.	G	3₁₀ helix	trans	-52	-42.8	-166.3	0	0	0	0	0	113.9	V407 R413 M414 L419	V407-A411 WeakPolarHBondContact O-CB 3.31Å; V407-A411 PolarHBondContact O-N 3.47Å; A411-R413 PolarHBondContact O-N 2.89Å; A411-M414 PolarHBondContact O-N 2.98Å; A411-L419 HydrophobicContact CB-CD2 4.1Å
412	H	93.6	Very high	95.8	Very high	117 Å²	117	41.7 Å²	41.7	54%	0.542	20%	0.195	S	C	.	.	G	3₁₀ helix	trans	-58.3	-32.4	179.2	68.5	-93.7	0	0	0	113.7	Q409 R410 R443	Q409-H412 PolarHBondContact O-CE1 3.44Å; Q409-H412 PolarHBondContact O-ND1 3.01Å; R410-H412 VanDerWaalsContact C-N 3.3Å; R410-H412 PolarHBondContact O-N 2.93Å; R410-H412 VanDerWaalsContact O-N 3.09Å; H412-R443 VanDerWaalsContact O-CZ 3.27Å; H412-R443 PolarHBondContact O-NE 3.39Å; H412-R443 PolarHBondContact O-NH2 3.04Å
413	R	92.6	Very high	95.8	Very high	123 Å²	123	41 Å²	41	46%	0.464	19%	0.188	S	C	.	.	G	3₁₀ helix	trans	-100.8	-2.9	-179.3	64	166.9	-174.5	-114	10.5	114.4	V137 D379 R410 A411	V137-R413 WeakPolarHBondContact CG2-O 3.37Å; D379-R413 IonicContact OD2-NE 2.66Å; R410-R413 WeakPolarHBondContact O-CG 3.19Å; R410-R413 PolarHBondContact O-N 3.36Å; A411-R413 PolarHBondContact O-N 2.89Å
414	M	94.3	Very high	95.7	Very high	4 Å²	4	41.3 Å²	41.3	2%	0.02	19%	0.19	C	C	.	.	S	Bend	trans	-82.8	137.6	177.1	-70.9	176.1	76	0	0	111.6	D379 M382 V383 R410 A411 L419 V422	D379-M414 HydrophobicContact CB-CE 4.39Å; D379-M414 HydrophobicContact CB-CG 4.11Å; D379-M414 WeakPolarHBondContact OD2-CG 3.33Å; M382-M414 HydrophobicContact CE-CE 3.94Å; M382-M414 HydrophobicContact CE-SD 4.23Å; V383-M414 HydrophobicContact CG2-CE 4.01Å; R410-M414 HydrophobicContact CB-CG 4.14Å; R410-M414 HydrophobicContact CB-SD 3.85Å; R410-M414 WeakPolarHBondContact O-CG 3.42Å; R410-M414 PolarHBondContact O-N 3.02Å; A411-M414 PolarHBondContact O-N 2.98Å; M414-L419 HydrophobicContact CB-CD2 3.82Å; M414-L419 HydrophobicContact CB-CG 3.97Å; M414-L419 HydrophobicContact SD-CD2 4.14Å; M414-V422 HydrophobicContact CE-CG2 4.04Å
415	G	93.1	Very high	95.5	Very high	9 Å²	9	38 Å²	38	9%	0.093	18%	0.175	C	C	.	.			trans	-74.6	161.1	169.9	0	0	0	0	0	112.8	D136 Q417 G418 L419	D136-G415 WeakPolarHBondContact OD1-CA 3.38Å; G415-Q417 VanDerWaalsContact C-N 3.25Å; G415-Q417 PolarHBondContact O-N 3.35Å; G415-Q417 VanDerWaalsContact O-N 3.11Å; G415-G418 PolarHBondContact O-N 2.92Å; G415-L419 PolarHBondContact O-N 3.12Å
416	V	94.5	Very high	95.4	Very high	0 Å²	0	29.3 Å²	29.3	0%	0	14%	0.143	C	C	.	.	H	α-helix	trans	-61.9	-32	-164.5	71.2	0	0	0	0	113.6	D136 G418 L419 M420 L447 H450 L459	D136-V416 PolarHBondContact OD2-N 2.66Å; V416-G418 VanDerWaalsContact C-N 3.29Å; V416-G418 PolarHBondContact O-N 3.23Å; V416-L419 PolarHBondContact O-N 3.33Å; V416-M420 VanDerWaalsContact O-CB 3.29Å; V416-M420 WeakPolarHBondContact O-CB 3.48Å; V416-M420 PolarHBondContact O-N 2.85Å; V416-L447 HydrophobicContact CB-CB 4.04Å; V416-L447 HydrophobicContact CB-CD1 4.14Å; V416-L447 HydrophobicContact CG2-CB 4.29Å; V416-H450 HydrophobicContact CG1-CB 4.32Å; V416-L459 HydrophobicContact CG2-CD1 4.23Å
417	Q	92.6	Very high	95.3	Very high	89 Å²	89	28.1 Å²	28.1	42%	0.416	14%	0.137	S	C	.	.	H	α-helix	trans	-67.7	-29	179.2	-49.5	-169.6	41.3	0	0	112.6	G415 H421 R452	G415-Q417 VanDerWaalsContact C-N 3.25Å; G415-Q417 PolarHBondContact O-N 3.35Å; G415-Q417 VanDerWaalsContact O-N 3.11Å; Q417-H421 PolarHBondContact O-CD2 2.99Å; Q417-H421 PolarHBondContact O-N 2.98Å; Q417-R452 VanDerWaalsContact CD-CZ 3.48Å; Q417-R452 VanDerWaalsContact CD-NH1 3.35Å
418	G	94.4	Very high	94.9	Very high	15 Å²	15	29.2 Å²	29.2	16%	0.155	15%	0.146	C	C	.	.	H	α-helix	trans	-73	-52.9	174.7	0	0	0	0	0	111.1	G415 V416 M420 H421 V422	G415-G418 PolarHBondContact O-N 2.92Å; V416-G418 VanDerWaalsContact C-N 3.29Å; V416-G418 PolarHBondContact O-N 3.23Å; G418-M420 VanDerWaalsContact C-N 3.32Å; G418-M420 PolarHBondContact O-N 2.73Å; G418-H421 PolarHBondContact O-N 3.12Å; G418-V422 PolarHBondContact O-N 3.37Å
419	L	97.2	Very high	94.5	Very high	0 Å²	0	27.4 Å²	27.4	0%	0	13%	0.134	C	C	.	.	H	α-helix	trans	-55.2	-45.6	177.8	-60.8	170	0	0	0	111.9	A411 M414 G415 V416 H421 V422 T423 I440 R443 V444 L447	A411-L419 HydrophobicContact CB-CD2 4.1Å; M414-L419 HydrophobicContact CB-CD2 3.82Å; M414-L419 HydrophobicContact CB-CG 3.97Å; M414-L419 HydrophobicContact SD-CD2 4.14Å; G415-L419 PolarHBondContact O-N 3.12Å; V416-L419 PolarHBondContact O-N 3.33Å; L419-H421 VanDerWaalsContact C-N 3.33Å; L419-H421 PolarHBondContact O-N 3.49Å; L419-V422 PolarHBondContact O-N 2.98Å; L419-T423 PolarHBondContact O-N 2.89Å; L419-T423 PolarHBondContact O-OG1 3.16Å; L419-I440 HydrophobicContact CB-CG2 4.29Å; L419-I440 HydrophobicContact CD2-CG1 4.02Å; L419-R443 HydrophobicContact CD1-CB 4.15Å; L419-R443 HydrophobicContact CD1-CG 3.75Å; L419-V444 HydrophobicContact CD1-CG2 4.23Å; L419-L447 HydrophobicContact CD1-CD1 3.82Å
420	M	96.8	Very high	94.3	Very high	3 Å²	3	21.9 Å²	21.9	2%	0.015	11%	0.108	C	C	.	.	H	α-helix	trans	-60	-40.4	175	179.5	-80.5	-57.6	0	0	112.3	V416 G418 T423 L424 D455 K458 L459	V416-M420 VanDerWaalsContact O-CB 3.29Å; V416-M420 WeakPolarHBondContact O-CB 3.48Å; V416-M420 PolarHBondContact O-N 2.85Å; G418-M420 VanDerWaalsContact C-N 3.32Å; G418-M420 PolarHBondContact O-N 2.73Å; M420-T423 PolarHBondContact O-N 3.09Å; M420-L424 WeakPolarHBondContact O-CB 3.41Å; M420-L424 WeakPolarHBondContact O-CG 3.3Å; M420-L424 PolarHBondContact O-N 3.36Å; M420-L424 HydrophobicContact SD-CD1 3.38Å; M420-L424 WeakPolarHBondContact SD-CD1 3.23Å; M420-L424 HydrophobicContact SD-CG 3.85Å; M420-D455 WeakPolarHBondContact CE-OD1 3.25Å; M420-D455 HydrophobicContact CG-CB 4.34Å; M420-K458 HydrophobicContact CG-CB 3.92Å; M420-K458 HydrophobicContact SD-CB 3.81Å; M420-K458 HydrophobicContact SD-CG 4.38Å; M420-L459 HydrophobicContact CB-CD1 4.3Å; M420-L459 HydrophobicContact CB-CD2 4.17Å; M420-L459 HydrophobicContact CB-CG 3.95Å; M420-L459 HydrophobicContact CG-CG 4.04Å
421	H	96	Very high	94.2	Very high	37 Å²	37	22.2 Å²	22.2	17%	0.171	11%	0.11	C	C	.	.	H	α-helix	trans	-72.2	-32.5	177.4	-83	-40	0	0	0	114.2	V383 K387 Q417 G418 L419 T425	V383-H421 HydrophobicContact CG1-CB 3.72Å; K387-H421 WeakPolarHBondContact CE-CD2 3.42Å; K387-H421 WeakPolarHBondContact CE-NE2 3.36Å; Q417-H421 PolarHBondContact O-CD2 2.99Å; Q417-H421 PolarHBondContact O-N 2.98Å; G418-H421 PolarHBondContact O-N 3.12Å; L419-H421 VanDerWaalsContact C-N 3.33Å; L419-H421 PolarHBondContact O-N 3.49Å; H421-T425 PolarHBondContact O-N 3.11Å; H421-T425 VanDerWaalsContact O-N 3.14Å; H421-T425 PolarHBondContact O-OG1 3.46Å
422	V	97.7	Very high	94.2	Very high	2 Å²	2	24.9 Å²	24.9	1%	0.012	12%	0.119	C	C	.	.	H	α-helix	trans	-60.6	-54.3	169	177	0	0	0	0	109.4	V383 L386 V407 M414 G418 L419 L424 T425 C426 I436 I440	V383-V422 HydrophobicContact CG2-CG2 4.36Å; L386-V422 HydrophobicContact CD1-CB 4.47Å; L386-V422 HydrophobicContact CD1-CG2 3.82Å; V407-V422 HydrophobicContact CG1-CG1 4.2Å; V407-V422 HydrophobicContact CG2-CG1 3.97Å; V407-V422 HydrophobicContact CG2-CG2 4.32Å; M414-V422 HydrophobicContact CE-CG2 4.04Å; G418-V422 PolarHBondContact O-N 3.37Å; L419-V422 PolarHBondContact O-N 2.98Å; V422-L424 VanDerWaalsContact C-N 3.27Å; V422-L424 PolarHBondContact O-N 2.98Å; V422-T425 PolarHBondContact O-N 2.89Å; V422-C426 PolarHBondContact O-N 2.77Å; V422-C426 PolarHBondContact O-SG 3.39Å; V422-I436 HydrophobicContact CG1-CG2 3.83Å; V422-I440 HydrophobicContact CB-CD1 4.2Å; V422-I440 HydrophobicContact CG1-CD1 3.98Å
423	T	97	Very high	94.3	Very high	0 Å²	0	19.6 Å²	19.6	0%	0	10%	0.095	C	C	.	.	H	α-helix	trans	-58.7	-37.5	-179.6	-37.3	0	0	0	0	112.3	L419 M420 C426 S427 L437 A462 F463	L419-T423 PolarHBondContact O-N 2.89Å; L419-T423 PolarHBondContact O-OG1 3.16Å; M420-T423 PolarHBondContact O-N 3.09Å; T423-C426 PolarHBondContact O-N 3.33Å; T423-S427 PolarHBondContact O-N 2.83Å; T423-S427 PolarHBondContact O-OG 2.96Å; T423-L437 HydrophobicContact CG2-CD2 3.96Å; T423-A462 HydrophobicContact CG2-CB 3.48Å; T423-A462 VanDerWaalsContact CG2-CB 3.48Å; T423-F463 HydrophobicContact CG2-CD2 3.44Å; T423-F463 VanDerWaalsContact CG2-CD2 3.44Å; T423-F463 HydrophobicContact CG2-CE2 3.41Å; T423-F463 VanDerWaalsContact CG2-CE2 3.41Å; T423-F463 HydrophobicContact CG2-CG 4.48Å; T423-F463 HydrophobicContact CG2-CZ 4.44Å
424	L	94.8	Very high	94.4	Very high	10 Å²	10	17.3 Å²	17.3	5%	0.052	9%	0.092	C	C	.	.	H	α-helix	trans	-65.1	-34.9	174.2	-83.6	-173.6	0	0	0	113.3	R390 M420 V422 S427 A428 K458 W461 A462	R390-L424 WeakPolarHBondContact CD-O 3.17Å; M420-L424 WeakPolarHBondContact O-CB 3.41Å; M420-L424 WeakPolarHBondContact O-CG 3.3Å; M420-L424 PolarHBondContact O-N 3.36Å; M420-L424 HydrophobicContact SD-CD1 3.38Å; M420-L424 WeakPolarHBondContact SD-CD1 3.23Å; M420-L424 HydrophobicContact SD-CG 3.85Å; V422-L424 VanDerWaalsContact C-N 3.27Å; V422-L424 PolarHBondContact O-N 2.98Å; L424-S427 WeakPolarHBondContact CA-OG 3.23Å; L424-S427 PolarHBondContact O-OG 3.07Å; L424-A428 WeakPolarHBondContact O-CB 3.39Å; L424-A428 PolarHBondContact O-N 2.83Å; L424-K458 HydrophobicContact CD1-CB 4.16Å; L424-K458 HydrophobicContact CD1-CD 4.19Å; L424-K458 HydrophobicContact CD1-CG 4.26Å; L424-K458 HydrophobicContact CD2-CB 4.07Å; L424-K458 HydrophobicContact CD2-CD 4.05Å; L424-K458 HydrophobicContact CG-CB 4.22Å; L424-W461 HydrophobicContact CD2-CE3 3.8Å; L424-W461 HydrophobicContact CD2-CZ3 3.63Å; L424-A462 HydrophobicContact CD2-CB 4.39Å
425	T	93.4	Very high	94.4	Very high	1 Å²	1	19.7 Å²	19.7	1%	0.006	11%	0.109	C	C	.	.	H	α-helix	trans	-76.3	-36.6	176.4	-65.9	0	0	0	0	111.5	L386 R390 H421 V422 L429	L386-T425 HydrophobicContact CB-CG2 4.37Å; L386-T425 HydrophobicContact CD2-CG2 3.64Å; L386-T425 PolarHBondContact O-OG1 3.02Å; R390-T425 PolarHBondContact NH1-OG1 2.8Å; H421-T425 PolarHBondContact O-N 3.11Å; H421-T425 VanDerWaalsContact O-N 3.14Å; H421-T425 PolarHBondContact O-OG1 3.46Å; V422-T425 PolarHBondContact O-N 2.89Å; T425-L429 HydrophobicContact CG2-CD1 3.6Å; T425-L429 HydrophobicContact CG2-CG 4.09Å; T425-L429 WeakPolarHBondContact O-CB 3.14Å; T425-L429 WeakPolarHBondContact O-CG 3.43Å; T425-L429 PolarHBondContact O-N 3.32Å
426	C	95	Very high	94.6	Very high	6 Å²	6	19.2 Å²	19.2	4%	0.041	11%	0.105	C	C	.	.	H	α-helix	trans	-54.7	-54.9	167.4	-64.3	0	0	0	0	111.4	V422 T423 A428 H430 Y431 L466	V422-C426 PolarHBondContact O-N 2.77Å; V422-C426 PolarHBondContact O-SG 3.39Å; T423-C426 PolarHBondContact O-N 3.33Å; C426-A428 PolarHBondContact O-N 3.07Å; C426-H430 CarbonylContact O-C 3.29Å; C426-H430 WeakPolarHBondContact O-CA 3.26Å; C426-H430 PolarHBondContact O-N 3.4Å; C426-Y431 CarbonylContact C-O 3.56Å; C426-Y431 WeakPolarHBondContact CA-O 3.48Å; C426-Y431 VanDerWaalsContact CB-O 3.27Å; C426-Y431 WeakPolarHBondContact CB-O 3.4Å; C426-Y431 PolarHBondContact O-N 2.76Å; C426-L466 HydrophobicContact CB-CD1 3.77Å
427	S	93.9	Very high	94.8	Very high	0 Å²	0	19.2 Å²	19.2	0%	0	11%	0.105	C	C	.	.	H	α-helix	trans	-70.1	-29.3	-176.7	50.4	0	0	0	0	114.8	S97 T423 L424 W461 A462	S97-S427 PolarHBondContact OG-O 3.29Å; T423-S427 PolarHBondContact O-N 2.83Å; T423-S427 PolarHBondContact O-OG 2.96Å; L424-S427 WeakPolarHBondContact CA-OG 3.23Å; L424-S427 PolarHBondContact O-OG 3.07Å; S427-W461 WeakPolarHBondContact OG-CZ3 3.47Å; S427-A462 WeakPolarHBondContact OG-CB 3.35Å
428	A	90.6	Very high	95	Very high	23 Å²	23	16.8 Å²	16.8	19%	0.19	10%	0.096	C	C	.	.	H	α-helix	trans	-82.3	-34.4	177.3	0	0	0	0	0	113.6	R390 L424 C426 H430	R390-A428 VanDerWaalsContact CD-CB 3.41Å; R390-A428 HydrophobicContact CG-CB 3.62Å; L424-A428 WeakPolarHBondContact O-CB 3.39Å; L424-A428 PolarHBondContact O-N 2.83Å; C426-A428 PolarHBondContact O-N 3.07Å; A428-H430 PolarHBondContact O-CD2 3.07Å; A428-H430 PolarHBondContact O-N 3Å
429	L	89	Confident	95.2	Very high	6 Å²	6	16.7 Å²	16.7	3%	0.031	9%	0.093	C	C	.	.	T	Hydrogen-bonded Turn	trans	-84.7	7.3	170.7	-60	179.7	0	0	0	112.2	L400 T425 Y431 I750	L400-L429 HydrophobicContact CD1-CD1 4.35Å; L400-L429 HydrophobicContact CD2-CD1 4.23Å; T425-L429 HydrophobicContact CG2-CD1 3.6Å; T425-L429 HydrophobicContact CG2-CG 4.09Å; T425-L429 WeakPolarHBondContact O-CB 3.14Å; T425-L429 WeakPolarHBondContact O-CG 3.43Å; T425-L429 PolarHBondContact O-N 3.32Å; L429-Y431 PolarHBondContact O-N 3.35Å; L429-I750 WeakPolarHBondContact O-CD1 3.47Å
430	H	92.8	Very high	95.2	Very high	3 Å²	3	16.7 Å²	16.7	1%	0.014	9%	0.093	C	C	.	.	T	Hydrogen-bonded Turn	trans	53.4	25.1	-176.7	-48.6	176.3	0	0	0	113.3	S95 C426 A428 N746 Y748 C749 I750 L756	S95-H430 PolarHBondContact OG-CE1 3.06Å; S95-H430 PolarHBondContact OG-NE2 3.12Å; S95-H430 VanDerWaalsContact OG-NE2 3.11Å; C426-H430 CarbonylContact O-C 3.29Å; C426-H430 WeakPolarHBondContact O-CA 3.26Å; C426-H430 PolarHBondContact O-N 3.4Å; A428-H430 PolarHBondContact O-CD2 3.07Å; A428-H430 PolarHBondContact O-N 3Å; H430-N746 PolarHBondContact CE1-O 3.42Å; H430-N746 VanDerWaalsContact CE1-O 3.23Å; H430-Y748 WeakPolarHBondContact CB-O 3.33Å; H430-Y748 PolarHBondContact ND1-O 3.08Å; H430-C749 CarbonylContact O-C 3.5Å; H430-C749 WeakPolarHBondContact O-CA 3.36Å; H430-I750 HydrophobicContact CB-CG1 4.31Å; H430-I750 PolarHBondContact O-N 3.35Å; H430-L756 HydrophobicContact CB-CD2 4.23Å
431	Y	93.8	Very high	95.2	Very high	16 Å²	16	16.5 Å²	16.5	6%	0.063	9%	0.092	C	C	.	.			trans	-92.6	110.7	-177.7	-178.3	-112.6	0	0	0	109.7	F395 L400 E404 C426 L429 I436	F395-Y431 HydrophobicContact CE2-CD2 4.37Å; L400-Y431 HydrophobicContact CB-CD1 4.09Å; L400-Y431 HydrophobicContact CB-CE1 3.72Å; L400-Y431 HydrophobicContact CB-CE2 4.23Å; L400-Y431 HydrophobicContact CB-CG 4.45Å; L400-Y431 HydrophobicContact CD1-CD1 4.32Å; L400-Y431 HydrophobicContact CD1-CD2 4.22Å; L400-Y431 HydrophobicContact CD1-CG 4.02Å; L400-Y431 HydrophobicContact CD2-CD1 3.87Å; L400-Y431 HydrophobicContact CD2-CE1 4.24Å; L400-Y431 HydrophobicContact CD2-CG 4.33Å; L400-Y431 HydrophobicContact CG-CD1 4.31Å; L400-Y431 HydrophobicContact CG-CE1 4.43Å; E404-Y431 HydrophobicContact CG-CE1 4.25Å; E404-Y431 WeakPolarHBondContact CG-OH 3.47Å; E404-Y431 PolarHBondContact OE1-OH 2.92Å; E404-Y431 PolarHBondContact OE2-OH 2.92Å; C426-Y431 CarbonylContact C-O 3.56Å; C426-Y431 WeakPolarHBondContact CA-O 3.48Å; C426-Y431 VanDerWaalsContact CB-O 3.27Å; C426-Y431 WeakPolarHBondContact CB-O 3.4Å; C426-Y431 PolarHBondContact O-N 2.76Å; L429-Y431 PolarHBondContact O-N 3.35Å; Y431-I436 HydrophobicContact CE1-CD1 4.44Å
432	R	94.8	Very high	95.2	Very high	59 Å²	59	19.6 Å²	19.6	22%	0.223	11%	0.107	C	C	.	.			trans	-96.5	126.1	174.2	-177.5	-178.2	168.8	135	-1.7	109.3	D434 L437 L466 G467 F468 C749 Q754	R432-D434 IonicContact CZ-OD1 2.73Å; R432-D434 IonicContact CZ-OD2 2.73Å; R432-D434 IonicContact NE-OD1 2.69Å; R432-D434 PolarHBondContact NE-OD1 2.77Å; R432-D434 IonicContact NE-OD2 3.13Å; R432-D434 IonicContact NH2-OD1 2.71Å; R432-D434 PolarHBondContact NH2-OD1 3.2Å; R432-D434 IonicContact NH2-OD2 3.37Å; R432-D434 PolarHBondContact NH2-OD2 3.28Å; R432-L437 HydrophobicContact CG-CD1 3.96Å; R432-L466 HydrophobicContact CB-CD2 4.21Å; R432-L466 PolarHBondContact NH1-O 3.15Å; R432-G467 PolarHBondContact NH1-O 3.44Å; R432-G467 VanDerWaalsContact NH1-O 3.15Å; R432-F468 VanDerWaalsContact NH2-CD2 3.32Å; R432-C749 HydrophobicContact CB-CB 4.34Å; R432-Q754 VanDerWaalsContact NH1-CD 3.3Å
433	S	95.2	Very high	95.1	Very high	5 Å²	5	22.8 Å²	22.8	4%	0.035	12%	0.118	C	C	.	.			trans	-136.1	119.5	169.5	176.1	0	0	0	0	109	E404 S435 I436 L437	E404-S433 WeakPolarHBondContact CG-OG 3.36Å; E404-S433 WeakPolarHBondContact OE1-CB 3.36Å; E404-S433 PolarHBondContact OE1-OG 3.48Å; S433-S435 VanDerWaalsContact C-N 3.33Å; S433-S435 PolarHBondContact O-N 3.11Å; S433-S435 PolarHBondContact OG-OG 3.08Å; S433-I436 PolarHBondContact O-N 2.73Å; S433-L437 VanDerWaalsContact O-CG 3.3Å; S433-L437 WeakPolarHBondContact O-CG 3.26Å; S433-L437 PolarHBondContact O-N 3.11Å
434	D	94.8	Very high	95	Very high	76 Å²	76	22.8 Å²	22.8	41%	0.406	12%	0.118	S	C	.	.	H	α-helix	trans	-75.5	-23.8	-170.2	-74.5	35.5	0	0	0	112.1	R432 T438 F468	R432-D434 IonicContact CZ-OD1 2.73Å; R432-D434 IonicContact CZ-OD2 2.73Å; R432-D434 IonicContact NE-OD1 2.69Å; R432-D434 PolarHBondContact NE-OD1 2.77Å; R432-D434 IonicContact NE-OD2 3.13Å; R432-D434 IonicContact NH2-OD1 2.71Å; R432-D434 PolarHBondContact NH2-OD1 3.2Å; R432-D434 IonicContact NH2-OD2 3.37Å; R432-D434 PolarHBondContact NH2-OD2 3.28Å; D434-T438 WeakPolarHBondContact O-CB 3.19Å; D434-T438 PolarHBondContact O-N 3.09Å; D434-T438 PolarHBondContact O-OG1 3.11Å; D434-F468 HydrophobicContact CB-CE2 3.96Å
435	S	95.8	Very high	95.1	Very high	53 Å²	53	23.9 Å²	23.9	37%	0.371	13%	0.126	S	C	.	.	H	α-helix	trans	-69.1	-44.6	172	60	0	0	0	0	111.9	S433 S439	S433-S435 VanDerWaalsContact C-N 3.33Å; S433-S435 PolarHBondContact O-N 3.11Å; S433-S435 PolarHBondContact OG-OG 3.08Å; S435-S439 WeakPolarHBondContact O-CB 3.49Å; S435-S439 PolarHBondContact O-N 3.2Å; S435-S439 VanDerWaalsContact O-N 3.14Å; S435-S439 PolarHBondContact O-OG 3.24Å
436	I	97.7	Very high	95.1	Very high	0 Å²	0	26.9 Å²	26.9	0%	0	15%	0.147	C	C	.	.	H	α-helix	trans	-60.8	-49.4	174.3	-62.2	-176.2	0	0	0	109.8	M403 E404 V407 V422 Y431 S433 S439 I440	M403-I436 HydrophobicContact CB-CD1 4.02Å; E404-I436 HydrophobicContact CG-CD1 4.19Å; V407-I436 HydrophobicContact CB-CG1 4.38Å; V407-I436 HydrophobicContact CG1-CG2 4.14Å; V422-I436 HydrophobicContact CG1-CG2 3.83Å; Y431-I436 HydrophobicContact CE1-CD1 4.44Å; S433-I436 PolarHBondContact O-N 2.73Å; I436-S439 PolarHBondContact O-OG 3.17Å; I436-I440 HydrophobicContact CG2-CD1 3.72Å; I436-I440 WeakPolarHBondContact O-CB 3.5Å; I436-I440 WeakPolarHBondContact O-CD1 3.28Å; I436-I440 WeakPolarHBondContact O-CG1 3.3Å; I436-I440 PolarHBondContact O-N 3.38Å; I436-I440 VanDerWaalsContact O-N 3.13Å
437	L	97.6	Very high	95	Very high	0 Å²	0	26.9 Å²	26.9	0%	0	15%	0.147	C	C	.	.	H	α-helix	trans	-71.5	-34.4	-174.9	-66.1	167.6	0	0	0	112.7	T423 R432 S433 A441 F463 L466 F468	T423-L437 HydrophobicContact CG2-CD2 3.96Å; R432-L437 HydrophobicContact CG-CD1 3.96Å; S433-L437 VanDerWaalsContact O-CG 3.3Å; S433-L437 WeakPolarHBondContact O-CG 3.26Å; S433-L437 PolarHBondContact O-N 3.11Å; L437-A441 VanDerWaalsContact O-CB 3.27Å; L437-A441 WeakPolarHBondContact O-CB 3.43Å; L437-A441 PolarHBondContact O-N 3.25Å; L437-F463 HydrophobicContact CB-CE1 3.98Å; L437-F463 HydrophobicContact CB-CZ 4.31Å; L437-F463 HydrophobicContact CD2-CD1 4.33Å; L437-F463 HydrophobicContact CD2-CD2 4.48Å; L437-F463 HydrophobicContact CD2-CE1 3.99Å; L437-F463 HydrophobicContact CD2-CE2 4.15Å; L437-F463 HydrophobicContact CD2-CZ 3.89Å; L437-F463 WeakPolarHBondContact O-CE1 3.35Å; L437-F463 WeakPolarHBondContact O-CZ 3.48Å; L437-L466 HydrophobicContact CD1-CB 4.44Å; L437-L466 HydrophobicContact CD1-CD1 4.02Å; L437-L466 HydrophobicContact CD2-CD1 4.09Å; L437-F468 HydrophobicContact CB-CD1 4Å; L437-F468 HydrophobicContact CB-CD2 3.64Å; L437-F468 HydrophobicContact CB-CE1 3.92Å; L437-F468 HydrophobicContact CB-CE2 3.62Å; L437-F468 HydrophobicContact CB-CG 3.85Å; L437-F468 HydrophobicContact CB-CZ 3.76Å; L437-F468 HydrophobicContact CD1-CB 3.98Å; L437-F468 HydrophobicContact CD1-CD2 3.47Å; L437-F468 VanDerWaalsContact CD1-CD2 3.47Å; L437-F468 HydrophobicContact CD1-CE2 4.16Å; L437-F468 HydrophobicContact CD1-CG 3.83Å; L437-F468 HydrophobicContact CG-CD2 4.18Å; L437-F468 HydrophobicContact CG-CG 4.38Å
438	T	97.4	Very high	95.1	Very high	38 Å²	38	27.6 Å²	27.6	23%	0.233	15%	0.151	C	C	.	.	H	α-helix	trans	-67.3	-51.6	175.4	-55.8	0	0	0	0	111.4	D434 I440 A441 E442	D434-T438 WeakPolarHBondContact O-CB 3.19Å; D434-T438 PolarHBondContact O-N 3.09Å; D434-T438 PolarHBondContact O-OG1 3.11Å; T438-I440 VanDerWaalsContact C-N 3.27Å; T438-I440 PolarHBondContact O-N 3.21Å; T438-A441 CarbonylContact O-C 3.58Å; T438-A441 WeakPolarHBondContact O-CA 3.41Å; T438-A441 PolarHBondContact O-N 3.37Å; T438-E442 WeakPolarHBondContact O-CG 3.12Å; T438-E442 PolarHBondContact O-N 3.15Å
439	S	97.3	Very high	95.1	Very high	12 Å²	12	29.9 Å²	29.9	8%	0.084	16%	0.164	C	C	.	.	H	α-helix	trans	-63.2	-30.9	-179.5	55.7	0	0	0	0	113.5	S435 I436 R443	S435-S439 WeakPolarHBondContact O-CB 3.49Å; S435-S439 PolarHBondContact O-N 3.2Å; S435-S439 VanDerWaalsContact O-N 3.14Å; S435-S439 PolarHBondContact O-OG 3.24Å; I436-S439 PolarHBondContact O-OG 3.17Å; S439-R443 PolarHBondContact O-N 3.35Å
440	I	97.6	Very high	95.2	Very high	0 Å²	0	31.7 Å²	31.7	0%	0	17%	0.172	C	C	.	.	H	α-helix	trans	-69.9	-42.8	169.4	-66.9	170.3	0	0	0	111.1	V407 L419 V422 I436 T438 E442 R443 V444 L459 F463	V407-I440 HydrophobicContact CG1-CD1 4.43Å; V407-I440 HydrophobicContact CG1-CG1 4.45Å; L419-I440 HydrophobicContact CB-CG2 4.29Å; L419-I440 HydrophobicContact CD2-CG1 4.02Å; V422-I440 HydrophobicContact CB-CD1 4.2Å; V422-I440 HydrophobicContact CG1-CD1 3.98Å; I436-I440 HydrophobicContact CG2-CD1 3.72Å; I436-I440 WeakPolarHBondContact O-CB 3.5Å; I436-I440 WeakPolarHBondContact O-CD1 3.28Å; I436-I440 WeakPolarHBondContact O-CG1 3.3Å; I436-I440 PolarHBondContact O-N 3.38Å; I436-I440 VanDerWaalsContact O-N 3.13Å; T438-I440 VanDerWaalsContact C-N 3.27Å; T438-I440 PolarHBondContact O-N 3.21Å; I440-E442 VanDerWaalsContact C-N 3.34Å; I440-E442 PolarHBondContact O-N 3.17Å; I440-R443 PolarHBondContact O-N 3.1Å; I440-V444 HydrophobicContact CG2-CG2 3.81Å; I440-V444 WeakPolarHBondContact O-CB 3.49Å; I440-V444 VanDerWaalsContact O-CG2 3.26Å; I440-V444 WeakPolarHBondContact O-CG2 3.31Å; I440-V444 PolarHBondContact O-N 3.25Å; I440-L459 HydrophobicContact CG2-CD2 4.3Å; I440-F463 HydrophobicContact CB-CE2 4.5Å; I440-F463 HydrophobicContact CB-CZ 4.08Å; I440-F463 HydrophobicContact CG2-CE2 3.78Å; I440-F463 HydrophobicContact CG2-CZ 3.79Å
441	A	97.6	Very high	95.2	Very high	0 Å²	0	31.8 Å²	31.8	0%	0	17%	0.173	C	C	.	.	H	α-helix	trans	-67.5	-30.3	-179.4	0	0	0	0	0	113.7	L437 T438 P445 F463 P470 N473 F476	L437-A441 VanDerWaalsContact O-CB 3.27Å; L437-A441 WeakPolarHBondContact O-CB 3.43Å; L437-A441 PolarHBondContact O-N 3.25Å; T438-A441 CarbonylContact O-C 3.58Å; T438-A441 WeakPolarHBondContact O-CA 3.41Å; T438-A441 PolarHBondContact O-N 3.37Å; A441-P445 WeakPolarHBondContact O-CD 3.17Å; A441-P445 WeakPolarHBondContact O-CG 3.23Å; A441-F463 HydrophobicContact CB-CE1 4Å; A441-F463 HydrophobicContact CB-CZ 4.22Å; A441-P470 HydrophobicContact CB-CB 3.74Å; A441-P470 HydrophobicContact CB-CG 4.16Å; A441-N473 HydrophobicContact CB-CB 4.24Å; A441-F476 HydrophobicContact CB-CD2 3.93Å; A441-F476 HydrophobicContact CB-CE2 4.41Å; A441-F476 HydrophobicContact CB-CG 4.28Å
442	E	95.9	Very high	95.2	Very high	102 Å²	102	34.5 Å²	34.5	48%	0.477	18%	0.183	S	C	.	.	H	α-helix	trans	-65	-46.8	170.7	-70.8	166.4	175.2	0	0	111.7	T438 I440 N473	T438-E442 WeakPolarHBondContact O-CG 3.12Å; T438-E442 PolarHBondContact O-N 3.15Å; I440-E442 VanDerWaalsContact C-N 3.34Å; I440-E442 PolarHBondContact O-N 3.17Å; E442-N473 WeakPolarHBondContact CG-ND2 3.44Å
443	R	94.9	Very high	95.1	Very high	68 Å²	68	31.8 Å²	31.8	26%	0.257	17%	0.173	S	C	.	.	H	α-helix	trans	-76.9	-44.2	-173.9	-175.9	55.6	161.8	134.7	-8.4	113.2	H412 L419 S439 I440 S446 L447	H412-R443 VanDerWaalsContact O-CZ 3.27Å; H412-R443 PolarHBondContact O-NE 3.39Å; H412-R443 PolarHBondContact O-NH2 3.04Å; L419-R443 HydrophobicContact CD1-CB 4.15Å; L419-R443 HydrophobicContact CD1-CG 3.75Å; S439-R443 PolarHBondContact O-N 3.35Å; I440-R443 PolarHBondContact O-N 3.1Å; R443-S446 PolarHBondContact NH1-OG 2.94Å; R443-S446 PolarHBondContact O-N 2.99Å; R443-S446 VanDerWaalsContact O-N 3.12Å; R443-S446 PolarHBondContact O-OG 3.01Å; R443-L447 HydrophobicContact CG-CD1 3.87Å; R443-L447 HydrophobicContact CG-CG 4.44Å
444	V	96.1	Very high	95.1	Very high	0 Å²	0	34.1 Å²	34.1	0%	0	18%	0.183	C	C	.	.	G	3₁₀ helix	trans	-53.9	-43.4	-168.6	160.2	0	0	0	0	114.7	L419 I440 S446 L447 V448 L459 F476 L480	L419-V444 HydrophobicContact CD1-CG2 4.23Å; I440-V444 HydrophobicContact CG2-CG2 3.81Å; I440-V444 WeakPolarHBondContact O-CB 3.49Å; I440-V444 VanDerWaalsContact O-CG2 3.26Å; I440-V444 WeakPolarHBondContact O-CG2 3.31Å; I440-V444 PolarHBondContact O-N 3.25Å; V444-S446 PolarHBondContact O-N 3.33Å; V444-S446 VanDerWaalsContact O-N 3.12Å; V444-L447 CarbonylContact O-C 3.55Å; V444-L447 WeakPolarHBondContact O-CA 3.24Å; V444-L447 PolarHBondContact O-N 3.14Å; V444-V448 PolarHBondContact O-N 3.46Å; V444-L459 HydrophobicContact CG1-CD1 4.01Å; V444-L459 HydrophobicContact CG2-CD1 4.07Å; V444-L459 HydrophobicContact CG2-CD2 4.26Å; V444-F476 HydrophobicContact CB-CD2 4.07Å; V444-F476 HydrophobicContact CB-CE2 3.78Å; V444-F476 HydrophobicContact CG1-CD2 3.98Å; V444-F476 HydrophobicContact CG1-CE2 3.65Å; V444-F476 HydrophobicContact CG2-CE2 4.19Å; V444-L480 HydrophobicContact CG1-CD1 4.15Å; V444-L480 HydrophobicContact CG1-CD2 3.73Å; V444-L480 HydrophobicContact CG1-CG 4.09Å
445	P	95.5	Very high	95.1	Very high	33 Å²	33	30.5 Å²	30.5	21%	0.214	16%	0.163	C	C	.	.	G	3₁₀ helix	trans	-54	-34.3	178.9	-29.5	36.8	0	0	0	113.9	A441 L447	A441-P445 WeakPolarHBondContact O-CD 3.17Å; A441-P445 WeakPolarHBondContact O-CG 3.23Å; P445-L447 VanDerWaalsContact C-N 3.29Å; P445-L447 PolarHBondContact O-N 2.83Å
446	S	93.3	Very high	95.2	Very high	65 Å²	65	28 Å²	28	46%	0.455	15%	0.146	S	C	.	.	G	3₁₀ helix	trans	-74.4	-14.9	177.2	70.2	0	0	0	0	114.6	R443 V444	R443-S446 PolarHBondContact NH1-OG 2.94Å; R443-S446 PolarHBondContact O-N 2.99Å; R443-S446 VanDerWaalsContact O-N 3.12Å; R443-S446 PolarHBondContact O-OG 3.01Å; V444-S446 PolarHBondContact O-N 3.33Å; V444-S446 VanDerWaalsContact O-N 3.12Å
447	L	94.3	Very high	95.2	Very high	6 Å²	6	28 Å²	28	3%	0.031	15%	0.146	C	C	.	.	G	3₁₀ helix	trans	-108.8	3.7	-179.2	-59.5	177.3	0	0	0	113.1	V416 L419 R443 V444 P445 P449 H450 C451	V416-L447 HydrophobicContact CB-CB 4.04Å; V416-L447 HydrophobicContact CB-CD1 4.14Å; V416-L447 HydrophobicContact CG2-CB 4.29Å; L419-L447 HydrophobicContact CD1-CD1 3.82Å; R443-L447 HydrophobicContact CG-CD1 3.87Å; R443-L447 HydrophobicContact CG-CG 4.44Å; V444-L447 CarbonylContact O-C 3.55Å; V444-L447 WeakPolarHBondContact O-CA 3.24Å; V444-L447 PolarHBondContact O-N 3.14Å; P445-L447 VanDerWaalsContact C-N 3.29Å; P445-L447 PolarHBondContact O-N 2.83Å; L447-P449 VanDerWaalsContact C-N 3.32Å; L447-H450 WeakPolarHBondContact O-CA 3.29Å; L447-H450 WeakPolarHBondContact O-CB 3.5Å; L447-H450 PolarHBondContact O-N 2.9Å; L447-C451 PolarHBondContact O-N 3.13Å
448	V	94.2	Very high	95.1	Very high	15 Å²	15	28.8 Å²	28.8	9%	0.091	15%	0.149	C	C	.	.	G	3₁₀ helix	trans	-52.9	-36	177.5	162.5	0	0	0	0	114.7	V444 H450 C451 L480 A483 R487	V444-V448 PolarHBondContact O-N 3.46Å; V448-H450 PolarHBondContact O-N 3.48Å; V448-C451 PolarHBondContact O-N 2.98Å; V448-L480 HydrophobicContact CG2-CD2 4.15Å; V448-A483 HydrophobicContact CG1-CB 3.79Å; V448-R487 PolarHBondContact O-NH2 3.5Å
449	P	92	Very high	95.1	Very high	71 Å²	71	27 Å²	27	46%	0.461	14%	0.138	S	C	.	.	G	3₁₀ helix	trans	-58.8	-30.7	171.8	-27.6	37.7	0	0	0	113.8	V133 L447 R487	V133-P449 HydrophobicContact CG1-CB 3.73Å; V133-P449 HydrophobicContact CG1-CG 4.45Å; V133-P449 HydrophobicContact CG2-CB 4.35Å; L447-P449 VanDerWaalsContact C-N 3.32Å; P449-R487 PolarHBondContact O-NH2 3.13Å
450	H	90.6	Very high	95.2	Very high	44 Å²	44	26.4 Å²	26.4	20%	0.204	13%	0.134	C	C	.	.	G	3₁₀ helix	trans	-91.7	-13.2	-174.9	-50	94	0	0	0	114.6	V133 T134 D136 V416 L447 V448	V133-H450 WeakPolarHBondContact CG1-NE2 3.5Å; T134-H450 PolarHBondContact O-CE1 2.9Å; T134-H450 PolarHBondContact O-NE2 3.38Å; D136-H450 HydrophobicContact CB-CB 3.98Å; D136-H450 PolarHBondContact N-CD2 3.15Å; V416-H450 HydrophobicContact CG1-CB 4.32Å; L447-H450 WeakPolarHBondContact O-CA 3.29Å; L447-H450 WeakPolarHBondContact O-CB 3.5Å; L447-H450 PolarHBondContact O-N 2.9Å; V448-H450 PolarHBondContact O-N 3.48Å
451	C	92.9	Very high	95.2	Very high	5 Å²	5	27 Å²	27	3%	0.034	14%	0.137	C	C	.	.			trans	-52.9	143.9	171.3	-69.9	0	0	0	0	111.1	L447 V448 D455 S456 R487	L447-C451 PolarHBondContact O-N 3.13Å; V448-C451 PolarHBondContact O-N 2.98Å; C451-D455 HydrophobicContact CB-CB 4.41Å; C451-S456 VanDerWaalsContact CB-OG 3.28Å; C451-S456 WeakPolarHBondContact CB-OG 3.04Å; C451-S456 PolarHBondContact SG-OG 2.82Å; C451-S456 VanDerWaalsContact SG-OG 3.42Å; C451-R487 PolarHBondContact O-NE 3.16Å; C451-R487 PolarHBondContact O-NH2 3.21Å
452	R	92.9	Very high	95.2	Very high	73 Å²	73	27 Å²	27	28%	0.275	14%	0.137	S	C	.	.			trans	-85.9	163.5	151.3	-58.1	161	-64.6	-148.3	-1.5	108	Q417 K454 D455 S456	Q417-R452 VanDerWaalsContact CD-CZ 3.48Å; Q417-R452 VanDerWaalsContact CD-NH1 3.35Å; R452-K454 HydrophobicContact CB-CB 4.48Å; R452-K454 PolarHBondContact O-N 2.73Å; R452-K454 VanDerWaalsContact O-N 3.12Å; R452-D455 VanDerWaalsContact CB-OD2 3.28Å; R452-D455 WeakPolarHBondContact CB-OD2 3.46Å; R452-D455 IonicContact CZ-OD1 2.85Å; R452-D455 IonicContact CZ-OD2 3.23Å; R452-D455 PolarHBondContact N-OD2 3.16Å; R452-D455 IonicContact NE-OD1 2.67Å; R452-D455 IonicContact NE-OD2 3.26Å; R452-D455 PolarHBondContact NE-OD2 3.31Å; R452-D455 IonicContact NH2-OD1 2.71Å; R452-D455 PolarHBondContact NH2-OD1 3.35Å; R452-D455 IonicContact NH2-OD2 3.59Å; R452-D455 PolarHBondContact NH2-OD2 3.02Å; R452-D455 PolarHBondContact O-N 3.35Å; R452-S456 PolarHBondContact O-N 3.38Å
453	S	94.1	Very high	95.3	Very high	1 Å²	1	22.2 Å²	22.2	1%	0.007	11%	0.114	C	C	.	.	H	α-helix	trans	-48.2	-41.7	171.2	52	0	0	0	0	112.4	D455 S457 E490 H497	S453-D455 VanDerWaalsContact C-N 3.35Å; S453-D455 PolarHBondContact O-N 2.76Å; S453-S457 WeakPolarHBondContact O-CB 3.47Å; S453-S457 PolarHBondContact O-N 3.11Å; S453-S457 VanDerWaalsContact O-N 3.08Å; S453-S457 PolarHBondContact O-OG 3.21Å; S453-S457 VanDerWaalsContact O-OG 3.13Å; S453-E490 WeakPolarHBondContact CB-OE2 3.36Å; S453-E490 PolarHBondContact N-OE2 3.21Å; S453-E490 PolarHBondContact OG-OE2 2.82Å; S453-H497 PolarHBondContact OG-ND1 3.06Å
454	K	93.9	Very high	95.4	Very high	55 Å²	55	19 Å²	19	24%	0.239	10%	0.102	C	C	.	.	H	α-helix	trans	-50.8	-48.6	172.9	-169.7	169.2	63.3	-173.4	0	113.4	R452 K458 H497	R452-K454 HydrophobicContact CB-CB 4.48Å; R452-K454 PolarHBondContact O-N 2.73Å; R452-K454 VanDerWaalsContact O-N 3.12Å; K454-K458 HydrophobicContact CG-CG 4.25Å; K454-K458 WeakPolarHBondContact O-CB 3.36Å; K454-K458 WeakPolarHBondContact O-CG 3.42Å; K454-K458 PolarHBondContact O-N 2.9Å; K454-H497 VanDerWaalsContact CB-CE1 3.49Å; K454-H497 WeakPolarHBondContact CB-CE1 3.26Å; K454-H497 WeakPolarHBondContact CB-NE2 3.17Å; K454-H497 PolarHBondContact N-ND1 3.44Å
455	D	95.6	Very high	95.4	Very high	0 Å²	0	19.2 Å²	19.2	0%	0	10%	0.103	C	C	.	.	H	α-helix	trans	-72.7	-44.4	-168.4	-52.6	-52.1	0	0	0	110.1	M420 C451 R452 S453 K458 L459	M420-D455 WeakPolarHBondContact CE-OD1 3.25Å; M420-D455 HydrophobicContact CG-CB 4.34Å; C451-D455 HydrophobicContact CB-CB 4.41Å; R452-D455 VanDerWaalsContact CB-OD2 3.28Å; R452-D455 WeakPolarHBondContact CB-OD2 3.46Å; R452-D455 IonicContact CZ-OD1 2.85Å; R452-D455 IonicContact CZ-OD2 3.23Å; R452-D455 PolarHBondContact N-OD2 3.16Å; R452-D455 IonicContact NE-OD1 2.67Å; R452-D455 IonicContact NE-OD2 3.26Å; R452-D455 PolarHBondContact NE-OD2 3.31Å; R452-D455 IonicContact NH2-OD1 2.71Å; R452-D455 PolarHBondContact NH2-OD1 3.35Å; R452-D455 IonicContact NH2-OD2 3.59Å; R452-D455 PolarHBondContact NH2-OD2 3.02Å; R452-D455 PolarHBondContact O-N 3.35Å; S453-D455 VanDerWaalsContact C-N 3.35Å; S453-D455 PolarHBondContact O-N 2.76Å; D455-K458 PolarHBondContact O-N 3.31Å; D455-L459 WeakPolarHBondContact O-CB 3.21Å; D455-L459 WeakPolarHBondContact O-CG 2.96Å; D455-L459 PolarHBondContact O-N 2.71Å
456	S	97.6	Very high	95.4	Very high	0 Å²	0	17.7 Å²	17.7	0%	0	9%	0.093	C	C	.	.	H	α-helix	trans	-59.4	-47.9	173.6	-63.1	0	0	0	0	112.2	C451 R452 K458 L459 L460 A483	C451-S456 VanDerWaalsContact CB-OG 3.28Å; C451-S456 WeakPolarHBondContact CB-OG 3.04Å; C451-S456 PolarHBondContact SG-OG 2.82Å; C451-S456 VanDerWaalsContact SG-OG 3.42Å; R452-S456 PolarHBondContact O-N 3.38Å; S456-K458 PolarHBondContact O-N 3.25Å; S456-L459 PolarHBondContact O-N 2.69Å; S456-L460 WeakPolarHBondContact O-CB 3.45Å; S456-L460 WeakPolarHBondContact O-CG 3.45Å; S456-L460 PolarHBondContact O-N 3.17Å; S456-A483 WeakPolarHBondContact OG-CB 3.47Å
457	S	97.4	Very high	95.5	Very high	0 Å²	0	15.8 Å²	15.8	0%	0	8%	0.084	C	C	.	.	H	α-helix	trans	-63.7	-39.9	179.4	-65.6	0	0	0	0	113	S453 W461 L484 H497 T500	S453-S457 WeakPolarHBondContact O-CB 3.47Å; S453-S457 PolarHBondContact O-N 3.11Å; S453-S457 VanDerWaalsContact O-N 3.08Å; S453-S457 PolarHBondContact O-OG 3.21Å; S453-S457 VanDerWaalsContact O-OG 3.13Å; S457-W461 WeakPolarHBondContact O-CB 3.43Å; S457-W461 PolarHBondContact O-N 3.17Å; S457-L484 VanDerWaalsContact OG-CD2 3.3Å; S457-L484 WeakPolarHBondContact OG-CD2 3.32Å; S457-H497 WeakPolarHBondContact CB-O 3.3Å; S457-H497 PolarHBondContact OG-O 2.86Å; S457-T500 WeakPolarHBondContact O-CG2 3.49Å
458	K	96.1	Very high	95.6	Very high	17 Å²	17	15.9 Å²	15.9	7%	0.074	9%	0.085	C	C	.	.	H	α-helix	trans	-70.6	-36.1	178.2	-67.9	-69.4	-178.8	-178.3	0	111.8	L102 M420 L424 K454 D455 S456 A462 T500	L102-K458 PolarHBondContact O-NZ 2.72Å; M420-K458 HydrophobicContact CG-CB 3.92Å; M420-K458 HydrophobicContact SD-CB 3.81Å; M420-K458 HydrophobicContact SD-CG 4.38Å; L424-K458 HydrophobicContact CD1-CB 4.16Å; L424-K458 HydrophobicContact CD1-CD 4.19Å; L424-K458 HydrophobicContact CD1-CG 4.26Å; L424-K458 HydrophobicContact CD2-CB 4.07Å; L424-K458 HydrophobicContact CD2-CD 4.05Å; L424-K458 HydrophobicContact CG-CB 4.22Å; K454-K458 HydrophobicContact CG-CG 4.25Å; K454-K458 WeakPolarHBondContact O-CB 3.36Å; K454-K458 WeakPolarHBondContact O-CG 3.42Å; K454-K458 PolarHBondContact O-N 2.9Å; D455-K458 PolarHBondContact O-N 3.31Å; S456-K458 PolarHBondContact O-N 3.25Å; K458-A462 WeakPolarHBondContact O-CB 3.36Å; K458-A462 PolarHBondContact O-N 3.35Å; K458-T500 HydrophobicContact CD-CG2 4.11Å
459	L	98.3	Very high	95.5	Very high	0 Å²	0	20.2 Å²	20.2	0%	0	11%	0.106	C	C	.	.	H	α-helix	trans	-63.1	-54.8	171.8	-79	163.6	0	0	0	111.7	V416 M420 I440 V444 D455 S456 W461 A462 F463 F476 L480	V416-L459 HydrophobicContact CG2-CD1 4.23Å; M420-L459 HydrophobicContact CB-CD1 4.3Å; M420-L459 HydrophobicContact CB-CD2 4.17Å; M420-L459 HydrophobicContact CB-CG 3.95Å; M420-L459 HydrophobicContact CG-CG 4.04Å; I440-L459 HydrophobicContact CG2-CD2 4.3Å; V444-L459 HydrophobicContact CG1-CD1 4.01Å; V444-L459 HydrophobicContact CG2-CD1 4.07Å; V444-L459 HydrophobicContact CG2-CD2 4.26Å; D455-L459 WeakPolarHBondContact O-CB 3.21Å; D455-L459 WeakPolarHBondContact O-CG 2.96Å; D455-L459 PolarHBondContact O-N 2.71Å; S456-L459 PolarHBondContact O-N 2.69Å; L459-W461 VanDerWaalsContact C-N 3.31Å; L459-W461 PolarHBondContact O-N 2.94Å; L459-A462 PolarHBondContact O-N 3.26Å; L459-A462 VanDerWaalsContact O-N 3.12Å; L459-F463 HydrophobicContact CD2-CE2 4.28Å; L459-F463 WeakPolarHBondContact O-CD2 3.21Å; L459-F463 PolarHBondContact O-N 3.01Å; L459-F476 HydrophobicContact CB-CZ 4.38Å; L459-L480 HydrophobicContact CB-CD1 3.73Å; L459-L480 HydrophobicContact CD1-CD1 4.44Å; L459-L480 HydrophobicContact CD1-CD2 4.22Å
460	L	98.3	Very high	95.5	Very high	0 Å²	0	17.3 Å²	17.3	0%	0	9%	0.088	C	C	.	.	H	α-helix	trans	-51.6	-49.9	177.2	-76.8	170.9	0	0	0	111.5	S456 A464 Y477 L480 L484 L505	S456-L460 WeakPolarHBondContact O-CB 3.45Å; S456-L460 WeakPolarHBondContact O-CG 3.45Å; S456-L460 PolarHBondContact O-N 3.17Å; L460-A464 VanDerWaalsContact O-CB 3.27Å; L460-A464 WeakPolarHBondContact O-CB 3.48Å; L460-A464 PolarHBondContact O-N 3.37Å; L460-A464 VanDerWaalsContact O-N 3.15Å; L460-Y477 HydrophobicContact CD2-CD1 3.54Å; L460-Y477 HydrophobicContact CD2-CE1 4.15Å; L460-Y477 HydrophobicContact CD2-CG 4.38Å; L460-L480 HydrophobicContact CD1-CB 4.11Å; L460-L480 HydrophobicContact CD2-CB 3.75Å; L460-L480 HydrophobicContact CD2-CD1 4.09Å; L460-L480 HydrophobicContact CG-CB 3.79Å; L460-L480 HydrophobicContact CG-CD1 4.04Å; L460-L484 HydrophobicContact CD1-CD1 3.77Å; L460-L484 HydrophobicContact CD1-CG 4.41Å; L460-L505 HydrophobicContact CD1-CD1 4.28Å; L460-L505 HydrophobicContact CD1-CG 4.42Å; L460-L505 HydrophobicContact CD2-CD2 3.9Å; L460-L505 HydrophobicContact CD2-CG 4.34Å
461	W	97.9	Very high	95.3	Very high	13 Å²	13	19 Å²	19	5%	0.049	11%	0.11	C	C	.	.	H	α-helix	trans	-63.3	-43.9	177.9	173.4	76	0	0	0	113.2	S97 R100 L424 S427 S457 L459 A464 T465 T500 F507	S97-W461 WeakPolarHBondContact OG-CH2 3.44Å; S97-W461 WeakPolarHBondContact OG-CZ2 3.48Å; R100-W461 VanDerWaalsContact CZ-CD1 3.45Å; L424-W461 HydrophobicContact CD2-CE3 3.8Å; L424-W461 HydrophobicContact CD2-CZ3 3.63Å; S427-W461 WeakPolarHBondContact OG-CZ3 3.47Å; S457-W461 WeakPolarHBondContact O-CB 3.43Å; S457-W461 PolarHBondContact O-N 3.17Å; L459-W461 VanDerWaalsContact C-N 3.31Å; L459-W461 PolarHBondContact O-N 2.94Å; W461-A464 PolarHBondContact O-N 3.09Å; W461-T465 HydrophobicContact CZ2-CG2 4.07Å; W461-T465 PolarHBondContact NE1-OG1 2.99Å; W461-T465 WeakPolarHBondContact O-CB 3.32Å; W461-T465 PolarHBondContact O-N 3.39Å; W461-T465 PolarHBondContact O-OG1 2.87Å; W461-T500 HydrophobicContact CB-CG2 4.15Å; W461-F507 AromaticContact CD1-CE2 3.95Å; W461-F507 AromaticContact NE1-CE2 3.76Å
462	A	97.4	Very high	94.9	Very high	0 Å²	0	26.3 Å²	26.3	0%	0	14%	0.143	C	C	.	.	H	α-helix	trans	-67.7	-44.3	-173.8	0	0	0	0	0	111.7	T423 L424 S427 K458 L459 T465 L466	T423-A462 HydrophobicContact CG2-CB 3.48Å; T423-A462 VanDerWaalsContact CG2-CB 3.48Å; L424-A462 HydrophobicContact CD2-CB 4.39Å; S427-A462 WeakPolarHBondContact OG-CB 3.35Å; K458-A462 WeakPolarHBondContact O-CB 3.36Å; K458-A462 PolarHBondContact O-N 3.35Å; L459-A462 PolarHBondContact O-N 3.26Å; L459-A462 VanDerWaalsContact O-N 3.12Å; A462-T465 PolarHBondContact O-N 2.92Å; A462-L466 PolarHBondContact O-N 3.14Å; A462-L466 VanDerWaalsContact O-N 3.14Å
463	F	97.9	Very high	94.8	Very high	0 Å²	0	24.3 Å²	24.3	0%	0	14%	0.138	C	C	.	.	H	α-helix	trans	-60.8	-49	174.7	-90.3	-101.5	0	0	0	111.6	T423 L437 I440 A441 L459 T465 L466 G467 F468 F476 Y477	T423-F463 HydrophobicContact CG2-CD2 3.44Å; T423-F463 VanDerWaalsContact CG2-CD2 3.44Å; T423-F463 HydrophobicContact CG2-CE2 3.41Å; T423-F463 VanDerWaalsContact CG2-CE2 3.41Å; T423-F463 HydrophobicContact CG2-CG 4.48Å; T423-F463 HydrophobicContact CG2-CZ 4.44Å; L437-F463 HydrophobicContact CB-CE1 3.98Å; L437-F463 HydrophobicContact CB-CZ 4.31Å; L437-F463 HydrophobicContact CD2-CD1 4.33Å; L437-F463 HydrophobicContact CD2-CD2 4.48Å; L437-F463 HydrophobicContact CD2-CE1 3.99Å; L437-F463 HydrophobicContact CD2-CE2 4.15Å; L437-F463 HydrophobicContact CD2-CZ 3.89Å; L437-F463 WeakPolarHBondContact O-CE1 3.35Å; L437-F463 WeakPolarHBondContact O-CZ 3.48Å; I440-F463 HydrophobicContact CB-CE2 4.5Å; I440-F463 HydrophobicContact CB-CZ 4.08Å; I440-F463 HydrophobicContact CG2-CE2 3.78Å; I440-F463 HydrophobicContact CG2-CZ 3.79Å; A441-F463 HydrophobicContact CB-CE1 4Å; A441-F463 HydrophobicContact CB-CZ 4.22Å; L459-F463 HydrophobicContact CD2-CE2 4.28Å; L459-F463 WeakPolarHBondContact O-CD2 3.21Å; L459-F463 PolarHBondContact O-N 3.01Å; F463-T465 PolarHBondContact O-N 3.15Å; F463-L466 CarbonylContact O-C 3.37Å; F463-L466 PolarHBondContact O-N 3.25Å; F463-G467 PolarHBondContact O-N 3.36Å; F463-G467 VanDerWaalsContact O-N 3.15Å; F463-F468 HydrophobicContact CD1-CB 4.03Å; F463-F468 AromaticContact CD1-CD1 3.6Å; F463-F468 HydrophobicContact CD1-CD1 3.6Å; F463-F468 HydrophobicContact CD1-CE1 4.47Å; F463-F468 HydrophobicContact CD1-CG 4.13Å; F463-F468 AromaticContact CE1-CD1 3.64Å; F463-F468 HydrophobicContact CE1-CD1 3.64Å; F463-F468 HydrophobicContact CE1-CE1 4.1Å; F463-F468 HydrophobicContact CE1-CG 4.37Å; F463-F468 PolarHBondContact O-N 3Å; F463-F476 HydrophobicContact CB-CE1 3.96Å; F463-F476 HydrophobicContact CB-CZ 4.44Å; F463-F476 HydrophobicContact CD1-CD1 4.43Å; F463-F476 AromaticContact CD1-CE1 3.81Å; F463-F476 HydrophobicContact CD1-CE1 3.81Å; F463-F476 HydrophobicContact CD1-CZ 4.01Å; F463-F476 AromaticContact CD2-CE1 3.7Å; F463-F476 HydrophobicContact CD2-CE1 3.7Å; F463-F476 HydrophobicContact CD2-CE2 4.27Å; F463-F476 AromaticContact CD2-CZ 3.3Å; F463-F476 HydrophobicContact CD2-CZ 3.3Å; F463-F476 HydrophobicContact CE1-CE1 4.23Å; F463-F476 HydrophobicContact CE1-CE2 4.43Å; F463-F476 HydrophobicContact CE1-CZ 4.07Å; F463-F476 HydrophobicContact CE2-CE1 4.13Å; F463-F476 AromaticContact CE2-CE2 3.9Å; F463-F476 HydrophobicContact CE2-CE2 3.9Å; F463-F476 AromaticContact CE2-CZ 3.37Å; F463-F476 HydrophobicContact CE2-CZ 3.37Å; F463-F476 AromaticContact CG-CE1 3.53Å; F463-F476 HydrophobicContact CG-CE1 3.53Å; F463-F476 AromaticContact CG-CZ 3.65Å; F463-F476 HydrophobicContact CG-CZ 3.65Å; F463-F476 HydrophobicContact CZ-CE1 4.38Å; F463-F476 AromaticContact CZ-CE2 3.99Å; F463-F476 HydrophobicContact CZ-CE2 3.99Å; F463-F476 AromaticContact CZ-CZ 3.76Å; F463-F476 HydrophobicContact CZ-CZ 3.76Å; F463-Y477 WeakPolarHBondContact CB-OH 3.44Å
464	A	97.1	Very high	94.6	Very high	1 Å²	1	31.6 Å²	31.6	1%	0.008	17%	0.172	C	C	.	.	H	α-helix	trans	-69.1	-31.5	-179.8	0	0	0	0	0	113.3	L460 W461 L466 G467 Y477 G504 F507 V508 G757	L460-A464 VanDerWaalsContact O-CB 3.27Å; L460-A464 WeakPolarHBondContact O-CB 3.48Å; L460-A464 PolarHBondContact O-N 3.37Å; L460-A464 VanDerWaalsContact O-N 3.15Å; W461-A464 PolarHBondContact O-N 3.09Å; A464-L466 VanDerWaalsContact C-N 3.32Å; A464-L466 PolarHBondContact O-N 3.46Å; A464-G467 WeakPolarHBondContact O-CA 3.37Å; A464-G467 PolarHBondContact O-N 3.28Å; A464-Y477 HydrophobicContact CB-CE1 4.37Å; A464-Y477 PolarHBondContact N-OH 2.79Å; A464-G504 WeakPolarHBondContact CB-O 3.4Å; A464-F507 HydrophobicContact CB-CB 4.09Å; A464-V508 HydrophobicContact CB-CG1 3.78Å; A464-V508 HydrophobicContact CB-CG2 4.27Å; A464-G757 WeakPolarHBondContact O-CA 3.39Å
465	T	96.4	Very high	94.6	Very high	5 Å²	5	31.9 Å²	31.9	3%	0.031	18%	0.181	C	C	.	.	H	α-helix	trans	-65.6	-35.3	173.6	-62.6	0	0	0	0	111.7	W461 A462 F463 G467 L756 G757	W461-T465 HydrophobicContact CZ2-CG2 4.07Å; W461-T465 PolarHBondContact NE1-OG1 2.99Å; W461-T465 WeakPolarHBondContact O-CB 3.32Å; W461-T465 PolarHBondContact O-N 3.39Å; W461-T465 PolarHBondContact O-OG1 2.87Å; A462-T465 PolarHBondContact O-N 2.92Å; F463-T465 PolarHBondContact O-N 3.15Å; T465-G467 PolarHBondContact O-N 3.37Å; T465-L756 HydrophobicContact CG2-CB 4.4Å; T465-L756 HydrophobicContact CG2-CD2 4.38Å; T465-L756 CarbonylContact O-C 3.6Å; T465-L756 WeakPolarHBondContact O-CA 3.36Å; T465-L756 WeakPolarHBondContact O-CD2 3.3Å; T465-G757 PolarHBondContact O-N 3.49Å
466	L	96.3	Very high	94.6	Very high	0 Å²	0	31.9 Å²	31.9	0%	0	18%	0.181	C	C	.	.	T	Hydrogen-bonded Turn	trans	-85	6.9	171.5	-64.8	169.6	0	0	0	113.1	C426 R432 L437 A462 F463 A464 F468 Q754	C426-L466 HydrophobicContact CB-CD1 3.77Å; R432-L466 HydrophobicContact CB-CD2 4.21Å; R432-L466 PolarHBondContact NH1-O 3.15Å; L437-L466 HydrophobicContact CD1-CB 4.44Å; L437-L466 HydrophobicContact CD1-CD1 4.02Å; L437-L466 HydrophobicContact CD2-CD1 4.09Å; A462-L466 PolarHBondContact O-N 3.14Å; A462-L466 VanDerWaalsContact O-N 3.14Å; F463-L466 CarbonylContact O-C 3.37Å; F463-L466 PolarHBondContact O-N 3.25Å; A464-L466 VanDerWaalsContact C-N 3.32Å; A464-L466 PolarHBondContact O-N 3.46Å; L466-F468 PolarHBondContact O-N 2.68Å; L466-Q754 PolarHBondContact O-NE2 3.09Å
467	G	94.6	Very high	94.6	Very high	26 Å²	26	32.2 Å²	32.2	27%	0.268	18%	0.182	S	C	.	.	T	Hydrogen-bonded Turn	trans	55	33.7	-178.2	0	0	0	0	0	114	R432 F463 A464 T465 Q754	R432-G467 PolarHBondContact NH1-O 3.44Å; R432-G467 VanDerWaalsContact NH1-O 3.15Å; F463-G467 PolarHBondContact O-N 3.36Å; F463-G467 VanDerWaalsContact O-N 3.15Å; A464-G467 WeakPolarHBondContact O-CA 3.37Å; A464-G467 PolarHBondContact O-N 3.28Å; T465-G467 PolarHBondContact O-N 3.37Å; G467-Q754 PolarHBondContact O-NE2 3.44Å
468	F	95.4	Very high	94.6	Very high	8 Å²	8	35.2 Å²	35.2	4%	0.035	20%	0.201	C	C	.	.			trans	-93.4	120.7	-176.6	-165.2	-84.1	0	0	0	111.5	R432 D434 L437 F463 L466 P470 Y477	R432-F468 VanDerWaalsContact NH2-CD2 3.32Å; D434-F468 HydrophobicContact CB-CE2 3.96Å; L437-F468 HydrophobicContact CB-CD1 4Å; L437-F468 HydrophobicContact CB-CD2 3.64Å; L437-F468 HydrophobicContact CB-CE1 3.92Å; L437-F468 HydrophobicContact CB-CE2 3.62Å; L437-F468 HydrophobicContact CB-CG 3.85Å; L437-F468 HydrophobicContact CB-CZ 3.76Å; L437-F468 HydrophobicContact CD1-CB 3.98Å; L437-F468 HydrophobicContact CD1-CD2 3.47Å; L437-F468 VanDerWaalsContact CD1-CD2 3.47Å; L437-F468 HydrophobicContact CD1-CE2 4.16Å; L437-F468 HydrophobicContact CD1-CG 3.83Å; L437-F468 HydrophobicContact CG-CD2 4.18Å; L437-F468 HydrophobicContact CG-CG 4.38Å; F463-F468 HydrophobicContact CD1-CB 4.03Å; F463-F468 AromaticContact CD1-CD1 3.6Å; F463-F468 HydrophobicContact CD1-CD1 3.6Å; F463-F468 HydrophobicContact CD1-CE1 4.47Å; F463-F468 HydrophobicContact CD1-CG 4.13Å; F463-F468 AromaticContact CE1-CD1 3.64Å; F463-F468 HydrophobicContact CE1-CD1 3.64Å; F463-F468 HydrophobicContact CE1-CE1 4.1Å; F463-F468 HydrophobicContact CE1-CG 4.37Å; F463-F468 PolarHBondContact O-N 3Å; L466-F468 PolarHBondContact O-N 2.68Å; F468-P470 HydrophobicContact CD1-CB 4.39Å; F468-P470 HydrophobicContact CE1-CB 3.88Å; F468-Y477 WeakPolarHBondContact O-CE2 3.37Å; F468-Y477 PolarHBondContact O-OH 3.34Å
469	L	93.3	Very high	94.7	Very high	105 Å²	105	35.5 Å²	35.5	55%	0.55	21%	0.206	S	C	.	.			trans	-114.5	109.1	172.8	-66.7	177.4	0	0	0	108.4	A471 Y477 V508	L469-A471 PolarHBondContact O-N 3Å; L469-Y477 HydrophobicContact CD2-CD2 4.39Å; L469-Y477 HydrophobicContact CD2-CE2 3.77Å; L469-V508 HydrophobicContact CD2-CB 4.06Å; L469-V508 HydrophobicContact CD2-CG1 3.86Å
470	P	91	Very high	94.7	Very high	11 Å²	11	35.5 Å²	35.5	7%	0.071	21%	0.206	C	C	.	.			trans	-72.8	90.9	-176.3	26.9	-31.5	0	0	0	111.3	A441 F468 Q472 N473 Q474 F476 Y477	A441-P470 HydrophobicContact CB-CB 3.74Å; A441-P470 HydrophobicContact CB-CG 4.16Å; F468-P470 HydrophobicContact CD1-CB 4.39Å; F468-P470 HydrophobicContact CE1-CB 3.88Å; P470-Q472 PolarHBondContact O-N 2.8Å; P470-N473 HydrophobicContact CB-CB 4.05Å; P470-N473 WeakPolarHBondContact CG-O 3.01Å; P470-N473 CarbonylContact O-C 3.53Å; P470-N473 VanDerWaalsContact O-C 3.29Å; P470-N473 PolarHBondContact O-N 3.35Å; P470-Q474 PolarHBondContact O-N 3.09Å; P470-F476 HydrophobicContact CG-CB 3.73Å; P470-F476 HydrophobicContact CG-CD1 4.27Å; P470-F476 HydrophobicContact CG-CG 4.17Å; P470-Y477 HydrophobicContact CG-CD2 4.5Å
471	A	87.1	Confident	94.7	Very high	80 Å²	80	36 Å²	36	66%	0.661	21%	0.209	S	C	*	.	T	Hydrogen-bonded Turn	trans	-56.1	-34.3	-177.4	0	0	0	0	0	113.8	L469 Q474	L469-A471 PolarHBondContact O-N 3Å; A471-Q474 WeakPolarHBondContact O-CG 3.36Å; A471-Q474 PolarHBondContact O-NE2 3.29Å
472	Q	85.5	Confident	94.7	Very high	158 Å²	158	38.3 Å²	38.3	74%	0.738	22%	0.222	S	C	*	.	T	Hydrogen-bonded Turn	trans	-85	-21.2	177.5	-65.3	175.4	-5.2	0	0	113.5	P470	P470-Q472 PolarHBondContact O-N 2.8Å
473	N	89.5	Confident	94.6	Very high	31 Å²	31	38.3 Å²	38.3	17%	0.166	22%	0.222	C	C	.	.			trans	-125.7	55.9	-174.3	-68.8	-83	0	0	0	110.8	A441 E442 P470 S475 F476	A441-N473 HydrophobicContact CB-CB 4.24Å; E442-N473 WeakPolarHBondContact CG-ND2 3.44Å; P470-N473 HydrophobicContact CB-CB 4.05Å; P470-N473 WeakPolarHBondContact CG-O 3.01Å; P470-N473 CarbonylContact O-C 3.53Å; P470-N473 VanDerWaalsContact O-C 3.29Å; P470-N473 PolarHBondContact O-N 3.35Å; N473-S475 PolarHBondContact O-N 3.26Å; N473-F476 VanDerWaalsContact O-CB 3.27Å; N473-F476 WeakPolarHBondContact O-CB 3.45Å; N473-F476 PolarHBondContact O-N 3.02Å
474	Q	89.9	Confident	94.6	Very high	153 Å²	153	38.3 Å²	38.3	72%	0.715	22%	0.222	S	C	*	.	T	Hydrogen-bonded Turn	trans	-60.5	-21.4	-173.3	-57.3	-179.9	12.3	0	0	113.4	P470 A471 F476 P478	P470-Q474 PolarHBondContact O-N 3.09Å; A471-Q474 WeakPolarHBondContact O-CG 3.36Å; A471-Q474 PolarHBondContact O-NE2 3.29Å; Q474-F476 PolarHBondContact O-N 3.23Å; Q474-P478 WeakPolarHBondContact O-CD 3.35Å
475	S	93.5	Very high	94.6	Very high	61 Å²	61	42.8 Å²	42.8	43%	0.427	24%	0.239	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68.6	-12.6	174.3	57	0	0	0	0	114.4	N473 S479	N473-S475 PolarHBondContact O-N 3.26Å; S475-S479 WeakPolarHBondContact O-CB 3.4Å; S475-S479 PolarHBondContact O-N 3.12Å; S475-S479 PolarHBondContact O-OG 3.36Å
476	F	97	Very high	94.6	Very high	0 Å²	0	49.5 Å²	49.5	0%	0	27%	0.27	C	S	.	.	H	α-helix	trans	-57.4	-57.9	-177.8	179	-94.2	0	0	0	113.3	A441 V444 L459 F463 P470 N473 Q474 S479 L480	A441-F476 HydrophobicContact CB-CD2 3.93Å; A441-F476 HydrophobicContact CB-CE2 4.41Å; A441-F476 HydrophobicContact CB-CG 4.28Å; V444-F476 HydrophobicContact CB-CD2 4.07Å; V444-F476 HydrophobicContact CB-CE2 3.78Å; V444-F476 HydrophobicContact CG1-CD2 3.98Å; V444-F476 HydrophobicContact CG1-CE2 3.65Å; V444-F476 HydrophobicContact CG2-CE2 4.19Å; L459-F476 HydrophobicContact CB-CZ 4.38Å; F463-F476 HydrophobicContact CB-CE1 3.96Å; F463-F476 HydrophobicContact CB-CZ 4.44Å; F463-F476 HydrophobicContact CD1-CD1 4.43Å; F463-F476 AromaticContact CD1-CE1 3.81Å; F463-F476 HydrophobicContact CD1-CE1 3.81Å; F463-F476 HydrophobicContact CD1-CZ 4.01Å; F463-F476 AromaticContact CD2-CE1 3.7Å; F463-F476 HydrophobicContact CD2-CE1 3.7Å; F463-F476 HydrophobicContact CD2-CE2 4.27Å; F463-F476 AromaticContact CD2-CZ 3.3Å; F463-F476 HydrophobicContact CD2-CZ 3.3Å; F463-F476 HydrophobicContact CE1-CE1 4.23Å; F463-F476 HydrophobicContact CE1-CE2 4.43Å; F463-F476 HydrophobicContact CE1-CZ 4.07Å; F463-F476 HydrophobicContact CE2-CE1 4.13Å; F463-F476 AromaticContact CE2-CE2 3.9Å; F463-F476 HydrophobicContact CE2-CE2 3.9Å; F463-F476 AromaticContact CE2-CZ 3.37Å; F463-F476 HydrophobicContact CE2-CZ 3.37Å; F463-F476 AromaticContact CG-CE1 3.53Å; F463-F476 HydrophobicContact CG-CE1 3.53Å; F463-F476 AromaticContact CG-CZ 3.65Å; F463-F476 HydrophobicContact CG-CZ 3.65Å; F463-F476 HydrophobicContact CZ-CE1 4.38Å; F463-F476 AromaticContact CZ-CE2 3.99Å; F463-F476 HydrophobicContact CZ-CE2 3.99Å; F463-F476 AromaticContact CZ-CZ 3.76Å; F463-F476 HydrophobicContact CZ-CZ 3.76Å; P470-F476 HydrophobicContact CG-CB 3.73Å; P470-F476 HydrophobicContact CG-CD1 4.27Å; P470-F476 HydrophobicContact CG-CG 4.17Å; N473-F476 VanDerWaalsContact O-CB 3.27Å; N473-F476 WeakPolarHBondContact O-CB 3.45Å; N473-F476 PolarHBondContact O-N 3.02Å; Q474-F476 PolarHBondContact O-N 3.23Å; F476-S479 PolarHBondContact O-OG 3.05Å; F476-L480 HydrophobicContact CD1-CD1 4.2Å; F476-L480 HydrophobicContact CD2-CD1 4.31Å; F476-L480 HydrophobicContact CE1-CD1 3.67Å; F476-L480 HydrophobicContact CE2-CD1 3.82Å; F476-L480 HydrophobicContact CG-CD1 4.49Å; F476-L480 HydrophobicContact CZ-CD1 3.45Å; F476-L480 VanDerWaalsContact CZ-CD1 3.45Å; F476-L480 WeakPolarHBondContact O-CB 3.45Å; F476-L480 WeakPolarHBondContact O-CG 3.24Å; F476-L480 PolarHBondContact O-N 3.33Å; F476-L480 VanDerWaalsContact O-N 3.16Å
477	Y	97.8	Very high	94.4	Very high	7 Å²	7	50.9 Å²	50.9	3%	0.027	28%	0.275	C	S	.	.	H	α-helix	trans	-66.3	-45.8	-179.5	-77.7	-86.6	0	0	0	113	L460 F463 A464 F468 L469 P470 T481 L505 V508	L460-Y477 HydrophobicContact CD2-CD1 3.54Å; L460-Y477 HydrophobicContact CD2-CE1 4.15Å; L460-Y477 HydrophobicContact CD2-CG 4.38Å; F463-Y477 WeakPolarHBondContact CB-OH 3.44Å; A464-Y477 HydrophobicContact CB-CE1 4.37Å; A464-Y477 PolarHBondContact N-OH 2.79Å; F468-Y477 WeakPolarHBondContact O-CE2 3.37Å; F468-Y477 PolarHBondContact O-OH 3.34Å; L469-Y477 HydrophobicContact CD2-CD2 4.39Å; L469-Y477 HydrophobicContact CD2-CE2 3.77Å; P470-Y477 HydrophobicContact CG-CD2 4.5Å; Y477-T481 WeakPolarHBondContact O-CB 3.12Å; Y477-T481 PolarHBondContact O-N 3.46Å; Y477-T481 PolarHBondContact O-OG1 3.1Å; Y477-L505 HydrophobicContact CD1-CD2 3.89Å; Y477-V508 HydrophobicContact CD1-CG2 4.33Å; Y477-V508 HydrophobicContact CE1-CG2 3.83Å
478	P	97.4	Very high	94.4	Very high	63 Å²	63	54.7 Å²	54.7	41%	0.409	28%	0.284	S	S	.	.	H	α-helix	trans	-57.8	-51.9	174.6	-27.3	36.2	0	0	0	113	Q474 L480 T481 D482	Q474-P478 WeakPolarHBondContact O-CD 3.35Å; P478-L480 VanDerWaalsContact C-N 3.34Å; P478-L480 PolarHBondContact O-N 3.42Å; P478-T481 CarbonylContact O-C 3.55Å; P478-T481 WeakPolarHBondContact O-CA 3.45Å; P478-T481 WeakPolarHBondContact O-CB 3.43Å; P478-T481 PolarHBondContact O-N 3.08Å; P478-D482 PolarHBondContact O-N 3.11Å
479	S	97.5	Very high	94.3	Very high	24 Å²	24	58.5 Å²	58.5	17%	0.168	32%	0.317	C	S	.	.	H	α-helix	trans	-64.8	-36.9	-175.1	63.1	0	0	0	0	112.5	S475 F476 A483	S475-S479 WeakPolarHBondContact O-CB 3.4Å; S475-S479 PolarHBondContact O-N 3.12Å; S475-S479 PolarHBondContact O-OG 3.36Å; F476-S479 PolarHBondContact O-OG 3.05Å; S479-A483 WeakPolarHBondContact O-CB 3.49Å; S479-A483 PolarHBondContact O-N 3.29Å
480	L	98.3	Very high	94.3	Very high	0 Å²	0	56.6 Å²	56.6	0%	0	31%	0.305	C	S	.	.	H	α-helix	trans	-68.5	-30.3	170.7	-70.8	-178.7	0	0	0	113.5	V444 V448 L459 L460 F476 P478 A483 L484	V444-L480 HydrophobicContact CG1-CD1 4.15Å; V444-L480 HydrophobicContact CG1-CD2 3.73Å; V444-L480 HydrophobicContact CG1-CG 4.09Å; V448-L480 HydrophobicContact CG2-CD2 4.15Å; L459-L480 HydrophobicContact CB-CD1 3.73Å; L459-L480 HydrophobicContact CD1-CD1 4.44Å; L459-L480 HydrophobicContact CD1-CD2 4.22Å; L460-L480 HydrophobicContact CD1-CB 4.11Å; L460-L480 HydrophobicContact CD2-CB 3.75Å; L460-L480 HydrophobicContact CD2-CD1 4.09Å; L460-L480 HydrophobicContact CG-CB 3.79Å; L460-L480 HydrophobicContact CG-CD1 4.04Å; F476-L480 HydrophobicContact CD1-CD1 4.2Å; F476-L480 HydrophobicContact CD2-CD1 4.31Å; F476-L480 HydrophobicContact CE1-CD1 3.67Å; F476-L480 HydrophobicContact CE2-CD1 3.82Å; F476-L480 HydrophobicContact CG-CD1 4.49Å; F476-L480 HydrophobicContact CZ-CD1 3.45Å; F476-L480 VanDerWaalsContact CZ-CD1 3.45Å; F476-L480 WeakPolarHBondContact O-CB 3.45Å; F476-L480 WeakPolarHBondContact O-CG 3.24Å; F476-L480 PolarHBondContact O-N 3.33Å; F476-L480 VanDerWaalsContact O-N 3.16Å; P478-L480 VanDerWaalsContact C-N 3.34Å; P478-L480 PolarHBondContact O-N 3.42Å; L480-A483 VanDerWaalsContact O-CB 3.27Å; L480-A483 WeakPolarHBondContact O-CB 3.49Å; L480-A483 PolarHBondContact O-N 3.23Å; L480-L484 PolarHBondContact O-N 3.18Å
481	T	98.1	Very high	94.4	Very high	9 Å²	9	56.2 Å²	56.2	6%	0.055	30%	0.303	C	S	.	.	H	α-helix	trans	-72.5	-43.1	175.9	-58.3	0	0	0	0	111.3	Y477 P478 A483 L484 R485 L505 P512 L515	Y477-T481 WeakPolarHBondContact O-CB 3.12Å; Y477-T481 PolarHBondContact O-N 3.46Å; Y477-T481 PolarHBondContact O-OG1 3.1Å; P478-T481 CarbonylContact O-C 3.55Å; P478-T481 WeakPolarHBondContact O-CA 3.45Å; P478-T481 WeakPolarHBondContact O-CB 3.43Å; P478-T481 PolarHBondContact O-N 3.08Å; T481-A483 PolarHBondContact O-N 3.27Å; T481-L484 WeakPolarHBondContact O-CA 3.48Å; T481-L484 WeakPolarHBondContact O-CB 3.23Å; T481-L484 PolarHBondContact O-N 3.14Å; T481-R485 PolarHBondContact O-N 2.87Å; T481-R485 VanDerWaalsContact O-N 3.1Å; T481-L505 HydrophobicContact CG2-CD1 4.22Å; T481-P512 HydrophobicContact CG2-CB 3.82Å; T481-P512 HydrophobicContact CG2-CG 3.82Å; T481-L515 HydrophobicContact CG2-CD1 4.07Å
482	D	97.4	Very high	94.6	Very high	62 Å²	62	58.5 Å²	58.5	33%	0.332	30%	0.3	S	S	.	.	H	α-helix	trans	-64.3	-32.1	172.9	-65.9	-34.6	0	0	0	111.7	P478 L484 R485 Q486	P478-D482 PolarHBondContact O-N 3.11Å; D482-L484 PolarHBondContact O-N 2.76Å; D482-R485 WeakPolarHBondContact O-CB 3.34Å; D482-R485 PolarHBondContact O-N 2.96Å; D482-R485 IonicContact OD1-CZ 3.93Å; D482-R485 IonicContact OD1-NH1 2.84Å; D482-R485 PolarHBondContact OD1-NH1 3.2Å; D482-Q486 VanDerWaalsContact O-CG 3.3Å; D482-Q486 WeakPolarHBondContact O-CG 3.41Å; D482-Q486 PolarHBondContact O-N 3.13Å
483	A	96.8	Very high	94.8	Very high	0 Å²	0	56.2 Å²	56.2	0%	0	29%	0.289	C	S	.	.	H	α-helix	trans	-60.2	-29.6	170.2	0	0	0	0	0	113.4	V448 S456 S479 L480 T481 R487	V448-A483 HydrophobicContact CG1-CB 3.79Å; S456-A483 WeakPolarHBondContact OG-CB 3.47Å; S479-A483 WeakPolarHBondContact O-CB 3.49Å; S479-A483 PolarHBondContact O-N 3.29Å; L480-A483 VanDerWaalsContact O-CB 3.27Å; L480-A483 WeakPolarHBondContact O-CB 3.49Å; L480-A483 PolarHBondContact O-N 3.23Å; T481-A483 PolarHBondContact O-N 3.27Å; A483-R487 VanDerWaalsContact CB-NH1 3.34Å; A483-R487 WeakPolarHBondContact O-CB 3.4Å; A483-R487 WeakPolarHBondContact O-CG 3.4Å; A483-R487 PolarHBondContact O-NH1 3.29Å
484	L	97.2	Very high	94.9	Very high	0 Å²	0	56.2 Å²	56.2	0%	0	29%	0.287	C	S	.	.	H	α-helix	trans	-78.7	-40.2	172.7	-61.8	-175.5	0	0	0	111.6	S457 L460 L480 T481 D482 Q486 R487 K488 F491 L515	S457-L484 VanDerWaalsContact OG-CD2 3.3Å; S457-L484 WeakPolarHBondContact OG-CD2 3.32Å; L460-L484 HydrophobicContact CD1-CD1 3.77Å; L460-L484 HydrophobicContact CD1-CG 4.41Å; L480-L484 PolarHBondContact O-N 3.18Å; T481-L484 WeakPolarHBondContact O-CA 3.48Å; T481-L484 WeakPolarHBondContact O-CB 3.23Å; T481-L484 PolarHBondContact O-N 3.14Å; D482-L484 PolarHBondContact O-N 2.76Å; L484-Q486 PolarHBondContact O-N 3.47Å; L484-R487 CarbonylContact O-C 3.16Å; L484-R487 PolarHBondContact O-N 3.08Å; L484-R487 VanDerWaalsContact O-N 3.16Å; L484-K488 PolarHBondContact O-N 3.39Å; L484-F491 HydrophobicContact CB-CZ 4.02Å; L484-F491 HydrophobicContact CD2-CE1 4.42Å; L484-F491 HydrophobicContact CD2-CZ 4.04Å; L484-F491 WeakPolarHBondContact O-CE2 3.31Å; L484-L515 HydrophobicContact CB-CD1 3.94Å
485	R	96.8	Very high	95.1	Very high	95 Å²	95	49.1 Å²	49.1	36%	0.358	25%	0.254	S	S	.	.	H	α-helix	trans	-57.2	-49.3	174.4	-65.3	179.5	169.1	130.9	-3.5	111.8	T481 D482 R487 K488 D514 L515	T481-R485 PolarHBondContact O-N 2.87Å; T481-R485 VanDerWaalsContact O-N 3.1Å; D482-R485 WeakPolarHBondContact O-CB 3.34Å; D482-R485 PolarHBondContact O-N 2.96Å; D482-R485 IonicContact OD1-CZ 3.93Å; D482-R485 IonicContact OD1-NH1 2.84Å; D482-R485 PolarHBondContact OD1-NH1 3.2Å; R485-R487 PolarHBondContact O-N 3.41Å; R485-K488 WeakPolarHBondContact O-CB 3.4Å; R485-K488 PolarHBondContact O-N 3.12Å; R485-D514 WeakPolarHBondContact CD-OD2 3.47Å; R485-D514 WeakPolarHBondContact CG-OD2 3.33Å; R485-D514 IonicContact CZ-OD1 2.71Å; R485-D514 IonicContact CZ-OD2 2.79Å; R485-D514 VanDerWaalsContact NE-CG 3.34Å; R485-D514 IonicContact NE-OD1 2.74Å; R485-D514 PolarHBondContact NE-OD1 3.06Å; R485-D514 VanDerWaalsContact NE-OD1 3.14Å; R485-D514 IonicContact NE-OD2 3.19Å; R485-D514 PolarHBondContact NE-OD2 3.33Å; R485-D514 IonicContact NH2-OD1 3.16Å; R485-D514 PolarHBondContact NH2-OD1 2.91Å; R485-D514 IonicContact NH2-OD2 3.89Å; R485-L515 HydrophobicContact CG-CD1 4.02Å; R485-L515 HydrophobicContact CG-CD2 4.07Å; R485-L515 HydrophobicContact CG-CG 4.06Å
486	Q	95.5	Very high	95.1	Very high	147 Å²	147	46.6 Å²	46.6	69%	0.687	24%	0.235	S	C	*	.	T	Hydrogen-bonded Turn	trans	-62.9	-23.9	178.7	-68.9	171.4	20	0	0	113.4	D482 L484	D482-Q486 VanDerWaalsContact O-CG 3.3Å; D482-Q486 WeakPolarHBondContact O-CG 3.41Å; D482-Q486 PolarHBondContact O-N 3.13Å; L484-Q486 PolarHBondContact O-N 3.47Å
487	R	93.9	Very high	95	Very high	28 Å²	28	47.2 Å²	47.2	11%	0.106	24%	0.238	C	C	.	.	T	Hydrogen-bonded Turn	trans	-106.5	18.7	-178	-65.8	178.3	-174.8	84.5	-5.3	113.2	V448 P449 C451 A483 L484 R485 A489 E490	V448-R487 PolarHBondContact O-NH2 3.5Å; P449-R487 PolarHBondContact O-NH2 3.13Å; C451-R487 PolarHBondContact O-NE 3.16Å; C451-R487 PolarHBondContact O-NH2 3.21Å; A483-R487 VanDerWaalsContact CB-NH1 3.34Å; A483-R487 WeakPolarHBondContact O-CB 3.4Å; A483-R487 WeakPolarHBondContact O-CG 3.4Å; A483-R487 PolarHBondContact O-NH1 3.29Å; L484-R487 CarbonylContact O-C 3.16Å; L484-R487 PolarHBondContact O-N 3.08Å; L484-R487 VanDerWaalsContact O-N 3.16Å; R485-R487 PolarHBondContact O-N 3.41Å; R487-A489 PolarHBondContact O-N 3.35Å; R487-E490 HydrophobicContact CB-CG 4.35Å; R487-E490 WeakPolarHBondContact CB-OE1 3.33Å; R487-E490 VanDerWaalsContact CD-OE1 3.25Å; R487-E490 WeakPolarHBondContact CD-OE1 3.44Å; R487-E490 VanDerWaalsContact CG-OE1 3.29Å; R487-E490 WeakPolarHBondContact CG-OE1 3.48Å; R487-E490 WeakPolarHBondContact O-CB 3.46Å; R487-E490 PolarHBondContact O-N 3.28Å
488	K	93.3	Very high	95	Very high	106 Å²	106	46.9 Å²	46.9	46%	0.461	24%	0.237	S	C	.	.	G	3₁₀ helix	trans	-48.9	-31.7	-177.7	176.4	161.4	175.7	164.1	0	115	L484 R485 F491 L518	L484-K488 PolarHBondContact O-N 3.39Å; R485-K488 WeakPolarHBondContact O-CB 3.4Å; R485-K488 PolarHBondContact O-N 3.12Å; K488-F491 WeakPolarHBondContact O-CD2 3.44Å; K488-L518 HydrophobicContact CD-CD2 3.9Å; K488-L518 HydrophobicContact CG-CD2 3.75Å
489	A	92.8	Very high	94.9	Very high	88 Å²	88	43.9 Å²	43.9	73%	0.727	22%	0.217	S	C	*	.	G	3₁₀ helix	trans	-67.9	-32	176.9	0	0	0	0	0	114	R487 F491 Q492	R487-A489 PolarHBondContact O-N 3.35Å; A489-F491 PolarHBondContact O-N 3.31Å; A489-Q492 PolarHBondContact O-N 2.91Å
490	E	93.9	Very high	94.9	Very high	65 Å²	65	42.7 Å²	42.7	30%	0.304	21%	0.209	S	C	.	.	G	3₁₀ helix	trans	-63.1	-26.5	-178.4	-67.1	178.6	-145.1	0	0	112.3	S453 R487 Q492 Q493 Y494	S453-E490 WeakPolarHBondContact CB-OE2 3.36Å; S453-E490 PolarHBondContact N-OE2 3.21Å; S453-E490 PolarHBondContact OG-OE2 2.82Å; R487-E490 HydrophobicContact CB-CG 4.35Å; R487-E490 WeakPolarHBondContact CB-OE1 3.33Å; R487-E490 VanDerWaalsContact CD-OE1 3.25Å; R487-E490 WeakPolarHBondContact CD-OE1 3.44Å; R487-E490 VanDerWaalsContact CG-OE1 3.29Å; R487-E490 WeakPolarHBondContact CG-OE1 3.48Å; R487-E490 WeakPolarHBondContact O-CB 3.46Å; R487-E490 PolarHBondContact O-N 3.28Å; E490-Q492 PolarHBondContact O-N 3.04Å; E490-Q493 PolarHBondContact O-N 2.96Å; E490-Y494 PolarHBondContact O-N 3.43Å
491	F	93.4	Very high	94.8	Very high	3 Å²	3	42.7 Å²	42.7	1%	0.013	21%	0.209	C	C	.	.	G	3₁₀ helix	trans	-69.8	-11.6	-176.7	-52.1	-47.9	0	0	0	114.3	L484 K488 A489 Q493 P495 H497 L498 L518 F524	L484-F491 HydrophobicContact CB-CZ 4.02Å; L484-F491 HydrophobicContact CD2-CE1 4.42Å; L484-F491 HydrophobicContact CD2-CZ 4.04Å; L484-F491 WeakPolarHBondContact O-CE2 3.31Å; K488-F491 WeakPolarHBondContact O-CD2 3.44Å; A489-F491 PolarHBondContact O-N 3.31Å; F491-Q493 VanDerWaalsContact C-N 3.31Å; F491-P495 WeakPolarHBondContact O-CA 3.33Å; F491-H497 HydrophobicContact CD1-CB 4.13Å; F491-H497 HydrophobicContact CE1-CB 3.98Å; F491-L498 HydrophobicContact CB-CB 4.39Å; F491-L498 HydrophobicContact CD1-CB 3.74Å; F491-L498 HydrophobicContact CD2-CB 4.08Å; F491-L498 HydrophobicContact CD2-CD1 4.21Å; F491-L498 HydrophobicContact CD2-CD2 4.12Å; F491-L498 HydrophobicContact CD2-CG 4.36Å; F491-L498 HydrophobicContact CE1-CB 3.95Å; F491-L498 HydrophobicContact CE2-CB 4.29Å; F491-L498 HydrophobicContact CE2-CD1 3.85Å; F491-L498 HydrophobicContact CE2-CG 4.46Å; F491-L498 HydrophobicContact CG-CB 3.82Å; F491-L498 HydrophobicContact CG-CD2 4.42Å; F491-L498 HydrophobicContact CZ-CB 4.23Å; F491-L498 HydrophobicContact CZ-CD1 4.09Å; F491-L518 HydrophobicContact CD2-CD2 4.11Å; F491-F524 HydrophobicContact CB-CE2 4.07Å
492	Q	91.4	Very high	94.9	Very high	129 Å²	129	42.4 Å²	42.4	60%	0.603	21%	0.207	S	C	*	.	G	3₁₀ helix	trans	-68.7	-31.2	168	-69.8	-65.9	-24	0	0	112.1	A489 E490	A489-Q492 PolarHBondContact O-N 2.91Å; E490-Q492 PolarHBondContact O-N 3.04Å
493	Q	90.2	Very high	94.9	Very high	110 Å²	110	39.6 Å²	39.6	51%	0.514	19%	0.193	S	C	.	.	T	Hydrogen-bonded Turn	trans	-96	-31.4	176.7	-172.7	176.2	6.9	0	0	112.2	E490 F491	E490-Q493 PolarHBondContact O-N 2.96Å; F491-Q493 VanDerWaalsContact C-N 3.31Å
494	Y	91.2	Very high	94.9	Very high	31 Å²	31	39.6 Å²	39.6	12%	0.122	19%	0.193	C	C	.	.			trans	-129.8	64.1	-175	-52.5	-79.6	0	0	0	112.6	L110 E490 E496 H497	L110-Y494 HydrophobicContact CD2-CE1 4.01Å; E490-Y494 PolarHBondContact O-N 3.43Å; Y494-E496 VanDerWaalsContact CA-OE2 3.28Å; Y494-E496 WeakPolarHBondContact CA-OE2 3.26Å; Y494-E496 PolarHBondContact O-N 2.85Å; Y494-H497 WeakPolarHBondContact CB-CE1 3.28Å; Y494-H497 VanDerWaalsContact CB-ND1 3.25Å; Y494-H497 WeakPolarHBondContact CB-ND1 3.21Å; Y494-H497 AromaticContact CD1-CE1 3.79Å; Y494-H497 AromaticContact CG-CE1 3.56Å; Y494-H497 AromaticContact CG-ND1 3.85Å; Y494-H497 WeakPolarHBondContact O-CB 3.29Å; Y494-H497 PolarHBondContact O-N 2.71Å; Y494-H497 VanDerWaalsContact O-N 3.1Å
495	P	93.1	Very high	95	Very high	3 Å²	3	39.6 Å²	39.6	2%	0.019	19%	0.193	C	C	.	.	H	α-helix	trans	-62.5	-25.4	-177.4	26	-34.9	0	0	0	113	F491 H497 L498 F524 L527 L534 L536	F491-P495 WeakPolarHBondContact O-CA 3.33Å; P495-H497 PolarHBondContact O-N 3.5Å; P495-L498 PolarHBondContact O-N 2.67Å; P495-F524 HydrophobicContact CB-CE1 4.35Å; P495-F524 HydrophobicContact CB-CE2 3.79Å; P495-F524 HydrophobicContact CB-CZ 3.51Å; P495-L527 HydrophobicContact CB-CD2 4.19Å; P495-L527 HydrophobicContact CB-CG 4.46Å; P495-L527 HydrophobicContact CG-CD2 4.47Å; P495-L527 HydrophobicContact CG-CG 4.4Å; P495-L534 HydrophobicContact CG-CD1 4.48Å; P495-L536 HydrophobicContact CB-CD1 4.18Å; P495-L536 HydrophobicContact CG-CD1 4.04Å
496	E	93.5	Very high	95	Very high	8 Å²	8	35.1 Å²	35.1	4%	0.037	18%	0.175	C	C	.	.	H	α-helix	trans	-64.5	-23.4	176.6	76.5	-85	-142.9	0	0	112.9	L102 Y494 T500 L534 L536	L102-E496 HydrophobicContact CD1-CB 4.19Å; L102-E496 HydrophobicContact CD1-CG 4.47Å; L102-E496 HydrophobicContact CD2-CG 4.38Å; Y494-E496 VanDerWaalsContact CA-OE2 3.28Å; Y494-E496 WeakPolarHBondContact CA-OE2 3.26Å; Y494-E496 PolarHBondContact O-N 2.85Å; E496-T500 WeakPolarHBondContact O-CB 3.49Å; E496-T500 PolarHBondContact O-N 2.62Å; E496-T500 PolarHBondContact O-OG1 3.46Å; E496-L534 HydrophobicContact CB-CD1 4.28Å; E496-L536 HydrophobicContact CB-CD1 4.43Å; E496-L536 HydrophobicContact CB-CD2 3.87Å
497	H	95.2	Very high	95.1	Very high	13 Å²	13	29 Å²	29	6%	0.06	15%	0.147	C	C	.	.	H	α-helix	trans	-68.4	-45.2	176.8	-63	164.7	0	0	0	111.2	S453 K454 S457 F491 Y494 P495 T500 G501	S453-H497 PolarHBondContact OG-ND1 3.06Å; K454-H497 VanDerWaalsContact CB-CE1 3.49Å; K454-H497 WeakPolarHBondContact CB-CE1 3.26Å; K454-H497 WeakPolarHBondContact CB-NE2 3.17Å; K454-H497 PolarHBondContact N-ND1 3.44Å; S457-H497 WeakPolarHBondContact CB-O 3.3Å; S457-H497 PolarHBondContact OG-O 2.86Å; F491-H497 HydrophobicContact CD1-CB 4.13Å; F491-H497 HydrophobicContact CE1-CB 3.98Å; Y494-H497 WeakPolarHBondContact CB-CE1 3.28Å; Y494-H497 VanDerWaalsContact CB-ND1 3.25Å; Y494-H497 WeakPolarHBondContact CB-ND1 3.21Å; Y494-H497 AromaticContact CD1-CE1 3.79Å; Y494-H497 AromaticContact CG-CE1 3.56Å; Y494-H497 AromaticContact CG-ND1 3.85Å; Y494-H497 WeakPolarHBondContact O-CB 3.29Å; Y494-H497 PolarHBondContact O-N 2.71Å; Y494-H497 VanDerWaalsContact O-N 3.1Å; P495-H497 PolarHBondContact O-N 3.5Å; H497-T500 PolarHBondContact O-N 2.87Å; H497-G501 PolarHBondContact O-N 3.2Å
498	L	97.5	Very high	95.2	Very high	0 Å²	0	28.7 Å²	28.7	0%	0	15%	0.148	C	C	.	.	H	α-helix	trans	-61.4	-51.9	-179.6	-179.7	58.6	0	0	0	111.1	F491 P495 T500 G501 L502 L515 L518 A519 F524	F491-L498 HydrophobicContact CB-CB 4.39Å; F491-L498 HydrophobicContact CD1-CB 3.74Å; F491-L498 HydrophobicContact CD2-CB 4.08Å; F491-L498 HydrophobicContact CD2-CD1 4.21Å; F491-L498 HydrophobicContact CD2-CD2 4.12Å; F491-L498 HydrophobicContact CD2-CG 4.36Å; F491-L498 HydrophobicContact CE1-CB 3.95Å; F491-L498 HydrophobicContact CE2-CB 4.29Å; F491-L498 HydrophobicContact CE2-CD1 3.85Å; F491-L498 HydrophobicContact CE2-CG 4.46Å; F491-L498 HydrophobicContact CG-CB 3.82Å; F491-L498 HydrophobicContact CG-CD2 4.42Å; F491-L498 HydrophobicContact CZ-CB 4.23Å; F491-L498 HydrophobicContact CZ-CD1 4.09Å; P495-L498 PolarHBondContact O-N 2.67Å; L498-T500 VanDerWaalsContact C-N 3.31Å; L498-T500 PolarHBondContact O-N 3.26Å; L498-G501 PolarHBondContact O-N 2.86Å; L498-L502 HydrophobicContact CD1-CD1 3.82Å; L498-L502 HydrophobicContact CD1-CG 4.1Å; L498-L502 HydrophobicContact CG-CD1 3.89Å; L498-L502 WeakPolarHBondContact O-CG 3.4Å; L498-L502 PolarHBondContact O-N 2.71Å; L498-L515 HydrophobicContact CD1-CB 4.24Å; L498-L515 HydrophobicContact CD1-CD2 4.27Å; L498-L518 HydrophobicContact CD2-CB 4.39Å; L498-L518 HydrophobicContact CD2-CD2 3.64Å; L498-L518 HydrophobicContact CD2-CG 3.8Å; L498-A519 HydrophobicContact CD2-CB 3.83Å; L498-A519 HydrophobicContact CG-CB 4.14Å; L498-F524 HydrophobicContact CB-CZ 4.07Å; L498-F524 HydrophobicContact CD2-CD2 4.34Å; L498-F524 HydrophobicContact CD2-CE1 4.33Å; L498-F524 HydrophobicContact CD2-CE2 3.83Å; L498-F524 HydrophobicContact CD2-CZ 3.81Å; L498-F524 HydrophobicContact CG-CZ 4.42Å
499	L	96.6	Very high	95.3	Very high	0 Å²	0	26.5 Å²	26.5	0%	0	15%	0.146	C	C	.	.	H	α-helix	trans	-62.7	-37.7	177.8	-62.2	176.6	0	0	0	112	G501 L503 A519 F524 L536 L540 L543	L499-G501 VanDerWaalsContact C-N 3.32Å; L499-G501 PolarHBondContact O-N 3.43Å; L499-L503 WeakPolarHBondContact O-CB 3.27Å; L499-L503 VanDerWaalsContact O-CG 3.3Å; L499-L503 WeakPolarHBondContact O-CG 3.42Å; L499-L503 PolarHBondContact O-N 3.23Å; L499-A519 HydrophobicContact CD2-CB 4.01Å; L499-F524 HydrophobicContact CD1-CE1 4.22Å; L499-F524 HydrophobicContact CD2-CE1 4.15Å; L499-F524 HydrophobicContact CG-CE1 4.02Å; L499-F524 HydrophobicContact CG-CZ 4.49Å; L499-L536 HydrophobicContact CD1-CB 3.97Å; L499-L536 HydrophobicContact CD1-CD1 4.21Å; L499-L536 HydrophobicContact CD1-CD2 4.21Å; L499-L536 HydrophobicContact CD1-CG 4.34Å; L499-L540 HydrophobicContact CD1-CD2 4.02Å; L499-L540 HydrophobicContact CD1-CG 3.91Å; L499-L540 HydrophobicContact CD2-CD2 3.75Å; L499-L540 HydrophobicContact CD2-CG 4.4Å; L499-L543 HydrophobicContact CD2-CD2 3.98Å
500	T	96.3	Very high	95.5	Very high	0 Å²	0	25.4 Å²	25.4	0%	0	13%	0.126	C	C	.	.	H	α-helix	trans	-57.8	-44.4	174.8	-73.5	0	0	0	0	111.9	S457 K458 W461 E496 H497 L498 G504	S457-T500 WeakPolarHBondContact O-CG2 3.49Å; K458-T500 HydrophobicContact CD-CG2 4.11Å; W461-T500 HydrophobicContact CB-CG2 4.15Å; E496-T500 WeakPolarHBondContact O-CB 3.49Å; E496-T500 PolarHBondContact O-N 2.62Å; E496-T500 PolarHBondContact O-OG1 3.46Å; H497-T500 PolarHBondContact O-N 2.87Å; L498-T500 VanDerWaalsContact C-N 3.31Å; L498-T500 PolarHBondContact O-N 3.26Å; T500-G504 PolarHBondContact O-N 3.18Å
501	G	97.8	Very high	95.6	Very high	0 Å²	0	23.6 Å²	23.6	0%	0	12%	0.117	C	C	.	.	H	α-helix	trans	-72.9	-46.6	-179.6	0	0	0	0	0	112.8	H497 L498 L499 L503 G504 L505	H497-G501 PolarHBondContact O-N 3.2Å; L498-G501 PolarHBondContact O-N 2.86Å; L499-G501 VanDerWaalsContact C-N 3.32Å; L499-G501 PolarHBondContact O-N 3.43Å; G501-L503 PolarHBondContact O-N 2.88Å; G501-G504 WeakPolarHBondContact O-CA 3.44Å; G501-G504 PolarHBondContact O-N 3.31Å; G501-L505 PolarHBondContact O-N 3.11Å
502	L	98.5	Very high	95.8	Very high	2 Å²	2	24 Å²	24	1%	0.01	12%	0.12	C	C	.	.	H	α-helix	trans	-63.4	-38.2	179.4	-72.1	175.9	0	0	0	113.1	L498 G504 L505 A506 P512 L515 V516 A519 L543	L498-L502 HydrophobicContact CD1-CD1 3.82Å; L498-L502 HydrophobicContact CD1-CG 4.1Å; L498-L502 HydrophobicContact CG-CD1 3.89Å; L498-L502 WeakPolarHBondContact O-CG 3.4Å; L498-L502 PolarHBondContact O-N 2.71Å; L502-G504 VanDerWaalsContact C-N 3.29Å; L502-G504 PolarHBondContact O-N 3.14Å; L502-L505 HydrophobicContact CD2-CD1 4.4Å; L502-L505 PolarHBondContact O-N 2.84Å; L502-A506 WeakPolarHBondContact O-CB 3.32Å; L502-A506 PolarHBondContact O-N 2.94Å; L502-P512 HydrophobicContact CD2-CG 3.69Å; L502-L515 HydrophobicContact CD1-CB 4.48Å; L502-L515 HydrophobicContact CD2-CB 3.9Å; L502-V516 HydrophobicContact CD2-CG2 4.06Å; L502-A519 HydrophobicContact CD1-CB 3.36Å; L502-L543 HydrophobicContact CB-CD1 4.08Å; L502-L543 HydrophobicContact CB-CD2 4.2Å; L502-L543 HydrophobicContact CD1-CD2 3.82Å
503	L	97.9	Very high	96.1	Very high	4 Å²	4	23.5 Å²	23.5	2%	0.021	12%	0.118	C	C	.	.	H	α-helix	trans	-67.1	-31.5	172.7	-71	176.8	0	0	0	112.5	L499 G501 F507 D539 T542 L543	L499-L503 WeakPolarHBondContact O-CB 3.27Å; L499-L503 VanDerWaalsContact O-CG 3.3Å; L499-L503 WeakPolarHBondContact O-CG 3.42Å; L499-L503 PolarHBondContact O-N 3.23Å; G501-L503 PolarHBondContact O-N 2.88Å; L503-F507 WeakPolarHBondContact O-CD1 3.19Å; L503-F507 WeakPolarHBondContact O-CE1 3.4Å; L503-F507 WeakPolarHBondContact O-CG 3.23Å; L503-F507 PolarHBondContact O-N 3.35Å; L503-D539 HydrophobicContact CD1-CB 3.58Å; L503-D539 VanDerWaalsContact CD1-CG 3.41Å; L503-T542 HydrophobicContact CD2-CG2 3.66Å; L503-L543 HydrophobicContact CD2-CB 4.09Å
504	G	97.1	Very high	96.4	Very high	0 Å²	0	21.4 Å²	21.4	0%	0	11%	0.11	C	C	.	.	H	α-helix	trans	-61	-51.8	168.5	0	0	0	0	0	111.4	A464 T500 G501 L502 A506 F507	A464-G504 WeakPolarHBondContact CB-O 3.4Å; T500-G504 PolarHBondContact O-N 3.18Å; G501-G504 WeakPolarHBondContact O-CA 3.44Å; G501-G504 PolarHBondContact O-N 3.31Å; L502-G504 VanDerWaalsContact C-N 3.29Å; L502-G504 PolarHBondContact O-N 3.14Å; G504-A506 PolarHBondContact O-N 3.44Å; G504-F507 WeakPolarHBondContact O-CB 3.43Å; G504-F507 PolarHBondContact O-N 2.76Å
505	L	98.3	Very high	96.8	Very high	0 Å²	0	20 Å²	20	0%	0	10%	0.104	C	C	.	.	H	α-helix	trans	-60.4	-41.4	179.1	-68.7	165.6	0	0	0	112.3	L460 Y477 T481 G501 L502 F507 V508 S509 Q510 P512	L460-L505 HydrophobicContact CD1-CD1 4.28Å; L460-L505 HydrophobicContact CD1-CG 4.42Å; L460-L505 HydrophobicContact CD2-CD2 3.9Å; L460-L505 HydrophobicContact CD2-CG 4.34Å; Y477-L505 HydrophobicContact CD1-CD2 3.89Å; T481-L505 HydrophobicContact CG2-CD1 4.22Å; G501-L505 PolarHBondContact O-N 3.11Å; L502-L505 HydrophobicContact CD2-CD1 4.4Å; L502-L505 PolarHBondContact O-N 2.84Å; L505-F507 VanDerWaalsContact C-N 3.34Å; L505-F507 PolarHBondContact O-N 2.84Å; L505-V508 CarbonylContact O-C 3.5Å; L505-V508 WeakPolarHBondContact O-CG2 3.28Å; L505-V508 PolarHBondContact O-N 3.33Å; L505-S509 PolarHBondContact O-N 3.21Å; L505-Q510 CarbonylContact C-O 3.49Å; L505-Q510 HydrophobicContact CB-CB 4.03Å; L505-Q510 VanDerWaalsContact CB-O 3.25Å; L505-Q510 WeakPolarHBondContact CB-O 3.27Å; L505-Q510 HydrophobicContact CD2-CB 3.96Å; L505-Q510 PolarHBondContact O-N 3.01Å; L505-P512 HydrophobicContact CD1-CG 3.84Å
506	A	97.9	Very high	97	Very high	0 Å²	0	19.8 Å²	19.8	0%	0	10%	0.103	C	C	.	.	H	α-helix	trans	-61.5	-36.3	175.5	0	0	0	0	0	113.3	L502 G504 V508 S509 Q510 F511 A546 M761 R764	L502-A506 WeakPolarHBondContact O-CB 3.32Å; L502-A506 PolarHBondContact O-N 2.94Å; G504-A506 PolarHBondContact O-N 3.44Å; A506-V508 PolarHBondContact O-N 3.49Å; A506-S509 PolarHBondContact O-N 3.03Å; A506-Q510 PolarHBondContact N-O 2.79Å; A506-F511 HydrophobicContact CB-CE1 3.7Å; A506-F511 HydrophobicContact CB-CZ 3.89Å; A506-A546 HydrophobicContact CB-CB 4.31Å; A506-M761 HydrophobicContact CB-SD 4.36Å; A506-R764 PolarHBondContact O-NH2 3.33Å; A506-R764 VanDerWaalsContact O-NH2 3.17Å
507	F	96.8	Very high	97.3	Very high	20 Å²	20	22.2 Å²	22.2	9%	0.088	12%	0.119	C	C	.	.	H	α-helix	trans	-60.7	-26.3	174.7	-64.6	-9.5	0	0	0	112.8	W461 A464 L503 G504 L505 L758 M761	W461-F507 AromaticContact CD1-CE2 3.95Å; W461-F507 AromaticContact NE1-CE2 3.76Å; A464-F507 HydrophobicContact CB-CB 4.09Å; L503-F507 WeakPolarHBondContact O-CD1 3.19Å; L503-F507 WeakPolarHBondContact O-CE1 3.4Å; L503-F507 WeakPolarHBondContact O-CG 3.23Å; L503-F507 PolarHBondContact O-N 3.35Å; G504-F507 WeakPolarHBondContact O-CB 3.43Å; G504-F507 PolarHBondContact O-N 2.76Å; L505-F507 VanDerWaalsContact C-N 3.34Å; L505-F507 PolarHBondContact O-N 2.84Å; F507-L758 HydrophobicContact CE1-CB 3.88Å; F507-L758 HydrophobicContact CE1-CD1 3.75Å; F507-L758 HydrophobicContact CE1-CG 4.44Å; F507-L758 HydrophobicContact CE2-CB 4.43Å; F507-L758 HydrophobicContact CZ-CB 3.79Å; F507-L758 HydrophobicContact CZ-CD1 4.22Å; F507-M761 HydrophobicContact CD1-CB 4.42Å; F507-M761 HydrophobicContact CD1-SD 3.8Å; F507-M761 HydrophobicContact CE1-SD 4.24Å
508	V	95.8	Very high	97.4	Very high	20 Å²	20	22.9 Å²	22.9	12%	0.121	12%	0.123	C	C	.	.	T	Hydrogen-bonded Turn	trans	-106.4	19.3	175.5	-67.6	0	0	0	0	113.7	A464 L469 Y477 L505 A506 Q510	A464-V508 HydrophobicContact CB-CG1 3.78Å; A464-V508 HydrophobicContact CB-CG2 4.27Å; L469-V508 HydrophobicContact CD2-CB 4.06Å; L469-V508 HydrophobicContact CD2-CG1 3.86Å; Y477-V508 HydrophobicContact CD1-CG2 4.33Å; Y477-V508 HydrophobicContact CE1-CG2 3.83Å; L505-V508 CarbonylContact O-C 3.5Å; L505-V508 WeakPolarHBondContact O-CG2 3.28Å; L505-V508 PolarHBondContact O-N 3.33Å; A506-V508 PolarHBondContact O-N 3.49Å; V508-Q510 VanDerWaalsContact C-N 3.31Å; V508-Q510 HydrophobicContact CG2-CB 4.47Å; V508-Q510 HydrophobicContact CG2-CG 4.2Å; V508-Q510 PolarHBondContact O-N 3.26Å
509	S	96.1	Very high	97.4	Very high	61 Å²	61	22.9 Å²	22.9	43%	0.427	12%	0.123	S	C	.	.	T	Hydrogen-bonded Turn	trans	66	24.6	176.6	-11.1	0	0	0	0	114.9	L505 A506 E550 R764	L505-S509 PolarHBondContact O-N 3.21Å; A506-S509 PolarHBondContact O-N 3.03Å; S509-E550 WeakPolarHBondContact CB-OE2 3.44Å; S509-R764 PolarHBondContact OG-NH1 3.29Å; S509-R764 PolarHBondContact OG-NH2 3.26Å
510	Q	96.5	Very high	97.5	Very high	64 Å²	64	23 Å²	23	30%	0.299	12%	0.123	S	C	.	.			trans	-106.4	129.3	179.5	-65.7	178.7	28.3	0	0	110.9	L505 A506 V508	L505-Q510 CarbonylContact C-O 3.49Å; L505-Q510 HydrophobicContact CB-CB 4.03Å; L505-Q510 VanDerWaalsContact CB-O 3.25Å; L505-Q510 WeakPolarHBondContact CB-O 3.27Å; L505-Q510 HydrophobicContact CD2-CB 3.96Å; L505-Q510 PolarHBondContact O-N 3.01Å; A506-Q510 PolarHBondContact N-O 2.79Å; V508-Q510 VanDerWaalsContact C-N 3.31Å; V508-Q510 HydrophobicContact CG2-CB 4.47Å; V508-Q510 HydrophobicContact CG2-CG 4.2Å; V508-Q510 PolarHBondContact O-N 3.26Å
511	F	97.3	Very high	97.5	Very high	27 Å²	27	23.8 Å²	23.8	12%	0.118	13%	0.129	C	C	.	.			trans	-134.9	91	-178.4	-60.9	-89.1	0	0	0	110.5	A506 E513 V516 A546 V547 E550 L551	A506-F511 HydrophobicContact CB-CE1 3.7Å; A506-F511 HydrophobicContact CB-CZ 3.89Å; F511-E513 PolarHBondContact O-N 2.99Å; F511-V516 HydrophobicContact CB-CG2 4.38Å; F511-A546 HydrophobicContact CE1-CB 4Å; F511-A546 HydrophobicContact CZ-CB 4.16Å; F511-V547 HydrophobicContact CD1-CG2 3.94Å; F511-V547 HydrophobicContact CE1-CG2 4.15Å; F511-E550 HydrophobicContact CD2-CB 4.44Å; F511-E550 HydrophobicContact CE2-CB 3.59Å; F511-E550 VanDerWaalsContact CE2-CD 3.48Å; F511-E550 HydrophobicContact CE2-CG 4.12Å; F511-E550 VanDerWaalsContact CE2-OE2 3.28Å; F511-E550 WeakPolarHBondContact CE2-OE2 3.14Å; F511-E550 HydrophobicContact CZ-CB 3.81Å; F511-E550 VanDerWaalsContact CZ-CD 3.46Å; F511-E550 HydrophobicContact CZ-CG 4.07Å; F511-L551 HydrophobicContact CB-CD1 3.66Å; F511-L551 HydrophobicContact CB-CD2 4.28Å; F511-L551 HydrophobicContact CB-CG 4.17Å; F511-L551 HydrophobicContact CD2-CD2 4.26Å; F511-L551 HydrophobicContact CD2-CG 4.26Å; F511-L551 HydrophobicContact CG-CD1 4.04Å; F511-L551 HydrophobicContact CG-CD2 4.44Å; F511-L551 HydrophobicContact CG-CG 4.14Å
512	P	97.4	Very high	97.5	Very high	13 Å²	13	28 Å²	28	8%	0.084	16%	0.156	C	C	.	.			trans	-67.7	97.8	171.3	26.9	-33.6	0	0	0	109.8	T481 L502 L505 D514 L515 V516	T481-P512 HydrophobicContact CG2-CB 3.82Å; T481-P512 HydrophobicContact CG2-CG 3.82Å; L502-P512 HydrophobicContact CD2-CG 3.69Å; L505-P512 HydrophobicContact CD1-CG 3.84Å; P512-D514 PolarHBondContact O-N 3.01Å; P512-D514 VanDerWaalsContact O-N 3.09Å; P512-L515 HydrophobicContact CB-CB 4.33Å; P512-L515 HydrophobicContact CB-CD1 4.27Å; P512-L515 HydrophobicContact CB-CG 4.43Å; P512-L515 HydrophobicContact CG-CB 4.08Å; P512-L515 HydrophobicContact CG-CD1 4.01Å; P512-L515 HydrophobicContact CG-CG 4.45Å; P512-L515 PolarHBondContact O-N 3.43Å; P512-V516 WeakPolarHBondContact O-CG2 3.39Å; P512-V516 PolarHBondContact O-N 3.19Å
513	E	97.3	Very high	97.4	Very high	118 Å²	118	34 Å²	34	55%	0.551	18%	0.184	S	C	*	.	H	α-helix	trans	-53.1	-33.7	-170.9	-67.3	-168.1	-136.4	0	0	114.1	F511 V516 T517 L551 W554	F511-E513 PolarHBondContact O-N 2.99Å; E513-V516 PolarHBondContact O-N 3.11Å; E513-T517 WeakPolarHBondContact O-CB 3.39Å; E513-T517 PolarHBondContact O-N 2.9Å; E513-T517 PolarHBondContact O-OG1 3.42Å; E513-L551 HydrophobicContact CG-CD1 4.46Å; E513-W554 HydrophobicContact CB-CZ3 3.84Å; E513-W554 HydrophobicContact CG-CE3 4.4Å; E513-W554 HydrophobicContact CG-CZ3 3.87Å
514	D	97.2	Very high	97.3	Very high	65 Å²	65	34 Å²	34	35%	0.348	18%	0.184	S	C	.	.	H	α-helix	trans	-68.1	-32.7	177.2	64.8	-63.1	0	0	0	113.6	R485 P512 L518	R485-D514 WeakPolarHBondContact CD-OD2 3.47Å; R485-D514 WeakPolarHBondContact CG-OD2 3.33Å; R485-D514 IonicContact CZ-OD1 2.71Å; R485-D514 IonicContact CZ-OD2 2.79Å; R485-D514 VanDerWaalsContact NE-CG 3.34Å; R485-D514 IonicContact NE-OD1 2.74Å; R485-D514 PolarHBondContact NE-OD1 3.06Å; R485-D514 VanDerWaalsContact NE-OD1 3.14Å; R485-D514 IonicContact NE-OD2 3.19Å; R485-D514 PolarHBondContact NE-OD2 3.33Å; R485-D514 IonicContact NH2-OD1 3.16Å; R485-D514 PolarHBondContact NH2-OD1 2.91Å; R485-D514 IonicContact NH2-OD2 3.89Å; P512-D514 PolarHBondContact O-N 3.01Å; P512-D514 VanDerWaalsContact O-N 3.09Å; D514-L518 PolarHBondContact O-N 3.04Å
515	L	98.3	Very high	97.3	Very high	1 Å²	1	34.9 Å²	34.9	1%	0.005	19%	0.189	C	C	.	.	H	α-helix	trans	-86.6	-33.4	175.7	-66.5	-179.1	0	0	0	111.7	T481 L484 R485 L498 L502 P512 L518 A519	T481-L515 HydrophobicContact CG2-CD1 4.07Å; L484-L515 HydrophobicContact CB-CD1 3.94Å; R485-L515 HydrophobicContact CG-CD1 4.02Å; R485-L515 HydrophobicContact CG-CD2 4.07Å; R485-L515 HydrophobicContact CG-CG 4.06Å; L498-L515 HydrophobicContact CD1-CB 4.24Å; L498-L515 HydrophobicContact CD1-CD2 4.27Å; L502-L515 HydrophobicContact CD1-CB 4.48Å; L502-L515 HydrophobicContact CD2-CB 3.9Å; P512-L515 HydrophobicContact CB-CB 4.33Å; P512-L515 HydrophobicContact CB-CD1 4.27Å; P512-L515 HydrophobicContact CB-CG 4.43Å; P512-L515 HydrophobicContact CG-CB 4.08Å; P512-L515 HydrophobicContact CG-CD1 4.01Å; P512-L515 HydrophobicContact CG-CG 4.45Å; P512-L515 PolarHBondContact O-N 3.43Å; L515-L518 WeakPolarHBondContact O-CB 3.44Å; L515-L518 PolarHBondContact O-N 3.19Å; L515-A519 WeakPolarHBondContact O-CB 3.29Å; L515-A519 PolarHBondContact O-N 3.28Å
516	V	98.3	Very high	97.1	Very high	0 Å²	0	40.6 Å²	40.6	0%	0	22%	0.216	C	C	.	.	H	α-helix	trans	-65.5	-43.1	171.9	176.8	0	0	0	0	110.5	L502 F511 P512 E513 L518 A519 L520 V547 W554	L502-V516 HydrophobicContact CD2-CG2 4.06Å; F511-V516 HydrophobicContact CB-CG2 4.38Å; P512-V516 WeakPolarHBondContact O-CG2 3.39Å; P512-V516 PolarHBondContact O-N 3.19Å; E513-V516 PolarHBondContact O-N 3.11Å; V516-L518 VanDerWaalsContact C-N 3.26Å; V516-L518 PolarHBondContact O-N 3.49Å; V516-A519 PolarHBondContact O-N 3.04Å; V516-A519 VanDerWaalsContact O-N 3.12Å; V516-L520 HydrophobicContact CG1-CD1 3.97Å; V516-L520 HydrophobicContact CG1-CG 4.43Å; V516-L520 PolarHBondContact O-N 3.15Å; V516-V547 HydrophobicContact CG1-CG1 4.45Å; V516-V547 HydrophobicContact CG1-CG2 3.53Å; V516-W554 HydrophobicContact CB-CH2 3.79Å; V516-W554 HydrophobicContact CB-CZ2 4.38Å; V516-W554 HydrophobicContact CB-CZ3 4.34Å; V516-W554 HydrophobicContact CG1-CH2 3.51Å; V516-W554 HydrophobicContact CG1-CZ2 3.65Å; V516-W554 HydrophobicContact CG1-CZ3 4.16Å
517	T	98.3	Very high	96.9	Very high	59 Å²	59	42.5 Å²	42.5	36%	0.362	23%	0.226	S	C	.	.	H	α-helix	trans	-56.8	-41.8	174.3	-65.1	0	0	0	0	111.1	E513 S521 W554 P557	E513-T517 WeakPolarHBondContact O-CB 3.39Å; E513-T517 PolarHBondContact O-N 2.9Å; E513-T517 PolarHBondContact O-OG1 3.42Å; T517-S521 WeakPolarHBondContact O-CB 3.42Å; T517-S521 PolarHBondContact O-N 3.25Å; T517-W554 WeakPolarHBondContact OG1-CH2 3.45Å; T517-P557 HydrophobicContact CG2-CG 4.17Å; T517-P557 VanDerWaalsContact O-CG 3.29Å; T517-P557 WeakPolarHBondContact O-CG 3.41Å
518	L	97.9	Very high	96.6	Very high	27 Å²	27	41.6 Å²	41.6	14%	0.141	22%	0.222	C	C	.	.	H	α-helix	trans	-65.4	-48	174.2	176	64.9	0	0	0	111.9	K488 F491 L498 D514 L515 V516 L520 S521 F524	K488-L518 HydrophobicContact CD-CD2 3.9Å; K488-L518 HydrophobicContact CG-CD2 3.75Å; F491-L518 HydrophobicContact CD2-CD2 4.11Å; L498-L518 HydrophobicContact CD2-CB 4.39Å; L498-L518 HydrophobicContact CD2-CD2 3.64Å; L498-L518 HydrophobicContact CD2-CG 3.8Å; D514-L518 PolarHBondContact O-N 3.04Å; L515-L518 WeakPolarHBondContact O-CB 3.44Å; L515-L518 PolarHBondContact O-N 3.19Å; V516-L518 VanDerWaalsContact C-N 3.26Å; V516-L518 PolarHBondContact O-N 3.49Å; L518-L520 VanDerWaalsContact C-N 3.31Å; L518-L520 PolarHBondContact O-N 3.11Å; L518-S521 PolarHBondContact O-N 2.83Å; L518-F524 WeakPolarHBondContact O-CB 2.89Å; L518-F524 WeakPolarHBondContact O-CG 3.45Å
519	A	97.7	Very high	96.3	Very high	0 Å²	0	43.7 Å²	43.7	0%	0	23%	0.232	C	C	.	.	H	α-helix	trans	-70.2	-24.6	-173.9	0	0	0	0	0	114.4	L498 L499 L502 L515 V516 F524 L540 L543	L498-A519 HydrophobicContact CD2-CB 3.83Å; L498-A519 HydrophobicContact CG-CB 4.14Å; L499-A519 HydrophobicContact CD2-CB 4.01Å; L502-A519 HydrophobicContact CD1-CB 3.36Å; L515-A519 WeakPolarHBondContact O-CB 3.29Å; L515-A519 PolarHBondContact O-N 3.28Å; V516-A519 PolarHBondContact O-N 3.04Å; V516-A519 VanDerWaalsContact O-N 3.12Å; A519-F524 VanDerWaalsContact O-CD1 3.24Å; A519-F524 WeakPolarHBondContact O-CD1 3.47Å; A519-L540 WeakPolarHBondContact O-CD2 3.37Å; A519-L543 HydrophobicContact CB-CD2 3.75Å
520	L	98	Very high	95.9	Very high	1 Å²	1	50.4 Å²	50.4	1%	0.005	25%	0.248	C	C	.	.	T	Hydrogen-bonded Turn	trans	-101.6	3.4	176.1	-59.9	-179	0	0	0	113	V516 L518 L540 L543 D544 V547 P557 L559	V516-L520 HydrophobicContact CG1-CD1 3.97Å; V516-L520 HydrophobicContact CG1-CG 4.43Å; V516-L520 PolarHBondContact O-N 3.15Å; L518-L520 VanDerWaalsContact C-N 3.31Å; L518-L520 PolarHBondContact O-N 3.11Å; L520-L540 HydrophobicContact CD2-CD2 4.45Å; L520-L543 HydrophobicContact CD2-CD2 4.21Å; L520-L543 HydrophobicContact CD2-CG 4.38Å; L520-L543 HydrophobicContact CG-CD2 4.42Å; L520-D544 HydrophobicContact CD2-CB 4.14Å; L520-V547 HydrophobicContact CD1-CG2 4.4Å; L520-P557 HydrophobicContact CB-CG 4.26Å; L520-P557 WeakPolarHBondContact O-CB 3.49Å; L520-L559 HydrophobicContact CD2-CD2 4.22Å; L520-L559 HydrophobicContact CD2-CG 4.36Å
521	S	97.7	Very high	95	Very high	17 Å²	17	49.7 Å²	49.7	12%	0.119	25%	0.246	C	C	.	.	S	Bend	trans	-65.3	146.7	178.2	103.4	0	0	0	0	111.3	T517 L518 E523 F524 V525	T517-S521 WeakPolarHBondContact O-CB 3.42Å; T517-S521 PolarHBondContact O-N 3.25Å; L518-S521 PolarHBondContact O-N 2.83Å; S521-E523 VanDerWaalsContact CB-OE2 3.25Å; S521-E523 WeakPolarHBondContact CB-OE2 3.5Å; S521-E523 PolarHBondContact O-N 3.48Å; S521-E523 VanDerWaalsContact O-N 3.17Å; S521-E523 PolarHBondContact OG-N 2.96Å; S521-E523 PolarHBondContact OG-OE2 3.39Å; S521-F524 PolarHBondContact O-N 3.1Å; S521-F524 VanDerWaalsContact O-N 3.12Å; S521-F524 PolarHBondContact OG-N 2.59Å; S521-V525 WeakPolarHBondContact O-CB 3Å; S521-V525 VanDerWaalsContact O-CG2 3.32Å; S521-V525 WeakPolarHBondContact O-CG2 3.43Å; S521-V525 PolarHBondContact O-N 3.37Å
522	P	96.8	Very high	93.5	Very high	88 Å²	88	54 Å²	54	57%	0.571	28%	0.28	S	S	*	.	H	α-helix	trans	-54.7	-36.4	179.6	-26.7	35.6	0	0	0	113.5	H526	P522-H526 VanDerWaalsContact O-CB 3.27Å; P522-H526 WeakPolarHBondContact O-CB 3.19Å; P522-H526 PolarHBondContact O-N 2.98Å
523	E	95.9	Very high	92.1	Very high	129 Å²	129	59.5 Å²	59.5	60%	0.603	30%	0.302	S	S	*	.	H	α-helix	trans	-67.9	-44.6	179.4	-52.2	70.1	-149.9	0	0	111.2	S521 L527	S521-E523 VanDerWaalsContact CB-OE2 3.25Å; S521-E523 WeakPolarHBondContact CB-OE2 3.5Å; S521-E523 PolarHBondContact O-N 3.48Å; S521-E523 VanDerWaalsContact O-N 3.17Å; S521-E523 PolarHBondContact OG-N 2.96Å; S521-E523 PolarHBondContact OG-OE2 3.39Å; E523-L527 WeakPolarHBondContact O-CB 3.19Å; E523-L527 PolarHBondContact O-N 3.49Å
524	F	96.4	Very high	90.9	Very high	4 Å²	4	54.3 Å²	54.3	2%	0.018	28%	0.278	C	S	.	.	H	α-helix	trans	-72.7	-38.9	179	-170.7	-87.6	0	0	0	112.1	F491 P495 L498 L499 L518 A519 S521 L527 A528	F491-F524 HydrophobicContact CB-CE2 4.07Å; P495-F524 HydrophobicContact CB-CE1 4.35Å; P495-F524 HydrophobicContact CB-CE2 3.79Å; P495-F524 HydrophobicContact CB-CZ 3.51Å; L498-F524 HydrophobicContact CB-CZ 4.07Å; L498-F524 HydrophobicContact CD2-CD2 4.34Å; L498-F524 HydrophobicContact CD2-CE1 4.33Å; L498-F524 HydrophobicContact CD2-CE2 3.83Å; L498-F524 HydrophobicContact CD2-CZ 3.81Å; L498-F524 HydrophobicContact CG-CZ 4.42Å; L499-F524 HydrophobicContact CD1-CE1 4.22Å; L499-F524 HydrophobicContact CD2-CE1 4.15Å; L499-F524 HydrophobicContact CG-CE1 4.02Å; L499-F524 HydrophobicContact CG-CZ 4.49Å; L518-F524 WeakPolarHBondContact O-CB 2.89Å; L518-F524 WeakPolarHBondContact O-CG 3.45Å; A519-F524 VanDerWaalsContact O-CD1 3.24Å; A519-F524 WeakPolarHBondContact O-CD1 3.47Å; S521-F524 PolarHBondContact O-N 3.1Å; S521-F524 VanDerWaalsContact O-N 3.12Å; S521-F524 PolarHBondContact OG-N 2.59Å; F524-L527 HydrophobicContact CD2-CD2 4.29Å; F524-L527 HydrophobicContact CE2-CD2 4.39Å; F524-L527 WeakPolarHBondContact O-CB 3.13Å; F524-L527 PolarHBondContact O-N 3.4Å; F524-A528 HydrophobicContact CE1-CB 4.38Å; F524-A528 VanDerWaalsContact O-CB 3.31Å; F524-A528 WeakPolarHBondContact O-CB 3.43Å; F524-A528 PolarHBondContact O-N 3.03Å
525	V	96.4	Very high	90.1	Very high	18 Å²	18	58 Å²	58	11%	0.109	29%	0.294	C	S	.	.	H	α-helix	trans	-58.7	-51.2	172.2	172.2	0	0	0	0	109.2	S521 L527 A528 L529 L540 L559 L563	S521-V525 WeakPolarHBondContact O-CB 3Å; S521-V525 VanDerWaalsContact O-CG2 3.32Å; S521-V525 WeakPolarHBondContact O-CG2 3.43Å; S521-V525 PolarHBondContact O-N 3.37Å; V525-L527 PolarHBondContact O-N 2.75Å; V525-A528 PolarHBondContact O-N 2.8Å; V525-L529 HydrophobicContact CG1-CD1 3.95Å; V525-L529 HydrophobicContact CG1-CG 4.2Å; V525-L529 WeakPolarHBondContact O-CB 3.21Å; V525-L529 VanDerWaalsContact O-CG 3.24Å; V525-L529 WeakPolarHBondContact O-CG 3.48Å; V525-L529 PolarHBondContact O-N 3.31Å; V525-L540 HydrophobicContact CG1-CD1 4.35Å; V525-L540 HydrophobicContact CG2-CD1 4.47Å; V525-L540 HydrophobicContact CG2-CD2 4.25Å; V525-L559 HydrophobicContact CG1-CD2 4.19Å; V525-L559 HydrophobicContact CG2-CD2 3.58Å; V525-L563 HydrophobicContact CG1-CD2 3.94Å
526	H	94.8	Very high	89.7	Confident	120 Å²	120	58.2 Å²	58.2	56%	0.556	30%	0.295	S	S	*	.	H	α-helix	trans	-59.4	-41.8	177.2	177.8	-110.9	0	0	0	112.9	P522 L529 R530	P522-H526 VanDerWaalsContact O-CB 3.27Å; P522-H526 WeakPolarHBondContact O-CB 3.19Å; P522-H526 PolarHBondContact O-N 2.98Å; H526-L529 PolarHBondContact O-N 3.1Å; H526-R530 VanDerWaalsContact O-CB 3.3Å; H526-R530 WeakPolarHBondContact O-CB 3.44Å; H526-R530 PolarHBondContact O-N 3Å
527	L	93.2	Very high	89.3	Confident	41 Å²	41	61.3 Å²	61.3	22%	0.215	31%	0.308	C	S	.	.	H	α-helix	trans	-57.4	-49.7	173	173	67.6	0	0	0	112	P495 E523 F524 V525 L529 R530	P495-L527 HydrophobicContact CB-CD2 4.19Å; P495-L527 HydrophobicContact CB-CG 4.46Å; P495-L527 HydrophobicContact CG-CD2 4.47Å; P495-L527 HydrophobicContact CG-CG 4.4Å; E523-L527 WeakPolarHBondContact O-CB 3.19Å; E523-L527 PolarHBondContact O-N 3.49Å; F524-L527 HydrophobicContact CD2-CD2 4.29Å; F524-L527 HydrophobicContact CE2-CD2 4.39Å; F524-L527 WeakPolarHBondContact O-CB 3.13Å; F524-L527 PolarHBondContact O-N 3.4Å; V525-L527 PolarHBondContact O-N 2.75Å; L527-L529 VanDerWaalsContact C-N 3.35Å; L527-L529 PolarHBondContact O-N 3.43Å; L527-R530 PolarHBondContact O-N 2.98Å
528	A	90.6	Very high	89	Confident	1 Å²	1	61 Å²	61	1%	0.008	30%	0.302	C	S	.	.	H	α-helix	trans	-67.4	-32.8	-178.5	0	0	0	0	0	112.8	F524 V525 L536 L540	F524-A528 HydrophobicContact CE1-CB 4.38Å; F524-A528 VanDerWaalsContact O-CB 3.31Å; F524-A528 WeakPolarHBondContact O-CB 3.43Å; F524-A528 PolarHBondContact O-N 3.03Å; V525-A528 PolarHBondContact O-N 2.8Å; A528-L536 HydrophobicContact CB-CB 4.07Å; A528-L536 HydrophobicContact CB-CD1 3.81Å; A528-L540 HydrophobicContact CB-CD1 4.02Å
529	L	90.3	Very high	88.9	Confident	64 Å²	64	60.4 Å²	60.4	34%	0.335	30%	0.299	S	S	.	.	H	α-helix	trans	-75.2	-33.6	175.2	-67.5	-173	0	0	0	113.3	V525 H526 L527 N531 K537 L540 L563	V525-L529 HydrophobicContact CG1-CD1 3.95Å; V525-L529 HydrophobicContact CG1-CG 4.2Å; V525-L529 WeakPolarHBondContact O-CB 3.21Å; V525-L529 VanDerWaalsContact O-CG 3.24Å; V525-L529 WeakPolarHBondContact O-CG 3.48Å; V525-L529 PolarHBondContact O-N 3.31Å; H526-L529 PolarHBondContact O-N 3.1Å; L527-L529 VanDerWaalsContact C-N 3.35Å; L527-L529 PolarHBondContact O-N 3.43Å; L529-N531 VanDerWaalsContact C-N 3.3Å; L529-N531 PolarHBondContact O-N 3.32Å; L529-K537 HydrophobicContact CD2-CD 4.12Å; L529-K537 HydrophobicContact CD2-CG 3.33Å; L529-L540 HydrophobicContact CD2-CD1 4.45Å; L529-L563 HydrophobicContact CD1-CD1 4.29Å; L529-L563 HydrophobicContact CD1-CD2 4.07Å; L529-L563 HydrophobicContact CD2-CD1 4.38Å
530	R	87.8	Confident	88.8	Confident	202 Å²	202	60.4 Å²	60.4	76%	0.762	30%	0.299	S	S	*	.	H	α-helix	trans	-69.7	-24.8	-177.3	-171.7	175.9	-177.3	-168.1	2.8	113.2	H526 L527 S532	H526-R530 VanDerWaalsContact O-CB 3.3Å; H526-R530 WeakPolarHBondContact O-CB 3.44Å; H526-R530 PolarHBondContact O-N 3Å; L527-R530 PolarHBondContact O-N 2.98Å; R530-S532 PolarHBondContact O-N 3.17Å; R530-S532 VanDerWaalsContact O-N 3.17Å
531	N	77	Confident	88.8	Confident	49 Å²	49	61.1 Å²	61.1	26%	0.262	30%	0.302	S	S	.	.			trans	-86.3	82.8	-178.3	-167.9	-10.6	0	0	0	112	L529 K533 L534	L529-N531 VanDerWaalsContact C-N 3.3Å; L529-N531 PolarHBondContact O-N 3.32Å; N531-K533 PolarHBondContact O-N 3.11Å; N531-K533 PolarHBondContact OD1-N 3.42Å; N531-L534 HydrophobicContact CB-CD1 4.47Å; N531-L534 VanDerWaalsContact ND2-CD1 3.26Å; N531-L534 WeakPolarHBondContact ND2-CD1 3.45Å; N531-L534 PolarHBondContact O-N 3.01Å
532	S	65.5	Low	88.7	Confident	118 Å²	118	60.4 Å²	60.4	83%	0.825	30%	0.296	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.7	-4.8	-179.2	60.2	0	0	0	0	116.3	R530	R530-S532 PolarHBondContact O-N 3.17Å; R530-S532 VanDerWaalsContact O-N 3.17Å
533	K	68.9	Low	88.8	Confident	127 Å²	127	56.2 Å²	56.2	55%	0.552	27%	0.269	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.4	-12.9	172.8	-62.5	172.1	-177	167.7	0	113	N531	N531-K533 PolarHBondContact O-N 3.11Å; N531-K533 PolarHBondContact OD1-N 3.42Å
534	L	71.4	Confident	88.9	Confident	9 Å²	9	50.2 Å²	50.2	5%	0.047	24%	0.241	C	C	.	.	S	Bend	trans	-123.4	114.8	-177	-53.5	176.5	0	0	0	109.7	L102 P495 E496 N531 L536	L102-L534 HydrophobicContact CD2-CD2 3.75Å; P495-L534 HydrophobicContact CG-CD1 4.48Å; E496-L534 HydrophobicContact CB-CD1 4.28Å; N531-L534 HydrophobicContact CB-CD1 4.47Å; N531-L534 VanDerWaalsContact ND2-CD1 3.26Å; N531-L534 WeakPolarHBondContact ND2-CD1 3.45Å; N531-L534 PolarHBondContact O-N 3.01Å; L534-L536 HydrophobicContact CB-CD1 4.11Å; L534-L536 HydrophobicContact CB-CD2 4.22Å; L534-L536 HydrophobicContact CB-CG 3.79Å; L534-L536 HydrophobicContact CD1-CD1 4.22Å; L534-L536 PolarHBondContact O-N 3.5Å
535	E	81.1	Confident	88.9	Confident	143 Å²	143	50.8 Å²	50.8	67%	0.668	25%	0.247	S	C	*	.			trans	-77.2	60.6	179	-73.3	-170.2	-153.8	0	0	113.1	K537 K538	E535-K537 VanDerWaalsContact C-N 3.31Å; E535-K537 PolarHBondContact O-N 3.2Å; E535-K538 IonicContact OE2-NZ 3.51Å; E535-K538 PolarHBondContact OE2-NZ 2.97Å
536	L	89.3	Confident	89	Confident	5 Å²	5	49.9 Å²	49.9	3%	0.026	24%	0.242	C	C	.	.	H	α-helix	trans	-76.4	-13.3	-174	-58.5	-178.5	0	0	0	114.2	P495 E496 L499 A528 L534 K538 D539 L540	P495-L536 HydrophobicContact CB-CD1 4.18Å; P495-L536 HydrophobicContact CG-CD1 4.04Å; E496-L536 HydrophobicContact CB-CD1 4.43Å; E496-L536 HydrophobicContact CB-CD2 3.87Å; L499-L536 HydrophobicContact CD1-CB 3.97Å; L499-L536 HydrophobicContact CD1-CD1 4.21Å; L499-L536 HydrophobicContact CD1-CD2 4.21Å; L499-L536 HydrophobicContact CD1-CG 4.34Å; A528-L536 HydrophobicContact CB-CB 4.07Å; A528-L536 HydrophobicContact CB-CD1 3.81Å; L534-L536 HydrophobicContact CB-CD1 4.11Å; L534-L536 HydrophobicContact CB-CD2 4.22Å; L534-L536 HydrophobicContact CB-CG 3.79Å; L534-L536 HydrophobicContact CD1-CD1 4.22Å; L534-L536 PolarHBondContact O-N 3.5Å; L536-K538 VanDerWaalsContact C-N 3.28Å; L536-K538 PolarHBondContact O-N 3.4Å; L536-D539 PolarHBondContact O-N 2.78Å; L536-D539 VanDerWaalsContact O-N 3.11Å; L536-L540 PolarHBondContact O-N 2.9Å
537	K	91.6	Very high	89.2	Confident	66 Å²	66	44.2 Å²	44.2	29%	0.287	22%	0.215	S	C	.	.	H	α-helix	trans	-48.3	-48.5	174.2	-81.4	-164.9	-178.2	-164.4	0	112.7	L529 E535 F541 L563 E566 V567	L529-K537 HydrophobicContact CD2-CD 4.12Å; L529-K537 HydrophobicContact CD2-CG 3.33Å; E535-K537 VanDerWaalsContact C-N 3.31Å; E535-K537 PolarHBondContact O-N 3.2Å; K537-F541 WeakPolarHBondContact O-CB 3.38Å; K537-F541 PolarHBondContact O-N 3.27Å; K537-L563 HydrophobicContact CD-CD1 4.28Å; K537-L563 HydrophobicContact CG-CD1 4.47Å; K537-E566 IonicContact NZ-OE1 2.72Å; K537-E566 PolarHBondContact NZ-OE1 3.1Å; K537-E566 IonicContact NZ-OE2 2.87Å; K537-E566 PolarHBondContact NZ-OE2 2.93Å; K537-V567 HydrophobicContact CB-CG2 3.9Å; K537-V567 HydrophobicContact CD-CG2 4.11Å; K537-V567 HydrophobicContact CG-CG2 4.35Å
538	K	91.9	Very high	89.3	Confident	53 Å²	53	44.3 Å²	44.3	23%	0.23	22%	0.222	C	C	.	.	H	α-helix	trans	-67.2	-37.5	-177.2	-64.7	166.9	-179.7	164.4	0	111.4	E535 L536 T542 M570 L571 R612	E535-K538 IonicContact OE2-NZ 3.51Å; E535-K538 PolarHBondContact OE2-NZ 2.97Å; L536-K538 VanDerWaalsContact C-N 3.28Å; L536-K538 PolarHBondContact O-N 3.4Å; K538-T542 PolarHBondContact O-N 3.08Å; K538-T542 PolarHBondContact O-OG1 2.66Å; K538-M570 WeakPolarHBondContact CE-SD 3.37Å; K538-M570 HydrophobicContact CG-CE 4.03Å; K538-L571 HydrophobicContact CD-CD2 4.49Å; K538-L571 HydrophobicContact CG-CD2 4.38Å; K538-R612 PolarHBondContact O-NH2 2.8Å
539	D	94.1	Very high	89.6	Confident	13 Å²	13	46.6 Å²	46.6	7%	0.07	23%	0.234	C	C	.	.	H	α-helix	trans	-77.1	-38.4	-178.1	-82	16.2	0	0	0	112	L503 L536 T542 L543 R612	L503-D539 HydrophobicContact CD1-CB 3.58Å; L503-D539 VanDerWaalsContact CD1-CG 3.41Å; L536-D539 PolarHBondContact O-N 2.78Å; L536-D539 VanDerWaalsContact O-N 3.11Å; D539-T542 PolarHBondContact O-N 3Å; D539-L543 PolarHBondContact O-N 3.34Å; D539-R612 IonicContact OD1-CZ 3.6Å; D539-R612 IonicContact OD1-NH1 3.53Å; D539-R612 PolarHBondContact OD1-NH1 2.97Å; D539-R612 VanDerWaalsContact OD1-NH1 3.09Å; D539-R612 IonicContact OD1-NH2 3.56Å; D539-R612 PolarHBondContact OD1-NH2 3.45Å
540	L	96.7	Very high	89.9	Confident	0 Å²	0	45.1 Å²	45.1	0%	0	23%	0.225	C	C	.	.	H	α-helix	trans	-57.9	-48.3	168.1	-77.3	169.4	0	0	0	111.5	L499 A519 L520 V525 A528 L529 L536 T542 L543 D544 L559	L499-L540 HydrophobicContact CD1-CD2 4.02Å; L499-L540 HydrophobicContact CD1-CG 3.91Å; L499-L540 HydrophobicContact CD2-CD2 3.75Å; L499-L540 HydrophobicContact CD2-CG 4.4Å; A519-L540 WeakPolarHBondContact O-CD2 3.37Å; L520-L540 HydrophobicContact CD2-CD2 4.45Å; V525-L540 HydrophobicContact CG1-CD1 4.35Å; V525-L540 HydrophobicContact CG2-CD1 4.47Å; V525-L540 HydrophobicContact CG2-CD2 4.25Å; A528-L540 HydrophobicContact CB-CD1 4.02Å; L529-L540 HydrophobicContact CD2-CD1 4.45Å; L536-L540 PolarHBondContact O-N 2.9Å; L540-T542 VanDerWaalsContact C-N 3.35Å; L540-T542 PolarHBondContact O-N 3.01Å; L540-L543 PolarHBondContact O-N 3.36Å; L540-L543 VanDerWaalsContact O-N 3.15Å; L540-D544 WeakPolarHBondContact O-CB 3.26Å; L540-D544 PolarHBondContact O-N 3.43Å; L540-L559 HydrophobicContact CB-CD1 4.11Å; L540-L559 HydrophobicContact CB-CD2 4.42Å
541	F	96.9	Very high	90.2	Very high	17 Å²	17	37.4 Å²	37.4	8%	0.075	20%	0.199	C	C	.	.	H	α-helix	trans	-64.1	-37.5	179.6	-177.7	-125.5	0	0	0	112.7	K537 A545 R564 V567 A568 L571 P609 H610	K537-F541 WeakPolarHBondContact O-CB 3.38Å; K537-F541 PolarHBondContact O-N 3.27Å; F541-A545 WeakPolarHBondContact O-CB 3.2Å; F541-A545 PolarHBondContact O-N 3.02Å; F541-R564 HydrophobicContact CD2-CB 4.3Å; F541-R564 HydrophobicContact CD2-CG 4.09Å; F541-R564 HydrophobicContact CE2-CB 3.96Å; F541-R564 HydrophobicContact CE2-CG 4.14Å; F541-V567 HydrophobicContact CB-CB 4.33Å; F541-V567 HydrophobicContact CB-CG1 3.72Å; F541-V567 HydrophobicContact CD1-CB 4.24Å; F541-V567 HydrophobicContact CD1-CG1 3.51Å; F541-V567 HydrophobicContact CE1-CG1 4.25Å; F541-V567 HydrophobicContact CG-CB 4.19Å; F541-V567 HydrophobicContact CG-CG1 3.74Å; F541-A568 HydrophobicContact CE1-CB 4.4Å; F541-A568 HydrophobicContact CZ-CB 3.98Å; F541-L571 HydrophobicContact CD1-CD1 3.92Å; F541-L571 HydrophobicContact CE1-CD1 4Å; F541-P609 HydrophobicContact CE1-CB 3.98Å; F541-P609 HydrophobicContact CZ-CB 4.13Å; F541-H610 HydrophobicContact CD1-CB 3.83Å; F541-H610 HydrophobicContact CE1-CB 3.79Å; F541-H610 HydrophobicContact CG-CB 4.36Å; F541-H610 HydrophobicContact CZ-CB 4.26Å
542	T	97.1	Very high	90.7	Very high	1 Å²	1	40.5 Å²	40.5	1%	0.006	22%	0.222	C	C	.	.	H	α-helix	trans	-63.7	-38	171.7	-56.6	0	0	0	0	112.6	L503 K538 D539 L540 A546 H610 R612 L758 M761	L503-T542 HydrophobicContact CD2-CG2 3.66Å; K538-T542 PolarHBondContact O-N 3.08Å; K538-T542 PolarHBondContact O-OG1 2.66Å; D539-T542 PolarHBondContact O-N 3Å; L540-T542 VanDerWaalsContact C-N 3.35Å; L540-T542 PolarHBondContact O-N 3.01Å; T542-A546 WeakPolarHBondContact O-CB 3.38Å; T542-A546 PolarHBondContact O-N 3.04Å; T542-H610 PolarHBondContact OG1-O 3.28Å; T542-R612 PolarHBondContact OG1-NE 3.49Å; T542-R612 PolarHBondContact OG1-NH2 2.99Å; T542-L758 HydrophobicContact CG2-CD1 4.15Å; T542-M761 HydrophobicContact CG2-CE 3.82Å
543	L	98.2	Very high	91.9	Very high	1 Å²	1	42.4 Å²	42.4	1%	0.005	22%	0.218	C	C	.	.	H	α-helix	trans	-70.5	-49.7	177.1	-179.4	61.7	0	0	0	112.2	L499 L502 L503 A519 L520 D539 L540 A545 A546 V547	L499-L543 HydrophobicContact CD2-CD2 3.98Å; L502-L543 HydrophobicContact CB-CD1 4.08Å; L502-L543 HydrophobicContact CB-CD2 4.2Å; L502-L543 HydrophobicContact CD1-CD2 3.82Å; L503-L543 HydrophobicContact CD2-CB 4.09Å; A519-L543 HydrophobicContact CB-CD2 3.75Å; L520-L543 HydrophobicContact CD2-CD2 4.21Å; L520-L543 HydrophobicContact CD2-CG 4.38Å; L520-L543 HydrophobicContact CG-CD2 4.42Å; D539-L543 PolarHBondContact O-N 3.34Å; L540-L543 PolarHBondContact O-N 3.36Å; L540-L543 VanDerWaalsContact O-N 3.15Å; L543-A545 VanDerWaalsContact C-N 3.35Å; L543-A545 PolarHBondContact O-N 2.85Å; L543-A546 PolarHBondContact O-N 3.02Å; L543-A546 VanDerWaalsContact O-N 3.15Å; L543-V547 HydrophobicContact CD1-CG2 4.27Å; L543-V547 WeakPolarHBondContact O-CG2 3.48Å; L543-V547 PolarHBondContact O-N 3.16Å
544	D	98.1	Very high	93.1	Very high	2 Å²	2	37.9 Å²	37.9	1%	0.011	20%	0.197	C	C	.	.	H	α-helix	trans	-57.5	-44.9	-178.4	-179.6	89.2	0	0	0	112.6	L520 L540 V547 A548 R558 L559 R564	L520-D544 HydrophobicContact CD2-CB 4.14Å; L540-D544 WeakPolarHBondContact O-CB 3.26Å; L540-D544 PolarHBondContact O-N 3.43Å; D544-V547 PolarHBondContact O-N 3.2Å; D544-A548 WeakPolarHBondContact O-CB 3.47Å; D544-A548 PolarHBondContact O-N 3.18Å; D544-R558 WeakPolarHBondContact OD1-CA 3.42Å; D544-R558 IonicContact OD1-CZ 4Å; D544-R558 IonicContact OD1-NE 3.84Å; D544-R558 PolarHBondContact OD1-NE 3.41Å; D544-R558 IonicContact OD1-NH2 3.62Å; D544-R558 IonicContact OD2-CZ 3.14Å; D544-R558 IonicContact OD2-NE 2.73Å; D544-R558 PolarHBondContact OD2-NE 2.94Å; D544-R558 IonicContact OD2-NH2 3.38Å; D544-R558 PolarHBondContact OD2-NH2 3.33Å; D544-L559 HydrophobicContact CB-CB 4.43Å; D544-L559 HydrophobicContact CB-CD1 3.63Å; D544-L559 HydrophobicContact CB-CG 3.73Å; D544-L559 PolarHBondContact OD1-N 3.05Å; D544-R564 WeakPolarHBondContact OD2-CD 3.41Å
545	A	97.3	Very high	94.2	Very high	16 Å²	16	46.7 Å²	46.7	13%	0.132	24%	0.235	C	C	.	.	H	α-helix	trans	-76.8	-21.7	179.3	0	0	0	0	0	113.5	F541 L543 L549 H610	F541-A545 WeakPolarHBondContact O-CB 3.2Å; F541-A545 PolarHBondContact O-N 3.02Å; L543-A545 VanDerWaalsContact C-N 3.35Å; L543-A545 PolarHBondContact O-N 2.85Å; A545-L549 WeakPolarHBondContact O-CD1 3.5Å; A545-L549 WeakPolarHBondContact O-CG 3.24Å; A545-L549 PolarHBondContact O-N 3.21Å; A545-H610 HydrophobicContact CB-CB 3.68Å; A545-H610 WeakPolarHBondContact CB-CD2 3.05Å; A545-H610 VanDerWaalsContact CB-CG 3.41Å
546	A	97.9	Very high	94.9	Very high	0 Å²	0	41.1 Å²	41.1	0%	0	22%	0.216	C	C	.	.	H	α-helix	trans	-72.1	-47.3	168.4	0	0	0	0	0	110.9	A506 F511 T542 L543 A548 L549 E550 M761	A506-A546 HydrophobicContact CB-CB 4.31Å; F511-A546 HydrophobicContact CE1-CB 4Å; F511-A546 HydrophobicContact CZ-CB 4.16Å; T542-A546 WeakPolarHBondContact O-CB 3.38Å; T542-A546 PolarHBondContact O-N 3.04Å; L543-A546 PolarHBondContact O-N 3.02Å; L543-A546 VanDerWaalsContact O-N 3.15Å; A546-A548 VanDerWaalsContact C-N 3.28Å; A546-A548 PolarHBondContact O-N 3.14Å; A546-L549 PolarHBondContact O-N 3.19Å; A546-L549 VanDerWaalsContact O-N 3.13Å; A546-E550 WeakPolarHBondContact O-CB 3.47Å; A546-E550 PolarHBondContact O-N 3.34Å; A546-M761 HydrophobicContact CB-SD 4.31Å
547	V	97.6	Very high	95.3	Very high	0 Å²	0	42.7 Å²	42.7	0%	0	23%	0.227	C	C	.	.	H	α-helix	trans	-55.8	-43.5	173.4	169.9	0	0	0	0	111.1	F511 V516 L520 L543 D544 L549 L551 W554	F511-V547 HydrophobicContact CD1-CG2 3.94Å; F511-V547 HydrophobicContact CE1-CG2 4.15Å; V516-V547 HydrophobicContact CG1-CG1 4.45Å; V516-V547 HydrophobicContact CG1-CG2 3.53Å; L520-V547 HydrophobicContact CD1-CG2 4.4Å; L543-V547 HydrophobicContact CD1-CG2 4.27Å; L543-V547 WeakPolarHBondContact O-CG2 3.48Å; L543-V547 PolarHBondContact O-N 3.16Å; D544-V547 PolarHBondContact O-N 3.2Å; V547-L549 VanDerWaalsContact C-N 3.26Å; V547-L549 PolarHBondContact O-N 3.09Å; V547-L551 HydrophobicContact CG1-CB 4.48Å; V547-L551 HydrophobicContact CG1-CD1 4.37Å; V547-L551 WeakPolarHBondContact O-CA 3.28Å; V547-L551 WeakPolarHBondContact O-CB 3.44Å; V547-L551 PolarHBondContact O-N 2.86Å; V547-W554 HydrophobicContact CG1-CB 4.11Å; V547-W554 HydrophobicContact CG1-CD2 3.67Å; V547-W554 HydrophobicContact CG1-CE3 4.38Å; V547-W554 HydrophobicContact CG1-CG 3.54Å
548	A	96	Very high	95.6	Very high	43 Å²	43	44.2 Å²	44.2	36%	0.355	23%	0.23	S	C	.	.	H	α-helix	trans	-60.7	-29.6	178.7	0	0	0	0	0	115.1	D544 A546	D544-A548 WeakPolarHBondContact O-CB 3.47Å; D544-A548 PolarHBondContact O-N 3.18Å; A546-A548 VanDerWaalsContact C-N 3.28Å; A546-A548 PolarHBondContact O-N 3.14Å
549	L	96.1	Very high	95.8	Very high	50 Å²	50	42.1 Å²	42.1	26%	0.262	22%	0.222	S	C	.	.	H	α-helix	trans	-99.8	-32.1	-175.3	-69.7	170.1	0	0	0	112.4	A545 A546 V547 M608 H765 I768	A545-L549 WeakPolarHBondContact O-CD1 3.5Å; A545-L549 WeakPolarHBondContact O-CG 3.24Å; A545-L549 PolarHBondContact O-N 3.21Å; A546-L549 PolarHBondContact O-N 3.19Å; A546-L549 VanDerWaalsContact O-N 3.13Å; V547-L549 VanDerWaalsContact C-N 3.26Å; V547-L549 PolarHBondContact O-N 3.09Å; L549-M608 HydrophobicContact CD1-CE 4.35Å; L549-M608 HydrophobicContact CD1-SD 3.91Å; L549-H765 HydrophobicContact CD1-CB 3.86Å; L549-I768 HydrophobicContact CB-CG2 4.38Å; L549-I768 HydrophobicContact CD2-CG2 4.35Å
550	E	96.7	Very high	95.9	Very high	33 Å²	33	44.2 Å²	44.2	15%	0.154	24%	0.237	C	C	.	.	H	α-helix	trans	-101.6	-22.6	-174.1	-60.5	-164.8	-133.7	0	0	114.1	S509 F511 A546 P552 R764 H765 I768	S509-E550 WeakPolarHBondContact CB-OE2 3.44Å; F511-E550 HydrophobicContact CD2-CB 4.44Å; F511-E550 HydrophobicContact CE2-CB 3.59Å; F511-E550 VanDerWaalsContact CE2-CD 3.48Å; F511-E550 HydrophobicContact CE2-CG 4.12Å; F511-E550 VanDerWaalsContact CE2-OE2 3.28Å; F511-E550 WeakPolarHBondContact CE2-OE2 3.14Å; F511-E550 HydrophobicContact CZ-CB 3.81Å; F511-E550 VanDerWaalsContact CZ-CD 3.46Å; F511-E550 HydrophobicContact CZ-CG 4.07Å; A546-E550 WeakPolarHBondContact O-CB 3.47Å; A546-E550 PolarHBondContact O-N 3.34Å; E550-P552 VanDerWaalsContact C-CD 3.42Å; E550-P552 VanDerWaalsContact O-CD 3.25Å; E550-P552 WeakPolarHBondContact O-CD 3.19Å; E550-R764 IonicContact OE1-CZ 3.7Å; E550-R764 IonicContact OE1-NH1 2.66Å; E550-R764 PolarHBondContact OE1-NH1 3.35Å; E550-R764 IonicContact OE1-NH2 3.47Å; E550-R764 PolarHBondContact OE1-NH2 3.39Å; E550-R764 IonicContact OE2-CZ 2.65Å; E550-R764 VanDerWaalsContact OE2-CZ 3.26Å; E550-R764 IonicContact OE2-NH1 2.68Å; E550-R764 PolarHBondContact OE2-NH1 3.5Å; E550-R764 IonicContact OE2-NH2 2.61Å; E550-R764 PolarHBondContact OE2-NH2 2.64Å; E550-H765 IonicContact OE1-CD2 3.33Å; E550-H765 IonicContact OE1-NE2 3.23Å; E550-H765 PolarHBondContact OE1-NE2 2.92Å; E550-I768 HydrophobicContact CG-CD1 4.23Å
551	L	94.5	Very high	95.9	Very high	40 Å²	40	45.1 Å²	45.1	21%	0.209	25%	0.247	C	C	.	.			trans	-114.7	73.4	174.4	-61.7	-175.2	0	0	0	110.7	F511 E513 V547 Q553 W554	F511-L551 HydrophobicContact CB-CD1 3.66Å; F511-L551 HydrophobicContact CB-CD2 4.28Å; F511-L551 HydrophobicContact CB-CG 4.17Å; F511-L551 HydrophobicContact CD2-CD2 4.26Å; F511-L551 HydrophobicContact CD2-CG 4.26Å; F511-L551 HydrophobicContact CG-CD1 4.04Å; F511-L551 HydrophobicContact CG-CD2 4.44Å; F511-L551 HydrophobicContact CG-CG 4.14Å; E513-L551 HydrophobicContact CG-CD1 4.46Å; V547-L551 HydrophobicContact CG1-CB 4.48Å; V547-L551 HydrophobicContact CG1-CD1 4.37Å; V547-L551 WeakPolarHBondContact O-CA 3.28Å; V547-L551 WeakPolarHBondContact O-CB 3.44Å; V547-L551 PolarHBondContact O-N 2.86Å; L551-Q553 PolarHBondContact O-N 3.24Å; L551-W554 HydrophobicContact CB-CB 3.95Å; L551-W554 HydrophobicContact CD1-CE3 3.84Å; L551-W554 HydrophobicContact CD1-CZ3 4.37Å; L551-W554 WeakPolarHBondContact O-CB 3.27Å; L551-W554 PolarHBondContact O-N 3.35Å
552	P	87.8	Confident	95.9	Very high	114 Å²	114	50.9 Å²	50.9	74%	0.74	27%	0.274	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63	-16.5	-178.4	25.9	-35.4	0	0	0	114.1	E550	E550-P552 VanDerWaalsContact C-CD 3.42Å; E550-P552 VanDerWaalsContact O-CD 3.25Å; E550-P552 WeakPolarHBondContact O-CD 3.19Å
553	Q	91.1	Very high	95.7	Very high	158 Å²	158	51.7 Å²	51.7	74%	0.738	28%	0.278	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.8	7.2	175.6	-62.5	-65.1	-15.4	0	0	113.5	L551 K555	L551-Q553 PolarHBondContact O-N 3.24Å; Q553-K555 PolarHBondContact O-N 3.18Å
554	W	95	Very high	95.6	Very high	31 Å²	31	56.2 Å²	56.2	12%	0.117	30%	0.295	C	S	.	.			trans	-65	118.6	-175.7	179	-100	0	0	0	113	E513 V516 T517 V547 L551 G556 P557	E513-W554 HydrophobicContact CB-CZ3 3.84Å; E513-W554 HydrophobicContact CG-CE3 4.4Å; E513-W554 HydrophobicContact CG-CZ3 3.87Å; V516-W554 HydrophobicContact CB-CH2 3.79Å; V516-W554 HydrophobicContact CB-CZ2 4.38Å; V516-W554 HydrophobicContact CB-CZ3 4.34Å; V516-W554 HydrophobicContact CG1-CH2 3.51Å; V516-W554 HydrophobicContact CG1-CZ2 3.65Å; V516-W554 HydrophobicContact CG1-CZ3 4.16Å; T517-W554 WeakPolarHBondContact OG1-CH2 3.45Å; V547-W554 HydrophobicContact CG1-CB 4.11Å; V547-W554 HydrophobicContact CG1-CD2 3.67Å; V547-W554 HydrophobicContact CG1-CE3 4.38Å; V547-W554 HydrophobicContact CG1-CG 3.54Å; L551-W554 HydrophobicContact CB-CB 3.95Å; L551-W554 HydrophobicContact CD1-CE3 3.84Å; L551-W554 HydrophobicContact CD1-CZ3 4.37Å; L551-W554 WeakPolarHBondContact O-CB 3.27Å; L551-W554 PolarHBondContact O-N 3.35Å; W554-G556 VanDerWaalsContact CE2-CA 3.48Å; W554-G556 VanDerWaalsContact NE1-C 3.26Å; W554-G556 PolarHBondContact NE1-O 3.3Å; W554-G556 VanDerWaalsContact NE1-O 3.08Å; W554-P557 PolarHBondContact NE1-O 3.44Å
555	K	94.3	Very high	95.6	Very high	194 Å²	194	62.7 Å²	62.7	84%	0.843	33%	0.325	S	S	*	.			trans	-111.1	3.4	176	-63.7	174.1	-172.5	176.5	0	113.4	Q553	Q553-K555 PolarHBondContact O-N 3.18Å
556	G	95.3	Very high	95.5	Very high	26 Å²	26	65.7 Å²	65.7	27%	0.268	34%	0.337	S	S	.	.	S	Bend	trans	-77.2	-177.6	177.2	0	0	0	0	0	113.1	W554	W554-G556 VanDerWaalsContact CE2-CA 3.48Å; W554-G556 VanDerWaalsContact NE1-C 3.26Å; W554-G556 PolarHBondContact NE1-O 3.3Å; W554-G556 VanDerWaalsContact NE1-O 3.08Å
557	P	97.1	Very high	95.3	Very high	39 Å²	39	65.8 Å²	65.8	25%	0.253	34%	0.337	S	S	.	.			trans	-65	159.4	-177.6	28.9	-35.8	0	0	0	112.6	T517 L520 W554	T517-P557 HydrophobicContact CG2-CG 4.17Å; T517-P557 VanDerWaalsContact O-CG 3.29Å; T517-P557 WeakPolarHBondContact O-CG 3.41Å; L520-P557 HydrophobicContact CB-CG 4.26Å; L520-P557 WeakPolarHBondContact O-CB 3.49Å; W554-P557 PolarHBondContact NE1-O 3.44Å
558	R	97	Very high	95.1	Very high	98 Å²	98	67 Å²	67	37%	0.37	35%	0.347	S	S	.	.			trans	-146	156.8	-173.6	-68.2	-62.1	-56.7	-83.5	-8.4	109.5	D544	D544-R558 WeakPolarHBondContact OD1-CA 3.42Å; D544-R558 IonicContact OD1-CZ 4Å; D544-R558 IonicContact OD1-NE 3.84Å; D544-R558 PolarHBondContact OD1-NE 3.41Å; D544-R558 IonicContact OD1-NH2 3.62Å; D544-R558 IonicContact OD2-CZ 3.14Å; D544-R558 IonicContact OD2-NE 2.73Å; D544-R558 PolarHBondContact OD2-NE 2.94Å; D544-R558 IonicContact OD2-NH2 3.38Å; D544-R558 PolarHBondContact OD2-NH2 3.33Å
559	L	97.2	Very high	95.1	Very high	9 Å²	9	71.4 Å²	71.4	5%	0.047	36%	0.36	C	S	.	.			trans	-68.5	149	172.2	-57.4	-179	0	0	0	111.1	L520 V525 L540 D544 L563 R564	L520-L559 HydrophobicContact CD2-CD2 4.22Å; L520-L559 HydrophobicContact CD2-CG 4.36Å; V525-L559 HydrophobicContact CG1-CD2 4.19Å; V525-L559 HydrophobicContact CG2-CD2 3.58Å; L540-L559 HydrophobicContact CB-CD1 4.11Å; L540-L559 HydrophobicContact CB-CD2 4.42Å; D544-L559 HydrophobicContact CB-CB 4.43Å; D544-L559 HydrophobicContact CB-CD1 3.63Å; D544-L559 HydrophobicContact CB-CG 3.73Å; D544-L559 PolarHBondContact OD1-N 3.05Å; L559-L563 HydrophobicContact CD2-CD2 4.13Å; L559-R564 HydrophobicContact CB-CG 3.78Å; L559-R564 HydrophobicContact CD1-CG 4.38Å; L559-R564 PolarHBondContact O-NE 3.36Å; L559-R564 VanDerWaalsContact O-NE 3.14Å
560	S	96.6	Very high	94.9	Very high	57 Å²	57	72 Å²	72	40%	0.399	36%	0.363	S	S	.	.			trans	-64.7	168.6	178.5	84.6	0	0	0	0	112.3	E562 L563 R564	S560-E562 WeakPolarHBondContact CB-OE2 3.47Å; S560-E562 PolarHBondContact OG-OE2 3.04Å; S560-L563 PolarHBondContact OG-N 2.85Å; S560-R564 VanDerWaalsContact O-CG 3.32Å; S560-R564 WeakPolarHBondContact O-CG 3.33Å; S560-R564 PolarHBondContact O-N 3.11Å; S560-R564 PolarHBondContact O-NE 3.4Å
561	G	96.1	Very high	94.7	Very high	19 Å²	19	70.8 Å²	70.8	20%	0.196	36%	0.357	C	S	.	.	H	α-helix	trans	-63	-51	176.2	0	0	0	0	0	111.4	L563 R564 E565	G561-L563 PolarHBondContact O-N 2.97Å; G561-R564 PolarHBondContact O-N 3.49Å; G561-R564 VanDerWaalsContact O-N 3.09Å; G561-E565 WeakPolarHBondContact O-CG 3.46Å; G561-E565 PolarHBondContact O-N 3.41Å
562	E	96.3	Very high	94.6	Very high	137 Å²	137	72.4 Å²	72.4	64%	0.64	36%	0.361	S	S	*	.	H	α-helix	trans	-59.5	-43.7	-174.3	-44.8	75.6	-168	0	0	111.5	S560 E565 E566	S560-E562 WeakPolarHBondContact CB-OE2 3.47Å; S560-E562 PolarHBondContact OG-OE2 3.04Å; E562-E565 PolarHBondContact O-N 3.44Å; E562-E566 VanDerWaalsContact O-CB 3.26Å; E562-E566 WeakPolarHBondContact O-CB 3.48Å; E562-E566 PolarHBondContact O-N 3.12Å
563	L	94.4	Very high	94.9	Very high	18 Å²	18	70.5 Å²	70.5	9%	0.094	35%	0.347	C	S	.	.	H	α-helix	trans	-70.7	-32.5	178.9	-178.7	63	0	0	0	112.6	V525 L529 K537 L559 S560 G561 V567	V525-L563 HydrophobicContact CG1-CD2 3.94Å; L529-L563 HydrophobicContact CD1-CD1 4.29Å; L529-L563 HydrophobicContact CD1-CD2 4.07Å; L529-L563 HydrophobicContact CD2-CD1 4.38Å; K537-L563 HydrophobicContact CD-CD1 4.28Å; K537-L563 HydrophobicContact CG-CD1 4.47Å; L559-L563 HydrophobicContact CD2-CD2 4.13Å; S560-L563 PolarHBondContact OG-N 2.85Å; G561-L563 PolarHBondContact O-N 2.97Å; L563-V567 HydrophobicContact CD1-CG2 4.21Å; L563-V567 WeakPolarHBondContact O-CB 3.29Å; L563-V567 VanDerWaalsContact O-CG2 3.26Å; L563-V567 WeakPolarHBondContact O-CG2 3.41Å; L563-V567 PolarHBondContact O-N 2.71Å
564	R	96.3	Very high	94.8	Very high	96 Å²	96	67.5 Å²	67.5	36%	0.362	33%	0.331	S	S	.	.	H	α-helix	trans	-72	-39.2	175.5	-71.7	179	-66.3	143	1.2	110.9	F541 D544 L559 S560 G561 A568	F541-R564 HydrophobicContact CD2-CB 4.3Å; F541-R564 HydrophobicContact CD2-CG 4.09Å; F541-R564 HydrophobicContact CE2-CB 3.96Å; F541-R564 HydrophobicContact CE2-CG 4.14Å; D544-R564 WeakPolarHBondContact OD2-CD 3.41Å; L559-R564 HydrophobicContact CB-CG 3.78Å; L559-R564 HydrophobicContact CD1-CG 4.38Å; L559-R564 PolarHBondContact O-NE 3.36Å; L559-R564 VanDerWaalsContact O-NE 3.14Å; S560-R564 VanDerWaalsContact O-CG 3.32Å; S560-R564 WeakPolarHBondContact O-CG 3.33Å; S560-R564 PolarHBondContact O-N 3.11Å; S560-R564 PolarHBondContact O-NE 3.4Å; G561-R564 PolarHBondContact O-N 3.49Å; G561-R564 VanDerWaalsContact O-N 3.09Å; R564-A568 WeakPolarHBondContact O-CB 3.39Å; R564-A568 PolarHBondContact O-N 2.87Å
565	E	96.3	Very high	94.5	Very high	138 Å²	138	66 Å²	66	65%	0.645	33%	0.326	S	S	*	.	H	α-helix	trans	-68.2	-47.8	176	-72.5	167.3	-162	0	0	111.4	G561 E562 V567 A568 E569	G561-E565 WeakPolarHBondContact O-CG 3.46Å; G561-E565 PolarHBondContact O-N 3.41Å; E562-E565 PolarHBondContact O-N 3.44Å; E565-V567 VanDerWaalsContact C-N 3.32Å; E565-V567 PolarHBondContact O-N 3.16Å; E565-A568 PolarHBondContact O-N 2.71Å; E565-A568 VanDerWaalsContact O-N 3.17Å; E565-E569 WeakPolarHBondContact O-CB 3.35Å; E565-E569 PolarHBondContact O-N 2.88Å
566	E	95.4	Very high	94.4	Very high	80 Å²	80	61.2 Å²	61.2	37%	0.374	31%	0.306	S	S	.	.	H	α-helix	trans	-54.8	-45.6	175.4	-171.6	-136.5	137.7	0	0	111.9	K537 E562 M570	K537-E566 IonicContact NZ-OE1 2.72Å; K537-E566 PolarHBondContact NZ-OE1 3.1Å; K537-E566 IonicContact NZ-OE2 2.87Å; K537-E566 PolarHBondContact NZ-OE2 2.93Å; E562-E566 VanDerWaalsContact O-CB 3.26Å; E562-E566 WeakPolarHBondContact O-CB 3.48Å; E562-E566 PolarHBondContact O-N 3.12Å; E566-M570 VanDerWaalsContact O-CB 3.23Å; E566-M570 WeakPolarHBondContact O-CB 3.4Å; E566-M570 PolarHBondContact O-N 2.67Å
567	V	93.4	Very high	94.1	Very high	1 Å²	1	63.7 Å²	63.7	1%	0.006	32%	0.32	C	S	.	.	H	α-helix	trans	-74.9	-33.4	-179.6	178.7	0	0	0	0	111.9	K537 F541 L563 E565 M570 L571	K537-V567 HydrophobicContact CB-CG2 3.9Å; K537-V567 HydrophobicContact CD-CG2 4.11Å; K537-V567 HydrophobicContact CG-CG2 4.35Å; F541-V567 HydrophobicContact CB-CB 4.33Å; F541-V567 HydrophobicContact CB-CG1 3.72Å; F541-V567 HydrophobicContact CD1-CB 4.24Å; F541-V567 HydrophobicContact CD1-CG1 3.51Å; F541-V567 HydrophobicContact CE1-CG1 4.25Å; F541-V567 HydrophobicContact CG-CB 4.19Å; F541-V567 HydrophobicContact CG-CG1 3.74Å; L563-V567 HydrophobicContact CD1-CG2 4.21Å; L563-V567 WeakPolarHBondContact O-CB 3.29Å; L563-V567 VanDerWaalsContact O-CG2 3.26Å; L563-V567 WeakPolarHBondContact O-CG2 3.41Å; L563-V567 PolarHBondContact O-N 2.71Å; E565-V567 VanDerWaalsContact C-N 3.32Å; E565-V567 PolarHBondContact O-N 3.16Å; V567-M570 HydrophobicContact CB-CE 4.44Å; V567-M570 HydrophobicContact CG1-CE 4.04Å; V567-M570 HydrophobicContact CG2-CE 4.32Å; V567-L571 HydrophobicContact CG1-CD1 3.94Å; V567-L571 HydrophobicContact CG1-CG 4.4Å; V567-L571 WeakPolarHBondContact O-CB 3.49Å; V567-L571 WeakPolarHBondContact O-CD1 3.36Å; V567-L571 WeakPolarHBondContact O-CG 3.41Å; V567-L571 PolarHBondContact O-N 2.9Å; V567-L571 VanDerWaalsContact O-N 3.07Å
568	A	94.3	Very high	93.6	Very high	26 Å²	26	64.3 Å²	64.3	22%	0.215	32%	0.321	C	S	.	.	H	α-helix	trans	-66.9	-44.1	173.9	0	0	0	0	0	112	F541 R564 E565 L571 W572 P609	F541-A568 HydrophobicContact CE1-CB 4.4Å; F541-A568 HydrophobicContact CZ-CB 3.98Å; R564-A568 WeakPolarHBondContact O-CB 3.39Å; R564-A568 PolarHBondContact O-N 2.87Å; E565-A568 PolarHBondContact O-N 2.71Å; E565-A568 VanDerWaalsContact O-N 3.17Å; A568-L571 PolarHBondContact O-N 2.7Å; A568-W572 WeakPolarHBondContact O-CB 3.47Å; A568-W572 PolarHBondContact O-N 3.46Å; A568-P609 HydrophobicContact CB-CB 4.27Å
569	E	95.2	Very high	93.1	Very high	135 Å²	135	60.3 Å²	60.3	63%	0.631	31%	0.307	S	S	*	.	H	α-helix	trans	-63	-51.1	175.8	-175.7	175.8	-161.6	0	0	110.8	E565 L571 W572 T573	E565-E569 WeakPolarHBondContact O-CB 3.35Å; E565-E569 PolarHBondContact O-N 2.88Å; E569-L571 VanDerWaalsContact C-N 3.27Å; E569-L571 PolarHBondContact O-N 2.8Å; E569-W572 CarbonylContact O-C 3.53Å; E569-W572 WeakPolarHBondContact O-CA 3.23Å; E569-W572 PolarHBondContact O-N 2.93Å; E569-T573 PolarHBondContact O-N 3.29Å; E569-T573 PolarHBondContact O-OG1 2.9Å; E569-T573 VanDerWaalsContact O-OG1 3.11Å
570	M	93.1	Very high	92.9	Very high	63 Å²	63	60.1 Å²	60.1	31%	0.31	31%	0.307	S	S	.	.	H	α-helix	trans	-55.7	-39.9	177.5	173.1	-97.8	-69.3	0	0	113	K538 E566 V567 F574	K538-M570 WeakPolarHBondContact CE-SD 3.37Å; K538-M570 HydrophobicContact CG-CE 4.03Å; E566-M570 VanDerWaalsContact O-CB 3.23Å; E566-M570 WeakPolarHBondContact O-CB 3.4Å; E566-M570 PolarHBondContact O-N 2.67Å; V567-M570 HydrophobicContact CB-CE 4.44Å; V567-M570 HydrophobicContact CG1-CE 4.04Å; V567-M570 HydrophobicContact CG2-CE 4.32Å; M570-F574 WeakPolarHBondContact O-CB 3.38Å; M570-F574 PolarHBondContact O-N 3.11Å
571	L	91.8	Very high	92.7	Very high	8 Å²	8	62.6 Å²	62.6	4%	0.042	32%	0.315	C	S	.	.	H	α-helix	trans	-70.9	-35.1	174.7	-72.5	170.7	0	0	0	112.4	K538 F541 V567 A568 E569 A575 M606 R612	K538-L571 HydrophobicContact CD-CD2 4.49Å; K538-L571 HydrophobicContact CG-CD2 4.38Å; F541-L571 HydrophobicContact CD1-CD1 3.92Å; F541-L571 HydrophobicContact CE1-CD1 4Å; V567-L571 HydrophobicContact CG1-CD1 3.94Å; V567-L571 HydrophobicContact CG1-CG 4.4Å; V567-L571 WeakPolarHBondContact O-CB 3.49Å; V567-L571 WeakPolarHBondContact O-CD1 3.36Å; V567-L571 WeakPolarHBondContact O-CG 3.41Å; V567-L571 PolarHBondContact O-N 2.9Å; V567-L571 VanDerWaalsContact O-N 3.07Å; A568-L571 PolarHBondContact O-N 2.7Å; E569-L571 VanDerWaalsContact C-N 3.27Å; E569-L571 PolarHBondContact O-N 2.8Å; L571-A575 WeakPolarHBondContact O-CB 3.4Å; L571-A575 PolarHBondContact O-N 3.13Å; L571-M606 HydrophobicContact CB-CE 4.16Å; L571-M606 HydrophobicContact CB-SD 4.39Å; L571-R612 HydrophobicContact CD1-CG 4.31Å; L571-R612 HydrophobicContact CD2-CB 4.46Å; L571-R612 HydrophobicContact CD2-CG 4.13Å
572	W	93.3	Very high	92.5	Very high	74 Å²	74	62.8 Å²	62.8	28%	0.28	31%	0.31	S	S	.	.	H	α-helix	trans	-72.8	-45.9	178.9	179.7	-127.7	0	0	0	112.6	A568 E569 F574 A575 Q576 K604 M606 I614	A568-W572 WeakPolarHBondContact O-CB 3.47Å; A568-W572 PolarHBondContact O-N 3.46Å; E569-W572 CarbonylContact O-C 3.53Å; E569-W572 WeakPolarHBondContact O-CA 3.23Å; E569-W572 PolarHBondContact O-N 2.93Å; W572-F574 VanDerWaalsContact C-N 3.27Å; W572-F574 PolarHBondContact O-N 2.95Å; W572-A575 HydrophobicContact CE3-CB 4.19Å; W572-A575 PolarHBondContact O-N 3.25Å; W572-A575 VanDerWaalsContact O-N 3.11Å; W572-Q576 HydrophobicContact CD2-CG 3.98Å; W572-Q576 HydrophobicContact CE3-CG 4.29Å; W572-Q576 HydrophobicContact CH2-CG 4.17Å; W572-Q576 HydrophobicContact CZ2-CG 3.85Å; W572-Q576 HydrophobicContact CZ3-CG 4.38Å; W572-Q576 WeakPolarHBondContact O-CG 3.27Å; W572-Q576 PolarHBondContact O-N 3.37Å; W572-K604 WeakPolarHBondContact CH2-O 3.47Å; W572-M606 HydrophobicContact CB-SD 4.3Å; W572-M606 HydrophobicContact CE3-CG 3.74Å; W572-M606 HydrophobicContact CE3-SD 3.95Å; W572-M606 HydrophobicContact CZ3-CG 4.12Å; W572-I614 HydrophobicContact CZ3-CG2 4.03Å
573	T	93.3	Very high	92.3	Very high	74 Å²	74	60.8 Å²	60.8	45%	0.454	31%	0.309	S	S	.	.	H	α-helix	trans	-56.8	-42.7	174.1	-51.1	0	0	0	0	111.1	E569 Q576 S577	E569-T573 PolarHBondContact O-N 3.29Å; E569-T573 PolarHBondContact O-OG1 2.9Å; E569-T573 VanDerWaalsContact O-OG1 3.11Å; T573-Q576 PolarHBondContact O-N 2.96Å; T573-S577 PolarHBondContact O-N 2.88Å; T573-S577 VanDerWaalsContact O-N 3.14Å; T573-S577 PolarHBondContact O-OG 3.04Å
574	F	89	Confident	92.3	Very high	94 Å²	94	61 Å²	61	41%	0.412	31%	0.309	S	S	.	.	H	α-helix	trans	-62.8	-48.5	174	179.2	-109.4	0	0	0	111.9	Y94 M570 W572 Q576 S577 D578	Y94-F574 HydrophobicContact CD2-CE1 4.5Å; Y94-F574 HydrophobicContact CE2-CD1 4.35Å; Y94-F574 AromaticContact CE2-CE1 3.58Å; Y94-F574 HydrophobicContact CE2-CE1 3.58Å; Y94-F574 HydrophobicContact CE2-CZ 4.31Å; M570-F574 WeakPolarHBondContact O-CB 3.38Å; M570-F574 PolarHBondContact O-N 3.11Å; W572-F574 VanDerWaalsContact C-N 3.27Å; W572-F574 PolarHBondContact O-N 2.95Å; F574-Q576 VanDerWaalsContact C-N 3.3Å; F574-Q576 PolarHBondContact O-N 3.28Å; F574-S577 PolarHBondContact O-N 3.41Å; F574-S577 PolarHBondContact O-OG 2.72Å; F574-D578 PolarHBondContact O-N 3.19Å; F574-D578 VanDerWaalsContact O-N 3.11Å
575	A	89.8	Confident	92.3	Very high	0 Å²	0	56.6 Å²	56.6	0%	0	29%	0.293	C	S	.	.	H	α-helix	trans	-61.4	-35.9	178.4	0	0	0	0	0	113.1	L571 W572 V579 C580 M606 I614	L571-A575 WeakPolarHBondContact O-CB 3.4Å; L571-A575 PolarHBondContact O-N 3.13Å; W572-A575 HydrophobicContact CE3-CB 4.19Å; W572-A575 PolarHBondContact O-N 3.25Å; W572-A575 VanDerWaalsContact O-N 3.11Å; A575-V579 HydrophobicContact CB-CG2 4.5Å; A575-V579 PolarHBondContact O-N 3.21Å; A575-C580 PolarHBondContact O-N 3.2Å; A575-C580 PolarHBondContact O-SG 2.9Å; A575-M606 HydrophobicContact CB-SD 3.99Å; A575-I614 HydrophobicContact CB-CG2 3.86Å
576	Q	91	Very high	92.3	Very high	93 Å²	93	53.5 Å²	53.5	44%	0.435	28%	0.281	S	S	.	.	H	α-helix	trans	-62.8	-39.6	172.3	-74.7	-179.4	-36.9	0	0	112.2	W572 T573 F574	W572-Q576 HydrophobicContact CD2-CG 3.98Å; W572-Q576 HydrophobicContact CE3-CG 4.29Å; W572-Q576 HydrophobicContact CH2-CG 4.17Å; W572-Q576 HydrophobicContact CZ2-CG 3.85Å; W572-Q576 HydrophobicContact CZ3-CG 4.38Å; W572-Q576 WeakPolarHBondContact O-CG 3.27Å; W572-Q576 PolarHBondContact O-N 3.37Å; T573-Q576 PolarHBondContact O-N 2.96Å; F574-Q576 VanDerWaalsContact C-N 3.3Å; F574-Q576 PolarHBondContact O-N 3.28Å
577	S	88.9	Confident	92.3	Very high	78 Å²	78	51.9 Å²	51.9	55%	0.545	27%	0.273	S	S	.	.	H	α-helix	trans	-78.1	-20.9	-178	71.2	0	0	0	0	115.4	T573 F574	T573-S577 PolarHBondContact O-N 2.88Å; T573-S577 VanDerWaalsContact O-N 3.14Å; T573-S577 PolarHBondContact O-OG 3.04Å; F574-S577 PolarHBondContact O-N 3.41Å; F574-S577 PolarHBondContact O-OG 2.72Å
578	D	87.7	Confident	92.5	Very high	52 Å²	52	51.9 Å²	51.9	28%	0.278	27%	0.273	S	S	.	.	T	Hydrogen-bonded Turn	trans	-121.1	-74.5	-179.4	172.9	55.2	0	0	0	111.8	Y94 F574 C580 L581 K582	Y94-D578 WeakPolarHBondContact CD2-OD2 3.41Å; Y94-D578 VanDerWaalsContact CE2-OD2 3.26Å; Y94-D578 WeakPolarHBondContact CE2-OD2 3.27Å; F574-D578 PolarHBondContact O-N 3.19Å; F574-D578 VanDerWaalsContact O-N 3.11Å; D578-C580 PolarHBondContact O-N 3.13Å; D578-L581 PolarHBondContact O-N 3.42Å; D578-K582 VanDerWaalsContact CG-CE 3.41Å; D578-K582 VanDerWaalsContact CG-NZ 3.28Å; D578-K582 WeakPolarHBondContact OD1-CE 3.44Å; D578-K582 IonicContact OD1-NZ 2.68Å; D578-K582 PolarHBondContact OD1-NZ 3.18Å; D578-K582 VanDerWaalsContact OD1-NZ 3.17Å; D578-K582 VanDerWaalsContact OD2-CE 3.3Å; D578-K582 WeakPolarHBondContact OD2-CE 3.36Å; D578-K582 IonicContact OD2-NZ 2.7Å; D578-K582 PolarHBondContact OD2-NZ 2.88Å
579	V	86.9	Confident	92.6	Very high	14 Å²	14	52 Å²	52	9%	0.085	27%	0.269	C	S	.	.	G	3₁₀ helix	trans	-62.1	-43.7	-169	-164.8	0	0	0	0	113.1	Y94 A575 L581 K582 V585 I614	Y94-V579 HydrophobicContact CD1-CG2 4.39Å; Y94-V579 HydrophobicContact CD2-CG2 3.88Å; Y94-V579 HydrophobicContact CE1-CG2 3.77Å; Y94-V579 HydrophobicContact CE2-CG2 3.16Å; Y94-V579 HydrophobicContact CG-CG2 4.45Å; Y94-V579 WeakPolarHBondContact OH-CG2 3.42Å; A575-V579 HydrophobicContact CB-CG2 4.5Å; A575-V579 PolarHBondContact O-N 3.21Å; V579-L581 PolarHBondContact O-N 2.95Å; V579-L581 VanDerWaalsContact O-N 3.09Å; V579-K582 WeakPolarHBondContact O-CB 3.4Å; V579-K582 PolarHBondContact O-N 3.21Å; V579-K582 VanDerWaalsContact O-N 3.12Å; V579-V585 HydrophobicContact CG1-CG2 4.41Å; V579-I614 HydrophobicContact CB-CG1 4.34Å; V579-I614 HydrophobicContact CB-CG2 4.43Å; V579-I614 HydrophobicContact CG1-CG1 3.57Å; V579-I614 HydrophobicContact CG1-CG2 4.47Å
580	C	91.2	Very high	92.7	Very high	6 Å²	6	47.7 Å²	47.7	4%	0.041	25%	0.254	C	S	.	.	G	3₁₀ helix	trans	-66.3	-11.4	-176.6	-71	0	0	0	0	113.9	A575 D578 L586 K604	A575-C580 PolarHBondContact O-N 3.2Å; A575-C580 PolarHBondContact O-SG 2.9Å; D578-C580 PolarHBondContact O-N 3.13Å; C580-L586 VanDerWaalsContact O-CD2 3.3Å; C580-L586 WeakPolarHBondContact O-CD2 3.41Å; C580-K604 HydrophobicContact CB-CD 4.11Å; C580-K604 PolarHBondContact O-NZ 3.04Å
581	L	92.4	Very high	92.9	Very high	108 Å²	108	44.7 Å²	44.7	57%	0.565	24%	0.239	S	C	*	.	G	3₁₀ helix	trans	-103.4	-2.4	178.9	-54	-177.7	0	0	0	113.2	D578 V579 L586	D578-L581 PolarHBondContact O-N 3.42Å; V579-L581 PolarHBondContact O-N 2.95Å; V579-L581 VanDerWaalsContact O-N 3.09Å; L581-L586 WeakPolarHBondContact O-CD1 3.44Å
582	K	91.8	Very high	93.2	Very high	24 Å²	24	44.3 Å²	44.3	10%	0.104	24%	0.237	C	C	.	.			trans	-69.7	135	-177.1	-67.3	-177.2	-176.4	173.2	0	110.6	N92 D578 V579 E584 V585 L586	N92-K582 PolarHBondContact OD1-NZ 2.61Å; D578-K582 VanDerWaalsContact CG-CE 3.41Å; D578-K582 VanDerWaalsContact CG-NZ 3.28Å; D578-K582 WeakPolarHBondContact OD1-CE 3.44Å; D578-K582 IonicContact OD1-NZ 2.68Å; D578-K582 PolarHBondContact OD1-NZ 3.18Å; D578-K582 VanDerWaalsContact OD1-NZ 3.17Å; D578-K582 VanDerWaalsContact OD2-CE 3.3Å; D578-K582 WeakPolarHBondContact OD2-CE 3.36Å; D578-K582 IonicContact OD2-NZ 2.7Å; D578-K582 PolarHBondContact OD2-NZ 2.88Å; V579-K582 WeakPolarHBondContact O-CB 3.4Å; V579-K582 PolarHBondContact O-N 3.21Å; V579-K582 VanDerWaalsContact O-N 3.12Å; K582-E584 PolarHBondContact O-N 3.33Å; K582-E584 VanDerWaalsContact O-N 3.16Å; K582-V585 HydrophobicContact CB-CG2 4.21Å; K582-V585 WeakPolarHBondContact O-CA 3.22Å; K582-V585 WeakPolarHBondContact O-CB 3.45Å; K582-V585 PolarHBondContact O-N 3.37Å; K582-L586 PolarHBondContact O-N 2.75Å
583	P	93.9	Very high	93.3	Very high	94 Å²	94	43.2 Å²	43.2	61%	0.61	24%	0.235	S	C	*	.	H	α-helix	trans	-55.2	-37	-175.6	-27.4	35.4	0	0	0	113.5	V585 E587	P583-V585 VanDerWaalsContact C-N 3.28Å; P583-V585 PolarHBondContact O-N 3.06Å; P583-E587 VanDerWaalsContact O-CB 3.31Å; P583-E587 WeakPolarHBondContact O-CB 3.46Å; P583-E587 PolarHBondContact O-N 3.2Å
584	E	94.4	Very high	93.5	Very high	22 Å²	22	43.8 Å²	43.8	10%	0.103	24%	0.236	C	C	.	.	H	α-helix	trans	-67.5	-24.2	176.9	66.9	-90.7	-147.6	0	0	114	K582 A588 I742 W781 F782 L785	K582-E584 PolarHBondContact O-N 3.33Å; K582-E584 VanDerWaalsContact O-N 3.16Å; E584-A588 WeakPolarHBondContact O-CB 3.47Å; E584-I742 HydrophobicContact CB-CG2 4.17Å; E584-I742 HydrophobicContact CG-CG2 3.72Å; E584-W781 PolarHBondContact O-NE1 3.44Å; E584-F782 HydrophobicContact CB-CD1 4.4Å; E584-F782 HydrophobicContact CB-CE1 3.86Å; E584-F782 HydrophobicContact CB-CZ 4.11Å; E584-F782 HydrophobicContact CG-CE1 3.8Å; E584-F782 HydrophobicContact CG-CZ 3.75Å; E584-F782 WeakPolarHBondContact OE1-CZ 3.45Å; E584-L785 HydrophobicContact CB-CD1 4.02Å; E584-L785 HydrophobicContact CB-CD2 4.44Å
585	V	95.3	Very high	93.8	Very high	4 Å²	4	41.1 Å²	41.1	2%	0.024	23%	0.226	C	C	.	.	H	α-helix	trans	-86.4	-46.2	175.9	178.8	0	0	0	0	110.4	V579 K582 P583 A588 E589 K604 I614 I742	V579-V585 HydrophobicContact CG1-CG2 4.41Å; K582-V585 HydrophobicContact CB-CG2 4.21Å; K582-V585 WeakPolarHBondContact O-CA 3.22Å; K582-V585 WeakPolarHBondContact O-CB 3.45Å; K582-V585 PolarHBondContact O-N 3.37Å; P583-V585 VanDerWaalsContact C-N 3.28Å; P583-V585 PolarHBondContact O-N 3.06Å; V585-A588 PolarHBondContact O-N 3.06Å; V585-E589 WeakPolarHBondContact O-CB 3.46Å; V585-E589 PolarHBondContact O-N 3.15Å; V585-K604 HydrophobicContact CG1-CD 3.9Å; V585-I614 HydrophobicContact CG1-CD1 3.83Å; V585-I614 HydrophobicContact CG2-CD1 4.37Å; V585-I742 HydrophobicContact CG2-CB 4.39Å; V585-I742 HydrophobicContact CG2-CD1 4.42Å; V585-I742 HydrophobicContact CG2-CG1 4.3Å; V585-I742 HydrophobicContact CG2-CG2 4.49Å
586	L	96	Very high	94.1	Very high	73 Å²	73	41.6 Å²	41.6	38%	0.382	23%	0.228	S	C	.	.	H	α-helix	trans	-62.8	-42	179.3	-68.8	174.5	0	0	0	112.4	C580 L581 K582 A588 S590	C580-L586 VanDerWaalsContact O-CD2 3.3Å; C580-L586 WeakPolarHBondContact O-CD2 3.41Å; L581-L586 WeakPolarHBondContact O-CD1 3.44Å; K582-L586 PolarHBondContact O-N 2.75Å; L586-A588 VanDerWaalsContact C-N 3.33Å; L586-S590 VanDerWaalsContact O-CB 3.23Å; L586-S590 WeakPolarHBondContact O-CB 3.45Å; L586-S590 PolarHBondContact O-N 3.12Å
587	E	96.7	Very high	94.2	Very high	47 Å²	47	39.7 Å²	39.7	22%	0.22	23%	0.234	C	C	.	.	H	α-helix	trans	-67.2	-35.5	176	-175.3	63.5	-162.2	0	0	111.7	P583 A591 W781 L785 R789 K792	P583-E587 VanDerWaalsContact O-CB 3.31Å; P583-E587 WeakPolarHBondContact O-CB 3.46Å; P583-E587 PolarHBondContact O-N 3.2Å; E587-A591 WeakPolarHBondContact O-CB 3.36Å; E587-A591 PolarHBondContact O-N 2.76Å; E587-W781 HydrophobicContact CB-CZ2 4.24Å; E587-W781 HydrophobicContact CG-CH2 4.36Å; E587-W781 HydrophobicContact CG-CZ2 4.01Å; E587-L785 HydrophobicContact CB-CD2 3.88Å; E587-L785 HydrophobicContact CG-CD2 3.94Å; E587-R789 IonicContact OE1-CZ 2.73Å; E587-R789 IonicContact OE1-NH1 2.77Å; E587-R789 PolarHBondContact OE1-NH1 3.35Å; E587-R789 IonicContact OE2-NH1 3.63Å; E587-K792 VanDerWaalsContact CD-NZ 3.25Å; E587-K792 HydrophobicContact CG-CD 4.09Å; E587-K792 WeakPolarHBondContact OE1-CD 3.49Å; E587-K792 WeakPolarHBondContact OE1-CE 3.3Å; E587-K792 IonicContact OE1-NZ 3.42Å; E587-K792 PolarHBondContact OE1-NZ 3.26Å; E587-K792 IonicContact OE2-NZ 3.65Å
588	A	97	Very high	94.4	Very high	0 Å²	0	37 Å²	37	0%	0	22%	0.218	C	C	.	.	H	α-helix	trans	-69.8	-46.8	178.9	0	0	0	0	0	111.2	E584 V585 L586 A591 L592 L616 I742 L776 W781	E584-A588 WeakPolarHBondContact O-CB 3.47Å; V585-A588 PolarHBondContact O-N 3.06Å; L586-A588 VanDerWaalsContact C-N 3.33Å; A588-A591 PolarHBondContact O-N 3.32Å; A588-L592 WeakPolarHBondContact O-CB 3.49Å; A588-L592 WeakPolarHBondContact O-CD1 3.24Å; A588-L592 WeakPolarHBondContact O-CG 3.44Å; A588-L592 PolarHBondContact O-N 3.39Å; A588-L616 HydrophobicContact CB-CD1 3.85Å; A588-I742 HydrophobicContact CB-CD1 4.33Å; A588-I742 HydrophobicContact CB-CG1 4.09Å; A588-L776 HydrophobicContact CB-CD1 3.74Å; A588-W781 HydrophobicContact CB-CZ2 3.7Å
589	E	96.9	Very high	94.6	Very high	29 Å²	29	40.1 Å²	40.1	14%	0.136	24%	0.235	C	C	.	.	H	α-helix	trans	-56.8	-53.2	174.2	180	177.8	-140	0	0	110.9	V585 A591 L592 Q593 V602 K604 L616	V585-E589 WeakPolarHBondContact O-CB 3.46Å; V585-E589 PolarHBondContact O-N 3.15Å; E589-A591 PolarHBondContact O-N 2.79Å; E589-L592 PolarHBondContact O-N 3.31Å; E589-Q593 VanDerWaalsContact O-CG 3.24Å; E589-Q593 WeakPolarHBondContact O-CG 3.47Å; E589-Q593 PolarHBondContact O-N 3.31Å; E589-V602 HydrophobicContact CG-CG1 4.45Å; E589-K604 WeakPolarHBondContact OE1-CB 3.17Å; E589-K604 WeakPolarHBondContact OE1-CD 3.44Å; E589-K604 WeakPolarHBondContact OE1-CE 3.28Å; E589-K604 IonicContact OE1-NZ 2.68Å; E589-K604 PolarHBondContact OE1-NZ 2.91Å; E589-K604 WeakPolarHBondContact OE2-CE 3.42Å; E589-K604 IonicContact OE2-NZ 3.78Å; E589-K604 PolarHBondContact OE2-NZ 2.95Å; E589-L616 HydrophobicContact CB-CD1 4.02Å; E589-L616 HydrophobicContact CB-CD2 4.09Å; E589-L616 HydrophobicContact CG-CD2 4.39Å
590	S	97.3	Very high	94.9	Very high	44 Å²	44	44.2 Å²	44.2	31%	0.308	25%	0.251	S	S	.	.	H	α-helix	trans	-62.1	-43	-180	-176.8	0	0	0	0	112.7	L586 Q593 D594 R789	L586-S590 VanDerWaalsContact O-CB 3.23Å; L586-S590 WeakPolarHBondContact O-CB 3.45Å; L586-S590 PolarHBondContact O-N 3.12Å; S590-Q593 PolarHBondContact O-N 2.96Å; S590-D594 PolarHBondContact O-N 3.21Å; S590-D594 VanDerWaalsContact O-N 3.07Å; S590-R789 VanDerWaalsContact C-NH2 3.31Å; S590-R789 PolarHBondContact O-NH2 3.03Å; S590-R789 VanDerWaalsContact O-NH2 3.16Å; S590-R789 PolarHBondContact OG-NH2 3.08Å
591	A	97	Very high	95	Very high	0 Å²	0	45.1 Å²	45.1	0%	0	26%	0.255	C	S	.	.	H	α-helix	trans	-72.9	-27.6	179.4	0	0	0	0	0	113.1	E587 A588 E589 L595 L793 L796	E587-A591 WeakPolarHBondContact O-CB 3.36Å; E587-A591 PolarHBondContact O-N 2.76Å; A588-A591 PolarHBondContact O-N 3.32Å; E589-A591 PolarHBondContact O-N 2.79Å; A591-L595 VanDerWaalsContact O-CB 3.31Å; A591-L595 WeakPolarHBondContact O-CB 3.25Å; A591-L595 PolarHBondContact O-N 3.07Å; A591-L595 VanDerWaalsContact O-N 3.11Å; A591-L793 HydrophobicContact CB-CD2 4.32Å; A591-L793 WeakPolarHBondContact O-CD2 3.23Å; A591-L796 HydrophobicContact CB-CD1 3.43Å; A591-L796 VanDerWaalsContact CB-CD1 3.43Å
592	L	97.1	Very high	95.2	Very high	0 Å²	0	40.5 Å²	40.5	0%	0	23%	0.231	C	C	.	.	H	α-helix	trans	-71.4	-36.4	169.7	-72.7	166.8	0	0	0	111.7	A588 E589 L595 L596 V602 L616 I618 V740 L796 I800	A588-L592 WeakPolarHBondContact O-CB 3.49Å; A588-L592 WeakPolarHBondContact O-CD1 3.24Å; A588-L592 WeakPolarHBondContact O-CG 3.44Å; A588-L592 PolarHBondContact O-N 3.39Å; E589-L592 PolarHBondContact O-N 3.31Å; L592-L595 HydrophobicContact CD2-CD2 4.32Å; L592-L595 PolarHBondContact O-N 2.97Å; L592-L596 HydrophobicContact CB-CD1 4.47Å; L592-L596 WeakPolarHBondContact O-CB 3.37Å; L592-L596 WeakPolarHBondContact O-CD1 3.31Å; L592-L596 VanDerWaalsContact O-CG 3.23Å; L592-L596 WeakPolarHBondContact O-CG 3.42Å; L592-L596 PolarHBondContact O-N 3.4Å; L592-V602 HydrophobicContact CB-CG1 4.42Å; L592-V602 HydrophobicContact CB-CG2 3.79Å; L592-L616 HydrophobicContact CD1-CB 4.3Å; L592-L616 HydrophobicContact CD1-CD1 3.79Å; L592-I618 HydrophobicContact CD1-CD1 4.13Å; L592-I618 HydrophobicContact CD2-CD1 3.89Å; L592-I618 HydrophobicContact CG-CD1 4.47Å; L592-V740 HydrophobicContact CD1-CB 4.47Å; L592-V740 HydrophobicContact CD1-CG1 4.31Å; L592-V740 HydrophobicContact CD1-CG2 4.29Å; L592-L796 HydrophobicContact CD2-CB 4.26Å; L592-L796 HydrophobicContact CD2-CD1 4.22Å; L592-L796 HydrophobicContact CD2-CD2 4.15Å; L592-L796 HydrophobicContact CD2-CG 4.45Å; L592-L796 HydrophobicContact CG-CD1 4.15Å; L592-L796 HydrophobicContact CG-CD2 4.42Å; L592-I800 HydrophobicContact CD2-CD1 4.25Å; L592-I800 HydrophobicContact CD2-CG1 4.05Å
593	Q	96.8	Very high	95.3	Very high	51 Å²	51	40.8 Å²	40.8	24%	0.238	24%	0.235	C	C	.	.	H	α-helix	trans	-64.2	-43.7	175.4	-70.7	171.1	-13.7	0	0	111.8	E589 S590 G597 G598 V602	E589-Q593 VanDerWaalsContact O-CG 3.24Å; E589-Q593 WeakPolarHBondContact O-CG 3.47Å; E589-Q593 PolarHBondContact O-N 3.31Å; S590-Q593 PolarHBondContact O-N 2.96Å; Q593-G597 PolarHBondContact O-N 3.47Å; Q593-G597 VanDerWaalsContact O-N 3.08Å; Q593-G598 PolarHBondContact O-N 3.3Å; Q593-V602 HydrophobicContact CG-CB 3.88Å; Q593-V602 HydrophobicContact CG-CG2 3.83Å
594	D	96.2	Very high	95.3	Very high	86 Å²	86	38.3 Å²	38.3	46%	0.46	22%	0.215	S	C	.	.	H	α-helix	trans	-57	-50.4	170.4	-77.2	14.7	0	0	0	111.5	S590 L596 G597 R789 L793	S590-D594 PolarHBondContact O-N 3.21Å; S590-D594 VanDerWaalsContact O-N 3.07Å; D594-L596 VanDerWaalsContact C-N 3.31Å; D594-L596 PolarHBondContact O-N 3.45Å; D594-G597 PolarHBondContact O-N 3.37Å; D594-R789 IonicContact OD1-NH2 3.28Å; D594-R789 PolarHBondContact OD1-NH2 2.75Å; D594-R789 IonicContact OD2-CZ 2.62Å; D594-R789 IonicContact OD2-NE 2.93Å; D594-R789 PolarHBondContact OD2-NE 2.9Å; D594-R789 IonicContact OD2-NH2 3.1Å; D594-R789 PolarHBondContact OD2-NH2 2.98Å; D594-L793 HydrophobicContact CB-CD2 3.64Å
595	L	96	Very high	95.3	Very high	39 Å²	39	40.6 Å²	40.6	20%	0.204	22%	0.223	C	C	.	.	H	α-helix	trans	-62.8	-34.9	-175.5	177.6	64.1	0	0	0	113.1	A591 L592 L793 L796 H797	A591-L595 VanDerWaalsContact O-CB 3.31Å; A591-L595 WeakPolarHBondContact O-CB 3.25Å; A591-L595 PolarHBondContact O-N 3.07Å; A591-L595 VanDerWaalsContact O-N 3.11Å; L592-L595 HydrophobicContact CD2-CD2 4.32Å; L592-L595 PolarHBondContact O-N 2.97Å; L595-L793 HydrophobicContact CB-CD2 4.03Å; L595-L796 HydrophobicContact CD2-CB 3.81Å; L595-H797 HydrophobicContact CD1-CB 4Å; L595-H797 HydrophobicContact CD2-CB 4.47Å
596	L	94.9	Very high	95.2	Very high	9 Å²	9	41.1 Å²	41.1	5%	0.047	23%	0.225	C	C	.	.	H	α-helix	trans	-99.6	-4.8	-173.8	-59.2	166.2	0	0	0	113	L592 D594 F601 V602 I618 L620 P626	L592-L596 HydrophobicContact CB-CD1 4.47Å; L592-L596 WeakPolarHBondContact O-CB 3.37Å; L592-L596 WeakPolarHBondContact O-CD1 3.31Å; L592-L596 VanDerWaalsContact O-CG 3.23Å; L592-L596 WeakPolarHBondContact O-CG 3.42Å; L592-L596 PolarHBondContact O-N 3.4Å; D594-L596 VanDerWaalsContact C-N 3.31Å; D594-L596 PolarHBondContact O-N 3.45Å; L596-F601 HydrophobicContact CB-CB 3.83Å; L596-F601 HydrophobicContact CB-CD2 4.32Å; L596-F601 HydrophobicContact CB-CG 4.33Å; L596-F601 HydrophobicContact CD1-CB 4.35Å; L596-F601 WeakPolarHBondContact O-CD2 3.43Å; L596-F601 WeakPolarHBondContact O-CE2 3.44Å; L596-V602 HydrophobicContact CD1-CG2 3.69Å; L596-I618 HydrophobicContact CD1-CB 4.38Å; L596-I618 HydrophobicContact CD1-CD1 3.85Å; L596-I618 HydrophobicContact CD1-CG1 3.76Å; L596-I618 HydrophobicContact CD1-CG2 3.68Å; L596-I618 HydrophobicContact CD2-CG2 4.34Å; L596-L620 HydrophobicContact CD2-CD2 4.21Å; L596-P626 HydrophobicContact CB-CB 4.24Å; L596-P626 HydrophobicContact CB-CG 4.04Å; L596-P626 HydrophobicContact CD2-CB 4.29Å; L596-P626 HydrophobicContact CD2-CG 3.69Å; L596-P626 HydrophobicContact CG-CG 4.47Å
597	G	93.6	Very high	95.2	Very high	54 Å²	54	38.8 Å²	38.8	56%	0.557	21%	0.213	S	C	*	.	T	Hydrogen-bonded Turn	trans	84.4	29.4	176.8	0	0	0	0	0	115.3	Q593 D594 F601	Q593-G597 PolarHBondContact O-N 3.47Å; Q593-G597 VanDerWaalsContact O-N 3.08Å; D594-G597 PolarHBondContact O-N 3.37Å; G597-F601 WeakPolarHBondContact O-CE2 3.37Å
598	G	92.7	Very high	95.1	Very high	21 Å²	21	37.1 Å²	37.1	22%	0.216	21%	0.205	C	C	.	.	S	Bend	trans	143.9	166.3	167.9	0	0	0	0	0	116.3	Q593 K600 F601	Q593-G598 PolarHBondContact O-N 3.3Å; G598-K600 VanDerWaalsContact C-N 3.34Å; G598-K600 PolarHBondContact O-N 3.28Å; G598-F601 PolarHBondContact O-N 3.24Å
599	D	91.8	Very high	94.9	Very high	118 Å²	118	39 Å²	39	63%	0.631	22%	0.217	S	C	*	.	G	3₁₀ helix	trans	-52.3	-44.4	175.6	65	-27	0	0	0	113.7	F601 V602	D599-F601 PolarHBondContact O-N 3.5Å; D599-V602 PolarHBondContact O-N 3.03Å; D599-V602 VanDerWaalsContact O-O 3.14Å
600	K	93.3	Very high	94.8	Very high	100 Å²	100	37.9 Å²	37.9	44%	0.435	21%	0.212	S	C	.	.	G	3₁₀ helix	trans	-55.5	-17.3	-178.1	71.2	-163.4	177.7	-166.6	0	115.3	G598 P628 V629	G598-K600 VanDerWaalsContact C-N 3.34Å; G598-K600 PolarHBondContact O-N 3.28Å; K600-P628 HydrophobicContact CB-CB 4.3Å; K600-P628 HydrophobicContact CG-CB 4.25Å; K600-P628 HydrophobicContact CG-CG 4.41Å; K600-P628 CarbonylContact O-C 3.44Å; K600-P628 VanDerWaalsContact O-CA 3.22Å; K600-P628 WeakPolarHBondContact O-CA 3.25Å; K600-V629 PolarHBondContact O-N 3.07Å; K600-V629 VanDerWaalsContact O-N 3.09Å
601	F	94.6	Very high	94.5	Very high	25 Å²	25	35.8 Å²	35.8	11%	0.11	20%	0.198	C	C	.	.	G	3₁₀ helix	trans	-96.5	-7.8	-179.2	-59.4	-66	0	0	0	114.1	L596 G597 G598 D599 P626 P628	L596-F601 HydrophobicContact CB-CB 3.83Å; L596-F601 HydrophobicContact CB-CD2 4.32Å; L596-F601 HydrophobicContact CB-CG 4.33Å; L596-F601 HydrophobicContact CD1-CB 4.35Å; L596-F601 WeakPolarHBondContact O-CD2 3.43Å; L596-F601 WeakPolarHBondContact O-CE2 3.44Å; G597-F601 WeakPolarHBondContact O-CE2 3.37Å; G598-F601 PolarHBondContact O-N 3.24Å; D599-F601 PolarHBondContact O-N 3.5Å; F601-P626 HydrophobicContact CB-CB 4.28Å; F601-P626 HydrophobicContact CD1-CB 3.42Å; F601-P626 VanDerWaalsContact CD1-CB 3.42Å; F601-P626 HydrophobicContact CD2-CB 4.3Å; F601-P626 HydrophobicContact CE1-CB 3.61Å; F601-P626 WeakPolarHBondContact CE1-O 3.34Å; F601-P626 HydrophobicContact CE2-CB 4.42Å; F601-P626 HydrophobicContact CG-CB 3.78Å; F601-P626 HydrophobicContact CZ-CB 4.09Å; F601-P628 HydrophobicContact CD1-CB 4.45Å; F601-P628 HydrophobicContact CD1-CG 4.1Å; F601-P628 HydrophobicContact CE1-CG 3.68Å
602	V	95.3	Very high	94.1	Very high	11 Å²	11	36.9 Å²	36.9	7%	0.067	20%	0.202	C	C	.	.			trans	-128.8	115.1	-177.9	-175.6	0	0	0	0	110.1	E589 L592 Q593 L596 D599 L616 E617 I618	E589-V602 HydrophobicContact CG-CG1 4.45Å; L592-V602 HydrophobicContact CB-CG1 4.42Å; L592-V602 HydrophobicContact CB-CG2 3.79Å; Q593-V602 HydrophobicContact CG-CB 3.88Å; Q593-V602 HydrophobicContact CG-CG2 3.83Å; L596-V602 HydrophobicContact CD1-CG2 3.69Å; D599-V602 PolarHBondContact O-N 3.03Å; D599-V602 VanDerWaalsContact O-O 3.14Å; V602-L616 HydrophobicContact CG1-CB 4.27Å; V602-E617 WeakPolarHBondContact CA-O 3.44Å; V602-I618 HydrophobicContact CG2-CG1 4.46Å
603	C	94.6	Very high	93.8	Very high	29 Å²	29	37.5 Å²	37.5	20%	0.196	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	107.5	176.5	-171.6	0	0	0	0	111.2	R605 E617 V629	C603-R605 PolarHBondContact O-N 3.1Å; C603-E617 HydrophobicContact CB-CB 4.28Å; C603-E617 PolarHBondContact N-O 2.92Å; C603-E617 PolarHBondContact O-N 2.99Å; C603-V629 HydrophobicContact CB-CB 4.1Å; C603-V629 HydrophobicContact CB-CG1 3.63Å; C603-V629 HydrophobicContact CB-CG2 4.41Å
604	K	94.3	Very high	93.6	Very high	43 Å²	43	35.7 Å²	35.7	19%	0.187	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.7	107.6	170.1	-179.4	168.5	65.3	-171.2	0	109.7	W572 C580 V585 E589 L616	W572-K604 WeakPolarHBondContact CH2-O 3.47Å; C580-K604 HydrophobicContact CB-CD 4.11Å; C580-K604 PolarHBondContact O-NZ 3.04Å; V585-K604 HydrophobicContact CG1-CD 3.9Å; E589-K604 WeakPolarHBondContact OE1-CB 3.17Å; E589-K604 WeakPolarHBondContact OE1-CD 3.44Å; E589-K604 WeakPolarHBondContact OE1-CE 3.28Å; E589-K604 IonicContact OE1-NZ 2.68Å; E589-K604 PolarHBondContact OE1-NZ 2.91Å; E589-K604 WeakPolarHBondContact OE2-CE 3.42Å; E589-K604 IonicContact OE2-NZ 3.78Å; E589-K604 PolarHBondContact OE2-NZ 2.95Å; K604-L616 HydrophobicContact CB-CD2 3.55Å; K604-L616 HydrophobicContact CD-CD2 4.02Å; K604-L616 HydrophobicContact CG-CD2 3.68Å
605	R	94	Very high	93.6	Very high	69 Å²	69	31.6 Å²	31.6	26%	0.26	18%	0.176	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.6	173.1	177.8	65.6	177.7	-179.1	-179.1	-2.4	112.3	C603 I607 D615 E617 C633	C603-R605 PolarHBondContact O-N 3.1Å; R605-I607 HydrophobicContact CG-CG1 4.2Å; R605-D615 PolarHBondContact N-O 3.46Å; R605-D615 VanDerWaalsContact N-O 3.17Å; R605-D615 PolarHBondContact O-N 3.12Å; R605-E617 IonicContact CZ-OE1 3.48Å; R605-E617 IonicContact CZ-OE2 2.73Å; R605-E617 IonicContact NE-OE2 3.01Å; R605-E617 PolarHBondContact NE-OE2 3.31Å; R605-E617 IonicContact NH2-OE1 2.73Å; R605-E617 PolarHBondContact NH2-OE1 3.5Å; R605-E617 IonicContact NH2-OE2 3.75Å; R605-E617 PolarHBondContact NH2-OE2 2.88Å; R605-C633 PolarHBondContact NH1-SG 3.12Å
606	M	94.1	Very high	93.7	Very high	16 Å²	16	29.8 Å²	29.8	8%	0.079	17%	0.166	C	C	.	.			trans	-89.7	99.6	165.7	-60.5	173.4	84.4	0	0	108.5	L571 W572 A575 M608 P609 I614	L571-M606 HydrophobicContact CB-CE 4.16Å; L571-M606 HydrophobicContact CB-SD 4.39Å; W572-M606 HydrophobicContact CB-SD 4.3Å; W572-M606 HydrophobicContact CE3-CG 3.74Å; W572-M606 HydrophobicContact CE3-SD 3.95Å; W572-M606 HydrophobicContact CZ3-CG 4.12Å; A575-M606 HydrophobicContact CB-SD 3.99Å; M606-M608 PolarHBondContact O-N 3.16Å; M606-P609 HydrophobicContact CB-CB 4.36Å; M606-P609 HydrophobicContact CB-CG 4.17Å; M606-P609 WeakPolarHBondContact CE-O 3.37Å; M606-P609 WeakPolarHBondContact O-CD 3.39Å; M606-P609 WeakPolarHBondContact O-CG 3.35Å; M606-I614 HydrophobicContact CG-CG2 3.89Å
607	I	95.2	Very high	93.7	Very high	23 Å²	23	29.4 Å²	29.4	12%	0.118	16%	0.164	C	C	.	.	S	Bend	trans	-66.7	-31.1	177.7	-56.1	174.5	0	0	0	110.2	R605 D615 E617 A739 L766 Y771	R605-I607 HydrophobicContact CG-CG1 4.2Å; I607-D615 HydrophobicContact CD1-CB 3.63Å; I607-D615 HydrophobicContact CG1-CB 3.95Å; I607-D615 PolarHBondContact N-OD2 3.39Å; I607-E617 HydrophobicContact CD1-CB 3.97Å; I607-E617 HydrophobicContact CD1-CG 4.13Å; I607-E617 WeakPolarHBondContact CG1-OE2 3.47Å; I607-A739 HydrophobicContact CD1-CB 3.6Å; I607-L766 HydrophobicContact CB-CD2 3.89Å; I607-L766 HydrophobicContact CD1-CD2 4.36Å; I607-L766 HydrophobicContact CG2-CD2 3.52Å; I607-Y771 HydrophobicContact CD1-CD1 4.21Å; I607-Y771 HydrophobicContact CD1-CE1 4.03Å; I607-Y771 HydrophobicContact CG2-CD2 4.08Å; I607-Y771 HydrophobicContact CG2-CE1 4.19Å; I607-Y771 HydrophobicContact CG2-CE2 3.62Å
608	M	95.1	Very high	93.8	Very high	13 Å²	13	26.8 Å²	26.8	6%	0.064	14%	0.138	C	C	.	.	S	Bend	trans	-124.7	77.3	176.3	-66.5	-67.2	164.7	0	0	109.9	L549 M606 H610 T611 K762 H765 L766 A769	L549-M608 HydrophobicContact CD1-CE 4.35Å; L549-M608 HydrophobicContact CD1-SD 3.91Å; M606-M608 PolarHBondContact O-N 3.16Å; M608-H610 PolarHBondContact O-N 2.97Å; M608-H610 VanDerWaalsContact O-N 3.12Å; M608-T611 HydrophobicContact CB-CG2 3.9Å; M608-T611 WeakPolarHBondContact CB-OG1 3.48Å; M608-T611 WeakPolarHBondContact O-CB 3.39Å; M608-T611 PolarHBondContact O-N 3.23Å; M608-T611 PolarHBondContact O-OG1 3.28Å; M608-K762 HydrophobicContact CB-CG 4.48Å; M608-H765 HydrophobicContact CE-CB 4.31Å; M608-H765 WeakPolarHBondContact CE-O 3.19Å; M608-H765 HydrophobicContact CG-CB 4.41Å; M608-H765 HydrophobicContact SD-CB 4.03Å; M608-L766 HydrophobicContact CE-CD2 4.16Å; M608-L766 HydrophobicContact CG-CD2 3.8Å; M608-L766 HydrophobicContact CG-CG 4.04Å; M608-A769 HydrophobicContact CE-CB 3.43Å; M608-A769 VanDerWaalsContact CE-CB 3.43Å
609	P	92.9	Very high	93.9	Very high	38 Å²	38	26 Å²	26	25%	0.247	13%	0.128	C	C	.	.	G	3₁₀ helix	trans	-53.4	-37.2	-172.4	-27.8	35.6	0	0	0	113.9	F541 A568 M606 T611 R612	F541-P609 HydrophobicContact CE1-CB 3.98Å; F541-P609 HydrophobicContact CZ-CB 4.13Å; A568-P609 HydrophobicContact CB-CB 4.27Å; M606-P609 HydrophobicContact CB-CB 4.36Å; M606-P609 HydrophobicContact CB-CG 4.17Å; M606-P609 WeakPolarHBondContact CE-O 3.37Å; M606-P609 WeakPolarHBondContact O-CD 3.39Å; M606-P609 WeakPolarHBondContact O-CG 3.35Å; P609-T611 PolarHBondContact O-N 3.06Å; P609-T611 VanDerWaalsContact O-N 3.15Å; P609-R612 WeakPolarHBondContact O-CA 3.24Å; P609-R612 PolarHBondContact O-N 3.08Å
610	H	93.3	Very high	94	Very high	6 Å²	6	20.3 Å²	20.3	3%	0.028	10%	0.098	C	C	.	.	G	3₁₀ helix	trans	-65.4	-15.2	179	72.1	-67.1	0	0	0	114.6	F541 T542 A545 M608 R612 H765	F541-H610 HydrophobicContact CD1-CB 3.83Å; F541-H610 HydrophobicContact CE1-CB 3.79Å; F541-H610 HydrophobicContact CG-CB 4.36Å; F541-H610 HydrophobicContact CZ-CB 4.26Å; T542-H610 PolarHBondContact OG1-O 3.28Å; A545-H610 HydrophobicContact CB-CB 3.68Å; A545-H610 WeakPolarHBondContact CB-CD2 3.05Å; A545-H610 VanDerWaalsContact CB-CG 3.41Å; M608-H610 PolarHBondContact O-N 2.97Å; M608-H610 VanDerWaalsContact O-N 3.12Å; H610-R612 VanDerWaalsContact C-N 3.33Å; H610-H765 AromaticContact CE1-ND1 3.61Å; H610-H765 AromaticContact NE2-CE1 3.37Å; H610-H765 PolarHBondContact NE2-CE1 3.42Å; H610-H765 AromaticContact NE2-ND1 2.99Å; H610-H765 PolarHBondContact NE2-ND1 3.16Å
611	T	91.3	Very high	93.8	Very high	1 Å²	1	16.4 Å²	16.4	1%	0.006	8%	0.082	C	C	.	.	G	3₁₀ helix	trans	-92.1	7.1	171.7	70.6	0	0	0	0	113.2	M608 P609 S613 M761 K762	M608-T611 HydrophobicContact CB-CG2 3.9Å; M608-T611 WeakPolarHBondContact CB-OG1 3.48Å; M608-T611 WeakPolarHBondContact O-CB 3.39Å; M608-T611 PolarHBondContact O-N 3.23Å; M608-T611 PolarHBondContact O-OG1 3.28Å; P609-T611 PolarHBondContact O-N 3.06Å; P609-T611 VanDerWaalsContact O-N 3.15Å; T611-S613 PolarHBondContact O-N 3Å; T611-S613 PolarHBondContact O-OG 3.31Å; T611-S613 VanDerWaalsContact O-OG 3.07Å; T611-M761 HydrophobicContact CG2-CE 4.25Å; T611-K762 HydrophobicContact CG2-CB 3.82Å; T611-K762 HydrophobicContact CG2-CG 3.94Å; T611-K762 WeakPolarHBondContact OG1-CD 3.41Å; T611-K762 VanDerWaalsContact OG1-CE 3.23Å; T611-K762 WeakPolarHBondContact OG1-CE 3.47Å; T611-K762 WeakPolarHBondContact OG1-CG 3.36Å
612	R	89.7	Confident	93.4	Very high	22 Å²	22	18.9 Å²	18.9	8%	0.083	10%	0.101	C	C	.	.	T	Hydrogen-bonded Turn	trans	61.9	13.8	164.5	-48.8	176.9	-162.6	179.5	4.4	115.2	Y94 V96 K538 D539 T542 L571 P609 H610	Y94-R612 WeakPolarHBondContact CE1-O 3.44Å; Y94-R612 PolarHBondContact OH-O 3Å; V96-R612 HydrophobicContact CG2-CB 4.5Å; K538-R612 PolarHBondContact O-NH2 2.8Å; D539-R612 IonicContact OD1-CZ 3.6Å; D539-R612 IonicContact OD1-NH1 3.53Å; D539-R612 PolarHBondContact OD1-NH1 2.97Å; D539-R612 VanDerWaalsContact OD1-NH1 3.09Å; D539-R612 IonicContact OD1-NH2 3.56Å; D539-R612 PolarHBondContact OD1-NH2 3.45Å; T542-R612 PolarHBondContact OG1-NE 3.49Å; T542-R612 PolarHBondContact OG1-NH2 2.99Å; L571-R612 HydrophobicContact CD1-CG 4.31Å; L571-R612 HydrophobicContact CD2-CB 4.46Å; L571-R612 HydrophobicContact CD2-CG 4.13Å; P609-R612 WeakPolarHBondContact O-CA 3.24Å; P609-R612 PolarHBondContact O-N 3.08Å; H610-R612 VanDerWaalsContact C-N 3.33Å
613	S	89.8	Confident	93	Very high	13 Å²	13	25.4 Å²	25.4	9%	0.091	13%	0.128	C	C	.	.			trans	-136.6	148.6	-174.6	50.1	0	0	0	0	112.1	T611 K762	T611-S613 PolarHBondContact O-N 3Å; T611-S613 PolarHBondContact O-OG 3.31Å; T611-S613 VanDerWaalsContact O-OG 3.07Å; S613-K762 PolarHBondContact O-NZ 2.9Å; S613-K762 WeakPolarHBondContact OG-CD 3.05Å; S613-K762 PolarHBondContact OG-NZ 3.46Å
614	I	93.5	Very high	92.6	Very high	14 Å²	14	24.3 Å²	24.3	7%	0.072	12%	0.121	C	C	.	.			trans	-79.5	165.8	178.2	68.6	86.8	0	0	0	112.1	W572 A575 V579 V585 M606 I742 K762	W572-I614 HydrophobicContact CZ3-CG2 4.03Å; A575-I614 HydrophobicContact CB-CG2 3.86Å; V579-I614 HydrophobicContact CB-CG1 4.34Å; V579-I614 HydrophobicContact CB-CG2 4.43Å; V579-I614 HydrophobicContact CG1-CG1 3.57Å; V579-I614 HydrophobicContact CG1-CG2 4.47Å; V585-I614 HydrophobicContact CG1-CD1 3.83Å; V585-I614 HydrophobicContact CG2-CD1 4.37Å; M606-I614 HydrophobicContact CG-CG2 3.89Å; I614-I742 HydrophobicContact CD1-CD1 4.34Å; I614-K762 PolarHBondContact O-NZ 2.94Å; I614-K762 VanDerWaalsContact O-NZ 3.13Å
615	D	96.2	Very high	92.4	Very high	0 Å²	0	27.7 Å²	27.7	0%	0	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.6	158.7	169	-48.6	-89.6	0	0	0	107.7	R605 I607 Q741 K762	R605-D615 PolarHBondContact N-O 3.46Å; R605-D615 VanDerWaalsContact N-O 3.17Å; R605-D615 PolarHBondContact O-N 3.12Å; I607-D615 HydrophobicContact CD1-CB 3.63Å; I607-D615 HydrophobicContact CG1-CB 3.95Å; I607-D615 PolarHBondContact N-OD2 3.39Å; D615-Q741 WeakPolarHBondContact OD1-CG 3.13Å; D615-Q741 PolarHBondContact OD1-NE2 2.93Å; D615-K762 WeakPolarHBondContact OD1-CE 3.12Å; D615-K762 IonicContact OD1-NZ 3.77Å; D615-K762 PolarHBondContact OD1-NZ 3.49Å; D615-K762 WeakPolarHBondContact OD2-CE 3.37Å; D615-K762 IonicContact OD2-NZ 3.17Å; D615-K762 PolarHBondContact OD2-NZ 2.76Å
616	L	97.1	Very high	92.4	Very high	0 Å²	0	26 Å²	26	0%	0	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	116.2	166	-54.4	175.9	0	0	0	108.1	A588 E589 L592 V602 K604 V740 I742	A588-L616 HydrophobicContact CB-CD1 3.85Å; E589-L616 HydrophobicContact CB-CD1 4.02Å; E589-L616 HydrophobicContact CB-CD2 4.09Å; E589-L616 HydrophobicContact CG-CD2 4.39Å; L592-L616 HydrophobicContact CD1-CB 4.3Å; L592-L616 HydrophobicContact CD1-CD1 3.79Å; V602-L616 HydrophobicContact CG1-CB 4.27Å; K604-L616 HydrophobicContact CB-CD2 3.55Å; K604-L616 HydrophobicContact CD-CD2 4.02Å; K604-L616 HydrophobicContact CG-CD2 3.68Å; L616-V740 HydrophobicContact CB-CB 4.21Å; L616-V740 PolarHBondContact N-O 3.37Å; L616-V740 WeakPolarHBondContact O-CB 3.5Å; L616-V740 PolarHBondContact O-N 2.73Å; L616-I742 HydrophobicContact CD1-CD1 3.81Å; L616-I742 HydrophobicContact CG-CD1 3.9Å
617	E	96.3	Very high	92.3	Very high	1 Å²	1	26.1 Å²	26.1	1%	0.005	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.2	133.5	-175.8	-169.4	170.7	149.6	0	0	111.9	V602 C603 R605 I607 H619 I738 Y771	V602-E617 WeakPolarHBondContact CA-O 3.44Å; C603-E617 HydrophobicContact CB-CB 4.28Å; C603-E617 PolarHBondContact N-O 2.92Å; C603-E617 PolarHBondContact O-N 2.99Å; R605-E617 IonicContact CZ-OE1 3.48Å; R605-E617 IonicContact CZ-OE2 2.73Å; R605-E617 IonicContact NE-OE2 3.01Å; R605-E617 PolarHBondContact NE-OE2 3.31Å; R605-E617 IonicContact NH2-OE1 2.73Å; R605-E617 PolarHBondContact NH2-OE1 3.5Å; R605-E617 IonicContact NH2-OE2 3.75Å; R605-E617 PolarHBondContact NH2-OE2 2.88Å; I607-E617 HydrophobicContact CD1-CB 3.97Å; I607-E617 HydrophobicContact CD1-CG 4.13Å; I607-E617 WeakPolarHBondContact CG1-OE2 3.47Å; E617-H619 IonicContact OE1-CD2 2.76Å; E617-H619 IonicContact OE1-CE1 3.85Å; E617-H619 IonicContact OE1-NE2 2.89Å; E617-H619 PolarHBondContact OE1-NE2 3.31Å; E617-I738 WeakPolarHBondContact CA-O 3.45Å; E617-Y771 HydrophobicContact CG-CE1 3.9Å; E617-Y771 PolarHBondContact OE1-OH 3Å; E617-Y771 VanDerWaalsContact OE1-OH 3.1Å
618	I	95.4	Very high	92.1	Very high	0 Å²	0	26.8 Å²	26.8	0%	0	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.8	141	177.4	-58.1	157.8	0	0	0	107.8	L592 L596 V602 L620 I738 V740 I800	L592-I618 HydrophobicContact CD1-CD1 4.13Å; L592-I618 HydrophobicContact CD2-CD1 3.89Å; L592-I618 HydrophobicContact CG-CD1 4.47Å; L596-I618 HydrophobicContact CD1-CB 4.38Å; L596-I618 HydrophobicContact CD1-CD1 3.85Å; L596-I618 HydrophobicContact CD1-CG1 3.76Å; L596-I618 HydrophobicContact CD1-CG2 3.68Å; L596-I618 HydrophobicContact CD2-CG2 4.34Å; V602-I618 HydrophobicContact CG2-CG1 4.46Å; I618-L620 HydrophobicContact CG2-CD2 3.85Å; I618-L620 HydrophobicContact CG2-CG 4.17Å; I618-I738 HydrophobicContact CB-CB 4.38Å; I618-I738 PolarHBondContact N-O 3.42Å; I618-I738 PolarHBondContact O-N 3.22Å; I618-V740 HydrophobicContact CD1-CG2 3.64Å; I618-I800 HydrophobicContact CD1-CD1 3.67Å; I618-I800 HydrophobicContact CD1-CG1 4.49Å
619	H	94.3	Very high	91.7	Very high	3 Å²	3	26.2 Å²	26.2	1%	0.014	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	134	169.4	-59.2	159.5	0	0	0	109.5	E617 I627 L632 V736	E617-H619 IonicContact OE1-CD2 2.76Å; E617-H619 IonicContact OE1-CE1 3.85Å; E617-H619 IonicContact OE1-NE2 2.89Å; E617-H619 PolarHBondContact OE1-NE2 3.31Å; H619-I627 HydrophobicContact CB-CB 3.94Å; H619-I627 HydrophobicContact CB-CG2 4.43Å; H619-I627 PolarHBondContact O-N 3.49Å; H619-L632 WeakPolarHBondContact ND1-CD1 3.5Å; H619-V736 WeakPolarHBondContact CA-O 3.31Å
620	L	92.9	Very high	90.6	Very high	0 Å²	0	30 Å²	30	0%	0	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	146.7	175.7	-57.4	-178.8	0	0	0	110.3	L596 I618 Q625 P626 S735 V736 I738 I800 L804	L596-L620 HydrophobicContact CD2-CD2 4.21Å; I618-L620 HydrophobicContact CG2-CD2 3.85Å; I618-L620 HydrophobicContact CG2-CG 4.17Å; L620-Q625 CarbonylContact C-O 3.59Å; L620-Q625 WeakPolarHBondContact CA-O 3.37Å; L620-P626 HydrophobicContact CD2-CB 4.41Å; L620-P626 HydrophobicContact CD2-CG 4.3Å; L620-S735 CarbonylContact O-C 3.6Å; L620-S735 VanDerWaalsContact O-CA 3.32Å; L620-S735 WeakPolarHBondContact O-CA 3.41Å; L620-V736 PolarHBondContact N-O 3.02Å; L620-V736 PolarHBondContact O-N 3.43Å; L620-I738 HydrophobicContact CD1-CD1 3.72Å; L620-I738 HydrophobicContact CG-CD1 4.27Å; L620-I800 HydrophobicContact CD1-CG2 3.87Å; L620-L804 HydrophobicContact CD1-CD1 4.06Å; L620-L804 HydrophobicContact CD1-CD2 3.97Å; L620-L804 HydrophobicContact CD1-CG 4.23Å
621	D	90.6	Very high	88.8	Confident	18 Å²	18	35.3 Å²	35.3	10%	0.096	19%	0.185	C	C	.	.			trans	-77.1	172.1	172.3	94.9	-27.3	0	0	0	111.6	K623 G624 Q625 I627	D621-K623 PolarHBondContact O-N 2.8Å; D621-K623 VanDerWaalsContact OD1-CA 3.23Å; D621-K623 WeakPolarHBondContact OD1-CA 3.47Å; D621-K623 VanDerWaalsContact OD1-CB 3.31Å; D621-K623 WeakPolarHBondContact OD1-CB 3.47Å; D621-K623 PolarHBondContact OD1-N 3.02Å; D621-K623 IonicContact OD2-NZ 3.98Å; D621-G624 PolarHBondContact O-N 2.87Å; D621-G624 PolarHBondContact OD1-N 3.12Å; D621-G624 VanDerWaalsContact OD1-N 3.11Å; D621-Q625 PolarHBondContact N-O 2.93Å; D621-Q625 WeakPolarHBondContact OD1-CB 3.38Å; D621-Q625 PolarHBondContact OD1-N 3.41Å; D621-I627 HydrophobicContact CB-CD1 3.84Å; D621-I627 HydrophobicContact CB-CG1 4.14Å
622	P	85.8	Confident	86.8	Confident	77 Å²	77	38.5 Å²	38.5	50%	0.5	20%	0.202	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.1	-2.7	176.5	-25.4	36.3	0	0	0	116	N734	P622-N734 HydrophobicContact CG-CB 3.69Å
623	K	86.5	Confident	84.2	Confident	148 Å²	148	39.8 Å²	39.8	64%	0.643	21%	0.214	S	C	*	.	T	Hydrogen-bonded Turn	trans	-112.9	13.4	175.4	-52	164	-168.3	135.4	0	111.1	D621 Q625	D621-K623 PolarHBondContact O-N 2.8Å; D621-K623 VanDerWaalsContact OD1-CA 3.23Å; D621-K623 WeakPolarHBondContact OD1-CA 3.47Å; D621-K623 VanDerWaalsContact OD1-CB 3.31Å; D621-K623 WeakPolarHBondContact OD1-CB 3.47Å; D621-K623 PolarHBondContact OD1-N 3.02Å; D621-K623 IonicContact OD2-NZ 3.98Å; K623-Q625 VanDerWaalsContact C-N 3.27Å; K623-Q625 HydrophobicContact CB-CG 4.34Å; K623-Q625 PolarHBondContact O-N 3.49Å; K623-Q625 PolarHBondContact O-NE2 3.21Å
624	G	87.1	Confident	81.3	Confident	5 Å²	5	45.1 Å²	45.1	5%	0.052	25%	0.248	C	C	.	.	S	Bend	trans	73.3	7.8	-178.1	0	0	0	0	0	115.1	D621 Y801	D621-G624 PolarHBondContact O-N 2.87Å; D621-G624 PolarHBondContact OD1-N 3.12Å; D621-G624 VanDerWaalsContact OD1-N 3.11Å; G624-Y801 WeakPolarHBondContact O-CE1 3.15Å
625	Q	90.5	Very high	78.2	Confident	115 Å²	115	53.5 Å²	53.5	54%	0.537	28%	0.284	S	S	.	.			trans	-78.6	137.9	-176.5	-58.4	-55	-65.9	0	0	111.6	L620 D621 K623 I627	L620-Q625 CarbonylContact C-O 3.59Å; L620-Q625 WeakPolarHBondContact CA-O 3.37Å; D621-Q625 PolarHBondContact N-O 2.93Å; D621-Q625 WeakPolarHBondContact OD1-CB 3.38Å; D621-Q625 PolarHBondContact OD1-N 3.41Å; K623-Q625 VanDerWaalsContact C-N 3.27Å; K623-Q625 HydrophobicContact CB-CG 4.34Å; K623-Q625 PolarHBondContact O-N 3.49Å; K623-Q625 PolarHBondContact O-NE2 3.21Å; Q625-I627 PolarHBondContact O-N 3.35Å
626	P	92.5	Very high	75.2	Confident	32 Å²	32	62.4 Å²	62.4	21%	0.208	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.6	132	179.7	-25.3	35.9	0	0	0	114	L596 F601 L620	L596-P626 HydrophobicContact CB-CB 4.24Å; L596-P626 HydrophobicContact CB-CG 4.04Å; L596-P626 HydrophobicContact CD2-CB 4.29Å; L596-P626 HydrophobicContact CD2-CG 3.69Å; L596-P626 HydrophobicContact CG-CG 4.47Å; F601-P626 HydrophobicContact CB-CB 4.28Å; F601-P626 HydrophobicContact CD1-CB 3.42Å; F601-P626 VanDerWaalsContact CD1-CB 3.42Å; F601-P626 HydrophobicContact CD2-CB 4.3Å; F601-P626 HydrophobicContact CE1-CB 3.61Å; F601-P626 WeakPolarHBondContact CE1-O 3.34Å; F601-P626 HydrophobicContact CE2-CB 4.42Å; F601-P626 HydrophobicContact CG-CB 3.78Å; F601-P626 HydrophobicContact CZ-CB 4.09Å; L620-P626 HydrophobicContact CD2-CB 4.41Å; L620-P626 HydrophobicContact CD2-CG 4.3Å
627	I	92.8	Very high	71.7	Confident	20 Å²	20	69.3 Å²	69.3	10%	0.103	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	131.6	173.4	-60.6	173.2	0	0	0	108.8	H619 D621 Q625 V629	H619-I627 HydrophobicContact CB-CB 3.94Å; H619-I627 HydrophobicContact CB-CG2 4.43Å; H619-I627 PolarHBondContact O-N 3.49Å; D621-I627 HydrophobicContact CB-CD1 3.84Å; D621-I627 HydrophobicContact CB-CG1 4.14Å; Q625-I627 PolarHBondContact O-N 3.35Å; I627-V629 PolarHBondContact O-N 2.89Å
628	P	91.8	Very high	68.6	Low	36 Å²	36	74.4 Å²	74.4	23%	0.234	40%	0.396	C	S	.	.			trans	-65.7	117.7	178.4	-20.5	32	0	0	0	112.4	K600 F601 N630 L631	K600-P628 HydrophobicContact CB-CB 4.3Å; K600-P628 HydrophobicContact CG-CB 4.25Å; K600-P628 HydrophobicContact CG-CG 4.41Å; K600-P628 CarbonylContact O-C 3.44Å; K600-P628 VanDerWaalsContact O-CA 3.22Å; K600-P628 WeakPolarHBondContact O-CA 3.25Å; F601-P628 HydrophobicContact CD1-CB 4.45Å; F601-P628 HydrophobicContact CD1-CG 4.1Å; F601-P628 HydrophobicContact CE1-CG 3.68Å; P628-N630 PolarHBondContact O-N 3.4Å; P628-N630 VanDerWaalsContact O-N 3.11Å; P628-L631 HydrophobicContact CB-CD1 4.18Å; P628-L631 HydrophobicContact CB-CG 4.24Å; P628-L631 HydrophobicContact CG-CD1 4.11Å; P628-L631 WeakPolarHBondContact O-CB 3.36Å; P628-L631 PolarHBondContact O-N 2.9Å
629	V	85.4	Confident	65.4	Low	1 Å²	1	81.2 Å²	81.2	1%	0.006	44%	0.437	C	S	.	.	G	3₁₀ helix	trans	-58.4	-31.9	-173.7	178.3	0	0	0	0	112.2	K600 C603 I627 L631 L632	K600-V629 PolarHBondContact O-N 3.07Å; K600-V629 VanDerWaalsContact O-N 3.09Å; C603-V629 HydrophobicContact CB-CB 4.1Å; C603-V629 HydrophobicContact CB-CG1 3.63Å; C603-V629 HydrophobicContact CB-CG2 4.41Å; I627-V629 PolarHBondContact O-N 2.89Å; V629-L631 PolarHBondContact O-N 3.22Å; V629-L631 VanDerWaalsContact O-N 3.16Å; V629-L632 PolarHBondContact O-N 3.13Å
630	N	70.3	Confident	62.1	Low	117 Å²	117	89 Å²	89	63%	0.626	48%	0.476	S	S	*	.	G	3₁₀ helix	trans	-68.6	-6.1	178.7	-69.4	-25.1	0	0	0	114.8	P628 L632	P628-N630 PolarHBondContact O-N 3.4Å; P628-N630 VanDerWaalsContact O-N 3.11Å; N630-L632 VanDerWaalsContact C-N 3.34Å
631	L	54.5	Low	58.9	Low	118 Å²	118	95.1 Å²	95.1	62%	0.618	51%	0.513	S	S	*	.	G	3₁₀ helix	trans	-79.2	-17.8	171.9	-67.8	173.6	0	0	0	113.2	P628 V629	P628-L631 HydrophobicContact CB-CD1 4.18Å; P628-L631 HydrophobicContact CB-CG 4.24Å; P628-L631 HydrophobicContact CG-CD1 4.11Å; P628-L631 WeakPolarHBondContact O-CB 3.36Å; P628-L631 PolarHBondContact O-N 2.9Å; V629-L631 PolarHBondContact O-N 3.22Å; V629-L631 VanDerWaalsContact O-N 3.16Å
632	L	49	Very low	55.8	Low	69 Å²	69	100 Å²	100	36%	0.361	55%	0.546	S	S	.	.	S	Bend	trans	-105.2	-0.1	-173.9	-88.9	167.4	0	0	0	114.5	H619 V629 N630 I732	H619-L632 WeakPolarHBondContact ND1-CD1 3.5Å; V629-L632 PolarHBondContact O-N 3.13Å; N630-L632 VanDerWaalsContact C-N 3.34Å; L632-I732 HydrophobicContact CD1-CG2 4.32Å; L632-I732 HydrophobicContact CD2-CG2 3.78Å; L632-I732 HydrophobicContact CG-CG2 4.29Å
633	C	35.1	Very low	52.9	Low	49 Å²	49	101.6 Å²	101.6	33%	0.331	56%	0.559	S	S	.	*	S	Bend	trans	-117.9	128	174	-64	0	0	0	0	110.2	R605 K635	R605-C633 PolarHBondContact NH1-SG 3.12Å; C633-K635 PolarHBondContact O-N 3.44Å
634	P	29.5	Very low	50.2	Low	124 Å²	124	99.8 Å²	99.8	81%	0.805	57%	0.565	S	S	*	*			trans	-54.5	139.8	160.2	-21.4	33.4	0	0	0	109.4	Q636	P634-Q636 PolarHBondContact O-N 2.93Å
635	K	29.2	Very low	47.5	Very low	191 Å²	191	108.7 Å²	108.7	83%	0.83	61%	0.605	S	S	*	*			trans	-60.8	107.9	-173.7	-65.3	-178.5	-179.4	-178.8	0	111.3	C633	C633-K635 PolarHBondContact O-N 3.44Å
636	Q	31.8	Very low	44.4	Very low	187 Å²	187	108.3 Å²	108.3	87%	0.874	62%	0.615	S	S	*	*	P	Polyproline II helix	trans	-66.7	129.7	143.6	-70.8	-178.9	-18	0	0	106.6	P634	P634-Q636 PolarHBondContact O-N 2.93Å
637	N	24.6	Very low	41.3	Very low	144 Å²	144	119.2 Å²	119.2	77%	0.77	65%	0.652	S	S	*	*	P	Polyproline II helix	trans	-67.5	134.3	-170.9	-72	-41.4	0	0	0	110.8	T639	N637-T639 PolarHBondContact O-N 2.88Å
638	P	31.5	Very low	38.2	Very low	109 Å²	109	125.4 Å²	125.4	71%	0.708	68%	0.681	S	S	*	*	P	Polyproline II helix	trans	-61.8	134.3	169.6	-16.4	29.2	0	0	0	109.7	M640	P638-M640 PolarHBondContact O-N 3.49Å
639	T	27.6	Very low	35.2	Very low	142 Å²	142	132.5 Å²	132.5	87%	0.871	71%	0.708	S	S	*	*			trans	-63.1	104.4	179.8	-36	0	0	0	0	110.2	N637 V641	N637-T639 PolarHBondContact O-N 2.88Å; T639-V641 PolarHBondContact O-N 3.47Å
640	M	25	Very low	32.4	Very low	166 Å²	166	139.3 Å²	139.3	82%	0.818	74%	0.743	S	S	*	*			trans	-68.5	124.3	172.7	-82.1	-172.6	65.5	0	0	110.1	P638 P642	P638-M640 PolarHBondContact O-N 3.49Å; M640-P642 WeakPolarHBondContact O-CD 3.42Å
641	V	25.9	Very low	30.4	Very low	129 Å²	129	141.7 Å²	141.7	78%	0.782	76%	0.756	S	S	*	*			trans	-66.3	123.1	163.3	-179.3	0	0	0	0	107.6	T639 S643	T639-V641 PolarHBondContact O-N 3.47Å; V641-S643 PolarHBondContact O-N 3.46Å; V641-S643 VanDerWaalsContact O-N 3.1Å
642	P	25.9	Very low	29.1	Very low	122 Å²	122	141.1 Å²	141.1	79%	0.792	76%	0.761	S	S	*	*			trans	-76.8	100.5	-177.2	29.6	-33.6	0	0	0	110.8	M640	M640-P642 WeakPolarHBondContact O-CD 3.42Å
643	S	24.6	Very low	28.1	Very low	109 Å²	109	141.6 Å²	141.6	76%	0.762	78%	0.783	S	S	*	*			trans	-72.4	130.1	162.1	48.6	0	0	0	0	109.8	V641 Q645	V641-S643 PolarHBondContact O-N 3.46Å; V641-S643 VanDerWaalsContact O-N 3.1Å; S643-Q645 PolarHBondContact O-N 3.02Å; S643-Q645 VanDerWaalsContact O-N 3.11Å
644	S	30.3	Very low	28	Very low	111 Å²	111	146 Å²	146	78%	0.776	81%	0.808	S	S	*	*	S	Bend	trans	-82	89.2	-172.9	55.4	0	0	0	0	112.5
645	Q	29	Very low	28	Very low	192 Å²	192	146.1 Å²	146.1	90%	0.897	81%	0.807	S	S	*	*			trans	-177	109.3	155.2	-103.4	155.3	36.7	0	0	111.5	S643	S643-Q645 PolarHBondContact O-N 3.02Å; S643-Q645 VanDerWaalsContact O-N 3.11Å
646	S	25.6	Very low	28.3	Very low	107 Å²	107	143.7 Å²	143.7	75%	0.748	80%	0.801	S	S	*	*			trans	152.6	90.1	155.9	-174.9	0	0	0	0	109.4
647	W	27.7	Very low	29.4	Very low	261 Å²	261	139 Å²	139	99%	0.989	79%	0.786	S	S	*	*			trans	-129.2	36	175.9	-94.2	82.3	0	0	0	111.2
648	E	27.5	Very low	30.2	Very low	149 Å²	149	138.4 Å²	138.4	70%	0.696	78%	0.783	S	S	*	*			trans	-126.4	123.8	175.2	-72.3	-164.9	-178.2	0	0	112.1
649	K	28.8	Very low	30.6	Very low	185 Å²	185	138.7 Å²	138.7	80%	0.804	78%	0.778	S	S	*	*			trans	68.6	137.4	-177.8	-52.5	139.7	-172.1	160.1	0	111.7
650	I	27.7	Very low	31.4	Very low	145 Å²	145	136.5 Å²	136.5	74%	0.744	76%	0.761	S	S	*	*			cis	-126.9	127.3	20.2	-65.4	163.4	0	0	0	110.4	S652	I650-S652 WeakPolarHBondContact CG2-OG 3.3Å
651	N	27.4	Very low	32.1	Very low	167 Å²	167	133.5 Å²	133.5	89%	0.893	75%	0.747	S	S	*	*			trans	-86.4	132.4	158.1	-87.7	-24.5	0	0	0	108.8
652	S	28	Very low	32.9	Very low	105 Å²	105	130.2 Å²	130.2	73%	0.734	73%	0.733	S	S	*	*			trans	-145.4	96.9	168.6	-71.2	0	0	0	0	108.3	I650	I650-S652 WeakPolarHBondContact CG2-OG 3.3Å
653	G	28.2	Very low	33.7	Very low	80 Å²	80	130.8 Å²	130.8	83%	0.825	73%	0.726	S	S	*	*	P	Polyproline II helix	trans	-75.6	149.9	-179.7	0	0	0	0	0	112.1
654	V	32	Very low	34.4	Very low	140 Å²	140	132.7 Å²	132.7	85%	0.848	73%	0.726	S	S	*	*	P	Polyproline II helix	trans	-86.7	123.3	173.5	179.2	0	0	0	0	109.1	I656	V654-I656 PolarHBondContact O-N 3.02Å
655	T	30.5	Very low	35.1	Very low	127 Å²	127	133.4 Å²	133.4	78%	0.779	72%	0.72	S	S	*	*	P	Polyproline II helix	trans	-74	118.7	172.2	27	0	0	0	0	110.7
656	I	35.7	Very low	35.3	Very low	140 Å²	140	133.3 Å²	133.3	72%	0.718	72%	0.717	S	S	*	*	P	Polyproline II helix	trans	-71.4	137.4	169.5	-58.1	174	0	0	0	108.1	V654 L660	V654-I656 PolarHBondContact O-N 3.02Å; I656-L660 HydrophobicContact CG2-CD2 4.3Å
657	T	53.5	Low	35.6	Very low	89 Å²	89	131.9 Å²	131.9	55%	0.546	72%	0.719	S	S	.	*			trans	-111.2	149.6	177.7	53.8	0	0	0	0	111.2	N659 L660	T657-N659 PolarHBondContact O-N 2.86Å; T657-L660 WeakPolarHBondContact O-CB 3.43Å; T657-L660 PolarHBondContact O-N 3.45Å
658	D	41.8	Very low	35.9	Very low	132 Å²	132	128.7 Å²	128.7	71%	0.706	71%	0.712	S	S	*	*	H	α-helix	trans	-59.8	-22.4	-174.1	-54.2	-70.5	0	0	0	113.9	L660 L661 A662	D658-L660 VanDerWaalsContact C-N 3.26Å; D658-L660 PolarHBondContact O-N 3.43Å; D658-L661 WeakPolarHBondContact O-CB 3.3Å; D658-L661 PolarHBondContact O-N 2.98Å; D658-L661 VanDerWaalsContact O-N 3.14Å; D658-A662 PolarHBondContact O-N 2.74Å
659	N	40.6	Very low	36	Very low	114 Å²	114	128.7 Å²	128.7	61%	0.61	72%	0.717	S	S	*	*	H	α-helix	trans	-65.5	-29.8	176.2	-153.1	12.1	0	0	0	112.1	T657 Q663	T657-N659 PolarHBondContact O-N 2.86Å; N659-Q663 WeakPolarHBondContact O-CG 3.49Å; N659-Q663 PolarHBondContact O-N 2.99Å
660	L	43.4	Very low	36	Very low	97 Å²	97	125.7 Å²	125.7	51%	0.508	72%	0.719	S	S	.	*	H	α-helix	trans	-74.1	-35.9	172.4	-158.8	78.2	0	0	0	111.4	I656 T657 D658	I656-L660 HydrophobicContact CG2-CD2 4.3Å; T657-L660 WeakPolarHBondContact O-CB 3.43Å; T657-L660 PolarHBondContact O-N 3.45Å; D658-L660 VanDerWaalsContact C-N 3.26Å; D658-L660 PolarHBondContact O-N 3.43Å
661	L	40.4	Very low	36	Very low	103 Å²	103	125 Å²	125	54%	0.539	72%	0.722	S	S	.	*	H	α-helix	trans	-67.2	-40.4	177	-164.1	71.6	0	0	0	111.4	D658 Q663 L664 I665	D658-L661 WeakPolarHBondContact O-CB 3.3Å; D658-L661 PolarHBondContact O-N 2.98Å; D658-L661 VanDerWaalsContact O-N 3.14Å; L661-Q663 PolarHBondContact O-N 3.25Å; L661-L664 PolarHBondContact O-N 3.01Å; L661-I665 WeakPolarHBondContact O-CD1 3.49Å; L661-I665 WeakPolarHBondContact O-CG1 3.21Å
662	A	42.1	Very low	36	Very low	59 Å²	59	125.6 Å²	125.6	49%	0.488	72%	0.72	S	S	.	*	H	α-helix	trans	-64.6	-35.9	178.2	0	0	0	0	0	113.5	D658 I665	D658-A662 PolarHBondContact O-N 2.74Å; A662-I665 PolarHBondContact O-N 3.16Å
663	Q	43.7	Very low	36	Very low	135 Å²	135	128.5 Å²	128.5	63%	0.631	73%	0.726	S	S	*	*	H	α-helix	trans	-71.8	-26.6	-178.4	-72.7	176.4	19.7	0	0	113.5	N659 L661 I665	N659-Q663 WeakPolarHBondContact O-CG 3.49Å; N659-Q663 PolarHBondContact O-N 2.99Å; L661-Q663 PolarHBondContact O-N 3.25Å; Q663-I665 VanDerWaalsContact C-N 3.29Å; Q663-I665 PolarHBondContact O-N 3.02Å
664	L	39.3	Very low	36.7	Very low	148 Å²	148	130.2 Å²	130.2	78%	0.775	72%	0.722	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.6	-9.3	179.4	-72.6	166.8	0	0	0	114.1	L661	L661-L664 PolarHBondContact O-N 3.01Å
665	I	44.3	Very low	37.1	Very low	127 Å²	127	129.7 Å²	129.7	65%	0.651	72%	0.722	S	S	*	*	T	Hydrogen-bonded Turn	trans	-102.5	-5.8	-169.2	-65.5	173.4	0	0	0	112.9	L661 A662 Q663	L661-I665 WeakPolarHBondContact O-CD1 3.49Å; L661-I665 WeakPolarHBondContact O-CG1 3.21Å; A662-I665 PolarHBondContact O-N 3.16Å; Q663-I665 VanDerWaalsContact C-N 3.29Å; Q663-I665 PolarHBondContact O-N 3.02Å
666	K	34.2	Very low	37	Very low	189 Å²	189	128.1 Å²	128.1	82%	0.822	72%	0.722	S	S	*	*			trans	-141	124.5	174.8	-65.5	179.4	179.5	177.4	0	111
667	G	30.2	Very low	36.5	Very low	77 Å²	77	127.9 Å²	127.9	79%	0.794	73%	0.727	S	S	*	*			cis	174.6	160.2	-5.9	0	0	0	0	0	110.9
668	K	34.9	Very low	35.3	Very low	195 Å²	195	130.8 Å²	130.8	85%	0.848	74%	0.738	S	S	*	*			trans	-103.3	149.9	170.1	-75.5	-176.9	173.5	-179.5	0	110.5
669	N	29.9	Very low	34.5	Very low	149 Å²	149	129 Å²	129	80%	0.797	74%	0.741	S	S	*	*				165.4	165.3	122.4	-84.3	-12.4	0	0	0	114.1
670	S	28.8	Very low	33.7	Very low	121 Å²	121	127.4 Å²	127.4	85%	0.846	74%	0.744	S	S	*	*			trans	79.7	163	162.9	71.4	0	0	0	0	119.1
671	T	28.2	Very low	32.9	Very low	132 Å²	132	128.3 Å²	128.3	81%	0.81	76%	0.758	S	S	*	*			trans	-156.6	165.8	-143	-35.8	0	0	0	0	111.9
672	E	26	Very low	32.3	Very low	179 Å²	179	128.3 Å²	128.3	84%	0.836	77%	0.767	S	S	*	*			trans	96.2	164	161	-54.6	-163.6	156.5	0	0	119.9
673	L	27.6	Very low	31.5	Very low	166 Å²	166	132.1 Å²	132.1	87%	0.869	78%	0.784	S	S	*	*			trans	-112.6	-160.5	-158.3	-66.9	116.2	0	0	0	110.5
674	P	44.7	Very low	30.5	Very low	115 Å²	115	129.3 Å²	129.3	75%	0.747	79%	0.791	S	S	*	*			cis	-130	-153.1	-4.3	42.7	-20.7	0	0	0	111.5
675	P	39.8	Very low	29.6	Very low	129 Å²	129	131.3 Å²	131.3	84%	0.838	80%	0.796	S	S	*	*			cis	-132	-164.7	-0.3	42.6	-22	0	0	0	116.4
676	A	28.7	Very low	28.7	Very low	94 Å²	94	131.5 Å²	131.5	78%	0.777	80%	0.803	S	S	*	*			trans	-129.3	168.5	-162.5	0	0	0	0	0	115.6
677	T	25.7	Very low	28.3	Very low	135 Å²	135	128.6 Å²	128.6	83%	0.828	80%	0.804	S	S	*	*			trans	-177.8	152.7	161.3	33.6	0	0	0	0	110.7
678	I	27.9	Very low	27.9	Very low	151 Å²	151	130.5 Å²	130.5	77%	0.774	80%	0.804	S	S	*	*			cis	-165.1	145.8	-30	-153.5	172	0	0	0	110.4
679	A	24.6	Very low	27.3	Very low	94 Å²	94	130.4 Å²	130.4	78%	0.777	81%	0.806	S	S	*	*			trans	56.7	162.6	159.9	0	0	0	0	0	122.1
680	A	23.9	Very low	26.9	Very low	80 Å²	80	132.5 Å²	132.5	66%	0.661	81%	0.808	S	S	*	*			cis	-175.2	156.7	-36.9	0	0	0	0	0	111.6
681	S	27.2	Very low	26.6	Very low	116 Å²	116	134.3 Å²	134.3	81%	0.811	81%	0.808	S	S	*	*			trans	61.5	156.2	154.2	37	0	0	0	0	120.3
682	S	26.1	Very low	26.6	Very low	104 Å²	104	133.6 Å²	133.6	73%	0.727	81%	0.805	S	S	*	*			cis	-167.8	151.2	-12.4	46.7	0	0	0	0	112.8
683	V	26.1	Very low	27.2	Very low	139 Å²	139	130 Å²	130	84%	0.842	80%	0.798	S	S	*	*			trans	24.2	135.1	145.2	-171	0	0	0	0	121.5
684	G	22.4	Very low	27.1	Very low	75 Å²	75	129.6 Å²	129.6	77%	0.773	80%	0.796	S	S	*	*			trans	-155.8	154.9	159.3	0	0	0	0	0	111.7
685	E	20.9	Very low	26.1	Very low	190 Å²	190	132.5 Å²	132.5	89%	0.888	80%	0.8	S	S	*	*			trans	-110.9	171.2	-162.8	-64	-174.5	126.3	0	0	116.5
686	T	24.8	Very low	25.4	Very low	131 Å²	131	134.6 Å²	134.6	80%	0.804	80%	0.804	S	S	*	*			trans	-72.5	163.6	-178.1	-16.6	0	0	0	0	114.3
687	P	26	Very low	25.2	Very low	129 Å²	129	133.2 Å²	133.2	84%	0.838	80%	0.799	S	S	*	*				-142.3	178.1	110.9	38.2	-25	0	0	0	114.9
688	C	22.4	Very low	25.2	Very low	116 Å²	116	138.4 Å²	138.4	78%	0.784	80%	0.803	S	S	*	*			trans	-124	143.8	-171.6	-178.9	0	0	0	0	112.4
689	Q	22.4	Very low	25.1	Very low	194 Å²	194	136.2 Å²	136.2	91%	0.907	80%	0.797	S	S	*	*			trans	-141	174.4	170.3	-79.7	-166.9	-14	0	0	112
690	K	20.7	Very low	25.1	Very low	192 Å²	192	141 Å²	141	84%	0.835	80%	0.8	S	S	*	*			trans	-145.8	151.5	-156.3	-112.5	-174.7	179.7	-177.2	0	113.9
691	L	21.8	Very low	25.2	Very low	160 Å²	160	144.3 Å²	144.3	84%	0.838	81%	0.807	S	S	*	*			trans	69.2	163.2	162.1	-61.5	162.3	0	0	0	116.2
692	P	29.1	Very low	25.2	Very low	117 Å²	117	143.8 Å²	143.8	76%	0.76	80%	0.804	S	S	*	*			cis	-117.9	-167.5	-5.3	43.9	-29.3	0	0	0	112.2
693	P	38.9	Very low	25.3	Very low	104 Å²	104	145.1 Å²	145.1	68%	0.675	81%	0.807	S	S	*	*			trans	-98.4	169.3	179.2	39	-32.2	0	0	0	113.8
694	D	24.3	Very low	25.3	Very low	156 Å²	156	146.6 Å²	146.6	83%	0.834	81%	0.809	S	S	*	*				-177.5	177.8	130	-92.1	-9.8	0	0	0	112.8
695	E	24.4	Very low	25.5	Very low	177 Å²	177	149.4 Å²	149.4	83%	0.827	81%	0.807	S	S	*	*			trans	-73.9	164.7	-152.8	-50.2	-173	118.9	0	0	119.9
696	D	24.8	Very low	25.9	Very low	173 Å²	173	149.9 Å²	149.9	93%	0.925	81%	0.806	S	S	*	*			trans	53.6	160.8	154.2	-99	11.2	0	0	0	121.7
697	G	25	Very low	26.2	Very low	65 Å²	65	149.4 Å²	149.4	67%	0.67	80%	0.803	S	S	*	*			trans	152.1	-42.1	154.4	0	0	0	0	0	120.6
698	R	26.3	Very low	26.5	Very low	243 Å²	243	148 Å²	148	92%	0.917	79%	0.788	S	S	*	*			trans	71.5	162	-175.9	-43.2	174.5	179.9	-159.5	0.4	118
699	V	24.5	Very low	26.8	Very low	105 Å²	105	148.6 Å²	148.6	64%	0.636	78%	0.784	S	S	*	*			trans	70.8	105.1	161	-161.4	0	0	0	0	119.3
700	F	24.2	Very low	27.3	Very low	194 Å²	194	147.3 Å²	147.3	85%	0.851	78%	0.78	S	S	*	*				162.3	104.9	123.3	-91.8	-66.2	0	0	0	106.2
701	D	26.7	Very low	28.1	Very low	150 Å²	150	144 Å²	144	80%	0.802	77%	0.77	S	S	*	*			cis	74.4	66.3	41	-153.1	21.6	0	0	0	114.1
702	S	27.2	Very low	28.6	Very low	106 Å²	106	143.6 Å²	143.6	74%	0.741	76%	0.764	S	S	*	*			trans	-164.9	168.3	152.1	56.6	0	0	0	0	110.6
703	V	28.6	Very low	28.5	Very low	131 Å²	131	143.5 Å²	143.5	79%	0.794	76%	0.761	S	S	*	*			trans	69.5	62.4	174	-159.2	0	0	0	0	116.2
704	L	25.9	Very low	28.2	Very low	171 Å²	171	145.9 Å²	145.9	90%	0.895	77%	0.768	S	S	*	*			trans	-137.4	39	154	-86.5	-174.7	0	0	0	112.9	F706	L704-F706 PolarHBondContact O-N 3.1Å
705	D	27.3	Very low	28.5	Very low	134 Å²	134	142.7 Å²	142.7	72%	0.717	75%	0.754	S	S	*	*			trans	-80.4	98	165.3	-82.2	-49.3	0	0	0	110.4
706	F	27.8	Very low	28.7	Very low	200 Å²	200	144.3 Å²	144.3	88%	0.877	76%	0.758	S	S	*	*			trans	-170.8	86.5	148.3	-88.4	-53.6	0	0	0	110.5	L704	L704-F706 PolarHBondContact O-N 3.1Å
707	T	32	Very low	29.1	Very low	120 Å²	120	140.7 Å²	140.7	74%	0.736	74%	0.744	S	S	*	*	S	Bend	trans	-172.3	-21.1	158.4	7.5	0	0	0	0	114.3	D709	T707-D709 VanDerWaalsContact C-N 3.34Å; T707-D709 PolarHBondContact O-N 3.45Å
708	N	31.6	Very low	29.3	Very low	100 Å²	100	143.1 Å²	143.1	54%	0.535	75%	0.751	S	S	.	*	T	Hydrogen-bonded Turn	trans	-65.7	-26.3	-172.4	-70.9	-37.8	0	0	0	115.4	M710 I711 E712	N708-M710 PolarHBondContact O-N 3.49Å; N708-M710 VanDerWaalsContact O-N 3.14Å; N708-I711 PolarHBondContact O-N 3.03Å; N708-E712 PolarHBondContact O-N 3.13Å
709	D	28.4	Very low	29.7	Very low	128 Å²	128	141.2 Å²	141.2	68%	0.684	74%	0.743	S	S	*	*	H	α-helix	trans	-58.4	-29.4	-174.5	-79.2	-1.8	0	0	0	114.6	T707 I711 T713	T707-D709 VanDerWaalsContact C-N 3.34Å; T707-D709 PolarHBondContact O-N 3.45Å; D709-I711 VanDerWaalsContact C-N 3.26Å; D709-I711 PolarHBondContact O-N 3.45Å; D709-T713 PolarHBondContact O-OG1 2.85Å
710	M	34.3	Very low	30.2	Very low	168 Å²	168	143 Å²	143	83%	0.828	75%	0.75	S	S	*	*	H	α-helix	trans	-79	-5.4	176.5	-67.5	-168	72.7	0	0	113.9	N708	N708-M710 PolarHBondContact O-N 3.49Å; N708-M710 VanDerWaalsContact O-N 3.14Å
711	I	36.2	Very low	30.7	Very low	122 Å²	122	141 Å²	141	63%	0.626	75%	0.748	S	S	*	*	H	α-helix	trans	-109	-37.9	-179	-62.2	179.7	0	0	0	111.4	N708 D709	N708-I711 PolarHBondContact O-N 3.03Å; D709-I711 VanDerWaalsContact C-N 3.26Å; D709-I711 PolarHBondContact O-N 3.45Å
712	E	32.6	Very low	31	Very low	151 Å²	151	142.1 Å²	142.1	71%	0.706	74%	0.741	S	S	*	*	H	α-helix	trans	-73.3	-27.9	-178.2	-66	-141.1	123.5	0	0	113.9	N708 L714 T715	N708-E712 PolarHBondContact O-N 3.13Å; E712-L714 PolarHBondContact O-N 3.32Å; E712-L714 VanDerWaalsContact O-N 3.07Å; E712-T715 PolarHBondContact O-N 3.44Å
713	T	28.5	Very low	31.6	Very low	116 Å²	116	143.7 Å²	143.7	71%	0.712	75%	0.746	S	S	*	*	T	Hydrogen-bonded Turn	trans	-64	-14.8	-177.5	30.9	0	0	0	0	114.8	D709	D709-T713 PolarHBondContact O-OG1 2.85Å
714	L	31.3	Very low	32.2	Very low	154 Å²	154	144.8 Å²	144.8	81%	0.806	74%	0.742	S	S	*	*	T	Hydrogen-bonded Turn	trans	-106.1	4.7	-177.8	-73.4	171.5	0	0	0	115.5	E712	E712-L714 PolarHBondContact O-N 3.32Å; E712-L714 VanDerWaalsContact O-N 3.07Å
715	T	31.6	Very low	32.7	Very low	88 Å²	88	144.4 Å²	144.4	54%	0.54	73%	0.729	S	S	.	*			trans	-127.8	66.1	-173.5	55.8	0	0	0	0	116.4	E712 P717	E712-T715 PolarHBondContact O-N 3.44Å; T715-P717 VanDerWaalsContact C-CD 3.47Å; T715-P717 WeakPolarHBondContact O-CD 3.14Å
716	K	28.5	Very low	33.3	Very low	212 Å²	212	141.9 Å²	141.9	92%	0.922	72%	0.715	S	S	*	*			trans	-105	86.3	164	-75.8	-176.4	178.8	173	0	113.4
717	P	31.6	Very low	34.1	Very low	96 Å²	96	134.9 Å²	134.9	62%	0.623	69%	0.691	S	S	*	*			trans	-79.6	153.2	159.2	34.2	-32.7	0	0	0	110.9	T715	T715-P717 VanDerWaalsContact C-CD 3.47Å; T715-P717 WeakPolarHBondContact O-CD 3.14Å
718	S	30.1	Very low	34.9	Very low	117 Å²	117	132.6 Å²	132.6	82%	0.818	68%	0.677	S	S	*	*			trans	-66	156.4	178.1	-166.9	0	0	0	0	112.9	N720	S718-N720 PolarHBondContact O-N 3.44Å
719	R	34.5	Very low	35.7	Very low	202 Å²	202	135.6 Å²	135.6	76%	0.762	68%	0.681	S	S	*	*	S	Bend	trans	-65.2	113.4	174.7	-91.6	174.7	155.6	165	-8.5	110.5
720	N	35.1	Very low	36.7	Very low	144 Å²	144	135.9 Å²	135.9	77%	0.77	68%	0.678	S	S	*	*				-174.9	170.7	122.7	-88.3	-17.6	0	0	0	110.7	S718	S718-N720 PolarHBondContact O-N 3.44Å
721	N	34.4	Very low	37.4	Very low	151 Å²	151	130.9 Å²	130.9	81%	0.807	65%	0.654	S	S	*	*			trans	61.3	77.4	-177.4	-59.3	-2.5	0	0	0	115.1
722	R	34.3	Very low	38.4	Very low	174 Å²	174	127.3 Å²	127.3	66%	0.657	64%	0.636	S	S	*	*			trans	-89.2	-39	178.3	-71.7	-176.4	167	-164.9	-9.9	114.9	H724 R725	R722-H724 VanDerWaalsContact C-N 3.33Å; R722-H724 PolarHBondContact O-N 3.23Å; R722-H724 VanDerWaalsContact O-N 3.11Å; R722-R725 PolarHBondContact O-N 3.39Å
723	T	38.8	Very low	39.7	Very low	138 Å²	138	128.8 Å²	128.8	85%	0.847	64%	0.64	S	S	*	*	T	Hydrogen-bonded Turn	trans	-61.5	-27.1	-162.8	46.2	0	0	0	0	116.6
724	H	40.6	Very low	41.8	Very low	154 Å²	154	128.3 Å²	128.3	71%	0.713	63%	0.634	S	S	*	*	T	Hydrogen-bonded Turn	trans	-102.9	-3.4	-176.2	-148	-49.3	0	0	0	114.1	R722	R722-H724 VanDerWaalsContact C-N 3.33Å; R722-H724 PolarHBondContact O-N 3.23Å; R722-H724 VanDerWaalsContact O-N 3.11Å
725	R	36.9	Very low	44.4	Very low	163 Å²	163	122 Å²	122	62%	0.615	60%	0.602	S	S	*	*	T	Hydrogen-bonded Turn	trans	-94.2	-30.2	178.9	-113	-176.1	179.4	-153.7	-0.9	113	R722 R729	R722-R725 PolarHBondContact O-N 3.39Å; R725-R729 WeakPolarHBondContact O-CG 3.3Å; R725-R729 PolarHBondContact O-N 3.02Å; R725-R729 VanDerWaalsContact O-N 3.12Å
726	D	39.4	Very low	47.2	Very low	81 Å²	81	119.6 Å²	119.6	43%	0.433	59%	0.587	S	S	.	*	H	α-helix	trans	-78.6	-32.3	-172.4	-62.3	-28.2	0	0	0	111.9	R729 Q730	D726-R729 PolarHBondContact O-N 2.84Å; D726-Q730 PolarHBondContact O-N 2.83Å
727	S	46.2	Very low	50.3	Low	54 Å²	54	113 Å²	113	38%	0.378	56%	0.558	S	S	.	*	H	α-helix	trans	-60.5	-50.8	169.5	51.6	0	0	0	0	112.3	R729 Q730 D731	S727-R729 PolarHBondContact O-N 3.16Å; S727-Q730 WeakPolarHBondContact O-CA 3.21Å; S727-Q730 VanDerWaalsContact O-CB 3.27Å; S727-Q730 WeakPolarHBondContact O-CB 3.32Å; S727-Q730 PolarHBondContact O-N 3.24Å; S727-D731 PolarHBondContact O-N 3.02Å
728	V	48.8	Very low	53.4	Low	71 Å²	71	108.4 Å²	108.4	43%	0.43	53%	0.529	S	S	.	.	H	α-helix	trans	-59.4	-36.6	177.4	179.6	0	0	0	0	111.3	I732	V728-I732 HydrophobicContact CG1-CD1 3.93Å; V728-I732 WeakPolarHBondContact O-CB 3.36Å; V728-I732 WeakPolarHBondContact O-CD1 3.49Å; V728-I732 WeakPolarHBondContact O-CG1 3.34Å; V728-I732 PolarHBondContact O-N 3.33Å; V728-I732 VanDerWaalsContact O-N 3.09Å
729	R	48.6	Very low	56.6	Low	164 Å²	164	102.8 Å²	102.8	62%	0.619	49%	0.49	S	S	*	.	H	α-helix	trans	-68	-34.9	173	-79.5	176.7	153.4	-159.2	-11.9	113.1	R725 D726 S727 K733	R725-R729 WeakPolarHBondContact O-CG 3.3Å; R725-R729 PolarHBondContact O-N 3.02Å; R725-R729 VanDerWaalsContact O-N 3.12Å; D726-R729 PolarHBondContact O-N 2.84Å; S727-R729 PolarHBondContact O-N 3.16Å; R729-K733 PolarHBondContact O-N 3.49Å
730	Q	48.3	Very low	59.6	Low	134 Å²	134	93.2 Å²	93.2	63%	0.626	45%	0.453	S	S	*	.	H	α-helix	trans	-67.4	-48.9	175.4	-149.5	89.6	-6.1	0	0	111.1	D726 S727 I732 K733	D726-Q730 PolarHBondContact O-N 2.83Å; S727-Q730 WeakPolarHBondContact O-CA 3.21Å; S727-Q730 VanDerWaalsContact O-CB 3.27Å; S727-Q730 WeakPolarHBondContact O-CB 3.32Å; S727-Q730 PolarHBondContact O-N 3.24Å; Q730-I732 PolarHBondContact O-N 3.3Å; Q730-K733 WeakPolarHBondContact O-CB 3.41Å; Q730-K733 PolarHBondContact O-N 2.9Å; Q730-K733 VanDerWaalsContact O-N 3.07Å
731	D	49.5	Very low	62.5	Low	62 Å²	62	86.9 Å²	86.9	33%	0.332	42%	0.419	S	S	.	.	H	α-helix	trans	-63.5	-41.1	-179.3	-69.7	-39.5	0	0	0	111.7	S727 K733 N734 S735	S727-D731 PolarHBondContact O-N 3.02Å; D731-K733 PolarHBondContact O-N 3.45Å; D731-N734 PolarHBondContact O-N 3.23Å; D731-N734 VanDerWaalsContact O-N 3.17Å; D731-S735 PolarHBondContact O-N 3.14Å
732	I	56	Low	65.4	Low	48 Å²	48	80.8 Å²	80.8	25%	0.246	39%	0.387	C	S	.	.	H	α-helix	trans	-58.8	-35.2	172.8	-74.9	168.5	0	0	0	111.8	L632 V728 Q730 N734 S735	L632-I732 HydrophobicContact CD1-CG2 4.32Å; L632-I732 HydrophobicContact CD2-CG2 3.78Å; L632-I732 HydrophobicContact CG-CG2 4.29Å; V728-I732 HydrophobicContact CG1-CD1 3.93Å; V728-I732 WeakPolarHBondContact O-CB 3.36Å; V728-I732 WeakPolarHBondContact O-CD1 3.49Å; V728-I732 WeakPolarHBondContact O-CG1 3.34Å; V728-I732 PolarHBondContact O-N 3.33Å; V728-I732 VanDerWaalsContact O-N 3.09Å; Q730-I732 PolarHBondContact O-N 3.3Å; I732-N734 PolarHBondContact O-N 3.26Å; I732-S735 WeakPolarHBondContact O-CB 3.49Å; I732-S735 PolarHBondContact O-N 3.48Å; I732-S735 PolarHBondContact O-OG 3.05Å
733	K	61.2	Low	68.1	Low	181 Å²	181	72.6 Å²	72.6	79%	0.787	36%	0.356	S	S	*	.	H	α-helix	trans	-69.8	-20.7	-178.7	-154.8	176.1	-176.5	-176.5	0	112.8	R729 Q730 D731	R729-K733 PolarHBondContact O-N 3.49Å; Q730-K733 WeakPolarHBondContact O-CB 3.41Å; Q730-K733 PolarHBondContact O-N 2.9Å; Q730-K733 VanDerWaalsContact O-N 3.07Å; D731-K733 PolarHBondContact O-N 3.45Å
734	N	72.2	Confident	70.5	Confident	107 Å²	107	67.2 Å²	67.2	57%	0.572	32%	0.322	S	S	*	.	T	Hydrogen-bonded Turn	trans	-106.7	11.6	178	-64.9	-13.4	0	0	0	113.1	P622 D731 I732	P622-N734 HydrophobicContact CG-CB 3.69Å; D731-N734 PolarHBondContact O-N 3.23Å; D731-N734 VanDerWaalsContact O-N 3.17Å; I732-N734 PolarHBondContact O-N 3.26Å
735	S	85.9	Confident	72.7	Confident	20 Å²	20	65.1 Å²	65.1	14%	0.14	31%	0.308	C	S	.	.			trans	-69.1	133.7	-176.8	66.2	0	0	0	0	112.9	L620 D731 I732 K737	L620-S735 CarbonylContact O-C 3.6Å; L620-S735 VanDerWaalsContact O-CA 3.32Å; L620-S735 WeakPolarHBondContact O-CA 3.41Å; D731-S735 PolarHBondContact O-N 3.14Å; I732-S735 WeakPolarHBondContact O-CB 3.49Å; I732-S735 PolarHBondContact O-N 3.48Å; I732-S735 PolarHBondContact O-OG 3.05Å; S735-K737 PolarHBondContact O-N 3.03Å
736	V	90.9	Very high	75.1	Confident	39 Å²	39	58.3 Å²	58.3	24%	0.236	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80	115.6	173.1	-176.1	0	0	0	0	109.1	H619 L620 I738 R772 L804	H619-V736 WeakPolarHBondContact CA-O 3.31Å; L620-V736 PolarHBondContact N-O 3.02Å; L620-V736 PolarHBondContact O-N 3.43Å; V736-I738 HydrophobicContact CG1-CG1 4.08Å; V736-R772 HydrophobicContact CG1-CB 4.44Å; V736-L804 HydrophobicContact CB-CD2 4.22Å; V736-L804 HydrophobicContact CG1-CD2 4.18Å; V736-L804 HydrophobicContact CG2-CD2 4.14Å
737	K	93.9	Very high	77.6	Confident	72 Å²	72	55.4 Å²	55.4	31%	0.313	27%	0.267	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.3	124.1	173.4	-57.3	-178.7	-175	172.1	0	109.7	S735 Y771 R772	S735-K737 PolarHBondContact O-N 3.03Å; K737-Y771 HydrophobicContact CB-CD1 3.6Å; K737-Y771 HydrophobicContact CB-CE1 3.68Å; K737-Y771 HydrophobicContact CB-CG 4.26Å; K737-Y771 HydrophobicContact CD-CE1 4.07Å; K737-Y771 HydrophobicContact CD-CE2 4.48Å; K737-Y771 HydrophobicContact CG-CE1 4.43Å; K737-Y771 WeakPolarHBondContact O-CA 3.11Å; K737-R772 PolarHBondContact O-N 2.89Å
738	I	96	Very high	79.9	Confident	0 Å²	0	53.1 Å²	53.1	0%	0	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	128.1	179.5	-58.1	-178.8	0	0	0	109.4	E617 I618 L620 V736 V740 R772 V774 I800	E617-I738 WeakPolarHBondContact CA-O 3.45Å; I618-I738 HydrophobicContact CB-CB 4.38Å; I618-I738 PolarHBondContact N-O 3.42Å; I618-I738 PolarHBondContact O-N 3.22Å; L620-I738 HydrophobicContact CD1-CD1 3.72Å; L620-I738 HydrophobicContact CG-CD1 4.27Å; V736-I738 HydrophobicContact CG1-CG1 4.08Å; I738-V740 HydrophobicContact CG2-CG2 3.9Å; I738-R772 CarbonylContact C-O 3.51Å; I738-R772 WeakPolarHBondContact CA-O 3.43Å; I738-R772 HydrophobicContact CG1-CB 4.41Å; I738-V774 HydrophobicContact CG2-CB 4.04Å; I738-V774 HydrophobicContact CG2-CG2 3.67Å; I738-I800 HydrophobicContact CD1-CG2 4.11Å; I738-I800 HydrophobicContact CG2-CD1 4.18Å
739	A	97.1	Very high	81.9	Confident	0 Å²	0	49.9 Å²	49.9	0%	0	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	105.5	169.3	0	0	0	0	0	109	I607 L766 Y771 R772 V774	I607-A739 HydrophobicContact CD1-CB 3.6Å; A739-L766 HydrophobicContact CB-CD1 3.96Å; A739-L766 HydrophobicContact CB-CD2 4Å; A739-Y771 HydrophobicContact CB-CD1 4.06Å; A739-Y771 HydrophobicContact CB-CG 4.34Å; A739-R772 PolarHBondContact N-O 3.24Å; A739-V774 PolarHBondContact O-N 2.91Å
740	V	97.5	Very high	83.8	Confident	0 Å²	0	43 Å²	43	0%	0	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.1	121.8	178.5	-173.5	0	0	0	0	109.8	L592 L616 I618 I738 V774 L776 I800	L592-V740 HydrophobicContact CD1-CB 4.47Å; L592-V740 HydrophobicContact CD1-CG1 4.31Å; L592-V740 HydrophobicContact CD1-CG2 4.29Å; L616-V740 HydrophobicContact CB-CB 4.21Å; L616-V740 PolarHBondContact N-O 3.37Å; L616-V740 WeakPolarHBondContact O-CB 3.5Å; L616-V740 PolarHBondContact O-N 2.73Å; I618-V740 HydrophobicContact CD1-CG2 3.64Å; I738-V740 HydrophobicContact CG2-CG2 3.9Å; V740-V774 CarbonylContact C-O 3.55Å; V740-V774 WeakPolarHBondContact CA-O 3.4Å; V740-V774 HydrophobicContact CG1-CG1 4.45Å; V740-V774 HydrophobicContact CG2-CB 4.4Å; V740-L776 HydrophobicContact CG1-CD1 3.79Å; V740-L776 HydrophobicContact CG1-CD2 4.08Å; V740-L776 HydrophobicContact CG1-CG 3.63Å; V740-I800 HydrophobicContact CG2-CD1 3.65Å
741	Q	96	Very high	85.6	Confident	12 Å²	12	43.5 Å²	43.5	6%	0.056	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110	109.8	-174.9	-59.4	-157.4	-42.5	0	0	112	D615 S743 V773 V774 L776	D615-Q741 WeakPolarHBondContact OD1-CG 3.13Å; D615-Q741 PolarHBondContact OD1-NE2 2.93Å; Q741-S743 PolarHBondContact O-N 3.3Å; Q741-V773 HydrophobicContact CG-CG1 3.92Å; Q741-V774 PolarHBondContact N-O 3.4Å; Q741-L776 PolarHBondContact O-N 3.38Å
742	I	94.5	Very high	87.4	Confident	23 Å²	23	43.1 Å²	43.1	12%	0.118	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.5	105.4	165.7	-54	81	0	0	0	107.2	E584 V585 A588 I614 L616 L776	E584-I742 HydrophobicContact CB-CG2 4.17Å; E584-I742 HydrophobicContact CG-CG2 3.72Å; V585-I742 HydrophobicContact CG2-CB 4.39Å; V585-I742 HydrophobicContact CG2-CD1 4.42Å; V585-I742 HydrophobicContact CG2-CG1 4.3Å; V585-I742 HydrophobicContact CG2-CG2 4.49Å; A588-I742 HydrophobicContact CB-CD1 4.33Å; A588-I742 HydrophobicContact CB-CG1 4.09Å; I614-I742 HydrophobicContact CD1-CD1 4.34Å; L616-I742 HydrophobicContact CD1-CD1 3.81Å; L616-I742 HydrophobicContact CG-CD1 3.9Å; I742-L776 HydrophobicContact CG1-CD1 4.36Å
743	S	91.5	Very high	89	Confident	2 Å²	2	47.7 Å²	47.7	1%	0.014	23%	0.231	C	C	.	.			trans	-100.8	129.7	-174	-64.4	0	0	0	0	111.3	Q741 R763 E775 L776 H778	Q741-S743 PolarHBondContact O-N 3.3Å; S743-R763 PolarHBondContact OG-NH2 2.98Å; S743-R763 VanDerWaalsContact OG-NH2 3.13Å; S743-E775 VanDerWaalsContact CB-OE1 3.29Å; S743-E775 WeakPolarHBondContact CB-OE1 3.31Å; S743-L776 PolarHBondContact N-O 3.24Å; S743-H778 VanDerWaalsContact O-CB 3.3Å; S743-H778 WeakPolarHBondContact O-CB 3.36Å; S743-H778 PolarHBondContact O-N 2.89Å; S743-H778 VanDerWaalsContact O-N 3.1Å
744	N	89.3	Confident	90.5	Very high	24 Å²	24	41.9 Å²	41.9	13%	0.128	21%	0.207	C	C	.	.			trans	-95.1	161.5	-179.2	-164.5	-68.7	0	0	0	111	N746 H747 Y748	N744-N746 PolarHBondContact O-N 2.99Å; N744-N746 PolarHBondContact OD1-N 3.29Å; N744-H747 PolarHBondContact N-CE1 2.95Å; N744-H747 PolarHBondContact N-ND1 3.06Å; N744-H747 WeakPolarHBondContact O-CB 3.29Å; N744-H747 PolarHBondContact O-N 3.18Å; N744-Y748 WeakPolarHBondContact O-CD2 3.44Å
745	R	88.1	Confident	91.6	Very high	110 Å²	110	38 Å²	38	42%	0.415	19%	0.186	S	C	.	.	G	3₁₀ helix	trans	-54.7	-34.7	175.4	-167.1	174.6	-171.2	-167.4	3.1	112.7	H747 Y748 H778	R745-H747 PolarHBondContact O-N 3.26Å; R745-H747 VanDerWaalsContact O-N 3.17Å; R745-Y748 PolarHBondContact O-N 3.38Å; R745-H778 VanDerWaalsContact CA-CE1 3.44Å; R745-H778 WeakPolarHBondContact CA-CE1 3.19Å
746	N	87.4	Confident	92	Very high	20 Å²	20	37.3 Å²	37.3	11%	0.107	18%	0.181	C	C	.	.	G	3₁₀ helix	trans	-71.6	-1.9	178.5	-70.3	-2.3	0	0	0	114.5	H430 N744	H430-N746 PolarHBondContact CE1-O 3.42Å; H430-N746 VanDerWaalsContact CE1-O 3.23Å; N744-N746 PolarHBondContact O-N 2.99Å; N744-N746 PolarHBondContact OD1-N 3.29Å
747	H	91.4	Very high	92.2	Very high	20 Å²	20	35.6 Å²	35.6	9%	0.093	17%	0.17	C	C	.	.	G	3₁₀ helix	trans	-87.6	-10	172.2	-57.9	177.5	0	0	0	112.8	N744 R745 L755 L756 H759	N744-H747 PolarHBondContact N-CE1 2.95Å; N744-H747 PolarHBondContact N-ND1 3.06Å; N744-H747 WeakPolarHBondContact O-CB 3.29Å; N744-H747 PolarHBondContact O-N 3.18Å; R745-H747 PolarHBondContact O-N 3.26Å; R745-H747 VanDerWaalsContact O-N 3.17Å; H747-L755 HydrophobicContact CB-CD2 4.4Å; H747-L755 WeakPolarHBondContact O-CA 3.46Å; H747-L756 PolarHBondContact O-N 2.87Å; H747-H759 HydrophobicContact CB-CB 4.44Å; H747-H759 AromaticContact CD2-CE1 3.24Å; H747-H759 PolarHBondContact CD2-CE1 2.97Å; H747-H759 AromaticContact CD2-ND1 3.86Å; H747-H759 AromaticContact CD2-NE2 3.47Å; H747-H759 PolarHBondContact CD2-NE2 3.48Å; H747-H759 AromaticContact CG-CE1 3.55Å; H747-H759 AromaticContact CG-ND1 3.71Å; H747-H759 AromaticContact CG-NE2 3.77Å; H747-H759 AromaticContact ND1-ND1 3.93Å; H747-H759 AromaticContact NE2-CE1 3.64Å
748	Y	93	Very high	92.2	Very high	7 Å²	7	32.6 Å²	32.6	3%	0.027	16%	0.158	C	C	.	.	B	Isolated β-bridge	trans	-116.6	157.2	-170	-69.2	-73.3	0	0	0	112.7	H430 N744 R745 Q753 Q754 L755 R763 E775 W779	H430-Y748 WeakPolarHBondContact CB-O 3.33Å; H430-Y748 PolarHBondContact ND1-O 3.08Å; N744-Y748 WeakPolarHBondContact O-CD2 3.44Å; R745-Y748 PolarHBondContact O-N 3.38Å; Y748-Q753 WeakPolarHBondContact CD1-O 3.47Å; Y748-Q753 VanDerWaalsContact CE1-O 3.24Å; Y748-Q753 WeakPolarHBondContact CE1-O 3.5Å; Y748-Q754 WeakPolarHBondContact CA-O 3.47Å; Y748-L755 HydrophobicContact CD1-CD2 3.98Å; Y748-L755 HydrophobicContact CD1-CG 4.36Å; Y748-L755 HydrophobicContact CE1-CD2 3.33Å; Y748-L755 HydrophobicContact CE1-CG 3.74Å; Y748-L755 HydrophobicContact CE2-CD2 4.38Å; Y748-R763 PolarHBondContact OH-NH2 2.91Å; Y748-R763 VanDerWaalsContact OH-NH2 3.16Å; Y748-E775 PolarHBondContact OH-OE1 3.38Å; Y748-E775 PolarHBondContact OH-OE2 3.15Å; Y748-W779 HydrophobicContact CD2-CZ3 4.05Å; Y748-W779 HydrophobicContact CE1-CH2 4.29Å; Y748-W779 HydrophobicContact CE2-CH2 4.06Å; Y748-W779 AromaticContact CE2-CZ3 3.93Å; Y748-W779 HydrophobicContact CE2-CZ3 3.93Å; Y748-W779 HydrophobicContact CG-CZ3 4.49Å; Y748-W779 AromaticContact CZ-CH2 3.97Å
749	C	92.6	Very high	92.2	Very high	3 Å²	3	33.2 Å²	33.2	2%	0.02	16%	0.161	C	C	.	.			trans	-64.6	142.4	159.7	-61.3	0	0	0	0	109.9	H430 R432 Q751 S752 Q754	H430-C749 CarbonylContact O-C 3.5Å; H430-C749 WeakPolarHBondContact O-CA 3.36Å; R432-C749 HydrophobicContact CB-CB 4.34Å; C749-Q751 PolarHBondContact O-N 3.17Å; C749-S752 PolarHBondContact O-N 2.91Å; C749-S752 VanDerWaalsContact O-O 3.09Å; C749-Q754 PolarHBondContact N-O 3.27Å
750	I	88.3	Confident	92.1	Very high	19 Å²	19	35.6 Å²	35.6	10%	0.097	18%	0.177	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.4	138.6	177.8	-70.9	179.5	0	0	0	110.1	W88 F395 L429 H430 S752	W88-I750 HydrophobicContact CH2-CD1 3.76Å; W88-I750 HydrophobicContact CH2-CG1 4.44Å; W88-I750 HydrophobicContact CZ2-CD1 3.73Å; F395-I750 HydrophobicContact CB-CD1 4.44Å; F395-I750 HydrophobicContact CD2-CD1 3.25Å; F395-I750 HydrophobicContact CD2-CG2 4.49Å; F395-I750 HydrophobicContact CE2-CB 4.38Å; F395-I750 HydrophobicContact CE2-CD1 3.55Å; F395-I750 HydrophobicContact CE2-CG2 3.77Å; F395-I750 HydrophobicContact CG-CD1 3.89Å; F395-I750 HydrophobicContact CZ-CD1 4.4Å; F395-I750 HydrophobicContact CZ-CG2 3.81Å; L429-I750 WeakPolarHBondContact O-CD1 3.47Å; H430-I750 HydrophobicContact CB-CG1 4.31Å; H430-I750 PolarHBondContact O-N 3.35Å; I750-S752 PolarHBondContact O-N 3Å; I750-S752 VanDerWaalsContact O-N 3.12Å
751	Q	84.4	Confident	92.1	Very high	144 Å²	144	35.6 Å²	35.6	67%	0.673	18%	0.177	S	C	*	.	T	Hydrogen-bonded Turn	trans	58.7	18.4	-179.4	-66.9	162.7	-70.6	0	0	114.5	C749	C749-Q751 PolarHBondContact O-N 3.17Å
752	S	88.5	Confident	92.1	Very high	54 Å²	54	35.3 Å²	35.3	38%	0.378	18%	0.176	S	C	.	.	S	Bend	trans	-137.6	157.7	-179.8	178.4	0	0	0	0	111.8	C749 I750 Q754	C749-S752 PolarHBondContact O-N 2.91Å; C749-S752 VanDerWaalsContact O-O 3.09Å; I750-S752 PolarHBondContact O-N 3Å; I750-S752 VanDerWaalsContact O-N 3.12Å; S752-Q754 VanDerWaalsContact C-N 3.32Å; S752-Q754 WeakPolarHBondContact OG-CB 3.3Å; S752-Q754 PolarHBondContact OG-N 2.67Å
753	Q	89	Confident	92.2	Very high	144 Å²	144	36.4 Å²	36.4	67%	0.673	18%	0.178	S	C	*	.			trans	-89.9	4.3	169.1	-64.5	-176.6	-13.6	0	0	112.3	Y748 L755 W779	Y748-Q753 WeakPolarHBondContact CD1-O 3.47Å; Y748-Q753 VanDerWaalsContact CE1-O 3.24Å; Y748-Q753 WeakPolarHBondContact CE1-O 3.5Å; Q753-L755 PolarHBondContact O-N 3.26Å; Q753-W779 HydrophobicContact CB-CH2 4.43Å; Q753-W779 HydrophobicContact CG-CH2 3.85Å; Q753-W779 HydrophobicContact CG-CZ2 3.99Å
754	Q	93.1	Very high	92.5	Very high	59 Å²	59	39.2 Å²	39.2	28%	0.276	19%	0.189	S	C	.	.	P	Polyproline II helix	trans	-70.2	116.6	175.4	-179.7	161.8	13.9	0	0	111.2	R432 L466 G467 Y748 C749 S752	R432-Q754 VanDerWaalsContact NH1-CD 3.3Å; L466-Q754 PolarHBondContact O-NE2 3.09Å; G467-Q754 PolarHBondContact O-NE2 3.44Å; Y748-Q754 WeakPolarHBondContact CA-O 3.47Å; C749-Q754 PolarHBondContact N-O 3.27Å; S752-Q754 VanDerWaalsContact C-N 3.32Å; S752-Q754 WeakPolarHBondContact OG-CB 3.3Å; S752-Q754 PolarHBondContact OG-N 2.67Å
755	L	94.6	Very high	92.9	Very high	26 Å²	26	38.1 Å²	38.1	14%	0.136	18%	0.183	C	C	.	.	B	Isolated β-bridge	trans	-61.6	144.6	171.2	-70	167.4	0	0	0	111.6	H747 Y748 Q753 H759 R763	H747-L755 HydrophobicContact CB-CD2 4.4Å; H747-L755 WeakPolarHBondContact O-CA 3.46Å; Y748-L755 HydrophobicContact CD1-CD2 3.98Å; Y748-L755 HydrophobicContact CD1-CG 4.36Å; Y748-L755 HydrophobicContact CE1-CD2 3.33Å; Y748-L755 HydrophobicContact CE1-CG 3.74Å; Y748-L755 HydrophobicContact CE2-CD2 4.38Å; Q753-L755 PolarHBondContact O-N 3.26Å; L755-H759 HydrophobicContact CB-CB 4.38Å; L755-H759 HydrophobicContact CD2-CB 3.88Å; L755-R763 HydrophobicContact CD1-CG 4.3Å
756	L	95.4	Very high	93.3	Very high	6 Å²	6	32.9 Å²	32.9	3%	0.031	16%	0.163	C	C	.	.	P	Polyproline II helix	trans	-69.8	153.5	166.4	-56.6	173.9	0	0	0	111	H430 T465 H747 L758 H759 S760	H430-L756 HydrophobicContact CB-CD2 4.23Å; T465-L756 HydrophobicContact CG2-CB 4.4Å; T465-L756 HydrophobicContact CG2-CD2 4.38Å; T465-L756 CarbonylContact O-C 3.6Å; T465-L756 WeakPolarHBondContact O-CA 3.36Å; T465-L756 WeakPolarHBondContact O-CD2 3.3Å; H747-L756 PolarHBondContact O-N 2.87Å; L756-L758 VanDerWaalsContact C-N 3.33Å; L756-L758 PolarHBondContact O-N 3.03Å; L756-L758 VanDerWaalsContact O-N 3.09Å; L756-H759 PolarHBondContact O-N 2.99Å; L756-S760 PolarHBondContact O-N 3.39Å
757	G	94.8	Very high	93.8	Very high	2 Å²	2	39 Å²	39	2%	0.021	19%	0.189	C	C	.	.	H	α-helix	trans	-45.7	-45.5	-170.5	0	0	0	0	0	115.7	A464 T465 H759 S760 M761	A464-G757 WeakPolarHBondContact O-CA 3.39Å; T465-G757 PolarHBondContact O-N 3.49Å; G757-H759 PolarHBondContact O-N 3.17Å; G757-S760 PolarHBondContact O-N 3.47Å; G757-M761 VanDerWaalsContact O-CB 3.3Å; G757-M761 WeakPolarHBondContact O-CB 3.43Å; G757-M761 PolarHBondContact O-N 2.98Å
758	L	93.9	Very high	94	Very high	9 Å²	9	42.2 Å²	42.2	5%	0.047	21%	0.206	C	C	.	.	H	α-helix	trans	-63.8	-39.6	178.2	-177.1	68.6	0	0	0	113.4	V96 F507 T542 L756 M761 K762	V96-L758 HydrophobicContact CB-CD2 3.51Å; V96-L758 HydrophobicContact CG1-CD2 3.63Å; V96-L758 HydrophobicContact CG2-CD2 3.52Å; F507-L758 HydrophobicContact CE1-CB 3.88Å; F507-L758 HydrophobicContact CE1-CD1 3.75Å; F507-L758 HydrophobicContact CE1-CG 4.44Å; F507-L758 HydrophobicContact CE2-CB 4.43Å; F507-L758 HydrophobicContact CZ-CB 3.79Å; F507-L758 HydrophobicContact CZ-CD1 4.22Å; T542-L758 HydrophobicContact CG2-CD1 4.15Å; L756-L758 VanDerWaalsContact C-N 3.33Å; L756-L758 PolarHBondContact O-N 3.03Å; L756-L758 VanDerWaalsContact O-N 3.09Å; L758-M761 HydrophobicContact CD1-CE 3.68Å; L758-M761 PolarHBondContact O-N 3.43Å; L758-K762 PolarHBondContact O-N 3.35Å
759	H	95.1	Very high	94	Very high	14 Å²	14	43.6 Å²	43.6	7%	0.065	22%	0.219	C	C	.	.	H	α-helix	trans	-77.9	-33.2	-178.7	-57.1	-76.3	0	0	0	111.1	H747 L755 L756 G757 K762 R763	H747-H759 HydrophobicContact CB-CB 4.44Å; H747-H759 AromaticContact CD2-CE1 3.24Å; H747-H759 PolarHBondContact CD2-CE1 2.97Å; H747-H759 AromaticContact CD2-ND1 3.86Å; H747-H759 AromaticContact CD2-NE2 3.47Å; H747-H759 PolarHBondContact CD2-NE2 3.48Å; H747-H759 AromaticContact CG-CE1 3.55Å; H747-H759 AromaticContact CG-ND1 3.71Å; H747-H759 AromaticContact CG-NE2 3.77Å; H747-H759 AromaticContact ND1-ND1 3.93Å; H747-H759 AromaticContact NE2-CE1 3.64Å; L755-H759 HydrophobicContact CB-CB 4.38Å; L755-H759 HydrophobicContact CD2-CB 3.88Å; L756-H759 PolarHBondContact O-N 2.99Å; G757-H759 PolarHBondContact O-N 3.17Å; H759-K762 PolarHBondContact O-N 3.16Å; H759-R763 PolarHBondContact O-N 2.9Å; H759-R763 VanDerWaalsContact O-N 3.09Å
760	S	96.2	Very high	94.1	Very high	50 Å²	50	46 Å²	46	35%	0.35	24%	0.244	S	C	.	.	H	α-helix	trans	-58.7	-50.8	166.5	-173.4	0	0	0	0	110.9	L756 G757 K762 R763 R764	L756-S760 PolarHBondContact O-N 3.39Å; G757-S760 PolarHBondContact O-N 3.47Å; S760-K762 VanDerWaalsContact C-N 3.34Å; S760-K762 PolarHBondContact O-N 3.45Å; S760-R763 PolarHBondContact O-N 3.01Å; S760-R764 WeakPolarHBondContact O-CB 3.44Å; S760-R764 PolarHBondContact O-N 3.13Å
761	M	97.1	Very high	94.5	Very high	0 Å²	0	46.3 Å²	46.3	0%	0	24%	0.244	C	C	.	.	H	α-helix	trans	-57.2	-42.6	174.6	-170.1	-171.4	83.7	0	0	111.8	A506 F507 T542 A546 T611 G757 L758 R763 R764 H765	A506-M761 HydrophobicContact CB-SD 4.36Å; F507-M761 HydrophobicContact CD1-CB 4.42Å; F507-M761 HydrophobicContact CD1-SD 3.8Å; F507-M761 HydrophobicContact CE1-SD 4.24Å; T542-M761 HydrophobicContact CG2-CE 3.82Å; A546-M761 HydrophobicContact CB-SD 4.31Å; T611-M761 HydrophobicContact CG2-CE 4.25Å; G757-M761 VanDerWaalsContact O-CB 3.3Å; G757-M761 WeakPolarHBondContact O-CB 3.43Å; G757-M761 PolarHBondContact O-N 2.98Å; L758-M761 HydrophobicContact CD1-CE 3.68Å; L758-M761 PolarHBondContact O-N 3.43Å; M761-R763 PolarHBondContact O-N 2.93Å; M761-R764 WeakPolarHBondContact O-CB 3.39Å; M761-R764 PolarHBondContact O-N 3.32Å; M761-H765 VanDerWaalsContact CG-CE1 3.47Å; M761-H765 WeakPolarHBondContact CG-CE1 3.37Å; M761-H765 WeakPolarHBondContact CG-NE2 3.37Å; M761-H765 WeakPolarHBondContact O-CB 3.32Å; M761-H765 PolarHBondContact O-CD2 3.38Å; M761-H765 VanDerWaalsContact O-CG 3.26Å; M761-H765 PolarHBondContact O-N 3.09Å
762	K	96.7	Very high	95	Very high	5 Å²	5	44.6 Å²	44.6	2%	0.022	23%	0.231	C	C	.	.	H	α-helix	trans	-57.3	-48.3	174.6	-173.3	178.3	-169	-173.4	0	112.3	M608 T611 S613 I614 D615 L758 H759 S760 R764 H765 L766	M608-K762 HydrophobicContact CB-CG 4.48Å; T611-K762 HydrophobicContact CG2-CB 3.82Å; T611-K762 HydrophobicContact CG2-CG 3.94Å; T611-K762 WeakPolarHBondContact OG1-CD 3.41Å; T611-K762 VanDerWaalsContact OG1-CE 3.23Å; T611-K762 WeakPolarHBondContact OG1-CE 3.47Å; T611-K762 WeakPolarHBondContact OG1-CG 3.36Å; S613-K762 PolarHBondContact O-NZ 2.9Å; S613-K762 WeakPolarHBondContact OG-CD 3.05Å; S613-K762 PolarHBondContact OG-NZ 3.46Å; I614-K762 PolarHBondContact O-NZ 2.94Å; I614-K762 VanDerWaalsContact O-NZ 3.13Å; D615-K762 WeakPolarHBondContact OD1-CE 3.12Å; D615-K762 IonicContact OD1-NZ 3.77Å; D615-K762 PolarHBondContact OD1-NZ 3.49Å; D615-K762 WeakPolarHBondContact OD2-CE 3.37Å; D615-K762 IonicContact OD2-NZ 3.17Å; D615-K762 PolarHBondContact OD2-NZ 2.76Å; L758-K762 PolarHBondContact O-N 3.35Å; H759-K762 PolarHBondContact O-N 3.16Å; S760-K762 VanDerWaalsContact C-N 3.34Å; S760-K762 PolarHBondContact O-N 3.45Å; K762-R764 VanDerWaalsContact C-N 3.28Å; K762-R764 PolarHBondContact O-N 2.7Å; K762-H765 PolarHBondContact O-N 3.23Å; K762-L766 HydrophobicContact CG-CD1 4.13Å; K762-L766 WeakPolarHBondContact O-CG 3.38Å; K762-L766 PolarHBondContact O-N 3.2Å
763	R	96.8	Very high	95.3	Very high	46 Å²	46	43.6 Å²	43.6	17%	0.174	22%	0.223	C	C	.	.	H	α-helix	trans	-65.8	-32.7	178.5	-65.9	-162.6	-176.8	165.7	11.7	112.2	S743 Y748 L755 H759 S760 M761 K767 V773 E775	S743-R763 PolarHBondContact OG-NH2 2.98Å; S743-R763 VanDerWaalsContact OG-NH2 3.13Å; Y748-R763 PolarHBondContact OH-NH2 2.91Å; Y748-R763 VanDerWaalsContact OH-NH2 3.16Å; L755-R763 HydrophobicContact CD1-CG 4.3Å; H759-R763 PolarHBondContact O-N 2.9Å; H759-R763 VanDerWaalsContact O-N 3.09Å; S760-R763 PolarHBondContact O-N 3.01Å; M761-R763 PolarHBondContact O-N 2.93Å; R763-K767 WeakPolarHBondContact O-CG 3.19Å; R763-K767 PolarHBondContact O-N 3.43Å; R763-V773 HydrophobicContact CG-CG1 4.09Å; R763-E775 IonicContact CZ-OE2 3.26Å; R763-E775 IonicContact NH1-OE2 3Å; R763-E775 PolarHBondContact NH1-OE2 3.41Å; R763-E775 IonicContact NH2-OE1 3.48Å; R763-E775 IonicContact NH2-OE2 2.76Å; R763-E775 PolarHBondContact NH2-OE2 3.38Å
764	R	96.8	Very high	95.7	Very high	62 Å²	62	37 Å²	37	23%	0.234	19%	0.192	C	C	.	.	H	α-helix	trans	-67.8	-46	175.3	-154.4	156.3	59.7	69.5	7	111.3	A506 S509 E550 S760 M761 K762 K767 I768	A506-R764 PolarHBondContact O-NH2 3.33Å; A506-R764 VanDerWaalsContact O-NH2 3.17Å; S509-R764 PolarHBondContact OG-NH1 3.29Å; S509-R764 PolarHBondContact OG-NH2 3.26Å; E550-R764 IonicContact OE1-CZ 3.7Å; E550-R764 IonicContact OE1-NH1 2.66Å; E550-R764 PolarHBondContact OE1-NH1 3.35Å; E550-R764 IonicContact OE1-NH2 3.47Å; E550-R764 PolarHBondContact OE1-NH2 3.39Å; E550-R764 IonicContact OE2-CZ 2.65Å; E550-R764 VanDerWaalsContact OE2-CZ 3.26Å; E550-R764 IonicContact OE2-NH1 2.68Å; E550-R764 PolarHBondContact OE2-NH1 3.5Å; E550-R764 IonicContact OE2-NH2 2.61Å; E550-R764 PolarHBondContact OE2-NH2 2.64Å; S760-R764 WeakPolarHBondContact O-CB 3.44Å; S760-R764 PolarHBondContact O-N 3.13Å; M761-R764 WeakPolarHBondContact O-CB 3.39Å; M761-R764 PolarHBondContact O-N 3.32Å; K762-R764 VanDerWaalsContact C-N 3.28Å; K762-R764 PolarHBondContact O-N 2.7Å; R764-K767 PolarHBondContact O-N 2.91Å; R764-I768 WeakPolarHBondContact O-CG1 3.34Å; R764-I768 PolarHBondContact O-N 2.89Å; R764-I768 VanDerWaalsContact O-N 3.07Å
765	H	97.7	Very high	95.8	Very high	0 Å²	0	36.1 Å²	36.1	0%	0	19%	0.188	C	C	.	.	H	α-helix	trans	-63.3	-41.6	174.9	-71.2	-177.4	0	0	0	113.6	L549 E550 M608 H610 M761 K762 K767 I768 A769	L549-H765 HydrophobicContact CD1-CB 3.86Å; E550-H765 IonicContact OE1-CD2 3.33Å; E550-H765 IonicContact OE1-NE2 3.23Å; E550-H765 PolarHBondContact OE1-NE2 2.92Å; M608-H765 HydrophobicContact CE-CB 4.31Å; M608-H765 WeakPolarHBondContact CE-O 3.19Å; M608-H765 HydrophobicContact CG-CB 4.41Å; M608-H765 HydrophobicContact SD-CB 4.03Å; H610-H765 AromaticContact CE1-ND1 3.61Å; H610-H765 AromaticContact NE2-CE1 3.37Å; H610-H765 PolarHBondContact NE2-CE1 3.42Å; H610-H765 AromaticContact NE2-ND1 2.99Å; H610-H765 PolarHBondContact NE2-ND1 3.16Å; M761-H765 VanDerWaalsContact CG-CE1 3.47Å; M761-H765 WeakPolarHBondContact CG-CE1 3.37Å; M761-H765 WeakPolarHBondContact CG-NE2 3.37Å; M761-H765 WeakPolarHBondContact O-CB 3.32Å; M761-H765 PolarHBondContact O-CD2 3.38Å; M761-H765 VanDerWaalsContact O-CG 3.26Å; M761-H765 PolarHBondContact O-N 3.09Å; K762-H765 PolarHBondContact O-N 3.23Å; H765-K767 VanDerWaalsContact C-N 3.34Å; H765-K767 PolarHBondContact O-N 2.93Å; H765-I768 PolarHBondContact O-N 3.24Å; H765-A769 PolarHBondContact O-N 3.21Å
766	L	97.2	Very high	95.8	Very high	0 Å²	0	34.9 Å²	34.9	0%	0	18%	0.182	C	C	.	.	H	α-helix	trans	-60	-44.5	175.7	-77	170.2	0	0	0	111.4	I607 M608 A739 K762 I768 A769 G770 Y771 V773	I607-L766 HydrophobicContact CB-CD2 3.89Å; I607-L766 HydrophobicContact CD1-CD2 4.36Å; I607-L766 HydrophobicContact CG2-CD2 3.52Å; M608-L766 HydrophobicContact CE-CD2 4.16Å; M608-L766 HydrophobicContact CG-CD2 3.8Å; M608-L766 HydrophobicContact CG-CG 4.04Å; A739-L766 HydrophobicContact CB-CD1 3.96Å; A739-L766 HydrophobicContact CB-CD2 4Å; K762-L766 HydrophobicContact CG-CD1 4.13Å; K762-L766 WeakPolarHBondContact O-CG 3.38Å; K762-L766 PolarHBondContact O-N 3.2Å; L766-I768 PolarHBondContact O-N 3.11Å; L766-A769 CarbonylContact O-C 3.58Å; L766-A769 PolarHBondContact O-N 3.25Å; L766-G770 PolarHBondContact O-N 2.95Å; L766-Y771 HydrophobicContact CD2-CD2 4.21Å; L766-Y771 HydrophobicContact CD2-CG 4.21Å; L766-Y771 WeakPolarHBondContact O-CB 3.41Å; L766-Y771 PolarHBondContact O-N 3.32Å; L766-V773 HydrophobicContact CB-CG2 3.7Å; L766-V773 HydrophobicContact CD1-CG2 3.94Å; L766-V773 HydrophobicContact CG-CG2 4.48Å
767	K	96.4	Very high	95.7	Very high	150 Å²	150	34.7 Å²	34.7	65%	0.652	18%	0.181	S	C	*	.	H	α-helix	trans	-60.8	-42.8	174.2	-71.4	177.2	178	-169.8	0	112.5	R763 R764 H765 A769 G770	R763-K767 WeakPolarHBondContact O-CG 3.19Å; R763-K767 PolarHBondContact O-N 3.43Å; R764-K767 PolarHBondContact O-N 2.91Å; H765-K767 VanDerWaalsContact C-N 3.34Å; H765-K767 PolarHBondContact O-N 2.93Å; K767-A769 VanDerWaalsContact C-N 3.29Å; K767-A769 PolarHBondContact O-N 3.34Å; K767-G770 PolarHBondContact O-N 3.38Å
768	I	96	Very high	95.5	Very high	86 Å²	86	36.6 Å²	36.6	44%	0.441	19%	0.189	S	C	.	.	H	α-helix	trans	-59.6	-39.9	175.4	-69.4	164.3	0	0	0	111.2	L549 E550 R764 H765 L766 G770	L549-I768 HydrophobicContact CB-CG2 4.38Å; L549-I768 HydrophobicContact CD2-CG2 4.35Å; E550-I768 HydrophobicContact CG-CD1 4.23Å; R764-I768 WeakPolarHBondContact O-CG1 3.34Å; R764-I768 PolarHBondContact O-N 2.89Å; R764-I768 VanDerWaalsContact O-N 3.07Å; H765-I768 PolarHBondContact O-N 3.24Å; L766-I768 PolarHBondContact O-N 3.11Å; I768-G770 PolarHBondContact O-N 3.28Å
769	A	94.3	Very high	95.4	Very high	37 Å²	37	40.6 Å²	40.6	31%	0.306	20%	0.204	S	C	.	.	T	Hydrogen-bonded Turn	trans	-79.6	12.4	175.8	0	0	0	0	0	114.7	M608 H765 L766 K767 Y771	M608-A769 HydrophobicContact CE-CB 3.43Å; M608-A769 VanDerWaalsContact CE-CB 3.43Å; H765-A769 PolarHBondContact O-N 3.21Å; L766-A769 CarbonylContact O-C 3.58Å; L766-A769 PolarHBondContact O-N 3.25Å; K767-A769 VanDerWaalsContact C-N 3.29Å; K767-A769 PolarHBondContact O-N 3.34Å; A769-Y771 HydrophobicContact CB-CD2 3.96Å; A769-Y771 HydrophobicContact CB-CE2 4.18Å; A769-Y771 WeakPolarHBondContact O-CD2 3.49Å
770	G	94.2	Very high	95.3	Very high	53 Å²	53	42.9 Å²	42.9	55%	0.546	22%	0.215	S	C	.	.	T	Hydrogen-bonded Turn	trans	77	17.6	176.8	0	0	0	0	0	115.4	L766 K767 I768	L766-G770 PolarHBondContact O-N 2.95Å; K767-G770 PolarHBondContact O-N 3.38Å; I768-G770 PolarHBondContact O-N 3.28Å
771	Y	95.4	Very high	95.2	Very high	25 Å²	25	40.5 Å²	40.5	10%	0.098	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.6	129.3	174.9	-69.4	-93.3	0	0	0	112	I607 E617 K737 A739 L766 A769	I607-Y771 HydrophobicContact CD1-CD1 4.21Å; I607-Y771 HydrophobicContact CD1-CE1 4.03Å; I607-Y771 HydrophobicContact CG2-CD2 4.08Å; I607-Y771 HydrophobicContact CG2-CE1 4.19Å; I607-Y771 HydrophobicContact CG2-CE2 3.62Å; E617-Y771 HydrophobicContact CG-CE1 3.9Å; E617-Y771 PolarHBondContact OE1-OH 3Å; E617-Y771 VanDerWaalsContact OE1-OH 3.1Å; K737-Y771 HydrophobicContact CB-CD1 3.6Å; K737-Y771 HydrophobicContact CB-CE1 3.68Å; K737-Y771 HydrophobicContact CB-CG 4.26Å; K737-Y771 HydrophobicContact CD-CE1 4.07Å; K737-Y771 HydrophobicContact CD-CE2 4.48Å; K737-Y771 HydrophobicContact CG-CE1 4.43Å; K737-Y771 WeakPolarHBondContact O-CA 3.11Å; A739-Y771 HydrophobicContact CB-CD1 4.06Å; A739-Y771 HydrophobicContact CB-CG 4.34Å; L766-Y771 HydrophobicContact CD2-CD2 4.21Å; L766-Y771 HydrophobicContact CD2-CG 4.21Å; L766-Y771 WeakPolarHBondContact O-CB 3.41Å; L766-Y771 PolarHBondContact O-N 3.32Å; A769-Y771 HydrophobicContact CB-CD2 3.96Å; A769-Y771 HydrophobicContact CB-CE2 4.18Å; A769-Y771 WeakPolarHBondContact O-CD2 3.49Å
772	R	94.9	Very high	95	Very high	108 Å²	108	44.1 Å²	44.1	41%	0.408	21%	0.214	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.9	131.8	159.7	-162.3	175.6	-149.8	120.1	-0.4	108.3	V736 K737 I738 A739 S803 L804	V736-R772 HydrophobicContact CG1-CB 4.44Å; K737-R772 PolarHBondContact O-N 2.89Å; I738-R772 CarbonylContact C-O 3.51Å; I738-R772 WeakPolarHBondContact CA-O 3.43Å; I738-R772 HydrophobicContact CG1-CB 4.41Å; A739-R772 PolarHBondContact N-O 3.24Å; R772-S803 PolarHBondContact NE-O 3.14Å; R772-S803 PolarHBondContact NH2-O 2.94Å; R772-L804 PolarHBondContact NH1-O 2.81Å; R772-L804 PolarHBondContact NH2-O 3.06Å
773	V	95.8	Very high	94.8	Very high	33 Å²	33	47.3 Å²	47.3	20%	0.2	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	121	179.9	-176.7	0	0	0	0	109.3	Q741 R763 L766	Q741-V773 HydrophobicContact CG-CG1 3.92Å; R763-V773 HydrophobicContact CG-CG1 4.09Å; L766-V773 HydrophobicContact CB-CG2 3.7Å; L766-V773 HydrophobicContact CD1-CG2 3.94Å; L766-V773 HydrophobicContact CG-CG2 4.48Å
774	V	96.6	Very high	94.5	Very high	6 Å²	6	46.5 Å²	46.5	4%	0.036	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	134	171.8	168.6	0	0	0	0	108.4	I738 A739 V740 Q741 K799 I800	I738-V774 HydrophobicContact CG2-CB 4.04Å; I738-V774 HydrophobicContact CG2-CG2 3.67Å; A739-V774 PolarHBondContact O-N 2.91Å; V740-V774 CarbonylContact C-O 3.55Å; V740-V774 WeakPolarHBondContact CA-O 3.4Å; V740-V774 HydrophobicContact CG1-CG1 4.45Å; V740-V774 HydrophobicContact CG2-CB 4.4Å; Q741-V774 PolarHBondContact N-O 3.4Å; V774-K799 HydrophobicContact CG1-CB 4.07Å; V774-K799 WeakPolarHBondContact CG1-O 3.47Å; V774-K799 WeakPolarHBondContact CG2-O 3.41Å; V774-I800 HydrophobicContact CG1-CD1 4.22Å; V774-I800 HydrophobicContact CG2-CD1 4.45Å
775	E	95.1	Very high	94.3	Very high	40 Å²	40	45.8 Å²	45.8	19%	0.187	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	130	179.8	-171.4	-175.4	163.4	0	0	112.5	S743 Y748 R763 S777	S743-E775 VanDerWaalsContact CB-OE1 3.29Å; S743-E775 WeakPolarHBondContact CB-OE1 3.31Å; Y748-E775 PolarHBondContact OH-OE1 3.38Å; Y748-E775 PolarHBondContact OH-OE2 3.15Å; R763-E775 IonicContact CZ-OE2 3.26Å; R763-E775 IonicContact NH1-OE2 3Å; R763-E775 PolarHBondContact NH1-OE2 3.41Å; R763-E775 IonicContact NH2-OE1 3.48Å; R763-E775 IonicContact NH2-OE2 2.76Å; R763-E775 PolarHBondContact NH2-OE2 3.38Å; E775-S777 VanDerWaalsContact OE1-CA 3.26Å; E775-S777 WeakPolarHBondContact OE1-CA 3.41Å; E775-S777 WeakPolarHBondContact OE1-CB 3.41Å
776	L	95.6	Very high	94	Very high	1 Å²	1	56 Å²	56	1%	0.005	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.8	93.8	158.4	-46.6	-174.1	0	0	0	107.3	A588 V740 Q741 I742 S743 W781 Y795 L796 K799	A588-L776 HydrophobicContact CB-CD1 3.74Å; V740-L776 HydrophobicContact CG1-CD1 3.79Å; V740-L776 HydrophobicContact CG1-CD2 4.08Å; V740-L776 HydrophobicContact CG1-CG 3.63Å; Q741-L776 PolarHBondContact O-N 3.38Å; I742-L776 HydrophobicContact CG1-CD1 4.36Å; S743-L776 PolarHBondContact N-O 3.24Å; L776-W781 HydrophobicContact CB-CB 4.03Å; L776-W781 HydrophobicContact CB-CD2 4.4Å; L776-W781 HydrophobicContact CB-CG 3.97Å; L776-W781 HydrophobicContact CD1-CD2 4.27Å; L776-Y795 HydrophobicContact CD2-CE1 4.05Å; L776-L796 HydrophobicContact CD1-CD2 3.77Å; L776-L796 HydrophobicContact CD2-CD2 3.61Å; L776-L796 HydrophobicContact CG-CD2 4.38Å; L776-K799 HydrophobicContact CD2-CB 4.4Å; L776-K799 HydrophobicContact CD2-CG 4.49Å
777	S	92.8	Very high	93.9	Very high	1 Å²	1	61 Å²	61	1%	0.007	30%	0.296	C	S	.	.			trans	-73.1	152.6	-173.5	72.8	0	0	0	0	111.4	E775 W779 E780 W781	E775-S777 VanDerWaalsContact OE1-CA 3.26Å; E775-S777 WeakPolarHBondContact OE1-CA 3.41Å; E775-S777 WeakPolarHBondContact OE1-CB 3.41Å; S777-W779 VanDerWaalsContact C-N 3.32Å; S777-W779 PolarHBondContact O-N 3.21Å; S777-W779 VanDerWaalsContact OG-CE2 3.3Å; S777-W779 PolarHBondContact OG-NE1 3.02Å; S777-W779 VanDerWaalsContact OG-NE1 3.16Å; S777-E780 WeakPolarHBondContact CB-OE2 3.39Å; S777-E780 PolarHBondContact O-N 3.26Å; S777-E780 WeakPolarHBondContact OG-CB 3.43Å; S777-E780 VanDerWaalsContact OG-CD 3.31Å; S777-E780 VanDerWaalsContact OG-CG 3.27Å; S777-E780 WeakPolarHBondContact OG-CG 3.36Å; S777-E780 PolarHBondContact OG-N 3.45Å; S777-E780 PolarHBondContact OG-OE2 3.31Å; S777-W781 WeakPolarHBondContact O-CB 3.33Å; S777-W781 PolarHBondContact O-N 3.02Å
778	H	90.7	Very high	93.8	Very high	42 Å²	42	56.8 Å²	56.8	19%	0.194	29%	0.285	C	S	.	.	H	α-helix	trans	-63.4	-36.3	-178	70.9	-83.8	0	0	0	113.1	S743 R745 F782	S743-H778 VanDerWaalsContact O-CB 3.3Å; S743-H778 WeakPolarHBondContact O-CB 3.36Å; S743-H778 PolarHBondContact O-N 2.89Å; S743-H778 VanDerWaalsContact O-N 3.1Å; R745-H778 VanDerWaalsContact CA-CE1 3.44Å; R745-H778 WeakPolarHBondContact CA-CE1 3.19Å; H778-F782 HydrophobicContact CB-CD1 4Å; H778-F782 HydrophobicContact CB-CE1 4.02Å; H778-F782 VanDerWaalsContact O-CB 3.22Å; H778-F782 WeakPolarHBondContact O-CB 3.3Å; H778-F782 WeakPolarHBondContact O-CD1 3.37Å; H778-F782 PolarHBondContact O-N 2.78Å
779	W	91.4	Very high	93.8	Very high	93 Å²	93	56.1 Å²	56.1	35%	0.352	28%	0.277	S	S	.	.	H	α-helix	trans	-70	-37.9	-178.7	52.6	85.4	0	0	0	112.5	Y748 Q753 S777 S783	Y748-W779 HydrophobicContact CD2-CZ3 4.05Å; Y748-W779 HydrophobicContact CE1-CH2 4.29Å; Y748-W779 HydrophobicContact CE2-CH2 4.06Å; Y748-W779 AromaticContact CE2-CZ3 3.93Å; Y748-W779 HydrophobicContact CE2-CZ3 3.93Å; Y748-W779 HydrophobicContact CG-CZ3 4.49Å; Y748-W779 AromaticContact CZ-CH2 3.97Å; Q753-W779 HydrophobicContact CB-CH2 4.43Å; Q753-W779 HydrophobicContact CG-CH2 3.85Å; Q753-W779 HydrophobicContact CG-CZ2 3.99Å; S777-W779 VanDerWaalsContact C-N 3.32Å; S777-W779 PolarHBondContact O-N 3.21Å; S777-W779 VanDerWaalsContact OG-CE2 3.3Å; S777-W779 PolarHBondContact OG-NE1 3.02Å; S777-W779 VanDerWaalsContact OG-NE1 3.16Å; W779-S783 PolarHBondContact O-OG 3.42Å
780	E	93.3	Very high	93.8	Very high	63 Å²	63	57.8 Å²	57.8	29%	0.294	29%	0.291	S	S	.	.	H	α-helix	trans	-75.8	-59.1	172.8	-62.7	167.5	120.8	0	0	111.2	S777 F782 S783 M784 Y795 K799	S777-E780 WeakPolarHBondContact CB-OE2 3.39Å; S777-E780 PolarHBondContact O-N 3.26Å; S777-E780 WeakPolarHBondContact OG-CB 3.43Å; S777-E780 VanDerWaalsContact OG-CD 3.31Å; S777-E780 VanDerWaalsContact OG-CG 3.27Å; S777-E780 WeakPolarHBondContact OG-CG 3.36Å; S777-E780 PolarHBondContact OG-N 3.45Å; S777-E780 PolarHBondContact OG-OE2 3.31Å; E780-F782 PolarHBondContact O-N 3.49Å; E780-S783 VanDerWaalsContact O-CB 3.31Å; E780-S783 WeakPolarHBondContact O-CB 3.11Å; E780-S783 PolarHBondContact O-N 3.21Å; E780-M784 WeakPolarHBondContact O-CG 3.25Å; E780-M784 PolarHBondContact O-N 3.12Å; E780-Y795 HydrophobicContact CB-CE2 4.03Å; E780-Y795 VanDerWaalsContact CB-OH 3.31Å; E780-Y795 WeakPolarHBondContact CB-OH 3.47Å; E780-Y795 PolarHBondContact OE2-OH 2.82Å; E780-K799 WeakPolarHBondContact OE1-CE 3.22Å; E780-K799 IonicContact OE1-NZ 2.64Å; E780-K799 PolarHBondContact OE1-NZ 2.78Å; E780-K799 IonicContact OE2-NZ 3.47Å; E780-K799 PolarHBondContact OE2-NZ 3.05Å
781	W	95	Very high	93.9	Very high	0 Å²	0	60 Å²	60	0%	0	29%	0.287	C	S	.	.	H	α-helix	trans	-70.3	-38.7	-164.5	-174.4	-123.2	0	0	0	113.3	E584 E587 A588 L776 S777 S783 M784 L785 K792 Y795 L796	E584-W781 PolarHBondContact O-NE1 3.44Å; E587-W781 HydrophobicContact CB-CZ2 4.24Å; E587-W781 HydrophobicContact CG-CH2 4.36Å; E587-W781 HydrophobicContact CG-CZ2 4.01Å; A588-W781 HydrophobicContact CB-CZ2 3.7Å; L776-W781 HydrophobicContact CB-CB 4.03Å; L776-W781 HydrophobicContact CB-CD2 4.4Å; L776-W781 HydrophobicContact CB-CG 3.97Å; L776-W781 HydrophobicContact CD1-CD2 4.27Å; S777-W781 WeakPolarHBondContact O-CB 3.33Å; S777-W781 PolarHBondContact O-N 3.02Å; W781-S783 PolarHBondContact O-N 3.11Å; W781-M784 HydrophobicContact CE3-CB 3.72Å; W781-M784 HydrophobicContact CE3-CG 4.33Å; W781-M784 HydrophobicContact CZ3-CB 3.98Å; W781-M784 CarbonylContact O-C 3.47Å; W781-M784 WeakPolarHBondContact O-CA 3.08Å; W781-M784 WeakPolarHBondContact O-CB 3.29Å; W781-M784 PolarHBondContact O-N 2.95Å; W781-L785 HydrophobicContact CZ2-CD2 4.01Å; W781-L785 WeakPolarHBondContact O-CG 3.38Å; W781-L785 PolarHBondContact O-N 3.16Å; W781-K792 HydrophobicContact CH2-CB 4.42Å; W781-K792 HydrophobicContact CH2-CG 4.48Å; W781-K792 HydrophobicContact CZ3-CB 4.47Å; W781-Y795 AromaticContact CE3-CD1 3.83Å; W781-Y795 HydrophobicContact CE3-CD1 3.83Å; W781-Y795 AromaticContact CE3-CE1 3.54Å; W781-Y795 HydrophobicContact CE3-CE1 3.54Å; W781-Y795 AromaticContact CZ3-CD1 3.86Å; W781-Y795 HydrophobicContact CZ3-CD1 3.86Å; W781-Y795 HydrophobicContact CZ3-CE1 4.04Å; W781-L796 HydrophobicContact CH2-CD1 4.13Å; W781-L796 HydrophobicContact CH2-CG 4.45Å; W781-L796 HydrophobicContact CZ3-CD1 4.4Å; W781-L796 HydrophobicContact CZ3-CD2 4.27Å; W781-L796 HydrophobicContact CZ3-CG 4.24Å
782	F	92.4	Very high	93.9	Very high	76 Å²	76	59.6 Å²	59.6	33%	0.333	29%	0.286	S	S	.	.	H	α-helix	trans	-67.6	-29.5	178.8	-72.4	43.2	0	0	0	110.8	E584 H778 E780	E584-F782 HydrophobicContact CB-CD1 4.4Å; E584-F782 HydrophobicContact CB-CE1 3.86Å; E584-F782 HydrophobicContact CB-CZ 4.11Å; E584-F782 HydrophobicContact CG-CE1 3.8Å; E584-F782 HydrophobicContact CG-CZ 3.75Å; E584-F782 WeakPolarHBondContact OE1-CZ 3.45Å; H778-F782 HydrophobicContact CB-CD1 4Å; H778-F782 HydrophobicContact CB-CE1 4.02Å; H778-F782 VanDerWaalsContact O-CB 3.22Å; H778-F782 WeakPolarHBondContact O-CB 3.3Å; H778-F782 WeakPolarHBondContact O-CD1 3.37Å; H778-F782 PolarHBondContact O-N 2.78Å; E780-F782 PolarHBondContact O-N 3.49Å
783	S	91.8	Very high	93.9	Very high	72 Å²	72	56.6 Å²	56.6	50%	0.503	28%	0.277	S	S	.	.	H	α-helix	trans	-69	-34.3	170.3	-54.4	0	0	0	0	111.9	W779 E780 W781	W779-S783 PolarHBondContact O-OG 3.42Å; E780-S783 VanDerWaalsContact O-CB 3.31Å; E780-S783 WeakPolarHBondContact O-CB 3.11Å; E780-S783 PolarHBondContact O-N 3.21Å; W781-S783 PolarHBondContact O-N 3.11Å
784	M	92.3	Very high	93.9	Very high	29 Å²	29	57.7 Å²	57.7	14%	0.143	29%	0.29	C	S	.	.	H	α-helix	trans	-73	-25.4	175.9	-67.6	-58.1	-63.3	0	0	114.1	E780 W781 R786 K787 Q791 K792 Y795	E780-M784 WeakPolarHBondContact O-CG 3.25Å; E780-M784 PolarHBondContact O-N 3.12Å; W781-M784 HydrophobicContact CE3-CB 3.72Å; W781-M784 HydrophobicContact CE3-CG 4.33Å; W781-M784 HydrophobicContact CZ3-CB 3.98Å; W781-M784 CarbonylContact O-C 3.47Å; W781-M784 WeakPolarHBondContact O-CA 3.08Å; W781-M784 WeakPolarHBondContact O-CB 3.29Å; W781-M784 PolarHBondContact O-N 2.95Å; M784-R786 PolarHBondContact O-N 3.5Å; M784-R786 VanDerWaalsContact O-N 3.11Å; M784-K787 HydrophobicContact CE-CB 4.09Å; M784-K787 HydrophobicContact CE-CG 4.15Å; M784-K787 VanDerWaalsContact O-CB 3.3Å; M784-K787 WeakPolarHBondContact O-CB 3.12Å; M784-K787 PolarHBondContact O-N 3.43Å; M784-K787 HydrophobicContact SD-CB 4.47Å; M784-K787 HydrophobicContact SD-CG 3.89Å; M784-Q791 VanDerWaalsContact CE-C 3.48Å; M784-Q791 HydrophobicContact CE-CB 4.06Å; M784-Q791 WeakPolarHBondContact CE-O 3.39Å; M784-K792 HydrophobicContact CE-CG 4.38Å; M784-K792 WeakPolarHBondContact O-CE 3.39Å; M784-Y795 HydrophobicContact CE-CG 4.2Å; M784-Y795 HydrophobicContact CG-CD1 4.28Å; M784-Y795 HydrophobicContact CG-CD2 4.29Å; M784-Y795 HydrophobicContact CG-CG 4.16Å
785	L	91.1	Very high	93.9	Very high	46 Å²	46	59 Å²	59	24%	0.241	30%	0.295	C	S	.	.	T	Hydrogen-bonded Turn	trans	-55.1	-33.4	178.1	-60.8	179	0	0	0	112.9	E584 E587 W781 K792	E584-L785 HydrophobicContact CB-CD1 4.02Å; E584-L785 HydrophobicContact CB-CD2 4.44Å; E587-L785 HydrophobicContact CB-CD2 3.88Å; E587-L785 HydrophobicContact CG-CD2 3.94Å; W781-L785 HydrophobicContact CZ2-CD2 4.01Å; W781-L785 WeakPolarHBondContact O-CG 3.38Å; W781-L785 PolarHBondContact O-N 3.16Å; L785-K792 WeakPolarHBondContact O-CE 3.44Å; L785-K792 PolarHBondContact O-NZ 3.47Å
786	R	91.6	Very high	93.9	Very high	215 Å²	215	57.1 Å²	57.1	81%	0.811	29%	0.286	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.3	2.5	178.6	-59.3	-179.4	-178.6	167.6	0	114.3	M784	M784-R786 PolarHBondContact O-N 3.5Å; M784-R786 VanDerWaalsContact O-N 3.11Å
787	K	94.5	Very high	93.9	Very high	105 Å²	105	61.3 Å²	61.3	46%	0.457	31%	0.305	S	S	.	.	S	Bend	trans	-94	165.7	-178.6	-61.5	-63.7	-176.2	176	0	111.8	M784 Q791 K792	M784-K787 HydrophobicContact CE-CB 4.09Å; M784-K787 HydrophobicContact CE-CG 4.15Å; M784-K787 VanDerWaalsContact O-CB 3.3Å; M784-K787 WeakPolarHBondContact O-CB 3.12Å; M784-K787 PolarHBondContact O-N 3.43Å; M784-K787 HydrophobicContact SD-CB 4.47Å; M784-K787 HydrophobicContact SD-CG 3.89Å; K787-Q791 HydrophobicContact CB-CB 4Å; K787-K792 VanDerWaalsContact O-CE 3.25Å; K787-K792 WeakPolarHBondContact O-CE 3.39Å
788	S	95.5	Very high	93.9	Very high	61 Å²	61	64.1 Å²	64.1	43%	0.427	32%	0.324	S	S	.	.			trans	-65.6	157	178.2	75.6	0	0	0	0	111.3	A790 Q791 K792	S788-A790 VanDerWaalsContact C-N 3.3Å; S788-A790 PolarHBondContact O-N 3.32Å; S788-Q791 WeakPolarHBondContact O-CB 3.35Å; S788-Q791 PolarHBondContact O-N 2.99Å; S788-Q791 WeakPolarHBondContact OG-CG 3.48Å; S788-Q791 PolarHBondContact OG-N 3.3Å; S788-Q791 PolarHBondContact OG-OE1 2.96Å; S788-K792 PolarHBondContact O-N 2.72Å; S788-K792 VanDerWaalsContact O-N 3.08Å
789	R	95.4	Very high	94.1	Very high	73 Å²	73	64.8 Å²	64.8	28%	0.275	33%	0.327	S	S	.	.	H	α-helix	trans	-57.5	-43.7	-179.9	-168.2	60	161.9	-149.2	-13	111.7	E587 S590 D594 Q791 K792 L793	E587-R789 IonicContact OE1-CZ 2.73Å; E587-R789 IonicContact OE1-NH1 2.77Å; E587-R789 PolarHBondContact OE1-NH1 3.35Å; E587-R789 IonicContact OE2-NH1 3.63Å; S590-R789 VanDerWaalsContact C-NH2 3.31Å; S590-R789 PolarHBondContact O-NH2 3.03Å; S590-R789 VanDerWaalsContact O-NH2 3.16Å; S590-R789 PolarHBondContact OG-NH2 3.08Å; D594-R789 IonicContact OD1-NH2 3.28Å; D594-R789 PolarHBondContact OD1-NH2 2.75Å; D594-R789 IonicContact OD2-CZ 2.62Å; D594-R789 IonicContact OD2-NE 2.93Å; D594-R789 PolarHBondContact OD2-NE 2.9Å; D594-R789 IonicContact OD2-NH2 3.1Å; D594-R789 PolarHBondContact OD2-NH2 2.98Å; R789-Q791 VanDerWaalsContact C-N 3.31Å; R789-Q791 PolarHBondContact O-N 2.78Å; R789-K792 WeakPolarHBondContact O-CB 3.49Å; R789-K792 PolarHBondContact O-N 2.96Å; R789-K792 VanDerWaalsContact O-N 3.11Å; R789-L793 HydrophobicContact CG-CD1 4.19Å; R789-L793 HydrophobicContact CG-CG 4.39Å; R789-L793 VanDerWaalsContact O-CG 3.31Å; R789-L793 WeakPolarHBondContact O-CG 3.46Å; R789-L793 PolarHBondContact O-N 3.45Å
790	A	95.3	Very high	94.2	Very high	71 Å²	71	60.4 Å²	60.4	59%	0.587	31%	0.31	S	S	*	.	H	α-helix	trans	-57	-40.2	174.9	0	0	0	0	0	113.3	S788 L793 A794	S788-A790 VanDerWaalsContact C-N 3.3Å; S788-A790 PolarHBondContact O-N 3.32Å; A790-L793 PolarHBondContact O-N 3.45Å; A790-A794 WeakPolarHBondContact O-CB 3.35Å; A790-A794 PolarHBondContact O-N 3.01Å
791	Q	95.3	Very high	94	Very high	99 Å²	99	60.2 Å²	60.2	46%	0.463	31%	0.307	S	S	.	.	H	α-helix	trans	-67	-38.5	176.3	-73.1	172.8	-33.1	0	0	112.1	M784 K787 S788 R789 Y795	M784-Q791 VanDerWaalsContact CE-C 3.48Å; M784-Q791 HydrophobicContact CE-CB 4.06Å; M784-Q791 WeakPolarHBondContact CE-O 3.39Å; K787-Q791 HydrophobicContact CB-CB 4Å; S788-Q791 WeakPolarHBondContact O-CB 3.35Å; S788-Q791 PolarHBondContact O-N 2.99Å; S788-Q791 WeakPolarHBondContact OG-CG 3.48Å; S788-Q791 PolarHBondContact OG-N 3.3Å; S788-Q791 PolarHBondContact OG-OE1 2.96Å; R789-Q791 VanDerWaalsContact C-N 3.31Å; R789-Q791 PolarHBondContact O-N 2.78Å; Q791-Y795 WeakPolarHBondContact O-CB 3.38Å; Q791-Y795 PolarHBondContact O-N 3.45Å
792	K	95.7	Very high	93.6	Very high	18 Å²	18	66.2 Å²	66.2	8%	0.078	34%	0.339	C	S	.	.	H	α-helix	trans	-65.7	-43.8	174.7	-65.2	169.8	176.8	167.8	0	111.8	E587 W781 M784 L785 K787 S788 R789 Y795 L796	E587-K792 VanDerWaalsContact CD-NZ 3.25Å; E587-K792 HydrophobicContact CG-CD 4.09Å; E587-K792 WeakPolarHBondContact OE1-CD 3.49Å; E587-K792 WeakPolarHBondContact OE1-CE 3.3Å; E587-K792 IonicContact OE1-NZ 3.42Å; E587-K792 PolarHBondContact OE1-NZ 3.26Å; E587-K792 IonicContact OE2-NZ 3.65Å; W781-K792 HydrophobicContact CH2-CB 4.42Å; W781-K792 HydrophobicContact CH2-CG 4.48Å; W781-K792 HydrophobicContact CZ3-CB 4.47Å; M784-K792 HydrophobicContact CE-CG 4.38Å; M784-K792 WeakPolarHBondContact O-CE 3.39Å; L785-K792 WeakPolarHBondContact O-CE 3.44Å; L785-K792 PolarHBondContact O-NZ 3.47Å; K787-K792 VanDerWaalsContact O-CE 3.25Å; K787-K792 WeakPolarHBondContact O-CE 3.39Å; S788-K792 PolarHBondContact O-N 2.72Å; S788-K792 VanDerWaalsContact O-N 3.08Å; R789-K792 WeakPolarHBondContact O-CB 3.49Å; R789-K792 PolarHBondContact O-N 2.96Å; R789-K792 VanDerWaalsContact O-N 3.11Å; K792-Y795 PolarHBondContact O-N 2.88Å; K792-L796 WeakPolarHBondContact O-CB 3.38Å; K792-L796 WeakPolarHBondContact O-CG 3.23Å; K792-L796 PolarHBondContact O-N 3.37Å
793	L	95.8	Very high	92.6	Very high	44 Å²	44	63.7 Å²	63.7	23%	0.23	33%	0.331	C	S	.	.	H	α-helix	trans	-62.6	-44.8	177	-65.8	173.7	0	0	0	111.7	A591 D594 L595 R789 A790 L796 H797	A591-L793 HydrophobicContact CB-CD2 4.32Å; A591-L793 WeakPolarHBondContact O-CD2 3.23Å; D594-L793 HydrophobicContact CB-CD2 3.64Å; L595-L793 HydrophobicContact CB-CD2 4.03Å; R789-L793 HydrophobicContact CG-CD1 4.19Å; R789-L793 HydrophobicContact CG-CG 4.39Å; R789-L793 VanDerWaalsContact O-CG 3.31Å; R789-L793 WeakPolarHBondContact O-CG 3.46Å; R789-L793 PolarHBondContact O-N 3.45Å; A790-L793 PolarHBondContact O-N 3.45Å; L793-L796 PolarHBondContact O-N 2.83Å; L793-H797 WeakPolarHBondContact O-CB 3.31Å; L793-H797 PolarHBondContact O-N 3.04Å
794	A	95.3	Very high	91.8	Very high	57 Å²	57	64.8 Å²	64.8	47%	0.471	33%	0.331	S	S	.	.	H	α-helix	trans	-62	-44.3	175.8	0	0	0	0	0	112.4	A790 L796 H797 C798	A790-A794 WeakPolarHBondContact O-CB 3.35Å; A790-A794 PolarHBondContact O-N 3.01Å; A794-L796 PolarHBondContact O-N 2.9Å; A794-H797 WeakPolarHBondContact O-CB 3.46Å; A794-H797 PolarHBondContact O-N 3.06Å; A794-C798 PolarHBondContact O-N 3.13Å
795	Y	95.8	Very high	91.7	Very high	34 Å²	34	66.6 Å²	66.6	13%	0.133	34%	0.34	C	S	.	.	H	α-helix	trans	-61.2	-43	175.5	169.3	-93.9	0	0	0	112.5	L776 E780 W781 M784 Q791 K792 K799	L776-Y795 HydrophobicContact CD2-CE1 4.05Å; E780-Y795 HydrophobicContact CB-CE2 4.03Å; E780-Y795 VanDerWaalsContact CB-OH 3.31Å; E780-Y795 WeakPolarHBondContact CB-OH 3.47Å; E780-Y795 PolarHBondContact OE2-OH 2.82Å; W781-Y795 AromaticContact CE3-CD1 3.83Å; W781-Y795 HydrophobicContact CE3-CD1 3.83Å; W781-Y795 AromaticContact CE3-CE1 3.54Å; W781-Y795 HydrophobicContact CE3-CE1 3.54Å; W781-Y795 AromaticContact CZ3-CD1 3.86Å; W781-Y795 HydrophobicContact CZ3-CD1 3.86Å; W781-Y795 HydrophobicContact CZ3-CE1 4.04Å; M784-Y795 HydrophobicContact CE-CG 4.2Å; M784-Y795 HydrophobicContact CG-CD1 4.28Å; M784-Y795 HydrophobicContact CG-CD2 4.29Å; M784-Y795 HydrophobicContact CG-CG 4.16Å; Q791-Y795 WeakPolarHBondContact O-CB 3.38Å; Q791-Y795 PolarHBondContact O-N 3.45Å; K792-Y795 PolarHBondContact O-N 2.88Å; Y795-K799 HydrophobicContact CD1-CG 4.41Å; Y795-K799 HydrophobicContact CD2-CG 4.45Å; Y795-K799 HydrophobicContact CE1-CG 4Å; Y795-K799 HydrophobicContact CE2-CD 4.42Å; Y795-K799 HydrophobicContact CE2-CG 4.05Å; Y795-K799 WeakPolarHBondContact O-CB 3.35Å; Y795-K799 VanDerWaalsContact O-CG 3.27Å; Y795-K799 WeakPolarHBondContact O-CG 3.43Å; Y795-K799 PolarHBondContact O-N 3.46Å; Y795-K799 WeakPolarHBondContact OH-CE 3.36Å
796	L	95.8	Very high	91.8	Very high	0 Å²	0	67.6 Å²	67.6	0%	0	35%	0.345	C	S	.	.	H	α-helix	trans	-69.7	-36.2	176.4	-70.3	170.5	0	0	0	112.1	A591 L592 L595 L776 W781 K792 L793 A794 K799 I800	A591-L796 HydrophobicContact CB-CD1 3.43Å; A591-L796 VanDerWaalsContact CB-CD1 3.43Å; L592-L796 HydrophobicContact CD2-CB 4.26Å; L592-L796 HydrophobicContact CD2-CD1 4.22Å; L592-L796 HydrophobicContact CD2-CD2 4.15Å; L592-L796 HydrophobicContact CD2-CG 4.45Å; L592-L796 HydrophobicContact CG-CD1 4.15Å; L592-L796 HydrophobicContact CG-CD2 4.42Å; L595-L796 HydrophobicContact CD2-CB 3.81Å; L776-L796 HydrophobicContact CD1-CD2 3.77Å; L776-L796 HydrophobicContact CD2-CD2 3.61Å; L776-L796 HydrophobicContact CG-CD2 4.38Å; W781-L796 HydrophobicContact CH2-CD1 4.13Å; W781-L796 HydrophobicContact CH2-CG 4.45Å; W781-L796 HydrophobicContact CZ3-CD1 4.4Å; W781-L796 HydrophobicContact CZ3-CD2 4.27Å; W781-L796 HydrophobicContact CZ3-CG 4.24Å; K792-L796 WeakPolarHBondContact O-CB 3.38Å; K792-L796 WeakPolarHBondContact O-CG 3.23Å; K792-L796 PolarHBondContact O-N 3.37Å; L793-L796 PolarHBondContact O-N 2.83Å; A794-L796 PolarHBondContact O-N 2.9Å; L796-K799 PolarHBondContact O-N 2.88Å; L796-I800 WeakPolarHBondContact O-CB 3.34Å; L796-I800 VanDerWaalsContact O-CG1 3.24Å; L796-I800 WeakPolarHBondContact O-CG1 3.4Å; L796-I800 PolarHBondContact O-N 3.5Å
797	H	94.8	Very high	91.8	Very high	89 Å²	89	59.4 Å²	59.4	41%	0.412	32%	0.319	S	S	.	.	H	α-helix	trans	-58	-52.1	172.8	-173.2	-64	0	0	0	110.4	L595 L793 A794 I800 Y801	L595-H797 HydrophobicContact CD1-CB 4Å; L595-H797 HydrophobicContact CD2-CB 4.47Å; L793-H797 WeakPolarHBondContact O-CB 3.31Å; L793-H797 PolarHBondContact O-N 3.04Å; A794-H797 WeakPolarHBondContact O-CB 3.46Å; A794-H797 PolarHBondContact O-N 3.06Å; H797-I800 PolarHBondContact O-N 3.45Å; H797-Y801 AromaticContact CD2-CD2 3.88Å; H797-Y801 AromaticContact CE1-CD2 3.76Å; H797-Y801 AromaticContact CE1-CG 3.87Å; H797-Y801 AromaticContact CG-CD2 3.81Å; H797-Y801 AromaticContact ND1-CD2 3.74Å; H797-Y801 AromaticContact NE2-CD2 3.86Å; H797-Y801 WeakPolarHBondContact O-CB 3.39Å; H797-Y801 WeakPolarHBondContact O-CD2 3.41Å; H797-Y801 PolarHBondContact O-N 3.23Å
798	C	94.1	Very high	91.6	Very high	59 Å²	59	56.8 Å²	56.8	40%	0.399	31%	0.311	S	S	.	.	H	α-helix	trans	-54.9	-55	173.1	-73.4	0	0	0	0	111.5	A794 I800 Y801 D802	A794-C798 PolarHBondContact O-N 3.13Å; C798-I800 PolarHBondContact O-N 3.08Å; C798-Y801 PolarHBondContact O-N 2.72Å; C798-D802 VanDerWaalsContact CA-OD2 3.26Å; C798-D802 WeakPolarHBondContact CA-OD2 3.46Å; C798-D802 WeakPolarHBondContact CB-OD2 3.49Å; C798-D802 WeakPolarHBondContact O-CA 3.33Å; C798-D802 WeakPolarHBondContact O-CB 3.31Å; C798-D802 PolarHBondContact O-N 2.77Å
799	K	93.9	Very high	91.4	Very high	57 Å²	57	56.5 Å²	56.5	25%	0.248	30%	0.304	C	S	.	.	H	α-helix	trans	-59.6	-26	-177.5	-70.2	-78.5	172.9	164.4	0	114.7	V774 L776 E780 Y795 L796	V774-K799 HydrophobicContact CG1-CB 4.07Å; V774-K799 WeakPolarHBondContact CG1-O 3.47Å; V774-K799 WeakPolarHBondContact CG2-O 3.41Å; L776-K799 HydrophobicContact CD2-CB 4.4Å; L776-K799 HydrophobicContact CD2-CG 4.49Å; E780-K799 WeakPolarHBondContact OE1-CE 3.22Å; E780-K799 IonicContact OE1-NZ 2.64Å; E780-K799 PolarHBondContact OE1-NZ 2.78Å; E780-K799 IonicContact OE2-NZ 3.47Å; E780-K799 PolarHBondContact OE2-NZ 3.05Å; Y795-K799 HydrophobicContact CD1-CG 4.41Å; Y795-K799 HydrophobicContact CD2-CG 4.45Å; Y795-K799 HydrophobicContact CE1-CG 4Å; Y795-K799 HydrophobicContact CE2-CD 4.42Å; Y795-K799 HydrophobicContact CE2-CG 4.05Å; Y795-K799 WeakPolarHBondContact O-CB 3.35Å; Y795-K799 VanDerWaalsContact O-CG 3.27Å; Y795-K799 WeakPolarHBondContact O-CG 3.43Å; Y795-K799 PolarHBondContact O-N 3.46Å; Y795-K799 WeakPolarHBondContact OH-CE 3.36Å; L796-K799 PolarHBondContact O-N 2.88Å
800	I	92.8	Very high	91.1	Very high	1 Å²	1	55.4 Å²	55.4	1%	0.005	31%	0.306	C	S	.	.	H	α-helix	trans	-92.8	-50	178.3	-64.8	-67.2	0	0	0	111.7	L592 I618 L620 I738 V740 V774 L796 H797 C798 S803	L592-I800 HydrophobicContact CD2-CD1 4.25Å; L592-I800 HydrophobicContact CD2-CG1 4.05Å; I618-I800 HydrophobicContact CD1-CD1 3.67Å; I618-I800 HydrophobicContact CD1-CG1 4.49Å; L620-I800 HydrophobicContact CD1-CG2 3.87Å; I738-I800 HydrophobicContact CD1-CG2 4.11Å; I738-I800 HydrophobicContact CG2-CD1 4.18Å; V740-I800 HydrophobicContact CG2-CD1 3.65Å; V774-I800 HydrophobicContact CG1-CD1 4.22Å; V774-I800 HydrophobicContact CG2-CD1 4.45Å; L796-I800 WeakPolarHBondContact O-CB 3.34Å; L796-I800 VanDerWaalsContact O-CG1 3.24Å; L796-I800 WeakPolarHBondContact O-CG1 3.4Å; L796-I800 PolarHBondContact O-N 3.5Å; H797-I800 PolarHBondContact O-N 3.45Å; C798-I800 PolarHBondContact O-N 3.08Å; I800-S803 VanDerWaalsContact O-CB 3.24Å; I800-S803 WeakPolarHBondContact O-CB 3.17Å; I800-S803 PolarHBondContact O-N 2.83Å; I800-S803 PolarHBondContact O-OG 2.78Å
801	Y	90.4	Very high	90.8	Very high	58 Å²	58	54.3 Å²	54.3	23%	0.227	29%	0.286	C	S	.	.	H	α-helix	trans	-87.1	-30.7	-172.2	-68.3	-90.6	0	0	0	113.4	G624 H797 C798 S803 L804	G624-Y801 WeakPolarHBondContact O-CE1 3.15Å; H797-Y801 AromaticContact CD2-CD2 3.88Å; H797-Y801 AromaticContact CE1-CD2 3.76Å; H797-Y801 AromaticContact CE1-CG 3.87Å; H797-Y801 AromaticContact CG-CD2 3.81Å; H797-Y801 AromaticContact ND1-CD2 3.74Å; H797-Y801 AromaticContact NE2-CD2 3.86Å; H797-Y801 WeakPolarHBondContact O-CB 3.39Å; H797-Y801 WeakPolarHBondContact O-CD2 3.41Å; H797-Y801 PolarHBondContact O-N 3.23Å; C798-Y801 PolarHBondContact O-N 2.72Å; Y801-S803 PolarHBondContact O-N 2.84Å; Y801-L804 HydrophobicContact CD1-CD1 3.75Å; Y801-L804 HydrophobicContact CE1-CD1 4.36Å; Y801-L804 PolarHBondContact O-N 2.71Å
802	D	86.7	Confident	90.5	Very high	126 Å²	126	50.8 Å²	50.8	67%	0.674	27%	0.272	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.7	-10.5	165.6	-45.8	-18.2	0	0	0	110.8	C798	C798-D802 VanDerWaalsContact CA-OD2 3.26Å; C798-D802 WeakPolarHBondContact CA-OD2 3.46Å; C798-D802 WeakPolarHBondContact CB-OD2 3.49Å; C798-D802 WeakPolarHBondContact O-CA 3.33Å; C798-D802 WeakPolarHBondContact O-CB 3.31Å; C798-D802 PolarHBondContact O-N 2.77Å
803	S	71.8	Confident	90.1	Very high	24 Å²	24	53.6 Å²	53.6	17%	0.168	29%	0.288	C	S	.	.	T	Hydrogen-bonded Turn	trans	-76.7	-43.2	172.3	94.1	0	0	0	0	111.8	R772 I800 Y801	R772-S803 PolarHBondContact NE-O 3.14Å; R772-S803 PolarHBondContact NH2-O 2.94Å; I800-S803 VanDerWaalsContact O-CB 3.24Å; I800-S803 WeakPolarHBondContact O-CB 3.17Å; I800-S803 PolarHBondContact O-N 2.83Å; I800-S803 PolarHBondContact O-OG 2.78Å; Y801-S803 PolarHBondContact O-N 2.84Å
804	L	73.6	Confident	89.5	Confident	94 Å²	94	54.5 Å²	54.5	49%	0.492	29%	0.294	S	S	.	.			trans	-49.1	0	-168.3	-79	171.3	0	0	0	114.4	L620 V736 R772 Y801	L620-L804 HydrophobicContact CD1-CD1 4.06Å; L620-L804 HydrophobicContact CD1-CD2 3.97Å; L620-L804 HydrophobicContact CD1-CG 4.23Å; V736-L804 HydrophobicContact CB-CD2 4.22Å; V736-L804 HydrophobicContact CG1-CD2 4.18Å; V736-L804 HydrophobicContact CG2-CD2 4.14Å; R772-L804 PolarHBondContact NH1-O 2.81Å; R772-L804 PolarHBondContact NH2-O 3.06Å; Y801-L804 HydrophobicContact CD1-CD1 3.75Å; Y801-L804 HydrophobicContact CE1-CD1 4.36Å; Y801-L804 PolarHBondContact O-N 2.71Å

Retrieved 804 of 804 residues in 556.2 ms (Link to these results)

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