A0A087XHA4_POEFO Loading...

TBC1 domain family member 2B

AlphaFold DB , UniProt , Accession A0A087XHA4, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 1,006 aa.

						>A0A087XHA4_POEFO|A0A087XHA4
MPLIHVTITSNYISQHPLSEESSHADGPRSCHLRGCKKKKKKLLGKMHEEEDGSGESSCTVSRLQSFKSLDVAEVEGAKEQASKLCGYLNKLSGKGPLRGYKLRWFVYDPRKCYLYYFKTPQDALPLGHIDIGDACFMYDVEGEEGQFEIRTAGKEFLLKAPSRQVMHYWLQELQQKRWEYSNTRGTGKRDSWSSPTQAYPPTGLVGKDSDAFFVEKLSDSMEKVRSDFAMDTEMDAGGMVGIQSARGPFSLKNFGTELRNSMSNLRPGRVENRRSVFYTGNHNSSSEEWEMVDAPPKDFTEQKPHLDTQRHSFGSAFTFDFVRNRQRPQRLLLRDVRGPGKFARGVERRGSGSPTGECNGSKSLEMQLRLQNQQDEMNQMQQEQIKLREELASQKELVRLLQQTLRTSQFERPSVWRAAPDPSAAPDQAPSPAVTQEDVAQLEAVLQERDVQIQSLCGHMERLSLEKESLQQELKGLKIKVGEINDQLGMLMETIQAKDQVIVKLSQENSEQSGNANDAGSPPPQQELSILKDSLQGYKSQNKFLNKEILELTVLRRNAEIREKALEAKCTALEAKLCQVESKYLVLLQEVRKPVCSSEEDPAREVISRLLEDALQAESPDQNEHQIFKPNSVSEYDVYGFKTVPEEEEEEEKLVAKLRALELKSLSMTDQEVSVGVKWENFLASTMNRDLVHSPELKALIRCGVPHEHRSIVWRWCVTFHVKKFRDHLAPDYYETLLNVARDRPNPASKQIELDLLRTLPNNKHYASPSAGGINKLRNVLVAFSWRNPDIGYCQGLNRLAAIALLYLDQEDAFWTLVAIVEVFMPRDYYTKTLLGSQVDQRVFKDLMSEKLPRLHAHFEQHKVDFSLITFNWFLVVFVDSVVSDILFKIWDAFLFEGPKIIFRFALALFKYQEEEFLKLQDTTAIFKYLRYFTRTILDSRKLMNIAFVDMNPFPMRQIQNRRSFHLEKVRLELTELEAIRQTFLKERETSLDRRSFVSDDEEDN
					

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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	24.1	Very low	26.3	Very low	157 Å²	157	122.3 Å²	122.3	77%	0.773	68%	0.679	S	S	*	*				0	142.9	0	-62.7	-171.6	-171.1	0	0	113.1	E648	M1-E648 HydrophobicContact CE-CG 3.5Å
2	P	25.3	Very low	26.5	Very low	128 Å²	128	123.6 Å²	123.6	83%	0.831	67%	0.667	S	S	*	*			trans	-87.8	121.8	172.9	33.2	-31.2	0	0	0	112.9
3	L	27	Very low	26.5	Very low	152 Å²	152	126.2 Å²	126.2	80%	0.796	68%	0.678	S	S	*	*			trans	-70.1	140.7	175.2	-77.5	160	0	0	0	111.8	H5	L3-H5 PolarHBondContact O-N 2.79Å
4	I	29.2	Very low	26.4	Very low	97 Å²	97	123.8 Å²	123.8	50%	0.497	68%	0.676	S	S	.	*			trans	-73.8	89.5	176	-54.3	178.6	0	0	0	109.4	V6	I4-V6 VanDerWaalsContact C-N 3.34Å; I4-V6 HydrophobicContact CG2-CG2 4.02Å; I4-V6 PolarHBondContact O-N 2.96Å
5	H	24.3	Very low	26.6	Very low	164 Å²	164	128.2 Å²	128.2	76%	0.759	69%	0.69	S	S	*	*			trans	-67	92	163.7	-103.8	-94.6	0	0	0	109.7	L3 T7	L3-H5 PolarHBondContact O-N 2.79Å; H5-T7 PolarHBondContact O-N 3.32Å
6	V	26.7	Very low	26.7	Very low	84 Å²	84	130.5 Å²	130.5	51%	0.509	70%	0.695	S	S	.	*			trans	-75.6	100.9	155.2	-174.7	0	0	0	0	106.2	I4 I8	I4-V6 VanDerWaalsContact C-N 3.34Å; I4-V6 HydrophobicContact CG2-CG2 4.02Å; I4-V6 PolarHBondContact O-N 2.96Å; V6-I8 HydrophobicContact CG1-CG1 3.92Å; V6-I8 PolarHBondContact O-N 3.33Å
7	T	23.1	Very low	27	Very low	107 Å²	107	130.2 Å²	130.2	66%	0.656	70%	0.701	S	S	*	*			trans	-72.8	74.8	179.5	-51.8	0	0	0	0	110.6	H5 T9	H5-T7 PolarHBondContact O-N 3.32Å; T7-T9 HydrophobicContact CG2-CG2 4.38Å; T7-T9 PolarHBondContact O-N 2.76Å; T7-T9 VanDerWaalsContact O-N 3.16Å
8	I	29.5	Very low	27.1	Very low	115 Å²	115	132.4 Å²	132.4	59%	0.59	71%	0.712	S	S	*	*			trans	-71.2	103.6	164.6	-55.7	-177.5	0	0	0	106.7	V6 S10	V6-I8 HydrophobicContact CG1-CG1 3.92Å; V6-I8 PolarHBondContact O-N 3.33Å; I8-S10 PolarHBondContact O-N 3.01Å
9	T	24.2	Very low	27.1	Very low	118 Å²	118	131.2 Å²	131.2	72%	0.724	72%	0.715	S	S	*	*			trans	-71.9	75.6	170	34.1	0	0	0	0	109.6	T7 N11	T7-T9 HydrophobicContact CG2-CG2 4.38Å; T7-T9 PolarHBondContact O-N 2.76Å; T7-T9 VanDerWaalsContact O-N 3.16Å; T9-N11 VanDerWaalsContact C-N 3.28Å; T9-N11 PolarHBondContact O-N 3.46Å
10	S	28.2	Very low	27.1	Very low	84 Å²	84	133.4 Å²	133.4	59%	0.587	72%	0.72	S	S	*	*			trans	-72.5	84.2	173.3	-167.8	0	0	0	0	109.8	I8 Y12	I8-S10 PolarHBondContact O-N 3.01Å; S10-Y12 PolarHBondContact O-N 3.41Å
11	N	27.4	Very low	27.1	Very low	139 Å²	139	135.8 Å²	135.8	74%	0.743	73%	0.727	S	S	*	*			trans	-73.6	74.9	168.2	-85.5	2.6	0	0	0	109.8	T9	T9-N11 VanDerWaalsContact C-N 3.28Å; T9-N11 PolarHBondContact O-N 3.46Å
12	Y	28.6	Very low	27.2	Very low	138 Å²	138	132.9 Å²	132.9	54%	0.541	72%	0.721	S	S	.	*			trans	-110	109.6	164.6	-96.4	-80.1	0	0	0	109.8	S10 S14 E974 L978	S10-Y12 PolarHBondContact O-N 3.41Å; Y12-S14 PolarHBondContact O-N 2.96Å; Y12-E974 PolarHBondContact OH-OE2 2.84Å; Y12-L978 HydrophobicContact CE2-CD1 4.1Å
13	I	26.4	Very low	27.3	Very low	158 Å²	158	131.4 Å²	131.4	81%	0.81	71%	0.714	S	S	*	*			trans	-71	127.2	178.1	-65.1	171.6	0	0	0	108.5	Q15	I13-Q15 PolarHBondContact O-N 3.31Å
14	S	25.6	Very low	27.4	Very low	92 Å²	92	132.6 Å²	132.6	64%	0.643	72%	0.716	S	S	*	*			trans	-66.4	114.3	175.7	-174.1	0	0	0	0	110.6	Y12	Y12-S14 PolarHBondContact O-N 2.96Å
15	Q	29.3	Very low	27.5	Very low	190 Å²	190	132.1 Å²	132.1	89%	0.888	73%	0.726	S	S	*	*	P	Polyproline II helix	trans	-81.8	117.9	165.1	-69.2	-173.9	-4.7	0	0	109.2	I13	I13-Q15 PolarHBondContact O-N 3.31Å
16	H	27.6	Very low	27.7	Very low	165 Å²	165	132.1 Å²	132.1	76%	0.764	73%	0.732	S	S	*	*	P	Polyproline II helix	trans	-91.2	143.7	167.8	-92.4	-108.3	0	0	0	110.8
17	P	33.1	Very low	27.7	Very low	125 Å²	125	130.9 Å²	130.9	81%	0.812	74%	0.735	S	S	*	*	P	Polyproline II helix	trans	-79.4	165	179.1	33.3	-36	0	0	0	113.4
18	L	27.4	Very low	29	Very low	170 Å²	170	131.1 Å²	131.1	89%	0.89	74%	0.739	S	S	*	*	P	Polyproline II helix	trans	-90.6	137.6	-179.5	-69.4	160.7	0	0	0	112.9
19	S	27.3	Very low	28.8	Very low	109 Å²	109	136.6 Å²	136.6	76%	0.762	75%	0.752	S	S	*	*			trans	159.5	151.7	149.6	41.2	0	0	0	0	109.5
20	E	27.8	Very low	28.9	Very low	175 Å²	175	135.4 Å²	135.4	82%	0.818	75%	0.749	S	S	*	*			cis	-162.3	150.6	-19.5	-112.7	168.9	160.3	0	0	107
21	E	27.1	Very low	28.7	Very low	185 Å²	185	136.7 Å²	136.7	86%	0.864	76%	0.756	S	S	*	*			trans	58.7	153.8	159	-67.9	-164.4	155.1	0	0	120.1
22	S	26.1	Very low	28.7	Very low	95 Å²	95	137.4 Å²	137.4	66%	0.664	76%	0.755	S	S	*	*			cis	-160.5	164.7	-10.6	49	0	0	0	0	112.6
23	S	27.9	Very low	28.6	Very low	97 Å²	97	135.9 Å²	135.9	68%	0.678	76%	0.756	S	S	*	*			trans	77.4	135.9	150.4	78.2	0	0	0	0	122.5
24	H	29.3	Very low	28.6	Very low	178 Å²	178	139.2 Å²	139.2	82%	0.824	76%	0.758	S	S	*	*			trans	54.7	118.2	152.3	-60.3	-38	0	0	0	120.2
25	A	29.7	Very low	28.6	Very low	86 Å²	86	138.2 Å²	138.2	71%	0.711	76%	0.762	S	S	*	*				72.2	139.4	81.6	0	0	0	0	0	113.3
26	D	29	Very low	28.3	Very low	165 Å²	165	134.4 Å²	134.4	88%	0.882	76%	0.755	S	S	*	*			cis	-146.8	179	13	-143	-37.3	0	0	0	111.3
27	G	26.9	Very low	28.3	Very low	57 Å²	57	135.1 Å²	135.1	59%	0.588	76%	0.756	S	S	*	*			trans	-91.8	-154	171.9	0	0	0	0	0	113.8
28	P	50.2	Low	28	Very low	112 Å²	112	138.3 Å²	138.3	73%	0.727	76%	0.757	S	S	*	*				-137.3	-163.9	-52.2	29.6	-8.7	0	0	0	111.7
29	R	26.5	Very low	28	Very low	230 Å²	230	139.9 Å²	139.9	87%	0.868	76%	0.757	S	S	*	*			trans	77.8	167.1	165.5	-50.6	170.9	-177.4	177.2	0.9	116.7
30	S	25.2	Very low	28	Very low	94 Å²	94	144.4 Å²	144.4	66%	0.657	76%	0.763	S	S	*	*			cis	-175.2	152.3	-46.4	62.6	0	0	0	0	109.7
31	C	25	Very low	28.1	Very low	110 Å²	110	145.5 Å²	145.5	74%	0.743	77%	0.765	S	S	*	*			trans	69.2	161.9	162.6	-64.1	0	0	0	0	116.1
32	H	26.3	Very low	28.3	Very low	155 Å²	155	145.5 Å²	145.5	72%	0.718	76%	0.762	S	S	*	*			cis	-157.4	149.5	13.2	-134.7	16.8	0	0	0	113.6
33	L	26.7	Very low	28.4	Very low	106 Å²	106	147.1 Å²	147.1	56%	0.555	76%	0.762	S	S	*	*			trans	70.2	131.1	141.7	-70.1	171.2	0	0	0	125.1
34	R	26.3	Very low	28.4	Very low	228 Å²	228	150.1 Å²	150.1	86%	0.86	77%	0.77	S	S	*	*			trans	67.6	155	145.9	-59.4	164.7	-153.7	-135.5	3.2	117.5
35	G	25.6	Very low	28.3	Very low	71 Å²	71	144.9 Å²	144.9	73%	0.732	76%	0.764	S	S	*	*			cis	158.5	126.5	-13.3	0	0	0	0	0	115.3
36	C	24.5	Very low	28.2	Very low	109 Å²	109	149.3 Å²	149.3	74%	0.736	77%	0.767	S	S	*	*			trans	67.1	116.7	160.6	-89.7	0	0	0	0	123.1
37	K	26.1	Very low	28.1	Very low	181 Å²	181	148.3 Å²	148.3	79%	0.787	76%	0.759	S	S	*	*				80.4	132.1	122.5	-72.4	171.8	-178.5	165.1	0	123.3
38	K	26.6	Very low	28.1	Very low	192 Å²	192	151.6 Å²	151.6	84%	0.835	76%	0.759	S	S	*	*			trans	91.5	104.6	140.4	-77.1	173.8	176.7	-179.9	0	123.1
39	K	27.5	Very low	27	Very low	202 Å²	202	153.2 Å²	153.2	88%	0.878	76%	0.757	S	S	*	*				30.3	130.1	124.8	-70.6	-174.3	173	-177.7	0	122
40	K	27.4	Very low	27.1	Very low	205 Å²	205	149.6 Å²	149.6	89%	0.891	75%	0.75	S	S	*	*			trans	174.4	166.8	130.6	-96.5	166.1	179.8	-179.3	0	110.3
41	K	31.5	Very low	27.2	Very low	197 Å²	197	153.7 Å²	153.7	86%	0.857	76%	0.759	S	S	*	*			cis	177.8	173.8	-31.2	-163	179.3	-179.2	-170.8	0	109
42	K	30.5	Very low	27.3	Very low	185 Å²	185	156.3 Å²	156.3	80%	0.804	77%	0.765	S	S	*	*			trans	87.3	151.9	-173.5	-76.6	-161	164.6	-171.1	0	113.6
43	L	28	Very low	27.2	Very low	129 Å²	129	151 Å²	151	68%	0.675	75%	0.752	S	S	*	*			cis	-145.5	179.2	-24.8	-90.4	173.9	0	0	0	106.2
44	L	26.9	Very low	27.2	Very low	160 Å²	160	152.2 Å²	152.2	84%	0.838	77%	0.77	S	S	*	*			cis	74.8	139.4	27.4	-108.6	67.4	0	0	0	116.1
45	G	27.5	Very low	27.2	Very low	68 Å²	68	145 Å²	145	70%	0.701	77%	0.766	S	S	*	*			cis	-170.1	155.4	-8.7	0	0	0	0	0	108.4
46	K	27.9	Very low	27.5	Very low	180 Å²	180	150.9 Å²	150.9	78%	0.783	77%	0.774	S	S	*	*			cis	97.4	147	46.3	-154.2	-154.8	176.3	-157.6	0	112.4
47	M	27.1	Very low	27.7	Very low	143 Å²	143	151 Å²	151	70%	0.704	78%	0.777	S	S	*	*			trans	90.6	147.7	162.1	-57.3	174.9	110.5	0	0	117.1
48	H	26.9	Very low	27.8	Very low	126 Å²	126	147.8 Å²	147.8	58%	0.583	78%	0.777	S	S	*	*			cis	-153.4	-168	-10.6	-123.8	-69.8	0	0	0	113.1
49	E	27.6	Very low	27.7	Very low	146 Å²	146	143.8 Å²	143.8	68%	0.682	77%	0.772	S	S	*	*			trans	-68.9	-166.6	-172.7	-71.1	139	-177.2	0	0	115.6
50	E	27.1	Very low	27.8	Very low	155 Å²	155	139.6 Å²	139.6	72%	0.724	76%	0.763	S	S	*	*			cis	-169.3	163	32.5	-152.6	156.4	-142.3	0	0	113.8
51	E	28.8	Very low	28	Very low	180 Å²	180	136 Å²	136	84%	0.841	76%	0.758	S	S	*	*			trans	23.6	151.1	159.5	-70.7	175.8	170.5	0	0	123.4
52	D	26.1	Very low	27.9	Very low	164 Å²	164	131 Å²	131	88%	0.877	75%	0.748	S	S	*	*			cis	-162.9	-157.7	-21.8	-160.7	30.9	0	0	0	106.5
53	G	25.4	Very low	27.7	Very low	44 Å²	44	132.9 Å²	132.9	45%	0.454	75%	0.75	S	S	.	*			cis	173.5	164.6	3.9	0	0	0	0	0	115.1
54	S	26.4	Very low	27.7	Very low	132 Å²	132	133.1 Å²	133.1	92%	0.923	75%	0.752	S	S	*	*			trans	65.2	149.7	179.5	76.7	0	0	0	0	117.7
55	G	25.6	Very low	27.7	Very low	75 Å²	75	133.2 Å²	133.2	77%	0.773	75%	0.748	S	S	*	*			cis	-157.5	178.5	0.6	0	0	0	0	0	112.9
56	E	32.2	Very low	27.6	Very low	195 Å²	195	134.2 Å²	134.2	91%	0.911	74%	0.744	S	S	*	*			trans	-102.3	164.6	-154.2	-49.9	176.9	106.7	0	0	118.1
57	S	27.7	Very low	27.5	Very low	113 Å²	113	134.2 Å²	134.2	79%	0.79	74%	0.744	S	S	*	*				-173	132.8	114.7	41.2	0	0	0	0	115.2
58	S	28.5	Very low	27.6	Very low	113 Å²	113	135.9 Å²	135.9	79%	0.79	75%	0.748	S	S	*	*			trans	55.3	134.2	150.1	171.9	0	0	0	0	120.7
59	C	25	Very low	27.5	Very low	107 Å²	107	134.8 Å²	134.8	72%	0.723	75%	0.754	S	S	*	*			cis	-176.7	169.3	-5.2	-98.8	0	0	0	0	106
60	T	29.7	Very low	27.4	Very low	115 Å²	115	135.5 Å²	135.5	71%	0.706	76%	0.761	S	S	*	*			cis	-161	126.6	0.5	10.5	0	0	0	0	106.7
61	V	30.8	Very low	27.4	Very low	130 Å²	130	134.9 Å²	134.9	79%	0.788	76%	0.763	S	S	*	*				76.3	132.2	92.7	169.1	0	0	0	0	116.2
62	S	29.4	Very low	27.3	Very low	92 Å²	92	133.5 Å²	133.5	64%	0.643	77%	0.767	S	S	*	*			cis	-177.4	174.2	-17.8	-84.9	0	0	0	0	112
63	R	28.2	Very low	27.4	Very low	224 Å²	224	129.8 Å²	129.8	85%	0.845	76%	0.759	S	S	*	*			trans	100.7	125.7	149.2	-57.4	-141.8	160.3	144.5	-0.9	117.7
64	L	27.2	Very low	27.7	Very low	134 Å²	134	136.6 Å²	136.6	70%	0.702	78%	0.779	S	S	*	*			cis	90.5	144.7	41.2	-71.5	170.3	0	0	0	112.9
65	Q	25.7	Very low	27.8	Very low	162 Å²	162	137.4 Å²	137.4	76%	0.757	78%	0.778	S	S	*	*			cis	-174.3	147.6	-22.5	-149.8	-178.3	17.3	0	0	111.8
66	S	26.4	Very low	28.1	Very low	89 Å²	89	142.9 Å²	142.9	62%	0.622	78%	0.783	S	S	*	*			trans	76.5	148.8	145.2	78	0	0	0	0	126.3
67	F	25.9	Very low	28.1	Very low	179 Å²	179	137.7 Å²	137.7	79%	0.785	78%	0.782	S	S	*	*			trans	85.7	124	142.7	-72.6	-51.8	0	0	0	127.2
68	K	28.2	Very low	28.1	Very low	179 Å²	179	137 Å²	137	78%	0.778	78%	0.783	S	S	*	*			trans	70.5	103.5	135.1	-74.4	175.2	178.6	179.7	0	124.7
69	S	25.4	Very low	28.2	Very low	102 Å²	102	141.2 Å²	141.2	71%	0.713	79%	0.787	S	S	*	*				25.1	126.5	115.6	-169	0	0	0	0	122.4
70	L	25	Very low	28.5	Very low	161 Å²	161	145.5 Å²	145.5	84%	0.843	80%	0.797	S	S	*	*				-168.7	171.3	106.7	-129.8	91.1	0	0	0	112.8
71	D	27.1	Very low	28.7	Very low	142 Å²	142	147.8 Å²	147.8	76%	0.759	80%	0.799	S	S	*	*			trans	-88.6	166.2	-175.3	-53.3	-86.2	0	0	0	116.4
72	V	27.9	Very low	29.2	Very low	151 Å²	151	145.9 Å²	145.9	92%	0.915	80%	0.797	S	S	*	*				173.1	163.3	125.8	153.6	0	0	0	0	110.8
73	A	28.1	Very low	30.3	Very low	86 Å²	86	147.1 Å²	147.1	71%	0.711	81%	0.806	S	S	*	*			trans	-104.9	-177.1	-158	0	0	0	0	0	117.2
74	E	31.3	Very low	32.4	Very low	188 Å²	188	143.2 Å²	143.2	88%	0.879	80%	0.795	S	S	*	*			trans	64.5	110.7	162.6	-64.9	-173.4	162.3	0	0	120.8
75	V	29.7	Very low	35.4	Very low	149 Å²	149	137.3 Å²	137.3	90%	0.903	76%	0.764	S	S	*	*				-150.3	135.8	127.4	167.5	0	0	0	0	108.2
76	E	30.6	Very low	38.6	Very low	190 Å²	190	132.3 Å²	132.3	89%	0.888	75%	0.746	S	S	*	*			trans	-79.4	159	173.7	-64.1	-172.1	113.9	0	0	113.6
77	G	32.5	Very low	41.7	Very low	85 Å²	85	128.7 Å²	128.7	88%	0.876	72%	0.723	S	S	*	*			trans	95.3	55.6	143.6	0	0	0	0	0	118.7
78	A	28.6	Very low	44.8	Very low	98 Å²	98	125.2 Å²	125.2	81%	0.81	71%	0.705	S	S	*	*			trans	-118.7	117.8	158.8	0	0	0	0	0	110.7	E80	A78-E80 PolarHBondContact O-N 3.49Å
79	K	29.9	Very low	47.9	Very low	203 Å²	203	116.7 Å²	116.7	88%	0.883	67%	0.668	S	S	*	*			trans	-68.6	127.8	169.9	-68.9	179.2	179.1	178	0	108.8	Q81	K79-Q81 PolarHBondContact O-N 3.43Å
80	E	30.1	Very low	51.1	Low	197 Å²	197	114.1 Å²	114.1	92%	0.921	65%	0.647	S	S	*	*			trans	-59.8	102.7	171.7	-67.4	-174.3	124.6	0	0	110.2	A78 A82	A78-E80 PolarHBondContact O-N 3.49Å; E80-A82 PolarHBondContact O-N 3.39Å
81	Q	35.7	Very low	54.3	Low	162 Å²	162	107.6 Å²	107.6	76%	0.757	61%	0.611	S	S	*	*			trans	-74.3	112.9	163	-71.1	-171.2	0.7	0	0	107.1	K79 S83	K79-Q81 PolarHBondContact O-N 3.43Å; Q81-S83 PolarHBondContact O-N 3.28Å
82	A	40.2	Very low	57.2	Low	90 Å²	90	102.2 Å²	102.2	74%	0.744	58%	0.582	S	S	*	*			trans	-45.3	129.6	177.3	0	0	0	0	0	110.9	E80 K84	E80-A82 PolarHBondContact O-N 3.39Å; A82-K84 PolarHBondContact O-N 3.41Å
83	S	52.5	Low	59.7	Low	119 Å²	119	96.2 Å²	96.2	83%	0.832	55%	0.547	S	S	*	.			trans	-55.7	110.4	-173.9	46.8	0	0	0	0	110.8	Q81 L85	Q81-S83 PolarHBondContact O-N 3.28Å; S83-L85 PolarHBondContact O-N 3.27Å
84	K	73.3	Confident	61.8	Low	142 Å²	142	94.3 Å²	94.3	62%	0.617	54%	0.536	S	S	*	.			trans	-65.3	126.6	179	-66.6	174.8	-176.5	167.1	0	109.2	A82 C86	A82-K84 PolarHBondContact O-N 3.41Å; K84-C86 PolarHBondContact O-N 3.02Å; K84-C86 PolarHBondContact O-SG 3.23Å; K84-C86 VanDerWaalsContact O-SG 3.41Å
85	L	90.1	Very high	63.1	Low	9 Å²	9	94.8 Å²	94.8	5%	0.047	54%	0.535	C	S	.	.			trans	-60.9	108.6	173.7	177.9	68.5	0	0	0	109.8	S83 Y108 Y169 W170 E173 L174	S83-L85 PolarHBondContact O-N 3.27Å; L85-Y108 PolarHBondContact O-N 3.14Å; L85-Y169 HydrophobicContact CD1-CE1 4.04Å; L85-W170 HydrophobicContact CD1-CE3 4.11Å; L85-W170 HydrophobicContact CD1-CH2 4.29Å; L85-W170 HydrophobicContact CD1-CZ3 3.98Å; L85-W170 HydrophobicContact CD2-CE3 4.09Å; L85-W170 HydrophobicContact CD2-CZ3 3.82Å; L85-W170 HydrophobicContact CG-CE3 4.16Å; L85-W170 HydrophobicContact CG-CH2 4.09Å; L85-W170 HydrophobicContact CG-CZ3 3.64Å; L85-E173 HydrophobicContact CD1-CB 3.77Å; L85-E173 HydrophobicContact CD1-CG 4.05Å; L85-E173 HydrophobicContact CD2-CB 3.83Å; L85-E173 HydrophobicContact CG-CB 4.41Å; L85-L174 HydrophobicContact CD2-CD2 3.72Å; L85-L174 HydrophobicContact CD2-CG 4.13Å
86	C	91.5	Very high	64.3	Low	58 Å²	58	90.4 Å²	90.4	39%	0.392	52%	0.52	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.5	156.5	177.7	63.1	0	0	0	0	111.9	K84 W105 F106 V107	K84-C86 PolarHBondContact O-N 3.02Å; K84-C86 PolarHBondContact O-SG 3.23Å; K84-C86 VanDerWaalsContact O-SG 3.41Å; C86-W105 HydrophobicContact CB-CH2 4.33Å; C86-W105 HydrophobicContact CB-CZ2 3.68Å; C86-F106 CarbonylContact C-O 3.58Å; C86-F106 WeakPolarHBondContact CA-O 3.36Å; C86-F106 VanDerWaalsContact CB-O 3.28Å; C86-F106 WeakPolarHBondContact CB-O 3.28Å; C86-V107 HydrophobicContact CB-CB 4.42Å; C86-V107 HydrophobicContact CB-CG1 4.41Å; C86-V107 HydrophobicContact CB-CG2 4.04Å
87	G	91.6	Very high	65.1	Low	12 Å²	12	88 Å²	88	12%	0.124	52%	0.521	C	S	.	.	E	Extended strand (participates in β ladder)	trans	166.3	178.9	179.8	0	0	0	0	0	112.9	W105 F106	G87-W105 VanDerWaalsContact C-CE3 3.45Å; G87-W105 VanDerWaalsContact CA-CZ3 3.4Å; G87-F106 PolarHBondContact N-O 2.82Å; G87-F106 PolarHBondContact O-N 3.31Å
88	Y	91.9	Very high	66.3	Low	106 Å²	106	90.9 Å²	90.9	42%	0.416	52%	0.515	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.7	135.9	175.6	-70.9	-76.2	0	0	0	112.2	L103 R104 W105 P121	Y88-L103 HydrophobicContact CD1-CD2 4.01Å; Y88-L103 HydrophobicContact CD1-CG 3.95Å; Y88-L103 HydrophobicContact CG-CD2 4.33Å; Y88-L103 HydrophobicContact CG-CG 4.39Å; Y88-R104 WeakPolarHBondContact CA-O 3.48Å; Y88-W105 HydrophobicContact CD1-CB 4.16Å; Y88-W105 AromaticContact CD1-CE3 3.91Å; Y88-W105 HydrophobicContact CD1-CE3 3.91Å; Y88-W105 AromaticContact CD2-CE3 3.6Å; Y88-W105 HydrophobicContact CD2-CE3 3.6Å; Y88-W105 AromaticContact CD2-CZ3 3.72Å; Y88-W105 HydrophobicContact CD2-CZ3 3.72Å; Y88-W105 HydrophobicContact CE1-CB 3.93Å; Y88-W105 AromaticContact CE1-CE3 3.87Å; Y88-W105 HydrophobicContact CE1-CE3 3.87Å; Y88-W105 AromaticContact CE2-CE3 3.56Å; Y88-W105 HydrophobicContact CE2-CE3 3.56Å; Y88-W105 AromaticContact CE2-CZ3 3.73Å; Y88-W105 HydrophobicContact CE2-CZ3 3.73Å; Y88-W105 AromaticContact CG-CE3 3.78Å; Y88-W105 HydrophobicContact CG-CE3 3.78Å; Y88-W105 HydrophobicContact CG-CZ3 4.29Å; Y88-W105 AromaticContact CZ-CE3 3.71Å; Y88-P121 WeakPolarHBondContact OH-CD 3.29Å; Y88-P121 WeakPolarHBondContact OH-CG 3.5Å
89	L	92.9	Very high	68.6	Low	1 Å²	1	94 Å²	94	1%	0.005	51%	0.506	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137	152.5	168.1	-65.5	169.7	0	0	0	109.9	R104 F106 F148 L159 A161 W170	L89-R104 PolarHBondContact N-O 3.07Å; L89-R104 PolarHBondContact O-N 3.17Å; L89-F106 HydrophobicContact CB-CD2 3.77Å; L89-F106 HydrophobicContact CB-CE2 3.62Å; L89-F106 HydrophobicContact CB-CZ 4.5Å; L89-F106 HydrophobicContact CD1-CD2 4.22Å; L89-F106 HydrophobicContact CD1-CE2 4.45Å; L89-F106 HydrophobicContact CD1-CG 4.48Å; L89-F106 HydrophobicContact CG-CD2 4.29Å; L89-F148 HydrophobicContact CD1-CE1 4.46Å; L89-F148 HydrophobicContact CD1-CZ 3.88Å; L89-F148 HydrophobicContact CD2-CE1 4.31Å; L89-F148 HydrophobicContact CD2-CZ 4.47Å; L89-L159 HydrophobicContact CD1-CD1 4.17Å; L89-A161 HydrophobicContact CD2-CB 3.83Å; L89-W170 HydrophobicContact CD1-CD2 3.87Å; L89-W170 HydrophobicContact CD1-CE3 4.26Å; L89-W170 HydrophobicContact CD1-CG 4.15Å; L89-W170 HydrophobicContact CD1-CZ2 4.3Å; L89-W170 HydrophobicContact CD2-CG 4.31Å; L89-W170 HydrophobicContact CG-CD2 4.49Å; L89-W170 HydrophobicContact CG-CZ2 4.45Å
90	N	92.3	Very high	71	Confident	48 Å²	48	85.7 Å²	85.7	26%	0.257	48%	0.478	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85	115.2	174.2	-74.7	-62.5	0	0	0	110.2	Y101 L103 L159 K160	N90-Y101 HydrophobicContact CB-CD1 3.95Å; N90-Y101 HydrophobicContact CB-CG 4.37Å; N90-L103 WeakPolarHBondContact OD1-CA 3.47Å; N90-L103 WeakPolarHBondContact OD1-CD1 3.46Å; N90-L103 PolarHBondContact OD1-N 3.49Å; N90-L159 CarbonylContact O-C 3.58Å; N90-L159 VanDerWaalsContact O-CA 3.32Å; N90-L159 WeakPolarHBondContact O-CA 3.3Å; N90-K160 HydrophobicContact CB-CB 4.25Å; N90-K160 WeakPolarHBondContact CB-O 3.32Å; N90-K160 PolarHBondContact N-O 2.94Å; N90-K160 PolarHBondContact O-N 3.19Å
91	K	92.7	Very high	73.8	Confident	23 Å²	23	79.9 Å²	79.9	10%	0.1	45%	0.448	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	123.9	178.9	-172.6	-170.7	-176.6	-53.6	0	111.2	S93 K102 R104 F106 Y117 L159	K91-S93 PolarHBondContact O-N 3.34Å; K91-S93 PolarHBondContact O-OG 3.2Å; K91-K102 PolarHBondContact N-O 2.93Å; K91-K102 PolarHBondContact O-N 3.03Å; K91-R104 HydrophobicContact CB-CG 4.05Å; K91-F106 HydrophobicContact CB-CZ 4.12Å; K91-F106 HydrophobicContact CD-CZ 4.48Å; K91-F106 HydrophobicContact CG-CZ 4.46Å; K91-Y117 HydrophobicContact CD-CD2 4.27Å; K91-Y117 HydrophobicContact CD-CE1 4.33Å; K91-Y117 HydrophobicContact CD-CE2 4.09Å; K91-L159 HydrophobicContact CB-CD2 3.88Å; K91-L159 HydrophobicContact CG-CD2 3.73Å
92	L	88.5	Confident	76.4	Confident	29 Å²	29	76.9 Å²	76.9	15%	0.152	43%	0.433	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.9	125.3	173.5	-166.4	55.6	0	0	0	110.4	R99 Y101 L158	L92-R99 HydrophobicContact CD1-CG 3.9Å; L92-R99 HydrophobicContact CD2-CG 4.11Å; L92-R99 HydrophobicContact CG-CG 3.86Å; L92-Y101 HydrophobicContact CB-CD1 4.07Å; L92-Y101 HydrophobicContact CB-CE1 3.78Å; L92-Y101 HydrophobicContact CD1-CD1 4.31Å; L92-Y101 HydrophobicContact CD1-CD2 4.28Å; L92-Y101 HydrophobicContact CD1-CE1 4.38Å; L92-Y101 HydrophobicContact CD1-CE2 4.38Å; L92-Y101 HydrophobicContact CD1-CG 4.24Å; L92-L158 HydrophobicContact CB-CB 4.18Å; L92-L158 WeakPolarHBondContact CB-O 3.45Å; L92-L158 HydrophobicContact CD2-CB 4.18Å; L92-L158 HydrophobicContact CD2-CD2 3.8Å; L92-L158 PolarHBondContact N-O 3.13Å
93	S	80.8	Confident	78.9	Confident	26 Å²	26	76.9 Å²	76.9	18%	0.182	42%	0.419	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.9	102.9	-165.3	-60.4	0	0	0	0	113.2	K91 G100 K102	K91-S93 PolarHBondContact O-N 3.34Å; K91-S93 PolarHBondContact O-OG 3.2Å; S93-G100 PolarHBondContact N-O 3.12Å; S93-K102 WeakPolarHBondContact O-CE 3.47Å
94	G	71.4	Confident	80.8	Confident	45 Å²	45	73.5 Å²	73.5	46%	0.464	39%	0.388	S	S	.	.			trans	167.4	173.9	173.4	0	0	0	0	0	111.9
95	K	57.7	Low	81.8	Confident	199 Å²	199	69.2 Å²	69.2	87%	0.865	37%	0.369	S	S	*	.	S	Bend	trans	-124.7	144.4	167.5	-70.9	-170.1	177.3	-172.9	0	108.7
96	G	55.8	Low	82	Confident	57 Å²	57	68.8 Å²	68.8	59%	0.588	37%	0.366	S	S	*	.	G	3₁₀ helix	trans	61.8	-150.7	-177	0	0	0	0	0	113	L98 R99	G96-L98 PolarHBondContact O-N 3.07Å; G96-R99 WeakPolarHBondContact O-CB 3.48Å; G96-R99 PolarHBondContact O-N 3.31Å
97	P	47.9	Very low	82.1	Confident	140 Å²	140	67.9 Å²	67.9	91%	0.909	36%	0.359	S	S	*	.	G	3₁₀ helix	trans	-68.6	1.2	-173.3	28.2	-35.8	0	0	0	115.2
98	L	57.7	Low	82.2	Confident	145 Å²	145	67.8 Å²	67.8	76%	0.759	36%	0.355	S	S	*	.	G	3₁₀ helix	trans	-99.5	23.1	174.2	-60.2	176.2	0	0	0	112.6	G96 G100	G96-L98 PolarHBondContact O-N 3.07Å; L98-G100 PolarHBondContact O-N 3.48Å
99	R	75.8	Confident	82.1	Confident	163 Å²	163	64.7 Å²	64.7	62%	0.615	35%	0.345	S	S	*	.			trans	-79.5	100.3	178.6	-167.4	-176.7	-168.3	-165.3	2.6	110	L92 G96	L92-R99 HydrophobicContact CD1-CG 3.9Å; L92-R99 HydrophobicContact CD2-CG 4.11Å; L92-R99 HydrophobicContact CG-CG 3.86Å; G96-R99 WeakPolarHBondContact O-CB 3.48Å; G96-R99 PolarHBondContact O-N 3.31Å
100	G	81.1	Confident	81.6	Confident	28 Å²	28	68.5 Å²	68.5	29%	0.289	37%	0.37	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.1	154.2	-179.8	0	0	0	0	0	113.6	S93 L98	S93-G100 PolarHBondContact N-O 3.12Å; L98-G100 PolarHBondContact O-N 3.48Å
101	Y	88.6	Confident	81	Confident	76 Å²	76	76.7 Å²	76.7	30%	0.298	40%	0.397	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.4	137	174.1	-82.4	-66.6	0	0	0	111.3	N90 L92 Q147 L158 K160	N90-Y101 HydrophobicContact CB-CD1 3.95Å; N90-Y101 HydrophobicContact CB-CG 4.37Å; L92-Y101 HydrophobicContact CB-CD1 4.07Å; L92-Y101 HydrophobicContact CB-CE1 3.78Å; L92-Y101 HydrophobicContact CD1-CD1 4.31Å; L92-Y101 HydrophobicContact CD1-CD2 4.28Å; L92-Y101 HydrophobicContact CD1-CE1 4.38Å; L92-Y101 HydrophobicContact CD1-CE2 4.38Å; L92-Y101 HydrophobicContact CD1-CG 4.24Å; Y101-Q147 PolarHBondContact OH-OE1 3.12Å; Y101-L158 WeakPolarHBondContact OH-CD2 3.32Å; Y101-K160 HydrophobicContact CD1-CB 4.33Å; Y101-K160 HydrophobicContact CE1-CB 3.87Å; Y101-K160 HydrophobicContact CE2-CD 4.46Å
102	K	90.1	Very high	80.6	Confident	99 Å²	99	80.3 Å²	80.3	43%	0.43	41%	0.413	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.1	125	177.2	-56.3	-173.1	-173.4	-176.2	0	109.3	K91 S93 R104	K91-K102 PolarHBondContact N-O 2.93Å; K91-K102 PolarHBondContact O-N 3.03Å; S93-K102 WeakPolarHBondContact O-CE 3.47Å; K102-R104 PolarHBondContact O-N 3.47Å
103	L	92.4	Very high	80.6	Confident	89 Å²	89	79 Å²	79	47%	0.466	41%	0.406	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-60	133	177.7	-162.8	71.1	0	0	0	110.3	Y88 N90	Y88-L103 HydrophobicContact CD1-CD2 4.01Å; Y88-L103 HydrophobicContact CD1-CG 3.95Å; Y88-L103 HydrophobicContact CG-CD2 4.33Å; Y88-L103 HydrophobicContact CG-CG 4.39Å; N90-L103 WeakPolarHBondContact OD1-CA 3.47Å; N90-L103 WeakPolarHBondContact OD1-CD1 3.46Å; N90-L103 PolarHBondContact OD1-N 3.49Å
104	R	93.4	Very high	81.2	Confident	48 Å²	48	80.6 Å²	80.6	18%	0.181	41%	0.409	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.5	145.8	178.8	-66.8	-65.7	176.3	-102.4	8.7	109.8	Y88 L89 K91 K102 F106 F118	Y88-R104 WeakPolarHBondContact CA-O 3.48Å; L89-R104 PolarHBondContact N-O 3.07Å; L89-R104 PolarHBondContact O-N 3.17Å; K91-R104 HydrophobicContact CB-CG 4.05Å; K102-R104 PolarHBondContact O-N 3.47Å; R104-F106 HydrophobicContact CB-CD2 4.17Å; R104-F106 HydrophobicContact CB-CE2 3.64Å; R104-F106 HydrophobicContact CB-CZ 4.29Å; R104-F106 WeakPolarHBondContact O-CD2 3.43Å; R104-F118 WeakPolarHBondContact CA-O 3.45Å; R104-F118 WeakPolarHBondContact CD-O 3.38Å
105	W	93.1	Very high	82.3	Confident	53 Å²	53	78.5 Å²	78.5	20%	0.201	39%	0.387	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.6	125.4	170.7	-179.5	-106	0	0	0	108.7	C86 G87 Y88 Y117 F118 P121	C86-W105 HydrophobicContact CB-CH2 4.33Å; C86-W105 HydrophobicContact CB-CZ2 3.68Å; G87-W105 VanDerWaalsContact C-CE3 3.45Å; G87-W105 VanDerWaalsContact CA-CZ3 3.4Å; Y88-W105 HydrophobicContact CD1-CB 4.16Å; Y88-W105 AromaticContact CD1-CE3 3.91Å; Y88-W105 HydrophobicContact CD1-CE3 3.91Å; Y88-W105 AromaticContact CD2-CE3 3.6Å; Y88-W105 HydrophobicContact CD2-CE3 3.6Å; Y88-W105 AromaticContact CD2-CZ3 3.72Å; Y88-W105 HydrophobicContact CD2-CZ3 3.72Å; Y88-W105 HydrophobicContact CE1-CB 3.93Å; Y88-W105 AromaticContact CE1-CE3 3.87Å; Y88-W105 HydrophobicContact CE1-CE3 3.87Å; Y88-W105 AromaticContact CE2-CE3 3.56Å; Y88-W105 HydrophobicContact CE2-CE3 3.56Å; Y88-W105 AromaticContact CE2-CZ3 3.73Å; Y88-W105 HydrophobicContact CE2-CZ3 3.73Å; Y88-W105 AromaticContact CG-CE3 3.78Å; Y88-W105 HydrophobicContact CG-CE3 3.78Å; Y88-W105 HydrophobicContact CG-CZ3 4.29Å; Y88-W105 AromaticContact CZ-CE3 3.71Å; W105-Y117 CarbonylContact O-C 3.54Å; W105-Y117 VanDerWaalsContact O-CA 3.27Å; W105-Y117 WeakPolarHBondContact O-CA 3.4Å; W105-F118 HydrophobicContact CB-CB 4.44Å; W105-F118 PolarHBondContact N-O 3.29Å; W105-F118 VanDerWaalsContact N-O 3.12Å; W105-F118 PolarHBondContact O-N 3.39Å; W105-P121 HydrophobicContact CD2-CB 3.87Å; W105-P121 HydrophobicContact CD2-CG 4.37Å; W105-P121 HydrophobicContact CG-CB 3.83Å; W105-P121 HydrophobicContact CG-CG 4.44Å; W105-P121 HydrophobicContact CZ2-CB 4.48Å
106	F	94.7	Very high	84	Confident	0 Å²	0	71.1 Å²	71.1	0%	0	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	142.2	179.6	-73	-100.1	0	0	0	110.3	C86 G87 L89 K91 R104 L115 Y116 Y117 I130 L159 W170	C86-F106 CarbonylContact C-O 3.58Å; C86-F106 WeakPolarHBondContact CA-O 3.36Å; C86-F106 VanDerWaalsContact CB-O 3.28Å; C86-F106 WeakPolarHBondContact CB-O 3.28Å; G87-F106 PolarHBondContact N-O 2.82Å; G87-F106 PolarHBondContact O-N 3.31Å; L89-F106 HydrophobicContact CB-CD2 3.77Å; L89-F106 HydrophobicContact CB-CE2 3.62Å; L89-F106 HydrophobicContact CB-CZ 4.5Å; L89-F106 HydrophobicContact CD1-CD2 4.22Å; L89-F106 HydrophobicContact CD1-CE2 4.45Å; L89-F106 HydrophobicContact CD1-CG 4.48Å; L89-F106 HydrophobicContact CG-CD2 4.29Å; K91-F106 HydrophobicContact CB-CZ 4.12Å; K91-F106 HydrophobicContact CD-CZ 4.48Å; K91-F106 HydrophobicContact CG-CZ 4.46Å; R104-F106 HydrophobicContact CB-CD2 4.17Å; R104-F106 HydrophobicContact CB-CE2 3.64Å; R104-F106 HydrophobicContact CB-CZ 4.29Å; R104-F106 WeakPolarHBondContact O-CD2 3.43Å; F106-L115 HydrophobicContact CB-CD1 4.22Å; F106-L115 HydrophobicContact CB-CG 4.45Å; F106-L115 HydrophobicContact CD1-CD2 3.73Å; F106-L115 HydrophobicContact CD1-CG 3.87Å; F106-L115 HydrophobicContact CE1-CD2 4.33Å; F106-Y116 CarbonylContact C-O 3.58Å; F106-Y116 VanDerWaalsContact CA-O 3.31Å; F106-Y116 WeakPolarHBondContact CA-O 3.33Å; F106-Y117 HydrophobicContact CE1-CD1 4.02Å; F106-Y117 HydrophobicContact CE1-CG 4.09Å; F106-Y117 HydrophobicContact CZ-CG 4.43Å; F106-I130 HydrophobicContact CE1-CD1 4.26Å; F106-L159 HydrophobicContact CE1-CD1 4.39Å; F106-L159 HydrophobicContact CE1-CD2 4.32Å; F106-L159 HydrophobicContact CZ-CD1 4.36Å; F106-L159 HydrophobicContact CZ-CD2 3.69Å; F106-W170 HydrophobicContact CB-CH2 3.93Å
107	V	93.1	Very high	85.8	Confident	39 Å²	39	70 Å²	70	24%	0.236	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.3	128.1	176.7	-173.7	0	0	0	0	109.5	C86 Y116 F118	C86-V107 HydrophobicContact CB-CB 4.42Å; C86-V107 HydrophobicContact CB-CG1 4.41Å; C86-V107 HydrophobicContact CB-CG2 4.04Å; V107-Y116 PolarHBondContact N-O 3.33Å; V107-Y116 PolarHBondContact O-N 3.04Å; V107-F118 HydrophobicContact CB-CE2 4.25Å; V107-F118 HydrophobicContact CG2-CD2 4.37Å; V107-F118 HydrophobicContact CG2-CE2 4.02Å
108	Y	93.6	Very high	87.9	Confident	10 Å²	10	64.8 Å²	64.8	4%	0.039	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.7	130.6	176.1	-179.8	-102.1	0	0	0	112.1	L85 P110 C113 I132 L174 K177	L85-Y108 PolarHBondContact O-N 3.14Å; Y108-P110 HydrophobicContact CD1-CB 4.42Å; Y108-P110 VanDerWaalsContact CE1-CA 3.47Å; Y108-P110 HydrophobicContact CE1-CB 3.8Å; Y108-C113 HydrophobicContact CE2-CB 4.46Å; Y108-C113 PolarHBondContact OH-SG 3Å; Y108-I132 HydrophobicContact CE2-CB 4.41Å; Y108-L174 HydrophobicContact CD2-CD2 4.45Å; Y108-K177 HydrophobicContact CD1-CB 4.36Å; Y108-K177 HydrophobicContact CD1-CD 4.14Å; Y108-K177 HydrophobicContact CD1-CG 4.38Å; Y108-K177 HydrophobicContact CE1-CB 3.75Å; Y108-K177 HydrophobicContact CE1-CD 3.81Å; Y108-K177 HydrophobicContact CE1-CG 4.11Å; Y108-K177 HydrophobicContact CE2-CB 4.15Å; Y108-K177 PolarHBondContact OH-O 3.35Å
109	D	89.9	Confident	89.4	Confident	40 Å²	40	64.7 Å²	64.7	21%	0.214	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	106.1	170	-179.9	9.1	0	0	0	110.9	R111 K112 C113 Y114 Y116	D109-R111 PolarHBondContact O-N 3.41Å; D109-R111 VanDerWaalsContact OD1-CB 3.32Å; D109-R111 WeakPolarHBondContact OD1-CB 3.35Å; D109-R111 PolarHBondContact OD1-N 3.15Å; D109-K112 PolarHBondContact O-N 3.43Å; D109-C113 WeakPolarHBondContact O-CA 3.5Å; D109-C113 PolarHBondContact O-N 3.43Å; D109-Y114 PolarHBondContact N-O 3.47Å; D109-Y114 PolarHBondContact O-N 2.96Å; D109-Y116 HydrophobicContact CB-CD2 3.99Å; D109-Y116 HydrophobicContact CB-CE2 3.78Å
110	P	82.4	Confident	89.7	Confident	82 Å²	82	59.1 Å²	59.1	53%	0.532	27%	0.273	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.2	-16.1	179	27.8	-35.1	0	0	0	113.7	Y108 K112	Y108-P110 HydrophobicContact CD1-CB 4.42Å; Y108-P110 VanDerWaalsContact CE1-CA 3.47Å; Y108-P110 HydrophobicContact CE1-CB 3.8Å; P110-K112 VanDerWaalsContact C-N 3.27Å; P110-K112 PolarHBondContact O-N 3.04Å
111	R	80.8	Confident	89.9	Confident	219 Å²	219	60.3 Å²	60.3	83%	0.826	28%	0.276	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.4	-17.3	179.6	-63	-178.3	170.2	-170.3	-3.5	113.4	D109	D109-R111 PolarHBondContact O-N 3.41Å; D109-R111 VanDerWaalsContact OD1-CB 3.32Å; D109-R111 WeakPolarHBondContact OD1-CB 3.35Å; D109-R111 PolarHBondContact OD1-N 3.15Å
112	K	82.7	Confident	89.6	Confident	100 Å²	100	64.1 Å²	64.1	44%	0.435	30%	0.296	S	S	.	.	T	Hydrogen-bonded Turn	trans	-131.3	-8	-177.9	-63.5	-179.5	-177.5	174.1	0	113.7	D109 P110 Y114 Y181	D109-K112 PolarHBondContact O-N 3.43Å; P110-K112 VanDerWaalsContact C-N 3.27Å; P110-K112 PolarHBondContact O-N 3.04Å; K112-Y114 HydrophobicContact CB-CD1 3.86Å; K112-Y114 HydrophobicContact CB-CD2 4.21Å; K112-Y114 HydrophobicContact CB-CE1 4.29Å; K112-Y114 HydrophobicContact CB-CG 3.8Å; K112-Y114 HydrophobicContact CD-CD2 4.2Å; K112-Y114 HydrophobicContact CD-CE2 4.43Å; K112-Y114 WeakPolarHBondContact O-CD1 3.38Å; K112-Y114 WeakPolarHBondContact O-CE1 3.33Å; K112-Y114 PolarHBondContact O-N 2.96Å; K112-Y181 PolarHBondContact O-OH 3.29Å
113	C	90.5	Very high	89.4	Confident	0 Å²	0	61.8 Å²	61.8	0%	0	29%	0.288	C	S	.	.	T	Hydrogen-bonded Turn	trans	56.9	35.1	-164.6	-150.1	0	0	0	0	113.1	Y108 D109 I132 Y181	Y108-C113 HydrophobicContact CE2-CB 4.46Å; Y108-C113 PolarHBondContact OH-SG 3Å; D109-C113 WeakPolarHBondContact O-CA 3.5Å; D109-C113 PolarHBondContact O-N 3.43Å; C113-I132 VanDerWaalsContact O-CB 3.24Å; C113-I132 WeakPolarHBondContact O-CB 3.36Å; C113-I132 PolarHBondContact O-N 3.43Å; C113-Y181 HydrophobicContact CB-CD1 3.37Å; C113-Y181 HydrophobicContact CB-CD2 3.86Å; C113-Y181 HydrophobicContact CB-CE1 3.56Å; C113-Y181 HydrophobicContact CB-CE2 4.06Å; C113-Y181 HydrophobicContact CB-CG 3.49Å; C113-Y181 VanDerWaalsContact CB-CG 3.49Å
114	Y	93.2	Very high	88.5	Confident	61 Å²	61	62.2 Å²	62.2	24%	0.239	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	124.2	-177.5	-78.3	15	0	0	0	109.9	D109 K112 Y116 H129 D131	D109-Y114 PolarHBondContact N-O 3.47Å; D109-Y114 PolarHBondContact O-N 2.96Å; K112-Y114 HydrophobicContact CB-CD1 3.86Å; K112-Y114 HydrophobicContact CB-CD2 4.21Å; K112-Y114 HydrophobicContact CB-CE1 4.29Å; K112-Y114 HydrophobicContact CB-CG 3.8Å; K112-Y114 HydrophobicContact CD-CD2 4.2Å; K112-Y114 HydrophobicContact CD-CE2 4.43Å; K112-Y114 WeakPolarHBondContact O-CD1 3.38Å; K112-Y114 WeakPolarHBondContact O-CE1 3.33Å; K112-Y114 PolarHBondContact O-N 2.96Å; Y114-Y116 HydrophobicContact CD2-CE1 4.47Å; Y114-Y116 HydrophobicContact CD2-CE2 4.4Å; Y114-Y116 AromaticContact CD2-CZ 3.93Å; Y114-Y116 PolarHBondContact O-N 2.94Å; Y114-H129 HydrophobicContact CD2-CB 4.09Å; Y114-H129 AromaticContact CD2-CD2 3.45Å; Y114-H129 VanDerWaalsContact CD2-CD2 3.45Å; Y114-H129 WeakPolarHBondContact CD2-CD2 3.27Å; Y114-H129 AromaticContact CD2-CG 3.78Å; Y114-H129 AromaticContact CE2-CD2 3.42Å; Y114-H129 VanDerWaalsContact CE2-CD2 3.42Å; Y114-H129 WeakPolarHBondContact CE2-CD2 3.49Å; Y114-H129 AromaticContact CE2-NE2 3.58Å; Y114-H129 HydrophobicContact CG-CB 4.45Å; Y114-D131 HydrophobicContact CD1-CB 4.21Å; Y114-D131 HydrophobicContact CE1-CB 3.93Å; Y114-D131 VanDerWaalsContact CE1-CG 3.47Å; Y114-D131 WeakPolarHBondContact CE1-OD2 3.29Å
115	L	93.9	Very high	87.9	Confident	0 Å²	0	66.5 Å²	66.5	0%	0	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.5	96.4	168.9	-173.2	70.1	0	0	0	108.6	F106 H129 I130 I132 W170 L174	F106-L115 HydrophobicContact CB-CD1 4.22Å; F106-L115 HydrophobicContact CB-CG 4.45Å; F106-L115 HydrophobicContact CD1-CD2 3.73Å; F106-L115 HydrophobicContact CD1-CG 3.87Å; F106-L115 HydrophobicContact CE1-CD2 4.33Å; L115-H129 CarbonylContact O-C 3.57Å; L115-H129 WeakPolarHBondContact O-CA 3.39Å; L115-I130 HydrophobicContact CB-CB 4.41Å; L115-I130 PolarHBondContact N-O 3.25Å; L115-I130 PolarHBondContact O-N 3.5Å; L115-I132 HydrophobicContact CB-CD1 3.87Å; L115-I132 HydrophobicContact CB-CG1 3.63Å; L115-I132 HydrophobicContact CD2-CD1 4.32Å; L115-W170 HydrophobicContact CD1-CH2 4.5Å; L115-W170 HydrophobicContact CD1-CZ3 3.93Å; L115-L174 HydrophobicContact CD1-CD2 4.06Å; L115-L174 HydrophobicContact CD2-CD1 4.06Å; L115-L174 HydrophobicContact CD2-CD2 3.98Å; L115-L174 HydrophobicContact CG-CD2 4.42Å
116	Y	93.1	Very high	87.8	Confident	44 Å²	44	66.6 Å²	66.6	17%	0.173	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.7	147	177.3	-72.9	-78.2	0	0	0	111	F106 V107 D109 Y114 P126 H129	F106-Y116 CarbonylContact C-O 3.58Å; F106-Y116 VanDerWaalsContact CA-O 3.31Å; F106-Y116 WeakPolarHBondContact CA-O 3.33Å; V107-Y116 PolarHBondContact N-O 3.33Å; V107-Y116 PolarHBondContact O-N 3.04Å; D109-Y116 HydrophobicContact CB-CD2 3.99Å; D109-Y116 HydrophobicContact CB-CE2 3.78Å; Y114-Y116 HydrophobicContact CD2-CE1 4.47Å; Y114-Y116 HydrophobicContact CD2-CE2 4.4Å; Y114-Y116 AromaticContact CD2-CZ 3.93Å; Y114-Y116 PolarHBondContact O-N 2.94Å; Y116-P126 HydrophobicContact CD1-CB 3.76Å; Y116-P126 HydrophobicContact CD1-CG 3.67Å; Y116-P126 HydrophobicContact CE1-CG 4.07Å; Y116-P126 HydrophobicContact CG-CB 4.43Å; Y116-H129 HydrophobicContact CD1-CB 3.72Å; Y116-H129 HydrophobicContact CE1-CB 3.84Å; Y116-H129 HydrophobicContact CG-CB 4.36Å
117	Y	93.3	Very high	87.4	Confident	33 Å²	33	70.8 Å²	70.8	13%	0.129	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.8	141.9	174.8	63.5	-99.1	0	0	0	113.7	K91 W105 F106 P126 L127 G128 I130	K91-Y117 HydrophobicContact CD-CD2 4.27Å; K91-Y117 HydrophobicContact CD-CE1 4.33Å; K91-Y117 HydrophobicContact CD-CE2 4.09Å; W105-Y117 CarbonylContact O-C 3.54Å; W105-Y117 VanDerWaalsContact O-CA 3.27Å; W105-Y117 WeakPolarHBondContact O-CA 3.4Å; F106-Y117 HydrophobicContact CE1-CD1 4.02Å; F106-Y117 HydrophobicContact CE1-CG 4.09Å; F106-Y117 HydrophobicContact CZ-CG 4.43Å; Y117-P126 CarbonylContact O-C 3.48Å; Y117-L127 HydrophobicContact CD2-CB 3.8Å; Y117-L127 HydrophobicContact CE2-CB 3.63Å; Y117-L127 PolarHBondContact O-N 3.38Å; Y117-G128 PolarHBondContact N-O 3.42Å; Y117-I130 HydrophobicContact CD1-CG1 4.41Å; Y117-I130 HydrophobicContact CE1-CG1 4.34Å
118	F	93.3	Very high	87.2	Confident	32 Å²	32	69.8 Å²	69.8	14%	0.14	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	162.2	-170.6	-55.4	-100.9	0	0	0	110.4	R104 W105 V107 T120 D123 P126	R104-F118 WeakPolarHBondContact CA-O 3.45Å; R104-F118 WeakPolarHBondContact CD-O 3.38Å; W105-F118 HydrophobicContact CB-CB 4.44Å; W105-F118 PolarHBondContact N-O 3.29Å; W105-F118 VanDerWaalsContact N-O 3.12Å; W105-F118 PolarHBondContact O-N 3.39Å; V107-F118 HydrophobicContact CB-CE2 4.25Å; V107-F118 HydrophobicContact CG2-CD2 4.37Å; V107-F118 HydrophobicContact CG2-CE2 4.02Å; F118-T120 VanDerWaalsContact CB-O 3.31Å; F118-T120 WeakPolarHBondContact CB-O 3.36Å; F118-D123 HydrophobicContact CB-CB 4.26Å; F118-D123 HydrophobicContact CD1-CB 4.02Å; F118-D123 WeakPolarHBondContact CD1-O 3.25Å; F118-P126 HydrophobicContact CD1-CB 4.12Å; F118-P126 HydrophobicContact CE1-CB 3.73Å; F118-P126 HydrophobicContact CE1-CG 4.36Å; F118-P126 HydrophobicContact CE2-CB 4.37Å; F118-P126 HydrophobicContact CZ-CB 3.86Å
119	K	87.7	Confident	87.1	Confident	142 Å²	142	73.4 Å²	73.4	62%	0.617	37%	0.374	S	S	*	.	S	Bend	trans	-74.3	-41.7	171.5	-167.2	-170.3	171.1	-167.1	0	110	D123 L127	K119-D123 VanDerWaalsContact CA-OD2 3.23Å; K119-D123 WeakPolarHBondContact CA-OD2 3.39Å; K119-D123 WeakPolarHBondContact CB-OD2 3.48Å; K119-D123 PolarHBondContact N-OD2 2.97Å; K119-L127 HydrophobicContact CB-CD1 4.04Å
120	T	83.7	Confident	87.2	Confident	47 Å²	47	71.5 Å²	71.5	29%	0.288	36%	0.364	S	S	.	.	S	Bend	trans	-136.7	156.3	175.2	80.4	0	0	0	0	110.4	F118 Q122 D123	F118-T120 VanDerWaalsContact CB-O 3.31Å; F118-T120 WeakPolarHBondContact CB-O 3.36Å; T120-Q122 PolarHBondContact O-N 2.95Å; T120-Q122 PolarHBondContact OG1-N 2.96Å; T120-Q122 PolarHBondContact OG1-OE1 3.43Å; T120-D123 PolarHBondContact N-OD2 2.9Å; T120-D123 WeakPolarHBondContact O-CB 3.34Å; T120-D123 VanDerWaalsContact O-CG 3.3Å; T120-D123 PolarHBondContact O-N 3.44Å; T120-D123 PolarHBondContact OG1-N 2.93Å; T120-D123 PolarHBondContact OG1-OD1 3.39Å
121	P	84.1	Confident	87.6	Confident	53 Å²	53	69.6 Å²	69.6	34%	0.344	35%	0.349	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.4	-9.1	173.7	23.5	-30.4	0	0	0	114.2	Y88 W105	Y88-P121 WeakPolarHBondContact OH-CD 3.29Å; Y88-P121 WeakPolarHBondContact OH-CG 3.5Å; W105-P121 HydrophobicContact CD2-CB 3.87Å; W105-P121 HydrophobicContact CD2-CG 4.37Å; W105-P121 HydrophobicContact CG-CB 3.83Å; W105-P121 HydrophobicContact CG-CG 4.44Å; W105-P121 HydrophobicContact CZ2-CB 4.48Å
122	Q	82.3	Confident	88.2	Confident	156 Å²	156	59.1 Å²	59.1	73%	0.729	31%	0.31	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.9	-4.9	175.1	-64.7	78.8	14.1	0	0	113.4	T120 A124	T120-Q122 PolarHBondContact O-N 2.95Å; T120-Q122 PolarHBondContact OG1-N 2.96Å; T120-Q122 PolarHBondContact OG1-OE1 3.43Å; Q122-A124 PolarHBondContact O-N 3.14Å
123	D	85.8	Confident	88.2	Confident	49 Å²	49	55.2 Å²	55.2	26%	0.262	30%	0.298	S	S	.	.			trans	-71.3	123	-179.4	-60.2	-12.8	0	0	0	111.3	F118 K119 T120 L125	F118-D123 HydrophobicContact CB-CB 4.26Å; F118-D123 HydrophobicContact CD1-CB 4.02Å; F118-D123 WeakPolarHBondContact CD1-O 3.25Å; K119-D123 VanDerWaalsContact CA-OD2 3.23Å; K119-D123 WeakPolarHBondContact CA-OD2 3.39Å; K119-D123 WeakPolarHBondContact CB-OD2 3.48Å; K119-D123 PolarHBondContact N-OD2 2.97Å; T120-D123 PolarHBondContact N-OD2 2.9Å; T120-D123 WeakPolarHBondContact O-CB 3.34Å; T120-D123 VanDerWaalsContact O-CG 3.3Å; T120-D123 PolarHBondContact O-N 3.44Å; T120-D123 PolarHBondContact OG1-N 2.93Å; T120-D123 PolarHBondContact OG1-OD1 3.39Å; D123-L125 PolarHBondContact O-N 3.4Å
124	A	74.1	Confident	87.7	Confident	98 Å²	98	61 Å²	61	81%	0.81	33%	0.329	S	S	*	.	S	Bend	trans	-70.5	-11.4	177.9	0	0	0	0	0	114.8	Q122	Q122-A124 PolarHBondContact O-N 3.14Å
125	L	81.1	Confident	87.4	Confident	139 Å²	139	58.1 Å²	58.1	73%	0.728	32%	0.318	S	S	*	.	S	Bend	trans	-132.5	131.7	-177.4	-67.9	175	0	0	0	111.1	D123	D123-L125 PolarHBondContact O-N 3.4Å
126	P	90.1	Very high	87	Confident	54 Å²	54	61.9 Å²	61.9	35%	0.351	34%	0.343	S	S	.	.			trans	-72.6	143.7	176.9	29.6	-33.9	0	0	0	111.7	Y116 Y117 F118 G128	Y116-P126 HydrophobicContact CD1-CB 3.76Å; Y116-P126 HydrophobicContact CD1-CG 3.67Å; Y116-P126 HydrophobicContact CE1-CG 4.07Å; Y116-P126 HydrophobicContact CG-CB 4.43Å; Y117-P126 CarbonylContact O-C 3.48Å; F118-P126 HydrophobicContact CD1-CB 4.12Å; F118-P126 HydrophobicContact CE1-CB 3.73Å; F118-P126 HydrophobicContact CE1-CG 4.36Å; F118-P126 HydrophobicContact CE2-CB 4.37Å; F118-P126 HydrophobicContact CZ-CB 3.86Å; P126-G128 PolarHBondContact O-N 2.97Å
127	L	87.3	Confident	86.8	Confident	89 Å²	89	61.6 Å²	61.6	47%	0.466	34%	0.343	S	S	.	.	S	Bend	trans	-73.2	-7.4	170.3	-60.8	178.8	0	0	0	112.9	Y117 K119	Y117-L127 HydrophobicContact CD2-CB 3.8Å; Y117-L127 HydrophobicContact CE2-CB 3.63Å; Y117-L127 PolarHBondContact O-N 3.38Å; K119-L127 HydrophobicContact CB-CD1 4.04Å
128	G	89.1	Confident	86.4	Confident	17 Å²	17	63.6 Å²	63.6	18%	0.175	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	161.3	-177.6	176.6	0	0	0	0	0	112.1	Y117 P126	Y117-G128 PolarHBondContact N-O 3.42Å; P126-G128 PolarHBondContact O-N 2.97Å
129	H	91.5	Very high	86.1	Confident	86 Å²	86	66.9 Å²	66.9	40%	0.398	37%	0.366	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.4	156	173.5	58.2	-80.7	0	0	0	109.6	Y114 L115 Y116	Y114-H129 HydrophobicContact CD2-CB 4.09Å; Y114-H129 AromaticContact CD2-CD2 3.45Å; Y114-H129 VanDerWaalsContact CD2-CD2 3.45Å; Y114-H129 WeakPolarHBondContact CD2-CD2 3.27Å; Y114-H129 AromaticContact CD2-CG 3.78Å; Y114-H129 AromaticContact CE2-CD2 3.42Å; Y114-H129 VanDerWaalsContact CE2-CD2 3.42Å; Y114-H129 WeakPolarHBondContact CE2-CD2 3.49Å; Y114-H129 AromaticContact CE2-NE2 3.58Å; Y114-H129 HydrophobicContact CG-CB 4.45Å; L115-H129 CarbonylContact O-C 3.57Å; L115-H129 WeakPolarHBondContact O-CA 3.39Å; Y116-H129 HydrophobicContact CD1-CB 3.72Å; Y116-H129 HydrophobicContact CE1-CB 3.84Å; Y116-H129 HydrophobicContact CG-CB 4.36Å
130	I	92.1	Very high	85.7	Confident	1 Å²	1	64.9 Å²	64.9	1%	0.005	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	123.7	165	-54.1	178.7	0	0	0	105.3	F106 L115 Y117 I132 I150 T152 F157	F106-I130 HydrophobicContact CE1-CD1 4.26Å; L115-I130 HydrophobicContact CB-CB 4.41Å; L115-I130 PolarHBondContact N-O 3.25Å; L115-I130 PolarHBondContact O-N 3.5Å; Y117-I130 HydrophobicContact CD1-CG1 4.41Å; Y117-I130 HydrophobicContact CE1-CG1 4.34Å; I130-I132 HydrophobicContact CB-CD1 4.28Å; I130-I132 HydrophobicContact CG2-CD1 3.86Å; I130-I132 PolarHBondContact O-N 2.88Å; I130-I150 HydrophobicContact CD1-CD1 4.25Å; I130-I150 HydrophobicContact CG2-CB 4.45Å; I130-I150 HydrophobicContact CG2-CG2 3.93Å; I130-T152 HydrophobicContact CG2-CG2 3.64Å; I130-F157 HydrophobicContact CD1-CB 3.85Å; I130-F157 HydrophobicContact CD1-CD1 3.86Å; I130-F157 HydrophobicContact CD1-CD2 4.21Å; I130-F157 HydrophobicContact CD1-CE1 4.42Å; I130-F157 HydrophobicContact CD1-CG 3.73Å; I130-F157 HydrophobicContact CG1-CD1 3.92Å; I130-F157 HydrophobicContact CG1-CD2 4.09Å; I130-F157 HydrophobicContact CG1-CE1 3.97Å; I130-F157 HydrophobicContact CG1-CE2 4.14Å; I130-F157 HydrophobicContact CG1-CG 3.97Å; I130-F157 HydrophobicContact CG1-CZ 4.07Å; I130-F157 HydrophobicContact CG2-CD2 4.03Å; I130-F157 HydrophobicContact CG2-CE2 4.17Å
131	D	90.3	Very high	85	Confident	41 Å²	41	67 Å²	67	22%	0.219	38%	0.375	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.6	114	171.6	-170.7	-23.3	0	0	0	108.1	Y114 G133 A135 T152	Y114-D131 HydrophobicContact CD1-CB 4.21Å; Y114-D131 HydrophobicContact CE1-CB 3.93Å; Y114-D131 VanDerWaalsContact CE1-CG 3.47Å; Y114-D131 WeakPolarHBondContact CE1-OD2 3.29Å; D131-G133 PolarHBondContact OD1-N 3.17Å; D131-A135 WeakPolarHBondContact O-CB 3.45Å; D131-T152 VanDerWaalsContact O-CB 3.29Å; D131-T152 WeakPolarHBondContact O-CB 3.41Å; D131-T152 WeakPolarHBondContact O-CG2 3.46Å; D131-T152 PolarHBondContact O-OG1 3.22Å
132	I	92.7	Very high	84.1	Confident	0 Å²	0	73.4 Å²	73.4	0%	0	40%	0.4	C	S	.	.			trans	-88.8	-16.6	-176.7	-58.6	-61.7	0	0	0	111.4	Y108 C113 L115 I130 D134 A135 F137 I150 L174 R178	Y108-I132 HydrophobicContact CE2-CB 4.41Å; C113-I132 VanDerWaalsContact O-CB 3.24Å; C113-I132 WeakPolarHBondContact O-CB 3.36Å; C113-I132 PolarHBondContact O-N 3.43Å; L115-I132 HydrophobicContact CB-CD1 3.87Å; L115-I132 HydrophobicContact CB-CG1 3.63Å; L115-I132 HydrophobicContact CD2-CD1 4.32Å; I130-I132 HydrophobicContact CB-CD1 4.28Å; I130-I132 HydrophobicContact CG2-CD1 3.86Å; I130-I132 PolarHBondContact O-N 2.88Å; I132-D134 PolarHBondContact O-N 2.59Å; I132-A135 PolarHBondContact O-N 3.16Å; I132-F137 HydrophobicContact CD1-CE1 4.38Å; I132-F137 HydrophobicContact CG2-CZ 3.99Å; I132-I150 HydrophobicContact CD1-CD1 4.38Å; I132-I150 HydrophobicContact CD1-CG2 4.44Å; I132-L174 HydrophobicContact CD1-CD2 4.26Å; I132-L174 HydrophobicContact CG1-CD2 4.3Å; I132-R178 HydrophobicContact CG2-CB 4.02Å; I132-R178 WeakPolarHBondContact O-CD 3.43Å; I132-R178 WeakPolarHBondContact O-CG 3.28Å
133	G	84.1	Confident	83.5	Confident	17 Å²	17	67.3 Å²	67.3	18%	0.175	38%	0.379	C	S	.	.	T	Hydrogen-bonded Turn	trans	-57.8	-52.1	-177.5	0	0	0	0	0	112.3	D131 R178	D131-G133 PolarHBondContact OD1-N 3.17Å; G133-R178 WeakPolarHBondContact O-CD 3.33Å; G133-R178 WeakPolarHBondContact O-CG 3.32Å
134	D	80.1	Confident	83	Confident	122 Å²	122	70.3 Å²	70.3	65%	0.652	39%	0.392	S	S	*	.	T	Hydrogen-bonded Turn	trans	-106.1	23.2	-178.8	-55.5	-40.2	0	0	0	112.2	I132	I132-D134 PolarHBondContact O-N 2.59Å
135	A	87.1	Confident	83.2	Confident	1 Å²	1	72.3 Å²	72.3	1%	0.008	38%	0.384	C	S	.	.			trans	-82.6	139.1	-179.1	0	0	0	0	0	113.4	D131 I132 F137 I150 R151 R178	D131-A135 WeakPolarHBondContact O-CB 3.45Å; I132-A135 PolarHBondContact O-N 3.16Å; A135-F137 HydrophobicContact CB-CZ 4.47Å; A135-I150 HydrophobicContact CB-CG2 3.74Å; A135-R151 CarbonylContact C-O 3.52Å; A135-R151 WeakPolarHBondContact CA-O 3.29Å; A135-R178 PolarHBondContact O-NH1 3.45Å
136	C	83.6	Confident	83.3	Confident	78 Å²	78	65.8 Å²	65.8	53%	0.527	35%	0.351	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.8	141.2	162.2	-70.4	0	0	0	0	110.5	I150 R151	C136-I150 WeakPolarHBondContact O-CA 3.44Å; C136-R151 PolarHBondContact N-O 3.5Å; C136-R151 PolarHBondContact O-N 3.41Å
137	F	90.6	Very high	83.3	Confident	39 Å²	39	65.3 Å²	65.3	17%	0.171	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	137.4	176.2	-48.2	-83.5	0	0	0	109.8	I132 A135 E149 I150 L171 L174 Q175	I132-F137 HydrophobicContact CD1-CE1 4.38Å; I132-F137 HydrophobicContact CG2-CZ 3.99Å; A135-F137 HydrophobicContact CB-CZ 4.47Å; F137-E149 WeakPolarHBondContact CA-O 3.34Å; F137-I150 HydrophobicContact CD1-CB 4.47Å; F137-I150 HydrophobicContact CD1-CD1 4.3Å; F137-I150 HydrophobicContact CD1-CG1 4.03Å; F137-I150 HydrophobicContact CD1-CG2 3.98Å; F137-I150 HydrophobicContact CE1-CD1 4.19Å; F137-I150 HydrophobicContact CE1-CG1 4.38Å; F137-I150 HydrophobicContact CE1-CG2 3.98Å; F137-L171 HydrophobicContact CB-CD2 3.79Å; F137-L171 HydrophobicContact CD1-CD2 4.24Å; F137-L171 HydrophobicContact CG-CD2 4.24Å; F137-L174 HydrophobicContact CE1-CB 3.74Å; F137-L174 HydrophobicContact CE1-CD1 4.12Å; F137-L174 HydrophobicContact CZ-CB 3.67Å; F137-Q175 HydrophobicContact CE2-CB 4.34Å
138	M	83.3	Confident	83.5	Confident	75 Å²	75	61.2 Å²	61.2	37%	0.369	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.5	152.7	173.4	-73.2	164.3	-66.4	0	0	109.6	F148 E149 R151	M138-F148 CarbonylContact O-C 3.59Å; M138-F148 WeakPolarHBondContact O-CA 3.5Å; M138-E149 PolarHBondContact N-O 3.26Å; M138-E149 PolarHBondContact O-N 3.25Å; M138-R151 HydrophobicContact CE-CG 3.7Å; M138-R151 VanDerWaalsContact CE-CZ 3.41Å
139	Y	87.9	Confident	83.7	Confident	101 Å²	101	61.7 Å²	61.7	40%	0.396	32%	0.32	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.5	152.3	165.4	67	-84.8	0	0	0	107.9	V141 M167 H168 L171	Y139-V141 HydrophobicContact CE2-CG2 4.37Å; Y139-M167 HydrophobicContact CD1-CE 4.45Å; Y139-M167 HydrophobicContact CD2-CE 3.6Å; Y139-M167 HydrophobicContact CE2-CE 4.14Å; Y139-M167 HydrophobicContact CG-CE 3.8Å; Y139-M167 HydrophobicContact CG-SD 4.39Å; Y139-H168 AromaticContact CE2-CE1 3.99Å; Y139-H168 AromaticContact CZ-CE1 3.76Å; Y139-L171 HydrophobicContact CD1-CD1 3.64Å; Y139-L171 HydrophobicContact CE1-CD1 4.2Å; Y139-L171 HydrophobicContact CG-CD1 4.27Å
140	D	78.7	Confident	83.7	Confident	99 Å²	99	57.6 Å²	57.6	53%	0.529	30%	0.301	S	S	.	.			trans	-82.5	136.8	175.2	-167.5	-25.4	0	0	0	109	E142 G143	D140-E142 PolarHBondContact OD1-N 2.75Å; D140-G143 PolarHBondContact OD1-N 2.69Å; D140-G143 VanDerWaalsContact OD1-N 3.1Å
141	V	70.4	Confident	83.6	Confident	93 Å²	93	62.6 Å²	62.6	56%	0.564	32%	0.32	S	S	*	.	S	Bend	trans	-75.9	-35	179.7	-179.8	0	0	0	0	110.7	Y139 R164	Y139-V141 HydrophobicContact CE2-CG2 4.37Å; V141-R164 PolarHBondContact O-NH1 3.04Å
142	E	64.9	Low	83.5	Confident	186 Å²	186	61.1 Å²	61.1	87%	0.869	31%	0.312	S	S	*	.	S	Bend	trans	-105.4	-13	-174.8	-60.3	-176.9	176.5	0	0	113	D140	D140-E142 PolarHBondContact OD1-N 2.75Å
143	G	70.1	Confident	82.7	Confident	28 Å²	28	65.3 Å²	65.3	29%	0.289	35%	0.347	S	S	.	.	S	Bend	trans	-74.3	-176.2	179	0	0	0	0	0	115.9	D140 E145	D140-G143 PolarHBondContact OD1-N 2.69Å; D140-G143 VanDerWaalsContact OD1-N 3.1Å; G143-E145 PolarHBondContact O-N 2.73Å
144	E	73.6	Confident	82.1	Confident	113 Å²	113	68.7 Å²	68.7	53%	0.528	38%	0.381	S	S	.	.	S	Bend	trans	-54.1	131.5	-174.4	-71	-169.5	-163.6	0	0	114.1	G146 Q147 K160	E144-G146 PolarHBondContact O-N 3.02Å; E144-Q147 HydrophobicContact CB-CB 4.3Å; E144-Q147 VanDerWaalsContact O-CB 3.24Å; E144-Q147 WeakPolarHBondContact O-CB 3.45Å; E144-Q147 PolarHBondContact O-N 3.45Å; E144-Q147 VanDerWaalsContact O-N 3.08Å; E144-K160 IonicContact OE2-NZ 2.81Å; E144-K160 PolarHBondContact OE2-NZ 3.49Å
145	E	78.4	Confident	82.2	Confident	139 Å²	139	69.1 Å²	69.1	65%	0.65	38%	0.378	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.8	128.6	-177.2	-71.4	-152.6	118.3	0	0	113.9	G143 Q147 K160	G143-E145 PolarHBondContact O-N 2.73Å; E145-Q147 VanDerWaalsContact C-N 3.26Å; E145-Q147 PolarHBondContact O-N 3.49Å; E145-K160 WeakPolarHBondContact O-CE 3.47Å
146	G	82.8	Confident	82.2	Confident	2 Å²	2	75.1 Å²	75.1	2%	0.021	41%	0.406	C	S	.	.	T	Hydrogen-bonded Turn	trans	76	5.1	176.8	0	0	0	0	0	115	E144 K160 A161 M167	E144-G146 PolarHBondContact O-N 3.02Å; G146-K160 WeakPolarHBondContact O-CA 3.27Å; G146-A161 PolarHBondContact O-N 2.94Å; G146-M167 VanDerWaalsContact C-SD 3.52Å
147	Q	90.8	Very high	82.6	Confident	45 Å²	45	72.5 Å²	72.5	21%	0.21	39%	0.385	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84	129.4	177.2	-172.4	173.5	-91	0	0	112	Y101 E144 E145 L158 L159 K160	Y101-Q147 PolarHBondContact OH-OE1 3.12Å; E144-Q147 HydrophobicContact CB-CB 4.3Å; E144-Q147 VanDerWaalsContact O-CB 3.24Å; E144-Q147 WeakPolarHBondContact O-CB 3.45Å; E144-Q147 PolarHBondContact O-N 3.45Å; E144-Q147 VanDerWaalsContact O-N 3.08Å; E145-Q147 VanDerWaalsContact C-N 3.26Å; E145-Q147 PolarHBondContact O-N 3.49Å; Q147-L158 HydrophobicContact CG-CD1 4.02Å; Q147-L158 HydrophobicContact CG-CD2 4.36Å; Q147-L158 HydrophobicContact CG-CG 4.13Å; Q147-L159 WeakPolarHBondContact CA-O 3.4Å; Q147-K160 HydrophobicContact CB-CG 4.32Å
148	F	92.4	Very high	82.6	Confident	2 Å²	2	72.6 Å²	72.6	1%	0.009	39%	0.387	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.5	156	178.3	67.6	-75.4	0	0	0	111.7	L89 M138 I150 L159 A161 M167 W170 L171	L89-F148 HydrophobicContact CD1-CE1 4.46Å; L89-F148 HydrophobicContact CD1-CZ 3.88Å; L89-F148 HydrophobicContact CD2-CE1 4.31Å; L89-F148 HydrophobicContact CD2-CZ 4.47Å; M138-F148 CarbonylContact O-C 3.59Å; M138-F148 WeakPolarHBondContact O-CA 3.5Å; F148-I150 HydrophobicContact CD2-CG1 4.32Å; F148-I150 HydrophobicContact CE2-CD1 4.2Å; F148-I150 HydrophobicContact CE2-CG1 4.24Å; F148-L159 HydrophobicContact CD1-CB 4.15Å; F148-L159 HydrophobicContact CE1-CB 3.81Å; F148-L159 HydrophobicContact CE2-CB 4.2Å; F148-L159 HydrophobicContact CE2-CD1 3.86Å; F148-L159 HydrophobicContact CZ-CB 3.85Å; F148-L159 HydrophobicContact CZ-CD1 3.84Å; F148-L159 HydrophobicContact CZ-CG 4.48Å; F148-L159 PolarHBondContact N-O 2.93Å; F148-L159 PolarHBondContact O-N 3.29Å; F148-A161 HydrophobicContact CE1-CB 4.34Å; F148-M167 HydrophobicContact CB-CG 4.04Å; F148-M167 HydrophobicContact CB-SD 4.08Å; F148-M167 HydrophobicContact CD1-CB 4.46Å; F148-M167 HydrophobicContact CD1-CG 3.67Å; F148-M167 HydrophobicContact CD1-SD 4.45Å; F148-M167 HydrophobicContact CE1-CG 4.35Å; F148-M167 HydrophobicContact CG-CG 4.06Å; F148-W170 HydrophobicContact CZ-CB 4.25Å; F148-L171 HydrophobicContact CB-CD1 4.45Å; F148-L171 HydrophobicContact CB-CD2 4.33Å; F148-L171 HydrophobicContact CD2-CD2 3.65Å; F148-L171 HydrophobicContact CD2-CG 4.23Å; F148-L171 HydrophobicContact CE2-CD2 4.22Å; F148-L171 HydrophobicContact CG-CD2 4.25Å
149	E	91.9	Very high	83.1	Confident	27 Å²	27	69 Å²	69	13%	0.126	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	139.3	-177.7	-154.4	-161.8	152.7	0	0	111.2	F137 M138 R151 E156 L158	F137-E149 WeakPolarHBondContact CA-O 3.34Å; M138-E149 PolarHBondContact N-O 3.26Å; M138-E149 PolarHBondContact O-N 3.25Å; E149-R151 VanDerWaalsContact CD-NE 3.28Å; E149-R151 WeakPolarHBondContact OE1-CD 3.48Å; E149-R151 WeakPolarHBondContact OE1-CG 3.37Å; E149-R151 IonicContact OE1-CZ 2.72Å; E149-R151 IonicContact OE1-NE 3.19Å; E149-R151 PolarHBondContact OE1-NE 3.47Å; E149-R151 IonicContact OE1-NH2 3.24Å; E149-R151 IonicContact OE2-CZ 3.14Å; E149-R151 IonicContact OE2-NE 3.99Å; E149-R151 PolarHBondContact OE2-NE 3.23Å; E149-R151 IonicContact OE2-NH2 2.71Å; E149-R151 PolarHBondContact OE2-NH2 2.95Å; E149-E156 VanDerWaalsContact OE1-CB 3.28Å; E149-E156 WeakPolarHBondContact OE1-CB 3.2Å; E149-E156 WeakPolarHBondContact OE1-CG 3.47Å; E149-L158 HydrophobicContact CB-CD1 3.82Å; E149-L158 HydrophobicContact CG-CD1 3.92Å
150	I	92.9	Very high	83.3	Confident	0 Å²	0	66.7 Å²	66.7	0%	0	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	118.9	168.5	-41.8	-175.2	0	0	0	108.5	I130 I132 A135 C136 F137 F148 F157 L159 L174	I130-I150 HydrophobicContact CD1-CD1 4.25Å; I130-I150 HydrophobicContact CG2-CB 4.45Å; I130-I150 HydrophobicContact CG2-CG2 3.93Å; I132-I150 HydrophobicContact CD1-CD1 4.38Å; I132-I150 HydrophobicContact CD1-CG2 4.44Å; A135-I150 HydrophobicContact CB-CG2 3.74Å; C136-I150 WeakPolarHBondContact O-CA 3.44Å; F137-I150 HydrophobicContact CD1-CB 4.47Å; F137-I150 HydrophobicContact CD1-CD1 4.3Å; F137-I150 HydrophobicContact CD1-CG1 4.03Å; F137-I150 HydrophobicContact CD1-CG2 3.98Å; F137-I150 HydrophobicContact CE1-CD1 4.19Å; F137-I150 HydrophobicContact CE1-CG1 4.38Å; F137-I150 HydrophobicContact CE1-CG2 3.98Å; F148-I150 HydrophobicContact CD2-CG1 4.32Å; F148-I150 HydrophobicContact CE2-CD1 4.2Å; F148-I150 HydrophobicContact CE2-CG1 4.24Å; I150-F157 HydrophobicContact CB-CB 4.32Å; I150-F157 PolarHBondContact N-O 2.99Å; I150-F157 WeakPolarHBondContact O-CB 3.26Å; I150-F157 PolarHBondContact O-N 3.39Å; I150-L159 HydrophobicContact CD1-CD1 3.7Å; I150-L159 HydrophobicContact CG1-CD1 4.17Å; I150-L174 HydrophobicContact CD1-CD1 4.12Å
151	R	88.8	Confident	83.9	Confident	107 Å²	107	62.2 Å²	62.2	40%	0.404	34%	0.338	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	126.1	172.7	-61.1	-162.1	-172.5	147.2	14.3	109.9	A135 C136 M138 E149 K155 E156	A135-R151 CarbonylContact C-O 3.52Å; A135-R151 WeakPolarHBondContact CA-O 3.29Å; C136-R151 PolarHBondContact N-O 3.5Å; C136-R151 PolarHBondContact O-N 3.41Å; M138-R151 HydrophobicContact CE-CG 3.7Å; M138-R151 VanDerWaalsContact CE-CZ 3.41Å; E149-R151 VanDerWaalsContact CD-NE 3.28Å; E149-R151 WeakPolarHBondContact OE1-CD 3.48Å; E149-R151 WeakPolarHBondContact OE1-CG 3.37Å; E149-R151 IonicContact OE1-CZ 2.72Å; E149-R151 IonicContact OE1-NE 3.19Å; E149-R151 PolarHBondContact OE1-NE 3.47Å; E149-R151 IonicContact OE1-NH2 3.24Å; E149-R151 IonicContact OE2-CZ 3.14Å; E149-R151 IonicContact OE2-NE 3.99Å; E149-R151 PolarHBondContact OE2-NE 3.23Å; E149-R151 IonicContact OE2-NH2 2.71Å; E149-R151 PolarHBondContact OE2-NH2 2.95Å; R151-K155 WeakPolarHBondContact CA-O 3.43Å; R151-E156 HydrophobicContact CG-CG 4.08Å; R151-E156 IonicContact CZ-OE1 2.75Å; R151-E156 IonicContact NE-OE1 2.75Å; R151-E156 PolarHBondContact NE-OE1 2.97Å
152	T	89.1	Confident	84.7	Confident	10 Å²	10	62.7 Å²	62.7	6%	0.061	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.5	139.2	178.3	-176.9	0	0	0	0	110.8	I130 D131 G154 K155 F157	I130-T152 HydrophobicContact CG2-CG2 3.64Å; D131-T152 VanDerWaalsContact O-CB 3.29Å; D131-T152 WeakPolarHBondContact O-CB 3.41Å; D131-T152 WeakPolarHBondContact O-CG2 3.46Å; D131-T152 PolarHBondContact O-OG1 3.22Å; T152-G154 VanDerWaalsContact C-N 3.26Å; T152-G154 PolarHBondContact O-N 3.38Å; T152-G154 VanDerWaalsContact O-N 3.1Å; T152-K155 PolarHBondContact N-O 3.3Å; T152-K155 WeakPolarHBondContact O-CB 3.4Å; T152-K155 PolarHBondContact O-N 3.25Å; T152-F157 HydrophobicContact CG2-CD2 4.17Å; T152-F157 HydrophobicContact CG2-CE2 3.81Å
153	A	75.6	Confident	85.8	Confident	87 Å²	87	55.3 Å²	55.3	72%	0.719	31%	0.312	S	S	*	.	T	Hydrogen-bonded Turn	trans	44.3	44.4	179.1	0	0	0	0	0	114.9	K155	A153-K155 VanDerWaalsContact C-N 3.31Å; A153-K155 PolarHBondContact O-N 3.4Å
154	G	71.8	Confident	86.4	Confident	88 Å²	88	57.6 Å²	57.6	91%	0.907	31%	0.312	S	S	*	.	T	Hydrogen-bonded Turn	trans	70.8	18.1	-179	0	0	0	0	0	115.4	T152	T152-G154 VanDerWaalsContact C-N 3.26Å; T152-G154 PolarHBondContact O-N 3.38Å; T152-G154 VanDerWaalsContact O-N 3.1Å
155	K	81.8	Confident	86.8	Confident	132 Å²	132	58.9 Å²	58.9	57%	0.574	32%	0.318	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-123.1	136.6	179.5	-63.6	166.5	-172.2	161	0	111	R151 T152 A153 F157	R151-K155 WeakPolarHBondContact CA-O 3.43Å; T152-K155 PolarHBondContact N-O 3.3Å; T152-K155 WeakPolarHBondContact O-CB 3.4Å; T152-K155 PolarHBondContact O-N 3.25Å; A153-K155 VanDerWaalsContact C-N 3.31Å; A153-K155 PolarHBondContact O-N 3.4Å; K155-F157 HydrophobicContact CB-CD2 4.44Å; K155-F157 HydrophobicContact CB-CE2 3.74Å; K155-F157 HydrophobicContact CB-CZ 4.22Å
156	E	86.9	Confident	87.2	Confident	127 Å²	127	54.7 Å²	54.7	59%	0.593	30%	0.302	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-103.9	127.5	-178.7	-62.1	-174.9	155.3	0	0	110.7	E149 R151	E149-E156 VanDerWaalsContact OE1-CB 3.28Å; E149-E156 WeakPolarHBondContact OE1-CB 3.2Å; E149-E156 WeakPolarHBondContact OE1-CG 3.47Å; R151-E156 HydrophobicContact CG-CG 4.08Å; R151-E156 IonicContact CZ-OE1 2.75Å; R151-E156 IonicContact NE-OE1 2.75Å; R151-E156 PolarHBondContact NE-OE1 2.97Å
157	F	91.1	Very high	87.6	Confident	22 Å²	22	54.8 Å²	54.8	10%	0.096	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	91.6	-179.4	-63.8	-87.2	0	0	0	110.3	I130 I150 T152 K155	I130-F157 HydrophobicContact CD1-CB 3.85Å; I130-F157 HydrophobicContact CD1-CD1 3.86Å; I130-F157 HydrophobicContact CD1-CD2 4.21Å; I130-F157 HydrophobicContact CD1-CE1 4.42Å; I130-F157 HydrophobicContact CD1-CG 3.73Å; I130-F157 HydrophobicContact CG1-CD1 3.92Å; I130-F157 HydrophobicContact CG1-CD2 4.09Å; I130-F157 HydrophobicContact CG1-CE1 3.97Å; I130-F157 HydrophobicContact CG1-CE2 4.14Å; I130-F157 HydrophobicContact CG1-CG 3.97Å; I130-F157 HydrophobicContact CG1-CZ 4.07Å; I130-F157 HydrophobicContact CG2-CD2 4.03Å; I130-F157 HydrophobicContact CG2-CE2 4.17Å; I150-F157 HydrophobicContact CB-CB 4.32Å; I150-F157 PolarHBondContact N-O 2.99Å; I150-F157 WeakPolarHBondContact O-CB 3.26Å; I150-F157 PolarHBondContact O-N 3.39Å; T152-F157 HydrophobicContact CG2-CD2 4.17Å; T152-F157 HydrophobicContact CG2-CE2 3.81Å; K155-F157 HydrophobicContact CB-CD2 4.44Å; K155-F157 HydrophobicContact CB-CE2 3.74Å; K155-F157 HydrophobicContact CB-CZ 4.22Å
158	L	91.3	Very high	87.4	Confident	42 Å²	42	55.8 Å²	55.8	22%	0.22	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.7	123.7	172.3	-158.9	69	0	0	0	110.7	L92 Y101 Q147 E149	L92-L158 HydrophobicContact CB-CB 4.18Å; L92-L158 WeakPolarHBondContact CB-O 3.45Å; L92-L158 HydrophobicContact CD2-CB 4.18Å; L92-L158 HydrophobicContact CD2-CD2 3.8Å; L92-L158 PolarHBondContact N-O 3.13Å; Y101-L158 WeakPolarHBondContact OH-CD2 3.32Å; Q147-L158 HydrophobicContact CG-CD1 4.02Å; Q147-L158 HydrophobicContact CG-CD2 4.36Å; Q147-L158 HydrophobicContact CG-CG 4.13Å; E149-L158 HydrophobicContact CB-CD1 3.82Å; E149-L158 HydrophobicContact CG-CD1 3.92Å
159	L	93.9	Very high	87.2	Confident	0 Å²	0	61.9 Å²	61.9	0%	0	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	151.6	-177.9	-57.8	-176.9	0	0	0	109.8	L89 N90 K91 F106 Q147 F148 I150	L89-L159 HydrophobicContact CD1-CD1 4.17Å; N90-L159 CarbonylContact O-C 3.58Å; N90-L159 VanDerWaalsContact O-CA 3.32Å; N90-L159 WeakPolarHBondContact O-CA 3.3Å; K91-L159 HydrophobicContact CB-CD2 3.88Å; K91-L159 HydrophobicContact CG-CD2 3.73Å; F106-L159 HydrophobicContact CE1-CD1 4.39Å; F106-L159 HydrophobicContact CE1-CD2 4.32Å; F106-L159 HydrophobicContact CZ-CD1 4.36Å; F106-L159 HydrophobicContact CZ-CD2 3.69Å; Q147-L159 WeakPolarHBondContact CA-O 3.4Å; F148-L159 HydrophobicContact CD1-CB 4.15Å; F148-L159 HydrophobicContact CE1-CB 3.81Å; F148-L159 HydrophobicContact CE2-CB 4.2Å; F148-L159 HydrophobicContact CE2-CD1 3.86Å; F148-L159 HydrophobicContact CZ-CB 3.85Å; F148-L159 HydrophobicContact CZ-CD1 3.84Å; F148-L159 HydrophobicContact CZ-CG 4.48Å; F148-L159 PolarHBondContact N-O 2.93Å; F148-L159 PolarHBondContact O-N 3.29Å; I150-L159 HydrophobicContact CD1-CD1 3.7Å; I150-L159 HydrophobicContact CG1-CD1 4.17Å
160	K	92.2	Very high	87.2	Confident	52 Å²	52	61 Å²	61	23%	0.226	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.3	122.1	172.2	-166.1	170.9	-172.5	-179.6	0	110.8	N90 Y101 E144 E145 G146 Q147	N90-K160 HydrophobicContact CB-CB 4.25Å; N90-K160 WeakPolarHBondContact CB-O 3.32Å; N90-K160 PolarHBondContact N-O 2.94Å; N90-K160 PolarHBondContact O-N 3.19Å; Y101-K160 HydrophobicContact CD1-CB 4.33Å; Y101-K160 HydrophobicContact CE1-CB 3.87Å; Y101-K160 HydrophobicContact CE2-CD 4.46Å; E144-K160 IonicContact OE2-NZ 2.81Å; E144-K160 PolarHBondContact OE2-NZ 3.49Å; E145-K160 WeakPolarHBondContact O-CE 3.47Å; G146-K160 WeakPolarHBondContact O-CA 3.27Å; Q147-K160 HydrophobicContact CB-CG 4.32Å
161	A	92.3	Very high	87	Confident	5 Å²	5	61.7 Å²	61.7	4%	0.041	33%	0.329	C	S	.	.			trans	-81.6	163.8	173.5	0	0	0	0	0	111.3	L89 G146 F148 S163 V166 M167	L89-A161 HydrophobicContact CD2-CB 3.83Å; G146-A161 PolarHBondContact O-N 2.94Å; F148-A161 HydrophobicContact CE1-CB 4.34Å; A161-S163 VanDerWaalsContact C-N 3.26Å; A161-S163 PolarHBondContact O-N 2.82Å; A161-V166 HydrophobicContact CB-CB 4.22Å; A161-V166 HydrophobicContact CB-CG1 4.16Å; A161-M167 HydrophobicContact CB-CB 3.93Å
162	P	86.1	Confident	87	Confident	103 Å²	103	62.9 Å²	62.9	67%	0.669	34%	0.34	S	S	*	.	S	Bend	trans	-66.3	-21.1	175.3	-22.8	35	0	0	0	115.1
163	S	87.6	Confident	87	Confident	31 Å²	31	64.6 Å²	64.6	22%	0.217	35%	0.347	C	S	.	.	S	Bend	trans	-156.9	167.6	175	82.9	0	0	0	0	111.8	A161 Q165 V166 M167	A161-S163 VanDerWaalsContact C-N 3.26Å; A161-S163 PolarHBondContact O-N 2.82Å; S163-Q165 VanDerWaalsContact C-N 3.29Å; S163-Q165 VanDerWaalsContact CB-OE1 3.27Å; S163-Q165 PolarHBondContact O-N 3.39Å; S163-Q165 PolarHBondContact OG-N 3.09Å; S163-Q165 PolarHBondContact OG-OE1 3.38Å; S163-V166 PolarHBondContact O-N 3.19Å; S163-V166 PolarHBondContact OG-N 2.93Å; S163-M167 PolarHBondContact O-N 2.96Å
164	R	82.9	Confident	87.6	Confident	75 Å²	75	60.4 Å²	60.4	28%	0.283	31%	0.313	S	S	.	.	H	α-helix	trans	-61.2	-34	175.3	-166.7	169	-179.4	131	-5.4	112.7	V141 M167 H168	V141-R164 PolarHBondContact O-NH1 3.04Å; R164-M167 HydrophobicContact CG-CE 4.12Å; R164-M167 WeakPolarHBondContact O-CB 3.44Å; R164-M167 PolarHBondContact O-N 2.98Å; R164-H168 PolarHBondContact O-CD2 2.72Å; R164-H168 PolarHBondContact O-N 3.27Å
165	Q	82.6	Confident	88.4	Confident	141 Å²	141	61.3 Å²	61.3	66%	0.659	29%	0.293	S	S	*	.	H	α-helix	trans	-67.8	-43.2	175.3	-55.8	79.8	6	0	0	111.7	S163 M167 H168 Y169	S163-Q165 VanDerWaalsContact C-N 3.29Å; S163-Q165 VanDerWaalsContact CB-OE1 3.27Å; S163-Q165 PolarHBondContact O-N 3.39Å; S163-Q165 PolarHBondContact OG-N 3.09Å; S163-Q165 PolarHBondContact OG-OE1 3.38Å; Q165-M167 VanDerWaalsContact C-N 3.32Å; Q165-M167 PolarHBondContact O-N 3.32Å; Q165-H168 PolarHBondContact O-N 2.98Å; Q165-Y169 PolarHBondContact O-N 3.2Å
166	V	86.3	Confident	88.4	Confident	51 Å²	51	58.6 Å²	58.6	31%	0.309	28%	0.283	S	S	.	.	H	α-helix	trans	-67.9	-34.2	177.6	-179.1	0	0	0	0	111.1	A161 S163 W170	A161-V166 HydrophobicContact CB-CB 4.22Å; A161-V166 HydrophobicContact CB-CG1 4.16Å; S163-V166 PolarHBondContact O-N 3.19Å; S163-V166 PolarHBondContact OG-N 2.93Å; V166-W170 PolarHBondContact O-N 3.36Å
167	M	91.6	Very high	88.3	Confident	3 Å²	3	54.3 Å²	54.3	2%	0.015	26%	0.262	C	S	.	.	H	α-helix	trans	-59.6	-51.8	170.1	178.8	-172.2	84.9	0	0	111.7	Y139 G146 F148 A161 S163 R164 Q165 Y169 W170 L171	Y139-M167 HydrophobicContact CD1-CE 4.45Å; Y139-M167 HydrophobicContact CD2-CE 3.6Å; Y139-M167 HydrophobicContact CE2-CE 4.14Å; Y139-M167 HydrophobicContact CG-CE 3.8Å; Y139-M167 HydrophobicContact CG-SD 4.39Å; G146-M167 VanDerWaalsContact C-SD 3.52Å; F148-M167 HydrophobicContact CB-CG 4.04Å; F148-M167 HydrophobicContact CB-SD 4.08Å; F148-M167 HydrophobicContact CD1-CB 4.46Å; F148-M167 HydrophobicContact CD1-CG 3.67Å; F148-M167 HydrophobicContact CD1-SD 4.45Å; F148-M167 HydrophobicContact CE1-CG 4.35Å; F148-M167 HydrophobicContact CG-CG 4.06Å; A161-M167 HydrophobicContact CB-CB 3.93Å; S163-M167 PolarHBondContact O-N 2.96Å; R164-M167 HydrophobicContact CG-CE 4.12Å; R164-M167 WeakPolarHBondContact O-CB 3.44Å; R164-M167 PolarHBondContact O-N 2.98Å; Q165-M167 VanDerWaalsContact C-N 3.32Å; Q165-M167 PolarHBondContact O-N 3.32Å; M167-Y169 VanDerWaalsContact C-N 3.33Å; M167-Y169 PolarHBondContact O-N 2.94Å; M167-W170 PolarHBondContact O-N 3.04Å; M167-L171 HydrophobicContact CE-CD1 4.34Å; M167-L171 HydrophobicContact CG-CD1 3.84Å; M167-L171 HydrophobicContact CG-CG 4.41Å; M167-L171 WeakPolarHBondContact O-CG 3.42Å; M167-L171 PolarHBondContact O-N 3.31Å
168	H	85.6	Confident	88.2	Confident	67 Å²	67	56.7 Å²	56.7	31%	0.31	27%	0.27	S	S	.	.	H	α-helix	trans	-61.6	-39.7	179.2	-73.6	-56.8	0	0	0	112.5	Y139 R164 Q165 L171 Q172	Y139-H168 AromaticContact CE2-CE1 3.99Å; Y139-H168 AromaticContact CZ-CE1 3.76Å; R164-H168 PolarHBondContact O-CD2 2.72Å; R164-H168 PolarHBondContact O-N 3.27Å; Q165-H168 PolarHBondContact O-N 2.98Å; H168-L171 PolarHBondContact O-N 2.92Å; H168-Q172 VanDerWaalsContact O-CB 3.27Å; H168-Q172 WeakPolarHBondContact O-CB 3.17Å; H168-Q172 PolarHBondContact O-N 3.45Å
169	Y	89.1	Confident	87.5	Confident	129 Å²	129	61.5 Å²	61.5	51%	0.506	29%	0.286	S	S	.	.	H	α-helix	trans	-57.3	-49.5	172.4	173.8	-94.8	0	0	0	112.2	L85 Q165 M167 L171 Q172 E173	L85-Y169 HydrophobicContact CD1-CE1 4.04Å; Q165-Y169 PolarHBondContact O-N 3.2Å; M167-Y169 VanDerWaalsContact C-N 3.33Å; M167-Y169 PolarHBondContact O-N 2.94Å; Y169-L171 PolarHBondContact O-N 2.89Å; Y169-Q172 PolarHBondContact O-N 3.15Å; Y169-E173 HydrophobicContact CD2-CG 4.47Å; Y169-E173 HydrophobicContact CE1-CG 4.3Å; Y169-E173 HydrophobicContact CE2-CG 4.01Å; Y169-E173 WeakPolarHBondContact O-CB 3.49Å; Y169-E173 PolarHBondContact O-N 3.1Å
170	W	92.1	Very high	86.8	Confident	9 Å²	9	64.7 Å²	64.7	3%	0.034	30%	0.301	C	S	.	.	H	α-helix	trans	-65	-39.2	178.4	-89.4	100	0	0	0	113.1	L85 L89 F106 L115 F148 V166 M167 L174	L85-W170 HydrophobicContact CD1-CE3 4.11Å; L85-W170 HydrophobicContact CD1-CH2 4.29Å; L85-W170 HydrophobicContact CD1-CZ3 3.98Å; L85-W170 HydrophobicContact CD2-CE3 4.09Å; L85-W170 HydrophobicContact CD2-CZ3 3.82Å; L85-W170 HydrophobicContact CG-CE3 4.16Å; L85-W170 HydrophobicContact CG-CH2 4.09Å; L85-W170 HydrophobicContact CG-CZ3 3.64Å; L89-W170 HydrophobicContact CD1-CD2 3.87Å; L89-W170 HydrophobicContact CD1-CE3 4.26Å; L89-W170 HydrophobicContact CD1-CG 4.15Å; L89-W170 HydrophobicContact CD1-CZ2 4.3Å; L89-W170 HydrophobicContact CD2-CG 4.31Å; L89-W170 HydrophobicContact CG-CD2 4.49Å; L89-W170 HydrophobicContact CG-CZ2 4.45Å; F106-W170 HydrophobicContact CB-CH2 3.93Å; L115-W170 HydrophobicContact CD1-CH2 4.5Å; L115-W170 HydrophobicContact CD1-CZ3 3.93Å; F148-W170 HydrophobicContact CZ-CB 4.25Å; V166-W170 PolarHBondContact O-N 3.36Å; M167-W170 PolarHBondContact O-N 3.04Å; W170-L174 HydrophobicContact CE3-CD1 4.02Å; W170-L174 HydrophobicContact CE3-CD2 4.44Å; W170-L174 HydrophobicContact CE3-CG 4.12Å; W170-L174 HydrophobicContact CZ3-CD2 4.47Å; W170-L174 VanDerWaalsContact O-CB 3.28Å; W170-L174 WeakPolarHBondContact O-CB 3.29Å; W170-L174 WeakPolarHBondContact O-CD1 3.45Å; W170-L174 WeakPolarHBondContact O-CG 3.29Å; W170-L174 PolarHBondContact O-N 3.28Å
171	L	89.4	Confident	86.1	Confident	14 Å²	14	64.5 Å²	64.5	7%	0.073	30%	0.299	C	S	.	.	H	α-helix	trans	-64	-47.5	175.9	-72.7	170.7	0	0	0	111.3	F137 Y139 F148 M167 H168 Y169 Q175	F137-L171 HydrophobicContact CB-CD2 3.79Å; F137-L171 HydrophobicContact CD1-CD2 4.24Å; F137-L171 HydrophobicContact CG-CD2 4.24Å; Y139-L171 HydrophobicContact CD1-CD1 3.64Å; Y139-L171 HydrophobicContact CE1-CD1 4.2Å; Y139-L171 HydrophobicContact CG-CD1 4.27Å; F148-L171 HydrophobicContact CB-CD1 4.45Å; F148-L171 HydrophobicContact CB-CD2 4.33Å; F148-L171 HydrophobicContact CD2-CD2 3.65Å; F148-L171 HydrophobicContact CD2-CG 4.23Å; F148-L171 HydrophobicContact CE2-CD2 4.22Å; F148-L171 HydrophobicContact CG-CD2 4.25Å; M167-L171 HydrophobicContact CE-CD1 4.34Å; M167-L171 HydrophobicContact CG-CD1 3.84Å; M167-L171 HydrophobicContact CG-CG 4.41Å; M167-L171 WeakPolarHBondContact O-CG 3.42Å; M167-L171 PolarHBondContact O-N 3.31Å; H168-L171 PolarHBondContact O-N 2.92Å; Y169-L171 PolarHBondContact O-N 2.89Å; L171-Q175 VanDerWaalsContact O-CB 3.23Å; L171-Q175 WeakPolarHBondContact O-CB 3.49Å; L171-Q175 PolarHBondContact O-N 3.41Å
172	Q	86.9	Confident	85.1	Confident	133 Å²	133	68 Å²	68	62%	0.621	32%	0.323	S	S	*	.	H	α-helix	trans	-60.6	-50.2	177.9	179	176.4	-19.4	0	0	111.4	H168 Y169 Q175 Q176	H168-Q172 VanDerWaalsContact O-CB 3.27Å; H168-Q172 WeakPolarHBondContact O-CB 3.17Å; H168-Q172 PolarHBondContact O-N 3.45Å; Y169-Q172 PolarHBondContact O-N 3.15Å; Q172-Q175 PolarHBondContact O-N 2.94Å; Q172-Q176 VanDerWaalsContact O-CB 3.25Å; Q172-Q176 WeakPolarHBondContact O-CB 3.24Å; Q172-Q176 PolarHBondContact O-N 3.21Å
173	E	89.6	Confident	83.9	Confident	45 Å²	45	67.5 Å²	67.5	21%	0.21	31%	0.314	C	S	.	.	H	α-helix	trans	-65.1	-42.3	-179.9	-83.3	-62.9	112.1	0	0	112.5	L85 Y169 Q175 Q176 K177	L85-E173 HydrophobicContact CD1-CB 3.77Å; L85-E173 HydrophobicContact CD1-CG 4.05Å; L85-E173 HydrophobicContact CD2-CB 3.83Å; L85-E173 HydrophobicContact CG-CB 4.41Å; Y169-E173 HydrophobicContact CD2-CG 4.47Å; Y169-E173 HydrophobicContact CE1-CG 4.3Å; Y169-E173 HydrophobicContact CE2-CG 4.01Å; Y169-E173 WeakPolarHBondContact O-CB 3.49Å; Y169-E173 PolarHBondContact O-N 3.1Å; E173-Q175 PolarHBondContact O-N 3.45Å; E173-Q176 PolarHBondContact O-N 2.89Å; E173-K177 VanDerWaalsContact O-CB 3.25Å; E173-K177 WeakPolarHBondContact O-CB 3.48Å; E173-K177 WeakPolarHBondContact O-CG 3.41Å; E173-K177 PolarHBondContact O-N 2.93Å; E173-K177 IonicContact OE2-NZ 3.92Å
174	L	88.9	Confident	82.6	Confident	0 Å²	0	70.6 Å²	70.6	0%	0	33%	0.332	C	S	.	.	H	α-helix	trans	-66.9	-36.8	176.9	-68.8	171.2	0	0	0	112.1	L85 Y108 L115 I132 F137 I150 W170 R178	L85-L174 HydrophobicContact CD2-CD2 3.72Å; L85-L174 HydrophobicContact CD2-CG 4.13Å; Y108-L174 HydrophobicContact CD2-CD2 4.45Å; L115-L174 HydrophobicContact CD1-CD2 4.06Å; L115-L174 HydrophobicContact CD2-CD1 4.06Å; L115-L174 HydrophobicContact CD2-CD2 3.98Å; L115-L174 HydrophobicContact CG-CD2 4.42Å; I132-L174 HydrophobicContact CD1-CD2 4.26Å; I132-L174 HydrophobicContact CG1-CD2 4.3Å; F137-L174 HydrophobicContact CE1-CB 3.74Å; F137-L174 HydrophobicContact CE1-CD1 4.12Å; F137-L174 HydrophobicContact CZ-CB 3.67Å; I150-L174 HydrophobicContact CD1-CD1 4.12Å; W170-L174 HydrophobicContact CE3-CD1 4.02Å; W170-L174 HydrophobicContact CE3-CD2 4.44Å; W170-L174 HydrophobicContact CE3-CG 4.12Å; W170-L174 HydrophobicContact CZ3-CD2 4.47Å; W170-L174 VanDerWaalsContact O-CB 3.28Å; W170-L174 WeakPolarHBondContact O-CB 3.29Å; W170-L174 WeakPolarHBondContact O-CD1 3.45Å; W170-L174 WeakPolarHBondContact O-CG 3.29Å; W170-L174 PolarHBondContact O-N 3.28Å; L174-R178 VanDerWaalsContact O-CB 3.3Å; L174-R178 WeakPolarHBondContact O-CB 3.27Å; L174-R178 PolarHBondContact O-N 3.45Å
175	Q	87.5	Confident	81	Confident	107 Å²	107	74.8 Å²	74.8	50%	0.5	35%	0.348	S	S	.	.	H	α-helix	trans	-67.5	-42.5	175	-178	171.3	-1.4	0	0	112	F137 L171 Q172 E173 R178 W179	F137-Q175 HydrophobicContact CE2-CB 4.34Å; L171-Q175 VanDerWaalsContact O-CB 3.23Å; L171-Q175 WeakPolarHBondContact O-CB 3.49Å; L171-Q175 PolarHBondContact O-N 3.41Å; Q172-Q175 PolarHBondContact O-N 2.94Å; E173-Q175 PolarHBondContact O-N 3.45Å; Q175-R178 PolarHBondContact O-N 3.02Å; Q175-W179 PolarHBondContact O-N 2.74Å; Q175-W179 VanDerWaalsContact O-N 3.08Å
176	Q	82.9	Confident	79.1	Confident	75 Å²	75	71.6 Å²	71.6	35%	0.35	35%	0.353	S	S	.	.	H	α-helix	trans	-62.9	-47	175.6	175.7	58.1	28.9	0	0	111.3	Q172 E173 R178 W179 E180	Q172-Q176 VanDerWaalsContact O-CB 3.25Å; Q172-Q176 WeakPolarHBondContact O-CB 3.24Å; Q172-Q176 PolarHBondContact O-N 3.21Å; E173-Q176 PolarHBondContact O-N 2.89Å; Q176-R178 PolarHBondContact O-N 2.97Å; Q176-W179 WeakPolarHBondContact O-CB 3.49Å; Q176-W179 PolarHBondContact O-N 3.47Å; Q176-E180 WeakPolarHBondContact CG-OE1 3.28Å; Q176-E180 PolarHBondContact NE2-OE1 3.16Å; Q176-E180 WeakPolarHBondContact O-CG 3.39Å; Q176-E180 PolarHBondContact O-N 2.94Å
177	K	85.1	Confident	76.9	Confident	37 Å²	37	75.4 Å²	75.4	16%	0.161	38%	0.377	C	S	.	.	H	α-helix	trans	-68.4	-33.2	179.7	-65.8	-82.3	158.4	-74.1	0	112.3	Y108 E173 E180 Y181	Y108-K177 HydrophobicContact CD1-CB 4.36Å; Y108-K177 HydrophobicContact CD1-CD 4.14Å; Y108-K177 HydrophobicContact CD1-CG 4.38Å; Y108-K177 HydrophobicContact CE1-CB 3.75Å; Y108-K177 HydrophobicContact CE1-CD 3.81Å; Y108-K177 HydrophobicContact CE1-CG 4.11Å; Y108-K177 HydrophobicContact CE2-CB 4.15Å; Y108-K177 PolarHBondContact OH-O 3.35Å; E173-K177 VanDerWaalsContact O-CB 3.25Å; E173-K177 WeakPolarHBondContact O-CB 3.48Å; E173-K177 WeakPolarHBondContact O-CG 3.41Å; E173-K177 PolarHBondContact O-N 2.93Å; E173-K177 IonicContact OE2-NZ 3.92Å; K177-E180 WeakPolarHBondContact CD-OE2 3.38Å; K177-E180 WeakPolarHBondContact CE-OE2 3.44Å; K177-E180 IonicContact NZ-OE1 3.37Å; K177-E180 PolarHBondContact NZ-OE1 2.83Å; K177-E180 IonicContact NZ-OE2 3.59Å; K177-E180 PolarHBondContact NZ-OE2 3.01Å; K177-Y181 WeakPolarHBondContact O-CB 3.47Å; K177-Y181 PolarHBondContact O-N 2.75Å
178	R	87.6	Confident	74.1	Confident	71 Å²	71	78.1 Å²	78.1	27%	0.268	41%	0.406	S	S	.	.	H	α-helix	trans	-60.5	-45.5	168.4	-175.5	-177.8	67.2	171	5.7	111.9	I132 G133 A135 L174 Q175 Q176 Y181 S182	I132-R178 HydrophobicContact CG2-CB 4.02Å; I132-R178 WeakPolarHBondContact O-CD 3.43Å; I132-R178 WeakPolarHBondContact O-CG 3.28Å; G133-R178 WeakPolarHBondContact O-CD 3.33Å; G133-R178 WeakPolarHBondContact O-CG 3.32Å; A135-R178 PolarHBondContact O-NH1 3.45Å; L174-R178 VanDerWaalsContact O-CB 3.3Å; L174-R178 WeakPolarHBondContact O-CB 3.27Å; L174-R178 PolarHBondContact O-N 3.45Å; Q175-R178 PolarHBondContact O-N 3.02Å; Q176-R178 PolarHBondContact O-N 2.97Å; R178-Y181 PolarHBondContact O-N 3.01Å; R178-S182 WeakPolarHBondContact O-CB 3.33Å; R178-S182 PolarHBondContact O-N 3.38Å
179	W	76.8	Confident	71.6	Confident	144 Å²	144	84.3 Å²	84.3	55%	0.545	43%	0.432	S	S	.	.	H	α-helix	trans	-65.6	-45.5	179.4	179.4	85.5	0	0	0	112	Q175 Q176 Y181 S182 N183	Q175-W179 PolarHBondContact O-N 2.74Å; Q175-W179 VanDerWaalsContact O-N 3.08Å; Q176-W179 WeakPolarHBondContact O-CB 3.49Å; Q176-W179 PolarHBondContact O-N 3.47Å; W179-Y181 PolarHBondContact O-N 2.69Å; W179-S182 PolarHBondContact O-N 2.99Å; W179-N183 WeakPolarHBondContact CZ2-ND2 3.5Å; W179-N183 PolarHBondContact O-N 3.11Å; W179-N183 VanDerWaalsContact O-N 3.09Å; W179-N183 PolarHBondContact O-ND2 3.09Å
180	E	79	Confident	68.6	Low	67 Å²	67	86 Å²	86	31%	0.313	44%	0.437	S	S	.	.	H	α-helix	trans	-55.2	-49	173	-73.8	166.7	-162	0	0	111.9	Q176 K177 N183 T184	Q176-E180 WeakPolarHBondContact CG-OE1 3.28Å; Q176-E180 PolarHBondContact NE2-OE1 3.16Å; Q176-E180 WeakPolarHBondContact O-CG 3.39Å; Q176-E180 PolarHBondContact O-N 2.94Å; K177-E180 WeakPolarHBondContact CD-OE2 3.38Å; K177-E180 WeakPolarHBondContact CE-OE2 3.44Å; K177-E180 IonicContact NZ-OE1 3.37Å; K177-E180 PolarHBondContact NZ-OE1 2.83Å; K177-E180 IonicContact NZ-OE2 3.59Å; K177-E180 PolarHBondContact NZ-OE2 3.01Å; E180-N183 PolarHBondContact O-N 3.3Å; E180-T184 WeakPolarHBondContact O-CB 3.48Å; E180-T184 PolarHBondContact O-N 3.41Å; E180-T184 PolarHBondContact O-OG1 3.38Å
181	Y	77.9	Confident	65.6	Low	48 Å²	48	92.2 Å²	92.2	19%	0.188	47%	0.471	C	S	.	.	H	α-helix	trans	-64.8	-42.7	179.6	179.9	-103.5	0	0	0	112.8	K112 C113 K177 R178 W179 N183 T184 R185	K112-Y181 PolarHBondContact O-OH 3.29Å; C113-Y181 HydrophobicContact CB-CD1 3.37Å; C113-Y181 HydrophobicContact CB-CD2 3.86Å; C113-Y181 HydrophobicContact CB-CE1 3.56Å; C113-Y181 HydrophobicContact CB-CE2 4.06Å; C113-Y181 HydrophobicContact CB-CG 3.49Å; C113-Y181 VanDerWaalsContact CB-CG 3.49Å; K177-Y181 WeakPolarHBondContact O-CB 3.47Å; K177-Y181 PolarHBondContact O-N 2.75Å; R178-Y181 PolarHBondContact O-N 3.01Å; W179-Y181 PolarHBondContact O-N 2.69Å; Y181-N183 PolarHBondContact O-N 3.07Å; Y181-T184 PolarHBondContact O-N 3.11Å; Y181-R185 PolarHBondContact O-N 3.03Å
182	S	71.4	Confident	62.9	Low	79 Å²	79	96.1 Å²	96.1	55%	0.552	50%	0.499	S	S	*	.	H	α-helix	trans	-57.4	-49.4	177.8	-170	0	0	0	0	111.3	R178 W179 T184 R185	R178-S182 WeakPolarHBondContact O-CB 3.33Å; R178-S182 PolarHBondContact O-N 3.38Å; W179-S182 PolarHBondContact O-N 2.99Å; S182-T184 VanDerWaalsContact C-N 3.33Å; S182-T184 PolarHBondContact O-N 3.38Å; S182-R185 PolarHBondContact O-N 2.93Å
183	N	61.8	Low	60	Low	91 Å²	91	100 Å²	100	49%	0.487	51%	0.508	S	S	.	.	H	α-helix	trans	-63.5	-36.3	177.1	-67	-21.8	0	0	0	112.7	W179 E180 Y181 R185	W179-N183 WeakPolarHBondContact CZ2-ND2 3.5Å; W179-N183 PolarHBondContact O-N 3.11Å; W179-N183 VanDerWaalsContact O-N 3.09Å; W179-N183 PolarHBondContact O-ND2 3.09Å; E180-N183 PolarHBondContact O-N 3.3Å; Y181-N183 PolarHBondContact O-N 3.07Å; N183-R185 VanDerWaalsContact C-N 3.31Å; N183-R185 PolarHBondContact O-N 2.96Å
184	T	60.6	Low	57	Low	97 Å²	97	102.6 Å²	102.6	60%	0.595	53%	0.531	S	S	*	.	H	α-helix	trans	-71.3	-26.3	-180	-52	0	0	0	0	112.4	E180 Y181 S182 G186 T187	E180-T184 WeakPolarHBondContact O-CB 3.48Å; E180-T184 PolarHBondContact O-N 3.41Å; E180-T184 PolarHBondContact O-OG1 3.38Å; Y181-T184 PolarHBondContact O-N 3.11Å; S182-T184 VanDerWaalsContact C-N 3.33Å; S182-T184 PolarHBondContact O-N 3.38Å; T184-G186 PolarHBondContact O-N 3.33Å; T184-T187 PolarHBondContact O-OG1 2.93Å
185	R	49.2	Very low	53.9	Low	162 Å²	162	107.1 Å²	107.1	61%	0.611	56%	0.563	S	S	*	*	G	3₁₀ helix	trans	-71.3	-12.6	-174	-153.3	175.6	-175.4	-171.5	2.9	114.1	Y181 S182 N183 T187	Y181-R185 PolarHBondContact O-N 3.03Å; S182-R185 PolarHBondContact O-N 2.93Å; N183-R185 VanDerWaalsContact C-N 3.31Å; N183-R185 PolarHBondContact O-N 2.96Å; R185-T187 VanDerWaalsContact C-N 3.29Å; R185-T187 PolarHBondContact O-N 3.44Å
186	G	42.2	Very low	51.1	Low	74 Å²	74	107 Å²	107	76%	0.763	57%	0.572	S	S	*	*	G	3₁₀ helix	trans	-72.9	-5.7	-176.8	0	0	0	0	0	116.6	T184	T184-G186 PolarHBondContact O-N 3.33Å
187	T	39.7	Very low	48.5	Very low	132 Å²	132	109.4 Å²	109.4	81%	0.81	59%	0.592	S	S	*	*	G	3₁₀ helix	trans	-110.2	5.4	-167.2	61.2	0	0	0	0	115.8	T184 R185	T184-T187 PolarHBondContact O-OG1 2.93Å; R185-T187 VanDerWaalsContact C-N 3.29Å; R185-T187 PolarHBondContact O-N 3.44Å
188	G	33.1	Very low	45.8	Very low	60 Å²	60	116.5 Å²	116.5	62%	0.619	63%	0.625	S	S	*	*	S	Bend	trans	-137.2	105.9	-169.7	0	0	0	0	0	115.9
189	K	33	Very low	42.9	Very low	197 Å²	197	117.2 Å²	117.2	86%	0.857	65%	0.646	S	S	*	*			trans	56.9	113.1	171.6	-71.5	-166.3	171	-165.9	0	117.6
190	R	26.8	Very low	40.8	Very low	165 Å²	165	118.9 Å²	118.9	62%	0.623	65%	0.654	S	S	*	*			trans	-143.4	82.3	154.3	-171.7	175.4	175.9	172.4	-2.1	110.7	W193 S194	R190-W193 PolarHBondContact NE-O 3.21Å; R190-W193 PolarHBondContact NH2-O 3.23Å; R190-S194 PolarHBondContact NH2-O 2.99Å
191	D	28	Very low	38.7	Very low	139 Å²	139	119.1 Å²	119.1	74%	0.743	66%	0.662	S	S	*	*			trans	-78.7	123.6	169.2	-67.6	-58.5	0	0	0	110.1
192	S	32.2	Very low	37.4	Very low	95 Å²	95	121.1 Å²	121.1	66%	0.664	68%	0.68	S	S	*	*	S	Bend	trans	65.1	163.5	176.9	-66.8	0	0	0	0	117.7
193	W	27.3	Very low	36.9	Very low	214 Å²	214	119.1 Å²	119.1	81%	0.811	67%	0.665	S	S	*	*	S	Bend	trans	64	79.3	-179.3	-54.2	107.3	0	0	0	115.6	R190	R190-W193 PolarHBondContact NE-O 3.21Å; R190-W193 PolarHBondContact NH2-O 3.23Å
194	S	27	Very low	37.5	Very low	100 Å²	100	115 Å²	115	70%	0.699	64%	0.644	S	S	*	*			trans	38.9	107.6	144.4	55	0	0	0	0	118.5	R190	R190-S194 PolarHBondContact NH2-O 2.99Å
195	S	22.4	Very low	38.4	Very low	95 Å²	95	111.9 Å²	111.9	66%	0.664	62%	0.624	S	S	*	*	P	Polyproline II helix	trans	-62.6	139.1	167.9	-47.9	0	0	0	0	112.6
196	P	29.3	Very low	39.8	Very low	106 Å²	106	104.9 Å²	104.9	69%	0.688	60%	0.599	S	S	*	*	P	Polyproline II helix		-86.1	116.6	129.5	31.3	-25.2	0	0	0	108	Q198	P196-Q198 PolarHBondContact O-N 2.7Å
197	T	27.9	Very low	40.4	Very low	125 Å²	125	102.7 Å²	102.7	77%	0.767	58%	0.576	S	S	*	*	P	Polyproline II helix	trans	-65.2	124.9	166.8	-53.6	0	0	0	0	107.6	A199	T197-A199 PolarHBondContact O-N 3.16Å
198	Q	28.1	Very low	40.6	Very low	185 Å²	185	105 Å²	105	86%	0.864	58%	0.575	S	S	*	*			trans	-76	80.1	179.7	-168.4	170.2	12.7	0	0	109.9	P196 Y200	P196-Q198 PolarHBondContact O-N 2.7Å; Q198-Y200 PolarHBondContact O-N 2.65Å
199	A	26.8	Very low	40.5	Very low	86 Å²	86	107.9 Å²	107.9	71%	0.711	58%	0.577	S	S	*	*	P	Polyproline II helix	trans	-61.3	125.9	175.3	0	0	0	0	0	109.9	T197	T197-A199 PolarHBondContact O-N 3.16Å
200	Y	32.8	Very low	40.3	Very low	179 Å²	179	103.6 Å²	103.6	70%	0.702	57%	0.571	S	S	*	*	P	Polyproline II helix	trans	-62.3	146.3	158.6	-61.5	-75.9	0	0	0	108.5	Q198	Q198-Y200 PolarHBondContact O-N 2.65Å
201	P	35	Very low	40.3	Very low	73 Å²	73	103.2 Å²	103.2	47%	0.474	58%	0.582	S	S	.	*	P	Polyproline II helix	trans	-56.8	133.7	173	23.4	-32.7	0	0	0	109.6	T203	P201-T203 PolarHBondContact O-N 3.33Å
202	P	51.2	Low	40.1	Very low	90 Å²	90	99.8 Å²	99.8	58%	0.584	57%	0.573	S	S	*	*	S	Bend	trans	-78.9	35.8	-168.7	34.3	-38.5	0	0	0	113.4	R716	P202-R716 PolarHBondContact O-NH2 3.5Å
203	T	61.1	Low	39.7	Very low	37 Å²	37	105.3 Å²	105.3	23%	0.227	59%	0.585	C	S	.	*	S	Bend	trans	-131	142.1	-162.4	-36.5	0	0	0	0	110.5	P201	P201-T203 PolarHBondContact O-N 3.33Å
204	G	74.6	Confident	39.5	Very low	5 Å²	5	103 Å²	103	5%	0.052	58%	0.581	C	S	.	*			trans	-67.5	164.6	172.6	0	0	0	0	0	113.7	V206 G207 L807 Y808 L809	G204-V206 VanDerWaalsContact C-N 3.26Å; G204-V206 PolarHBondContact O-N 2.91Å; G204-V206 VanDerWaalsContact O-N 3.14Å; G204-G207 PolarHBondContact O-N 3.3Å; G204-G207 VanDerWaalsContact O-N 3.09Å; G204-L807 CarbonylContact C-O 3.54Å; G204-L807 VanDerWaalsContact C-O 3.31Å; G204-Y808 VanDerWaalsContact CA-C 3.45Å; G204-Y808 PolarHBondContact N-O 3.28Å; G204-L809 VanDerWaalsContact CA-O 3.27Å; G204-L809 WeakPolarHBondContact CA-O 3.48Å
205	L	79.6	Confident	39.4	Very low	31 Å²	31	104.8 Å²	104.8	16%	0.162	59%	0.587	C	S	.	*	T	Hydrogen-bonded Turn	trans	-57.7	-30.3	-169.9	-69	160.7	0	0	0	115.1	H766 Y767 K777 L806 L807	L205-H766 HydrophobicContact CB-CB 4.23Å; L205-H766 HydrophobicContact CD1-CB 4.07Å; L205-H766 PolarHBondContact O-CE1 3.09Å; L205-H766 PolarHBondContact O-NE2 3.33Å; L205-Y767 HydrophobicContact CD1-CE1 4.25Å; L205-Y767 HydrophobicContact CD1-CE2 4.43Å; L205-Y767 VanDerWaalsContact CD1-OH 3.28Å; L205-Y767 WeakPolarHBondContact CD1-OH 3.41Å; L205-K777 HydrophobicContact CD2-CD 4.08Å; L205-K777 HydrophobicContact CG-CD 4.39Å; L205-L806 WeakPolarHBondContact CB-O 3.4Å; L205-L806 HydrophobicContact CD1-CB 3.98Å; L205-L806 WeakPolarHBondContact CD1-O 3.3Å; L205-L806 VanDerWaalsContact CG-O 3.28Å; L205-L806 WeakPolarHBondContact CG-O 3.3Å; L205-L806 PolarHBondContact N-O 3.34Å; L205-L807 HydrophobicContact CB-CD2 4.47Å; L205-L807 PolarHBondContact N-O 2.8Å
206	V	77.6	Confident	39.5	Very low	14 Å²	14	107.2 Å²	107.2	9%	0.085	59%	0.588	C	S	.	*	T	Hydrogen-bonded Turn	trans	-96.7	-17.6	-178.7	-166	0	0	0	0	111.9	G204 K208 V639 L807	G204-V206 VanDerWaalsContact C-N 3.26Å; G204-V206 PolarHBondContact O-N 2.91Å; G204-V206 VanDerWaalsContact O-N 3.14Å; V206-K208 PolarHBondContact O-N 3.25Å; V206-K208 VanDerWaalsContact O-N 3.09Å; V206-V639 WeakPolarHBondContact CG1-O 3.33Å; V206-L807 WeakPolarHBondContact CB-O 3.24Å; V206-L807 HydrophobicContact CG2-CB 3.69Å; V206-L807 HydrophobicContact CG2-CD2 3.58Å; V206-L807 HydrophobicContact CG2-CG 4.08Å; V206-L807 PolarHBondContact N-O 2.67Å
207	G	55.7	Low	39.2	Very low	29 Å²	29	111.3 Å²	111.3	30%	0.299	60%	0.595	S	S	.	*			trans	-60.4	119	173.7	0	0	0	0	0	109.1	G204	G204-G207 PolarHBondContact O-N 3.3Å; G204-G207 VanDerWaalsContact O-N 3.09Å
208	K	43.2	Very low	39	Very low	179 Å²	179	113.1 Å²	113.1	78%	0.778	60%	0.599	S	S	*	*			trans	-54.4	144	160.5	-65	177.6	-178.4	174.5	0	107.2	V206 S210	V206-K208 PolarHBondContact O-N 3.25Å; V206-K208 VanDerWaalsContact O-N 3.09Å; K208-S210 VanDerWaalsContact C-N 3.3Å; K208-S210 PolarHBondContact O-N 2.94Å
209	D	32	Very low	38.8	Very low	122 Å²	122	108.1 Å²	108.1	65%	0.652	59%	0.585	S	S	*	*			trans	-58.6	106	152.1	-65.4	-54	0	0	0	105.8	D211	D209-D211 PolarHBondContact O-N 2.92Å
210	S	27.8	Very low	38.9	Very low	106 Å²	106	112.1 Å²	112.1	74%	0.741	59%	0.594	S	S	*	*			trans	-56.8	126.3	160.1	-63.7	0	0	0	0	105.7	K208 A212	K208-S210 VanDerWaalsContact C-N 3.3Å; K208-S210 PolarHBondContact O-N 2.94Å; S210-A212 PolarHBondContact O-N 2.76Å
211	D	25.9	Very low	38.6	Very low	158 Å²	158	109 Å²	109	85%	0.845	60%	0.599	S	S	*	*			trans	-43.5	116.5	170.2	-74.6	-63.2	0	0	0	107.5	D209 F213	D209-D211 PolarHBondContact O-N 2.92Å; D211-F213 PolarHBondContact O-N 3.41Å
212	A	25.2	Very low	38.2	Very low	67 Å²	67	114.6 Å²	114.6	55%	0.554	62%	0.621	S	S	*	*			trans	-57.7	134.6	-167	0	0	0	0	0	107.9	S210 F214	S210-A212 PolarHBondContact O-N 2.76Å; A212-F214 HydrophobicContact CB-CD2 3.82Å; A212-F214 HydrophobicContact CB-CE2 4.06Å; A212-F214 PolarHBondContact O-N 3.3Å
213	F	23.8	Very low	37	Very low	211 Å²	211	119 Å²	119	93%	0.925	63%	0.634	S	S	*	*			trans	-64.7	79.7	157.2	-96	-86.8	0	0	0	106.9	D211 V215	D211-F213 PolarHBondContact O-N 3.41Å; F213-V215 PolarHBondContact O-N 2.85Å
214	F	22.1	Very low	35.3	Very low	164 Å²	164	126.1 Å²	126.1	72%	0.719	66%	0.661	S	S	*	*			trans	-58	96.2	164.5	-95	-89.4	0	0	0	105.6	A212 E216	A212-F214 HydrophobicContact CB-CD2 3.82Å; A212-F214 HydrophobicContact CB-CE2 4.06Å; A212-F214 PolarHBondContact O-N 3.3Å; F214-E216 HydrophobicContact CB-CB 4.34Å; F214-E216 PolarHBondContact O-N 3.12Å
215	V	26.5	Very low	33	Very low	138 Å²	138	131.6 Å²	131.6	84%	0.836	69%	0.694	S	S	*	*			trans	-68.2	69.2	151.2	-175.9	0	0	0	0	105.5	F213 K217	F213-V215 PolarHBondContact O-N 2.85Å; V215-K217 PolarHBondContact O-N 2.92Å
216	E	22.4	Very low	30.4	Very low	147 Å²	147	139.9 Å²	139.9	69%	0.687	72%	0.723	S	S	*	*			trans	-66.8	109	178.5	-175.9	165.8	-140.3	0	0	106.8	F214 L218	F214-E216 HydrophobicContact CB-CB 4.34Å; F214-E216 PolarHBondContact O-N 3.12Å; E216-L218 PolarHBondContact O-N 3.4Å
217	K	25	Very low	27.8	Very low	192 Å²	192	144.2 Å²	144.2	84%	0.835	75%	0.754	S	S	*	*			trans	-76.5	74.1	-174.5	-169.7	-175.5	177.4	-175	0	109.4	V215 S219	V215-K217 PolarHBondContact O-N 2.92Å; K217-S219 PolarHBondContact O-N 3.36Å
218	L	23.4	Very low	26.3	Very low	162 Å²	162	149.1 Å²	149.1	85%	0.848	77%	0.773	S	S	*	*			trans	-56.9	104.6	171.1	-101.8	166.5	0	0	0	109.2	E216	E216-L218 PolarHBondContact O-N 3.4Å
219	S	23.8	Very low	25.4	Very low	81 Å²	81	150.1 Å²	150.1	57%	0.566	78%	0.778	S	S	*	*			trans	-87.9	135	-177	55.8	0	0	0	0	112	K217 S221	K217-S219 PolarHBondContact O-N 3.36Å; S219-S221 PolarHBondContact O-N 2.68Å
220	D	28.7	Very low	25.1	Very low	169 Å²	169	148 Å²	148	90%	0.904	78%	0.777	S	S	*	*	S	Bend	trans	32.3	66	138.8	-53.2	-21.9	0	0	0	117
221	S	27.1	Very low	25	Very low	115 Å²	115	150.2 Å²	150.2	80%	0.804	78%	0.777	S	S	*	*			trans	-149.5	33.9	167.7	-167.4	0	0	0	0	114.7	S219	S219-S221 PolarHBondContact O-N 2.68Å
222	M	25.3	Very low	24.9	Very low	190 Å²	190	148.2 Å²	148.2	94%	0.936	77%	0.767	S	S	*	*	S	Bend	trans	-146.9	35.3	162.4	-150.3	151.9	74.3	0	0	115.1
223	E	25.7	Very low	24.8	Very low	183 Å²	183	150.7 Å²	150.7	86%	0.855	78%	0.775	S	S	*	*			trans	-89.7	153.6	154.1	-76.3	-153.2	136.9	0	0	111
224	K	25.6	Very low	24.8	Very low	185 Å²	185	148.5 Å²	148.5	80%	0.804	77%	0.768	S	S	*	*			trans	61	73.6	175.5	-65.3	-171	176.9	-178.6	0	117.2
225	V	25.9	Very low	25	Very low	120 Å²	120	148.5 Å²	148.5	73%	0.727	77%	0.772	S	S	*	*	S	Bend	trans	-124.8	98.9	132.2	-179.2	0	0	0	0	109.4
226	R	26.1	Very low	24.8	Very low	206 Å²	206	148.8 Å²	148.8	78%	0.777	77%	0.769	S	S	*	*			trans	62.4	120.2	169.4	-55.6	166.9	-175.8	133.9	0.8	116.8
227	S	23.8	Very low	25	Very low	105 Å²	105	145.8 Å²	145.8	73%	0.734	77%	0.769	S	S	*	*			cis	54.2	55.3	-10.3	-170.9	0	0	0	0	117.8
228	D	23.6	Very low	24.9	Very low	131 Å²	131	140.7 Å²	140.7	70%	0.701	77%	0.771	S	S	*	*			trans	-159	121.8	149.9	-84	-46	0	0	0	104
229	F	23.8	Very low	25	Very low	200 Å²	200	136.9 Å²	136.9	88%	0.877	77%	0.771	S	S	*	*			cis	-122.5	141.6	44.9	-80.7	-105.4	0	0	0	114.9
230	A	25.6	Very low	25	Very low	77 Å²	77	141.3 Å²	141.3	64%	0.636	79%	0.785	S	S	*	*				32.2	141.7	119.7	0	0	0	0	0	121.5
231	M	25.2	Very low	24.8	Very low	153 Å²	153	139.5 Å²	139.5	75%	0.754	78%	0.78	S	S	*	*			cis	-162	164.8	2.9	-93.7	-115.6	79.9	0	0	112.3
232	D	23.9	Very low	24.7	Very low	117 Å²	117	137 Å²	137	63%	0.626	77%	0.773	S	S	*	*			trans	80.2	127.4	143.5	-68.7	-18	0	0	0	126
233	T	24.5	Very low	24.7	Very low	118 Å²	118	135.2 Å²	135.2	72%	0.724	77%	0.765	S	S	*	*			trans	70.7	139.6	143.1	53	0	0	0	0	121.8
234	E	23.7	Very low	24.6	Very low	166 Å²	166	134.7 Å²	134.7	78%	0.776	76%	0.763	S	S	*	*			cis	-170.6	176.7	-25.3	-138.3	175.9	-145.3	0	0	111.3
235	M	25.2	Very low	24.5	Very low	163 Å²	163	131.1 Å²	131.1	80%	0.803	76%	0.761	S	S	*	*			trans	69.1	147.7	165	-53.1	-163.4	81.4	0	0	120.6
236	D	23.4	Very low	24.4	Very low	145 Å²	145	128.9 Å²	128.9	78%	0.775	76%	0.755	S	S	*	*			cis	-158.1	163.8	-36.4	-159.9	15.3	0	0	0	112.5
237	A	24.8	Very low	24.4	Very low	84 Å²	84	130.7 Å²	130.7	69%	0.694	76%	0.762	S	S	*	*			trans	-2.4	129.9	166.4	0	0	0	0	0	123.5
238	G	24.5	Very low	24.4	Very low	84 Å²	84	128.9 Å²	128.9	87%	0.866	76%	0.76	S	S	*	*				107.8	150.6	96.5	0	0	0	0	0	119.2
239	G	24.6	Very low	25	Very low	83 Å²	83	128.8 Å²	128.8	86%	0.856	77%	0.766	S	S	*	*			trans	155.8	77.2	168.8	0	0	0	0	0	118.9
240	M	24.7	Very low	25.1	Very low	173 Å²	173	128.8 Å²	128.8	85%	0.852	77%	0.766	S	S	*	*			trans	-38.9	148.1	170	-77.6	166.7	56.1	0	0	120.8
241	V	24.8	Very low	25	Very low	132 Å²	132	130.7 Å²	130.7	80%	0.8	78%	0.775	S	S	*	*			trans	68.7	123.2	133	174.9	0	0	0	0	121.5
242	G	24.2	Very low	25	Very low	63 Å²	63	130.5 Å²	130.5	65%	0.649	78%	0.776	S	S	*	*				133.9	124.6	115.6	0	0	0	0	0	122
243	I	25.1	Very low	25.2	Very low	151 Å²	151	134.5 Å²	134.5	77%	0.774	79%	0.788	S	S	*	*			trans	76.2	113.5	138.4	-61.5	173.9	0	0	0	120.2
244	Q	23.3	Very low	25.5	Very low	173 Å²	173	136.1 Å²	136.1	81%	0.808	79%	0.792	S	S	*	*			trans	39.3	135.3	140	-49.5	173.7	20.3	0	0	119.7
245	S	23.4	Very low	25.4	Very low	110 Å²	110	138.4 Å²	138.4	77%	0.769	80%	0.8	S	S	*	*				173.3	171.6	56.8	-158.5	0	0	0	0	113.2
246	A	23.6	Very low	25.5	Very low	73 Å²	73	133.4 Å²	133.4	60%	0.603	79%	0.79	S	S	*	*			trans	70.6	115.7	146.9	0	0	0	0	0	123.2
247	R	25.6	Very low	25.9	Very low	243 Å²	243	132.6 Å²	132.6	92%	0.917	79%	0.791	S	S	*	*			trans	70.7	125.6	130.4	-63.3	175.9	-177.2	-177.4	0.6	121
248	G	24.5	Very low	26	Very low	67 Å²	67	136.7 Å²	136.7	69%	0.691	80%	0.795	S	S	*	*			trans	-77.7	-169.4	146.5	0	0	0	0	0	112
249	P	35.8	Very low	26	Very low	129 Å²	129	139.9 Å²	139.9	84%	0.838	79%	0.792	S	S	*	*				-146.6	-174.5	56.2	41.9	-23.2	0	0	0	116.3
250	F	26.7	Very low	26.1	Very low	201 Å²	201	145.6 Å²	145.6	88%	0.882	79%	0.788	S	S	*	*			trans	-66.1	159.1	169.3	-53.8	-101	0	0	0	113.9
251	S	23.5	Very low	26.2	Very low	117 Å²	117	143.7 Å²	143.7	82%	0.818	78%	0.781	S	S	*	*			trans	-159.5	160.2	138.9	-162.6	0	0	0	0	112.5
252	L	25.7	Very low	26.3	Very low	148 Å²	148	142 Å²	142	78%	0.775	78%	0.775	S	S	*	*			trans	-107.9	160.3	177.7	-43.3	89.9	0	0	0	111.1
253	K	26.7	Very low	26.2	Very low	202 Å²	202	147.1 Å²	147.1	88%	0.878	78%	0.784	S	S	*	*				171.1	157.2	115.1	-93.8	167	-176.2	179.2	0	114.6
254	N	30.6	Very low	26.2	Very low	152 Å²	152	143.5 Å²	143.5	81%	0.813	77%	0.772	S	S	*	*			trans	-72.4	160.4	171.8	-50.5	-8.1	0	0	0	112
255	F	23.3	Very low	26.2	Very low	213 Å²	213	142 Å²	142	93%	0.934	77%	0.77	S	S	*	*				-162.6	170.5	124.3	-123.7	-87.4	0	0	0	110.7
256	G	27.3	Very low	26.3	Very low	58 Å²	58	144.5 Å²	144.5	60%	0.598	77%	0.773	S	S	*	*			trans	-158.7	155	176.1	0	0	0	0	0	113.6
257	T	31.7	Very low	26.3	Very low	129 Å²	129	151.5 Å²	151.5	79%	0.791	78%	0.784	S	S	*	*			trans	-174.3	157.6	-171.6	32	0	0	0	0	106.9
258	E	25.3	Very low	26.5	Very low	169 Å²	169	145.9 Å²	145.9	79%	0.79	78%	0.779	S	S	*	*			cis	-156.3	-167.3	-3.9	-132	-175.7	135.7	0	0	110.6
259	L	26.5	Very low	26.4	Very low	152 Å²	152	146.2 Å²	146.2	80%	0.796	78%	0.783	S	S	*	*			trans	-138	133.6	-164.6	-135.5	177.2	0	0	0	114.5
260	R	26.6	Very low	25.9	Very low	203 Å²	203	149 Å²	149	77%	0.766	78%	0.777	S	S	*	*			trans	172	158.5	155.1	-103	173.2	-86.1	-157.6	-5.6	110.9
261	N	25.2	Very low	25.8	Very low	132 Å²	132	145.4 Å²	145.4	71%	0.706	77%	0.771	S	S	*	*			cis	-135.5	146.8	2.7	-86.3	-50	0	0	0	108.2
262	S	26.7	Very low	25.9	Very low	97 Å²	97	145.9 Å²	145.9	68%	0.678	76%	0.76	S	S	*	*				44.7	135.6	88	-69.4	0	0	0	0	116.1
263	M	23.2	Very low	25.8	Very low	170 Å²	170	144.2 Å²	144.2	84%	0.837	75%	0.752	S	S	*	*			cis	-171.7	171.7	1.2	-105.5	-164.1	-61.6	0	0	107.9
264	S	24.3	Very low	25.9	Very low	75 Å²	75	144.9 Å²	144.9	52%	0.524	75%	0.749	S	S	.	*			cis	-179.3	165.2	-15	56.8	0	0	0	0	110.9
265	N	24.4	Very low	25.6	Very low	143 Å²	143	149.9 Å²	149.9	77%	0.765	76%	0.756	S	S	*	*			trans	71.8	154.6	151.5	-64.9	-22.8	0	0	0	119
266	L	24.4	Very low	25.6	Very low	161 Å²	161	145.1 Å²	145.1	84%	0.843	75%	0.749	S	S	*	*			cis	-155.2	-176.3	-1.1	-123.6	168.7	0	0	0	111.9
267	R	25.1	Very low	25.4	Very low	221 Å²	221	148.2 Å²	148.2	83%	0.834	76%	0.757	S	S	*	*			trans	-136.7	148.8	-170.6	-168.7	-168.7	-166.3	-174.4	9.6	113.6
268	P	28.7	Very low	25	Very low	125 Å²	125	150.8 Å²	150.8	81%	0.812	76%	0.757	S	S	*	*			trans	-131.2	170.3	134.6	35.1	-22.3	0	0	0	111.4
269	G	23.1	Very low	25	Very low	74 Å²	74	152.7 Å²	152.7	76%	0.763	76%	0.758	S	S	*	*			cis	124.7	136	6.6	0	0	0	0	0	110.3
270	R	25.8	Very low	25.2	Very low	188 Å²	188	151.6 Å²	151.6	71%	0.709	76%	0.758	S	S	*	*			cis	-167.1	179	0.3	-163.6	-156.1	165.6	-72.5	-4.4	108.4	E272	R270-E272 IonicContact CZ-OE1 2.95Å; R270-E272 IonicContact NH1-OE1 3.37Å; R270-E272 PolarHBondContact NH1-OE1 3.29Å; R270-E272 IonicContact NH2-OE1 2.75Å; R270-E272 PolarHBondContact NH2-OE1 2.89Å
271	V	24.4	Very low	25.6	Very low	124 Å²	124	145 Å²	145	75%	0.752	75%	0.754	S	S	*	*			trans	80	149	168	-173.9	0	0	0	0	115.1
272	E	24.8	Very low	25.5	Very low	127 Å²	127	145.5 Å²	145.5	59%	0.593	76%	0.756	S	S	*	*				-172.9	-172.2	-50.6	-113.5	-175.5	-108.7	0	0	108	R270	R270-E272 IonicContact CZ-OE1 2.95Å; R270-E272 IonicContact NH1-OE1 3.37Å; R270-E272 PolarHBondContact NH1-OE1 3.29Å; R270-E272 IonicContact NH2-OE1 2.75Å; R270-E272 PolarHBondContact NH2-OE1 2.89Å
273	N	24.4	Very low	25.4	Very low	113 Å²	113	147.4 Å²	147.4	60%	0.604	75%	0.754	S	S	*	*			cis	-141.2	-91	13.2	-175.9	-106.2	0	0	0	114
274	R	27.8	Very low	25.5	Very low	217 Å²	217	145.9 Å²	145.9	82%	0.819	75%	0.75	S	S	*	*			trans	-157	140	-162.7	-65.6	170	172.8	177.4	-4.8	117
275	R	24.1	Very low	25.5	Very low	257 Å²	257	147.4 Å²	147.4	97%	0.97	76%	0.76	S	S	*	*				-161.1	168.2	119.7	-110.4	-177.7	-177.3	-168	0.9	110
276	S	24.7	Very low	25.4	Very low	112 Å²	112	145 Å²	145	78%	0.783	75%	0.754	S	S	*	*			trans	-124.4	-174.9	-170.2	-172.9	0	0	0	0	111.1
277	V	22.8	Very low	25.3	Very low	124 Å²	124	140.7 Å²	140.7	75%	0.752	74%	0.738	S	S	*	*			trans	86.9	124.1	-178.6	-179.6	0	0	0	0	113.6
278	F	22.2	Very low	25.2	Very low	182 Å²	182	138.5 Å²	138.5	80%	0.798	74%	0.737	S	S	*	*			cis	-160.5	179.3	-14.9	-128	-93.2	0	0	0	108.2
279	Y	25.7	Very low	24.9	Very low	209 Å²	209	138.9 Å²	138.9	82%	0.82	73%	0.728	S	S	*	*			trans	73.7	166.3	170.9	-104.4	-92.4	0	0	0	118.8
280	T	31.3	Very low	24.9	Very low	129 Å²	129	147.5 Å²	147.5	79%	0.791	74%	0.738	S	S	*	*			trans	-134.2	131.7	-135.9	51.7	0	0	0	0	115
281	G	34.2	Very low	24.8	Very low	66 Å²	66	147.5 Å²	147.5	68%	0.68	75%	0.746	S	S	*	*			trans	152.2	155.3	-175	0	0	0	0	0	107
282	N	24	Very low	24.8	Very low	141 Å²	141	149.9 Å²	149.9	75%	0.754	75%	0.751	S	S	*	*			trans	62.2	155.7	-165.8	-70	-8.2	0	0	0	113.6
283	H	24.2	Very low	24.7	Very low	138 Å²	138	150.7 Å²	150.7	64%	0.639	76%	0.764	S	S	*	*			cis	-152.4	170.9	-9.5	-118.4	-32.9	0	0	0	110.7
284	N	25.3	Very low	24.6	Very low	138 Å²	138	152.7 Å²	152.7	74%	0.738	78%	0.775	S	S	*	*				2.1	155.8	129.1	-49.7	19.2	0	0	0	116.8
285	S	23.5	Very low	24.7	Very low	107 Å²	107	147.2 Å²	147.2	75%	0.748	78%	0.776	S	S	*	*			cis	-157.5	-173.5	36.1	76.6	0	0	0	0	112.2
286	S	22.7	Very low	24.9	Very low	91 Å²	91	140.5 Å²	140.5	64%	0.636	77%	0.766	S	S	*	*			cis	-167.5	147.9	1.5	22.9	0	0	0	0	108.2
287	S	22.4	Very low	25.3	Very low	72 Å²	72	140.4 Å²	140.4	50%	0.503	76%	0.762	S	S	.	*			trans	51.5	159.6	152.5	-55.2	0	0	0	0	118.6	E289	S287-E289 WeakPolarHBondContact CB-OE2 3.26Å; S287-E289 PolarHBondContact OG-OE2 3.49Å
288	E	22.7	Very low	25.5	Very low	175 Å²	175	143.1 Å²	143.1	82%	0.818	76%	0.764	S	S	*	*			cis	-122.2	164.1	2.1	-69	78.9	-119.3	0	0	111
289	E	22.5	Very low	25.5	Very low	132 Å²	132	140.9 Å²	140.9	62%	0.617	76%	0.761	S	S	*	*			cis	-165	-178.9	-43.8	-139.9	71.3	-70.1	0	0	108.2	S287	S287-E289 WeakPolarHBondContact CB-OE2 3.26Å; S287-E289 PolarHBondContact OG-OE2 3.49Å
290	W	23.8	Very low	25.4	Very low	255 Å²	255	139.6 Å²	139.6	97%	0.966	76%	0.759	S	S	*	*			trans	-141	138	177.7	-77	99.4	0	0	0	114.1
291	E	23	Very low	24.9	Very low	188 Å²	188	139.2 Å²	139.2	88%	0.879	76%	0.757	S	S	*	*			trans	-119.7	146.1	171.3	-169.8	170.5	-133.8	0	0	109.5
292	M	23.8	Very low	24.4	Very low	175 Å²	175	143.4 Å²	143.4	86%	0.862	76%	0.759	S	S	*	*			trans	-110.5	147	-176.4	-77.8	-168.6	-66.4	0	0	112.6
293	V	23.4	Very low	24.2	Very low	144 Å²	144	145 Å²	145	87%	0.873	76%	0.762	S	S	*	*			trans	-137.6	135.9	161.5	-179.5	0	0	0	0	109
294	D	22.3	Very low	24.1	Very low	154 Å²	154	147.5 Å²	147.5	82%	0.824	77%	0.771	S	S	*	*			trans	-78.6	168.2	-169.1	-69.2	-70.1	0	0	0	116.4
295	A	29.2	Very low	24.3	Very low	102 Å²	102	145.6 Å²	145.6	84%	0.843	77%	0.766	S	S	*	*			trans	-121	123.6	167	0	0	0	0	0	111.7
296	P	28.7	Very low	24.2	Very low	116 Å²	116	148 Å²	148	75%	0.753	77%	0.765	S	S	*	*			trans	-118.4	177.8	173.8	45.2	-35	0	0	0	111.7
297	P	34.8	Very low	24.3	Very low	110 Å²	110	149.3 Å²	149.3	71%	0.714	76%	0.764	S	S	*	*				-140.9	-176.9	-81.8	39.2	-19.5	0	0	0	115.3
298	K	26.3	Very low	24.3	Very low	182 Å²	182	152 Å²	152	79%	0.791	77%	0.773	S	S	*	*			trans	72.1	163.8	155.9	-79.5	176.4	-176.9	-178.8	0	117.6
299	D	22.9	Very low	24.4	Very low	135 Å²	135	149 Å²	149	72%	0.722	77%	0.767	S	S	*	*			cis	-142	-179	16.6	-127.4	-35.8	0	0	0	115.8
300	F	22	Very low	24.6	Very low	181 Å²	181	150.1 Å²	150.1	79%	0.794	77%	0.772	S	S	*	*			trans	-81.2	176.4	178.6	-75.2	-105.6	0	0	0	112.7
301	T	22.5	Very low	24.6	Very low	121 Å²	121	148.3 Å²	148.3	74%	0.742	77%	0.765	S	S	*	*			cis	-165.9	155	45.2	38.5	0	0	0	0	114.5
302	E	21.8	Very low	24.8	Very low	155 Å²	155	147.6 Å²	147.6	72%	0.724	76%	0.761	S	S	*	*			trans	33.4	156.7	133.8	-52.1	-162.4	157	0	0	122.6
303	Q	21.5	Very low	24.8	Very low	173 Å²	173	144.1 Å²	144.1	81%	0.808	75%	0.754	S	S	*	*			cis	-156	-163.9	26.8	-144.8	163.6	76.6	0	0	113.2
304	K	20.7	Very low	25	Very low	192 Å²	192	147 Å²	147	84%	0.835	76%	0.756	S	S	*	*			trans	-122.9	-170.4	-172.2	-133.3	-179.3	-175.8	178.5	0	108.7
305	P	30.1	Very low	25	Very low	97 Å²	97	142.7 Å²	142.7	63%	0.63	75%	0.747	S	S	*	*			cis	-147.6	-157.4	-3.4	45.8	-24.3	0	0	0	116.6
306	H	22.3	Very low	25	Very low	157 Å²	157	144 Å²	144	73%	0.727	75%	0.75	S	S	*	*			trans	70.2	150.7	155.4	-89.9	-118.7	0	0	0	119.5
307	L	23.9	Very low	24.9	Very low	120 Å²	120	141.8 Å²	141.8	63%	0.628	74%	0.742	S	S	*	*			cis	-168.4	-175.9	-29.1	-148	76.1	0	0	0	110.3
308	D	22.5	Very low	24.4	Very low	129 Å²	129	146.4 Å²	146.4	69%	0.69	75%	0.751	S	S	*	*			trans	79.6	144.2	153	-75.3	-46.4	0	0	0	120.4
309	T	24.7	Very low	24.4	Very low	111 Å²	111	142.5 Å²	142.5	68%	0.681	74%	0.742	S	S	*	*			cis	-167.4	175	-23.9	-121.4	0	0	0	0	111.7
310	Q	25.9	Very low	24.5	Very low	156 Å²	156	145.7 Å²	145.7	73%	0.729	75%	0.75	S	S	*	*			trans	91.5	112.6	177.7	-49.2	-160.2	15.8	0	0	114.1
311	R	24.8	Very low	24.8	Very low	217 Å²	217	143.1 Å²	143.1	82%	0.819	75%	0.745	S	S	*	*				72.7	136.1	68.1	-69.5	179.7	179.1	-178.1	0.7	111.5
312	H	27	Very low	25	Very low	172 Å²	172	145.8 Å²	145.8	80%	0.796	75%	0.746	S	S	*	*			cis	-124.1	176.3	35.6	-85	-105.1	0	0	0	116.4
313	S	24.3	Very low	25.3	Very low	102 Å²	102	142.5 Å²	142.5	71%	0.713	74%	0.737	S	S	*	*			trans	-138.2	150.6	-173.1	167.5	0	0	0	0	110.5
314	F	26.5	Very low	25.7	Very low	206 Å²	206	144.3 Å²	144.3	90%	0.904	74%	0.736	S	S	*	*			trans	-141.7	157.3	154.6	-90.9	-72.9	0	0	0	111.2
315	G	23.3	Very low	25.8	Very low	63 Å²	63	141.7 Å²	141.7	65%	0.649	73%	0.731	S	S	*	*			trans	-73.4	168.7	-169.9	0	0	0	0	0	115.4
316	S	28.6	Very low	25.7	Very low	129 Å²	129	147 Å²	147	90%	0.902	74%	0.739	S	S	*	*			cis	71.1	136.7	47.3	-161.3	0	0	0	0	112.1
317	A	25.9	Very low	26	Very low	70 Å²	70	149 Å²	149	58%	0.579	75%	0.749	S	S	*	*			cis	-132.1	-173.9	12.9	0	0	0	0	0	111.5
318	F	24.4	Very low	26.3	Very low	206 Å²	206	153 Å²	153	90%	0.904	76%	0.755	S	S	*	*				-148.9	164.8	61	-106.9	-90.2	0	0	0	114.6
319	T	27.6	Very low	26.9	Very low	100 Å²	100	153 Å²	153	61%	0.613	76%	0.762	S	S	*	*			trans	-123.3	170.7	-176.7	54.1	0	0	0	0	111.5
320	F	23.7	Very low	27	Very low	203 Å²	203	154.5 Å²	154.5	89%	0.89	76%	0.761	S	S	*	*			trans	-139.5	136.6	143	-114.9	-81.7	0	0	0	110.7
321	D	28.4	Very low	27	Very low	126 Å²	126	157.1 Å²	157.1	67%	0.674	77%	0.765	S	S	*	*			trans	-103.3	170.5	179.5	-87	-71.6	0	0	0	110.8
322	F	27.4	Very low	27	Very low	178 Å²	178	152.8 Å²	152.8	78%	0.781	76%	0.757	S	S	*	*				-166.3	120.3	113.5	-117.4	-126.7	0	0	0	112.9
323	V	27.3	Very low	27	Very low	85 Å²	85	151.2 Å²	151.2	52%	0.515	75%	0.754	S	S	.	*				59.3	125.7	116.7	167.2	0	0	0	0	117.4
324	R	29.6	Very low	27.1	Very low	211 Å²	211	153.3 Å²	153.3	80%	0.796	76%	0.756	S	S	*	*			cis	-157.5	-170.5	11.9	-122.1	172.1	-155.2	128.8	1.9	108
325	N	24.8	Very low	27.1	Very low	138 Å²	138	153.5 Å²	153.5	74%	0.738	75%	0.751	S	S	*	*			cis	-150.4	-166.3	10.6	-153.6	3.9	0	0	0	111.8
326	R	27.3	Very low	27.2	Very low	208 Å²	208	157.6 Å²	157.6	79%	0.785	76%	0.758	S	S	*	*			trans	-149.6	161.2	170.1	-73.1	-179.4	166.5	178.5	-2.5	112.5
327	Q	28.4	Very low	27.3	Very low	200 Å²	200	156.3 Å²	156.3	94%	0.935	75%	0.745	S	S	*	*				-169.7	-178.6	114.7	-99.8	177.4	18.2	0	0	113.2
328	R	30.9	Very low	27.4	Very low	202 Å²	202	164.2 Å²	164.2	76%	0.762	76%	0.759	S	S	*	*			trans	-124.4	151.4	-153.3	-81.4	179.5	168.9	173.8	-4.9	115.9
329	P	34.5	Very low	27.4	Very low	129 Å²	129	157.5 Å²	157.5	84%	0.838	75%	0.748	S	S	*	*			trans	-100.5	179.9	134.7	-17.4	34.9	0	0	0	114.8
330	Q	25.7	Very low	28.2	Very low	143 Å²	143	159.4 Å²	159.4	67%	0.668	76%	0.762	S	S	*	*			trans	-168.5	140.5	-156.5	174.4	169.2	-110.5	0	0	117.2
331	R	26.1	Very low	28.4	Very low	212 Å²	212	153.4 Å²	153.4	80%	0.8	76%	0.757	S	S	*	*			trans	73.4	162.5	162.2	-71.6	172.1	168.3	-159.4	-3.2	118.3
332	L	24.7	Very low	28.6	Very low	125 Å²	125	156.5 Å²	156.5	65%	0.654	77%	0.765	S	S	*	*			cis	-168.1	157.8	-14.3	-104.6	167.5	0	0	0	114
333	L	27.6	Very low	28.6	Very low	139 Å²	139	158.1 Å²	158.1	73%	0.728	77%	0.772	S	S	*	*			trans	65.3	130.1	143.2	-67.3	170.9	0	0	0	125.9
334	L	27	Very low	28.6	Very low	146 Å²	146	158 Å²	158	76%	0.764	78%	0.78	S	S	*	*				127.7	136.4	111.6	-136.4	74.2	0	0	0	120.7
335	R	26.9	Very low	28.7	Very low	210 Å²	210	160.1 Å²	160.1	79%	0.792	79%	0.788	S	S	*	*			trans	89.3	89.4	138.1	-146.1	172.7	-162.1	170	4.8	123.8
336	D	25.6	Very low	28.7	Very low	150 Å²	150	156.9 Å²	156.9	80%	0.802	79%	0.787	S	S	*	*				51.9	159	102.6	-162.2	25.6	0	0	0	123.3
337	V	29.7	Very low	28.9	Very low	102 Å²	102	153.6 Å²	153.6	62%	0.618	79%	0.79	S	S	*	*			trans	107.2	97.5	158.1	-171.6	0	0	0	0	120.9
338	R	27.1	Very low	28.9	Very low	236 Å²	236	151.6 Å²	151.6	89%	0.891	78%	0.78	S	S	*	*			trans	69.1	139.3	132.2	-160.9	173.8	-71.7	-166	-2.5	122.7
339	G	25.6	Very low	28.7	Very low	65 Å²	65	152 Å²	152	67%	0.67	78%	0.782	S	S	*	*			trans	-89.5	-141.2	172.1	0	0	0	0	0	114.4
340	P	44.6	Very low	28.4	Very low	140 Å²	140	157.6 Å²	157.6	91%	0.909	79%	0.786	S	S	*	*			cis	-143	-159.4	14.8	45.6	-26.1	0	0	0	115
341	G	27.8	Very low	28.6	Very low	76 Å²	76	153.8 Å²	153.8	78%	0.784	79%	0.785	S	S	*	*			trans	139.2	132.1	147	0	0	0	0	0	118.5
342	K	31.5	Very low	28.8	Very low	191 Å²	191	150.2 Å²	150.2	83%	0.83	79%	0.793	S	S	*	*			trans	-125.6	153.1	167	-63.9	179.5	-179.4	178.9	0	109.5
343	F	28.2	Very low	29	Very low	212 Å²	212	148 Å²	148	93%	0.93	80%	0.801	S	S	*	*				175.8	-177.9	122	-96	-65.1	0	0	0	111.4
344	A	27.6	Very low	29.2	Very low	84 Å²	84	146.8 Å²	146.8	69%	0.694	80%	0.804	S	S	*	*			trans	-148.2	167.3	-156.4	0	0	0	0	0	115.7
345	R	30.4	Very low	30.1	Very low	255 Å²	255	145 Å²	145	96%	0.962	80%	0.801	S	S	*	*			trans	66.6	132.4	176.1	-46.8	-179.3	-174.5	-168.6	2	113.6
346	G	26	Very low	30.5	Very low	69 Å²	69	141.7 Å²	141.7	71%	0.711	80%	0.804	S	S	*	*			cis	138	166.8	22.4	0	0	0	0	0	109.1
347	V	30.2	Very low	30.8	Very low	139 Å²	139	138.4 Å²	138.4	84%	0.842	81%	0.806	S	S	*	*			trans	85.7	117.5	157.2	-173.9	0	0	0	0	120.1
348	E	28.4	Very low	31.4	Very low	158 Å²	158	142.9 Å²	142.9	74%	0.738	82%	0.82	S	S	*	*			trans	72.8	109.4	147.7	-77.9	-173.6	-146.6	0	0	127.1
349	R	28.4	Very low	31.8	Very low	212 Å²	212	137 Å²	137	80%	0.8	81%	0.813	S	S	*	*				65	138.7	111.1	-99.4	178.2	171.3	-178.5	-2	123.3
350	R	27.9	Very low	32.7	Very low	245 Å²	245	141.2 Å²	141.2	93%	0.925	82%	0.821	S	S	*	*			trans	70.9	143.5	171.7	-53.7	-175.9	-173.5	-139.2	3.4	114.5
351	G	28.4	Very low	32.9	Very low	63 Å²	63	136.7 Å²	136.7	65%	0.649	80%	0.8	S	S	*	*			cis	164	158.5	-9.3	0	0	0	0	0	113.3
352	S	31.2	Very low	33.9	Very low	138 Å²	138	137.8 Å²	137.8	97%	0.965	80%	0.796	S	S	*	*			trans	68.2	158.4	-177.6	78.9	0	0	0	0	116.3
353	G	28.1	Very low	34.6	Very low	79 Å²	79	136.6 Å²	136.6	81%	0.814	79%	0.79	S	S	*	*			trans	112.5	58.1	167	0	0	0	0	0	118.5
354	S	32.2	Very low	35.5	Very low	112 Å²	112	130.4 Å²	130.4	78%	0.783	77%	0.773	S	S	*	*			trans	-91.9	146.9	145.1	61.3	0	0	0	0	107.9
355	P	46.2	Very low	36.7	Very low	108 Å²	108	132.2 Å²	132.2	70%	0.701	77%	0.771	S	S	*	*			cis	-146.1	176.5	47.8	40.5	-20.9	0	0	0	117.6
356	T	35.9	Very low	37.7	Very low	142 Å²	142	124.9 Å²	124.9	87%	0.871	75%	0.747	S	S	*	*			trans	52.9	121.6	151.6	48.2	0	0	0	0	120.9
357	G	31.9	Very low	39.1	Very low	81 Å²	81	127.7 Å²	127.7	84%	0.835	74%	0.743	S	S	*	*			trans	171.4	128.2	163	0	0	0	0	0	111.5
358	E	41.6	Very low	40.4	Very low	196 Å²	196	127.2 Å²	127.2	92%	0.916	73%	0.732	S	S	*	*			trans	-92.6	146.3	-174.4	-59.5	172.9	108.2	0	0	113.1
359	C	35.3	Very low	42	Very low	111 Å²	111	124.5 Å²	124.5	75%	0.75	72%	0.722	S	S	*	*			trans	-164	98.8	146.6	-169.4	0	0	0	0	111.6	G361	C359-G361 PolarHBondContact O-N 2.91Å
360	N	44.9	Very low	43.4	Very low	154 Å²	154	121.6 Å²	121.6	82%	0.824	71%	0.711	S	S	*	*			trans	-95.1	34	177.9	-88.8	-31.3	0	0	0	113.5
361	G	49.1	Very low	45	Very low	46 Å²	46	114 Å²	114	47%	0.474	69%	0.688	S	S	.	*			trans	-79.3	-62.7	-176.8	0	0	0	0	0	115.1	C359 K363	C359-G361 PolarHBondContact O-N 2.91Å; G361-K363 VanDerWaalsContact C-N 3.35Å; G361-K363 PolarHBondContact O-N 2.82Å
362	S	48.1	Very low	46.8	Very low	99 Å²	99	116.2 Å²	116.2	69%	0.692	68%	0.682	S	S	*	*	H	α-helix	trans	-67.5	-26.3	-159.2	-46.4	0	0	0	0	115.8	S364 E366	S362-S364 PolarHBondContact O-N 3.24Å; S362-E366 PolarHBondContact O-N 3.08Å
363	K	46.3	Very low	48.6	Very low	166 Å²	166	114.3 Å²	114.3	72%	0.722	66%	0.661	S	S	*	*	H	α-helix	trans	-66.1	-33.9	-174	-69.5	-178.1	179.4	175.4	0	113.3	G361 M367	G361-K363 VanDerWaalsContact C-N 3.35Å; G361-K363 PolarHBondContact O-N 2.82Å; K363-M367 VanDerWaalsContact O-CB 3.23Å; K363-M367 WeakPolarHBondContact O-CB 3.45Å; K363-M367 PolarHBondContact O-N 3.47Å
364	S	47.3	Very low	50.3	Low	81 Å²	81	113.7 Å²	113.7	57%	0.566	64%	0.637	S	S	*	*	H	α-helix	trans	-67.2	-45.7	-176.6	-166	0	0	0	0	111.7	S362 M367 Q368	S362-S364 PolarHBondContact O-N 3.24Å; S364-M367 PolarHBondContact O-N 2.87Å; S364-Q368 WeakPolarHBondContact O-CB 3.48Å; S364-Q368 PolarHBondContact O-N 3.36Å
365	L	52.1	Low	52	Low	122 Å²	122	113.4 Å²	113.4	64%	0.639	62%	0.623	S	S	*	*	H	α-helix	trans	-71.9	-36.2	-175	-151.1	154.7	0	0	0	111.3	L369	L365-L369 HydrophobicContact CD2-CD1 3.97Å; L365-L369 PolarHBondContact O-N 3.38Å; L365-L369 VanDerWaalsContact O-N 3.08Å
366	E	52.1	Low	53.3	Low	102 Å²	102	112 Å²	112	48%	0.477	61%	0.61	S	S	.	*	H	α-helix	trans	-68.3	-39.5	172.6	-161	-170.3	167.7	0	0	112.4	S362 L369 R370	S362-E366 PolarHBondContact O-N 3.08Å; E366-L369 PolarHBondContact O-N 3.18Å; E366-R370 VanDerWaalsContact O-CG 3.3Å; E366-R370 WeakPolarHBondContact O-CG 3.3Å; E366-R370 PolarHBondContact O-N 2.85Å; E366-R370 VanDerWaalsContact O-N 3.1Å; E366-R370 IonicContact OE1-CZ 2.99Å; E366-R370 IonicContact OE1-NE 2.79Å; E366-R370 IonicContact OE1-NH2 3.73Å; E366-R370 PolarHBondContact OE1-NH2 3.24Å
367	M	55.8	Low	55	Low	127 Å²	127	109.8 Å²	109.8	63%	0.626	59%	0.589	S	S	*	*	H	α-helix	trans	-66.2	-38.4	175.7	-175.2	165.1	173.7	0	0	112	K363 S364 R370 L371	K363-M367 VanDerWaalsContact O-CB 3.23Å; K363-M367 WeakPolarHBondContact O-CB 3.45Å; K363-M367 PolarHBondContact O-N 3.47Å; S364-M367 PolarHBondContact O-N 2.87Å; M367-R370 PolarHBondContact O-N 2.88Å; M367-L371 WeakPolarHBondContact O-CG 3.43Å; M367-L371 PolarHBondContact O-N 2.9Å
368	Q	57.5	Low	56.8	Low	130 Å²	130	106.7 Å²	106.7	61%	0.607	55%	0.554	S	S	*	*	H	α-helix	trans	-68.7	-38.9	177.5	-165.2	164.5	6.9	0	0	112.4	S364 R370 L371 Q372	S364-Q368 WeakPolarHBondContact O-CB 3.48Å; S364-Q368 PolarHBondContact O-N 3.36Å; Q368-R370 VanDerWaalsContact C-N 3.34Å; Q368-R370 PolarHBondContact O-N 2.81Å; Q368-L371 PolarHBondContact O-N 3Å; Q368-Q372 PolarHBondContact O-N 3.27Å
369	L	60.9	Low	58.4	Low	100 Å²	100	100.7 Å²	100.7	52%	0.524	53%	0.528	S	S	.	.	H	α-helix	trans	-62.4	-37.3	170.8	-87.5	163	0	0	0	112.9	L365 E366 Q372 N373	L365-L369 HydrophobicContact CD2-CD1 3.97Å; L365-L369 PolarHBondContact O-N 3.38Å; L365-L369 VanDerWaalsContact O-N 3.08Å; E366-L369 PolarHBondContact O-N 3.18Å; L369-Q372 PolarHBondContact O-N 3.42Å; L369-N373 PolarHBondContact O-N 2.88Å; L369-N373 VanDerWaalsContact O-N 3.07Å
370	R	58.4	Low	60.4	Low	151 Å²	151	102.4 Å²	102.4	57%	0.57	53%	0.525	S	S	*	.	H	α-helix	trans	-67	-39.1	175.6	-70.2	169.5	-175	-153.4	4.5	112.1	E366 M367 Q368 Q374	E366-R370 VanDerWaalsContact O-CG 3.3Å; E366-R370 WeakPolarHBondContact O-CG 3.3Å; E366-R370 PolarHBondContact O-N 2.85Å; E366-R370 VanDerWaalsContact O-N 3.1Å; E366-R370 IonicContact OE1-CZ 2.99Å; E366-R370 IonicContact OE1-NE 2.79Å; E366-R370 IonicContact OE1-NH2 3.73Å; E366-R370 PolarHBondContact OE1-NH2 3.24Å; M367-R370 PolarHBondContact O-N 2.88Å; Q368-R370 VanDerWaalsContact C-N 3.34Å; Q368-R370 PolarHBondContact O-N 2.81Å; R370-Q374 WeakPolarHBondContact O-CB 3.37Å; R370-Q374 VanDerWaalsContact O-CG 3.3Å; R370-Q374 WeakPolarHBondContact O-CG 3.3Å; R370-Q374 PolarHBondContact O-N 3.26Å
371	L	62.1	Low	61.8	Low	86 Å²	86	96.1 Å²	96.1	45%	0.45	49%	0.491	S	S	.	.	H	α-helix	trans	-66.6	-42	174.8	-71.5	167.1	0	0	0	111.9	M367 Q368 Q374 Q375	M367-L371 WeakPolarHBondContact O-CG 3.43Å; M367-L371 PolarHBondContact O-N 2.9Å; Q368-L371 PolarHBondContact O-N 3Å; L371-Q374 PolarHBondContact O-N 3.34Å; L371-Q375 PolarHBondContact O-N 3.28Å
372	Q	65.5	Low	63.1	Low	109 Å²	109	98.1 Å²	98.1	51%	0.509	49%	0.488	S	S	.	.	H	α-helix	trans	-56.5	-53.1	174.5	-169.5	75.9	51	0	0	111.1	Q368 L369 Q374 Q375 D376	Q368-Q372 PolarHBondContact O-N 3.27Å; L369-Q372 PolarHBondContact O-N 3.42Å; Q372-Q374 VanDerWaalsContact C-N 3.33Å; Q372-Q374 PolarHBondContact O-N 2.95Å; Q372-Q375 PolarHBondContact O-N 2.9Å; Q372-Q375 VanDerWaalsContact O-N 3.17Å; Q372-D376 PolarHBondContact O-N 3.05Å
373	N	70.3	Confident	64.6	Low	99 Å²	99	99.5 Å²	99.5	53%	0.529	48%	0.483	S	S	.	.	H	α-helix	trans	-61.8	-37.6	178.6	-76.6	7.1	0	0	0	112.9	L369 Q375 D376 E377	L369-N373 PolarHBondContact O-N 2.88Å; L369-N373 VanDerWaalsContact O-N 3.07Å; N373-Q375 VanDerWaalsContact C-N 3.34Å; N373-D376 PolarHBondContact O-N 3.03Å; N373-E377 WeakPolarHBondContact O-CB 3.36Å; N373-E377 PolarHBondContact O-N 3.28Å
374	Q	63	Low	66.2	Low	65 Å²	65	95.2 Å²	95.2	30%	0.304	47%	0.466	S	S	.	.	H	α-helix	trans	-65.8	-36.7	176.5	-77	174.8	1.8	0	0	112.2	R370 L371 Q372 M378 L529	R370-Q374 WeakPolarHBondContact O-CB 3.37Å; R370-Q374 VanDerWaalsContact O-CG 3.3Å; R370-Q374 WeakPolarHBondContact O-CG 3.3Å; R370-Q374 PolarHBondContact O-N 3.26Å; L371-Q374 PolarHBondContact O-N 3.34Å; Q372-Q374 VanDerWaalsContact C-N 3.33Å; Q372-Q374 PolarHBondContact O-N 2.95Å; Q374-M378 WeakPolarHBondContact O-CB 3.47Å; Q374-M378 WeakPolarHBondContact O-CG 3.31Å; Q374-M378 PolarHBondContact O-N 3.31Å; Q374-L529 HydrophobicContact CB-CD1 4.48Å
375	Q	68	Low	67.7	Low	106 Å²	106	93.2 Å²	93.2	50%	0.495	45%	0.447	S	S	.	.	H	α-helix	trans	-67.9	-41.3	174.4	-169.9	61.1	54.7	0	0	111.6	L371 Q372 N373 M378 N379	L371-Q375 PolarHBondContact O-N 3.28Å; Q372-Q375 PolarHBondContact O-N 2.9Å; Q372-Q375 VanDerWaalsContact O-N 3.17Å; N373-Q375 VanDerWaalsContact C-N 3.34Å; Q375-M378 WeakPolarHBondContact O-CB 3.41Å; Q375-M378 PolarHBondContact O-N 3.23Å; Q375-N379 PolarHBondContact NE2-OD1 3.01Å; Q375-N379 VanDerWaalsContact NE2-OD1 3.08Å; Q375-N379 WeakPolarHBondContact O-CB 3.3Å; Q375-N379 PolarHBondContact O-N 3.21Å; Q375-N379 PolarHBondContact O-ND2 3.2Å; Q375-N379 PolarHBondContact O-OD1 2.89Å
376	D	72.6	Confident	69	Low	80 Å²	80	91.2 Å²	91.2	43%	0.428	44%	0.436	S	S	.	.	H	α-helix	trans	-69.7	-36.2	178.3	-69.8	-36	0	0	0	112.4	Q372 N373 N379 Q380	Q372-D376 PolarHBondContact O-N 3.05Å; N373-D376 PolarHBondContact O-N 3.03Å; D376-N379 PolarHBondContact O-N 3.01Å; D376-Q380 WeakPolarHBondContact O-CB 3.41Å; D376-Q380 PolarHBondContact O-N 2.98Å
377	E	71.5	Confident	70.4	Confident	94 Å²	94	92.9 Å²	92.9	44%	0.439	44%	0.442	S	S	.	.	H	α-helix	trans	-60.1	-44.7	167.8	-82.9	-171.3	-152.5	0	0	111.9	N373 Q380 M381 K533	N373-E377 WeakPolarHBondContact O-CB 3.36Å; N373-E377 PolarHBondContact O-N 3.28Å; E377-Q380 PolarHBondContact O-N 3.09Å; E377-M381 HydrophobicContact CB-CE 4.35Å; E377-M381 WeakPolarHBondContact O-CB 3.22Å; E377-M381 WeakPolarHBondContact O-CE 3.44Å; E377-M381 WeakPolarHBondContact O-CG 3.4Å; E377-M381 PolarHBondContact O-N 2.88Å; E377-K533 IonicContact OE2-NZ 3.28Å
378	M	69.6	Low	71.4	Confident	17 Å²	17	87.7 Å²	87.7	8%	0.084	42%	0.417	C	S	.	.	H	α-helix	trans	-60.2	-48.9	176.3	-81.4	-70.8	-81.1	0	0	111.7	Q374 Q375 Q380 M381 Q382 E528 L529 L532	Q374-M378 WeakPolarHBondContact O-CB 3.47Å; Q374-M378 WeakPolarHBondContact O-CG 3.31Å; Q374-M378 PolarHBondContact O-N 3.31Å; Q375-M378 WeakPolarHBondContact O-CB 3.41Å; Q375-M378 PolarHBondContact O-N 3.23Å; M378-Q380 VanDerWaalsContact C-N 3.33Å; M378-Q380 PolarHBondContact O-N 2.95Å; M378-M381 PolarHBondContact O-N 2.69Å; M378-M381 HydrophobicContact SD-CE 4.31Å; M378-Q382 WeakPolarHBondContact O-CG 3.33Å; M378-Q382 PolarHBondContact O-N 2.88Å; M378-E528 HydrophobicContact CE-CB 3.9Å; M378-L529 HydrophobicContact CG-CB 4.46Å; M378-L529 HydrophobicContact CG-CD1 3.88Å; M378-L529 HydrophobicContact CG-CG 4.03Å; M378-L529 VanDerWaalsContact SD-CA 3.54Å; M378-L529 HydrophobicContact SD-CB 3.72Å; M378-L529 HydrophobicContact SD-CD1 4.17Å; M378-L529 HydrophobicContact SD-CG 3.65Å; M378-L532 HydrophobicContact CE-CD2 4.19Å; M378-L532 HydrophobicContact SD-CB 4.49Å; M378-L532 HydrophobicContact SD-CD2 3.63Å
379	N	75.2	Confident	72.4	Confident	70 Å²	70	88.9 Å²	88.9	37%	0.374	42%	0.416	S	S	.	.	H	α-helix	trans	-58.8	-44.1	178.1	-63.1	-19.9	0	0	0	111.2	Q375 D376 Q382 Q383	Q375-N379 PolarHBondContact NE2-OD1 3.01Å; Q375-N379 VanDerWaalsContact NE2-OD1 3.08Å; Q375-N379 WeakPolarHBondContact O-CB 3.3Å; Q375-N379 PolarHBondContact O-N 3.21Å; Q375-N379 PolarHBondContact O-ND2 3.2Å; Q375-N379 PolarHBondContact O-OD1 2.89Å; D376-N379 PolarHBondContact O-N 3.01Å; N379-Q382 PolarHBondContact O-N 3.48Å; N379-Q383 PolarHBondContact O-N 2.82Å; N379-Q383 VanDerWaalsContact O-N 3.12Å
380	Q	78.1	Confident	73.5	Confident	146 Å²	146	90.1 Å²	90.1	68%	0.682	42%	0.419	S	S	*	.	H	α-helix	trans	-65.6	-40.1	178.7	-170.5	174.7	31.4	0	0	112.5	D376 E377 M378 Q383 E384	D376-Q380 WeakPolarHBondContact O-CB 3.41Å; D376-Q380 PolarHBondContact O-N 2.98Å; E377-Q380 PolarHBondContact O-N 3.09Å; M378-Q380 VanDerWaalsContact C-N 3.33Å; M378-Q380 PolarHBondContact O-N 2.95Å; Q380-Q383 PolarHBondContact O-N 3.5Å; Q380-E384 PolarHBondContact O-N 3.48Å
381	M	74.9	Confident	74.3	Confident	23 Å²	23	86.2 Å²	86.2	11%	0.113	41%	0.407	C	S	.	.	H	α-helix	trans	-70.6	-35.8	177.3	-77	-171.5	-65.5	0	0	113.1	E377 M378 Q383 E384 Q385 L529 L532 K533 L536	E377-M381 HydrophobicContact CB-CE 4.35Å; E377-M381 WeakPolarHBondContact O-CB 3.22Å; E377-M381 WeakPolarHBondContact O-CE 3.44Å; E377-M381 WeakPolarHBondContact O-CG 3.4Å; E377-M381 PolarHBondContact O-N 2.88Å; M378-M381 PolarHBondContact O-N 2.69Å; M378-M381 HydrophobicContact SD-CE 4.31Å; M381-Q383 VanDerWaalsContact C-N 3.31Å; M381-Q383 PolarHBondContact O-N 2.65Å; M381-E384 PolarHBondContact O-N 2.64Å; M381-Q385 WeakPolarHBondContact O-CB 3.48Å; M381-Q385 PolarHBondContact O-N 3.3Å; M381-L529 HydrophobicContact CE-CD2 3.86Å; M381-L529 HydrophobicContact CE-CG 3.89Å; M381-L532 HydrophobicContact CB-CD2 3.5Å; M381-L532 HydrophobicContact CB-CG 4.25Å; M381-L532 HydrophobicContact CE-CD2 4.28Å; M381-K533 HydrophobicContact CE-CG 4.33Å; M381-K533 HydrophobicContact SD-CD 4.03Å; M381-K533 WeakPolarHBondContact SD-CE 3.23Å; M381-K533 HydrophobicContact SD-CG 3.48Å; M381-K533 WeakPolarHBondContact SD-CG 3.37Å; M381-L536 HydrophobicContact CB-CD1 3.72Å; M381-L536 HydrophobicContact CG-CD1 3.89Å; M381-L536 HydrophobicContact SD-CD1 4.24Å
382	Q	76	Confident	75.1	Confident	88 Å²	88	82.8 Å²	82.8	41%	0.411	39%	0.389	S	S	.	.	H	α-helix	trans	-60.6	-43.3	171.2	-73.4	176.5	1.1	0	0	110.7	M378 N379 E384 Q385 I386 L532	M378-Q382 WeakPolarHBondContact O-CG 3.33Å; M378-Q382 PolarHBondContact O-N 2.88Å; N379-Q382 PolarHBondContact O-N 3.48Å; Q382-E384 PolarHBondContact O-N 3.04Å; Q382-Q385 WeakPolarHBondContact O-CB 3.34Å; Q382-Q385 PolarHBondContact O-N 3.37Å; Q382-Q385 VanDerWaalsContact O-N 3.15Å; Q382-I386 WeakPolarHBondContact O-CG1 3.44Å; Q382-I386 PolarHBondContact O-N 2.88Å; Q382-L532 HydrophobicContact CG-CD1 3.9Å; Q382-L532 HydrophobicContact CG-CD2 3.83Å
383	Q	80	Confident	75.5	Confident	128 Å²	128	80.3 Å²	80.3	60%	0.598	39%	0.388	S	S	*	.	H	α-helix	trans	-65	-37.7	176.5	-161.7	66.6	24.7	0	0	112.8	N379 Q380 M381 Q385 K387	N379-Q383 PolarHBondContact O-N 2.82Å; N379-Q383 VanDerWaalsContact O-N 3.12Å; Q380-Q383 PolarHBondContact O-N 3.5Å; M381-Q383 VanDerWaalsContact C-N 3.31Å; M381-Q383 PolarHBondContact O-N 2.65Å; Q383-Q385 VanDerWaalsContact C-N 3.33Å; Q383-K387 PolarHBondContact O-N 3.48Å
384	E	79.7	Confident	75.9	Confident	76 Å²	76	79.1 Å²	79.1	36%	0.355	39%	0.387	S	S	.	.	H	α-helix	trans	-64.5	-38.3	172.3	-161.6	-167.8	-166.8	0	0	111.4	Q380 M381 Q382 K387 L388 L536 K540	Q380-E384 PolarHBondContact O-N 3.48Å; M381-E384 PolarHBondContact O-N 2.64Å; Q382-E384 PolarHBondContact O-N 3.04Å; E384-K387 PolarHBondContact O-N 3.27Å; E384-L388 HydrophobicContact CG-CD1 3.87Å; E384-L388 HydrophobicContact CG-CG 4.49Å; E384-L388 WeakPolarHBondContact O-CB 3.34Å; E384-L388 WeakPolarHBondContact O-CG 3.3Å; E384-L388 PolarHBondContact O-N 3.41Å; E384-L536 HydrophobicContact CB-CD2 3.98Å; E384-L536 HydrophobicContact CG-CD2 4.13Å; E384-K540 VanDerWaalsContact CD-CE 3.5Å; E384-K540 WeakPolarHBondContact OE1-CE 3.46Å; E384-K540 IonicContact OE1-NZ 2.7Å; E384-K540 PolarHBondContact OE1-NZ 2.96Å; E384-K540 WeakPolarHBondContact OE2-CE 3.46Å; E384-K540 IonicContact OE2-NZ 3.68Å; E384-K540 PolarHBondContact OE2-NZ 2.97Å
385	Q	78.5	Confident	76.4	Confident	38 Å²	38	76.9 Å²	76.9	18%	0.178	38%	0.376	C	S	.	.	H	α-helix	trans	-66.4	-43.6	-179.1	-166	-167.2	93	0	0	111.7	M381 Q382 Q383 L388 R389 L536 Y539	M381-Q385 WeakPolarHBondContact O-CB 3.48Å; M381-Q385 PolarHBondContact O-N 3.3Å; Q382-Q385 WeakPolarHBondContact O-CB 3.34Å; Q382-Q385 PolarHBondContact O-N 3.37Å; Q382-Q385 VanDerWaalsContact O-N 3.15Å; Q383-Q385 VanDerWaalsContact C-N 3.33Å; Q385-L388 PolarHBondContact O-N 3.03Å; Q385-R389 VanDerWaalsContact O-CB 3.29Å; Q385-R389 WeakPolarHBondContact O-CB 3.44Å; Q385-R389 PolarHBondContact O-N 2.97Å; Q385-L536 HydrophobicContact CB-CD2 3.77Å; Q385-L536 HydrophobicContact CB-CG 4.19Å; Q385-L536 HydrophobicContact CG-CD2 4.31Å; Q385-Y539 HydrophobicContact CG-CD2 3.7Å; Q385-Y539 HydrophobicContact CG-CE2 3.64Å
386	I	79.4	Confident	76.8	Confident	80 Å²	80	76.5 Å²	76.5	41%	0.41	37%	0.373	S	S	.	.	H	α-helix	trans	-56.9	-52.3	174.8	-67.4	165.1	0	0	0	109.7	Q382 L388 R389 E390	Q382-I386 WeakPolarHBondContact O-CG1 3.44Å; Q382-I386 PolarHBondContact O-N 2.88Å; I386-L388 PolarHBondContact O-N 3.43Å; I386-R389 WeakPolarHBondContact O-CB 3.15Å; I386-R389 PolarHBondContact O-N 3.34Å; I386-R389 VanDerWaalsContact O-N 3.13Å; I386-E390 WeakPolarHBondContact O-CG 3.45Å; I386-E390 PolarHBondContact O-N 3.45Å
387	K	81.4	Confident	77.3	Confident	137 Å²	137	76.6 Å²	76.6	60%	0.596	37%	0.371	S	S	*	.	H	α-helix	trans	-58.4	-45.1	179.7	-176.8	-174.2	173.3	-169.8	0	112.6	Q383 E384 R389 E390 E391	Q383-K387 PolarHBondContact O-N 3.48Å; E384-K387 PolarHBondContact O-N 3.27Å; K387-R389 VanDerWaalsContact C-N 3.29Å; K387-R389 PolarHBondContact O-N 3.3Å; K387-E390 PolarHBondContact O-N 2.85Å; K387-E391 WeakPolarHBondContact O-CB 3.37Å; K387-E391 PolarHBondContact O-N 3.28Å
388	L	77.6	Confident	77.5	Confident	19 Å²	19	76 Å²	76	10%	0.099	37%	0.37	C	S	.	.	H	α-helix	trans	-67.5	-30.2	179.4	-75	162.2	0	0	0	112.6	E384 Q385 I386 L392 L536 K540 N543	E384-L388 HydrophobicContact CG-CD1 3.87Å; E384-L388 HydrophobicContact CG-CG 4.49Å; E384-L388 WeakPolarHBondContact O-CB 3.34Å; E384-L388 WeakPolarHBondContact O-CG 3.3Å; E384-L388 PolarHBondContact O-N 3.41Å; Q385-L388 PolarHBondContact O-N 3.03Å; I386-L388 PolarHBondContact O-N 3.43Å; L388-L392 VanDerWaalsContact O-CB 3.32Å; L388-L392 WeakPolarHBondContact O-CB 3.3Å; L388-L392 PolarHBondContact O-N 2.89Å; L388-L536 HydrophobicContact CD1-CD2 3.66Å; L388-K540 HydrophobicContact CD1-CD 4.26Å; L388-K540 VanDerWaalsContact CD1-CE 3.47Å; L388-K540 HydrophobicContact CD1-CG 3.71Å; L388-K540 HydrophobicContact CD2-CG 4.17Å; L388-N543 PolarHBondContact O-ND2 3.11Å; L388-N543 VanDerWaalsContact O-ND2 3.16Å
389	R	77.2	Confident	78	Confident	154 Å²	154	75.6 Å²	75.6	58%	0.581	37%	0.369	S	S	*	.	H	α-helix	trans	-73.6	-35.8	175.2	-174.5	179.7	179	-172.8	0.5	112.4	Q385 I386 K387 A393 Y539	Q385-R389 VanDerWaalsContact O-CB 3.29Å; Q385-R389 WeakPolarHBondContact O-CB 3.44Å; Q385-R389 PolarHBondContact O-N 2.97Å; I386-R389 WeakPolarHBondContact O-CB 3.15Å; I386-R389 PolarHBondContact O-N 3.34Å; I386-R389 VanDerWaalsContact O-N 3.13Å; K387-R389 VanDerWaalsContact C-N 3.29Å; K387-R389 PolarHBondContact O-N 3.3Å; R389-A393 PolarHBondContact O-N 2.92Å; R389-A393 VanDerWaalsContact O-N 3.09Å; R389-Y539 HydrophobicContact CB-CD1 4.48Å; R389-Y539 HydrophobicContact CB-CE1 4.11Å; R389-Y539 HydrophobicContact CG-CE1 4.05Å
390	E	83.6	Confident	78.6	Confident	126 Å²	126	77.4 Å²	77.4	59%	0.589	37%	0.371	S	S	*	.	H	α-helix	trans	-65.8	-44.3	169.1	-68.7	173.5	163.9	0	0	111.3	I386 K387 L392 A393 S394	I386-E390 WeakPolarHBondContact O-CG 3.45Å; I386-E390 PolarHBondContact O-N 3.45Å; K387-E390 PolarHBondContact O-N 2.85Å; E390-L392 PolarHBondContact O-N 3.24Å; E390-A393 PolarHBondContact O-N 3.37Å; E390-S394 PolarHBondContact O-N 3.13Å; E390-S394 PolarHBondContact O-OG 3.22Å
391	E	76.9	Confident	78.7	Confident	70 Å²	70	74.1 Å²	74.1	33%	0.327	36%	0.357	S	S	.	.	H	α-helix	trans	-61.1	-44.9	176	-164.1	-166.8	130.1	0	0	111.1	K387 A393 S394 Q395 N543	K387-E391 WeakPolarHBondContact O-CB 3.37Å; K387-E391 PolarHBondContact O-N 3.28Å; E391-A393 VanDerWaalsContact C-N 3.32Å; E391-A393 PolarHBondContact O-N 2.9Å; E391-S394 PolarHBondContact O-N 2.98Å; E391-S394 PolarHBondContact O-OG 3.33Å; E391-Q395 WeakPolarHBondContact O-CB 3.28Å; E391-Q395 WeakPolarHBondContact O-CG 3.49Å; E391-Q395 PolarHBondContact O-N 3.1Å; E391-Q395 PolarHBondContact OE1-NE2 2.89Å; E391-N543 PolarHBondContact OE1-ND2 2.91Å
392	L	77.1	Confident	78.7	Confident	14 Å²	14	74 Å²	74	7%	0.073	36%	0.357	C	S	.	.	H	α-helix	trans	-55.9	-44.2	173.3	-175.7	81.3	0	0	0	112	L388 E390 Q395 K396 Y539 Q542 N543 L546	L388-L392 VanDerWaalsContact O-CB 3.32Å; L388-L392 WeakPolarHBondContact O-CB 3.3Å; L388-L392 PolarHBondContact O-N 2.89Å; E390-L392 PolarHBondContact O-N 3.24Å; L392-Q395 PolarHBondContact O-N 2.83Å; L392-K396 HydrophobicContact CG-CD 4.17Å; L392-K396 WeakPolarHBondContact O-CB 3.44Å; L392-K396 WeakPolarHBondContact O-CG 3.3Å; L392-K396 PolarHBondContact O-N 3.22Å; L392-Y539 HydrophobicContact CD2-CD1 3.92Å; L392-Y539 HydrophobicContact CD2-CE1 3.89Å; L392-Q542 HydrophobicContact CD1-CB 3.47Å; L392-Q542 VanDerWaalsContact CD1-CB 3.47Å; L392-Q542 HydrophobicContact CD1-CG 4.48Å; L392-N543 VanDerWaalsContact CA-OD1 3.31Å; L392-N543 WeakPolarHBondContact CA-OD1 3.31Å; L392-N543 VanDerWaalsContact CB-OD1 3.25Å; L392-N543 WeakPolarHBondContact CB-OD1 3.48Å; L392-N543 WeakPolarHBondContact CD1-OD1 3.48Å; L392-L546 HydrophobicContact CD1-CD1 3.65Å; L392-L546 HydrophobicContact CG-CD1 4.41Å
393	A	75.5	Confident	78.8	Confident	57 Å²	57	72.3 Å²	72.3	47%	0.471	35%	0.349	S	S	.	.	H	α-helix	trans	-65.1	-44.1	-179.7	0	0	0	0	0	111.5	R389 E390 E391 K396 E397	R389-A393 PolarHBondContact O-N 2.92Å; R389-A393 VanDerWaalsContact O-N 3.09Å; E390-A393 PolarHBondContact O-N 3.37Å; E391-A393 VanDerWaalsContact C-N 3.32Å; E391-A393 PolarHBondContact O-N 2.9Å; A393-K396 PolarHBondContact O-N 3.08Å; A393-E397 PolarHBondContact O-N 3.48Å; A393-E397 VanDerWaalsContact O-N 3.08Å
394	S	78.6	Confident	78.8	Confident	74 Å²	74	70.6 Å²	70.6	52%	0.517	34%	0.341	S	S	.	.	H	α-helix	trans	-67.3	-37.7	177	64.4	0	0	0	0	112.8	E390 E391 E397 L398	E390-S394 PolarHBondContact O-N 3.13Å; E390-S394 PolarHBondContact O-OG 3.22Å; E391-S394 PolarHBondContact O-N 2.98Å; E391-S394 PolarHBondContact O-OG 3.33Å; S394-E397 PolarHBondContact O-N 2.7Å; S394-L398 WeakPolarHBondContact O-CB 3.4Å; S394-L398 PolarHBondContact O-N 2.98Å
395	Q	73.1	Confident	78.4	Confident	18 Å²	18	69.7 Å²	69.7	8%	0.084	34%	0.341	C	S	.	.	H	α-helix	trans	-65.9	-40.3	174.4	-73.9	170.5	10.5	0	0	112.1	E391 L392 L398 V399 N543 L546 N547 I550	E391-Q395 WeakPolarHBondContact O-CB 3.28Å; E391-Q395 WeakPolarHBondContact O-CG 3.49Å; E391-Q395 PolarHBondContact O-N 3.1Å; E391-Q395 PolarHBondContact OE1-NE2 2.89Å; L392-Q395 PolarHBondContact O-N 2.83Å; Q395-L398 PolarHBondContact O-N 3.38Å; Q395-V399 WeakPolarHBondContact O-CG2 3.27Å; Q395-V399 PolarHBondContact O-N 3.2Å; Q395-N543 PolarHBondContact OE1-O 3.44Å; Q395-L546 HydrophobicContact CB-CB 4.06Å; Q395-L546 HydrophobicContact CB-CD1 3.8Å; Q395-N547 VanDerWaalsContact CD-ND2 3.3Å; Q395-N547 PolarHBondContact NE2-ND2 3.44Å; Q395-N547 PolarHBondContact OE1-ND2 3.16Å; Q395-I550 HydrophobicContact CB-CD1 3.96Å; Q395-I550 HydrophobicContact CG-CD1 3.99Å
396	K	75.9	Confident	78.2	Confident	97 Å²	97	69.3 Å²	69.3	42%	0.422	34%	0.34	S	S	.	.	H	α-helix	trans	-63.8	-39.7	174.9	-75.1	177	-177.9	174.6	0	112.3	L392 A393 V399 R400 L546	L392-K396 HydrophobicContact CG-CD 4.17Å; L392-K396 WeakPolarHBondContact O-CB 3.44Å; L392-K396 WeakPolarHBondContact O-CG 3.3Å; L392-K396 PolarHBondContact O-N 3.22Å; A393-K396 PolarHBondContact O-N 3.08Å; K396-V399 PolarHBondContact O-N 3.43Å; K396-R400 WeakPolarHBondContact O-CB 3.39Å; K396-R400 PolarHBondContact O-N 2.97Å; K396-L546 HydrophobicContact CD-CD1 4.42Å; K396-L546 HydrophobicContact CG-CD1 3.62Å; K396-L546 HydrophobicContact CG-CD2 4.21Å
397	E	83.2	Confident	77.8	Confident	83 Å²	83	71.4 Å²	71.4	39%	0.388	34%	0.343	S	S	.	.	H	α-helix	trans	-70.4	-36.9	176	-176	56.5	-160.9	0	0	112.2	A393 S394 R400 L401	A393-E397 PolarHBondContact O-N 3.48Å; A393-E397 VanDerWaalsContact O-N 3.08Å; S394-E397 PolarHBondContact O-N 2.7Å; E397-R400 VanDerWaalsContact CD-NE 3.26Å; E397-R400 WeakPolarHBondContact O-CB 3.22Å; E397-R400 PolarHBondContact O-N 2.98Å; E397-R400 IonicContact OE1-CZ 3.3Å; E397-R400 VanDerWaalsContact OE1-CZ 3.24Å; E397-R400 IonicContact OE1-NE 3.86Å; E397-R400 PolarHBondContact OE1-NE 3.15Å; E397-R400 IonicContact OE1-NH2 3.98Å; E397-R400 PolarHBondContact OE1-NH2 3.33Å; E397-R400 WeakPolarHBondContact OE2-CD 3.28Å; E397-R400 IonicContact OE2-CZ 2.64Å; E397-R400 IonicContact OE2-NE 2.65Å; E397-R400 PolarHBondContact OE2-NE 2.97Å; E397-L401 HydrophobicContact CG-CD1 4.24Å; E397-L401 WeakPolarHBondContact O-CB 3.49Å; E397-L401 WeakPolarHBondContact O-CG 3.34Å; E397-L401 PolarHBondContact O-N 3.14Å
398	L	76.6	Confident	77	Confident	80 Å²	80	68.1 Å²	68.1	42%	0.419	33%	0.334	S	S	.	.	H	α-helix	trans	-63.4	-42.1	172.6	-180	57.8	0	0	0	112.1	S394 Q395 L401 L402 I550	S394-L398 WeakPolarHBondContact O-CB 3.4Å; S394-L398 PolarHBondContact O-N 2.98Å; Q395-L398 PolarHBondContact O-N 3.38Å; L398-L401 PolarHBondContact O-N 3.07Å; L398-L402 HydrophobicContact CD1-CD1 4.24Å; L398-L402 HydrophobicContact CD1-CG 4.21Å; L398-L402 HydrophobicContact CG-CD1 4.11Å; L398-L402 WeakPolarHBondContact O-CB 3.28Å; L398-L402 WeakPolarHBondContact O-CG 3.36Å; L398-L402 PolarHBondContact O-N 3.35Å; L398-I550 HydrophobicContact CD2-CD1 4.13Å; L398-I550 HydrophobicContact CD2-CG1 4.43Å; L398-I550 HydrophobicContact CD2-CG2 4.03Å
399	V	80.3	Confident	76.1	Confident	10 Å²	10	69.1 Å²	69.1	6%	0.061	34%	0.343	C	S	.	.	H	α-helix	trans	-59.1	-47	170.9	166.5	0	0	0	0	110.7	Q395 K396 L401 L402 Q403 L546 E549 I550 L553	Q395-V399 WeakPolarHBondContact O-CG2 3.27Å; Q395-V399 PolarHBondContact O-N 3.2Å; K396-V399 PolarHBondContact O-N 3.43Å; V399-L401 VanDerWaalsContact C-N 3.33Å; V399-L401 PolarHBondContact O-N 3.38Å; V399-L402 PolarHBondContact O-N 3.18Å; V399-Q403 HydrophobicContact CG1-CG 4.24Å; V399-Q403 WeakPolarHBondContact O-CB 3.49Å; V399-Q403 WeakPolarHBondContact O-CG 3.41Å; V399-Q403 PolarHBondContact O-N 2.75Å; V399-L546 HydrophobicContact CG2-CD2 4.3Å; V399-E549 WeakPolarHBondContact CG1-OE1 3.47Å; V399-E549 HydrophobicContact CG2-CG 4.46Å; V399-I550 HydrophobicContact CG2-CD1 4.22Å; V399-I550 HydrophobicContact CG2-CG1 3.53Å; V399-L553 HydrophobicContact CG1-CD1 4.01Å; V399-L553 HydrophobicContact CG2-CD1 4.49Å
400	R	86.7	Confident	75.1	Confident	108 Å²	108	67.6 Å²	67.6	41%	0.408	34%	0.342	S	S	.	.	H	α-helix	trans	-58	-44.3	178.7	-163.6	-161	67.4	67.1	4.8	111.8	K396 E397 Q404	K396-R400 WeakPolarHBondContact O-CB 3.39Å; K396-R400 PolarHBondContact O-N 2.97Å; E397-R400 VanDerWaalsContact CD-NE 3.26Å; E397-R400 WeakPolarHBondContact O-CB 3.22Å; E397-R400 PolarHBondContact O-N 2.98Å; E397-R400 IonicContact OE1-CZ 3.3Å; E397-R400 VanDerWaalsContact OE1-CZ 3.24Å; E397-R400 IonicContact OE1-NE 3.86Å; E397-R400 PolarHBondContact OE1-NE 3.15Å; E397-R400 IonicContact OE1-NH2 3.98Å; E397-R400 PolarHBondContact OE1-NH2 3.33Å; E397-R400 WeakPolarHBondContact OE2-CD 3.28Å; E397-R400 IonicContact OE2-CZ 2.64Å; E397-R400 IonicContact OE2-NE 2.65Å; E397-R400 PolarHBondContact OE2-NE 2.97Å; R400-Q404 WeakPolarHBondContact O-CB 3.42Å; R400-Q404 PolarHBondContact O-N 3.45Å
401	L	79.6	Confident	73.5	Confident	77 Å²	77	68.8 Å²	68.8	40%	0.403	35%	0.345	S	S	.	.	H	α-helix	trans	-66.3	-47.7	176.7	-72.5	167.4	0	0	0	112	E397 L398 V399 Q403 Q404 T405	E397-L401 HydrophobicContact CG-CD1 4.24Å; E397-L401 WeakPolarHBondContact O-CB 3.49Å; E397-L401 WeakPolarHBondContact O-CG 3.34Å; E397-L401 PolarHBondContact O-N 3.14Å; L398-L401 PolarHBondContact O-N 3.07Å; V399-L401 VanDerWaalsContact C-N 3.33Å; V399-L401 PolarHBondContact O-N 3.38Å; L401-Q403 PolarHBondContact O-N 2.86Å; L401-Q404 WeakPolarHBondContact O-CB 3.39Å; L401-Q404 PolarHBondContact O-N 3.35Å; L401-Q404 VanDerWaalsContact O-N 3.1Å; L401-T405 PolarHBondContact O-N 3.45Å; L401-T405 PolarHBondContact O-OG1 3.25Å
402	L	76.8	Confident	72	Confident	19 Å²	19	72.8 Å²	72.8	10%	0.099	36%	0.364	C	S	.	.	H	α-helix	trans	-59.2	-45.8	177	-76.3	170	0	0	0	111.8	L398 V399 Q404 T405 L406 I550 L553	L398-L402 HydrophobicContact CD1-CD1 4.24Å; L398-L402 HydrophobicContact CD1-CG 4.21Å; L398-L402 HydrophobicContact CG-CD1 4.11Å; L398-L402 WeakPolarHBondContact O-CB 3.28Å; L398-L402 WeakPolarHBondContact O-CG 3.36Å; L398-L402 PolarHBondContact O-N 3.35Å; V399-L402 PolarHBondContact O-N 3.18Å; L402-Q404 VanDerWaalsContact C-N 3.33Å; L402-Q404 PolarHBondContact O-N 3.03Å; L402-T405 PolarHBondContact O-N 3.38Å; L402-L406 WeakPolarHBondContact O-CB 3.37Å; L402-L406 PolarHBondContact O-N 3.13Å; L402-I550 HydrophobicContact CD1-CG2 4.1Å; L402-L553 HydrophobicContact CB-CB 4.28Å; L402-L553 HydrophobicContact CB-CD1 4.3Å; L402-L553 HydrophobicContact CD1-CB 4.29Å
403	Q	77.7	Confident	70.6	Confident	53 Å²	53	79.1 Å²	79.1	25%	0.248	39%	0.387	C	S	.	.	H	α-helix	trans	-66.4	-32.8	175.2	-65.5	-174.4	13.2	0	0	112.4	V399 L401 R407 E549 L553	V399-Q403 HydrophobicContact CG1-CG 4.24Å; V399-Q403 WeakPolarHBondContact O-CB 3.49Å; V399-Q403 WeakPolarHBondContact O-CG 3.41Å; V399-Q403 PolarHBondContact O-N 2.75Å; L401-Q403 PolarHBondContact O-N 2.86Å; Q403-R407 WeakPolarHBondContact O-CD 3.09Å; Q403-R407 VanDerWaalsContact O-CG 3.23Å; Q403-R407 WeakPolarHBondContact O-CG 3.45Å; Q403-R407 PolarHBondContact O-N 3.36Å; Q403-R407 VanDerWaalsContact O-N 3.15Å; Q403-E549 PolarHBondContact NE2-OE1 3.18Å; Q403-L553 HydrophobicContact CG-CD1 3.74Å; Q403-L553 HydrophobicContact CG-CD2 4.12Å
404	Q	79	Confident	69	Low	92 Å²	92	81.3 Å²	81.3	43%	0.43	40%	0.397	S	S	.	.	H	α-helix	trans	-67.2	-48.7	174.3	-179	175.6	-12	0	0	110.9	R400 L401 L402 L406 R407 T408	R400-Q404 WeakPolarHBondContact O-CB 3.42Å; R400-Q404 PolarHBondContact O-N 3.45Å; L401-Q404 WeakPolarHBondContact O-CB 3.39Å; L401-Q404 PolarHBondContact O-N 3.35Å; L401-Q404 VanDerWaalsContact O-N 3.1Å; L402-Q404 VanDerWaalsContact C-N 3.33Å; L402-Q404 PolarHBondContact O-N 3.03Å; Q404-L406 VanDerWaalsContact C-N 3.33Å; Q404-L406 PolarHBondContact O-N 3.05Å; Q404-R407 PolarHBondContact O-N 3.5Å; Q404-R407 VanDerWaalsContact O-N 3.17Å; Q404-T408 PolarHBondContact O-N 3.25Å; Q404-T408 PolarHBondContact O-OG1 2.92Å
405	T	72.9	Confident	66.7	Low	58 Å²	58	83 Å²	83	36%	0.356	41%	0.409	S	S	.	.	H	α-helix	trans	-62	-39.5	177.2	-55.5	0	0	0	0	112	L401 L402 R407 T408 S409	L401-T405 PolarHBondContact O-N 3.45Å; L401-T405 PolarHBondContact O-OG1 3.25Å; L402-T405 PolarHBondContact O-N 3.38Å; T405-R407 VanDerWaalsContact C-N 3.3Å; T405-R407 PolarHBondContact O-N 2.87Å; T405-T408 WeakPolarHBondContact CA-OG1 3.4Å; T405-T408 PolarHBondContact O-N 2.93Å; T405-T408 PolarHBondContact O-OG1 2.94Å; T405-S409 PolarHBondContact O-N 3.38Å; T405-S409 PolarHBondContact O-OG 2.64Å
406	L	74.1	Confident	65	Low	29 Å²	29	88.6 Å²	88.6	15%	0.152	44%	0.443	C	S	.	.	H	α-helix	trans	-63.7	-35.8	176.1	-163.4	88.2	0	0	0	111.9	L402 Q404 S409 Q410 L556 R557	L402-L406 WeakPolarHBondContact O-CB 3.37Å; L402-L406 PolarHBondContact O-N 3.13Å; Q404-L406 VanDerWaalsContact C-N 3.33Å; Q404-L406 PolarHBondContact O-N 3.05Å; L406-S409 PolarHBondContact O-OG 3.41Å; L406-S409 VanDerWaalsContact O-OG 3.04Å; L406-Q410 VanDerWaalsContact O-CD 3.32Å; L406-Q410 VanDerWaalsContact O-CG 3.23Å; L406-Q410 WeakPolarHBondContact O-CG 3.38Å; L406-Q410 PolarHBondContact O-N 2.82Å; L406-Q410 PolarHBondContact O-NE2 3.18Å; L406-L556 HydrophobicContact CD1-CB 4.27Å; L406-R557 HydrophobicContact CD1-CB 4.14Å
407	R	69.5	Low	63.1	Low	125 Å²	125	92.4 Å²	92.4	47%	0.472	46%	0.455	S	S	.	.	H	α-helix	trans	-71.1	-44.9	174.7	-72.1	169.1	-170.1	121.2	6.9	111.5	Q403 Q404 T405 S409 Q410 F411	Q403-R407 WeakPolarHBondContact O-CD 3.09Å; Q403-R407 VanDerWaalsContact O-CG 3.23Å; Q403-R407 WeakPolarHBondContact O-CG 3.45Å; Q403-R407 PolarHBondContact O-N 3.36Å; Q403-R407 VanDerWaalsContact O-N 3.15Å; Q404-R407 PolarHBondContact O-N 3.5Å; Q404-R407 VanDerWaalsContact O-N 3.17Å; T405-R407 VanDerWaalsContact C-N 3.3Å; T405-R407 PolarHBondContact O-N 2.87Å; R407-S409 VanDerWaalsContact C-N 3.34Å; R407-S409 PolarHBondContact O-N 3.28Å; R407-Q410 WeakPolarHBondContact O-CB 3.23Å; R407-Q410 PolarHBondContact O-N 3.28Å; R407-F411 HydrophobicContact CB-CD2 4.42Å; R407-F411 HydrophobicContact CB-CE2 4.35Å; R407-F411 WeakPolarHBondContact O-CD2 3.39Å; R407-F411 PolarHBondContact O-N 3.43Å
408	T	64.6	Low	60.9	Low	67 Å²	67	99 Å²	99	41%	0.411	48%	0.477	S	S	.	.	H	α-helix	trans	-62.4	-41.8	178	54.4	0	0	0	0	111.4	Q404 T405 Q410 F411 E412	Q404-T408 PolarHBondContact O-N 3.25Å; Q404-T408 PolarHBondContact O-OG1 2.92Å; T405-T408 WeakPolarHBondContact CA-OG1 3.4Å; T405-T408 PolarHBondContact O-N 2.93Å; T405-T408 PolarHBondContact O-OG1 2.94Å; T408-Q410 PolarHBondContact O-N 2.91Å; T408-Q410 VanDerWaalsContact O-N 3.09Å; T408-F411 PolarHBondContact O-N 3.35Å; T408-F411 VanDerWaalsContact O-N 3.08Å; T408-E412 PolarHBondContact O-N 2.61Å
409	S	59.9	Low	58.8	Low	41 Å²	41	99.8 Å²	99.8	29%	0.287	49%	0.494	S	S	.	.	H	α-helix	trans	-67.4	-6.6	174.4	67.2	0	0	0	0	114.7	T405 L406 R407	T405-S409 PolarHBondContact O-N 3.38Å; T405-S409 PolarHBondContact O-OG 2.64Å; L406-S409 PolarHBondContact O-OG 3.41Å; L406-S409 VanDerWaalsContact O-OG 3.04Å; R407-S409 VanDerWaalsContact C-N 3.34Å; R407-S409 PolarHBondContact O-N 3.28Å
410	Q	55.5	Low	56.4	Low	121 Å²	121	103.9 Å²	103.9	57%	0.565	53%	0.53	S	S	*	.	H	α-helix	trans	-98.5	-29.9	171.1	-72.4	167.7	14.2	0	0	111.9	L406 R407 T408	L406-Q410 VanDerWaalsContact O-CD 3.32Å; L406-Q410 VanDerWaalsContact O-CG 3.23Å; L406-Q410 WeakPolarHBondContact O-CG 3.38Å; L406-Q410 PolarHBondContact O-N 2.82Å; L406-Q410 PolarHBondContact O-NE2 3.18Å; R407-Q410 WeakPolarHBondContact O-CB 3.23Å; R407-Q410 PolarHBondContact O-N 3.28Å; T408-Q410 PolarHBondContact O-N 2.91Å; T408-Q410 VanDerWaalsContact O-N 3.09Å
411	F	49.4	Very low	54.1	Low	151 Å²	151	104.5 Å²	104.5	66%	0.662	55%	0.548	S	S	*	.	H	α-helix	trans	-90.9	-14.5	179.9	-70.3	-60.8	0	0	0	114.8	R407 T408 R413	R407-F411 HydrophobicContact CB-CD2 4.42Å; R407-F411 HydrophobicContact CB-CE2 4.35Å; R407-F411 WeakPolarHBondContact O-CD2 3.39Å; R407-F411 PolarHBondContact O-N 3.43Å; T408-F411 PolarHBondContact O-N 3.35Å; T408-F411 VanDerWaalsContact O-N 3.08Å; F411-R413 PolarHBondContact O-N 2.92Å
412	E	45.3	Very low	51.7	Low	155 Å²	155	108 Å²	108	72%	0.724	57%	0.566	S	S	*	*			trans	-78.3	61.2	177.4	-74.2	-169.3	141.7	0	0	113.9	T408	T408-E412 PolarHBondContact O-N 2.61Å
413	R	47.7	Very low	49.8	Very low	147 Å²	147	112.7 Å²	112.7	56%	0.555	60%	0.598	S	S	*	*			trans	-155.3	132.7	153.5	-106.1	170.5	-176.9	128.9	3.2	108.6	F411	F411-R413 PolarHBondContact O-N 2.92Å
414	P	42.4	Very low	47.5	Very low	103 Å²	103	115.4 Å²	115.4	67%	0.669	62%	0.623	S	S	*	*	S	Bend	cis	-129.8	91.3	13.1	36	-15.6	0	0	0	113.8
415	S	31.3	Very low	45.4	Very low	110 Å²	110	116 Å²	116	77%	0.769	64%	0.644	S	S	*	*	S	Bend	trans	-104.4	-18.7	179.6	-51	0	0	0	0	115.3
416	V	36.1	Very low	43.5	Very low	134 Å²	134	117.9 Å²	117.9	81%	0.812	67%	0.665	S	S	*	*	S	Bend	trans	-82.3	-17.9	-168.6	-177	0	0	0	0	113.3	R418	V416-R418 PolarHBondContact O-N 3.15Å
417	W	37.2	Very low	42.6	Very low	178 Å²	178	122.3 Å²	122.3	67%	0.674	70%	0.696	S	S	*	*	S	Bend	trans	-74.3	20.3	-172.9	-61.6	111.6	0	0	0	116.1
418	R	37	Very low	40.8	Very low	222 Å²	222	122.9 Å²	122.9	84%	0.838	71%	0.708	S	S	*	*	S	Bend	trans	-145.5	56.9	-177.9	-159.4	-169.3	-70.5	-165.3	-2.2	113.5	V416	V416-R418 PolarHBondContact O-N 3.15Å
419	A	32.4	Very low	39.3	Very low	95 Å²	95	127.3 Å²	127.3	79%	0.785	72%	0.724	S	S	*	*			trans	-150.6	67	173.6	0	0	0	0	0	113.5
420	A	29.1	Very low	38.1	Very low	97 Å²	97	129.8 Å²	129.8	80%	0.802	75%	0.747	S	S	*	*			trans	-142.3	101.2	165	0	0	0	0	0	109.7
421	P	38.6	Very low	37.6	Very low	121 Å²	121	130.1 Å²	130.1	79%	0.786	76%	0.759	S	S	*	*			trans	-85.7	124.4	173.1	32.3	-29.9	0	0	0	110.2
422	D	29.4	Very low	36.5	Very low	149 Å²	149	128.3 Å²	128.3	80%	0.797	77%	0.766	S	S	*	*			trans	-97.6	117.3	178.2	-170	11	0	0	0	111.1
423	P	38	Very low	36.4	Very low	119 Å²	119	126.9 Å²	126.9	77%	0.773	77%	0.77	S	S	*	*			trans	-115.5	65.5	-168.4	41.3	-31.1	0	0	0	114.2
424	S	29.4	Very low	35.9	Very low	109 Å²	109	124.7 Å²	124.7	76%	0.762	78%	0.783	S	S	*	*			trans	-151.7	134.8	156.6	66.5	0	0	0	0	112.9
425	A	33.1	Very low	35.9	Very low	106 Å²	106	124.8 Å²	124.8	88%	0.876	78%	0.781	S	S	*	*			trans	-126.3	135.1	-179.4	0	0	0	0	0	111.4
426	A	32.9	Very low	36.8	Very low	97 Å²	97	122.7 Å²	122.7	80%	0.802	76%	0.764	S	S	*	*			trans	-156.1	128.6	156.5	0	0	0	0	0	108.8
427	P	57.1	Low	37.5	Very low	122 Å²	122	124.9 Å²	124.9	79%	0.792	77%	0.766	S	S	*	*			trans	-94.5	154.5	-180	36.4	-33.5	0	0	0	112.3
428	D	30.5	Very low	38.2	Very low	137 Å²	137	123.3 Å²	123.3	73%	0.733	77%	0.766	S	S	*	*			trans	-164.8	137.8	132.4	-117.5	-25.6	0	0	0	116.9
429	Q	34.1	Very low	38.8	Very low	160 Å²	160	116.7 Å²	116.7	75%	0.748	75%	0.747	S	S	*	*			trans	50.5	108.8	146.6	-74.6	164.2	69.7	0	0	124.3
430	A	33.8	Very low	40.1	Very low	92 Å²	92	115.5 Å²	115.5	76%	0.76	73%	0.73	S	S	*	*				85.4	163.2	124.6	0	0	0	0	0	119.6
431	P	46.1	Very low	41.8	Very low	128 Å²	128	113.4 Å²	113.4	83%	0.831	71%	0.712	S	S	*	*				-133.8	154.6	-82.7	36.3	-19.3	0	0	0	115.6
432	S	26.3	Very low	43	Very low	114 Å²	114	113.6 Å²	113.6	80%	0.797	70%	0.703	S	S	*	*			trans	-147	177.5	167.5	77.2	0	0	0	0	110.3
433	P	42.2	Very low	44.4	Very low	125 Å²	125	112.2 Å²	112.2	81%	0.812	70%	0.695	S	S	*	*			trans	-72	157.7	-144.1	29.1	-37.2	0	0	0	116.4	V435	P433-V435 PolarHBondContact O-N 3.03Å
434	A	37.8	Very low	45.8	Very low	100 Å²	100	111.9 Å²	111.9	83%	0.826	68%	0.683	S	S	*	*			trans	-72.1	115.9	-166.7	0	0	0	0	0	114.8
435	V	42.5	Very low	47.8	Very low	105 Å²	105	109.4 Å²	109.4	64%	0.636	67%	0.669	S	S	*	*			trans	-73.7	143.7	134.5	179.7	0	0	0	0	106.9	P433 D439 V440	P433-V435 PolarHBondContact O-N 3.03Å; V435-D439 HydrophobicContact CG1-CB 3.92Å; V435-V440 HydrophobicContact CG1-CG2 3.99Å
436	T	49.3	Very low	49.5	Very low	66 Å²	66	107.4 Å²	107.4	41%	0.405	65%	0.646	S	S	.	*			trans	-74.2	149.2	-179.6	82.2	0	0	0	0	110.8	E438 D439 V440	T436-E438 PolarHBondContact O-N 3.17Å; T436-D439 VanDerWaalsContact CB-OD2 3.27Å; T436-D439 WeakPolarHBondContact CB-OD2 3.11Å; T436-D439 WeakPolarHBondContact CG2-OD2 3.43Å; T436-D439 PolarHBondContact N-OD2 2.6Å; T436-D439 VanDerWaalsContact N-OD2 3.12Å; T436-D439 PolarHBondContact O-N 3Å; T436-D439 VanDerWaalsContact O-N 3.16Å; T436-D439 PolarHBondContact OG1-N 3.01Å; T436-D439 VanDerWaalsContact OG1-N 3.17Å; T436-D439 PolarHBondContact OG1-OD2 3.1Å; T436-V440 PolarHBondContact O-N 2.96Å
437	Q	51	Low	50.9	Low	180 Å²	180	107.7 Å²	107.7	84%	0.841	63%	0.634	S	S	*	*	H	α-helix	trans	-68	-19.3	179	-162.9	167.3	1.1	0	0	112.1	A441	Q437-A441 WeakPolarHBondContact O-CB 3.35Å; Q437-A441 PolarHBondContact O-N 3.06Å
438	E	51.8	Low	51.8	Low	146 Å²	146	108.2 Å²	108.2	68%	0.682	63%	0.625	S	S	*	*	H	α-helix	trans	-75.6	-37.1	171.9	-64.3	-175	117.5	0	0	112.2	T436 V440 A441 Q442	T436-E438 PolarHBondContact O-N 3.17Å; E438-V440 PolarHBondContact O-N 2.87Å; E438-A441 PolarHBondContact O-N 3.36Å; E438-Q442 WeakPolarHBondContact O-CB 3.42Å; E438-Q442 VanDerWaalsContact O-CG 3.29Å; E438-Q442 WeakPolarHBondContact O-CG 3.43Å; E438-Q442 PolarHBondContact O-N 2.95Å
439	D	49.8	Very low	53.9	Low	82 Å²	82	106.5 Å²	106.5	44%	0.439	61%	0.613	S	S	.	*	H	α-helix	trans	-61.9	-44.4	176.3	-60.1	-52.7	0	0	0	111.2	V435 T436 Q442 L443	V435-D439 HydrophobicContact CG1-CB 3.92Å; T436-D439 VanDerWaalsContact CB-OD2 3.27Å; T436-D439 WeakPolarHBondContact CB-OD2 3.11Å; T436-D439 WeakPolarHBondContact CG2-OD2 3.43Å; T436-D439 PolarHBondContact N-OD2 2.6Å; T436-D439 VanDerWaalsContact N-OD2 3.12Å; T436-D439 PolarHBondContact O-N 3Å; T436-D439 VanDerWaalsContact O-N 3.16Å; T436-D439 PolarHBondContact OG1-N 3.01Å; T436-D439 VanDerWaalsContact OG1-N 3.17Å; T436-D439 PolarHBondContact OG1-OD2 3.1Å; D439-Q442 PolarHBondContact O-N 2.96Å; D439-L443 PolarHBondContact O-N 3.07Å
440	V	59.9	Low	55.5	Low	70 Å²	70	105.1 Å²	105.1	42%	0.424	60%	0.601	S	S	.	*	H	α-helix	trans	-65.5	-45.9	178.3	-177.5	0	0	0	0	110.7	V435 T436 E438 Q442 L443 E444	V435-V440 HydrophobicContact CG1-CG2 3.99Å; T436-V440 PolarHBondContact O-N 2.96Å; E438-V440 PolarHBondContact O-N 2.87Å; V440-Q442 VanDerWaalsContact C-N 3.33Å; V440-Q442 PolarHBondContact O-N 3.24Å; V440-L443 PolarHBondContact O-N 3.35Å; V440-L443 VanDerWaalsContact O-N 3.14Å; V440-E444 WeakPolarHBondContact O-CG 3.48Å; V440-E444 PolarHBondContact O-N 3.12Å
441	A	65.2	Low	57.5	Low	53 Å²	53	104.8 Å²	104.8	44%	0.438	59%	0.586	S	S	.	*	H	α-helix	trans	-64.1	-35.7	178	0	0	0	0	0	112.7	Q437 E438 A445	Q437-A441 WeakPolarHBondContact O-CB 3.35Å; Q437-A441 PolarHBondContact O-N 3.06Å; E438-A441 PolarHBondContact O-N 3.36Å; A441-A445 WeakPolarHBondContact O-CB 3.48Å; A441-A445 PolarHBondContact O-N 2.95Å
442	Q	63.7	Low	59.2	Low	125 Å²	125	103.3 Å²	103.3	58%	0.584	58%	0.575	S	S	*	*	H	α-helix	trans	-66.4	-40.4	171.9	-75.9	178.4	51.9	0	0	111.7	E438 D439 V440 A445 V446	E438-Q442 WeakPolarHBondContact O-CB 3.42Å; E438-Q442 VanDerWaalsContact O-CG 3.29Å; E438-Q442 WeakPolarHBondContact O-CG 3.43Å; E438-Q442 PolarHBondContact O-N 2.95Å; D439-Q442 PolarHBondContact O-N 2.96Å; V440-Q442 VanDerWaalsContact C-N 3.33Å; V440-Q442 PolarHBondContact O-N 3.24Å; Q442-A445 PolarHBondContact O-N 3.34Å; Q442-V446 WeakPolarHBondContact O-CB 3.48Å; Q442-V446 WeakPolarHBondContact O-CG2 3.41Å; Q442-V446 PolarHBondContact O-N 2.98Å
443	L	58.6	Low	61.6	Low	120 Å²	120	102.1 Å²	102.1	63%	0.628	56%	0.556	S	S	*	*	H	α-helix	trans	-65.3	-43.1	177.1	-146.2	77.9	0	0	0	111.7	D439 V440 V446 L447	D439-L443 PolarHBondContact O-N 3.07Å; V440-L443 PolarHBondContact O-N 3.35Å; V440-L443 VanDerWaalsContact O-N 3.14Å; L443-V446 PolarHBondContact O-N 3.03Å; L443-L447 WeakPolarHBondContact O-CB 3.37Å; L443-L447 VanDerWaalsContact O-CG 3.28Å; L443-L447 WeakPolarHBondContact O-CG 3.25Å; L443-L447 PolarHBondContact O-N 3.21Å
444	E	67.7	Low	63.3	Low	112 Å²	112	100.4 Å²	100.4	52%	0.523	54%	0.539	S	S	.	.	H	α-helix	trans	-62.7	-42.7	174.4	-72.5	-176.3	163.5	0	0	112.1	V440 L447 Q448	V440-E444 WeakPolarHBondContact O-CG 3.48Å; V440-E444 PolarHBondContact O-N 3.12Å; E444-L447 PolarHBondContact O-N 3.36Å; E444-Q448 WeakPolarHBondContact O-CG 3.27Å; E444-Q448 PolarHBondContact O-N 3.35Å
445	A	71.2	Confident	65.3	Low	57 Å²	57	102.4 Å²	102.4	47%	0.471	53%	0.532	S	S	.	.	H	α-helix	trans	-63.1	-41.9	176	0	0	0	0	0	112.3	A441 Q442 Q448 E449	A441-A445 WeakPolarHBondContact O-CB 3.48Å; A441-A445 PolarHBondContact O-N 2.95Å; Q442-A445 PolarHBondContact O-N 3.34Å; A445-Q448 PolarHBondContact O-N 3.49Å; A445-E449 PolarHBondContact O-N 3.38Å
446	V	68.4	Low	67.2	Low	64 Å²	64	100.5 Å²	100.5	39%	0.388	52%	0.523	S	S	.	.	H	α-helix	trans	-66.1	-39.1	175.2	169.6	0	0	0	0	111.3	Q442 L443 E449 R450	Q442-V446 WeakPolarHBondContact O-CB 3.48Å; Q442-V446 WeakPolarHBondContact O-CG2 3.41Å; Q442-V446 PolarHBondContact O-N 2.98Å; L443-V446 PolarHBondContact O-N 3.03Å; V446-E449 PolarHBondContact O-N 2.99Å; V446-R450 VanDerWaalsContact O-CG 3.29Å; V446-R450 WeakPolarHBondContact O-CG 3.38Å; V446-R450 PolarHBondContact O-N 3.27Å
447	L	62.3	Low	68.4	Low	104 Å²	104	102.5 Å²	102.5	55%	0.545	53%	0.531	S	S	.	.	H	α-helix	trans	-63.2	-45.6	175	-73.8	167.8	0	0	0	111.4	L443 E444 E449 R450 D451	L443-L447 WeakPolarHBondContact O-CB 3.37Å; L443-L447 VanDerWaalsContact O-CG 3.28Å; L443-L447 WeakPolarHBondContact O-CG 3.25Å; L443-L447 PolarHBondContact O-N 3.21Å; E444-L447 PolarHBondContact O-N 3.36Å; L447-E449 PolarHBondContact O-N 3.04Å; L447-R450 PolarHBondContact O-N 3.5Å; L447-R450 VanDerWaalsContact O-N 3.15Å; L447-D451 PolarHBondContact O-N 2.84Å
448	Q	75.4	Confident	69.6	Low	133 Å²	133	97.1 Å²	97.1	62%	0.621	51%	0.512	S	S	*	.	H	α-helix	trans	-61	-40.9	175.2	-71.1	177.2	21	0	0	112.3	E444 A445 R450 D451 V452	E444-Q448 WeakPolarHBondContact O-CG 3.27Å; E444-Q448 PolarHBondContact O-N 3.35Å; A445-Q448 PolarHBondContact O-N 3.49Å; Q448-R450 VanDerWaalsContact C-N 3.31Å; Q448-R450 PolarHBondContact O-N 2.96Å; Q448-D451 PolarHBondContact O-N 3.34Å; Q448-V452 WeakPolarHBondContact O-CG2 3.49Å; Q448-V452 PolarHBondContact O-N 3.37Å
449	E	75.6	Confident	71.1	Confident	100 Å²	100	91.3 Å²	91.3	47%	0.467	49%	0.492	S	S	.	.	H	α-helix	trans	-60.1	-42.2	174.3	-163	-156.1	167.6	0	0	111.4	A445 V446 L447 V452 Q453	A445-E449 PolarHBondContact O-N 3.38Å; V446-E449 PolarHBondContact O-N 2.99Å; L447-E449 PolarHBondContact O-N 3.04Å; E449-V452 PolarHBondContact O-N 2.9Å; E449-Q453 WeakPolarHBondContact O-CG 3.34Å; E449-Q453 PolarHBondContact O-N 3.41Å; E449-Q453 PolarHBondContact OE1-NE2 3.21Å; E449-Q453 VanDerWaalsContact OE1-NE2 3.12Å
450	R	67	Low	72.6	Confident	131 Å²	131	91.6 Å²	91.6	49%	0.494	49%	0.491	S	S	.	.	H	α-helix	trans	-70.4	-38.2	179.5	-64.1	-64	159.7	81.5	8.8	112.6	V446 L447 Q448 V452 Q453 I454	V446-R450 VanDerWaalsContact O-CG 3.29Å; V446-R450 WeakPolarHBondContact O-CG 3.38Å; V446-R450 PolarHBondContact O-N 3.27Å; L447-R450 PolarHBondContact O-N 3.5Å; L447-R450 VanDerWaalsContact O-N 3.15Å; Q448-R450 VanDerWaalsContact C-N 3.31Å; Q448-R450 PolarHBondContact O-N 2.96Å; R450-V452 VanDerWaalsContact C-N 3.34Å; R450-V452 PolarHBondContact O-N 2.97Å; R450-Q453 PolarHBondContact O-N 2.89Å; R450-I454 WeakPolarHBondContact O-CB 3.15Å; R450-I454 WeakPolarHBondContact O-CD1 3.47Å; R450-I454 VanDerWaalsContact O-CG1 3.24Å; R450-I454 WeakPolarHBondContact O-CG1 3.44Å; R450-I454 PolarHBondContact O-N 3.32Å
451	D	75.8	Confident	72.9	Confident	85 Å²	85	94.9 Å²	94.9	46%	0.455	50%	0.503	S	S	.	.	H	α-helix	trans	-65	-37.9	174.3	-77.8	-26.9	0	0	0	111.8	L447 Q448 I454 Q455	L447-D451 PolarHBondContact O-N 2.84Å; Q448-D451 PolarHBondContact O-N 3.34Å; D451-I454 PolarHBondContact O-N 3.48Å; D451-Q455 WeakPolarHBondContact O-CG 3.31Å; D451-Q455 PolarHBondContact O-N 2.88Å
452	V	80.9	Confident	73.9	Confident	97 Å²	97	98.9 Å²	98.9	59%	0.588	51%	0.513	S	S	*	.	H	α-helix	trans	-64.9	-41.1	172.1	171.2	0	0	0	0	111.7	Q448 E449 R450 Q455 S456	Q448-V452 WeakPolarHBondContact O-CG2 3.49Å; Q448-V452 PolarHBondContact O-N 3.37Å; E449-V452 PolarHBondContact O-N 2.9Å; R450-V452 VanDerWaalsContact C-N 3.34Å; R450-V452 PolarHBondContact O-N 2.97Å; V452-Q455 PolarHBondContact O-N 2.71Å; V452-S456 WeakPolarHBondContact O-CB 3.46Å; V452-S456 PolarHBondContact O-N 2.98Å
453	Q	78.4	Confident	75	Confident	89 Å²	89	99.8 Å²	99.8	42%	0.416	51%	0.51	S	S	.	.	H	α-helix	trans	-63.2	-41.5	173.3	-73.1	-179.2	10.2	0	0	112	E449 R450 S456 L457	E449-Q453 WeakPolarHBondContact O-CG 3.34Å; E449-Q453 PolarHBondContact O-N 3.41Å; E449-Q453 PolarHBondContact OE1-NE2 3.21Å; E449-Q453 VanDerWaalsContact OE1-NE2 3.12Å; R450-Q453 PolarHBondContact O-N 2.89Å; Q453-S456 PolarHBondContact O-N 3.04Å; Q453-L457 WeakPolarHBondContact O-CG 3.49Å; Q453-L457 PolarHBondContact O-N 3.37Å
454	I	77.2	Confident	76	Confident	89 Å²	89	99.1 Å²	99.1	46%	0.456	51%	0.507	S	S	.	.	H	α-helix	trans	-62.2	-47.5	176.9	-71.3	162.5	0	0	0	110.6	R450 D451 S456 L457 C458	R450-I454 WeakPolarHBondContact O-CB 3.15Å; R450-I454 WeakPolarHBondContact O-CD1 3.47Å; R450-I454 VanDerWaalsContact O-CG1 3.24Å; R450-I454 WeakPolarHBondContact O-CG1 3.44Å; R450-I454 PolarHBondContact O-N 3.32Å; D451-I454 PolarHBondContact O-N 3.48Å; I454-S456 VanDerWaalsContact C-N 3.31Å; I454-S456 PolarHBondContact O-N 3.03Å; I454-L457 PolarHBondContact O-N 2.94Å; I454-C458 PolarHBondContact O-N 2.92Å; I454-C458 PolarHBondContact O-SG 3.41Å; I454-C458 VanDerWaalsContact O-SG 3.33Å
455	Q	80.1	Confident	76.6	Confident	142 Å²	142	96.1 Å²	96.1	66%	0.664	50%	0.499	S	S	*	.	H	α-helix	trans	-59.7	-41.2	175.6	-71	178.9	18	0	0	112.1	D451 V452 L457 C458 G459	D451-Q455 WeakPolarHBondContact O-CG 3.31Å; D451-Q455 PolarHBondContact O-N 2.88Å; V452-Q455 PolarHBondContact O-N 2.71Å; Q455-L457 VanDerWaalsContact C-N 3.34Å; Q455-L457 PolarHBondContact O-N 2.89Å; Q455-C458 PolarHBondContact O-N 3.46Å; Q455-G459 PolarHBondContact O-N 3.31Å
456	S	81.4	Confident	77.5	Confident	66 Å²	66	99 Å²	99	46%	0.462	51%	0.505	S	S	.	.	H	α-helix	trans	-64.6	-35.7	176.3	-167.1	0	0	0	0	113	V452 Q453 I454 H460	V452-S456 WeakPolarHBondContact O-CB 3.46Å; V452-S456 PolarHBondContact O-N 2.98Å; Q453-S456 PolarHBondContact O-N 3.04Å; I454-S456 VanDerWaalsContact C-N 3.31Å; I454-S456 PolarHBondContact O-N 3.03Å; S456-H460 PolarHBondContact O-N 3.47Å; S456-H460 VanDerWaalsContact O-N 3.12Å; S456-H460 PolarHBondContact O-ND1 2.83Å
457	L	75.3	Confident	78.4	Confident	108 Å²	108	101.4 Å²	101.4	57%	0.565	51%	0.512	S	S	*	.	H	α-helix	trans	-71.7	-43.3	175	-72.8	169.1	0	0	0	111.9	Q453 I454 Q455 G459 H460 M461	Q453-L457 WeakPolarHBondContact O-CG 3.49Å; Q453-L457 PolarHBondContact O-N 3.37Å; I454-L457 PolarHBondContact O-N 2.94Å; Q455-L457 VanDerWaalsContact C-N 3.34Å; Q455-L457 PolarHBondContact O-N 2.89Å; L457-G459 VanDerWaalsContact C-N 3.34Å; L457-G459 PolarHBondContact O-N 2.99Å; L457-H460 WeakPolarHBondContact O-CB 3.36Å; L457-H460 PolarHBondContact O-N 3.38Å; L457-M461 WeakPolarHBondContact O-CG 3.42Å; L457-M461 PolarHBondContact O-N 3.31Å
458	C	76.1	Confident	79.5	Confident	66 Å²	66	102.3 Å²	102.3	45%	0.446	51%	0.512	S	S	.	.	H	α-helix	trans	-56.4	-48.4	172.4	-67.6	0	0	0	0	111.1	I454 Q455 H460 M461 E462	I454-C458 PolarHBondContact O-N 2.92Å; I454-C458 PolarHBondContact O-SG 3.41Å; I454-C458 VanDerWaalsContact O-SG 3.33Å; Q455-C458 PolarHBondContact O-N 3.46Å; C458-H460 PolarHBondContact O-N 3.1Å; C458-M461 PolarHBondContact O-N 2.93Å; C458-E462 PolarHBondContact O-N 3.1Å
459	G	83.9	Confident	80.1	Confident	25 Å²	25	101.5 Å²	101.5	26%	0.258	51%	0.508	S	S	.	.	H	α-helix	trans	-67.4	-12.2	175.7	0	0	0	0	0	115	Q455 L457 R463	Q455-G459 PolarHBondContact O-N 3.31Å; L457-G459 VanDerWaalsContact C-N 3.34Å; L457-G459 PolarHBondContact O-N 2.99Å; G459-R463 PolarHBondContact O-NE 2.86Å; G459-R463 PolarHBondContact O-NH2 3.03Å
460	H	79.3	Confident	80.8	Confident	88 Å²	88	99.8 Å²	99.8	41%	0.407	51%	0.507	S	S	.	.	H	α-helix	trans	-84.7	-41.8	164.7	-83.2	95.5	0	0	0	111.7	S456 L457 C458 E462 R463 L464	S456-H460 PolarHBondContact O-N 3.47Å; S456-H460 VanDerWaalsContact O-N 3.12Å; S456-H460 PolarHBondContact O-ND1 2.83Å; L457-H460 WeakPolarHBondContact O-CB 3.36Å; L457-H460 PolarHBondContact O-N 3.38Å; C458-H460 PolarHBondContact O-N 3.1Å; H460-E462 PolarHBondContact O-N 3.01Å; H460-R463 PolarHBondContact CD2-NH2 2.74Å; H460-R463 PolarHBondContact CE1-NH2 2.84Å; H460-R463 PolarHBondContact ND1-NH2 2.79Å; H460-R463 PolarHBondContact NE2-NH2 3.12Å; H460-R463 PolarHBondContact O-N 2.81Å; H460-L464 WeakPolarHBondContact O-CG 3.44Å; H460-L464 PolarHBondContact O-N 3.44Å
461	M	68	Low	81.6	Confident	139 Å²	139	98 Å²	98	69%	0.685	51%	0.507	S	S	*	.	H	α-helix	trans	-62.9	-40.2	178.6	-70.2	-178.8	64.3	0	0	112.5	L457 C458 L464 S465	L457-M461 WeakPolarHBondContact O-CG 3.42Å; L457-M461 PolarHBondContact O-N 3.31Å; C458-M461 PolarHBondContact O-N 2.93Å; M461-L464 PolarHBondContact O-N 3.28Å; M461-S465 PolarHBondContact O-N 3.48Å
462	E	84.9	Confident	82.1	Confident	137 Å²	137	98.7 Å²	98.7	64%	0.64	51%	0.507	S	S	*	.	H	α-helix	trans	-61.9	-46.2	174.9	-71	-179.7	163.5	0	0	112	C458 H460 L464 S465 L466	C458-E462 PolarHBondContact O-N 3.1Å; H460-E462 PolarHBondContact O-N 3.01Å; E462-L464 PolarHBondContact O-N 2.96Å; E462-S465 WeakPolarHBondContact O-CB 3.48Å; E462-S465 PolarHBondContact O-N 2.9Å; E462-S465 VanDerWaalsContact O-N 3.11Å; E462-L466 WeakPolarHBondContact O-CG 3.37Å; E462-L466 PolarHBondContact O-N 3.22Å
463	R	86.8	Confident	82.4	Confident	143 Å²	143	101 Å²	101	54%	0.54	51%	0.512	S	S	.	.	H	α-helix	trans	-60.5	-43.8	176.5	-80.3	-178	-74.6	142.7	0.2	112.2	G459 H460 S465 L466 E467	G459-R463 PolarHBondContact O-NE 2.86Å; G459-R463 PolarHBondContact O-NH2 3.03Å; H460-R463 PolarHBondContact CD2-NH2 2.74Å; H460-R463 PolarHBondContact CE1-NH2 2.84Å; H460-R463 PolarHBondContact ND1-NH2 2.79Å; H460-R463 PolarHBondContact NE2-NH2 3.12Å; H460-R463 PolarHBondContact O-N 2.81Å; R463-S465 VanDerWaalsContact C-N 3.29Å; R463-S465 PolarHBondContact O-N 3.22Å; R463-L466 PolarHBondContact O-N 3.19Å; R463-E467 WeakPolarHBondContact O-CB 3.32Å; R463-E467 PolarHBondContact O-N 3.39Å
464	L	79.7	Confident	83	Confident	107 Å²	107	102.4 Å²	102.4	56%	0.56	52%	0.518	S	S	*	.	H	α-helix	trans	-66	-29.7	175.4	-70.6	169.9	0	0	0	112.5	H460 M461 E462 K468	H460-L464 WeakPolarHBondContact O-CG 3.44Å; H460-L464 PolarHBondContact O-N 3.44Å; M461-L464 PolarHBondContact O-N 3.28Å; E462-L464 PolarHBondContact O-N 2.96Å; L464-K468 WeakPolarHBondContact O-CB 3.23Å; L464-K468 PolarHBondContact O-N 3.38Å
465	S	81.1	Confident	83.5	Confident	49 Å²	49	103.7 Å²	103.7	34%	0.343	53%	0.525	S	S	.	.	H	α-helix	trans	-69.7	-43.6	173.4	-159.8	0	0	0	0	111.7	M461 E462 R463 K468 E469	M461-S465 PolarHBondContact O-N 3.48Å; E462-S465 WeakPolarHBondContact O-CB 3.48Å; E462-S465 PolarHBondContact O-N 2.9Å; E462-S465 VanDerWaalsContact O-N 3.11Å; R463-S465 VanDerWaalsContact C-N 3.29Å; R463-S465 PolarHBondContact O-N 3.22Å; S465-K468 WeakPolarHBondContact O-CB 3.39Å; S465-K468 PolarHBondContact O-N 3.37Å; S465-E469 WeakPolarHBondContact O-CG 3.26Å; S465-E469 PolarHBondContact O-N 3.49Å
466	L	89.8	Confident	83.8	Confident	116 Å²	116	103.2 Å²	103.2	61%	0.607	52%	0.521	S	S	*	.	H	α-helix	trans	-64.6	-41.6	176.2	-67.8	168.9	0	0	0	112	E462 R463 E469 S470	E462-L466 WeakPolarHBondContact O-CG 3.37Å; E462-L466 PolarHBondContact O-N 3.22Å; R463-L466 PolarHBondContact O-N 3.19Å; L466-E469 PolarHBondContact O-N 3.31Å; L466-S470 WeakPolarHBondContact O-CB 3.27Å; L466-S470 PolarHBondContact O-N 3.15Å
467	E	87.1	Confident	84.2	Confident	115 Å²	115	101.5 Å²	101.5	54%	0.537	51%	0.514	S	S	.	.	H	α-helix	trans	-61.7	-45	174.3	-175.5	176	-168	0	0	111.5	R463 E469 S470 L471	R463-E467 WeakPolarHBondContact O-CB 3.32Å; R463-E467 PolarHBondContact O-N 3.39Å; E467-E469 PolarHBondContact O-N 2.99Å; E467-S470 WeakPolarHBondContact O-CB 3.34Å; E467-S470 PolarHBondContact O-N 2.97Å; E467-L471 HydrophobicContact CG-CD1 4.13Å; E467-L471 WeakPolarHBondContact O-CB 3.39Å; E467-L471 WeakPolarHBondContact O-CG 3.04Å; E467-L471 PolarHBondContact O-N 2.96Å
468	K	85.9	Confident	84.8	Confident	123 Å²	123	101.5 Å²	101.5	54%	0.535	51%	0.514	S	S	.	.	H	α-helix	trans	-60.1	-41.3	174.4	172.6	-169.6	170.4	-163.1	0	112.6	L464 S465 Q472	L464-K468 WeakPolarHBondContact O-CB 3.23Å; L464-K468 PolarHBondContact O-N 3.38Å; S465-K468 WeakPolarHBondContact O-CB 3.39Å; S465-K468 PolarHBondContact O-N 3.37Å; K468-Q472 WeakPolarHBondContact O-CB 3.4Å; K468-Q472 VanDerWaalsContact O-CG 3.3Å; K468-Q472 WeakPolarHBondContact O-CG 3.43Å; K468-Q472 PolarHBondContact O-N 2.99Å
469	E	86.9	Confident	85.3	Confident	117 Å²	117	106.1 Å²	106.1	55%	0.547	53%	0.526	S	S	.	.	H	α-helix	trans	-67.2	-41.7	176.8	-76.7	178.5	-167.2	0	0	111.9	S465 L466 E467 Q472 Q473	S465-E469 WeakPolarHBondContact O-CG 3.26Å; S465-E469 PolarHBondContact O-N 3.49Å; L466-E469 PolarHBondContact O-N 3.31Å; E467-E469 PolarHBondContact O-N 2.99Å; E469-Q472 PolarHBondContact O-N 3.32Å; E469-Q473 PolarHBondContact O-N 2.88Å
470	S	90.5	Very high	85.7	Confident	64 Å²	64	110 Å²	110	45%	0.448	54%	0.54	S	S	.	.	H	α-helix	trans	-58.3	-51.8	173.4	-175.1	0	0	0	0	111.6	L466 E467 Q472 Q473 E474	L466-S470 WeakPolarHBondContact O-CB 3.27Å; L466-S470 PolarHBondContact O-N 3.15Å; E467-S470 WeakPolarHBondContact O-CB 3.34Å; E467-S470 PolarHBondContact O-N 2.97Å; S470-Q472 VanDerWaalsContact C-N 3.29Å; S470-Q472 PolarHBondContact O-N 3.33Å; S470-Q473 WeakPolarHBondContact O-CA 3.49Å; S470-Q473 WeakPolarHBondContact O-CB 3.4Å; S470-Q473 PolarHBondContact O-N 2.94Å; S470-E474 PolarHBondContact O-N 3.34Å
471	L	85.4	Confident	86.2	Confident	94 Å²	94	111.7 Å²	111.7	49%	0.492	55%	0.546	S	S	.	.	H	α-helix	trans	-61.3	-35.1	177	-69.9	169.5	0	0	0	112.5	E467 Q473 L475	E467-L471 HydrophobicContact CG-CD1 4.13Å; E467-L471 WeakPolarHBondContact O-CB 3.39Å; E467-L471 WeakPolarHBondContact O-CG 3.04Å; E467-L471 PolarHBondContact O-N 2.96Å; L471-Q473 VanDerWaalsContact C-N 3.32Å; L471-L475 VanDerWaalsContact O-CB 3.29Å; L471-L475 WeakPolarHBondContact O-CB 3.42Å; L471-L475 PolarHBondContact O-N 3.27Å
472	Q	86.1	Confident	87.1	Confident	98 Å²	98	109.6 Å²	109.6	46%	0.458	54%	0.541	S	S	.	.	H	α-helix	trans	-67.8	-30.6	172.5	-77.6	-174.4	9.8	0	0	113	K468 E469 S470 K476	K468-Q472 WeakPolarHBondContact O-CB 3.4Å; K468-Q472 VanDerWaalsContact O-CG 3.3Å; K468-Q472 WeakPolarHBondContact O-CG 3.43Å; K468-Q472 PolarHBondContact O-N 2.99Å; E469-Q472 PolarHBondContact O-N 3.32Å; S470-Q472 VanDerWaalsContact C-N 3.29Å; S470-Q472 PolarHBondContact O-N 3.33Å; Q472-K476 WeakPolarHBondContact O-CD 3.38Å; Q472-K476 VanDerWaalsContact O-CG 3.27Å; Q472-K476 WeakPolarHBondContact O-CG 3.49Å; Q472-K476 PolarHBondContact O-N 3.43Å
473	Q	87.6	Confident	87.2	Confident	145 Å²	145	104.4 Å²	104.4	68%	0.678	52%	0.524	S	S	*	.	H	α-helix	trans	-74.7	-40.6	175.2	-168.4	168.1	-3.4	0	0	111.6	E469 S470 L471 K476 G477	E469-Q473 PolarHBondContact O-N 2.88Å; S470-Q473 WeakPolarHBondContact O-CA 3.49Å; S470-Q473 WeakPolarHBondContact O-CB 3.4Å; S470-Q473 PolarHBondContact O-N 2.94Å; L471-Q473 VanDerWaalsContact C-N 3.32Å; Q473-K476 PolarHBondContact O-N 2.68Å; Q473-G477 PolarHBondContact O-N 2.82Å; Q473-G477 VanDerWaalsContact O-N 3.09Å
474	E	89.7	Confident	87.4	Confident	120 Å²	120	102.4 Å²	102.4	56%	0.561	52%	0.521	S	S	*	.	H	α-helix	trans	-61.8	-44.2	171.3	-67.6	-163.5	148.3	0	0	112.2	S470 K476 G477 L478	S470-E474 PolarHBondContact O-N 3.34Å; E474-K476 VanDerWaalsContact C-N 3.32Å; E474-K476 PolarHBondContact O-N 3.47Å; E474-G477 CarbonylContact O-C 3.57Å; E474-G477 WeakPolarHBondContact O-CA 3.28Å; E474-G477 PolarHBondContact O-N 2.99Å; E474-L478 PolarHBondContact O-N 3.45Å
475	L	87.1	Confident	87.9	Confident	115 Å²	115	102.4 Å²	102.4	60%	0.602	52%	0.521	S	S	*	.	H	α-helix	trans	-62.6	-37.8	178.7	-162.6	160.7	0	0	0	111.6	L471 L478 K479	L471-L475 VanDerWaalsContact O-CB 3.29Å; L471-L475 WeakPolarHBondContact O-CB 3.42Å; L471-L475 PolarHBondContact O-N 3.27Å; L475-L478 PolarHBondContact O-N 2.97Å; L475-K479 WeakPolarHBondContact O-CB 3.44Å; L475-K479 PolarHBondContact O-N 2.98Å
476	K	87.4	Confident	88	Confident	133 Å²	133	104.9 Å²	104.9	58%	0.578	53%	0.53	S	S	*	.	H	α-helix	trans	-60.4	-45.7	169.9	-72.8	164.5	-173.4	168.7	0	111.5	Q472 Q473 E474 K479 I480	Q472-K476 WeakPolarHBondContact O-CD 3.38Å; Q472-K476 VanDerWaalsContact O-CG 3.27Å; Q472-K476 WeakPolarHBondContact O-CG 3.49Å; Q472-K476 PolarHBondContact O-N 3.43Å; Q473-K476 PolarHBondContact O-N 2.68Å; E474-K476 VanDerWaalsContact C-N 3.32Å; E474-K476 PolarHBondContact O-N 3.47Å; K476-K479 PolarHBondContact O-N 3Å; K476-I480 WeakPolarHBondContact O-CG1 3.39Å; K476-I480 PolarHBondContact O-N 2.89Å; K476-I480 VanDerWaalsContact O-N 3.13Å
477	G	89	Confident	88	Confident	30 Å²	30	104.3 Å²	104.3	31%	0.309	53%	0.527	S	S	.	.	H	α-helix	trans	-63.1	-42.3	177.4	0	0	0	0	0	113.6	Q473 E474 I480 K481	Q473-G477 PolarHBondContact O-N 2.82Å; Q473-G477 VanDerWaalsContact O-N 3.09Å; E474-G477 CarbonylContact O-C 3.57Å; E474-G477 WeakPolarHBondContact O-CA 3.28Å; E474-G477 PolarHBondContact O-N 2.99Å; G477-I480 PolarHBondContact O-N 3.23Å; G477-K481 PolarHBondContact O-N 3.21Å
478	L	88.6	Confident	88	Confident	108 Å²	108	104 Å²	104	57%	0.565	53%	0.526	S	S	*	.	H	α-helix	trans	-62.6	-41.3	173.3	-77	165.5	0	0	0	111.7	E474 L475 I480 K481 V482	E474-L478 PolarHBondContact O-N 3.45Å; L475-L478 PolarHBondContact O-N 2.97Å; L478-I480 VanDerWaalsContact C-N 3.31Å; L478-I480 PolarHBondContact O-N 3.27Å; L478-K481 PolarHBondContact O-N 2.78Å; L478-V482 WeakPolarHBondContact O-CG2 3.17Å; L478-V482 PolarHBondContact O-N 3.43Å
479	K	87.2	Confident	87.9	Confident	162 Å²	162	102.7 Å²	102.7	70%	0.704	52%	0.524	S	S	*	.	H	α-helix	trans	-63.4	-35.2	178.1	-170.6	175.5	-178.3	-179.7	0	112.8	L475 K476 G483	L475-K479 WeakPolarHBondContact O-CB 3.44Å; L475-K479 PolarHBondContact O-N 2.98Å; K476-K479 PolarHBondContact O-N 3Å; K479-G483 PolarHBondContact O-N 3.26Å
480	I	91.3	Very high	87.8	Confident	107 Å²	107	98.6 Å²	98.6	55%	0.549	51%	0.513	S	S	.	.	H	α-helix	trans	-64.5	-50.4	173.4	-66.8	164.6	0	0	0	110	K476 G477 L478 V482 G483 E484	K476-I480 WeakPolarHBondContact O-CG1 3.39Å; K476-I480 PolarHBondContact O-N 2.89Å; K476-I480 VanDerWaalsContact O-N 3.13Å; G477-I480 PolarHBondContact O-N 3.23Å; L478-I480 VanDerWaalsContact C-N 3.31Å; L478-I480 PolarHBondContact O-N 3.27Å; I480-V482 VanDerWaalsContact C-N 3.29Å; I480-V482 PolarHBondContact O-N 2.96Å; I480-G483 WeakPolarHBondContact O-CA 3.41Å; I480-G483 PolarHBondContact O-N 2.94Å; I480-E484 HydrophobicContact CG2-CG 4.46Å; I480-E484 PolarHBondContact O-N 3.4Å
481	K	89.7	Confident	87.5	Confident	123 Å²	123	101 Å²	101	54%	0.535	52%	0.519	S	S	.	.	H	α-helix	trans	-59.5	-36	178.4	-67	176.3	-178.5	180	0	113.5	G477 L478 G483 E484 I485	G477-K481 PolarHBondContact O-N 3.21Å; L478-K481 PolarHBondContact O-N 2.78Å; K481-G483 VanDerWaalsContact C-N 3.31Å; K481-E484 PolarHBondContact O-N 2.91Å; K481-I485 WeakPolarHBondContact O-CB 3.32Å; K481-I485 WeakPolarHBondContact O-CD1 3.42Å; K481-I485 VanDerWaalsContact O-CG1 3.27Å; K481-I485 WeakPolarHBondContact O-CG1 3.47Å; K481-I485 PolarHBondContact O-N 3.39Å
482	V	88.5	Confident	87.3	Confident	96 Å²	96	101.5 Å²	101.5	58%	0.582	52%	0.521	S	S	*	.	H	α-helix	trans	-65.7	-35.5	173.8	170.2	0	0	0	0	111.4	L478 I480 N486	L478-V482 WeakPolarHBondContact O-CG2 3.17Å; L478-V482 PolarHBondContact O-N 3.43Å; I480-V482 VanDerWaalsContact C-N 3.29Å; I480-V482 PolarHBondContact O-N 2.96Å; V482-N486 VanDerWaalsContact O-CB 3.3Å; V482-N486 WeakPolarHBondContact O-CB 3.39Å; V482-N486 PolarHBondContact O-N 2.66Å
483	G	86.6	Confident	87	Confident	27 Å²	27	102 Å²	102	28%	0.278	53%	0.525	S	S	.	.	H	α-helix	trans	-62.4	-53.1	169.7	0	0	0	0	0	112	K479 I480 K481 I485 N486 D487	K479-G483 PolarHBondContact O-N 3.26Å; I480-G483 WeakPolarHBondContact O-CA 3.41Å; I480-G483 PolarHBondContact O-N 2.94Å; K481-G483 VanDerWaalsContact C-N 3.31Å; G483-I485 VanDerWaalsContact C-N 3.27Å; G483-I485 PolarHBondContact O-N 3.05Å; G483-N486 WeakPolarHBondContact O-CA 3.23Å; G483-N486 WeakPolarHBondContact O-CB 3.26Å; G483-N486 PolarHBondContact O-N 3.25Å; G483-D487 VanDerWaalsContact O-CG 3.28Å; G483-D487 PolarHBondContact O-N 3.04Å
484	E	90.9	Very high	86.8	Confident	101 Å²	101	101.5 Å²	101.5	47%	0.472	52%	0.523	S	S	.	.	H	α-helix	trans	-54.6	-40.7	178.6	-65.1	167.2	170.8	0	0	112.8	I480 K481 Q488	I480-E484 HydrophobicContact CG2-CG 4.46Å; I480-E484 PolarHBondContact O-N 3.4Å; K481-E484 PolarHBondContact O-N 2.91Å; E484-Q488 VanDerWaalsContact O-CG 3.25Å; E484-Q488 WeakPolarHBondContact O-CG 3.5Å; E484-Q488 PolarHBondContact O-N 3.2Å; E484-Q488 VanDerWaalsContact O-N 3.09Å; E484-Q488 PolarHBondContact O-NE2 3.41Å
485	I	89.9	Confident	86.4	Confident	108 Å²	108	98.9 Å²	98.9	55%	0.554	52%	0.515	S	S	*	.	H	α-helix	trans	-70.5	-38.4	176.3	-68.9	165.6	0	0	0	111.5	K481 G483 Q488 L489	K481-I485 WeakPolarHBondContact O-CB 3.32Å; K481-I485 WeakPolarHBondContact O-CD1 3.42Å; K481-I485 VanDerWaalsContact O-CG1 3.27Å; K481-I485 WeakPolarHBondContact O-CG1 3.47Å; K481-I485 PolarHBondContact O-N 3.39Å; G483-I485 VanDerWaalsContact C-N 3.27Å; G483-I485 PolarHBondContact O-N 3.05Å; I485-Q488 PolarHBondContact O-N 2.97Å; I485-L489 WeakPolarHBondContact O-CB 3.45Å; I485-L489 PolarHBondContact O-N 3.3Å
486	N	83.8	Confident	86	Confident	101 Å²	101	97.9 Å²	97.9	54%	0.54	51%	0.509	S	S	.	.	H	α-helix	trans	-66	-38.9	176.4	-177.4	91.9	0	0	0	111.8	V482 G483 L489 G490	V482-N486 VanDerWaalsContact O-CB 3.3Å; V482-N486 WeakPolarHBondContact O-CB 3.39Å; V482-N486 PolarHBondContact O-N 2.66Å; G483-N486 WeakPolarHBondContact O-CA 3.23Å; G483-N486 WeakPolarHBondContact O-CB 3.26Å; G483-N486 PolarHBondContact O-N 3.25Å; N486-L489 WeakPolarHBondContact O-CB 3.3Å; N486-L489 PolarHBondContact O-N 2.83Å; N486-G490 PolarHBondContact O-N 3.4Å
487	D	89.1	Confident	85.4	Confident	103 Å²	103	97.1 Å²	97.1	55%	0.551	51%	0.508	S	S	*	.	H	α-helix	trans	-70	-38.1	177.8	-61.2	-17.7	0	0	0	111.1	G483 G490 M491	G483-D487 VanDerWaalsContact O-CG 3.28Å; G483-D487 PolarHBondContact O-N 3.04Å; D487-G490 PolarHBondContact O-N 3.19Å; D487-M491 PolarHBondContact O-N 2.92Å
488	Q	87.2	Confident	84.8	Confident	110 Å²	110	98.1 Å²	98.1	51%	0.514	51%	0.514	S	S	.	.	H	α-helix	trans	-61.8	-40.9	169.4	-73.4	170.2	37	0	0	112.3	E484 I485 G490 M491 L492	E484-Q488 VanDerWaalsContact O-CG 3.25Å; E484-Q488 WeakPolarHBondContact O-CG 3.5Å; E484-Q488 PolarHBondContact O-N 3.2Å; E484-Q488 VanDerWaalsContact O-N 3.09Å; E484-Q488 PolarHBondContact O-NE2 3.41Å; I485-Q488 PolarHBondContact O-N 2.97Å; Q488-G490 VanDerWaalsContact C-N 3.33Å; Q488-M491 HydrophobicContact CG-CE 4.33Å; Q488-M491 PolarHBondContact O-N 3.35Å; Q488-L492 WeakPolarHBondContact O-CG 3.37Å; Q488-L492 PolarHBondContact O-N 2.88Å
489	L	83.7	Confident	84.1	Confident	95 Å²	95	99.2 Å²	99.2	50%	0.497	51%	0.513	S	S	.	.	H	α-helix	trans	-63.6	-39.9	174.7	-174.4	66.6	0	0	0	111.3	I485 N486 L492 M493	I485-L489 WeakPolarHBondContact O-CB 3.45Å; I485-L489 PolarHBondContact O-N 3.3Å; N486-L489 WeakPolarHBondContact O-CB 3.3Å; N486-L489 PolarHBondContact O-N 2.83Å; L489-L492 PolarHBondContact O-N 2.89Å; L489-M493 HydrophobicContact CG-SD 4.41Å; L489-M493 WeakPolarHBondContact O-CG 3.42Å; L489-M493 PolarHBondContact O-N 2.93Å
490	G	85.1	Confident	83.5	Confident	30 Å²	30	95.3 Å²	95.3	31%	0.309	50%	0.5	S	S	.	.	H	α-helix	trans	-57.1	-54.5	172.8	0	0	0	0	0	112.4	N486 D487 Q488 L492 M493 E494	N486-G490 PolarHBondContact O-N 3.4Å; D487-G490 PolarHBondContact O-N 3.19Å; Q488-G490 VanDerWaalsContact C-N 3.33Å; G490-L492 VanDerWaalsContact C-N 3.25Å; G490-L492 PolarHBondContact O-N 3.38Å; G490-M493 PolarHBondContact O-N 3.48Å; G490-E494 PolarHBondContact O-N 3.05Å
491	M	84.5	Confident	82.7	Confident	114 Å²	114	95.4 Å²	95.4	56%	0.562	50%	0.499	S	S	*	.	H	α-helix	trans	-59.1	-35.1	176.9	-69	-169.6	-65.3	0	0	112.9	D487 Q488 T495	D487-M491 PolarHBondContact O-N 2.92Å; Q488-M491 HydrophobicContact CG-CE 4.33Å; Q488-M491 PolarHBondContact O-N 3.35Å; M491-T495 VanDerWaalsContact O-CB 3.3Å; M491-T495 WeakPolarHBondContact O-CB 3.45Å; M491-T495 PolarHBondContact O-N 2.71Å; M491-T495 PolarHBondContact O-OG1 2.86Å
492	L	81.4	Confident	82	Confident	105 Å²	105	93.3 Å²	93.3	55%	0.55	50%	0.496	S	S	.	.	H	α-helix	trans	-69.2	-39.8	174.4	-73.9	170.3	0	0	0	112	Q488 L489 G490 T495 I496	Q488-L492 WeakPolarHBondContact O-CG 3.37Å; Q488-L492 PolarHBondContact O-N 2.88Å; L489-L492 PolarHBondContact O-N 2.89Å; G490-L492 VanDerWaalsContact C-N 3.25Å; G490-L492 PolarHBondContact O-N 3.38Å; L492-T495 PolarHBondContact O-N 3.4Å; L492-I496 WeakPolarHBondContact O-CD1 3.18Å; L492-I496 VanDerWaalsContact O-CG1 3.26Å; L492-I496 WeakPolarHBondContact O-CG1 3.33Å; L492-I496 PolarHBondContact O-N 3.05Å
493	M	78.1	Confident	81.2	Confident	109 Å²	109	93.4 Å²	93.4	54%	0.537	49%	0.492	S	S	.	.	H	α-helix	trans	-65.7	-42.1	174.6	-73.9	179.4	63.1	0	0	112.1	L489 G490 T495 I496 Q497	L489-M493 HydrophobicContact CG-SD 4.41Å; L489-M493 WeakPolarHBondContact O-CG 3.42Å; L489-M493 PolarHBondContact O-N 2.93Å; G490-M493 PolarHBondContact O-N 3.48Å; M493-T495 VanDerWaalsContact C-N 3.34Å; M493-I496 PolarHBondContact O-N 3.5Å; M493-Q497 WeakPolarHBondContact O-CG 3.37Å; M493-Q497 PolarHBondContact O-N 3.23Å
494	E	83.8	Confident	80.2	Confident	134 Å²	134	95.8 Å²	95.8	63%	0.626	50%	0.501	S	S	*	.	H	α-helix	trans	-61.2	-42.3	172	-70.6	177.7	175.7	0	0	111.4	G490 I496 Q497 A498	G490-E494 PolarHBondContact O-N 3.05Å; E494-I496 VanDerWaalsContact C-N 3.31Å; E494-I496 PolarHBondContact O-N 3.16Å; E494-Q497 PolarHBondContact O-N 2.87Å; E494-A498 WeakPolarHBondContact O-CB 3.2Å; E494-A498 PolarHBondContact O-N 3.07Å
495	T	81.3	Confident	79.2	Confident	66 Å²	66	96.6 Å²	96.6	41%	0.405	50%	0.503	S	S	.	.	H	α-helix	trans	-63.7	-35.4	175.7	-61.3	0	0	0	0	112.2	M491 L492 M493 K499	M491-T495 VanDerWaalsContact O-CB 3.3Å; M491-T495 WeakPolarHBondContact O-CB 3.45Å; M491-T495 PolarHBondContact O-N 2.71Å; M491-T495 PolarHBondContact O-OG1 2.86Å; L492-T495 PolarHBondContact O-N 3.4Å; M493-T495 VanDerWaalsContact C-N 3.34Å; T495-K499 HydrophobicContact CG2-CD 4.4Å; T495-K499 VanDerWaalsContact O-CG 3.29Å; T495-K499 WeakPolarHBondContact O-CG 3.37Å; T495-K499 PolarHBondContact O-N 3.43Å
496	I	78.1	Confident	77.7	Confident	93 Å²	93	96.5 Å²	96.5	48%	0.477	50%	0.503	S	S	.	.	H	α-helix	trans	-69.5	-51.3	174.4	-71.6	162.4	0	0	0	109.7	L492 M493 E494 A498 K499 D500	L492-I496 WeakPolarHBondContact O-CD1 3.18Å; L492-I496 VanDerWaalsContact O-CG1 3.26Å; L492-I496 WeakPolarHBondContact O-CG1 3.33Å; L492-I496 PolarHBondContact O-N 3.05Å; M493-I496 PolarHBondContact O-N 3.5Å; E494-I496 VanDerWaalsContact C-N 3.31Å; E494-I496 PolarHBondContact O-N 3.16Å; I496-A498 VanDerWaalsContact C-N 3.29Å; I496-A498 PolarHBondContact O-N 3.3Å; I496-K499 CarbonylContact O-C 3.58Å; I496-K499 WeakPolarHBondContact O-CA 3.24Å; I496-K499 WeakPolarHBondContact O-CB 3.33Å; I496-K499 PolarHBondContact O-N 2.64Å; I496-D500 WeakPolarHBondContact CG2-OD2 3.22Å; I496-D500 VanDerWaalsContact O-CG 3.31Å; I496-D500 PolarHBondContact O-N 2.92Å
497	Q	74.8	Confident	76.4	Confident	117 Å²	117	95.2 Å²	95.2	55%	0.547	50%	0.502	S	S	.	.	H	α-helix	trans	-57.3	-39.7	176.7	-74	-174.4	-6.4	0	0	112.9	M493 E494 K499 D500 Q501	M493-Q497 WeakPolarHBondContact O-CG 3.37Å; M493-Q497 PolarHBondContact O-N 3.23Å; E494-Q497 PolarHBondContact O-N 2.87Å; Q497-K499 VanDerWaalsContact C-N 3.35Å; Q497-D500 PolarHBondContact O-N 3.29Å; Q497-Q501 WeakPolarHBondContact O-CB 3.42Å; Q497-Q501 VanDerWaalsContact O-CG 3.27Å; Q497-Q501 WeakPolarHBondContact O-CG 3.09Å; Q497-Q501 PolarHBondContact O-N 3.41Å
498	A	77.7	Confident	74.5	Confident	52 Å²	52	96.5 Å²	96.5	43%	0.43	51%	0.505	S	S	.	.	H	α-helix	trans	-64.5	-38.1	175.6	0	0	0	0	0	112.3	E494 I496 V502	E494-A498 WeakPolarHBondContact O-CB 3.2Å; E494-A498 PolarHBondContact O-N 3.07Å; I496-A498 VanDerWaalsContact C-N 3.29Å; I496-A498 PolarHBondContact O-N 3.3Å; A498-V502 WeakPolarHBondContact O-CG2 3.35Å; A498-V502 PolarHBondContact O-N 3.29Å
499	K	73.5	Confident	72.6	Confident	130 Å²	130	98.7 Å²	98.7	57%	0.565	52%	0.515	S	S	*	.	H	α-helix	trans	-69.1	-42.6	173.6	-74.5	170.1	-178.2	176.1	0	111.7	T495 I496 Q497 Q501 V502 I503	T495-K499 HydrophobicContact CG2-CD 4.4Å; T495-K499 VanDerWaalsContact O-CG 3.29Å; T495-K499 WeakPolarHBondContact O-CG 3.37Å; T495-K499 PolarHBondContact O-N 3.43Å; I496-K499 CarbonylContact O-C 3.58Å; I496-K499 WeakPolarHBondContact O-CA 3.24Å; I496-K499 WeakPolarHBondContact O-CB 3.33Å; I496-K499 PolarHBondContact O-N 2.64Å; Q497-K499 VanDerWaalsContact C-N 3.35Å; K499-Q501 VanDerWaalsContact C-N 3.34Å; K499-Q501 PolarHBondContact O-N 2.89Å; K499-V502 CarbonylContact O-C 3.51Å; K499-V502 WeakPolarHBondContact O-CB 3.25Å; K499-V502 PolarHBondContact O-N 2.95Å; K499-V502 VanDerWaalsContact O-N 3.08Å; K499-I503 WeakPolarHBondContact O-CG1 3.46Å; K499-I503 PolarHBondContact O-N 3.36Å
500	D	74.6	Confident	70.4	Confident	80 Å²	80	101.2 Å²	101.2	43%	0.428	53%	0.529	S	S	.	.	H	α-helix	trans	-63.4	-40.4	177.6	-65	-25	0	0	0	111	I496 Q497 V502 I503 V504	I496-D500 WeakPolarHBondContact CG2-OD2 3.22Å; I496-D500 VanDerWaalsContact O-CG 3.31Å; I496-D500 PolarHBondContact O-N 2.92Å; Q497-D500 PolarHBondContact O-N 3.29Å; D500-V502 VanDerWaalsContact C-N 3.3Å; D500-V502 PolarHBondContact O-N 3.08Å; D500-I503 PolarHBondContact O-N 2.9Å; D500-V504 WeakPolarHBondContact O-CB 3.49Å; D500-V504 VanDerWaalsContact O-CG2 3.3Å; D500-V504 WeakPolarHBondContact O-CG2 3.46Å; D500-V504 PolarHBondContact O-N 3.33Å
501	Q	74.9	Confident	68.2	Low	110 Å²	110	104.2 Å²	104.2	51%	0.514	55%	0.545	S	S	.	.	H	α-helix	trans	-61.2	-35	171.6	-74.5	176.6	34.8	0	0	113.1	Q497 K499 K505	Q497-Q501 WeakPolarHBondContact O-CB 3.42Å; Q497-Q501 VanDerWaalsContact O-CG 3.27Å; Q497-Q501 WeakPolarHBondContact O-CG 3.09Å; Q497-Q501 PolarHBondContact O-N 3.41Å; K499-Q501 VanDerWaalsContact C-N 3.34Å; K499-Q501 PolarHBondContact O-N 2.89Å; Q501-K505 WeakPolarHBondContact O-CD 3.41Å; Q501-K505 VanDerWaalsContact O-CG 3.28Å; Q501-K505 WeakPolarHBondContact O-CG 3.38Å; Q501-K505 PolarHBondContact O-N 3.17Å; Q501-K505 VanDerWaalsContact O-N 3.1Å
502	V	75.2	Confident	66	Low	78 Å²	78	107.3 Å²	107.3	47%	0.473	56%	0.558	S	S	.	*	H	α-helix	trans	-73.5	-39.9	174.6	169.5	0	0	0	0	111.1	A498 K499 D500 V504 K505 L506	A498-V502 WeakPolarHBondContact O-CG2 3.35Å; A498-V502 PolarHBondContact O-N 3.29Å; K499-V502 CarbonylContact O-C 3.51Å; K499-V502 WeakPolarHBondContact O-CB 3.25Å; K499-V502 PolarHBondContact O-N 2.95Å; K499-V502 VanDerWaalsContact O-N 3.08Å; D500-V502 VanDerWaalsContact C-N 3.3Å; D500-V502 PolarHBondContact O-N 3.08Å; V502-V504 VanDerWaalsContact C-N 3.34Å; V502-V504 PolarHBondContact O-N 2.88Å; V502-K505 PolarHBondContact O-N 3.29Å; V502-L506 HydrophobicContact CG1-CD1 3.77Å; V502-L506 HydrophobicContact CG1-CG 4.32Å; V502-L506 WeakPolarHBondContact O-CB 3.14Å; V502-L506 WeakPolarHBondContact O-CG 3.47Å; V502-L506 PolarHBondContact O-N 2.9Å
503	I	71.1	Confident	63.8	Low	98 Å²	98	111.3 Å²	111.3	50%	0.503	57%	0.574	S	S	.	*	H	α-helix	trans	-60.8	-43.4	173.6	-69.3	163.5	0	0	0	110.4	K499 D500 S507	K499-I503 WeakPolarHBondContact O-CG1 3.46Å; K499-I503 PolarHBondContact O-N 3.36Å; D500-I503 PolarHBondContact O-N 2.9Å; I503-S507 VanDerWaalsContact O-CB 3.28Å; I503-S507 WeakPolarHBondContact O-CB 3.33Å; I503-S507 PolarHBondContact O-N 3.15Å; I503-S507 PolarHBondContact O-OG 3.22Å
504	V	64.7	Low	61.4	Low	78 Å²	78	112.3 Å²	112.3	47%	0.473	59%	0.592	S	S	.	*	H	α-helix	trans	-61.6	-46	175.3	168.9	0	0	0	0	111.2	D500 V502 S507 Q508	D500-V504 WeakPolarHBondContact O-CB 3.49Å; D500-V504 VanDerWaalsContact O-CG2 3.3Å; D500-V504 WeakPolarHBondContact O-CG2 3.46Å; D500-V504 PolarHBondContact O-N 3.33Å; V502-V504 VanDerWaalsContact C-N 3.34Å; V502-V504 PolarHBondContact O-N 2.88Å; V504-S507 WeakPolarHBondContact O-CB 3.42Å; V504-S507 PolarHBondContact O-N 3.28Å; V504-Q508 HydrophobicContact CG1-CG 4.5Å; V504-Q508 VanDerWaalsContact O-CG 3.31Å; V504-Q508 WeakPolarHBondContact O-CG 3.36Å; V504-Q508 PolarHBondContact O-N 2.95Å
505	K	71.2	Confident	58.9	Low	118 Å²	118	109.1 Å²	109.1	51%	0.513	60%	0.595	S	S	.	*	H	α-helix	trans	-62.5	-47.4	177.6	-74.5	166.9	-176.8	171.9	0	112.5	Q501 V502 S507 Q508 E509	Q501-K505 WeakPolarHBondContact O-CD 3.41Å; Q501-K505 VanDerWaalsContact O-CG 3.28Å; Q501-K505 WeakPolarHBondContact O-CG 3.38Å; Q501-K505 PolarHBondContact O-N 3.17Å; Q501-K505 VanDerWaalsContact O-N 3.1Å; V502-K505 PolarHBondContact O-N 3.29Å; K505-S507 PolarHBondContact O-N 2.98Å; K505-Q508 WeakPolarHBondContact O-CB 3.41Å; K505-Q508 PolarHBondContact O-N 2.58Å; K505-Q508 VanDerWaalsContact O-N 3.08Å; K505-E509 PolarHBondContact O-N 3.03Å
506	L	57.6	Low	56.4	Low	105 Å²	105	114.1 Å²	114.1	55%	0.55	62%	0.619	S	S	.	*	H	α-helix	trans	-65.7	-26.2	176.2	-68.2	170.6	0	0	0	112.7	V502	V502-L506 HydrophobicContact CG1-CD1 3.77Å; V502-L506 HydrophobicContact CG1-CG 4.32Å; V502-L506 WeakPolarHBondContact O-CB 3.14Å; V502-L506 WeakPolarHBondContact O-CG 3.47Å; V502-L506 PolarHBondContact O-N 2.9Å
507	S	56.5	Low	54.1	Low	74 Å²	74	114 Å²	114	52%	0.517	63%	0.632	S	S	.	*	H	α-helix	trans	-77	-30.6	172	-57.1	0	0	0	0	112.4	I503 V504 K505	I503-S507 VanDerWaalsContact O-CB 3.28Å; I503-S507 WeakPolarHBondContact O-CB 3.33Å; I503-S507 PolarHBondContact O-N 3.15Å; I503-S507 PolarHBondContact O-OG 3.22Å; V504-S507 WeakPolarHBondContact O-CB 3.42Å; V504-S507 PolarHBondContact O-N 3.28Å; K505-S507 PolarHBondContact O-N 2.98Å
508	Q	49	Very low	52.1	Low	130 Å²	130	115.9 Å²	115.9	61%	0.607	65%	0.646	S	S	*	*	H	α-helix	trans	-74.3	-41.5	176.3	-75.8	170.6	-26.7	0	0	112.1	V504 K505 N510 S511	V504-Q508 HydrophobicContact CG1-CG 4.5Å; V504-Q508 VanDerWaalsContact O-CG 3.31Å; V504-Q508 WeakPolarHBondContact O-CG 3.36Å; V504-Q508 PolarHBondContact O-N 2.95Å; K505-Q508 WeakPolarHBondContact O-CB 3.41Å; K505-Q508 PolarHBondContact O-N 2.58Å; K505-Q508 VanDerWaalsContact O-N 3.08Å; Q508-N510 PolarHBondContact O-N 2.76Å; Q508-N510 VanDerWaalsContact O-N 3.13Å; Q508-S511 PolarHBondContact O-N 2.74Å
509	E	47.8	Very low	50.1	Low	156 Å²	156	121.2 Å²	121.2	73%	0.729	67%	0.667	S	S	*	*	T	Hydrogen-bonded Turn	trans	-62	-18.4	175.9	-72.2	-178.8	156.1	0	0	113.5	K505	K505-E509 PolarHBondContact O-N 3.03Å
510	N	37.7	Very low	48.2	Very low	148 Å²	148	119.6 Å²	119.6	79%	0.791	68%	0.678	S	S	*	*	T	Hydrogen-bonded Turn	trans	-105	17.3	-175	-154.9	61	0	0	0	113.9	Q508	Q508-N510 PolarHBondContact O-N 2.76Å; Q508-N510 VanDerWaalsContact O-N 3.13Å
511	S	38.1	Very low	46.4	Very low	93 Å²	93	119.3 Å²	119.3	65%	0.65	69%	0.694	S	S	*	*			trans	-142.1	29.4	-176.4	-168.4	0	0	0	0	115.3	Q508 Q513	Q508-S511 PolarHBondContact O-N 2.74Å; S511-Q513 PolarHBondContact O-N 2.71Å
512	E	39.8	Very low	44.9	Very low	179 Å²	179	119.5 Å²	119.5	84%	0.836	71%	0.708	S	S	*	*			trans	-73.9	80.4	170.4	-73.1	-157.4	151.4	0	0	112.9
513	Q	33.9	Very low	43.3	Very low	190 Å²	190	120.2 Å²	120.2	89%	0.888	71%	0.714	S	S	*	*			trans	-167.3	134.8	144.9	-111.6	156.8	55.6	0	0	115.1	S511	S511-Q513 PolarHBondContact O-N 2.71Å
514	S	28.6	Very low	42.3	Very low	129 Å²	129	119 Å²	119	90%	0.902	71%	0.712	S	S	*	*			trans	69.2	96.6	158.6	-158.7	0	0	0	0	119.9
515	G	30.2	Very low	41.9	Very low	68 Å²	68	118.9 Å²	118.9	70%	0.701	71%	0.713	S	S	*	*				125.6	87.4	125.2	0	0	0	0	0	120.6
516	N	29.8	Very low	41.1	Very low	171 Å²	171	119.7 Å²	119.7	91%	0.914	72%	0.719	S	S	*	*			trans	70.8	156.2	148.8	-70.7	-14.6	0	0	0	122.1
517	A	30.5	Very low	41	Very low	89 Å²	89	119.9 Å²	119.9	74%	0.736	72%	0.717	S	S	*	*			trans	80.4	96.6	156.4	0	0	0	0	0	120.1
518	N	32.5	Very low	41.3	Very low	157 Å²	157	122.3 Å²	122.3	84%	0.84	72%	0.72	S	S	*	*				48.4	116.4	127	-65.1	13.4	0	0	0	122.3
519	D	35.6	Very low	42.1	Very low	164 Å²	164	117.1 Å²	117.1	88%	0.877	70%	0.696	S	S	*	*				81.2	165.8	122.2	-154.8	17.1	0	0	0	119.5
520	A	33.7	Very low	43.1	Very low	97 Å²	97	112.5 Å²	112.5	80%	0.802	68%	0.682	S	S	*	*			trans	69.1	130.8	-170.3	0	0	0	0	0	116.1
521	G	36.2	Very low	44.9	Very low	74 Å²	74	110.4 Å²	110.4	76%	0.763	67%	0.669	S	S	*	*			cis	162.1	77.1	-5.4	0	0	0	0	0	113.8
522	S	43.9	Very low	46.7	Very low	114 Å²	114	106.8 Å²	106.8	80%	0.797	64%	0.642	S	S	*	*	P	Polyproline II helix	trans	-73	132.4	168.6	54.9	0	0	0	0	110.7
523	P	39.9	Very low	48.4	Very low	93 Å²	93	102.7 Å²	102.7	60%	0.604	62%	0.622	S	S	*	*	P	Polyproline II helix	trans	-64.5	145.5	179.4	27.1	-34.4	0	0	0	111.6
524	P	51.9	Low	50.4	Low	71 Å²	71	98.5 Å²	98.5	46%	0.461	61%	0.605	S	S	.	*	P	Polyproline II helix	trans	-75.8	150.8	-178.1	31.1	-35	0	0	0	111.8	Q526 Q527	P524-Q526 PolarHBondContact O-N 3.16Å; P524-Q527 WeakPolarHBondContact O-CB 3.49Å; P524-Q527 PolarHBondContact O-N 3.26Å
525	P	55.9	Low	52.5	Low	77 Å²	77	94.6 Å²	94.6	50%	0.5	58%	0.578	S	S	.	*	H	α-helix	trans	-60.9	-15.1	-176.8	23.5	-34.5	0	0	0	114.6	Q527 L529	P525-Q527 PolarHBondContact O-N 3.38Å; P525-L529 WeakPolarHBondContact O-CB 3.44Å; P525-L529 PolarHBondContact O-N 2.7Å
526	Q	53.9	Low	54.7	Low	135 Å²	135	91.6 Å²	91.6	63%	0.631	55%	0.546	S	S	*	.	H	α-helix	trans	-66.5	-23.4	172.4	-64.2	-179.8	-74.1	0	0	113.3	P524 S530	P524-Q526 PolarHBondContact O-N 3.16Å; Q526-S530 PolarHBondContact O-N 3.03Å; Q526-S530 VanDerWaalsContact O-N 3.12Å
527	Q	55.8	Low	56.9	Low	108 Å²	108	89 Å²	89	51%	0.505	53%	0.528	S	S	.	.	H	α-helix	trans	-75.8	-44.4	-177.9	-169.2	168	3.3	0	0	111.8	P524 P525 L529 S530 I531	P524-Q527 WeakPolarHBondContact O-CB 3.49Å; P524-Q527 PolarHBondContact O-N 3.26Å; P525-Q527 PolarHBondContact O-N 3.38Å; Q527-L529 VanDerWaalsContact C-N 3.26Å; Q527-L529 PolarHBondContact O-N 3.37Å; Q527-S530 WeakPolarHBondContact O-CB 3.44Å; Q527-S530 PolarHBondContact O-N 2.68Å; Q527-I531 HydrophobicContact CG-CD1 4.39Å; Q527-I531 WeakPolarHBondContact O-CG1 3.42Å; Q527-I531 PolarHBondContact O-N 3.37Å; Q527-I531 VanDerWaalsContact O-N 3.08Å
528	E	63.1	Low	59.1	Low	125 Å²	125	86.2 Å²	86.2	58%	0.584	51%	0.509	S	S	*	.	H	α-helix	trans	-60.4	-39.8	171.8	-60.4	-173.6	161.4	0	0	111.3	M378 S530 I531 L532	M378-E528 HydrophobicContact CE-CB 3.9Å; E528-S530 VanDerWaalsContact C-N 3.27Å; E528-S530 PolarHBondContact O-N 3.04Å; E528-I531 PolarHBondContact O-N 2.7Å; E528-L532 WeakPolarHBondContact O-CB 3.29Å; E528-L532 PolarHBondContact O-N 3.28Å
529	L	66.1	Low	61.2	Low	21 Å²	21	81.1 Å²	81.1	11%	0.11	48%	0.478	C	S	.	.	H	α-helix	trans	-64.8	-28.7	177.9	-155	156.3	0	0	0	112.4	Q374 M378 M381 P525 Q527 K533	Q374-L529 HydrophobicContact CB-CD1 4.48Å; M378-L529 HydrophobicContact CG-CB 4.46Å; M378-L529 HydrophobicContact CG-CD1 3.88Å; M378-L529 HydrophobicContact CG-CG 4.03Å; M378-L529 VanDerWaalsContact SD-CA 3.54Å; M378-L529 HydrophobicContact SD-CB 3.72Å; M378-L529 HydrophobicContact SD-CD1 4.17Å; M378-L529 HydrophobicContact SD-CG 3.65Å; M381-L529 HydrophobicContact CE-CD2 3.86Å; M381-L529 HydrophobicContact CE-CG 3.89Å; P525-L529 WeakPolarHBondContact O-CB 3.44Å; P525-L529 PolarHBondContact O-N 2.7Å; Q527-L529 VanDerWaalsContact C-N 3.26Å; Q527-L529 PolarHBondContact O-N 3.37Å; L529-K533 HydrophobicContact CD2-CD 3.98Å; L529-K533 VanDerWaalsContact CD2-CE 3.48Å; L529-K533 VanDerWaalsContact O-CG 3.3Å; L529-K533 WeakPolarHBondContact O-CG 3.1Å; L529-K533 PolarHBondContact O-N 3.08Å
530	S	68.6	Low	63.1	Low	60 Å²	60	76.9 Å²	76.9	42%	0.42	45%	0.452	S	S	.	.	H	α-helix	trans	-72.3	-54.1	168.1	-162	0	0	0	0	111.4	Q526 Q527 E528 L532 K533 D534	Q526-S530 PolarHBondContact O-N 3.03Å; Q526-S530 VanDerWaalsContact O-N 3.12Å; Q527-S530 WeakPolarHBondContact O-CB 3.44Å; Q527-S530 PolarHBondContact O-N 2.68Å; E528-S530 VanDerWaalsContact C-N 3.27Å; E528-S530 PolarHBondContact O-N 3.04Å; S530-L532 PolarHBondContact O-N 3.41Å; S530-L532 VanDerWaalsContact O-N 3.13Å; S530-K533 CarbonylContact O-C 3.59Å; S530-K533 WeakPolarHBondContact O-CA 3.41Å; S530-K533 WeakPolarHBondContact O-CB 3.29Å; S530-K533 PolarHBondContact O-N 3.11Å; S530-D534 PolarHBondContact O-N 3.12Å; S530-D534 PolarHBondContact OG-OD2 3.15Å; S530-D534 VanDerWaalsContact OG-OD2 3.11Å
531	I	74.8	Confident	65.1	Low	103 Å²	103	75.2 Å²	75.2	53%	0.528	43%	0.434	S	S	.	.	H	α-helix	trans	-55.4	-37.6	-177.3	-65.4	163.8	0	0	0	111.3	Q527 E528 S535	Q527-I531 HydrophobicContact CG-CD1 4.39Å; Q527-I531 WeakPolarHBondContact O-CG1 3.42Å; Q527-I531 PolarHBondContact O-N 3.37Å; Q527-I531 VanDerWaalsContact O-N 3.08Å; E528-I531 PolarHBondContact O-N 2.7Å; I531-S535 VanDerWaalsContact O-CB 3.28Å; I531-S535 WeakPolarHBondContact O-CB 3.41Å; I531-S535 PolarHBondContact O-N 2.99Å; I531-S535 PolarHBondContact O-OG 3.01Å
532	L	75.4	Confident	67	Low	18 Å²	18	75.9 Å²	75.9	9%	0.094	42%	0.417	C	S	.	.	H	α-helix	trans	-67	-41	175.3	-167.2	74.3	0	0	0	112.6	M378 M381 Q382 E528 S530 L536	M378-L532 HydrophobicContact CE-CD2 4.19Å; M378-L532 HydrophobicContact SD-CB 4.49Å; M378-L532 HydrophobicContact SD-CD2 3.63Å; M381-L532 HydrophobicContact CB-CD2 3.5Å; M381-L532 HydrophobicContact CB-CG 4.25Å; M381-L532 HydrophobicContact CE-CD2 4.28Å; Q382-L532 HydrophobicContact CG-CD1 3.9Å; Q382-L532 HydrophobicContact CG-CD2 3.83Å; E528-L532 WeakPolarHBondContact O-CB 3.29Å; E528-L532 PolarHBondContact O-N 3.28Å; S530-L532 PolarHBondContact O-N 3.41Å; S530-L532 VanDerWaalsContact O-N 3.13Å; L532-L536 WeakPolarHBondContact O-CB 3.44Å; L532-L536 WeakPolarHBondContact O-CG 3.48Å; L532-L536 PolarHBondContact O-N 3.4Å
533	K	75.3	Confident	68.8	Low	92 Å²	92	70.7 Å²	70.7	40%	0.4	38%	0.381	S	S	.	.	H	α-helix	trans	-67.4	-41.7	175.7	-78.1	174.9	177.7	171.3	0	112.1	E377 M381 L529 S530 L536 Q537	E377-K533 IonicContact OE2-NZ 3.28Å; M381-K533 HydrophobicContact CE-CG 4.33Å; M381-K533 HydrophobicContact SD-CD 4.03Å; M381-K533 WeakPolarHBondContact SD-CE 3.23Å; M381-K533 HydrophobicContact SD-CG 3.48Å; M381-K533 WeakPolarHBondContact SD-CG 3.37Å; L529-K533 HydrophobicContact CD2-CD 3.98Å; L529-K533 VanDerWaalsContact CD2-CE 3.48Å; L529-K533 VanDerWaalsContact O-CG 3.3Å; L529-K533 WeakPolarHBondContact O-CG 3.1Å; L529-K533 PolarHBondContact O-N 3.08Å; S530-K533 CarbonylContact O-C 3.59Å; S530-K533 WeakPolarHBondContact O-CA 3.41Å; S530-K533 WeakPolarHBondContact O-CB 3.29Å; S530-K533 PolarHBondContact O-N 3.11Å; K533-L536 WeakPolarHBondContact O-CB 3.42Å; K533-L536 PolarHBondContact O-N 2.8Å; K533-Q537 WeakPolarHBondContact O-CB 3.24Å; K533-Q537 PolarHBondContact O-N 2.79Å
534	D	76.8	Confident	70.6	Confident	102 Å²	102	74.3 Å²	74.3	55%	0.545	39%	0.387	S	S	.	.	H	α-helix	trans	-66.5	-41.1	177.2	-62.7	-45.7	0	0	0	110.9	S530 Q537 G538	S530-D534 PolarHBondContact O-N 3.12Å; S530-D534 PolarHBondContact OG-OD2 3.15Å; S530-D534 VanDerWaalsContact OG-OD2 3.11Å; D534-Q537 PolarHBondContact O-N 3.47Å; D534-G538 PolarHBondContact O-N 2.87Å
535	S	72.4	Confident	72.1	Confident	47 Å²	47	77.5 Å²	77.5	33%	0.329	39%	0.394	S	S	.	.	H	α-helix	trans	-61.7	-45.2	172.4	-60.5	0	0	0	0	112.2	I531 Q537 G538 Y539	I531-S535 VanDerWaalsContact O-CB 3.28Å; I531-S535 WeakPolarHBondContact O-CB 3.41Å; I531-S535 PolarHBondContact O-N 2.99Å; I531-S535 PolarHBondContact O-OG 3.01Å; S535-Q537 VanDerWaalsContact C-N 3.33Å; S535-Q537 PolarHBondContact O-N 2.94Å; S535-G538 PolarHBondContact O-N 3.04Å; S535-Y539 WeakPolarHBondContact O-CD2 3.48Å; S535-Y539 PolarHBondContact O-N 3.27Å
536	L	76.4	Confident	73.1	Confident	6 Å²	6	74.5 Å²	74.5	3%	0.031	37%	0.373	C	S	.	.	H	α-helix	trans	-57.6	-44.4	174	-87.5	168.9	0	0	0	112.1	M381 E384 Q385 L388 L532 K533 G538 Y539 K540	M381-L536 HydrophobicContact CB-CD1 3.72Å; M381-L536 HydrophobicContact CG-CD1 3.89Å; M381-L536 HydrophobicContact SD-CD1 4.24Å; E384-L536 HydrophobicContact CB-CD2 3.98Å; E384-L536 HydrophobicContact CG-CD2 4.13Å; Q385-L536 HydrophobicContact CB-CD2 3.77Å; Q385-L536 HydrophobicContact CB-CG 4.19Å; Q385-L536 HydrophobicContact CG-CD2 4.31Å; L388-L536 HydrophobicContact CD1-CD2 3.66Å; L532-L536 WeakPolarHBondContact O-CB 3.44Å; L532-L536 WeakPolarHBondContact O-CG 3.48Å; L532-L536 PolarHBondContact O-N 3.4Å; K533-L536 WeakPolarHBondContact O-CB 3.42Å; K533-L536 PolarHBondContact O-N 2.8Å; L536-G538 VanDerWaalsContact C-N 3.32Å; L536-G538 PolarHBondContact O-N 2.96Å; L536-Y539 PolarHBondContact O-N 3.15Å; L536-K540 WeakPolarHBondContact O-CG 3.36Å; L536-K540 PolarHBondContact O-N 3.38Å
537	Q	76.1	Confident	74.4	Confident	116 Å²	116	71.3 Å²	71.3	54%	0.542	36%	0.361	S	S	.	.	H	α-helix	trans	-66.7	-35.4	178.9	-173.8	64.8	-3.3	0	0	112	K533 D534 S535 S541	K533-Q537 WeakPolarHBondContact O-CB 3.24Å; K533-Q537 PolarHBondContact O-N 2.79Å; D534-Q537 PolarHBondContact O-N 3.47Å; S535-Q537 VanDerWaalsContact C-N 3.33Å; S535-Q537 PolarHBondContact O-N 2.94Å; Q537-S541 WeakPolarHBondContact O-CB 3.11Å; Q537-S541 PolarHBondContact O-N 2.98Å; Q537-S541 PolarHBondContact O-OG 2.88Å
538	G	76.2	Confident	75.7	Confident	31 Å²	31	71.9 Å²	71.9	32%	0.32	36%	0.362	S	S	.	.	H	α-helix	trans	-57.7	-51	168.1	0	0	0	0	0	113	D534 S535 L536 S541 Q542	D534-G538 PolarHBondContact O-N 2.87Å; S535-G538 PolarHBondContact O-N 3.04Å; L536-G538 VanDerWaalsContact C-N 3.32Å; L536-G538 PolarHBondContact O-N 2.96Å; G538-S541 PolarHBondContact O-N 2.88Å; G538-Q542 WeakPolarHBondContact O-CG 3.4Å; G538-Q542 PolarHBondContact O-N 2.94Å
539	Y	76.7	Confident	76.7	Confident	49 Å²	49	68.1 Å²	68.1	19%	0.192	34%	0.344	C	S	.	.	H	α-helix	trans	-62	-45.3	176.3	-74.2	-64.4	0	0	0	112.5	Q385 R389 L392 S535 L536 S541 Q542 N543	Q385-Y539 HydrophobicContact CG-CD2 3.7Å; Q385-Y539 HydrophobicContact CG-CE2 3.64Å; R389-Y539 HydrophobicContact CB-CD1 4.48Å; R389-Y539 HydrophobicContact CB-CE1 4.11Å; R389-Y539 HydrophobicContact CG-CE1 4.05Å; L392-Y539 HydrophobicContact CD2-CD1 3.92Å; L392-Y539 HydrophobicContact CD2-CE1 3.89Å; S535-Y539 WeakPolarHBondContact O-CD2 3.48Å; S535-Y539 PolarHBondContact O-N 3.27Å; L536-Y539 PolarHBondContact O-N 3.15Å; Y539-S541 VanDerWaalsContact C-N 3.27Å; Y539-S541 PolarHBondContact O-N 2.94Å; Y539-Q542 PolarHBondContact O-N 3.22Å; Y539-N543 PolarHBondContact O-N 2.88Å; Y539-N543 PolarHBondContact O-OD1 3.4Å
540	K	75.7	Confident	77.3	Confident	75 Å²	75	68.1 Å²	68.1	33%	0.326	34%	0.344	S	S	.	.	H	α-helix	trans	-58.8	-38.6	175.8	-70.9	171.4	-176.2	177.1	0	112	E384 L388 L536 K544	E384-K540 VanDerWaalsContact CD-CE 3.5Å; E384-K540 WeakPolarHBondContact OE1-CE 3.46Å; E384-K540 IonicContact OE1-NZ 2.7Å; E384-K540 PolarHBondContact OE1-NZ 2.96Å; E384-K540 WeakPolarHBondContact OE2-CE 3.46Å; E384-K540 IonicContact OE2-NZ 3.68Å; E384-K540 PolarHBondContact OE2-NZ 2.97Å; L388-K540 HydrophobicContact CD1-CD 4.26Å; L388-K540 VanDerWaalsContact CD1-CE 3.47Å; L388-K540 HydrophobicContact CD1-CG 3.71Å; L388-K540 HydrophobicContact CD2-CG 4.17Å; L536-K540 WeakPolarHBondContact O-CG 3.36Å; L536-K540 PolarHBondContact O-N 3.38Å; K540-K544 WeakPolarHBondContact O-CB 3.26Å; K540-K544 PolarHBondContact O-N 3.42Å; K540-K544 VanDerWaalsContact O-N 3.08Å
541	S	76.4	Confident	77.9	Confident	63 Å²	63	71 Å²	71	44%	0.441	35%	0.354	S	S	.	.	H	α-helix	trans	-70.2	-41.3	177.2	-58.4	0	0	0	0	112.6	Q537 G538 Y539 K544 F545	Q537-S541 WeakPolarHBondContact O-CB 3.11Å; Q537-S541 PolarHBondContact O-N 2.98Å; Q537-S541 PolarHBondContact O-OG 2.88Å; G538-S541 PolarHBondContact O-N 2.88Å; Y539-S541 VanDerWaalsContact C-N 3.27Å; Y539-S541 PolarHBondContact O-N 2.94Å; S541-K544 PolarHBondContact O-N 3.03Å; S541-F545 PolarHBondContact O-N 3.15Å
542	Q	75.5	Confident	78.2	Confident	87 Å²	87	70.9 Å²	70.9	41%	0.407	35%	0.351	S	S	.	.	H	α-helix	trans	-65.6	-43.1	175.5	-70.8	-174.5	35.6	0	0	112.2	L392 G538 Y539 K544 F545 L546	L392-Q542 HydrophobicContact CD1-CB 3.47Å; L392-Q542 VanDerWaalsContact CD1-CB 3.47Å; L392-Q542 HydrophobicContact CD1-CG 4.48Å; G538-Q542 WeakPolarHBondContact O-CG 3.4Å; G538-Q542 PolarHBondContact O-N 2.94Å; Y539-Q542 PolarHBondContact O-N 3.22Å; Q542-K544 VanDerWaalsContact C-N 3.31Å; Q542-K544 PolarHBondContact O-N 3.23Å; Q542-F545 WeakPolarHBondContact O-CB 3.42Å; Q542-F545 PolarHBondContact O-N 2.95Å; Q542-F545 VanDerWaalsContact O-N 3.14Å; Q542-L546 WeakPolarHBondContact O-CG 3.31Å; Q542-L546 PolarHBondContact O-N 3.22Å
543	N	81.1	Confident	78.2	Confident	5 Å²	5	71 Å²	71	3%	0.027	35%	0.352	C	S	.	.	H	α-helix	trans	-63.7	-38.3	176.2	-67.8	6.9	0	0	0	111	L388 E391 L392 Q395 Y539 F545 L546 N547	L388-N543 PolarHBondContact O-ND2 3.11Å; L388-N543 VanDerWaalsContact O-ND2 3.16Å; E391-N543 PolarHBondContact OE1-ND2 2.91Å; L392-N543 VanDerWaalsContact CA-OD1 3.31Å; L392-N543 WeakPolarHBondContact CA-OD1 3.31Å; L392-N543 VanDerWaalsContact CB-OD1 3.25Å; L392-N543 WeakPolarHBondContact CB-OD1 3.48Å; L392-N543 WeakPolarHBondContact CD1-OD1 3.48Å; Q395-N543 PolarHBondContact OE1-O 3.44Å; Y539-N543 PolarHBondContact O-N 2.88Å; Y539-N543 PolarHBondContact O-OD1 3.4Å; N543-F545 VanDerWaalsContact C-N 3.32Å; N543-F545 PolarHBondContact O-N 3.44Å; N543-L546 PolarHBondContact O-N 3.45Å; N543-N547 WeakPolarHBondContact O-CB 3.28Å; N543-N547 PolarHBondContact O-N 3.1Å; N543-N547 PolarHBondContact O-ND2 3.01Å
544	K	78.4	Confident	78.3	Confident	169 Å²	169	69.7 Å²	69.7	74%	0.735	35%	0.352	S	S	*	.	H	α-helix	trans	-61.9	-37.6	173.4	-173	-179.3	178.7	-175.3	0	112.5	K540 S541 Q542 K548	K540-K544 WeakPolarHBondContact O-CB 3.26Å; K540-K544 PolarHBondContact O-N 3.42Å; K540-K544 VanDerWaalsContact O-N 3.08Å; S541-K544 PolarHBondContact O-N 3.03Å; Q542-K544 VanDerWaalsContact C-N 3.31Å; Q542-K544 PolarHBondContact O-N 3.23Å; K544-K548 PolarHBondContact O-N 2.96Å
545	F	84.4	Confident	78.7	Confident	139 Å²	139	68.8 Å²	68.8	61%	0.61	35%	0.35	S	S	*	.	H	α-helix	trans	-67.5	-50.8	174.8	179.8	-86.2	0	0	0	111.7	S541 Q542 N543 N547 K548 E549	S541-F545 PolarHBondContact O-N 3.15Å; Q542-F545 WeakPolarHBondContact O-CB 3.42Å; Q542-F545 PolarHBondContact O-N 2.95Å; Q542-F545 VanDerWaalsContact O-N 3.14Å; N543-F545 VanDerWaalsContact C-N 3.32Å; N543-F545 PolarHBondContact O-N 3.44Å; F545-N547 VanDerWaalsContact C-N 3.33Å; F545-N547 PolarHBondContact O-N 3.49Å; F545-K548 WeakPolarHBondContact O-CA 3.46Å; F545-K548 WeakPolarHBondContact O-CB 3.47Å; F545-K548 PolarHBondContact O-N 3.17Å; F545-E549 PolarHBondContact O-N 2.86Å
546	L	77.2	Confident	78.8	Confident	13 Å²	13	71.1 Å²	71.1	7%	0.068	36%	0.358	C	S	.	.	H	α-helix	trans	-62.7	-37.9	-178.6	-67.1	172.6	0	0	0	112.4	L392 Q395 K396 V399 Q542 N543 K548 E549 I550	L392-L546 HydrophobicContact CD1-CD1 3.65Å; L392-L546 HydrophobicContact CG-CD1 4.41Å; Q395-L546 HydrophobicContact CB-CB 4.06Å; Q395-L546 HydrophobicContact CB-CD1 3.8Å; K396-L546 HydrophobicContact CD-CD1 4.42Å; K396-L546 HydrophobicContact CG-CD1 3.62Å; K396-L546 HydrophobicContact CG-CD2 4.21Å; V399-L546 HydrophobicContact CG2-CD2 4.3Å; Q542-L546 WeakPolarHBondContact O-CG 3.31Å; Q542-L546 PolarHBondContact O-N 3.22Å; N543-L546 PolarHBondContact O-N 3.45Å; L546-K548 PolarHBondContact O-N 3.47Å; L546-E549 PolarHBondContact O-N 3.45Å; L546-E549 VanDerWaalsContact O-N 3.15Å; L546-I550 WeakPolarHBondContact O-CB 3.33Å; L546-I550 WeakPolarHBondContact O-CD1 3.34Å; L546-I550 WeakPolarHBondContact O-CG1 3.43Å; L546-I550 PolarHBondContact O-N 2.94Å
547	N	80.8	Confident	79	Confident	69 Å²	69	75.9 Å²	75.9	37%	0.369	38%	0.376	S	S	.	.	H	α-helix	trans	-61.3	-32.1	174.2	-83	-77.9	0	0	0	112.6	Q395 N543 F545 L551	Q395-N547 VanDerWaalsContact CD-ND2 3.3Å; Q395-N547 PolarHBondContact NE2-ND2 3.44Å; Q395-N547 PolarHBondContact OE1-ND2 3.16Å; N543-N547 WeakPolarHBondContact O-CB 3.28Å; N543-N547 PolarHBondContact O-N 3.1Å; N543-N547 PolarHBondContact O-ND2 3.01Å; F545-N547 VanDerWaalsContact C-N 3.33Å; F545-N547 PolarHBondContact O-N 3.49Å; N547-L551 WeakPolarHBondContact O-CD1 3.31Å; N547-L551 WeakPolarHBondContact O-CG 3.32Å; N547-L551 PolarHBondContact O-N 2.91Å
548	K	83.3	Confident	79	Confident	120 Å²	120	78.5 Å²	78.5	52%	0.522	38%	0.38	S	S	.	.	H	α-helix	trans	-69.5	-47	171.5	-173.9	-171.6	163.3	-171.3	0	111.1	K544 F545 L546 I550 L551 E552	K544-K548 PolarHBondContact O-N 2.96Å; F545-K548 WeakPolarHBondContact O-CA 3.46Å; F545-K548 WeakPolarHBondContact O-CB 3.47Å; F545-K548 PolarHBondContact O-N 3.17Å; L546-K548 PolarHBondContact O-N 3.47Å; K548-I550 VanDerWaalsContact C-N 3.34Å; K548-I550 PolarHBondContact O-N 3.38Å; K548-L551 WeakPolarHBondContact O-CB 3.4Å; K548-L551 PolarHBondContact O-N 3.5Å; K548-E552 WeakPolarHBondContact CE-OE1 3.44Å; K548-E552 WeakPolarHBondContact CE-OE2 3.5Å; K548-E552 IonicContact NZ-OE1 3.87Å; K548-E552 PolarHBondContact NZ-OE1 2.99Å; K548-E552 PolarHBondContact O-N 2.92Å
549	E	82.4	Confident	78.9	Confident	45 Å²	45	80.7 Å²	80.7	21%	0.21	39%	0.385	C	S	.	.	H	α-helix	trans	-60.1	-42.2	177.9	-167.8	-174.4	164.7	0	0	111.8	V399 Q403 F545 L546 L551 E552 L553	V399-E549 WeakPolarHBondContact CG1-OE1 3.47Å; V399-E549 HydrophobicContact CG2-CG 4.46Å; Q403-E549 PolarHBondContact NE2-OE1 3.18Å; F545-E549 PolarHBondContact O-N 2.86Å; L546-E549 PolarHBondContact O-N 3.45Å; L546-E549 VanDerWaalsContact O-N 3.15Å; E549-L551 VanDerWaalsContact C-N 3.34Å; E549-L551 PolarHBondContact O-N 3.06Å; E549-E552 PolarHBondContact O-N 3.08Å; E549-L553 HydrophobicContact CG-CD1 3.89Å; E549-L553 HydrophobicContact CG-CG 4.26Å; E549-L553 WeakPolarHBondContact O-CB 3.38Å; E549-L553 VanDerWaalsContact O-CG 3.29Å; E549-L553 WeakPolarHBondContact O-CG 3.26Å; E549-L553 PolarHBondContact O-N 2.8Å
550	I	80.3	Confident	78.6	Confident	21 Å²	21	79.1 Å²	79.1	11%	0.108	38%	0.382	C	S	.	.	H	α-helix	trans	-59.7	-42.9	175.6	-69.8	161.1	0	0	0	111.1	Q395 L398 V399 L402 L546 K548 T554	Q395-I550 HydrophobicContact CB-CD1 3.96Å; Q395-I550 HydrophobicContact CG-CD1 3.99Å; L398-I550 HydrophobicContact CD2-CD1 4.13Å; L398-I550 HydrophobicContact CD2-CG1 4.43Å; L398-I550 HydrophobicContact CD2-CG2 4.03Å; V399-I550 HydrophobicContact CG2-CD1 4.22Å; V399-I550 HydrophobicContact CG2-CG1 3.53Å; L402-I550 HydrophobicContact CD1-CG2 4.1Å; L546-I550 WeakPolarHBondContact O-CB 3.33Å; L546-I550 WeakPolarHBondContact O-CD1 3.34Å; L546-I550 WeakPolarHBondContact O-CG1 3.43Å; L546-I550 PolarHBondContact O-N 2.94Å; K548-I550 VanDerWaalsContact C-N 3.34Å; K548-I550 PolarHBondContact O-N 3.38Å; I550-T554 WeakPolarHBondContact O-CB 3.19Å; I550-T554 PolarHBondContact O-N 2.94Å; I550-T554 PolarHBondContact O-OG1 3.08Å
551	L	79.8	Confident	78.5	Confident	121 Å²	121	78.7 Å²	78.7	63%	0.634	38%	0.381	S	S	*	.	H	α-helix	trans	-63.3	-48.4	176	-79.5	164.3	0	0	0	111.6	N547 K548 E549 T554 V555	N547-L551 WeakPolarHBondContact O-CD1 3.31Å; N547-L551 WeakPolarHBondContact O-CG 3.32Å; N547-L551 PolarHBondContact O-N 2.91Å; K548-L551 WeakPolarHBondContact O-CB 3.4Å; K548-L551 PolarHBondContact O-N 3.5Å; E549-L551 VanDerWaalsContact C-N 3.34Å; E549-L551 PolarHBondContact O-N 3.06Å; L551-T554 PolarHBondContact O-N 2.9Å; L551-V555 WeakPolarHBondContact O-CG2 3.42Å; L551-V555 PolarHBondContact O-N 3.05Å
552	E	82	Confident	78.5	Confident	100 Å²	100	80.4 Å²	80.4	47%	0.467	38%	0.384	S	S	.	.	H	α-helix	trans	-64.8	-45.1	-179.2	-70.7	175.8	160	0	0	111.6	K548 E549 T554 V555 L556	K548-E552 WeakPolarHBondContact CE-OE1 3.44Å; K548-E552 WeakPolarHBondContact CE-OE2 3.5Å; K548-E552 IonicContact NZ-OE1 3.87Å; K548-E552 PolarHBondContact NZ-OE1 2.99Å; K548-E552 PolarHBondContact O-N 2.92Å; E549-E552 PolarHBondContact O-N 3.08Å; E552-T554 VanDerWaalsContact C-N 3.33Å; E552-T554 PolarHBondContact O-N 2.77Å; E552-V555 PolarHBondContact O-N 2.63Å; E552-L556 WeakPolarHBondContact O-CG 3.48Å; E552-L556 PolarHBondContact O-N 3.07Å
553	L	75.9	Confident	78.4	Confident	20 Å²	20	84.1 Å²	84.1	11%	0.105	40%	0.395	C	S	.	.	H	α-helix	trans	-62.7	-36.2	173.5	-71.3	173.5	0	0	0	112.7	V399 L402 Q403 E549 L556 R557	V399-L553 HydrophobicContact CG1-CD1 4.01Å; V399-L553 HydrophobicContact CG2-CD1 4.49Å; L402-L553 HydrophobicContact CB-CB 4.28Å; L402-L553 HydrophobicContact CB-CD1 4.3Å; L402-L553 HydrophobicContact CD1-CB 4.29Å; Q403-L553 HydrophobicContact CG-CD1 3.74Å; Q403-L553 HydrophobicContact CG-CD2 4.12Å; E549-L553 HydrophobicContact CG-CD1 3.89Å; E549-L553 HydrophobicContact CG-CG 4.26Å; E549-L553 WeakPolarHBondContact O-CB 3.38Å; E549-L553 VanDerWaalsContact O-CG 3.29Å; E549-L553 WeakPolarHBondContact O-CG 3.26Å; E549-L553 PolarHBondContact O-N 2.8Å; L553-L556 PolarHBondContact O-N 2.91Å; L553-R557 WeakPolarHBondContact O-CB 3.24Å; L553-R557 PolarHBondContact O-N 2.8Å
554	T	77.2	Confident	77.8	Confident	66 Å²	66	88.1 Å²	88.1	41%	0.405	41%	0.413	S	S	.	.	H	α-helix	trans	-68.1	-38.7	177	-61.8	0	0	0	0	111.6	I550 L551 E552 R558	I550-T554 WeakPolarHBondContact O-CB 3.19Å; I550-T554 PolarHBondContact O-N 2.94Å; I550-T554 PolarHBondContact O-OG1 3.08Å; L551-T554 PolarHBondContact O-N 2.9Å; E552-T554 VanDerWaalsContact C-N 3.33Å; E552-T554 PolarHBondContact O-N 2.77Å; T554-R558 WeakPolarHBondContact O-CB 3.49Å; T554-R558 PolarHBondContact O-N 3Å
555	V	84.1	Confident	77.7	Confident	83 Å²	83	85.4 Å²	85.4	50%	0.503	40%	0.401	S	S	.	.	H	α-helix	trans	-65.3	-46	173	171.7	0	0	0	0	110.8	L551 E552 R557 R558 N559	L551-V555 WeakPolarHBondContact O-CG2 3.42Å; L551-V555 PolarHBondContact O-N 3.05Å; E552-V555 PolarHBondContact O-N 2.63Å; V555-R557 PolarHBondContact O-N 3.42Å; V555-R558 PolarHBondContact O-N 3.37Å; V555-N559 WeakPolarHBondContact O-CB 3.44Å; V555-N559 VanDerWaalsContact O-CG 3.25Å; V555-N559 PolarHBondContact O-N 3.02Å
556	L	75.1	Confident	77.2	Confident	95 Å²	95	81.1 Å²	81.1	50%	0.497	39%	0.392	S	S	.	.	H	α-helix	trans	-60.5	-43.1	176.9	-71.3	171.8	0	0	0	112.3	L406 E552 L553 N559 A560	L406-L556 HydrophobicContact CD1-CB 4.27Å; E552-L556 WeakPolarHBondContact O-CG 3.48Å; E552-L556 PolarHBondContact O-N 3.07Å; L553-L556 PolarHBondContact O-N 2.91Å; L556-N559 PolarHBondContact O-N 3.09Å; L556-A560 PolarHBondContact O-N 3.03Å
557	R	79.8	Confident	76.7	Confident	106 Å²	106	84.3 Å²	84.3	40%	0.4	41%	0.408	S	S	.	.	H	α-helix	trans	-60.8	-46.6	174.3	-179.2	177.7	173.8	-110.3	-11.8	111.7	L406 L553 V555 N559 A560 E561	L406-R557 HydrophobicContact CD1-CB 4.14Å; L553-R557 WeakPolarHBondContact O-CB 3.24Å; L553-R557 PolarHBondContact O-N 2.8Å; V555-R557 PolarHBondContact O-N 3.42Å; R557-N559 VanDerWaalsContact C-N 3.3Å; R557-N559 PolarHBondContact O-N 3.16Å; R557-A560 WeakPolarHBondContact O-CB 3.23Å; R557-A560 PolarHBondContact O-N 3.44Å; R557-A560 VanDerWaalsContact O-N 3.1Å; R557-E561 PolarHBondContact O-N 2.99Å
558	R	75.8	Confident	76.2	Confident	171 Å²	171	86.6 Å²	86.6	65%	0.645	42%	0.417	S	S	*	.	H	α-helix	trans	-61.9	-38.3	177.7	-169.5	175.2	-173.2	142.3	3.6	112	T554 V555 A560 E561 I562	T554-R558 WeakPolarHBondContact O-CB 3.49Å; T554-R558 PolarHBondContact O-N 3Å; V555-R558 PolarHBondContact O-N 3.37Å; R558-A560 VanDerWaalsContact C-N 3.32Å; R558-E561 PolarHBondContact O-N 3.1Å; R558-I562 HydrophobicContact CG-CD1 3.99Å; R558-I562 WeakPolarHBondContact O-CB 3.44Å; R558-I562 WeakPolarHBondContact O-CD1 3.2Å; R558-I562 VanDerWaalsContact O-CG1 3.27Å; R558-I562 WeakPolarHBondContact O-CG1 3.36Å; R558-I562 PolarHBondContact O-N 3.49Å
559	N	75.7	Confident	75.8	Confident	78 Å²	78	84 Å²	84	42%	0.417	42%	0.417	S	S	.	.	H	α-helix	trans	-73.9	-20.4	176.4	-67.6	-7.2	0	0	0	113	V555 L556 R557 R563	V555-N559 WeakPolarHBondContact O-CB 3.44Å; V555-N559 VanDerWaalsContact O-CG 3.25Å; V555-N559 PolarHBondContact O-N 3.02Å; L556-N559 PolarHBondContact O-N 3.09Å; R557-N559 VanDerWaalsContact C-N 3.3Å; R557-N559 PolarHBondContact O-N 3.16Å; N559-R563 WeakPolarHBondContact O-CG 3.2Å; N559-R563 PolarHBondContact O-NE 2.91Å
560	A	69.4	Low	75.2	Confident	15 Å²	15	88.3 Å²	88.3	12%	0.124	44%	0.436	C	S	.	.	H	α-helix	trans	-73.7	-54.4	166	0	0	0	0	0	110.5	L556 R557 R558 I562 R563 E564	L556-A560 PolarHBondContact O-N 3.03Å; R557-A560 WeakPolarHBondContact O-CB 3.23Å; R557-A560 PolarHBondContact O-N 3.44Å; R557-A560 VanDerWaalsContact O-N 3.1Å; R558-A560 VanDerWaalsContact C-N 3.32Å; A560-I562 VanDerWaalsContact C-N 3.29Å; A560-I562 PolarHBondContact O-N 3.26Å; A560-R563 PolarHBondContact O-N 2.97Å; A560-E564 WeakPolarHBondContact O-CB 3.13Å; A560-E564 PolarHBondContact O-N 3.42Å
561	E	75.1	Confident	74.3	Confident	66 Å²	66	89 Å²	89	31%	0.308	44%	0.442	S	S	.	.	H	α-helix	trans	-56.8	-37.8	-178.3	-166.1	-167.7	140.2	0	0	113.1	R557 R558 K565	R557-E561 PolarHBondContact O-N 2.99Å; R558-E561 PolarHBondContact O-N 3.1Å; E561-K565 HydrophobicContact CG-CD 4.36Å; E561-K565 WeakPolarHBondContact O-CG 3.32Å; E561-K565 PolarHBondContact O-N 2.92Å; E561-K565 IonicContact OE1-NZ 2.72Å; E561-K565 PolarHBondContact OE1-NZ 3.36Å
562	I	76.4	Confident	74	Confident	100 Å²	100	87 Å²	87	51%	0.513	44%	0.435	S	S	.	.	H	α-helix	trans	-67.6	-41	175.4	-70.5	166.4	0	0	0	111.6	R558 A560 A566	R558-I562 HydrophobicContact CG-CD1 3.99Å; R558-I562 WeakPolarHBondContact O-CB 3.44Å; R558-I562 WeakPolarHBondContact O-CD1 3.2Å; R558-I562 VanDerWaalsContact O-CG1 3.27Å; R558-I562 WeakPolarHBondContact O-CG1 3.36Å; R558-I562 PolarHBondContact O-N 3.49Å; A560-I562 VanDerWaalsContact C-N 3.29Å; A560-I562 PolarHBondContact O-N 3.26Å; I562-A566 VanDerWaalsContact O-CB 3.26Å; I562-A566 WeakPolarHBondContact O-CB 3.45Å; I562-A566 PolarHBondContact O-N 2.86Å
563	R	72.3	Confident	73.6	Confident	165 Å²	165	84.8 Å²	84.8	62%	0.623	43%	0.434	S	S	*	.	H	α-helix	trans	-70	-36.6	177	-74.1	-178.7	-64.9	151.7	3.4	111.8	N559 A560 A566 L567	N559-R563 WeakPolarHBondContact O-CG 3.2Å; N559-R563 PolarHBondContact O-NE 2.91Å; A560-R563 PolarHBondContact O-N 2.97Å; R563-A566 PolarHBondContact O-N 3.25Å; R563-L567 WeakPolarHBondContact O-CB 3.37Å; R563-L567 VanDerWaalsContact O-CG 3.3Å; R563-L567 WeakPolarHBondContact O-CG 3.42Å; R563-L567 PolarHBondContact O-N 3.18Å
564	E	69.3	Low	73.1	Confident	88 Å²	88	88.1 Å²	88.1	41%	0.411	45%	0.451	S	S	.	.	H	α-helix	trans	-60.3	-55.4	175.5	-177.6	173.2	-153	0	0	111	A560 A566 L567 E568	A560-E564 WeakPolarHBondContact O-CB 3.13Å; A560-E564 PolarHBondContact O-N 3.42Å; E564-A566 VanDerWaalsContact C-N 3.28Å; E564-A566 PolarHBondContact O-N 3.12Å; E564-L567 CarbonylContact O-C 3.57Å; E564-L567 WeakPolarHBondContact O-CA 3.47Å; E564-L567 WeakPolarHBondContact O-CB 3.34Å; E564-L567 PolarHBondContact O-N 3.35Å; E564-E568 WeakPolarHBondContact O-CB 3.47Å; E564-E568 PolarHBondContact O-N 3.31Å
565	K	75.5	Confident	72.4	Confident	113 Å²	113	89 Å²	89	49%	0.491	45%	0.45	S	S	.	.	H	α-helix	trans	-60.4	-34.8	175.9	-72.4	170.4	176.9	173.4	0	113	E561 L567 A569	E561-K565 HydrophobicContact CG-CD 4.36Å; E561-K565 WeakPolarHBondContact O-CG 3.32Å; E561-K565 PolarHBondContact O-N 2.92Å; E561-K565 IonicContact OE1-NZ 2.72Å; E561-K565 PolarHBondContact OE1-NZ 3.36Å; K565-L567 VanDerWaalsContact C-N 3.32Å; K565-A569 WeakPolarHBondContact O-CB 3.46Å; K565-A569 PolarHBondContact O-N 2.96Å
566	A	74.1	Confident	71.9	Confident	49 Å²	49	87.3 Å²	87.3	41%	0.405	45%	0.445	S	S	.	.	H	α-helix	trans	-72.3	-21.8	174.2	0	0	0	0	0	113.9	I562 R563 E564 K570	I562-A566 VanDerWaalsContact O-CB 3.26Å; I562-A566 WeakPolarHBondContact O-CB 3.45Å; I562-A566 PolarHBondContact O-N 2.86Å; R563-A566 PolarHBondContact O-N 3.25Å; E564-A566 VanDerWaalsContact C-N 3.28Å; E564-A566 PolarHBondContact O-N 3.12Å; A566-K570 WeakPolarHBondContact O-CD 3.49Å; A566-K570 VanDerWaalsContact O-CG 3.25Å; A566-K570 WeakPolarHBondContact O-CG 3.35Å
567	L	66	Low	71.6	Confident	80 Å²	80	88.9 Å²	88.9	42%	0.419	45%	0.448	S	S	.	.	H	α-helix	trans	-86.1	-40.2	171.8	-74.7	169.5	0	0	0	111.4	R563 E564 K565 K570 C571	R563-L567 WeakPolarHBondContact O-CB 3.37Å; R563-L567 VanDerWaalsContact O-CG 3.3Å; R563-L567 WeakPolarHBondContact O-CG 3.42Å; R563-L567 PolarHBondContact O-N 3.18Å; E564-L567 CarbonylContact O-C 3.57Å; E564-L567 WeakPolarHBondContact O-CA 3.47Å; E564-L567 WeakPolarHBondContact O-CB 3.34Å; E564-L567 PolarHBondContact O-N 3.35Å; K565-L567 VanDerWaalsContact C-N 3.32Å; L567-K570 WeakPolarHBondContact O-CB 3.42Å; L567-K570 PolarHBondContact O-N 3.42Å; L567-K570 VanDerWaalsContact O-N 3.15Å; L567-C571 PolarHBondContact O-N 2.89Å; L567-C571 PolarHBondContact O-SG 3.35Å
568	E	70.2	Confident	71.1	Confident	117 Å²	117	88.6 Å²	88.6	55%	0.547	45%	0.454	S	S	.	.	H	α-helix	trans	-55.8	-53.9	173.2	-176.4	-179.7	-153.2	0	0	110.7	E564 K570 C571 T572	E564-E568 WeakPolarHBondContact O-CB 3.47Å; E564-E568 PolarHBondContact O-N 3.31Å; E568-K570 PolarHBondContact O-N 3.17Å; E568-K570 VanDerWaalsContact O-N 3.16Å; E568-C571 WeakPolarHBondContact O-CA 3.4Å; E568-C571 WeakPolarHBondContact O-CB 3.39Å; E568-C571 PolarHBondContact O-N 2.99Å; E568-T572 PolarHBondContact O-N 2.82Å; E568-T572 PolarHBondContact O-OG1 3.15Å
569	A	75.1	Confident	70.9	Confident	64 Å²	64	83.9 Å²	83.9	53%	0.529	45%	0.447	S	S	.	.	H	α-helix	trans	-58.9	-30	175.9	0	0	0	0	0	113.5	K565 A573	K565-A569 WeakPolarHBondContact O-CB 3.46Å; K565-A569 PolarHBondContact O-N 2.96Å; A569-A573 WeakPolarHBondContact O-CB 3.48Å; A569-A573 PolarHBondContact O-N 3.2Å; A569-A573 VanDerWaalsContact O-N 3.12Å
570	K	71.3	Confident	70.6	Confident	137 Å²	137	86.2 Å²	86.2	60%	0.596	46%	0.455	S	S	*	.	H	α-helix	trans	-74.3	-36.8	172.9	-77.1	175.4	-179.5	-174.8	0	112.4	A566 L567 E568 A573 L574	A566-K570 WeakPolarHBondContact O-CD 3.49Å; A566-K570 VanDerWaalsContact O-CG 3.25Å; A566-K570 WeakPolarHBondContact O-CG 3.35Å; L567-K570 WeakPolarHBondContact O-CB 3.42Å; L567-K570 PolarHBondContact O-N 3.42Å; L567-K570 VanDerWaalsContact O-N 3.15Å; E568-K570 PolarHBondContact O-N 3.17Å; E568-K570 VanDerWaalsContact O-N 3.16Å; K570-A573 PolarHBondContact O-N 3.28Å; K570-L574 WeakPolarHBondContact O-CB 3.44Å; K570-L574 VanDerWaalsContact O-CG 3.27Å; K570-L574 WeakPolarHBondContact O-CG 3.38Å; K570-L574 PolarHBondContact O-N 3.32Å
571	C	60.5	Low	70.6	Confident	36 Å²	36	90.2 Å²	90.2	24%	0.243	48%	0.477	C	S	.	.	H	α-helix	trans	-63.9	-52.3	175.2	-62.9	0	0	0	0	109.8	L567 E568 A573 L574 E575	L567-C571 PolarHBondContact O-N 2.89Å; L567-C571 PolarHBondContact O-SG 3.35Å; E568-C571 WeakPolarHBondContact O-CA 3.4Å; E568-C571 WeakPolarHBondContact O-CB 3.39Å; E568-C571 PolarHBondContact O-N 2.99Å; C571-A573 VanDerWaalsContact C-N 3.28Å; C571-A573 PolarHBondContact O-N 3.06Å; C571-L574 CarbonylContact O-C 3.6Å; C571-L574 WeakPolarHBondContact O-CA 3.35Å; C571-L574 PolarHBondContact O-N 2.86Å; C571-E575 WeakPolarHBondContact O-CG 3.48Å; C571-E575 PolarHBondContact O-N 3.48Å
572	T	73.4	Confident	70.1	Confident	79 Å²	79	92.2 Å²	92.2	49%	0.485	49%	0.487	S	S	.	.	H	α-helix	trans	-60.6	-35.5	177.7	-47.2	0	0	0	0	112.7	E568 E575 A576	E568-T572 PolarHBondContact O-N 2.82Å; E568-T572 PolarHBondContact O-OG1 3.15Å; T572-E575 WeakPolarHBondContact CA-OE2 3.46Å; T572-A576 VanDerWaalsContact O-CB 3.26Å; T572-A576 WeakPolarHBondContact O-CB 3.4Å; T572-A576 PolarHBondContact O-N 3.29Å
573	A	74.4	Confident	69.9	Low	53 Å²	53	90.9 Å²	90.9	44%	0.438	49%	0.486	S	S	.	.	H	α-helix	trans	-70.8	-28	174.2	0	0	0	0	0	113.7	A569 K570 C571 K577	A569-A573 WeakPolarHBondContact O-CB 3.48Å; A569-A573 PolarHBondContact O-N 3.2Å; A569-A573 VanDerWaalsContact O-N 3.12Å; K570-A573 PolarHBondContact O-N 3.28Å; C571-A573 VanDerWaalsContact C-N 3.28Å; C571-A573 PolarHBondContact O-N 3.06Å; A573-K577 WeakPolarHBondContact O-CG 3.37Å; A573-K577 PolarHBondContact O-N 3.31Å
574	L	64.3	Low	69.8	Low	90 Å²	90	87 Å²	87	47%	0.471	47%	0.474	S	S	.	.	H	α-helix	trans	-79.7	-40.7	173.8	-74.2	168.6	0	0	0	111.6	K570 C571 K577 L578	K570-L574 WeakPolarHBondContact O-CB 3.44Å; K570-L574 VanDerWaalsContact O-CG 3.27Å; K570-L574 WeakPolarHBondContact O-CG 3.38Å; K570-L574 PolarHBondContact O-N 3.32Å; C571-L574 CarbonylContact O-C 3.6Å; C571-L574 WeakPolarHBondContact O-CA 3.35Å; C571-L574 PolarHBondContact O-N 2.86Å; L574-K577 PolarHBondContact O-N 3.12Å; L574-L578 WeakPolarHBondContact O-CB 3.3Å; L574-L578 PolarHBondContact O-N 3.4Å
575	E	61.8	Low	69.7	Low	84 Å²	84	89.9 Å²	89.9	39%	0.393	48%	0.482	S	S	.	.	H	α-helix	trans	-59.3	-47.6	172.2	-71.1	157.2	-173.8	0	0	110.6	C571 T572 K577 L578 C579	C571-E575 WeakPolarHBondContact O-CG 3.48Å; C571-E575 PolarHBondContact O-N 3.48Å; T572-E575 WeakPolarHBondContact CA-OE2 3.46Å; E575-K577 VanDerWaalsContact C-N 3.28Å; E575-K577 PolarHBondContact O-N 3.46Å; E575-L578 PolarHBondContact O-N 3.43Å; E575-L578 VanDerWaalsContact O-N 3.12Å; E575-C579 PolarHBondContact O-N 2.97Å; E575-C579 PolarHBondContact O-SG 3.42Å
576	A	74.9	Confident	69.4	Low	48 Å²	48	89 Å²	89	40%	0.397	48%	0.483	S	S	.	.	H	α-helix	trans	-59.7	-36.7	174.8	0	0	0	0	0	112.9	T572 Q580	T572-A576 VanDerWaalsContact O-CB 3.26Å; T572-A576 WeakPolarHBondContact O-CB 3.4Å; T572-A576 PolarHBondContact O-N 3.29Å; A576-Q580 WeakPolarHBondContact O-CB 3.36Å; A576-Q580 VanDerWaalsContact O-CG 3.22Å; A576-Q580 WeakPolarHBondContact O-CG 3.27Å; A576-Q580 PolarHBondContact O-N 2.83Å; A576-Q580 VanDerWaalsContact O-N 3.1Å
577	K	67.9	Low	69.1	Low	128 Å²	128	89.1 Å²	89.1	56%	0.557	48%	0.478	S	S	*	.	H	α-helix	trans	-70.5	-38.5	173.9	-79.1	-178.9	177.8	-168.4	0	112.5	A573 L574 E575 Q580 V581	A573-K577 WeakPolarHBondContact O-CG 3.37Å; A573-K577 PolarHBondContact O-N 3.31Å; L574-K577 PolarHBondContact O-N 3.12Å; E575-K577 VanDerWaalsContact C-N 3.28Å; E575-K577 PolarHBondContact O-N 3.46Å; K577-Q580 WeakPolarHBondContact O-CB 3.41Å; K577-Q580 PolarHBondContact O-N 3.3Å; K577-V581 WeakPolarHBondContact O-CG2 3.44Å; K577-V581 PolarHBondContact O-N 3.3Å
578	L	69.7	Low	69	Low	99 Å²	99	88.3 Å²	88.3	52%	0.518	47%	0.474	S	S	.	.	H	α-helix	trans	-62.5	-51.3	176.1	-179.4	132	0	0	0	110.2	L574 E575 Q580 V581 E582	L574-L578 WeakPolarHBondContact O-CB 3.3Å; L574-L578 PolarHBondContact O-N 3.4Å; E575-L578 PolarHBondContact O-N 3.43Å; E575-L578 VanDerWaalsContact O-N 3.12Å; L578-Q580 VanDerWaalsContact C-N 3.25Å; L578-Q580 PolarHBondContact O-N 2.91Å; L578-V581 PolarHBondContact O-N 3.23Å; L578-E582 VanDerWaalsContact CD2-CD 3.49Å; L578-E582 HydrophobicContact CD2-CG 4.41Å; L578-E582 WeakPolarHBondContact CD2-OE1 3.27Å; L578-E582 WeakPolarHBondContact CD2-OE2 3.17Å; L578-E582 HydrophobicContact CG-CG 4.48Å; L578-E582 WeakPolarHBondContact O-CG 3.36Å; L578-E582 PolarHBondContact O-N 3.03Å
579	C	70.9	Confident	68.6	Low	73 Å²	73	86.2 Å²	86.2	49%	0.493	47%	0.466	S	S	.	.	H	α-helix	trans	-59.4	-33.2	175.1	-61.4	0	0	0	0	113	E575 S583	E575-C579 PolarHBondContact O-N 2.97Å; E575-C579 PolarHBondContact O-SG 3.42Å; C579-S583 WeakPolarHBondContact O-CB 3.49Å; C579-S583 PolarHBondContact O-N 2.79Å
580	Q	70.6	Confident	68	Low	127 Å²	127	88.3 Å²	88.3	59%	0.593	47%	0.465	S	S	*	.	H	α-helix	trans	-67.6	-42.2	172.9	-78.6	172.2	9	0	0	112.5	A576 K577 L578 K584	A576-Q580 WeakPolarHBondContact O-CB 3.36Å; A576-Q580 VanDerWaalsContact O-CG 3.22Å; A576-Q580 WeakPolarHBondContact O-CG 3.27Å; A576-Q580 PolarHBondContact O-N 2.83Å; A576-Q580 VanDerWaalsContact O-N 3.1Å; K577-Q580 WeakPolarHBondContact O-CB 3.41Å; K577-Q580 PolarHBondContact O-N 3.3Å; L578-Q580 VanDerWaalsContact C-N 3.25Å; L578-Q580 PolarHBondContact O-N 2.91Å; Q580-K584 WeakPolarHBondContact O-CB 3.48Å; Q580-K584 WeakPolarHBondContact O-CG 3.42Å; Q580-K584 PolarHBondContact O-N 3.33Å
581	V	69.6	Low	67.4	Low	98 Å²	98	84 Å²	84	59%	0.594	45%	0.447	S	S	*	.	H	α-helix	trans	-68.4	-43.6	177	171.2	0	0	0	0	110.9	K577 L578 K584 Y585	K577-V581 WeakPolarHBondContact O-CG2 3.44Å; K577-V581 PolarHBondContact O-N 3.3Å; L578-V581 PolarHBondContact O-N 3.23Å; V581-K584 PolarHBondContact O-N 2.83Å; V581-Y585 VanDerWaalsContact O-CB 3.3Å; V581-Y585 WeakPolarHBondContact O-CB 3.45Å; V581-Y585 PolarHBondContact O-N 2.96Å
582	E	64.6	Low	67.3	Low	109 Å²	109	88.1 Å²	88.1	51%	0.509	47%	0.47	S	S	.	.	H	α-helix	trans	-61.4	-43.5	175.3	-71.3	177.3	151.6	0	0	111.7	L578 Y585 L586	L578-E582 VanDerWaalsContact CD2-CD 3.49Å; L578-E582 HydrophobicContact CD2-CG 4.41Å; L578-E582 WeakPolarHBondContact CD2-OE1 3.27Å; L578-E582 WeakPolarHBondContact CD2-OE2 3.17Å; L578-E582 HydrophobicContact CG-CG 4.48Å; L578-E582 WeakPolarHBondContact O-CG 3.36Å; L578-E582 PolarHBondContact O-N 3.03Å; E582-Y585 PolarHBondContact O-N 2.87Å; E582-L586 VanDerWaalsContact O-CB 3.27Å; E582-L586 WeakPolarHBondContact O-CB 3.18Å; E582-L586 PolarHBondContact O-N 3.42Å
583	S	71.9	Confident	66.3	Low	72 Å²	72	94.9 Å²	94.9	50%	0.503	49%	0.487	S	S	.	.	H	α-helix	trans	-61.7	-46.9	174.4	-178.4	0	0	0	0	112.1	C579 Y585 L586 V587	C579-S583 WeakPolarHBondContact O-CB 3.49Å; C579-S583 PolarHBondContact O-N 2.79Å; S583-Y585 VanDerWaalsContact C-N 3.33Å; S583-Y585 PolarHBondContact O-N 3.42Å; S583-L586 PolarHBondContact O-N 3.28Å; S583-V587 WeakPolarHBondContact O-CG2 3.49Å; S583-V587 PolarHBondContact O-N 3.33Å
584	K	68.9	Low	65.3	Low	84 Å²	84	97.7 Å²	97.7	37%	0.365	49%	0.489	S	S	.	.	H	α-helix	trans	-59.9	-41.3	174.2	-77	-177	166.9	-166.6	0	112.1	Q580 V581 L588 L611 D614	Q580-K584 WeakPolarHBondContact O-CB 3.48Å; Q580-K584 WeakPolarHBondContact O-CG 3.42Å; Q580-K584 PolarHBondContact O-N 3.33Å; V581-K584 PolarHBondContact O-N 2.83Å; K584-L588 WeakPolarHBondContact O-CG 3.46Å; K584-L588 PolarHBondContact O-N 2.97Å; K584-L588 VanDerWaalsContact O-N 3.1Å; K584-L611 HydrophobicContact CB-CD2 4.46Å; K584-L611 HydrophobicContact CD-CD2 3.75Å; K584-L611 HydrophobicContact CG-CD2 3.79Å; K584-D614 IonicContact NZ-OD2 2.68Å; K584-D614 PolarHBondContact NZ-OD2 2.99Å
585	Y	67.4	Low	64.3	Low	147 Å²	147	99 Å²	99	58%	0.576	50%	0.504	S	S	*	.	H	α-helix	trans	-70.1	-38.2	178.5	-173.9	-115.9	0	0	0	112.5	V581 E582 S583 L588 L589	V581-Y585 VanDerWaalsContact O-CB 3.3Å; V581-Y585 WeakPolarHBondContact O-CB 3.45Å; V581-Y585 PolarHBondContact O-N 2.96Å; E582-Y585 PolarHBondContact O-N 2.87Å; S583-Y585 VanDerWaalsContact C-N 3.33Å; S583-Y585 PolarHBondContact O-N 3.42Å; Y585-L588 PolarHBondContact O-N 3.46Å; Y585-L589 HydrophobicContact CD1-CD1 3.86Å; Y585-L589 HydrophobicContact CD1-CG 4.39Å; Y585-L589 HydrophobicContact CE1-CD1 3.47Å; Y585-L589 VanDerWaalsContact CE1-CD1 3.47Å; Y585-L589 HydrophobicContact CE1-CG 4.06Å; Y585-L589 HydrophobicContact CE2-CG 4.42Å; Y585-L589 WeakPolarHBondContact O-CG 3.37Å; Y585-L589 PolarHBondContact O-N 2.68Å
586	L	69.9	Low	63.5	Low	96 Å²	96	101.1 Å²	101.1	50%	0.503	52%	0.522	S	S	.	.	H	α-helix	trans	-63.3	-41.9	174.7	-173.3	69.3	0	0	0	111.4	E582 S583 L589 Q590	E582-L586 VanDerWaalsContact O-CB 3.27Å; E582-L586 WeakPolarHBondContact O-CB 3.18Å; E582-L586 PolarHBondContact O-N 3.42Å; S583-L586 PolarHBondContact O-N 3.28Å; L586-L589 PolarHBondContact O-N 3.1Å; L586-Q590 WeakPolarHBondContact O-CB 3.29Å; L586-Q590 VanDerWaalsContact O-CG 3.29Å; L586-Q590 WeakPolarHBondContact O-CG 3.47Å; L586-Q590 PolarHBondContact O-N 3.01Å
587	V	68.1	Low	61.7	Low	51 Å²	51	104.6 Å²	104.6	31%	0.309	54%	0.542	S	S	.	.	H	α-helix	trans	-60.9	-47	173	170.1	0	0	0	0	110.8	S583 L589 Q590 E591 L611	S583-V587 WeakPolarHBondContact O-CG2 3.49Å; S583-V587 PolarHBondContact O-N 3.33Å; V587-L589 PolarHBondContact O-N 2.65Å; V587-Q590 PolarHBondContact O-N 3.08Å; V587-E591 PolarHBondContact O-N 3.29Å; V587-L611 HydrophobicContact CG1-CD1 4.47Å
588	L	62.7	Low	60.6	Low	63 Å²	63	104 Å²	104	33%	0.33	55%	0.553	S	S	.	*	H	α-helix	trans	-60.1	-42.4	176.4	-70.5	168.2	0	0	0	112.3	K584 Y585 E591 V592 I608 L611	K584-L588 WeakPolarHBondContact O-CG 3.46Å; K584-L588 PolarHBondContact O-N 2.97Å; K584-L588 VanDerWaalsContact O-N 3.1Å; Y585-L588 PolarHBondContact O-N 3.46Å; L588-E591 PolarHBondContact O-N 2.98Å; L588-V592 WeakPolarHBondContact O-CB 3.1Å; L588-V592 VanDerWaalsContact O-CG2 3.27Å; L588-V592 WeakPolarHBondContact O-CG2 3.32Å; L588-V592 PolarHBondContact O-N 3.12Å; L588-I608 HydrophobicContact CD2-CG1 4.32Å; L588-L611 HydrophobicContact CD2-CD1 4.41Å
589	L	62.4	Low	59.5	Low	73 Å²	73	104.4 Å²	104.4	38%	0.382	57%	0.565	S	S	.	*	H	α-helix	trans	-65.8	-34.4	175	-75.3	177.6	0	0	0	113.2	Y585 L586 V587 R593	Y585-L589 HydrophobicContact CD1-CD1 3.86Å; Y585-L589 HydrophobicContact CD1-CG 4.39Å; Y585-L589 HydrophobicContact CE1-CD1 3.47Å; Y585-L589 VanDerWaalsContact CE1-CD1 3.47Å; Y585-L589 HydrophobicContact CE1-CG 4.06Å; Y585-L589 HydrophobicContact CE2-CG 4.42Å; Y585-L589 WeakPolarHBondContact O-CG 3.37Å; Y585-L589 PolarHBondContact O-N 2.68Å; L586-L589 PolarHBondContact O-N 3.1Å; V587-L589 PolarHBondContact O-N 2.65Å; L589-R593 WeakPolarHBondContact O-CG 3.25Å; L589-R593 PolarHBondContact O-N 3.38Å; L589-R593 VanDerWaalsContact O-N 3.15Å
590	Q	62.7	Low	58.4	Low	108 Å²	108	109.9 Å²	109.9	51%	0.505	58%	0.583	S	S	.	*	H	α-helix	trans	-70.2	-40.1	176.4	-76.5	177.9	6.7	0	0	111.9	L586 V587 R593	L586-Q590 WeakPolarHBondContact O-CB 3.29Å; L586-Q590 VanDerWaalsContact O-CG 3.29Å; L586-Q590 WeakPolarHBondContact O-CG 3.47Å; L586-Q590 PolarHBondContact O-N 3.01Å; V587-Q590 PolarHBondContact O-N 3.08Å; Q590-R593 PolarHBondContact O-N 3.5Å
591	E	59.4	Low	57.6	Low	46 Å²	46	113.3 Å²	113.3	22%	0.215	60%	0.599	C	S	.	*	H	α-helix	trans	-70.1	-39.6	174.6	-63.4	-52.1	136.3	0	0	112.2	V587 L588 R593 K594 I608	V587-E591 PolarHBondContact O-N 3.29Å; L588-E591 PolarHBondContact O-N 2.98Å; E591-R593 PolarHBondContact O-N 3.48Å; E591-K594 PolarHBondContact O-N 3.15Å; E591-K594 WeakPolarHBondContact OE1-CE 3.44Å; E591-K594 IonicContact OE1-NZ 3.24Å; E591-K594 PolarHBondContact OE1-NZ 3.45Å; E591-K594 WeakPolarHBondContact OE2-CD 3.31Å; E591-K594 VanDerWaalsContact OE2-CE 3.29Å; E591-K594 WeakPolarHBondContact OE2-CE 3.01Å; E591-K594 IonicContact OE2-NZ 3.24Å; E591-K594 PolarHBondContact OE2-NZ 3.22Å; E591-I608 HydrophobicContact CB-CD1 4.04Å; E591-I608 HydrophobicContact CG-CD1 4.29Å
592	V	57.2	Low	56.7	Low	122 Å²	122	113.1 Å²	113.1	74%	0.739	60%	0.595	S	S	*	*	H	α-helix	trans	-63.3	-23.3	173.6	169.6	0	0	0	0	112.5	L588	L588-V592 WeakPolarHBondContact O-CB 3.1Å; L588-V592 VanDerWaalsContact O-CG2 3.27Å; L588-V592 WeakPolarHBondContact O-CG2 3.32Å; L588-V592 PolarHBondContact O-N 3.12Å
593	R	54	Low	56.4	Low	221 Å²	221	112.1 Å²	112.1	83%	0.834	60%	0.598	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80	-8.6	172.3	-81.9	-179.5	169	-167.2	-3.6	114.4	L589 Q590 E591	L589-R593 WeakPolarHBondContact O-CG 3.25Å; L589-R593 PolarHBondContact O-N 3.38Å; L589-R593 VanDerWaalsContact O-N 3.15Å; Q590-R593 PolarHBondContact O-N 3.5Å; E591-R593 PolarHBondContact O-N 3.48Å
594	K	52.5	Low	55.5	Low	112 Å²	112	109.6 Å²	109.6	49%	0.487	58%	0.581	S	S	.	*	S	Bend	trans	-88.2	123.8	172.3	-62.2	-178.4	-162.8	160.2	0	110	E591 V596	E591-K594 PolarHBondContact O-N 3.15Å; E591-K594 WeakPolarHBondContact OE1-CE 3.44Å; E591-K594 IonicContact OE1-NZ 3.24Å; E591-K594 PolarHBondContact OE1-NZ 3.45Å; E591-K594 WeakPolarHBondContact OE2-CD 3.31Å; E591-K594 VanDerWaalsContact OE2-CE 3.29Å; E591-K594 WeakPolarHBondContact OE2-CE 3.01Å; E591-K594 IonicContact OE2-NZ 3.24Å; E591-K594 PolarHBondContact OE2-NZ 3.22Å; K594-V596 PolarHBondContact O-N 3.02Å
595	P	42.7	Very low	55	Low	119 Å²	119	114.2 Å²	114.2	77%	0.773	60%	0.596	S	S	*	*			trans	-68.8	122	175.4	27.9	-33	0	0	0	110.3	C597	P595-C597 PolarHBondContact O-N 3.13Å
596	V	44.7	Very low	54.6	Low	128 Å²	128	112.1 Å²	112.1	78%	0.776	59%	0.592	S	S	*	*			trans	-73.4	90.6	-178.7	-177.6	0	0	0	0	110.5	K594	K594-V596 PolarHBondContact O-N 3.02Å
597	C	37.9	Very low	54.2	Low	120 Å²	120	111.1 Å²	111.1	81%	0.811	59%	0.59	S	S	*	*			trans	-78.4	143.5	161.3	-76.9	0	0	0	0	110.2	P595	P595-C597 PolarHBondContact O-N 3.13Å
598	S	45.4	Very low	53.8	Low	115 Å²	115	111.2 Å²	111.2	80%	0.804	59%	0.588	S	S	*	*			trans	-95.5	109.7	-163.9	55.8	0	0	0	0	114.7
599	S	45.3	Very low	53.7	Low	109 Å²	109	111.4 Å²	111.4	76%	0.762	60%	0.595	S	S	*	*			trans	-177	122.8	140.6	54.4	0	0	0	0	112.2
600	E	48.2	Very low	53.7	Low	188 Å²	188	114.8 Å²	114.8	88%	0.879	60%	0.602	S	S	*	*	S	Bend	trans	54	133.5	154.4	-52.7	-166.7	158.9	0	0	121.1	D602	E600-D602 PolarHBondContact O-N 2.98Å; E600-D602 VanDerWaalsContact O-N 3.12Å
601	E	53.2	Low	53.7	Low	198 Å²	198	111.2 Å²	111.2	93%	0.925	59%	0.586	S	S	*	*			trans	37.6	50.3	160.6	-56.2	-164.6	160.9	0	0	119.7	P603	E601-P603 WeakPolarHBondContact O-CD 3.46Å
602	D	52.4	Low	53.6	Low	94 Å²	94	113.9 Å²	113.9	50%	0.503	60%	0.602	S	S	.	*			trans	-76.5	120	166.3	-171.2	-21.3	0	0	0	111.5	E600 A604 R605	E600-D602 PolarHBondContact O-N 2.98Å; E600-D602 VanDerWaalsContact O-N 3.12Å; D602-A604 PolarHBondContact O-N 3.25Å; D602-A604 VanDerWaalsContact O-N 3.1Å; D602-A604 VanDerWaalsContact OD1-CB 3.23Å; D602-A604 WeakPolarHBondContact OD1-CB 3.32Å; D602-A604 PolarHBondContact OD1-N 2.97Å; D602-R605 WeakPolarHBondContact O-CB 3.27Å; D602-R605 PolarHBondContact O-N 3.39Å
603	P	57.1	Low	53.8	Low	88 Å²	88	113.3 Å²	113.3	57%	0.571	59%	0.591	S	S	*	*	H	α-helix	trans	-60.8	-17.4	177.1	25.5	-35.1	0	0	0	114	E601 R605 E606 V607	E601-P603 WeakPolarHBondContact O-CD 3.46Å; P603-R605 PolarHBondContact O-N 3.07Å; P603-E606 PolarHBondContact O-N 3.43Å; P603-V607 PolarHBondContact O-N 3.39Å
604	A	53.4	Low	54	Low	19 Å²	19	106.7 Å²	106.7	16%	0.157	57%	0.572	C	S	.	*	H	α-helix	trans	-57	-34.8	169.8	0	0	0	0	0	111.9	D602 V607 I608	D602-A604 PolarHBondContact O-N 3.25Å; D602-A604 VanDerWaalsContact O-N 3.1Å; D602-A604 VanDerWaalsContact OD1-CB 3.23Å; D602-A604 WeakPolarHBondContact OD1-CB 3.32Å; D602-A604 PolarHBondContact OD1-N 2.97Å; A604-V607 PolarHBondContact O-N 3.38Å; A604-I608 WeakPolarHBondContact O-CB 3.4Å; A604-I608 WeakPolarHBondContact O-CD1 3.44Å; A604-I608 VanDerWaalsContact O-CG1 3.23Å; A604-I608 WeakPolarHBondContact O-CG1 3.35Å; A604-I608 PolarHBondContact O-N 3.44Å
605	R	58.5	Low	54.2	Low	181 Å²	181	104.3 Å²	104.3	68%	0.683	57%	0.573	S	S	*	*	H	α-helix	trans	-67.5	-34.7	173.8	-78	-170	171.2	-138.8	-0.8	112.7	D602 P603 S609	D602-R605 WeakPolarHBondContact O-CB 3.27Å; D602-R605 PolarHBondContact O-N 3.39Å; P603-R605 PolarHBondContact O-N 3.07Å; R605-S609 VanDerWaalsContact O-CB 3.29Å; R605-S609 WeakPolarHBondContact O-CB 3.43Å; R605-S609 PolarHBondContact O-N 3.32Å; R605-S609 PolarHBondContact O-OG 3.2Å
606	E	59.3	Low	54.5	Low	104 Å²	104	104.5 Å²	104.5	49%	0.486	57%	0.567	S	S	.	*	H	α-helix	trans	-70.8	-40.6	176.4	-158.6	-170.5	178.9	0	0	110.7	P603 S609 R610	P603-E606 PolarHBondContact O-N 3.43Å; E606-S609 PolarHBondContact O-N 3.09Å; E606-R610 VanDerWaalsContact CD-NH2 3.33Å; E606-R610 WeakPolarHBondContact O-CB 3.46Å; E606-R610 VanDerWaalsContact O-CG 3.3Å; E606-R610 WeakPolarHBondContact O-CG 3.32Å; E606-R610 PolarHBondContact O-N 2.89Å; E606-R610 IonicContact OE1-CZ 3.27Å; E606-R610 VanDerWaalsContact OE1-CZ 3.31Å; E606-R610 IonicContact OE1-NE 3.6Å; E606-R610 PolarHBondContact OE1-NE 3.36Å; E606-R610 IonicContact OE1-NH2 2.7Å; E606-R610 PolarHBondContact OE1-NH2 2.88Å; E606-R610 IonicContact OE2-NH2 3.87Å
607	V	60.3	Low	54.7	Low	75 Å²	75	104 Å²	104	46%	0.455	56%	0.556	S	S	.	*	H	α-helix	trans	-61.2	-45.9	172.7	174.5	0	0	0	0	111.4	P603 A604 S609 R610 L611	P603-V607 PolarHBondContact O-N 3.39Å; A604-V607 PolarHBondContact O-N 3.38Å; V607-S609 VanDerWaalsContact C-N 3.35Å; V607-S609 PolarHBondContact O-N 3.38Å; V607-R610 PolarHBondContact O-N 3.49Å; V607-L611 HydrophobicContact CG1-CD1 3.97Å; V607-L611 HydrophobicContact CG1-CG 4.44Å; V607-L611 WeakPolarHBondContact O-CB 3.42Å; V607-L611 VanDerWaalsContact O-CG 3.26Å; V607-L611 WeakPolarHBondContact O-CG 3.48Å; V607-L611 PolarHBondContact O-N 3.26Å
608	I	60.4	Low	55.3	Low	53 Å²	53	101 Å²	101	27%	0.272	54%	0.54	S	S	.	.	H	α-helix	trans	-63.2	-41.1	176.1	-69.8	163.8	0	0	0	111.1	L588 E591 A604 L611 L612	L588-I608 HydrophobicContact CD2-CG1 4.32Å; E591-I608 HydrophobicContact CB-CD1 4.04Å; E591-I608 HydrophobicContact CG-CD1 4.29Å; A604-I608 WeakPolarHBondContact O-CB 3.4Å; A604-I608 WeakPolarHBondContact O-CD1 3.44Å; A604-I608 VanDerWaalsContact O-CG1 3.23Å; A604-I608 WeakPolarHBondContact O-CG1 3.35Å; A604-I608 PolarHBondContact O-N 3.44Å; I608-L611 PolarHBondContact O-N 3.19Å; I608-L612 HydrophobicContact CG2-CD1 4.15Å; I608-L612 PolarHBondContact O-N 3.16Å
609	S	60.9	Low	55.1	Low	67 Å²	67	103 Å²	103	47%	0.469	54%	0.537	S	S	.	.	H	α-helix	trans	-64.1	-46.7	177.5	-57.4	0	0	0	0	111.1	R605 E606 V607 L611 L612 E613	R605-S609 VanDerWaalsContact O-CB 3.29Å; R605-S609 WeakPolarHBondContact O-CB 3.43Å; R605-S609 PolarHBondContact O-N 3.32Å; R605-S609 PolarHBondContact O-OG 3.2Å; E606-S609 PolarHBondContact O-N 3.09Å; V607-S609 VanDerWaalsContact C-N 3.35Å; V607-S609 PolarHBondContact O-N 3.38Å; S609-L611 VanDerWaalsContact C-N 3.31Å; S609-L611 PolarHBondContact O-N 3.02Å; S609-L612 WeakPolarHBondContact O-CB 3.4Å; S609-L612 PolarHBondContact O-N 2.96Å; S609-E613 VanDerWaalsContact O-CB 3.27Å; S609-E613 WeakPolarHBondContact O-CB 3.41Å; S609-E613 PolarHBondContact O-N 2.89Å
610	R	62.3	Low	54.7	Low	144 Å²	144	100.6 Å²	100.6	54%	0.543	52%	0.52	S	S	.	.	H	α-helix	trans	-64.8	-31.2	175.3	-69.2	177.1	-172.5	-167.4	6.1	112.8	E606 V607 E613 D614	E606-R610 VanDerWaalsContact CD-NH2 3.33Å; E606-R610 WeakPolarHBondContact O-CB 3.46Å; E606-R610 VanDerWaalsContact O-CG 3.3Å; E606-R610 WeakPolarHBondContact O-CG 3.32Å; E606-R610 PolarHBondContact O-N 2.89Å; E606-R610 IonicContact OE1-CZ 3.27Å; E606-R610 VanDerWaalsContact OE1-CZ 3.31Å; E606-R610 IonicContact OE1-NE 3.6Å; E606-R610 PolarHBondContact OE1-NE 3.36Å; E606-R610 IonicContact OE1-NH2 2.7Å; E606-R610 PolarHBondContact OE1-NH2 2.88Å; E606-R610 IonicContact OE2-NH2 3.87Å; V607-R610 PolarHBondContact O-N 3.49Å; R610-E613 PolarHBondContact O-N 3.16Å; R610-D614 VanDerWaalsContact O-CB 3.32Å; R610-D614 WeakPolarHBondContact O-CB 3.36Å; R610-D614 PolarHBondContact O-N 2.94Å
611	L	61.9	Low	54.4	Low	32 Å²	32	97.5 Å²	97.5	17%	0.168	52%	0.516	C	S	.	.	H	α-helix	trans	-72.7	-35.1	174.1	-75.5	172.2	0	0	0	112.8	K584 V587 L588 V607 I608 S609 A615	K584-L611 HydrophobicContact CB-CD2 4.46Å; K584-L611 HydrophobicContact CD-CD2 3.75Å; K584-L611 HydrophobicContact CG-CD2 3.79Å; V587-L611 HydrophobicContact CG1-CD1 4.47Å; L588-L611 HydrophobicContact CD2-CD1 4.41Å; V607-L611 HydrophobicContact CG1-CD1 3.97Å; V607-L611 HydrophobicContact CG1-CG 4.44Å; V607-L611 WeakPolarHBondContact O-CB 3.42Å; V607-L611 VanDerWaalsContact O-CG 3.26Å; V607-L611 WeakPolarHBondContact O-CG 3.48Å; V607-L611 PolarHBondContact O-N 3.26Å; I608-L611 PolarHBondContact O-N 3.19Å; S609-L611 VanDerWaalsContact C-N 3.31Å; S609-L611 PolarHBondContact O-N 3.02Å; L611-A615 WeakPolarHBondContact O-CB 3.36Å; L611-A615 PolarHBondContact O-N 2.79Å; L611-A615 VanDerWaalsContact O-N 3.16Å
612	L	58.2	Low	53.8	Low	103 Å²	103	95.7 Å²	95.7	54%	0.539	51%	0.513	S	S	.	.	H	α-helix	trans	-68.4	-39.4	169	-82.8	161.3	0	0	0	111.4	I608 S609 A615 L616	I608-L612 HydrophobicContact CG2-CD1 4.15Å; I608-L612 PolarHBondContact O-N 3.16Å; S609-L612 WeakPolarHBondContact O-CB 3.4Å; S609-L612 PolarHBondContact O-N 2.96Å; L612-A615 PolarHBondContact O-N 3.3Å; L612-L616 WeakPolarHBondContact O-CB 3.3Å; L612-L616 VanDerWaalsContact O-CG 3.3Å; L612-L616 WeakPolarHBondContact O-CG 3.41Å; L612-L616 PolarHBondContact O-N 2.92Å
613	E	61.2	Low	53.2	Low	109 Å²	109	98.7 Å²	98.7	51%	0.509	52%	0.524	S	S	.	.	H	α-helix	trans	-70.5	-39.2	179.2	-162.9	164.1	-139.3	0	0	111.6	S609 R610 A615 L616 Q617	S609-E613 VanDerWaalsContact O-CB 3.27Å; S609-E613 WeakPolarHBondContact O-CB 3.41Å; S609-E613 PolarHBondContact O-N 2.89Å; R610-E613 PolarHBondContact O-N 3.16Å; E613-A615 VanDerWaalsContact C-N 3.32Å; E613-A615 PolarHBondContact O-N 3.34Å; E613-L616 PolarHBondContact O-N 3.22Å; E613-Q617 VanDerWaalsContact O-CB 3.3Å; E613-Q617 WeakPolarHBondContact O-CB 3.23Å; E613-Q617 VanDerWaalsContact O-CG 3.28Å; E613-Q617 WeakPolarHBondContact O-CG 3.32Å; E613-Q617 PolarHBondContact O-N 3.38Å
614	D	59.1	Low	52.4	Low	82 Å²	82	101.6 Å²	101.6	44%	0.439	54%	0.535	S	S	.	.	H	α-helix	trans	-55.1	-45	165.5	-101.8	13.6	0	0	0	111.6	K584 R610 A618	K584-D614 IonicContact NZ-OD2 2.68Å; K584-D614 PolarHBondContact NZ-OD2 2.99Å; R610-D614 VanDerWaalsContact O-CB 3.32Å; R610-D614 WeakPolarHBondContact O-CB 3.36Å; R610-D614 PolarHBondContact O-N 2.94Å; D614-A618 PolarHBondContact O-N 3.48Å
615	A	55.2	Low	51.8	Low	62 Å²	62	109.6 Å²	109.6	51%	0.512	57%	0.569	S	S	.	*	H	α-helix	trans	-70	-33.1	-178.4	0	0	0	0	0	112.5	L611 L612 E613	L611-A615 WeakPolarHBondContact O-CB 3.36Å; L611-A615 PolarHBondContact O-N 2.79Å; L611-A615 VanDerWaalsContact O-N 3.16Å; L612-A615 PolarHBondContact O-N 3.3Å; E613-A615 VanDerWaalsContact C-N 3.32Å; E613-A615 PolarHBondContact O-N 3.34Å
616	L	50	Low	50.7	Low	124 Å²	124	108.5 Å²	108.5	65%	0.649	57%	0.571	S	S	*	*	H	α-helix	trans	-78.1	-37	174.4	-70.8	164	0	0	0	112.1	L612 E613 A618 E619	L612-L616 WeakPolarHBondContact O-CB 3.3Å; L612-L616 VanDerWaalsContact O-CG 3.3Å; L612-L616 WeakPolarHBondContact O-CG 3.41Å; L612-L616 PolarHBondContact O-N 2.92Å; E613-L616 PolarHBondContact O-N 3.22Å; L616-A618 VanDerWaalsContact C-N 3.28Å; L616-A618 PolarHBondContact O-N 3.27Å; L616-E619 CarbonylContact O-C 3.58Å; L616-E619 PolarHBondContact O-N 2.89Å; L616-E619 VanDerWaalsContact O-N 3.09Å
617	Q	49.2	Very low	49.6	Very low	117 Å²	117	111.6 Å²	111.6	55%	0.547	59%	0.586	S	S	.	*	H	α-helix	trans	-69.9	-25.2	175	-74.4	-176	32	0	0	112.5	E613 E619 S620	E613-Q617 VanDerWaalsContact O-CB 3.3Å; E613-Q617 WeakPolarHBondContact O-CB 3.23Å; E613-Q617 VanDerWaalsContact O-CG 3.28Å; E613-Q617 WeakPolarHBondContact O-CG 3.32Å; E613-Q617 PolarHBondContact O-N 3.38Å; Q617-E619 PolarHBondContact O-N 3.28Å; Q617-S620 VanDerWaalsContact O-CB 3.3Å; Q617-S620 WeakPolarHBondContact O-CB 3.47Å; Q617-S620 PolarHBondContact O-N 3.22Å; Q617-S620 PolarHBondContact O-OG 3.37Å
618	A	50.2	Low	48.6	Very low	57 Å²	57	113.1 Å²	113.1	47%	0.471	59%	0.59	S	S	.	*	T	Hydrogen-bonded Turn	trans	-59.8	-27.6	168.2	0	0	0	0	0	112.6	D614 L616 I628	D614-A618 PolarHBondContact O-N 3.48Å; L616-A618 VanDerWaalsContact C-N 3.28Å; L616-A618 PolarHBondContact O-N 3.27Å; A618-I628 HydrophobicContact CB-CD1 4.23Å; A618-I628 WeakPolarHBondContact O-CD1 3.34Å
619	E	40.7	Very low	47.4	Very low	157 Å²	157	117 Å²	117	73%	0.734	61%	0.605	S	S	*	*	T	Hydrogen-bonded Turn	trans	-99.9	21.8	173.7	-59.6	-160.5	139.3	0	0	113.1	L616 Q617	L616-E619 CarbonylContact O-C 3.58Å; L616-E619 PolarHBondContact O-N 2.89Å; L616-E619 VanDerWaalsContact O-N 3.09Å; Q617-E619 PolarHBondContact O-N 3.28Å
620	S	36.3	Very low	46.1	Very low	59 Å²	59	121.7 Å²	121.7	41%	0.413	62%	0.617	S	S	.	*			trans	-77.7	146.4	173.4	67.1	0	0	0	0	112.9	Q617 D622	Q617-S620 VanDerWaalsContact O-CB 3.3Å; Q617-S620 WeakPolarHBondContact O-CB 3.47Å; Q617-S620 PolarHBondContact O-N 3.22Å; Q617-S620 PolarHBondContact O-OG 3.37Å; S620-D622 PolarHBondContact O-N 2.9Å
621	P	42.7	Very low	44.8	Very low	122 Å²	122	120.4 Å²	120.4	79%	0.792	63%	0.628	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.1	-19.2	-163.2	-17.3	33.6	0	0	0	116.3	Q623	P621-Q623 PolarHBondContact O-N 2.96Å
622	D	39.6	Very low	43.8	Very low	161 Å²	161	124.2 Å²	124.2	86%	0.861	65%	0.648	S	S	*	*	T	Hydrogen-bonded Turn	trans	-95.9	22.2	-161.9	-76.6	-35.3	0	0	0	115.1	S620	S620-D622 PolarHBondContact O-N 2.9Å
623	Q	40.2	Very low	43.5	Very low	157 Å²	157	123.9 Å²	123.9	73%	0.734	65%	0.654	S	S	*	*	S	Bend	trans	-112.1	109.2	167.5	-66.5	-164.8	26.8	0	0	111.8	P621 E625	P621-Q623 PolarHBondContact O-N 2.96Å; Q623-E625 PolarHBondContact O-N 2.94Å
624	N	40.7	Very low	43.4	Very low	149 Å²	149	120.7 Å²	120.7	80%	0.797	64%	0.642	S	S	*	*	T	Hydrogen-bonded Turn	trans	-49.6	121.5	-178.6	-91.8	-3	0	0	0	113.7	H626	N624-H626 VanDerWaalsContact C-N 3.33Å; N624-H626 PolarHBondContact O-N 3.35Å; N624-H626 VanDerWaalsContact O-N 3.09Å; N624-H626 PolarHBondContact O-ND1 3.49Å
625	E	40.2	Very low	44.1	Very low	186 Å²	186	120.6 Å²	120.6	87%	0.869	65%	0.648	S	S	*	*	T	Hydrogen-bonded Turn	trans	50.7	37	156.5	-56.9	-162.7	132.4	0	0	117	Q623	Q623-E625 PolarHBondContact O-N 2.94Å
626	H	35.2	Very low	45.1	Very low	158 Å²	158	122.7 Å²	122.7	73%	0.731	65%	0.647	S	S	*	*			trans	-98.3	95.3	167.1	-82.9	29	0	0	0	111	N624 I628	N624-H626 VanDerWaalsContact C-N 3.33Å; N624-H626 PolarHBondContact O-N 3.35Å; N624-H626 VanDerWaalsContact O-N 3.09Å; N624-H626 PolarHBondContact O-ND1 3.49Å; H626-I628 PolarHBondContact O-N 2.92Å
627	Q	37.9	Very low	46.7	Very low	170 Å²	170	119.2 Å²	119.2	79%	0.794	63%	0.626	S	S	*	*			trans	-54.2	98.3	175.6	-66.7	175	-8.2	0	0	111	F629	Q627-F629 PolarHBondContact O-N 2.89Å
628	I	38	Very low	48.5	Very low	106 Å²	106	115.5 Å²	115.5	54%	0.544	61%	0.609	S	S	.	*			trans	-62.4	118.2	160.7	-71.4	-179.4	0	0	0	106.8	A618 H626 K630	A618-I628 HydrophobicContact CB-CD1 4.23Å; A618-I628 WeakPolarHBondContact O-CD1 3.34Å; H626-I628 PolarHBondContact O-N 2.92Å; I628-K630 VanDerWaalsContact C-N 3.31Å; I628-K630 PolarHBondContact O-N 3.46Å
629	F	36.2	Very low	50.1	Low	135 Å²	135	117.2 Å²	117.2	59%	0.592	61%	0.614	S	S	*	*			trans	-67.1	87.7	-178	-96.5	-111.3	0	0	0	110.2	Q627 P631	Q627-F629 PolarHBondContact O-N 2.89Å; F629-P631 WeakPolarHBondContact O-CD 3.24Å
630	K	33.3	Very low	52.4	Low	165 Å²	165	111 Å²	111	72%	0.717	58%	0.584	S	S	*	*			trans	-56.4	118.2	144.4	-76	-179.1	177	173.2	0	105.8	I628 N632	I628-K630 VanDerWaalsContact C-N 3.31Å; I628-K630 PolarHBondContact O-N 3.46Å; K630-N632 PolarHBondContact O-N 3.02Å
631	P	35.8	Very low	54.8	Low	118 Å²	118	108.1 Å²	108.1	77%	0.766	56%	0.564	S	S	*	*			trans	-63.1	102.8	-170.9	23.7	-33.7	0	0	0	109.4	F629 S633	F629-P631 WeakPolarHBondContact O-CD 3.24Å; P631-S633 VanDerWaalsContact C-N 3.35Å; P631-S633 PolarHBondContact O-N 3.31Å
632	N	40.1	Very low	57	Low	112 Å²	112	102.9 Å²	102.9	60%	0.599	53%	0.529	S	S	*	.			trans	-0.3	79	-168.6	-93.7	-59.1	0	0	0	114.2	K630 V634	K630-N632 PolarHBondContact O-N 3.02Å; N632-V634 PolarHBondContact O-N 2.85Å
633	S	51.7	Low	59.2	Low	95 Å²	95	97.7 Å²	97.7	66%	0.664	50%	0.499	S	S	*	.	P	Polyproline II helix	trans	-54.4	118.4	175.1	52.2	0	0	0	0	108.1	P631 S635	P631-S633 VanDerWaalsContact C-N 3.35Å; P631-S633 PolarHBondContact O-N 3.31Å; S633-S635 PolarHBondContact O-N 2.75Å
634	V	60.2	Low	61	Low	42 Å²	42	91.8 Å²	91.8	26%	0.255	47%	0.474	S	S	.	.	P	Polyproline II helix	trans	-48.8	118.3	176.6	176.6	0	0	0	0	107	N632 E636 T644 V645 A661 L662	N632-V634 PolarHBondContact O-N 2.85Å; V634-E636 PolarHBondContact O-N 2.84Å; V634-T644 HydrophobicContact CG1-CG2 4.26Å; V634-T644 WeakPolarHBondContact CG1-OG1 3.33Å; V634-V645 HydrophobicContact CG1-CG2 4.38Å; V634-A661 HydrophobicContact CG1-CB 3.5Å; V634-A661 VanDerWaalsContact CG1-CB 3.5Å; V634-L662 HydrophobicContact CG2-CD1 4.49Å; V634-L662 HydrophobicContact CG2-CD2 3.8Å; V634-L662 HydrophobicContact CG2-CG 3.82Å
635	S	72.5	Confident	62.4	Low	81 Å²	81	86 Å²	86	57%	0.566	44%	0.443	S	S	*	.	P	Polyproline II helix	trans	-51.6	128.2	-176.7	172.9	0	0	0	0	109	S633 Y637 T644	S633-S635 PolarHBondContact O-N 2.75Å; S635-Y637 WeakPolarHBondContact CB-O 3.18Å; S635-Y637 PolarHBondContact O-N 3.13Å; S635-Y637 PolarHBondContact OG-O 3.3Å; S635-T644 WeakPolarHBondContact O-CB 3.43Å; S635-T644 WeakPolarHBondContact O-CG2 3.49Å; S635-T644 PolarHBondContact O-OG1 2.82Å
636	E	77.5	Confident	63.5	Low	106 Å²	106	78.9 Å²	78.9	50%	0.495	41%	0.413	S	S	.	.	S	Bend	trans	-50.2	-37.8	-175.7	-171.2	-165.9	153.8	0	0	111	V634 K643 T644	V634-E636 PolarHBondContact O-N 2.84Å; E636-K643 CarbonylContact O-C 3.57Å; E636-K643 VanDerWaalsContact O-CA 3.23Å; E636-K643 WeakPolarHBondContact O-CA 3.49Å; E636-K643 VanDerWaalsContact OE1-CE 3.23Å; E636-K643 WeakPolarHBondContact OE1-CE 3.45Å; E636-K643 IonicContact OE1-NZ 3.58Å; E636-T644 PolarHBondContact O-N 3.24Å; E636-T644 PolarHBondContact O-OG1 3.47Å
637	Y	83.3	Confident	64.5	Low	51 Å²	51	78.3 Å²	78.3	20%	0.2	41%	0.411	C	S	.	.	B	Isolated β-bridge	trans	-114.5	148.9	173.6	-55.5	-86.6	0	0	0	112.3	S635 G641 F642 K643 K765	S635-Y637 WeakPolarHBondContact CB-O 3.18Å; S635-Y637 PolarHBondContact O-N 3.13Å; S635-Y637 PolarHBondContact OG-O 3.3Å; Y637-G641 WeakPolarHBondContact CD1-O 3.18Å; Y637-F642 CarbonylContact C-O 3.56Å; Y637-F642 WeakPolarHBondContact CA-O 3.4Å; Y637-K643 HydrophobicContact CD1-CG 3.89Å; Y637-K643 HydrophobicContact CE1-CD 4.33Å; Y637-K643 HydrophobicContact CE1-CG 3.42Å; Y637-K643 VanDerWaalsContact CE1-CG 3.42Å; Y637-K643 WeakPolarHBondContact OH-CE 3.16Å; Y637-K765 HydrophobicContact CD1-CB 3.92Å; Y637-K765 HydrophobicContact CE1-CB 3.75Å; Y637-K765 HydrophobicContact CG-CB 4.38Å; Y637-K765 HydrophobicContact CG-CD 4.33Å
638	D	85.9	Confident	65.3	Low	38 Å²	38	71.6 Å²	71.6	20%	0.203	38%	0.38	C	S	.	.			trans	-73.8	177.7	168.6	71.1	10	0	0	0	111.7	Y640 G641 F642 T644 S885	D638-Y640 PolarHBondContact O-N 2.9Å; D638-Y640 VanDerWaalsContact O-N 3.09Å; D638-Y640 VanDerWaalsContact OD1-C 3.23Å; D638-Y640 VanDerWaalsContact OD1-CA 3.26Å; D638-Y640 WeakPolarHBondContact OD1-CA 3.46Å; D638-Y640 WeakPolarHBondContact OD1-CB 3.33Å; D638-Y640 PolarHBondContact OD1-N 3.01Å; D638-G641 PolarHBondContact O-N 3.4Å; D638-G641 PolarHBondContact OD1-N 3.31Å; D638-F642 PolarHBondContact N-O 3.37Å; D638-F642 PolarHBondContact OD1-N 2.81Å; D638-T644 HydrophobicContact CB-CG2 4.05Å; D638-S885 WeakPolarHBondContact OD2-CB 3.48Å; D638-S885 PolarHBondContact OD2-OG 3.1Å
639	V	85.1	Confident	65.8	Low	94 Å²	94	75 Å²	75	57%	0.57	39%	0.393	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.1	-26.8	177.1	-173.9	0	0	0	0	111.8	V206 H708	V206-V639 WeakPolarHBondContact CG1-O 3.33Å; V639-H708 HydrophobicContact CG1-CB 4.48Å
640	Y	88.2	Confident	67.1	Low	25 Å²	25	74.7 Å²	74.7	10%	0.098	39%	0.394	C	S	.	.	T	Hydrogen-bonded Turn	trans	-93.1	-0.9	-177	-47.4	-58	0	0	0	113.6	D638 H708 R711 N764 Y808 S885 F889	D638-Y640 PolarHBondContact O-N 2.9Å; D638-Y640 VanDerWaalsContact O-N 3.09Å; D638-Y640 VanDerWaalsContact OD1-C 3.23Å; D638-Y640 VanDerWaalsContact OD1-CA 3.26Å; D638-Y640 WeakPolarHBondContact OD1-CA 3.46Å; D638-Y640 WeakPolarHBondContact OD1-CB 3.33Å; D638-Y640 PolarHBondContact OD1-N 3.01Å; Y640-H708 AromaticContact CD1-ND1 3.84Å; Y640-H708 HydrophobicContact CE1-CB 4.33Å; Y640-H708 AromaticContact CE1-ND1 3.79Å; Y640-R711 PolarHBondContact OH-NH1 3.26Å; Y640-N764 PolarHBondContact O-ND2 2.96Å; Y640-N764 VanDerWaalsContact O-ND2 3.07Å; Y640-Y808 WeakPolarHBondContact CD1-OH 3.47Å; Y640-Y808 WeakPolarHBondContact CE1-OH 3.33Å; Y640-S885 VanDerWaalsContact CD2-CB 3.48Å; Y640-F889 VanDerWaalsContact CB-CE2 3.45Å; Y640-F889 AromaticContact CD1-CD2 3.72Å; Y640-F889 HydrophobicContact CD1-CD2 3.72Å; Y640-F889 AromaticContact CD1-CE2 3.76Å; Y640-F889 HydrophobicContact CD1-CE2 3.76Å; Y640-F889 AromaticContact CD2-CD2 3.68Å; Y640-F889 HydrophobicContact CD2-CD2 3.68Å; Y640-F889 AromaticContact CD2-CE2 3.71Å; Y640-F889 HydrophobicContact CD2-CE2 3.71Å; Y640-F889 AromaticContact CE1-CD2 3.87Å; Y640-F889 HydrophobicContact CE1-CD2 3.87Å; Y640-F889 HydrophobicContact CE1-CE2 4.38Å; Y640-F889 HydrophobicContact CE1-CG 4.49Å; Y640-F889 AromaticContact CE2-CD2 3.81Å; Y640-F889 HydrophobicContact CE2-CD2 3.81Å; Y640-F889 HydrophobicContact CE2-CE2 4.32Å; Y640-F889 AromaticContact CG-CD2 3.59Å; Y640-F889 HydrophobicContact CG-CD2 3.59Å; Y640-F889 AromaticContact CG-CE2 3.33Å; Y640-F889 HydrophobicContact CG-CE2 3.33Å; Y640-F889 HydrophobicContact CG-CZ 4.32Å; Y640-F889 AromaticContact CZ-CD2 3.87Å
641	G	87.1	Confident	68.7	Low	0 Å²	0	74.9 Å²	74.9	0%	0	40%	0.397	C	S	.	.	S	Bend	trans	83.7	12.3	178.6	0	0	0	0	0	115.6	Y637 D638 N764 K765	Y637-G641 WeakPolarHBondContact CD1-O 3.18Å; D638-G641 PolarHBondContact O-N 3.4Å; D638-G641 PolarHBondContact OD1-N 3.31Å; G641-N764 CarbonylContact O-C 3.57Å; G641-N764 VanDerWaalsContact O-CA 3.23Å; G641-N764 WeakPolarHBondContact O-CA 3.46Å; G641-N764 PolarHBondContact O-ND2 3.1Å; G641-K765 PolarHBondContact O-N 2.66Å
642	F	89.1	Confident	70.1	Confident	11 Å²	11	76.2 Å²	76.2	5%	0.048	39%	0.393	C	S	.	.	B	Isolated β-bridge	trans	-90.1	143.5	173.3	-65	-86.5	0	0	0	111.7	Y637 D638 T644 L761 N763 N764 I804 L807 F889	Y637-F642 CarbonylContact C-O 3.56Å; Y637-F642 WeakPolarHBondContact CA-O 3.4Å; D638-F642 PolarHBondContact N-O 3.37Å; D638-F642 PolarHBondContact OD1-N 2.81Å; F642-T644 PolarHBondContact O-N 2.96Å; F642-L761 HydrophobicContact CE1-CB 4.39Å; F642-L761 HydrophobicContact CE1-CD1 4.22Å; F642-L761 HydrophobicContact CE1-CD2 4.22Å; F642-L761 HydrophobicContact CZ-CD1 4.18Å; F642-N763 CarbonylContact C-O 3.57Å; F642-N763 WeakPolarHBondContact CA-O 3.35Å; F642-N764 HydrophobicContact CD1-CB 3.74Å; F642-N764 WeakPolarHBondContact CD2-ND2 3.42Å; F642-N764 HydrophobicContact CE1-CB 3.76Å; F642-N764 WeakPolarHBondContact CE2-ND2 3.41Å; F642-N764 HydrophobicContact CG-CB 4.37Å; F642-N764 HydrophobicContact CZ-CB 4.4Å; F642-I804 HydrophobicContact CZ-CD1 3.96Å; F642-L807 HydrophobicContact CE2-CD1 4.07Å; F642-L807 HydrophobicContact CZ-CD1 4.12Å; F642-F889 AromaticContact CE2-CE2 3.99Å; F642-F889 HydrophobicContact CE2-CE2 3.99Å; F642-F889 AromaticContact CE2-CZ 3.94Å; F642-F889 HydrophobicContact CE2-CZ 3.94Å
643	K	85.1	Confident	71.4	Confident	52 Å²	52	75.3 Å²	75.3	23%	0.226	39%	0.385	C	S	.	.	B	Isolated β-bridge	trans	-58.7	124.2	175.6	-75.7	-168.5	168	-179.9	0	111.2	E636 Y637 E647 N763	E636-K643 CarbonylContact O-C 3.57Å; E636-K643 VanDerWaalsContact O-CA 3.23Å; E636-K643 WeakPolarHBondContact O-CA 3.49Å; E636-K643 VanDerWaalsContact OE1-CE 3.23Å; E636-K643 WeakPolarHBondContact OE1-CE 3.45Å; E636-K643 IonicContact OE1-NZ 3.58Å; Y637-K643 HydrophobicContact CD1-CG 3.89Å; Y637-K643 HydrophobicContact CE1-CD 4.33Å; Y637-K643 HydrophobicContact CE1-CG 3.42Å; Y637-K643 VanDerWaalsContact CE1-CG 3.42Å; Y637-K643 WeakPolarHBondContact OH-CE 3.16Å; K643-E647 IonicContact NZ-OE1 3.39Å; K643-E647 PolarHBondContact NZ-OE1 3.32Å; K643-N763 PolarHBondContact N-O 2.92Å
644	T	77.6	Confident	72.2	Confident	34 Å²	34	74.7 Å²	74.7	21%	0.209	37%	0.371	C	S	.	.	S	Bend	trans	-73.8	-34.2	177.1	54.7	0	0	0	0	112.1	V634 S635 E636 D638 F642	V634-T644 HydrophobicContact CG1-CG2 4.26Å; V634-T644 WeakPolarHBondContact CG1-OG1 3.33Å; S635-T644 WeakPolarHBondContact O-CB 3.43Å; S635-T644 WeakPolarHBondContact O-CG2 3.49Å; S635-T644 PolarHBondContact O-OG1 2.82Å; E636-T644 PolarHBondContact O-N 3.24Å; E636-T644 PolarHBondContact O-OG1 3.47Å; D638-T644 HydrophobicContact CB-CG2 4.05Å; F642-T644 PolarHBondContact O-N 2.96Å
645	V	70.1	Confident	72.6	Confident	26 Å²	26	77.4 Å²	77.4	16%	0.158	38%	0.383	C	S	.	.	S	Bend	trans	-126.3	108.4	178.7	-178.5	0	0	0	0	106.5	V634 K654 A657 K658	V634-V645 HydrophobicContact CG1-CG2 4.38Å; V645-K654 HydrophobicContact CG1-CG 3.63Å; V645-A657 HydrophobicContact CG1-CB 4.25Å; V645-A657 HydrophobicContact CG2-CB 4.45Å; V645-K658 HydrophobicContact CG1-CG 4.42Å; V645-K658 HydrophobicContact CG2-CB 4.45Å; V645-K658 HydrophobicContact CG2-CG 3.68Å
646	P	63.4	Low	72.6	Confident	38 Å²	38	75.9 Å²	75.9	25%	0.247	37%	0.37	C	S	.	.			trans	-60.8	156.2	173.2	-23.9	35.6	0	0	0	112	E648	P646-E648 HydrophobicContact CB-CB 4.42Å; P646-E648 HydrophobicContact CB-CG 3.8Å; P646-E648 WeakPolarHBondContact CG-OE2 3.31Å; P646-E648 PolarHBondContact O-N 2.98Å
647	E	57.5	Low	72.4	Confident	146 Å²	146	71 Å²	71	68%	0.682	35%	0.348	S	S	*	.			trans	-79.7	65.4	160.6	-74.8	158	-108	0	0	108.8	K643	K643-E647 IonicContact NZ-OE1 3.39Å; K643-E647 PolarHBondContact NZ-OE1 3.32Å
648	E	53.6	Low	71.9	Confident	28 Å²	28	73.1 Å²	73.1	13%	0.131	36%	0.359	C	S	.	.			trans	-79.5	146.9	167.5	-81.8	153.8	176.7	0	0	109.1	M1 P646 E650 E653 R936	M1-E648 HydrophobicContact CE-CG 3.5Å; P646-E648 HydrophobicContact CB-CB 4.42Å; P646-E648 HydrophobicContact CB-CG 3.8Å; P646-E648 WeakPolarHBondContact CG-OE2 3.31Å; P646-E648 PolarHBondContact O-N 2.98Å; E648-E650 VanDerWaalsContact C-N 3.3Å; E648-E650 PolarHBondContact O-N 2.88Å; E648-E653 HydrophobicContact CB-CB 4.21Å; E648-R936 IonicContact OE1-NH1 3.84Å
649	E	49.4	Very low	71.4	Confident	179 Å²	179	76.1 Å²	76.1	84%	0.836	37%	0.374	S	S	*	.	S	Bend	trans	-76.8	-16.7	-165.7	-67.9	165.7	-132.7	0	0	112.8
650	E	63.3	Low	71	Confident	128 Å²	128	75.1 Å²	75.1	60%	0.598	36%	0.36	S	S	*	.	S	Bend	trans	-107.2	134	-177.3	-64.5	-179.6	-177.4	0	0	111.9	E648 E652 E653 K654	E648-E650 VanDerWaalsContact C-N 3.3Å; E648-E650 PolarHBondContact O-N 2.88Å; E650-E652 PolarHBondContact O-N 2.88Å; E650-E653 HydrophobicContact CB-CG 4.47Å; E650-E653 PolarHBondContact O-N 3.27Å; E650-K654 PolarHBondContact O-N 3.35Å
651	E	65.4	Low	70.3	Confident	169 Å²	169	74.6 Å²	74.6	79%	0.79	36%	0.361	S	S	*	.	H	α-helix	trans	-67.2	-24.8	-176.7	-62.3	-156	123.3	0	0	113.5	K654 L655	E651-K654 WeakPolarHBondContact O-CB 3.39Å; E651-L655 WeakPolarHBondContact O-CB 3.49Å; E651-L655 PolarHBondContact O-N 3.3Å
652	E	65.4	Low	69.8	Low	146 Å²	146	78.8 Å²	78.8	68%	0.682	38%	0.383	S	S	*	.	H	α-helix	trans	-70	-48	176.8	-170.7	174.9	173.8	0	0	111.6	E650 K654 L655 V656	E650-E652 PolarHBondContact O-N 2.88Å; E652-K654 PolarHBondContact O-N 3.32Å; E652-L655 PolarHBondContact O-N 3.07Å; E652-L655 VanDerWaalsContact O-N 3.08Å; E652-V656 WeakPolarHBondContact O-CG2 3.45Å; E652-V656 PolarHBondContact O-N 3.06Å
653	E	67.3	Low	69.2	Low	93 Å²	93	83.1 Å²	83.1	44%	0.435	40%	0.403	S	S	.	.	H	α-helix	trans	-57.1	-41.9	174	-65.8	-157.2	119.4	0	0	110.9	E648 E650 L655 V656 A657	E648-E653 HydrophobicContact CB-CB 4.21Å; E650-E653 HydrophobicContact CB-CG 4.47Å; E650-E653 PolarHBondContact O-N 3.27Å; E653-L655 PolarHBondContact O-N 2.97Å; E653-V656 PolarHBondContact O-N 3.13Å; E653-A657 WeakPolarHBondContact O-CB 3.44Å; E653-A657 PolarHBondContact O-N 3.31Å
654	K	68.6	Low	68.8	Low	82 Å²	82	83 Å²	83	36%	0.357	41%	0.405	S	S	.	.	H	α-helix	trans	-63.7	-36.9	176.4	-163.6	177.2	-167.5	167.7	0	113	V645 E650 E651 E652 K658	V645-K654 HydrophobicContact CG1-CG 3.63Å; E650-K654 PolarHBondContact O-N 3.35Å; E651-K654 WeakPolarHBondContact O-CB 3.39Å; E652-K654 PolarHBondContact O-N 3.32Å; K654-K658 WeakPolarHBondContact O-CG 3.4Å; K654-K658 PolarHBondContact O-N 3.01Å; K654-K658 VanDerWaalsContact O-N 3.15Å
655	L	68.6	Low	68.6	Low	98 Å²	98	87 Å²	87	51%	0.513	42%	0.419	S	S	.	.	H	α-helix	trans	-70.8	-45	174.6	-177.7	62.5	0	0	0	111.2	E651 E652 E653 A657 K658 L659	E651-L655 WeakPolarHBondContact O-CB 3.49Å; E651-L655 PolarHBondContact O-N 3.3Å; E652-L655 PolarHBondContact O-N 3.07Å; E652-L655 VanDerWaalsContact O-N 3.08Å; E653-L655 PolarHBondContact O-N 2.97Å; L655-A657 VanDerWaalsContact C-N 3.31Å; L655-A657 PolarHBondContact O-N 3.06Å; L655-K658 WeakPolarHBondContact O-CB 3.49Å; L655-K658 PolarHBondContact O-N 3.35Å; L655-L659 WeakPolarHBondContact O-CG 3.04Å; L655-L659 PolarHBondContact O-N 3.37Å
656	V	72.9	Confident	68.9	Low	50 Å²	50	89.8 Å²	89.8	30%	0.303	44%	0.44	S	S	.	.	H	α-helix	trans	-63.3	-38.2	176.4	178.8	0	0	0	0	110.8	E652 E653 L659 R660	E652-V656 WeakPolarHBondContact O-CG2 3.45Å; E652-V656 PolarHBondContact O-N 3.06Å; E653-V656 PolarHBondContact O-N 3.13Å; V656-L659 PolarHBondContact O-N 2.85Å; V656-R660 VanDerWaalsContact CG1-NH2 3.33Å; V656-R660 WeakPolarHBondContact O-CG 3.31Å; V656-R660 PolarHBondContact O-N 3.31Å
657	A	73	Confident	69.3	Low	4 Å²	4	90.5 Å²	90.5	3%	0.033	44%	0.441	C	S	.	.	H	α-helix	trans	-62.4	-43.4	173.2	0	0	0	0	0	112.5	V645 E653 L655 L659 R660 A661	V645-A657 HydrophobicContact CG1-CB 4.25Å; V645-A657 HydrophobicContact CG2-CB 4.45Å; E653-A657 WeakPolarHBondContact O-CB 3.44Å; E653-A657 PolarHBondContact O-N 3.31Å; L655-A657 VanDerWaalsContact C-N 3.31Å; L655-A657 PolarHBondContact O-N 3.06Å; A657-L659 VanDerWaalsContact C-N 3.34Å; A657-L659 PolarHBondContact O-N 3.42Å; A657-R660 PolarHBondContact O-N 2.99Å; A657-A661 WeakPolarHBondContact O-CB 3.34Å; A657-A661 PolarHBondContact O-N 3.33Å
658	K	72.9	Confident	69.9	Low	95 Å²	95	86.5 Å²	86.5	41%	0.413	43%	0.43	S	S	.	.	H	α-helix	trans	-58.6	-44	172.4	-73.4	168.6	-179.7	175.1	0	111.9	V645 K654 L655 A661 L662	V645-K658 HydrophobicContact CG1-CG 4.42Å; V645-K658 HydrophobicContact CG2-CB 4.45Å; V645-K658 HydrophobicContact CG2-CG 3.68Å; K654-K658 WeakPolarHBondContact O-CG 3.4Å; K654-K658 PolarHBondContact O-N 3.01Å; K654-K658 VanDerWaalsContact O-N 3.15Å; L655-K658 WeakPolarHBondContact O-CB 3.49Å; L655-K658 PolarHBondContact O-N 3.35Å; K658-A661 PolarHBondContact O-N 2.87Å; K658-L662 WeakPolarHBondContact O-CG 3.34Å; K658-L662 PolarHBondContact O-N 2.93Å
659	L	75.3	Confident	70.4	Confident	101 Å²	101	92.3 Å²	92.3	53%	0.529	46%	0.458	S	S	.	.	H	α-helix	trans	-61.5	-50.3	177.8	-71.2	170.1	0	0	0	111.5	L655 V656 A657 A661 L662 E663	L655-L659 WeakPolarHBondContact O-CG 3.04Å; L655-L659 PolarHBondContact O-N 3.37Å; V656-L659 PolarHBondContact O-N 2.85Å; A657-L659 VanDerWaalsContact C-N 3.34Å; A657-L659 PolarHBondContact O-N 3.42Å; L659-A661 VanDerWaalsContact C-N 3.27Å; L659-A661 PolarHBondContact O-N 2.93Å; L659-L662 PolarHBondContact O-N 2.96Å; L659-L662 VanDerWaalsContact O-N 3.17Å; L659-E663 WeakPolarHBondContact O-CB 3.23Å; L659-E663 PolarHBondContact O-N 3.14Å
660	R	76.4	Confident	71.4	Confident	73 Å²	73	85.9 Å²	85.9	28%	0.275	43%	0.432	S	S	.	.	H	α-helix	trans	-55.5	-41.2	175.2	-65.8	174.9	-166.7	139	3.3	112	V656 A657 E663 L664 L939	V656-R660 VanDerWaalsContact CG1-NH2 3.33Å; V656-R660 WeakPolarHBondContact O-CG 3.31Å; V656-R660 PolarHBondContact O-N 3.31Å; A657-R660 PolarHBondContact O-N 2.99Å; R660-E663 PolarHBondContact O-N 2.94Å; R660-L664 WeakPolarHBondContact O-CB 3.2Å; R660-L664 WeakPolarHBondContact O-CG 3.05Å; R660-L664 PolarHBondContact O-N 3Å; R660-L939 HydrophobicContact CB-CD1 3.96Å; R660-L939 HydrophobicContact CB-CD2 4.5Å; R660-L939 HydrophobicContact CG-CD1 4.1Å
661	A	75.3	Confident	71.2	Confident	14 Å²	14	85.4 Å²	85.4	12%	0.116	43%	0.433	C	S	.	.	H	α-helix	trans	-71.1	-34.4	-179.9	0	0	0	0	0	113.2	V634 A657 K658 L659 K665	V634-A661 HydrophobicContact CG1-CB 3.5Å; V634-A661 VanDerWaalsContact CG1-CB 3.5Å; A657-A661 WeakPolarHBondContact O-CB 3.34Å; A657-A661 PolarHBondContact O-N 3.33Å; K658-A661 PolarHBondContact O-N 2.87Å; L659-A661 VanDerWaalsContact C-N 3.27Å; L659-A661 PolarHBondContact O-N 2.93Å; A661-K665 WeakPolarHBondContact O-CB 3.22Å; A661-K665 PolarHBondContact O-N 3.41Å; A661-K665 VanDerWaalsContact O-N 3.12Å
662	L	75.1	Confident	71.1	Confident	87 Å²	87	81.9 Å²	81.9	46%	0.455	42%	0.417	S	S	.	.	H	α-helix	trans	-68.8	-40.3	170.8	-71.9	171.5	0	0	0	111.6	V634 K658 L659 K665 S666	V634-L662 HydrophobicContact CG2-CD1 4.49Å; V634-L662 HydrophobicContact CG2-CD2 3.8Å; V634-L662 HydrophobicContact CG2-CG 3.82Å; K658-L662 WeakPolarHBondContact O-CG 3.34Å; K658-L662 PolarHBondContact O-N 2.93Å; L659-L662 PolarHBondContact O-N 2.96Å; L659-L662 VanDerWaalsContact O-N 3.17Å; L662-K665 PolarHBondContact O-N 3.06Å; L662-S666 WeakPolarHBondContact O-CB 3.13Å; L662-S666 PolarHBondContact O-N 2.81Å
663	E	76.4	Confident	71.2	Confident	103 Å²	103	77.9 Å²	77.9	48%	0.481	40%	0.398	S	S	.	.	H	α-helix	trans	-64.2	-47.4	176.6	-170.6	179.5	163	0	0	111.5	L659 R660 K665 S666 L667 L939	L659-E663 WeakPolarHBondContact O-CB 3.23Å; L659-E663 PolarHBondContact O-N 3.14Å; R660-E663 PolarHBondContact O-N 2.94Å; E663-K665 VanDerWaalsContact C-N 3.29Å; E663-K665 PolarHBondContact O-N 3.21Å; E663-S666 WeakPolarHBondContact O-CB 3.49Å; E663-S666 PolarHBondContact O-N 2.75Å; E663-L667 HydrophobicContact CG-CD1 4.27Å; E663-L667 WeakPolarHBondContact O-CG 3.47Å; E663-L667 PolarHBondContact O-N 2.95Å; E663-L939 HydrophobicContact CB-CD1 4.11Å; E663-L939 HydrophobicContact CG-CD1 4.16Å; E663-L939 WeakPolarHBondContact OE2-CD1 3.27Å
664	L	78	Confident	71.3	Confident	49 Å²	49	77.9 Å²	77.9	26%	0.257	40%	0.404	S	S	.	.	H	α-helix	trans	-56.7	-41.8	172.6	-75.6	169.3	0	0	0	112.1	R660 L667 S668 V884 L939	R660-L664 WeakPolarHBondContact O-CB 3.2Å; R660-L664 WeakPolarHBondContact O-CG 3.05Å; R660-L664 PolarHBondContact O-N 3Å; L664-L667 PolarHBondContact O-N 3.49Å; L664-S668 PolarHBondContact O-N 2.71Å; L664-S668 VanDerWaalsContact O-N 3.1Å; L664-V884 HydrophobicContact CD2-CG2 4.43Å; L664-L939 HydrophobicContact CD1-CD2 4.15Å; L664-L939 HydrophobicContact CD2-CB 3.98Å; L664-L939 HydrophobicContact CD2-CD2 4.09Å; L664-L939 HydrophobicContact CG-CB 4.42Å; L664-L939 HydrophobicContact CG-CD1 4.49Å; L664-L939 HydrophobicContact CG-CD2 4.07Å
665	K	73.7	Confident	71.9	Confident	119 Å²	119	76.1 Å²	76.1	52%	0.517	40%	0.402	S	S	.	.	H	α-helix	trans	-66.1	-36.7	175.2	-172.4	175.1	180	179.5	0	112	A661 L662 E663 M669	A661-K665 WeakPolarHBondContact O-CB 3.22Å; A661-K665 PolarHBondContact O-N 3.41Å; A661-K665 VanDerWaalsContact O-N 3.12Å; L662-K665 PolarHBondContact O-N 3.06Å; E663-K665 VanDerWaalsContact C-N 3.29Å; E663-K665 PolarHBondContact O-N 3.21Å; K665-M669 VanDerWaalsContact O-CG 3.28Å; K665-M669 WeakPolarHBondContact O-CG 3.28Å; K665-M669 PolarHBondContact O-N 2.95Å
666	S	75	Confident	72.6	Confident	83 Å²	83	72.7 Å²	72.7	58%	0.58	39%	0.385	S	S	*	.	H	α-helix	trans	-67.4	-45	175.8	-177.2	0	0	0	0	112	L662 E663 S668 M669	L662-S666 WeakPolarHBondContact O-CB 3.13Å; L662-S666 PolarHBondContact O-N 2.81Å; E663-S666 WeakPolarHBondContact O-CB 3.49Å; E663-S666 PolarHBondContact O-N 2.75Å; S666-S668 VanDerWaalsContact C-N 3.33Å; S666-S668 PolarHBondContact O-N 2.75Å; S666-M669 PolarHBondContact O-N 2.68Å
667	L	73.3	Confident	73.1	Confident	53 Å²	53	71.3 Å²	71.3	28%	0.277	38%	0.381	S	S	.	.	H	α-helix	trans	-60.4	-40.3	177.3	-71.6	168.6	0	0	0	112.3	E663 L664 T670 L939	E663-L667 HydrophobicContact CG-CD1 4.27Å; E663-L667 WeakPolarHBondContact O-CG 3.47Å; E663-L667 PolarHBondContact O-N 2.95Å; L664-L667 PolarHBondContact O-N 3.49Å; L667-T670 WeakPolarHBondContact O-CB 3.49Å; L667-T670 WeakPolarHBondContact O-CG2 3.46Å; L667-T670 PolarHBondContact O-N 3.04Å; L667-T670 PolarHBondContact O-OG1 3.27Å; L667-L939 HydrophobicContact CD1-CB 4.17Å
668	S	69	Low	73.7	Confident	63 Å²	63	74.2 Å²	74.2	44%	0.441	40%	0.398	S	S	.	.	H	α-helix	trans	-72.3	-27.2	179.3	-168.8	0	0	0	0	113.6	L664 S666 T670 E673	L664-S668 PolarHBondContact O-N 2.71Å; L664-S668 VanDerWaalsContact O-N 3.1Å; S666-S668 VanDerWaalsContact C-N 3.33Å; S666-S668 PolarHBondContact O-N 2.75Å; S668-T670 PolarHBondContact O-N 2.62Å; S668-E673 VanDerWaalsContact CA-OE2 3.22Å; S668-E673 WeakPolarHBondContact CA-OE2 3.43Å; S668-E673 VanDerWaalsContact CB-OE2 3.31Å; S668-E673 WeakPolarHBondContact CB-OE2 3.45Å; S668-E673 PolarHBondContact OG-OE2 3.23Å
669	M	64.8	Low	74.4	Confident	149 Å²	149	74 Å²	74	73%	0.734	40%	0.397	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.7	10.2	173.8	-69.4	-62.7	-53	0	0	114.1	K665 S666	K665-M669 VanDerWaalsContact O-CG 3.28Å; K665-M669 WeakPolarHBondContact O-CG 3.28Å; K665-M669 PolarHBondContact O-N 2.95Å; S666-M669 PolarHBondContact O-N 2.68Å
670	T	70.4	Confident	75.1	Confident	45 Å²	45	69.1 Å²	69.1	28%	0.276	37%	0.372	S	S	.	.	S	Bend	trans	-84.6	145.5	179.3	62.9	0	0	0	0	112.9	L667 S668 Q672 E673 R942	L667-T670 WeakPolarHBondContact O-CB 3.49Å; L667-T670 WeakPolarHBondContact O-CG2 3.46Å; L667-T670 PolarHBondContact O-N 3.04Å; L667-T670 PolarHBondContact O-OG1 3.27Å; S668-T670 PolarHBondContact O-N 2.62Å; T670-Q672 PolarHBondContact O-N 2.96Å; T670-E673 PolarHBondContact O-N 3.3Å; T670-R942 PolarHBondContact OG1-NH2 3.46Å
671	D	59.2	Low	75.7	Confident	117 Å²	117	71.2 Å²	71.2	63%	0.626	39%	0.385	S	S	*	.	H	α-helix	trans	-53.1	-24.2	-177.2	-55	-50.5	0	0	0	114.4	S675	D671-S675 WeakPolarHBondContact O-CB 3.44Å; D671-S675 PolarHBondContact O-N 2.65Å
672	Q	62.4	Low	76.2	Confident	96 Å²	96	75.2 Å²	75.2	45%	0.449	40%	0.404	S	S	.	.	H	α-helix	trans	-70	-36.5	178.2	-160.2	75.4	17.5	0	0	112.6	T670 S675 V676	T670-Q672 PolarHBondContact O-N 2.96Å; Q672-S675 WeakPolarHBondContact O-CB 3.27Å; Q672-S675 PolarHBondContact O-N 2.89Å; Q672-V676 WeakPolarHBondContact O-CG2 3.44Å; Q672-V676 PolarHBondContact O-N 3.15Å
673	E	68.3	Low	76.9	Confident	61 Å²	61	72.1 Å²	72.1	29%	0.285	39%	0.387	S	S	.	.	H	α-helix	trans	-70.3	-40.1	175.4	-66.3	-134.5	133	0	0	110.2	S668 T670 S675 V676 G677 K890	S668-E673 VanDerWaalsContact CA-OE2 3.22Å; S668-E673 WeakPolarHBondContact CA-OE2 3.43Å; S668-E673 VanDerWaalsContact CB-OE2 3.31Å; S668-E673 WeakPolarHBondContact CB-OE2 3.45Å; S668-E673 PolarHBondContact OG-OE2 3.23Å; T670-E673 PolarHBondContact O-N 3.3Å; E673-S675 VanDerWaalsContact C-N 3.28Å; E673-S675 PolarHBondContact O-N 3.16Å; E673-V676 WeakPolarHBondContact O-CA 3.45Å; E673-V676 WeakPolarHBondContact O-CB 3.48Å; E673-V676 PolarHBondContact O-N 2.88Å; E673-G677 PolarHBondContact O-N 2.83Å; E673-K890 IonicContact OE1-NZ 2.98Å; E673-K890 PolarHBondContact OE1-NZ 3.46Å
674	V	68.9	Low	77.3	Confident	93 Å²	93	68.8 Å²	68.8	56%	0.564	37%	0.372	S	S	*	.	H	α-helix	trans	-56.9	-43.4	170	-173.9	0	0	0	0	110.8	V676 G677 V678	V674-V676 VanDerWaalsContact C-N 3.28Å; V674-V676 PolarHBondContact O-N 3.01Å; V674-G677 PolarHBondContact O-N 2.84Å; V674-V678 WeakPolarHBondContact O-CG2 3.46Å; V674-V678 PolarHBondContact O-N 2.93Å
675	S	81.9	Confident	77.6	Confident	45 Å²	45	69.1 Å²	69.1	32%	0.315	38%	0.382	S	S	.	.	H	α-helix	trans	-65.8	-24.1	174.9	-169.4	0	0	0	0	114	D671 Q672 E673 K679	D671-S675 WeakPolarHBondContact O-CB 3.44Å; D671-S675 PolarHBondContact O-N 2.65Å; Q672-S675 WeakPolarHBondContact O-CB 3.27Å; Q672-S675 PolarHBondContact O-N 2.89Å; E673-S675 VanDerWaalsContact C-N 3.28Å; E673-S675 PolarHBondContact O-N 3.16Å; S675-K679 VanDerWaalsContact O-CD 3.24Å; S675-K679 WeakPolarHBondContact O-CD 3.33Å; S675-K679 WeakPolarHBondContact O-CG 3.41Å; S675-K679 PolarHBondContact O-N 3.01Å; S675-K679 PolarHBondContact O-NZ 3.01Å; S675-K679 PolarHBondContact OG-NZ 3.49Å
676	V	82.6	Confident	77.8	Confident	26 Å²	26	68.5 Å²	68.5	16%	0.158	39%	0.393	C	S	.	.	H	α-helix	trans	-78.6	-43.6	172.2	170.2	0	0	0	0	110.3	Q672 E673 V674 V678 K679 W680 C704	Q672-V676 WeakPolarHBondContact O-CG2 3.44Å; Q672-V676 PolarHBondContact O-N 3.15Å; E673-V676 WeakPolarHBondContact O-CA 3.45Å; E673-V676 WeakPolarHBondContact O-CB 3.48Å; E673-V676 PolarHBondContact O-N 2.88Å; V674-V676 VanDerWaalsContact C-N 3.28Å; V674-V676 PolarHBondContact O-N 3.01Å; V676-V678 PolarHBondContact O-N 3.02Å; V676-K679 PolarHBondContact O-N 3.26Å; V676-W680 PolarHBondContact O-N 3.12Å; V676-W680 VanDerWaalsContact O-N 3.09Å; V676-C704 HydrophobicContact CG1-CB 4.19Å; V676-C704 HydrophobicContact CG2-CB 4.03Å
677	G	83.4	Confident	77.6	Confident	21 Å²	21	66 Å²	66	22%	0.216	37%	0.374	C	S	.	.	H	α-helix	trans	-53.7	-55	173.7	0	0	0	0	0	112.1	E673 V674 K679 W680 E681	E673-G677 PolarHBondContact O-N 2.83Å; V674-G677 PolarHBondContact O-N 2.84Å; G677-K679 PolarHBondContact O-N 2.96Å; G677-W680 WeakPolarHBondContact O-CA 3.26Å; G677-W680 WeakPolarHBondContact O-CB 3.38Å; G677-W680 PolarHBondContact O-N 3.28Å; G677-E681 WeakPolarHBondContact O-CG 3.49Å; G677-E681 PolarHBondContact O-N 3.16Å
678	V	85	Confident	76.6	Confident	65 Å²	65	70.4 Å²	70.4	39%	0.394	40%	0.395	S	S	.	.	H	α-helix	trans	-58.8	-32.9	178.7	172.9	0	0	0	0	112.7	V674 V676 N682	V674-V678 WeakPolarHBondContact O-CG2 3.46Å; V674-V678 PolarHBondContact O-N 2.93Å; V676-V678 PolarHBondContact O-N 3.02Å; V678-N682 WeakPolarHBondContact CG1-ND2 3.49Å; V678-N682 WeakPolarHBondContact O-CB 3.22Å; V678-N682 PolarHBondContact O-N 2.83Å; V678-N682 PolarHBondContact O-ND2 2.96Å
679	K	88.1	Confident	75.9	Confident	90 Å²	90	75.3 Å²	75.3	39%	0.391	42%	0.416	S	S	.	.	H	α-helix	trans	-68.3	-40.6	174.7	-75.6	167.4	-173.2	121.4	0	112.1	S675 V676 G677 F683 L701	S675-K679 VanDerWaalsContact O-CD 3.24Å; S675-K679 WeakPolarHBondContact O-CD 3.33Å; S675-K679 WeakPolarHBondContact O-CG 3.41Å; S675-K679 PolarHBondContact O-N 3.01Å; S675-K679 PolarHBondContact O-NZ 3.01Å; S675-K679 PolarHBondContact OG-NZ 3.49Å; V676-K679 PolarHBondContact O-N 3.26Å; G677-K679 PolarHBondContact O-N 2.96Å; K679-F683 WeakPolarHBondContact O-CB 3.47Å; K679-F683 PolarHBondContact O-N 3.19Å; K679-L701 HydrophobicContact CB-CD2 3.82Å
680	W	90.8	Very high	75.9	Confident	0 Å²	0	78.4 Å²	78.4	0%	0	42%	0.42	C	S	.	.	H	α-helix	trans	-67	-43	175.2	-85.3	99.7	0	0	0	112.4	V676 G677 N682 F683 L684 L698 L701 I702 G705 V706 P707 V714	V676-W680 PolarHBondContact O-N 3.12Å; V676-W680 VanDerWaalsContact O-N 3.09Å; G677-W680 WeakPolarHBondContact O-CA 3.26Å; G677-W680 WeakPolarHBondContact O-CB 3.38Å; G677-W680 PolarHBondContact O-N 3.28Å; W680-N682 PolarHBondContact O-N 2.98Å; W680-F683 PolarHBondContact O-N 3.31Å; W680-L684 HydrophobicContact CE3-CG 4.5Å; W680-L684 WeakPolarHBondContact O-CB 3.37Å; W680-L684 VanDerWaalsContact O-CG 3.32Å; W680-L684 WeakPolarHBondContact O-CG 3.26Å; W680-L684 PolarHBondContact O-N 3.31Å; W680-L698 HydrophobicContact CH2-CD1 3.77Å; W680-L698 HydrophobicContact CZ3-CD1 3.96Å; W680-L701 HydrophobicContact CD2-CB 4.32Å; W680-L701 HydrophobicContact CH2-CB 4.22Å; W680-L701 HydrophobicContact CZ2-CB 3.66Å; W680-I702 HydrophobicContact CH2-CG1 3.68Å; W680-I702 HydrophobicContact CZ2-CG1 3.82Å; W680-G705 PolarHBondContact NE1-O 2.97Å; W680-V706 HydrophobicContact CH2-CG1 4.29Å; W680-V706 HydrophobicContact CH2-CG2 3.95Å; W680-V706 HydrophobicContact CZ2-CB 4.16Å; W680-V706 HydrophobicContact CZ2-CG1 4.21Å; W680-V706 HydrophobicContact CZ2-CG2 3.63Å; W680-P707 HydrophobicContact CB-CG 3.93Å; W680-P707 VanDerWaalsContact CG-CD 3.48Å; W680-P707 HydrophobicContact CG-CG 3.84Å; W680-V714 HydrophobicContact CH2-CG1 4.38Å; W680-V714 HydrophobicContact CH2-CG2 3.93Å; W680-V714 HydrophobicContact CZ3-CG2 3.7Å
681	E	87.7	Confident	76	Confident	117 Å²	117	83 Å²	83	55%	0.547	44%	0.443	S	S	.	.	H	α-helix	trans	-57.1	-48.9	174.1	-70.2	174.8	162.2	0	0	111.4	G677 F683 L684 A685	G677-E681 WeakPolarHBondContact O-CG 3.49Å; G677-E681 PolarHBondContact O-N 3.16Å; E681-F683 PolarHBondContact O-N 2.93Å; E681-L684 PolarHBondContact O-N 3.1Å; E681-A685 WeakPolarHBondContact O-CB 3.23Å; E681-A685 PolarHBondContact O-N 2.96Å
682	N	87.5	Confident	77.2	Confident	98 Å²	98	78.3 Å²	78.3	52%	0.524	42%	0.418	S	S	.	.	H	α-helix	trans	-62.7	-40.2	177.7	-79.8	-67.8	0	0	0	112.7	V678 W680 S686	V678-N682 WeakPolarHBondContact CG1-ND2 3.49Å; V678-N682 WeakPolarHBondContact O-CB 3.22Å; V678-N682 PolarHBondContact O-N 2.83Å; V678-N682 PolarHBondContact O-ND2 2.96Å; W680-N682 PolarHBondContact O-N 2.98Å; N682-S686 WeakPolarHBondContact O-CB 3.44Å; N682-S686 PolarHBondContact O-N 2.89Å; N682-S686 PolarHBondContact O-OG 3.42Å
683	F	87.9	Confident	78.3	Confident	21 Å²	21	78.7 Å²	78.7	9%	0.092	43%	0.426	C	S	.	.	H	α-helix	trans	-66.5	-44.5	177.6	-178.8	-97	0	0	0	112.1	K679 W680 E681 S686 T687 L692 E697 L698 L701	K679-F683 WeakPolarHBondContact O-CB 3.47Å; K679-F683 PolarHBondContact O-N 3.19Å; W680-F683 PolarHBondContact O-N 3.31Å; E681-F683 PolarHBondContact O-N 2.93Å; F683-S686 PolarHBondContact O-N 2.98Å; F683-T687 WeakPolarHBondContact O-CB 3.46Å; F683-T687 PolarHBondContact O-N 2.83Å; F683-T687 PolarHBondContact O-OG1 3.04Å; F683-L692 HydrophobicContact CE1-CD2 3.76Å; F683-E697 HydrophobicContact CD2-CG 3.96Å; F683-E697 HydrophobicContact CE2-CB 4.43Å; F683-E697 HydrophobicContact CE2-CG 3.91Å; F683-L698 HydrophobicContact CE1-CB 4.37Å; F683-L698 HydrophobicContact CE1-CD1 3.9Å; F683-L698 HydrophobicContact CZ-CB 3.9Å; F683-L698 HydrophobicContact CZ-CD1 4.3Å; F683-L701 HydrophobicContact CB-CD1 3.6Å; F683-L701 HydrophobicContact CD1-CD1 3.83Å; F683-L701 HydrophobicContact CD2-CD1 3.66Å; F683-L701 HydrophobicContact CE1-CD1 4.45Å; F683-L701 HydrophobicContact CE2-CD1 4.3Å; F683-L701 HydrophobicContact CG-CD1 3.39Å
684	L	85.8	Confident	79.3	Confident	33 Å²	33	80.3 Å²	80.3	17%	0.173	43%	0.433	C	S	.	.	H	α-helix	trans	-69.1	-40.8	177.4	-67.9	173.7	0	0	0	111.7	W680 E681 S686 T687 M688 L692 H710	W680-L684 HydrophobicContact CE3-CG 4.5Å; W680-L684 WeakPolarHBondContact O-CB 3.37Å; W680-L684 VanDerWaalsContact O-CG 3.32Å; W680-L684 WeakPolarHBondContact O-CG 3.26Å; W680-L684 PolarHBondContact O-N 3.31Å; E681-L684 PolarHBondContact O-N 3.1Å; L684-S686 VanDerWaalsContact C-N 3.32Å; L684-S686 PolarHBondContact O-N 3.3Å; L684-T687 CarbonylContact O-C 3.59Å; L684-T687 WeakPolarHBondContact O-CA 3.46Å; L684-T687 PolarHBondContact O-N 2.85Å; L684-M688 PolarHBondContact O-N 3.12Å; L684-M688 VanDerWaalsContact O-N 3.11Å; L684-L692 HydrophobicContact CD2-CD2 4.26Å; L684-H710 HydrophobicContact CD1-CB 4.36Å
685	A	83.7	Confident	80.4	Confident	57 Å²	57	77.1 Å²	77.1	47%	0.471	42%	0.416	S	S	.	.	H	α-helix	trans	-58.6	-42.6	173.1	0	0	0	0	0	111.9	E681 T687 M688	E681-A685 WeakPolarHBondContact O-CB 3.23Å; E681-A685 PolarHBondContact O-N 2.96Å; A685-T687 PolarHBondContact O-N 3.1Å; A685-M688 WeakPolarHBondContact O-CB 3.23Å; A685-M688 VanDerWaalsContact O-CG 3.27Å; A685-M688 WeakPolarHBondContact O-CG 3.49Å; A685-M688 PolarHBondContact O-N 2.93Å
686	S	77.4	Confident	80.9	Confident	106 Å²	106	80.5 Å²	80.5	74%	0.741	44%	0.436	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.8	-15	173.8	-56.7	0	0	0	0	113.6	N682 F683 L684	N682-S686 WeakPolarHBondContact O-CB 3.44Å; N682-S686 PolarHBondContact O-N 2.89Å; N682-S686 PolarHBondContact O-OG 3.42Å; F683-S686 PolarHBondContact O-N 2.98Å; L684-S686 VanDerWaalsContact C-N 3.32Å; L684-S686 PolarHBondContact O-N 3.3Å
687	T	71.4	Confident	81.3	Confident	29 Å²	29	84.9 Å²	84.9	18%	0.178	46%	0.455	C	S	.	.	T	Hydrogen-bonded Turn	trans	-108.1	0.5	-176.1	-52.8	0	0	0	0	112.8	F683 L684 A685 N689 R690 L692	F683-T687 WeakPolarHBondContact O-CB 3.46Å; F683-T687 PolarHBondContact O-N 2.83Å; F683-T687 PolarHBondContact O-OG1 3.04Å; L684-T687 CarbonylContact O-C 3.59Å; L684-T687 WeakPolarHBondContact O-CA 3.46Å; L684-T687 PolarHBondContact O-N 2.85Å; A685-T687 PolarHBondContact O-N 3.1Å; T687-N689 PolarHBondContact O-N 2.99Å; T687-R690 HydrophobicContact CG2-CB 4.41Å; T687-R690 WeakPolarHBondContact CG2-O 3.46Å; T687-R690 PolarHBondContact O-N 3.39Å; T687-L692 HydrophobicContact CG2-CD2 4.37Å
688	M	53.6	Low	81.8	Confident	147 Å²	147	83.9 Å²	83.9	72%	0.724	45%	0.445	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.4	-7.2	-170.8	-84	-83.3	178.8	0	0	118.8	L684 A685	L684-M688 PolarHBondContact O-N 3.12Å; L684-M688 VanDerWaalsContact O-N 3.11Å; A685-M688 WeakPolarHBondContact O-CB 3.23Å; A685-M688 VanDerWaalsContact O-CG 3.27Å; A685-M688 WeakPolarHBondContact O-CG 3.49Å; A685-M688 PolarHBondContact O-N 2.93Å
689	N	53.5	Low	82.3	Confident	165 Å²	165	83.4 Å²	83.4	88%	0.882	44%	0.437	S	S	*	.	T	Hydrogen-bonded Turn	trans	-136.3	25.7	174.6	-75.2	-78.2	0	0	0	112.9	T687	T687-N689 PolarHBondContact O-N 2.99Å
690	R	64.3	Low	82.5	Confident	215 Å²	215	81.7 Å²	81.7	81%	0.811	44%	0.44	S	S	*	.	S	Bend	trans	-141.1	149.5	-179.7	-64.9	-175.8	178	-178.9	-0.4	110.8	T687	T687-R690 HydrophobicContact CG2-CB 4.41Å; T687-R690 WeakPolarHBondContact CG2-O 3.46Å; T687-R690 PolarHBondContact O-N 3.39Å
691	D	73	Confident	82.7	Confident	141 Å²	141	82.5 Å²	82.5	75%	0.754	44%	0.444	S	S	*	.			trans	-58.5	147.5	164.9	-71.7	-40.8	0	0	0	110.2
692	L	84.5	Confident	83	Confident	19 Å²	19	77 Å²	77	10%	0.099	42%	0.419	C	S	.	.			trans	-56.8	140.2	166.2	-74.3	167.5	0	0	0	109.6	F683 L684 T687 I713 W717	F683-L692 HydrophobicContact CE1-CD2 3.76Å; L684-L692 HydrophobicContact CD2-CD2 4.26Å; T687-L692 HydrophobicContact CG2-CD2 4.37Å; L692-I713 HydrophobicContact CD1-CG2 4.42Å; L692-W717 HydrophobicContact CB-CD2 3.73Å; L692-W717 HydrophobicContact CB-CE3 4.43Å; L692-W717 HydrophobicContact CB-CG 3.79Å; L692-W717 HydrophobicContact CB-CZ2 4.19Å; L692-W717 HydrophobicContact CD1-CB 3.98Å; L692-W717 HydrophobicContact CD1-CD2 4.24Å; L692-W717 HydrophobicContact CD1-CG 3.94Å; L692-W717 HydrophobicContact CG-CG 4.5Å; L692-W717 VanDerWaalsContact O-CZ2 3.31Å; L692-W717 WeakPolarHBondContact O-CZ2 3.42Å; L692-W717 PolarHBondContact O-NE1 2.99Å
693	V	86.1	Confident	83.3	Confident	104 Å²	104	75.7 Å²	75.7	63%	0.63	41%	0.406	S	S	*	.			trans	-123	138.5	179.7	-177.6	0	0	0	0	109.1	S695 L698	V693-S695 PolarHBondContact O-N 2.94Å; V693-L698 WeakPolarHBondContact O-CD2 3.44Å
694	H	89.4	Confident	83.4	Confident	94 Å²	94	77.9 Å²	77.9	44%	0.435	42%	0.424	S	S	.	.			trans	-64.2	94.9	174.2	175.2	-71.7	0	0	0	110.3	W717 F897	H694-W717 HydrophobicContact CB-CH2 4.05Å; H694-F897 AromaticContact CD2-CE1 3.91Å; H694-F897 AromaticContact CD2-CE2 3.84Å; H694-F897 AromaticContact CD2-CZ 3.35Å; H694-F897 WeakPolarHBondContact CD2-CZ 3.36Å; H694-F897 AromaticContact NE2-CE1 3.83Å; H694-F897 AromaticContact NE2-CZ 3.7Å
695	S	91.8	Very high	83.7	Confident	27 Å²	27	76.4 Å²	76.4	19%	0.189	42%	0.416	C	S	.	.			trans	-115.1	160.5	178.9	75	0	0	0	0	112.2	V693 E697 L698 K699	V693-S695 PolarHBondContact O-N 2.94Å; S695-E697 PolarHBondContact O-N 3.08Å; S695-E697 PolarHBondContact OG-N 3.23Å; S695-L698 WeakPolarHBondContact OG-CB 3.49Å; S695-L698 PolarHBondContact OG-N 2.96Å; S695-K699 WeakPolarHBondContact O-CB 3.45Å; S695-K699 PolarHBondContact O-N 3.48Å; S695-K699 VanDerWaalsContact O-N 3.12Å
696	P	92.1	Very high	84.1	Confident	116 Å²	116	74 Å²	74	75%	0.753	40%	0.395	S	S	*	.	H	α-helix	trans	-60.7	-27.6	170.9	-22.7	34.5	0	0	0	113.3	K699 A700	P696-K699 WeakPolarHBondContact O-CB 3.35Å; P696-A700 PolarHBondContact O-N 3.33Å; P696-A700 VanDerWaalsContact O-N 3.07Å
697	E	91.4	Very high	84.7	Confident	118 Å²	118	69.9 Å²	69.9	55%	0.551	37%	0.367	S	S	*	.	H	α-helix	trans	-73.2	-52.4	178	-179.7	178.6	-157.1	0	0	111.8	F683 S695 K699 A700 L701	F683-E697 HydrophobicContact CD2-CG 3.96Å; F683-E697 HydrophobicContact CE2-CB 4.43Å; F683-E697 HydrophobicContact CE2-CG 3.91Å; S695-E697 PolarHBondContact O-N 3.08Å; S695-E697 PolarHBondContact OG-N 3.23Å; E697-K699 PolarHBondContact O-N 3.18Å; E697-A700 WeakPolarHBondContact O-CA 3.34Å; E697-A700 WeakPolarHBondContact O-CB 3.47Å; E697-A700 PolarHBondContact O-N 3.37Å; E697-L701 HydrophobicContact CG-CD1 4.39Å; E697-L701 WeakPolarHBondContact O-CG 3.41Å; E697-L701 PolarHBondContact O-N 3.17Å
698	L	93.1	Very high	85.5	Confident	0 Å²	0	70 Å²	70	0%	0	37%	0.365	C	S	.	.	H	α-helix	trans	-55.3	-39.5	173.9	177.6	57.4	0	0	0	110.8	W680 F683 V693 S695 A700 L701 I702 W717 F897	W680-L698 HydrophobicContact CH2-CD1 3.77Å; W680-L698 HydrophobicContact CZ3-CD1 3.96Å; F683-L698 HydrophobicContact CE1-CB 4.37Å; F683-L698 HydrophobicContact CE1-CD1 3.9Å; F683-L698 HydrophobicContact CZ-CB 3.9Å; F683-L698 HydrophobicContact CZ-CD1 4.3Å; V693-L698 WeakPolarHBondContact O-CD2 3.44Å; S695-L698 WeakPolarHBondContact OG-CB 3.49Å; S695-L698 PolarHBondContact OG-N 2.96Å; L698-A700 PolarHBondContact O-N 3.12Å; L698-L701 PolarHBondContact O-N 3.02Å; L698-I702 HydrophobicContact CD1-CD1 3.81Å; L698-I702 HydrophobicContact CD1-CG1 4.14Å; L698-I702 HydrophobicContact CG-CD1 3.88Å; L698-I702 WeakPolarHBondContact O-CB 3.42Å; L698-I702 VanDerWaalsContact O-CG1 3.3Å; L698-I702 WeakPolarHBondContact O-CG1 3.41Å; L698-I702 PolarHBondContact O-N 3.31Å; L698-W717 HydrophobicContact CD2-CE3 4.48Å; L698-W717 HydrophobicContact CD2-CH2 3.89Å; L698-W717 HydrophobicContact CD2-CZ3 3.82Å; L698-F897 HydrophobicContact CD2-CE2 3.88Å; L698-F897 HydrophobicContact CG-CE2 3.96Å; L698-F897 HydrophobicContact CG-CZ 4.42Å
699	K	94.8	Very high	87.1	Confident	54 Å²	54	69 Å²	69	24%	0.235	36%	0.359	C	S	.	.	H	α-helix	trans	-61.9	-38	173.3	-177	170.3	-171.4	139.7	0	113.6	S695 P696 E697 R703 F897 E898	S695-K699 WeakPolarHBondContact O-CB 3.45Å; S695-K699 PolarHBondContact O-N 3.48Å; S695-K699 VanDerWaalsContact O-N 3.12Å; P696-K699 WeakPolarHBondContact O-CB 3.35Å; E697-K699 PolarHBondContact O-N 3.18Å; K699-R703 VanDerWaalsContact O-CG 3.24Å; K699-R703 WeakPolarHBondContact O-CG 3.37Å; K699-R703 PolarHBondContact O-N 3.42Å; K699-F897 HydrophobicContact CB-CE1 3.56Å; K699-F897 HydrophobicContact CB-CZ 3.94Å; K699-F897 HydrophobicContact CD-CE1 4.13Å; K699-F897 HydrophobicContact CG-CD1 4.43Å; K699-F897 HydrophobicContact CG-CE1 3.72Å; K699-E898 VanDerWaalsContact CE-OE2 3.23Å; K699-E898 WeakPolarHBondContact CE-OE2 3.43Å; K699-E898 VanDerWaalsContact NZ-CD 3.32Å; K699-E898 IonicContact NZ-OE1 2.68Å; K699-E898 IonicContact NZ-OE2 3.63Å; K699-E898 PolarHBondContact NZ-OE2 3.26Å
700	A	93.4	Very high	88.9	Confident	54 Å²	54	63 Å²	63	45%	0.446	33%	0.325	S	S	.	.	H	α-helix	trans	-71.6	-41.5	176.3	0	0	0	0	0	111.3	P696 E697 L698 R703 C704	P696-A700 PolarHBondContact O-N 3.33Å; P696-A700 VanDerWaalsContact O-N 3.07Å; E697-A700 WeakPolarHBondContact O-CA 3.34Å; E697-A700 WeakPolarHBondContact O-CB 3.47Å; E697-A700 PolarHBondContact O-N 3.37Å; L698-A700 PolarHBondContact O-N 3.12Å; A700-R703 PolarHBondContact O-N 3.39Å; A700-C704 PolarHBondContact O-N 2.9Å; A700-C704 PolarHBondContact O-SG 3Å; A700-C704 VanDerWaalsContact O-SG 3.38Å
701	L	93.4	Very high	90.3	Very high	18 Å²	18	52.9 Å²	52.9	9%	0.094	29%	0.287	C	S	.	.	H	α-helix	trans	-61.8	-47	175.9	-66.7	172.7	0	0	0	112.1	K679 W680 F683 E697 L698 R703 C704 G705	K679-L701 HydrophobicContact CB-CD2 3.82Å; W680-L701 HydrophobicContact CD2-CB 4.32Å; W680-L701 HydrophobicContact CH2-CB 4.22Å; W680-L701 HydrophobicContact CZ2-CB 3.66Å; F683-L701 HydrophobicContact CB-CD1 3.6Å; F683-L701 HydrophobicContact CD1-CD1 3.83Å; F683-L701 HydrophobicContact CD2-CD1 3.66Å; F683-L701 HydrophobicContact CE1-CD1 4.45Å; F683-L701 HydrophobicContact CE2-CD1 4.3Å; F683-L701 HydrophobicContact CG-CD1 3.39Å; E697-L701 HydrophobicContact CG-CD1 4.39Å; E697-L701 WeakPolarHBondContact O-CG 3.41Å; E697-L701 PolarHBondContact O-N 3.17Å; L698-L701 PolarHBondContact O-N 3.02Å; L701-R703 VanDerWaalsContact C-N 3.26Å; L701-R703 PolarHBondContact O-N 3.37Å; L701-C704 WeakPolarHBondContact O-CA 3.42Å; L701-C704 WeakPolarHBondContact O-CB 3.28Å; L701-C704 PolarHBondContact O-N 3.01Å; L701-G705 PolarHBondContact O-N 2.72Å
702	I	95.3	Very high	91.2	Very high	1 Å²	1	47.5 Å²	47.5	1%	0.005	26%	0.261	C	S	.	.	H	α-helix	trans	-60.9	-35.3	176.4	-71.5	171.1	0	0	0	111.8	W680 L698 C704 G705 V706 V714 D893 F897	W680-I702 HydrophobicContact CH2-CG1 3.68Å; W680-I702 HydrophobicContact CZ2-CG1 3.82Å; L698-I702 HydrophobicContact CD1-CD1 3.81Å; L698-I702 HydrophobicContact CD1-CG1 4.14Å; L698-I702 HydrophobicContact CG-CD1 3.88Å; L698-I702 WeakPolarHBondContact O-CB 3.42Å; L698-I702 VanDerWaalsContact O-CG1 3.3Å; L698-I702 WeakPolarHBondContact O-CG1 3.41Å; L698-I702 PolarHBondContact O-N 3.31Å; I702-C704 PolarHBondContact O-N 3.48Å; I702-G705 PolarHBondContact O-N 3.13Å; I702-V706 HydrophobicContact CG1-CG2 4.14Å; I702-V714 HydrophobicContact CD1-CG1 4.08Å; I702-V714 HydrophobicContact CG1-CG1 4.4Å; I702-D893 HydrophobicContact CG2-CB 4.32Å; I702-D893 VanDerWaalsContact CG2-O 3.23Å; I702-D893 WeakPolarHBondContact CG2-O 3.41Å; I702-F897 HydrophobicContact CD1-CB 3.93Å; I702-F897 HydrophobicContact CD1-CD1 4.31Å; I702-F897 HydrophobicContact CD1-CD2 3.31Å; I702-F897 HydrophobicContact CD1-CE2 3.84Å; I702-F897 HydrophobicContact CD1-CG 3.58Å; I702-F897 HydrophobicContact CG2-CB 4.15Å; I702-F897 HydrophobicContact CG2-CG 4.5Å
703	R	94.1	Very high	91.5	Very high	70 Å²	70	50.8 Å²	50.8	26%	0.264	28%	0.277	S	S	.	.	H	α-helix	trans	-72.3	-12	173.8	-73.5	175.9	171.2	-165.7	0.3	114.5	K699 A700 L701 E898 M945 F949	K699-R703 VanDerWaalsContact O-CG 3.24Å; K699-R703 WeakPolarHBondContact O-CG 3.37Å; K699-R703 PolarHBondContact O-N 3.42Å; A700-R703 PolarHBondContact O-N 3.39Å; L701-R703 VanDerWaalsContact C-N 3.26Å; L701-R703 PolarHBondContact O-N 3.37Å; R703-E898 IonicContact CZ-OE1 2.76Å; R703-E898 VanDerWaalsContact CZ-OE1 3.27Å; R703-E898 IonicContact NE-OE1 3.33Å; R703-E898 PolarHBondContact NE-OE1 3.46Å; R703-E898 IonicContact NH2-OE1 2.78Å; R703-E898 PolarHBondContact NH2-OE1 3.09Å; R703-E898 IonicContact NH2-OE2 3.98Å; R703-M945 WeakPolarHBondContact O-CE 3.44Å; R703-F949 HydrophobicContact CB-CD2 4Å; R703-F949 HydrophobicContact CB-CE2 4.07Å; R703-F949 HydrophobicContact CB-CG 4.31Å; R703-F949 HydrophobicContact CB-CZ 4.44Å; R703-F949 HydrophobicContact CG-CD1 3.85Å; R703-F949 HydrophobicContact CG-CD2 4.03Å; R703-F949 HydrophobicContact CG-CE1 3.76Å; R703-F949 HydrophobicContact CG-CE2 3.94Å; R703-F949 HydrophobicContact CG-CG 4.01Å; R703-F949 HydrophobicContact CG-CZ 3.82Å
704	C	89.8	Confident	91.9	Very high	68 Å²	68	46 Å²	46	46%	0.459	25%	0.248	S	C	.	.	T	Hydrogen-bonded Turn	trans	-88.4	-7.1	166.9	-62.9	0	0	0	0	112.5	V676 A700 L701 I702	V676-C704 HydrophobicContact CG1-CB 4.19Å; V676-C704 HydrophobicContact CG2-CB 4.03Å; A700-C704 PolarHBondContact O-N 2.9Å; A700-C704 PolarHBondContact O-SG 3Å; A700-C704 VanDerWaalsContact O-SG 3.38Å; L701-C704 WeakPolarHBondContact O-CA 3.42Å; L701-C704 WeakPolarHBondContact O-CB 3.28Å; L701-C704 PolarHBondContact O-N 3.01Å; I702-C704 PolarHBondContact O-N 3.48Å
705	G	91.1	Very high	92.2	Very high	2 Å²	2	41.5 Å²	41.5	2%	0.021	23%	0.227	C	C	.	.			trans	93.7	146.6	-169	0	0	0	0	0	112.3	W680 L701 I702	W680-G705 PolarHBondContact NE1-O 2.97Å; L701-G705 PolarHBondContact O-N 2.72Å; I702-G705 PolarHBondContact O-N 3.13Å
706	V	92.8	Very high	92.3	Very high	5 Å²	5	44.1 Å²	44.1	3%	0.03	23%	0.233	C	C	.	.			trans	-93	132.1	173.7	-173.7	0	0	0	0	108.8	W680 I702 H710 R711 V714 D893	W680-V706 HydrophobicContact CH2-CG1 4.29Å; W680-V706 HydrophobicContact CH2-CG2 3.95Å; W680-V706 HydrophobicContact CZ2-CB 4.16Å; W680-V706 HydrophobicContact CZ2-CG1 4.21Å; W680-V706 HydrophobicContact CZ2-CG2 3.63Å; I702-V706 HydrophobicContact CG1-CG2 4.14Å; V706-H710 HydrophobicContact CG1-CB 3.96Å; V706-R711 HydrophobicContact CB-CG 3.8Å; V706-R711 HydrophobicContact CG1-CG 3.75Å; V706-R711 PolarHBondContact O-NE 3.41Å; V706-R711 PolarHBondContact O-NH2 2.97Å; V706-V714 HydrophobicContact CG1-CB 4.2Å; V706-V714 HydrophobicContact CG1-CG2 3.94Å; V706-V714 HydrophobicContact CG2-CG1 4.11Å; V706-D893 HydrophobicContact CG2-CB 3.81Å; V706-D893 VanDerWaalsContact CG2-CG 3.48Å; V706-D893 PolarHBondContact N-OD2 2.99Å
707	P	91	Very high	92.4	Very high	21 Å²	21	40.5 Å²	40.5	14%	0.136	20%	0.204	C	C	.	.			trans	-54.5	145.8	170.5	-28.3	35.6	0	0	0	112	W680 E709 H710 R711	W680-P707 HydrophobicContact CB-CG 3.93Å; W680-P707 VanDerWaalsContact CG-CD 3.48Å; W680-P707 HydrophobicContact CG-CG 3.84Å; P707-E709 PolarHBondContact O-N 2.86Å; P707-E709 VanDerWaalsContact O-N 3.17Å; P707-H710 PolarHBondContact O-N 2.88Å; P707-R711 PolarHBondContact O-N 2.91Å
708	H	88	Confident	92.6	Very high	31 Å²	31	35 Å²	35	14%	0.144	18%	0.179	C	C	.	.	G	3₁₀ helix	trans	-53.7	-40.7	-175.6	167.1	64	0	0	0	112	V639 Y640 H710 Y808	V639-H708 HydrophobicContact CG1-CB 4.48Å; Y640-H708 AromaticContact CD1-ND1 3.84Å; Y640-H708 HydrophobicContact CE1-CB 4.33Å; Y640-H708 AromaticContact CE1-ND1 3.79Å; H708-H710 PolarHBondContact O-N 3.42Å; H708-Y808 AromaticContact CE1-CE1 3.82Å; H708-Y808 AromaticContact ND1-CE1 3.46Å; H708-Y808 WeakPolarHBondContact ND1-CE1 3.49Å; H708-Y808 AromaticContact ND1-CZ 3.61Å; H708-Y808 PolarHBondContact ND1-OH 2.74Å; H708-Y808 WeakPolarHBondContact O-CE1 3.48Å
709	E	87.1	Confident	92.7	Very high	127 Å²	127	35 Å²	35	59%	0.593	18%	0.179	S	C	*	.	G	3₁₀ helix	trans	-65.2	-23.2	-178.4	-59.7	66.5	-145.8	0	0	113.1	P707	P707-E709 PolarHBondContact O-N 2.86Å; P707-E709 VanDerWaalsContact O-N 3.17Å
710	H	89.9	Confident	92.7	Very high	38 Å²	38	34.1 Å²	34.1	18%	0.176	18%	0.178	C	C	.	.	G	3₁₀ helix	trans	-107.6	-10.8	-173.1	-59	-24.2	0	0	0	113.5	L684 V706 P707 H708 S712 I713 V714	L684-H710 HydrophobicContact CD1-CB 4.36Å; V706-H710 HydrophobicContact CG1-CB 3.96Å; P707-H710 PolarHBondContact O-N 2.88Å; H708-H710 PolarHBondContact O-N 3.42Å; H710-S712 PolarHBondContact O-N 3.46Å; H710-I713 PolarHBondContact O-N 2.9Å; H710-V714 WeakPolarHBondContact O-CG2 3.4Å; H710-V714 PolarHBondContact O-N 3.4Å
711	R	93.8	Very high	92.7	Very high	2 Å²	2	36.6 Å²	36.6	1%	0.008	18%	0.179	C	C	.	.	H	α-helix	trans	-59.8	-40.2	-177	-81.7	-177.1	176.8	121.8	1.6	113.6	Y640 V706 P707 I713 V714 W715 Y808 F889 D893	Y640-R711 PolarHBondContact OH-NH1 3.26Å; V706-R711 HydrophobicContact CB-CG 3.8Å; V706-R711 HydrophobicContact CG1-CG 3.75Å; V706-R711 PolarHBondContact O-NE 3.41Å; V706-R711 PolarHBondContact O-NH2 2.97Å; P707-R711 PolarHBondContact O-N 2.91Å; R711-I713 VanDerWaalsContact C-N 3.31Å; R711-I713 PolarHBondContact O-N 3.26Å; R711-V714 PolarHBondContact O-N 2.9Å; R711-W715 WeakPolarHBondContact O-CB 3.14Å; R711-W715 VanDerWaalsContact O-CD1 3.26Å; R711-W715 PolarHBondContact O-N 2.97Å; R711-Y808 HydrophobicContact CB-CD1 3.55Å; R711-Y808 HydrophobicContact CB-CD2 4.39Å; R711-Y808 HydrophobicContact CB-CE1 3.61Å; R711-Y808 HydrophobicContact CB-CE2 4.44Å; R711-Y808 HydrophobicContact CB-CG 3.95Å; R711-Y808 HydrophobicContact CG-CE1 4.36Å; R711-F889 VanDerWaalsContact CZ-CB 3.45Å; R711-D893 WeakPolarHBondContact CD-OD1 3.17Å; R711-D893 IonicContact CZ-OD1 3.02Å; R711-D893 IonicContact CZ-OD2 2.66Å; R711-D893 IonicContact NE-OD1 3.25Å; R711-D893 PolarHBondContact NE-OD1 2.73Å; R711-D893 IonicContact NE-OD2 3.53Å; R711-D893 PolarHBondContact NE-OD2 3.36Å; R711-D893 VanDerWaalsContact NE-OD2 3.09Å; R711-D893 IonicContact NH2-OD2 3.32Å; R711-D893 PolarHBondContact NH2-OD2 3Å
712	S	92.4	Very high	92.7	Very high	29 Å²	29	37.9 Å²	37.9	20%	0.203	19%	0.185	C	C	.	.	H	α-helix	trans	-55	-46.2	175.9	53.8	0	0	0	0	112	H710 R716 Y808	H710-S712 PolarHBondContact O-N 3.46Å; S712-R716 WeakPolarHBondContact O-CB 3.4Å; S712-R716 PolarHBondContact O-N 3.37Å; S712-R716 VanDerWaalsContact O-N 3.09Å; S712-Y808 VanDerWaalsContact CB-O 3.24Å; S712-Y808 WeakPolarHBondContact CB-O 3.3Å
713	I	91.2	Very high	92.7	Very high	88 Å²	88	37.9 Å²	37.9	45%	0.451	18%	0.184	S	C	.	.	H	α-helix	trans	-67.7	-51.6	178.9	-56	173	0	0	0	110.8	L692 H710 R711 W717	L692-I713 HydrophobicContact CD1-CG2 4.42Å; H710-I713 PolarHBondContact O-N 2.9Å; R711-I713 VanDerWaalsContact C-N 3.31Å; R711-I713 PolarHBondContact O-N 3.26Å; I713-W717 WeakPolarHBondContact O-CB 3.41Å; I713-W717 PolarHBondContact O-N 2.94Å
714	V	93.6	Very high	92.5	Very high	2 Å²	2	40 Å²	40	1%	0.012	20%	0.195	C	C	.	.	H	α-helix	trans	-66.5	-41.5	-175.5	176	0	0	0	0	111.5	W680 I702 V706 H710 R711 W717 C718	W680-V714 HydrophobicContact CH2-CG1 4.38Å; W680-V714 HydrophobicContact CH2-CG2 3.93Å; W680-V714 HydrophobicContact CZ3-CG2 3.7Å; I702-V714 HydrophobicContact CD1-CG1 4.08Å; I702-V714 HydrophobicContact CG1-CG1 4.4Å; V706-V714 HydrophobicContact CG1-CB 4.2Å; V706-V714 HydrophobicContact CG1-CG2 3.94Å; V706-V714 HydrophobicContact CG2-CG1 4.11Å; H710-V714 WeakPolarHBondContact O-CG2 3.4Å; H710-V714 PolarHBondContact O-N 3.4Å; R711-V714 PolarHBondContact O-N 2.9Å; V714-W717 PolarHBondContact O-N 3.34Å; V714-C718 PolarHBondContact O-N 3.29Å; V714-C718 PolarHBondContact O-SG 3.31Å
715	W	96	Very high	92.4	Very high	1 Å²	1	44.9 Å²	44.9	0%	0.004	21%	0.209	C	C	.	.	H	α-helix	trans	-69	-46.6	178.5	-69.1	21.3	0	0	0	111.2	R711 W717 C718 V719 I804 Y808 L809 F889 W892 D893 L896	R711-W715 WeakPolarHBondContact O-CB 3.14Å; R711-W715 VanDerWaalsContact O-CD1 3.26Å; R711-W715 PolarHBondContact O-N 2.97Å; W715-W717 PolarHBondContact O-N 2.93Å; W715-C718 PolarHBondContact O-N 2.94Å; W715-C718 VanDerWaalsContact O-N 3.16Å; W715-V719 WeakPolarHBondContact O-CB 3.49Å; W715-V719 VanDerWaalsContact O-CG2 3.27Å; W715-V719 WeakPolarHBondContact O-CG2 3.39Å; W715-V719 PolarHBondContact O-N 3.02Å; W715-I804 HydrophobicContact CH2-CG2 3.96Å; W715-I804 HydrophobicContact CZ3-CG2 4.13Å; W715-Y808 HydrophobicContact CE3-CD2 4.27Å; W715-Y808 AromaticContact CH2-CD2 3.97Å; W715-Y808 HydrophobicContact CH2-CD2 3.97Å; W715-Y808 HydrophobicContact CH2-CE2 4.38Å; W715-Y808 HydrophobicContact CZ2-CD2 4.37Å; W715-Y808 AromaticContact CZ3-CD2 3.89Å; W715-Y808 HydrophobicContact CZ3-CD2 3.89Å; W715-L809 HydrophobicContact CB-CD1 4.29Å; W715-L809 HydrophobicContact CB-CD2 4.13Å; W715-L809 HydrophobicContact CB-CG 4.47Å; W715-L809 HydrophobicContact CE3-CD1 4.49Å; W715-F889 AromaticContact CH2-CD1 3.72Å; W715-F889 HydrophobicContact CH2-CD1 3.72Å; W715-F889 HydrophobicContact CH2-CE1 4.07Å; W715-F889 AromaticContact CZ2-CD1 3.94Å; W715-F889 HydrophobicContact CZ2-CD1 3.94Å; W715-W892 HydrophobicContact CH2-CB 3.8Å; W715-W892 HydrophobicContact CH2-CD2 4.2Å; W715-W892 AromaticContact CH2-CE3 3.81Å; W715-W892 HydrophobicContact CH2-CE3 3.81Å; W715-W892 HydrophobicContact CH2-CG 4.24Å; W715-W892 HydrophobicContact CZ2-CB 3.6Å; W715-W892 AromaticContact CZ3-CE3 3.88Å; W715-W892 HydrophobicContact CZ3-CE3 3.88Å; W715-W892 HydrophobicContact CZ3-CZ3 4.44Å; W715-D893 PolarHBondContact NE1-OD1 3.12Å; W715-L896 HydrophobicContact CB-CD1 3.93Å; W715-L896 HydrophobicContact CD2-CD1 3.43Å; W715-L896 VanDerWaalsContact CD2-CD1 3.43Å; W715-L896 HydrophobicContact CE3-CD1 3.78Å; W715-L896 HydrophobicContact CG-CD1 3.5Å; W715-L896 HydrophobicContact CZ2-CD1 4.49Å; W715-L896 HydrophobicContact CZ3-CD1 4.43Å
716	R	94.6	Very high	92.1	Very high	81 Å²	81	49.1 Å²	49.1	31%	0.306	23%	0.227	S	C	.	.	H	α-helix	trans	-53.8	-42.8	174.3	172.4	178.2	-81.2	152.4	-1.5	111.4	P202 S712 T720 L809 D810 D813	P202-R716 PolarHBondContact O-NH2 3.5Å; S712-R716 WeakPolarHBondContact O-CB 3.4Å; S712-R716 PolarHBondContact O-N 3.37Å; S712-R716 VanDerWaalsContact O-N 3.09Å; R716-T720 WeakPolarHBondContact O-CB 3.48Å; R716-T720 PolarHBondContact O-N 2.96Å; R716-T720 PolarHBondContact O-OG1 2.91Å; R716-L809 HydrophobicContact CB-CD2 3.9Å; R716-D810 IonicContact NH2-OD2 2.8Å; R716-D810 PolarHBondContact NH2-OD2 3.25Å; R716-D813 IonicContact CZ-OD2 2.68Å; R716-D813 VanDerWaalsContact CZ-OD2 3.25Å; R716-D813 IonicContact NE-OD2 2.81Å; R716-D813 PolarHBondContact NE-OD2 2.88Å; R716-D813 IonicContact NH2-OD2 2.79Å; R716-D813 PolarHBondContact NH2-OD2 3.33Å
717	W	94.4	Very high	92	Very high	40 Å²	40	52.4 Å²	52.4	15%	0.152	24%	0.239	C	C	.	.	H	α-helix	trans	-67.3	-48.1	175.8	177.4	84.5	0	0	0	112.8	L692 H694 L698 I713 V714 W715 V719 T720 F721 F897	L692-W717 HydrophobicContact CB-CD2 3.73Å; L692-W717 HydrophobicContact CB-CE3 4.43Å; L692-W717 HydrophobicContact CB-CG 3.79Å; L692-W717 HydrophobicContact CB-CZ2 4.19Å; L692-W717 HydrophobicContact CD1-CB 3.98Å; L692-W717 HydrophobicContact CD1-CD2 4.24Å; L692-W717 HydrophobicContact CD1-CG 3.94Å; L692-W717 HydrophobicContact CG-CG 4.5Å; L692-W717 VanDerWaalsContact O-CZ2 3.31Å; L692-W717 WeakPolarHBondContact O-CZ2 3.42Å; L692-W717 PolarHBondContact O-NE1 2.99Å; H694-W717 HydrophobicContact CB-CH2 4.05Å; L698-W717 HydrophobicContact CD2-CE3 4.48Å; L698-W717 HydrophobicContact CD2-CH2 3.89Å; L698-W717 HydrophobicContact CD2-CZ3 3.82Å; I713-W717 WeakPolarHBondContact O-CB 3.41Å; I713-W717 PolarHBondContact O-N 2.94Å; V714-W717 PolarHBondContact O-N 3.34Å; W715-W717 PolarHBondContact O-N 2.93Å; W717-V719 PolarHBondContact O-N 3.29Å; W717-T720 PolarHBondContact O-N 3.45Å; W717-F721 HydrophobicContact CZ2-CD2 4.49Å; W717-F721 WeakPolarHBondContact O-CB 3.27Å; W717-F721 PolarHBondContact O-N 3.45Å; W717-F897 HydrophobicContact CH2-CE2 4.14Å; W717-F897 AromaticContact CZ3-CD2 3.94Å; W717-F897 HydrophobicContact CZ3-CD2 3.94Å; W717-F897 AromaticContact CZ3-CE2 3.82Å; W717-F897 HydrophobicContact CZ3-CE2 3.82Å
718	C	95.7	Very high	92	Very high	3 Å²	3	56.2 Å²	56.2	2%	0.02	26%	0.258	C	S	.	.	H	α-helix	trans	-58.7	-46.9	178.4	-68.6	0	0	0	0	111.6	V714 W715 F721 H722 L896	V714-C718 PolarHBondContact O-N 3.29Å; V714-C718 PolarHBondContact O-SG 3.31Å; W715-C718 PolarHBondContact O-N 2.94Å; W715-C718 VanDerWaalsContact O-N 3.16Å; C718-F721 PolarHBondContact O-N 3.33Å; C718-H722 PolarHBondContact O-CD2 3.34Å; C718-H722 PolarHBondContact O-N 3.24Å; C718-L896 HydrophobicContact CB-CB 4.15Å
719	V	95.1	Very high	92	Very high	1 Å²	1	62.6 Å²	62.6	1%	0.006	29%	0.288	C	S	.	.	H	α-helix	trans	-61.8	-50.1	178	171.6	0	0	0	0	110.2	W715 W717 F721 H722 V723 W816 T817 L896	W715-V719 WeakPolarHBondContact O-CB 3.49Å; W715-V719 VanDerWaalsContact O-CG2 3.27Å; W715-V719 WeakPolarHBondContact O-CG2 3.39Å; W715-V719 PolarHBondContact O-N 3.02Å; W717-V719 PolarHBondContact O-N 3.29Å; V719-F721 VanDerWaalsContact C-N 3.35Å; V719-F721 PolarHBondContact O-N 2.95Å; V719-H722 PolarHBondContact O-N 3.28Å; V719-H722 VanDerWaalsContact O-N 3.16Å; V719-V723 HydrophobicContact CG1-CG1 4.48Å; V719-V723 WeakPolarHBondContact O-CG2 3.33Å; V719-V723 PolarHBondContact O-N 3.12Å; V719-W816 HydrophobicContact CG1-CB 3.78Å; V719-T817 HydrophobicContact CG2-CG2 4.06Å; V719-T817 WeakPolarHBondContact CG2-OG1 3.4Å; V719-L896 HydrophobicContact CG2-CD2 4.39Å
720	T	93.1	Very high	92.3	Very high	35 Å²	35	59.5 Å²	59.5	22%	0.215	28%	0.275	C	S	.	.	H	α-helix	trans	-55.8	-46.9	175.5	-74.5	0	0	0	0	111.8	R716 W717 H722 V723 K724 R727	R716-T720 WeakPolarHBondContact O-CB 3.48Å; R716-T720 PolarHBondContact O-N 2.96Å; R716-T720 PolarHBondContact O-OG1 2.91Å; W717-T720 PolarHBondContact O-N 3.45Å; T720-H722 VanDerWaalsContact C-N 3.29Å; T720-H722 PolarHBondContact O-N 2.96Å; T720-V723 PolarHBondContact O-N 2.86Å; T720-K724 WeakPolarHBondContact O-CA 3.42Å; T720-K724 VanDerWaalsContact O-CB 3.29Å; T720-K724 WeakPolarHBondContact O-CB 3.35Å; T720-K724 PolarHBondContact O-N 3.14Å; T720-R727 PolarHBondContact OG1-NH1 3.39Å
721	F	93.6	Very high	92.2	Very high	105 Å²	105	60.1 Å²	60.1	46%	0.461	29%	0.286	S	S	.	.	H	α-helix	trans	-57.4	-40.7	177.9	174.2	-98.3	0	0	0	112.4	W717 C718 V719	W717-F721 HydrophobicContact CZ2-CD2 4.49Å; W717-F721 WeakPolarHBondContact O-CB 3.27Å; W717-F721 PolarHBondContact O-N 3.45Å; C718-F721 PolarHBondContact O-N 3.33Å; V719-F721 VanDerWaalsContact C-N 3.35Å; V719-F721 PolarHBondContact O-N 2.95Å
722	H	94.3	Very high	91.9	Very high	46 Å²	46	66 Å²	66	21%	0.213	33%	0.325	C	S	.	.	H	α-helix	trans	-77.3	-40.2	179.3	-74.3	-57.5	0	0	0	114.1	C718 V719 T720 F825 L896	C718-H722 PolarHBondContact O-CD2 3.34Å; C718-H722 PolarHBondContact O-N 3.24Å; V719-H722 PolarHBondContact O-N 3.28Å; V719-H722 VanDerWaalsContact O-N 3.16Å; T720-H722 VanDerWaalsContact C-N 3.29Å; T720-H722 PolarHBondContact O-N 2.96Å; H722-F825 HydrophobicContact CB-CE1 4.34Å; H722-F825 AromaticContact CD2-CE1 3.58Å; H722-F825 AromaticContact CD2-CZ 3.53Å; H722-F825 AromaticContact CE1-CE1 3.87Å; H722-F825 AromaticContact CG-CE1 3.67Å; H722-F825 AromaticContact ND1-CE1 3.85Å; H722-F825 AromaticContact NE2-CE1 3.72Å; H722-F825 AromaticContact NE2-CZ 3.79Å; H722-L896 PolarHBondContact CD2-O 3.46Å; H722-L896 PolarHBondContact NE2-O 3.01Å
723	V	94.3	Very high	91.9	Very high	0 Å²	0	69.2 Å²	69.2	0%	0	34%	0.34	C	S	.	.	H	α-helix	trans	-85.4	-13.5	-178.8	-52.8	0	0	0	0	114.2	V719 T720 K725 F726 R727 W816 A820	V719-V723 HydrophobicContact CG1-CG1 4.48Å; V719-V723 WeakPolarHBondContact O-CG2 3.33Å; V719-V723 PolarHBondContact O-N 3.12Å; T720-V723 PolarHBondContact O-N 2.86Å; V723-K725 VanDerWaalsContact C-N 3.3Å; V723-K725 PolarHBondContact O-N 2.92Å; V723-K725 VanDerWaalsContact O-N 3.08Å; V723-F726 WeakPolarHBondContact O-CA 3.45Å; V723-F726 PolarHBondContact O-N 3.43Å; V723-R727 HydrophobicContact CG2-CB 4.18Å; V723-R727 PolarHBondContact O-N 3.11Å; V723-W816 HydrophobicContact CB-CE3 4.05Å; V723-W816 HydrophobicContact CG1-CB 4.45Å; V723-W816 HydrophobicContact CG1-CE3 4.21Å; V723-W816 WeakPolarHBondContact CG1-O 3.37Å; V723-W816 HydrophobicContact CG2-CB 4.24Å; V723-W816 HydrophobicContact CG2-CD2 4.22Å; V723-W816 HydrophobicContact CG2-CE3 4.01Å; V723-W816 HydrophobicContact CG2-CG 4.31Å; V723-A820 HydrophobicContact CG1-CB 3.78Å
724	K	91.3	Very high	92.1	Very high	114 Å²	114	67.3 Å²	67.3	50%	0.496	33%	0.328	S	S	.	.	H	α-helix	trans	-41.9	-51.5	-172.3	-174.6	164	-174.3	167.7	0	113.9	T720 F726 R727 D728	T720-K724 WeakPolarHBondContact O-CA 3.42Å; T720-K724 VanDerWaalsContact O-CB 3.29Å; T720-K724 WeakPolarHBondContact O-CB 3.35Å; T720-K724 PolarHBondContact O-N 3.14Å; K724-F726 PolarHBondContact O-N 2.94Å; K724-F726 VanDerWaalsContact O-N 3.09Å; K724-R727 PolarHBondContact O-N 2.88Å; K724-D728 WeakPolarHBondContact CE-OD2 3.47Å; K724-D728 WeakPolarHBondContact CG-OD2 3.47Å; K724-D728 VanDerWaalsContact O-CB 3.28Å; K724-D728 WeakPolarHBondContact O-CB 3.37Å; K724-D728 PolarHBondContact O-N 3.42Å
725	K	87.9	Confident	92.2	Very high	171 Å²	171	67.8 Å²	67.8	74%	0.743	33%	0.329	S	S	*	.	H	α-helix	trans	-58.2	-26.5	-179.1	-67.4	-175	178.2	-177.9	0	114.5	V723 H729	V723-K725 VanDerWaalsContact C-N 3.3Å; V723-K725 PolarHBondContact O-N 2.92Å; V723-K725 VanDerWaalsContact O-N 3.08Å; K725-H729 PolarHBondContact O-CE1 3.13Å; K725-H729 PolarHBondContact O-ND1 3.12Å
726	F	84.9	Confident	92.1	Very high	92 Å²	92	71.5 Å²	71.5	40%	0.404	35%	0.347	S	S	.	.	H	α-helix	trans	-94.6	-42.9	177.9	-53.6	-79.6	0	0	0	111.2	V723 K724 H729 L730 V824	V723-F726 WeakPolarHBondContact O-CA 3.45Å; V723-F726 PolarHBondContact O-N 3.43Å; K724-F726 PolarHBondContact O-N 2.94Å; K724-F726 VanDerWaalsContact O-N 3.09Å; F726-H729 PolarHBondContact O-N 2.97Å; F726-L730 WeakPolarHBondContact O-CD1 3.5Å; F726-V824 HydrophobicContact CD2-CG2 4.37Å; F726-V824 HydrophobicContact CE2-CG2 3.82Å
727	R	90.6	Very high	92.1	Very high	74 Å²	74	70.6 Å²	70.6	28%	0.279	35%	0.35	S	S	.	.	H	α-helix	trans	-65.8	-39.4	-179.3	-165.9	176.3	74.7	-166.3	3.9	112.5	T720 V723 K724 H729 L730 W816	T720-R727 PolarHBondContact OG1-NH1 3.39Å; V723-R727 HydrophobicContact CG2-CB 4.18Å; V723-R727 PolarHBondContact O-N 3.11Å; K724-R727 PolarHBondContact O-N 2.88Å; R727-H729 PolarHBondContact O-N 3.4Å; R727-H729 VanDerWaalsContact O-N 3.09Å; R727-L730 PolarHBondContact O-N 2.97Å; R727-W816 HydrophobicContact CB-CH2 4.24Å; R727-W816 HydrophobicContact CB-CZ2 4.35Å; R727-W816 HydrophobicContact CB-CZ3 4.39Å; R727-W816 HydrophobicContact CG-CD2 4.48Å; R727-W816 HydrophobicContact CG-CH2 4.08Å; R727-W816 HydrophobicContact CG-CZ2 3.71Å
728	D	89.5	Confident	92.2	Very high	100 Å²	100	69.4 Å²	69.4	54%	0.535	35%	0.346	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.9	-11.4	-179.8	-66.3	3.9	0	0	0	113.5	K724	K724-D728 WeakPolarHBondContact CE-OD2 3.47Å; K724-D728 WeakPolarHBondContact CG-OD2 3.47Å; K724-D728 VanDerWaalsContact O-CB 3.28Å; K724-D728 WeakPolarHBondContact O-CB 3.37Å; K724-D728 PolarHBondContact O-N 3.42Å
729	H	89.5	Confident	92.1	Very high	165 Å²	165	69.6 Å²	69.6	76%	0.764	35%	0.347	S	S	*	.	T	Hydrogen-bonded Turn	trans	-102.8	4.1	175.3	-67.6	96.1	0	0	0	113.5	K725 F726 R727	K725-H729 PolarHBondContact O-CE1 3.13Å; K725-H729 PolarHBondContact O-ND1 3.12Å; F726-H729 PolarHBondContact O-N 2.97Å; R727-H729 PolarHBondContact O-N 3.4Å; R727-H729 VanDerWaalsContact O-N 3.09Å
730	L	91.6	Very high	92.1	Very high	62 Å²	62	72.9 Å²	72.9	33%	0.325	37%	0.365	S	S	.	.	S	Bend	trans	-115.6	161.6	-177.1	-67.8	167.2	0	0	0	110.6	F726 R727 Y734 W816	F726-L730 WeakPolarHBondContact O-CD1 3.5Å; R727-L730 PolarHBondContact O-N 2.97Å; L730-Y734 HydrophobicContact CB-CG 4.24Å; L730-Y734 HydrophobicContact CD1-CD1 3.97Å; L730-Y734 HydrophobicContact CD1-CE1 3.89Å; L730-Y734 HydrophobicContact CD1-CG 4.4Å; L730-Y734 HydrophobicContact CD2-CD2 4.12Å; L730-Y734 HydrophobicContact CD2-CE2 3.97Å; L730-Y734 HydrophobicContact CD2-CG 4.49Å; L730-W816 HydrophobicContact CD1-CH2 3.78Å
731	A	88.9	Confident	92	Very high	51 Å²	51	73.6 Å²	73.6	42%	0.421	37%	0.369	S	S	.	.			trans	-70.1	147.4	179	0	0	0	0	0	111.1	D733 Y734	A731-D733 WeakPolarHBondContact CB-OD1 3.3Å; A731-D733 PolarHBondContact O-N 3.37Å; A731-D733 VanDerWaalsContact O-N 3.13Å; A731-Y734 WeakPolarHBondContact O-CB 3.38Å; A731-Y734 PolarHBondContact O-N 3.31Å; A731-Y734 VanDerWaalsContact O-N 3.08Å
732	P	87.2	Confident	91.8	Very high	126 Å²	126	69.7 Å²	69.7	82%	0.818	36%	0.356	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.2	-19	179.9	-24.6	35.4	0	0	0	114.9
733	D	92.5	Very high	91.5	Very high	96 Å²	96	74.2 Å²	74.2	51%	0.513	37%	0.371	S	S	.	.	T	Hydrogen-bonded Turn	trans	-101.1	17.5	178.4	62.3	-25.8	0	0	0	112.9	A731 Y735 E736 T737	A731-D733 WeakPolarHBondContact CB-OD1 3.3Å; A731-D733 PolarHBondContact O-N 3.37Å; A731-D733 VanDerWaalsContact O-N 3.13Å; D733-Y735 PolarHBondContact O-N 2.82Å; D733-E736 PolarHBondContact O-N 3.42Å; D733-T737 WeakPolarHBondContact O-CB 3.42Å; D733-T737 PolarHBondContact O-N 2.94Å; D733-T737 PolarHBondContact O-OG1 3Å
734	Y	95.2	Very high	91.2	Very high	49 Å²	49	80.7 Å²	80.7	19%	0.192	41%	0.406	C	S	.	.	H	α-helix	trans	-61.9	-38.4	-172.6	-177.9	-108.6	0	0	0	114	L730 A731 T737 L738 R788 F815 W816	L730-Y734 HydrophobicContact CB-CG 4.24Å; L730-Y734 HydrophobicContact CD1-CD1 3.97Å; L730-Y734 HydrophobicContact CD1-CE1 3.89Å; L730-Y734 HydrophobicContact CD1-CG 4.4Å; L730-Y734 HydrophobicContact CD2-CD2 4.12Å; L730-Y734 HydrophobicContact CD2-CE2 3.97Å; L730-Y734 HydrophobicContact CD2-CG 4.49Å; A731-Y734 WeakPolarHBondContact O-CB 3.38Å; A731-Y734 PolarHBondContact O-N 3.31Å; A731-Y734 VanDerWaalsContact O-N 3.08Å; Y734-T737 WeakPolarHBondContact O-CB 3.2Å; Y734-T737 PolarHBondContact O-N 2.91Å; Y734-L738 HydrophobicContact CD1-CD1 4.08Å; Y734-L738 HydrophobicContact CE1-CD1 3.6Å; Y734-L738 HydrophobicContact CE1-CG 4.33Å; Y734-L738 WeakPolarHBondContact O-CG 3.3Å; Y734-L738 PolarHBondContact O-N 3.18Å; Y734-R788 WeakPolarHBondContact OH-CD 3.33Å; Y734-F815 HydrophobicContact CE1-CZ 4.4Å; Y734-W816 HydrophobicContact CD1-CH2 4.06Å; Y734-W816 HydrophobicContact CD1-CZ2 4.18Å; Y734-W816 HydrophobicContact CE1-CH2 4.43Å
735	Y	95.4	Very high	91	Very high	11 Å²	11	83 Å²	83	4%	0.043	41%	0.411	C	S	.	.	H	α-helix	trans	-64.8	-46.8	176.5	175.2	-111.4	0	0	0	111.9	D733 T737 L738 L739 N780 V781 A784 Q811 E812 F815	D733-Y735 PolarHBondContact O-N 2.82Å; Y735-T737 VanDerWaalsContact C-N 3.31Å; Y735-T737 PolarHBondContact O-N 3.15Å; Y735-L738 WeakPolarHBondContact O-CB 3.42Å; Y735-L738 PolarHBondContact O-N 3.42Å; Y735-L739 HydrophobicContact CD1-CD1 4.23Å; Y735-L739 HydrophobicContact CE1-CD1 3.62Å; Y735-L739 HydrophobicContact CE1-CG 4.41Å; Y735-L739 HydrophobicContact CE2-CD1 4.48Å; Y735-L739 HydrophobicContact CE2-CG 4.48Å; Y735-L739 PolarHBondContact O-N 2.8Å; Y735-L739 VanDerWaalsContact O-N 3.08Å; Y735-N780 WeakPolarHBondContact OH-CB 3.47Å; Y735-V781 PolarHBondContact OH-N 3.41Å; Y735-A784 HydrophobicContact CD2-CB 3.91Å; Y735-A784 HydrophobicContact CE2-CB 3.56Å; Y735-Q811 HydrophobicContact CE1-CB 4Å; Y735-E812 HydrophobicContact CD1-CB 3.9Å; Y735-E812 HydrophobicContact CD1-CG 4.39Å; Y735-E812 HydrophobicContact CE1-CB 4.45Å; Y735-E812 HydrophobicContact CG-CB 4.18Å; Y735-E812 HydrophobicContact CG-CG 4.21Å; Y735-F815 HydrophobicContact CD2-CB 3.72Å; Y735-F815 AromaticContact CD2-CD1 3.74Å; Y735-F815 HydrophobicContact CD2-CD1 3.74Å; Y735-F815 AromaticContact CD2-CD2 3.83Å; Y735-F815 HydrophobicContact CD2-CD2 3.83Å; Y735-F815 HydrophobicContact CD2-CE1 4.3Å; Y735-F815 HydrophobicContact CD2-CE2 4.36Å; Y735-F815 AromaticContact CD2-CG 3.48Å; Y735-F815 HydrophobicContact CD2-CG 3.48Å; Y735-F815 VanDerWaalsContact CD2-CG 3.48Å; Y735-F815 HydrophobicContact CE2-CB 3.61Å; Y735-F815 HydrophobicContact CE2-CD1 4.47Å; Y735-F815 AromaticContact CE2-CD2 3.98Å; Y735-F815 HydrophobicContact CE2-CD2 3.98Å; Y735-F815 AromaticContact CE2-CG 3.78Å; Y735-F815 HydrophobicContact CE2-CG 3.78Å; Y735-F815 HydrophobicContact CG-CD1 4.46Å
736	E	94.9	Very high	90.7	Very high	80 Å²	80	81 Å²	81	37%	0.374	42%	0.416	S	S	.	.	H	α-helix	trans	-68.1	-31.5	177.1	-170.5	57.9	-146.7	0	0	111.8	D733 L739 N740 R743	D733-E736 PolarHBondContact O-N 3.42Å; E736-L739 PolarHBondContact O-N 3.22Å; E736-L739 WeakPolarHBondContact OE2-CD1 3.33Å; E736-N740 PolarHBondContact O-N 2.98Å; E736-N740 PolarHBondContact O-ND2 2.78Å; E736-R743 IonicContact OE1-CZ 3.95Å; E736-R743 IonicContact OE1-NH1 2.75Å; E736-R743 PolarHBondContact OE1-NH1 2.92Å; E736-R743 IonicContact OE1-NH2 2.65Å; E736-R743 PolarHBondContact OE1-NH2 3.18Å; E736-R743 IonicContact OE2-NH2 2.68Å
737	T	95.2	Very high	90.7	Very high	61 Å²	61	77.5 Å²	77.5	37%	0.374	40%	0.402	S	S	.	.	H	α-helix	trans	-60	-44.3	170.9	-61.8	0	0	0	0	111.7	D733 Y734 Y735 L739 N740 V741	D733-T737 WeakPolarHBondContact O-CB 3.42Å; D733-T737 PolarHBondContact O-N 2.94Å; D733-T737 PolarHBondContact O-OG1 3Å; Y734-T737 WeakPolarHBondContact O-CB 3.2Å; Y734-T737 PolarHBondContact O-N 2.91Å; Y735-T737 VanDerWaalsContact C-N 3.31Å; Y735-T737 PolarHBondContact O-N 3.15Å; T737-L739 VanDerWaalsContact C-N 3.35Å; T737-N740 PolarHBondContact O-N 3.09Å; T737-V741 WeakPolarHBondContact O-CG2 3.42Å; T737-V741 PolarHBondContact O-N 2.75Å
738	L	95.2	Very high	90.5	Very high	15 Å²	15	79.9 Å²	79.9	8%	0.079	43%	0.426	C	S	.	.	H	α-helix	trans	-64.1	-37.7	174.3	-69.2	168.6	0	0	0	112.2	Y734 Y735 V741 A742 A784 W787 R788 F815	Y734-L738 HydrophobicContact CD1-CD1 4.08Å; Y734-L738 HydrophobicContact CE1-CD1 3.6Å; Y734-L738 HydrophobicContact CE1-CG 4.33Å; Y734-L738 WeakPolarHBondContact O-CG 3.3Å; Y734-L738 PolarHBondContact O-N 3.18Å; Y735-L738 WeakPolarHBondContact O-CB 3.42Å; Y735-L738 PolarHBondContact O-N 3.42Å; L738-V741 PolarHBondContact O-N 3.19Å; L738-A742 WeakPolarHBondContact O-CB 3.45Å; L738-A742 PolarHBondContact O-N 3.07Å; L738-A784 HydrophobicContact CB-CB 4.06Å; L738-W787 HydrophobicContact CD2-CB 3.92Å; L738-R788 HydrophobicContact CD1-CB 3.94Å; L738-F815 HydrophobicContact CD1-CE2 3.85Å; L738-F815 HydrophobicContact CD1-CZ 3.54Å
739	L	94.4	Very high	90.5	Very high	7 Å²	7	75.7 Å²	75.7	4%	0.037	41%	0.406	C	S	.	.	H	α-helix	trans	-66.5	-37.4	174.6	-68.2	179.4	0	0	0	112.6	Y735 E736 T737 A742 R743 N780 A784	Y735-L739 HydrophobicContact CD1-CD1 4.23Å; Y735-L739 HydrophobicContact CE1-CD1 3.62Å; Y735-L739 HydrophobicContact CE1-CG 4.41Å; Y735-L739 HydrophobicContact CE2-CD1 4.48Å; Y735-L739 HydrophobicContact CE2-CG 4.48Å; Y735-L739 PolarHBondContact O-N 2.8Å; Y735-L739 VanDerWaalsContact O-N 3.08Å; E736-L739 PolarHBondContact O-N 3.22Å; E736-L739 WeakPolarHBondContact OE2-CD1 3.33Å; T737-L739 VanDerWaalsContact C-N 3.35Å; L739-A742 WeakPolarHBondContact O-CB 3.46Å; L739-A742 PolarHBondContact O-N 3.5Å; L739-R743 VanDerWaalsContact O-CG 3.29Å; L739-R743 WeakPolarHBondContact O-CG 3.4Å; L739-R743 PolarHBondContact O-N 2.85Å; L739-N780 HydrophobicContact CD1-CB 4.34Å; L739-N780 HydrophobicContact CD2-CB 3.81Å; L739-N780 WeakPolarHBondContact CD2-O 3.35Å; L739-A784 HydrophobicContact CD2-CB 3.96Å; L739-A784 HydrophobicContact CG-CB 4.42Å
740	N	93.7	Very high	90.5	Very high	70 Å²	70	69.6 Å²	69.6	37%	0.374	38%	0.382	S	S	.	.	H	α-helix	trans	-64.3	-48.6	173.7	-75.4	-52.4	0	0	0	111.8	E736 T737 A742 R743 D744	E736-N740 PolarHBondContact O-N 2.98Å; E736-N740 PolarHBondContact O-ND2 2.78Å; T737-N740 PolarHBondContact O-N 3.09Å; N740-A742 PolarHBondContact O-N 3.31Å; N740-A742 VanDerWaalsContact O-N 3.16Å; N740-R743 PolarHBondContact O-N 3.44Å; N740-R743 PolarHBondContact OD1-NH1 3.23Å; N740-D744 PolarHBondContact O-N 3.42Å; N740-D744 VanDerWaalsContact O-N 3.13Å
741	V	92.1	Very high	90.4	Very high	50 Å²	50	75 Å²	75	30%	0.303	40%	0.403	S	S	.	.	H	α-helix	trans	-55.5	-35	173.8	172.6	0	0	0	0	111.8	T737 L738 R745 W787	T737-V741 WeakPolarHBondContact O-CG2 3.42Å; T737-V741 PolarHBondContact O-N 2.75Å; L738-V741 PolarHBondContact O-N 3.19Å; V741-R745 WeakPolarHBondContact O-CB 3.49Å; V741-R745 PolarHBondContact O-N 3.08Å; V741-R745 VanDerWaalsContact O-N 3.15Å; V741-W787 HydrophobicContact CG1-CD2 4.03Å; V741-W787 HydrophobicContact CG1-CE3 4.08Å; V741-W787 HydrophobicContact CG1-CZ2 4.46Å; V741-W787 HydrophobicContact CG1-CZ3 4.33Å
742	A	90.1	Very high	90.6	Very high	23 Å²	23	76.3 Å²	76.3	19%	0.19	40%	0.4	C	S	.	.	H	α-helix	trans	-74.8	-26	177.3	0	0	0	0	0	115.6	L738 L739 N740 V783	L738-A742 WeakPolarHBondContact O-CB 3.45Å; L738-A742 PolarHBondContact O-N 3.07Å; L739-A742 WeakPolarHBondContact O-CB 3.46Å; L739-A742 PolarHBondContact O-N 3.5Å; N740-A742 PolarHBondContact O-N 3.31Å; N740-A742 VanDerWaalsContact O-N 3.16Å; A742-V783 HydrophobicContact CB-CG1 3.42Å; A742-V783 VanDerWaalsContact CB-CG1 3.42Å
743	R	88.1	Confident	91	Very high	141 Å²	141	70.3 Å²	70.3	53%	0.532	36%	0.361	S	S	.	.	H	α-helix	trans	-74.3	-37.6	172.9	-67.7	161	-166.1	150.7	4	110.4	E736 L739 N740	E736-R743 IonicContact OE1-CZ 3.95Å; E736-R743 IonicContact OE1-NH1 2.75Å; E736-R743 PolarHBondContact OE1-NH1 2.92Å; E736-R743 IonicContact OE1-NH2 2.65Å; E736-R743 PolarHBondContact OE1-NH2 3.18Å; E736-R743 IonicContact OE2-NH2 2.68Å; L739-R743 VanDerWaalsContact O-CG 3.29Å; L739-R743 WeakPolarHBondContact O-CG 3.4Å; L739-R743 PolarHBondContact O-N 2.85Å; N740-R743 PolarHBondContact O-N 3.44Å; N740-R743 PolarHBondContact OD1-NH1 3.23Å
744	D	87.6	Confident	91	Very high	136 Å²	136	69.5 Å²	69.5	73%	0.727	35%	0.354	S	S	*	.	H	α-helix	trans	-83.2	-20.1	-175.4	-67.7	-17.8	0	0	0	114.5	N740	N740-D744 PolarHBondContact O-N 3.42Å; N740-D744 VanDerWaalsContact O-N 3.13Å
745	R	85.9	Confident	90.9	Very high	162 Å²	162	72.7 Å²	72.7	61%	0.611	37%	0.374	S	S	*	.	S	Bend	trans	-133.5	135.2	-170.7	-59.6	-173.7	-179	-165.8	-0.5	113.5	V741 N747 W787	V741-R745 WeakPolarHBondContact O-CB 3.49Å; V741-R745 PolarHBondContact O-N 3.08Å; V741-R745 VanDerWaalsContact O-N 3.15Å; R745-N747 PolarHBondContact O-N 3.26Å; R745-W787 HydrophobicContact CB-CH2 3.81Å; R745-W787 HydrophobicContact CB-CZ2 3.73Å
746	P	82.1	Confident	90.9	Very high	129 Å²	129	72.2 Å²	72.2	84%	0.838	37%	0.372	S	S	*	.			trans	-67.6	124.8	174.8	28.9	-34	0	0	0	110.5
747	N	85.4	Confident	90.8	Very high	20 Å²	20	68.4 Å²	68.4	11%	0.107	36%	0.355	C	S	.	.			trans	-102.8	129.4	177	-175.5	-36.7	0	0	0	110	R745 A749 S750 S786 W787	R745-N747 PolarHBondContact O-N 3.26Å; N747-A749 PolarHBondContact O-N 3.32Å; N747-A749 VanDerWaalsContact O-N 3.16Å; N747-A749 VanDerWaalsContact OD1-CB 3.25Å; N747-A749 WeakPolarHBondContact OD1-CB 3.42Å; N747-A749 PolarHBondContact OD1-N 3.09Å; N747-S750 PolarHBondContact O-N 3.34Å; N747-S750 VanDerWaalsContact O-N 3.12Å; N747-S750 PolarHBondContact O-OG 3.32Å; N747-S786 PolarHBondContact ND2-OG 3.41Å; N747-W787 HydrophobicContact CB-CZ2 3.77Å; N747-W787 VanDerWaalsContact ND2-CD1 3.33Å; N747-W787 PolarHBondContact ND2-NE1 3Å; N747-W787 VanDerWaalsContact ND2-NE1 3.15Å
748	P	85.8	Confident	90.4	Very high	123 Å²	123	70.1 Å²	70.1	80%	0.799	36%	0.361	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.9	-30.8	177.1	-27.1	35.6	0	0	0	114.5
749	A	89.4	Confident	90.1	Very high	12 Å²	12	73.3 Å²	73.3	10%	0.099	37%	0.372	C	S	.	.	T	Hydrogen-bonded Turn	trans	-70.3	-28.3	179.2	0	0	0	0	0	113.7	N747 K751 Q752 I753	N747-A749 PolarHBondContact O-N 3.32Å; N747-A749 VanDerWaalsContact O-N 3.16Å; N747-A749 VanDerWaalsContact OD1-CB 3.25Å; N747-A749 WeakPolarHBondContact OD1-CB 3.42Å; N747-A749 PolarHBondContact OD1-N 3.09Å; A749-K751 VanDerWaalsContact C-N 3.26Å; A749-K751 PolarHBondContact O-N 2.79Å; A749-K751 VanDerWaalsContact O-N 3.12Å; A749-Q752 PolarHBondContact O-N 2.82Å; A749-I753 HydrophobicContact CB-CD1 3.94Å; A749-I753 WeakPolarHBondContact O-CG1 3.46Å; A749-I753 PolarHBondContact O-N 3.04Å
750	S	89.6	Confident	90	Very high	37 Å²	37	73 Å²	73	26%	0.259	37%	0.37	S	S	.	.	H	α-helix	trans	-55.3	-39.2	-169.9	-61.9	0	0	0	0	113.2	N747 Q752 I753 E754	N747-S750 PolarHBondContact O-N 3.34Å; N747-S750 VanDerWaalsContact O-N 3.12Å; N747-S750 PolarHBondContact O-OG 3.32Å; S750-Q752 VanDerWaalsContact C-N 3.34Å; S750-Q752 PolarHBondContact O-N 2.93Å; S750-I753 PolarHBondContact O-N 3.01Å; S750-E754 WeakPolarHBondContact O-CG 3.29Å; S750-E754 PolarHBondContact O-N 2.98Å
751	K	90.1	Very high	89.9	Confident	176 Å²	176	69.7 Å²	69.7	77%	0.765	35%	0.352	S	S	*	.	H	α-helix	trans	-60.8	-41	177.6	-69.5	-174.4	177.4	-177	0	112.7	A749 L755	A749-K751 VanDerWaalsContact C-N 3.26Å; A749-K751 PolarHBondContact O-N 2.79Å; A749-K751 VanDerWaalsContact O-N 3.12Å; K751-L755 WeakPolarHBondContact O-CG 3.48Å; K751-L755 PolarHBondContact O-N 3.27Å
752	Q	93.1	Very high	89.6	Confident	78 Å²	78	70.9 Å²	70.9	36%	0.364	36%	0.361	S	S	.	.	H	α-helix	trans	-76.9	-32.3	178.4	-169.5	60.3	61.5	0	0	111.7	A749 S750 D756 Y794	A749-Q752 PolarHBondContact O-N 2.82Å; S750-Q752 VanDerWaalsContact C-N 3.34Å; S750-Q752 PolarHBondContact O-N 2.93Å; Q752-D756 PolarHBondContact NE2-OD1 2.9Å; Q752-D756 WeakPolarHBondContact O-CB 3.32Å; Q752-D756 VanDerWaalsContact O-CG 3.31Å; Q752-D756 PolarHBondContact O-N 3.33Å; Q752-D756 VanDerWaalsContact O-N 3.16Å; Q752-Y794 HydrophobicContact CB-CD1 4.12Å; Q752-Y794 HydrophobicContact CB-CE1 4.41Å; Q752-Y794 HydrophobicContact CG-CD1 3.82Å; Q752-Y794 HydrophobicContact CG-CE1 3.77Å
753	I	95.4	Very high	89.4	Confident	0 Å²	0	72.8 Å²	72.8	0%	0	37%	0.368	C	S	.	.	H	α-helix	trans	-61.1	-52.5	173.9	-68.1	167.2	0	0	0	110	A749 S750 L755 D756 L757 L782 V783 Y794	A749-I753 HydrophobicContact CB-CD1 3.94Å; A749-I753 WeakPolarHBondContact O-CG1 3.46Å; A749-I753 PolarHBondContact O-N 3.04Å; S750-I753 PolarHBondContact O-N 3.01Å; I753-L755 VanDerWaalsContact C-N 3.32Å; I753-L755 PolarHBondContact O-N 2.94Å; I753-D756 WeakPolarHBondContact O-CA 3.48Å; I753-D756 WeakPolarHBondContact O-CB 3.5Å; I753-D756 PolarHBondContact O-N 2.88Å; I753-L757 HydrophobicContact CG2-CD2 4.21Å; I753-L757 HydrophobicContact CG2-CG 4.33Å; I753-L757 WeakPolarHBondContact O-CG 3.34Å; I753-L757 PolarHBondContact O-N 2.81Å; I753-L782 HydrophobicContact CD1-CB 3.99Å; I753-L782 HydrophobicContact CG1-CB 4.23Å; I753-L782 HydrophobicContact CG2-CB 4.08Å; I753-L782 HydrophobicContact CG2-CD1 4.04Å; I753-V783 HydrophobicContact CD1-CG2 3.75Å; I753-V783 HydrophobicContact CG2-CG2 4.31Å; I753-Y794 HydrophobicContact CD1-CD2 4.19Å; I753-Y794 HydrophobicContact CD1-CG 4.38Å; I753-Y794 HydrophobicContact CG1-CD1 4.27Å; I753-Y794 HydrophobicContact CG1-CD2 3.63Å; I753-Y794 HydrophobicContact CG1-CE2 4.02Å; I753-Y794 HydrophobicContact CG1-CG 3.78Å
754	E	92.9	Very high	89.6	Confident	80 Å²	80	66 Å²	66	37%	0.374	34%	0.343	S	S	.	.	H	α-helix	trans	-58.1	-41	179.5	-63.8	-51	130.9	0	0	113.1	S750 D756 L757 R779	S750-E754 WeakPolarHBondContact O-CG 3.29Å; S750-E754 PolarHBondContact O-N 2.98Å; E754-D756 PolarHBondContact O-N 3.43Å; E754-L757 PolarHBondContact O-N 2.58Å; E754-L757 WeakPolarHBondContact OE2-CD1 3.43Å; E754-R779 VanDerWaalsContact CD-NE 3.32Å; E754-R779 VanDerWaalsContact OE1-CD 3.29Å; E754-R779 WeakPolarHBondContact OE1-CD 3.43Å; E754-R779 IonicContact OE1-CZ 2.84Å; E754-R779 IonicContact OE1-NE 3.94Å; E754-R779 PolarHBondContact OE1-NE 3.28Å; E754-R779 IonicContact OE1-NH2 2.64Å; E754-R779 IonicContact OE2-CZ 3.64Å; E754-R779 IonicContact OE2-NE 3.66Å; E754-R779 PolarHBondContact OE2-NE 3.42Å; E754-R779 VanDerWaalsContact OE2-NE 3.12Å; E754-R779 IonicContact OE2-NH2 3.72Å; E754-R779 PolarHBondContact OE2-NH2 2.67Å
755	L	92.9	Very high	89.7	Confident	116 Å²	116	64 Å²	64	61%	0.607	33%	0.328	S	S	*	.	H	α-helix	trans	-63.8	-23.1	174.9	-72.1	172.2	0	0	0	113.2	K751 I753 R759	K751-L755 WeakPolarHBondContact O-CG 3.48Å; K751-L755 PolarHBondContact O-N 3.27Å; I753-L755 VanDerWaalsContact C-N 3.32Å; I753-L755 PolarHBondContact O-N 2.94Å; L755-R759 WeakPolarHBondContact O-CD 3.21Å; L755-R759 WeakPolarHBondContact O-CG 3.38Å; L755-R759 PolarHBondContact O-NE 2.96Å
756	D	94.8	Very high	89.9	Confident	0 Å²	0	58 Å²	58	0%	0	31%	0.306	C	S	.	.	H	α-helix	trans	-93.2	-30.5	-178.5	-78.6	26	0	0	0	112.8	Q752 I753 E754 L758 R759 T760 Y794 N799	Q752-D756 PolarHBondContact NE2-OD1 2.9Å; Q752-D756 WeakPolarHBondContact O-CB 3.32Å; Q752-D756 VanDerWaalsContact O-CG 3.31Å; Q752-D756 PolarHBondContact O-N 3.33Å; Q752-D756 VanDerWaalsContact O-N 3.16Å; I753-D756 WeakPolarHBondContact O-CA 3.48Å; I753-D756 WeakPolarHBondContact O-CB 3.5Å; I753-D756 PolarHBondContact O-N 2.88Å; E754-D756 PolarHBondContact O-N 3.43Å; D756-L758 PolarHBondContact O-N 3.29Å; D756-R759 CarbonylContact O-C 3.5Å; D756-R759 VanDerWaalsContact O-CG 3.29Å; D756-R759 WeakPolarHBondContact O-CG 3.37Å; D756-R759 PolarHBondContact O-N 2.96Å; D756-R759 IonicContact OD1-CZ 2.71Å; D756-R759 VanDerWaalsContact OD1-CZ 3.29Å; D756-R759 IonicContact OD1-NE 3.73Å; D756-R759 PolarHBondContact OD1-NE 3.14Å; D756-R759 VanDerWaalsContact OD1-NE 3.09Å; D756-R759 IonicContact OD1-NH2 3.77Å; D756-R759 PolarHBondContact OD1-NH2 3.06Å; D756-R759 IonicContact OD2-NH2 2.66Å; D756-T760 PolarHBondContact O-N 2.96Å; D756-T760 PolarHBondContact O-OG1 2.66Å; D756-Y794 WeakPolarHBondContact CB-OH 3Å; D756-Y794 VanDerWaalsContact CG-OH 3.29Å; D756-Y794 WeakPolarHBondContact OD2-CE1 3.23Å; D756-Y794 PolarHBondContact OD2-OH 3.3Å; D756-N799 HydrophobicContact CB-CB 4.4Å
757	L	92.5	Very high	90.4	Very high	1 Å²	1	51.9 Å²	51.9	1%	0.005	27%	0.266	C	S	.	.	H	α-helix	trans	-52.4	-56.8	-176.6	-67.4	179.7	0	0	0	112.5	I753 E754 R759 T760 I775 L778 R779 L782	I753-L757 HydrophobicContact CG2-CD2 4.21Å; I753-L757 HydrophobicContact CG2-CG 4.33Å; I753-L757 WeakPolarHBondContact O-CG 3.34Å; I753-L757 PolarHBondContact O-N 2.81Å; E754-L757 PolarHBondContact O-N 2.58Å; E754-L757 WeakPolarHBondContact OE2-CD1 3.43Å; L757-R759 PolarHBondContact O-N 3.26Å; L757-T760 WeakPolarHBondContact O-CB 3.4Å; L757-T760 PolarHBondContact O-N 3.32Å; L757-T760 VanDerWaalsContact O-N 3.11Å; L757-I775 HydrophobicContact CB-CD1 4.5Å; L757-I775 HydrophobicContact CB-CG2 4.28Å; L757-I775 HydrophobicContact CD1-CG2 4.11Å; L757-L778 HydrophobicContact CD2-CB 4.06Å; L757-L778 HydrophobicContact CD2-CD2 3.72Å; L757-L778 HydrophobicContact CD2-CG 3.63Å; L757-R779 HydrophobicContact CD1-CB 3.86Å; L757-R779 HydrophobicContact CD1-CG 4.25Å; L757-R779 VanDerWaalsContact CD1-NH2 3.35Å; L757-R779 HydrophobicContact CD2-CB 4.3Å; L757-L782 HydrophobicContact CD2-CD1 4.29Å
758	L	86.5	Confident	90.4	Very high	97 Å²	97	53.6 Å²	53.6	51%	0.508	28%	0.283	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.5	-9.6	-174.4	-57.1	-176.7	0	0	0	114.1	D756 P770 I775	D756-L758 PolarHBondContact O-N 3.29Å; L758-P770 HydrophobicContact CD1-CG 4.15Å; L758-P770 HydrophobicContact CD2-CB 3.85Å; L758-P770 HydrophobicContact CD2-CG 3.89Å; L758-I775 HydrophobicContact CD2-CD1 4.22Å; L758-I775 HydrophobicContact CD2-CG2 4.49Å
759	R	90.3	Very high	90.3	Very high	82 Å²	82	49.8 Å²	49.8	31%	0.309	26%	0.26	S	S	.	.	T	Hydrogen-bonded Turn	trans	-104.9	11.1	172.7	64.7	-179	-172.9	142	2.5	113.1	L755 D756 L757 Q796	L755-R759 WeakPolarHBondContact O-CD 3.21Å; L755-R759 WeakPolarHBondContact O-CG 3.38Å; L755-R759 PolarHBondContact O-NE 2.96Å; D756-R759 CarbonylContact O-C 3.5Å; D756-R759 VanDerWaalsContact O-CG 3.29Å; D756-R759 WeakPolarHBondContact O-CG 3.37Å; D756-R759 PolarHBondContact O-N 2.96Å; D756-R759 IonicContact OD1-CZ 2.71Å; D756-R759 VanDerWaalsContact OD1-CZ 3.29Å; D756-R759 IonicContact OD1-NE 3.73Å; D756-R759 PolarHBondContact OD1-NE 3.14Å; D756-R759 VanDerWaalsContact OD1-NE 3.09Å; D756-R759 IonicContact OD1-NH2 3.77Å; D756-R759 PolarHBondContact OD1-NH2 3.06Å; D756-R759 IonicContact OD2-NH2 2.66Å; L757-R759 PolarHBondContact O-N 3.26Å; R759-Q796 VanDerWaalsContact NH2-CD 3.34Å
760	T	92.4	Very high	89.9	Confident	0 Å²	0	53.7 Å²	53.7	0%	0	28%	0.284	C	S	.	.	S	Bend	trans	-96.8	118	178.4	-57.3	0	0	0	0	110.5	D756 L757 Y767 L778 N799 A803	D756-T760 PolarHBondContact O-N 2.96Å; D756-T760 PolarHBondContact O-OG1 2.66Å; L757-T760 WeakPolarHBondContact O-CB 3.4Å; L757-T760 PolarHBondContact O-N 3.32Å; L757-T760 VanDerWaalsContact O-N 3.11Å; T760-Y767 VanDerWaalsContact O-CB 3.31Å; T760-Y767 WeakPolarHBondContact O-CB 3.17Å; T760-L778 HydrophobicContact CG2-CD2 3.83Å; T760-N799 HydrophobicContact CG2-CB 4.29Å; T760-N799 PolarHBondContact OG1-ND2 2.93Å; T760-A803 HydrophobicContact CG2-CB 3.49Å; T760-A803 VanDerWaalsContact CG2-CB 3.49Å
761	L	90.2	Very high	89.3	Confident	0 Å²	0	57.1 Å²	57.1	0%	0	31%	0.308	C	S	.	.	S	Bend	trans	47.2	50.6	180	-50	-174.6	0	0	0	114.1	F642 N763 N764 Y767 A803 I804 V880 D881	F642-L761 HydrophobicContact CE1-CB 4.39Å; F642-L761 HydrophobicContact CE1-CD1 4.22Å; F642-L761 HydrophobicContact CE1-CD2 4.22Å; F642-L761 HydrophobicContact CZ-CD1 4.18Å; L761-N763 PolarHBondContact O-N 3.39Å; L761-N763 VanDerWaalsContact O-N 3.08Å; L761-N764 HydrophobicContact CB-CB 4Å; L761-N764 WeakPolarHBondContact O-CB 3.1Å; L761-N764 PolarHBondContact O-N 3Å; L761-Y767 HydrophobicContact CB-CD2 3.88Å; L761-Y767 HydrophobicContact CB-CG 4.48Å; L761-Y767 HydrophobicContact CD1-CD2 4.02Å; L761-Y767 HydrophobicContact CD1-CE2 3.92Å; L761-Y767 HydrophobicContact CG-CD2 4.42Å; L761-A803 HydrophobicContact CD1-CB 3.7Å; L761-A803 HydrophobicContact CG-CB 4.15Å; L761-I804 HydrophobicContact CD1-CD1 3.8Å; L761-I804 HydrophobicContact CD1-CG1 4.34Å; L761-V880 HydrophobicContact CD2-CG1 3.52Å; L761-D881 WeakPolarHBondContact CD2-OD1 2.97Å
762	P	86.7	Confident	89.1	Confident	75 Å²	75	49.3 Å²	49.3	49%	0.487	28%	0.276	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.7	-16.5	-175.7	29.4	-37	0	0	0	113.4	N764 A768	P762-N764 VanDerWaalsContact C-N 3.31Å; P762-A768 WeakPolarHBondContact O-CB 3.26Å
763	N	85.9	Confident	88.5	Confident	63 Å²	63	48 Å²	48	34%	0.337	28%	0.284	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.6	-2.2	171.6	62.7	-20.9	0	0	0	113.8	F642 K643 L761	F642-N763 CarbonylContact C-O 3.57Å; F642-N763 WeakPolarHBondContact CA-O 3.35Å; K643-N763 PolarHBondContact N-O 2.92Å; L761-N763 PolarHBondContact O-N 3.39Å; L761-N763 VanDerWaalsContact O-N 3.08Å
764	N	91.4	Very high	88.2	Confident	0 Å²	0	48 Å²	48	0%	0	28%	0.284	C	S	.	.	B	Isolated β-bridge	trans	-105.2	130.2	179	-171	-71.4	0	0	0	111.8	Y640 G641 F642 L761 P762 H766 Y767 A768	Y640-N764 PolarHBondContact O-ND2 2.96Å; Y640-N764 VanDerWaalsContact O-ND2 3.07Å; G641-N764 CarbonylContact O-C 3.57Å; G641-N764 VanDerWaalsContact O-CA 3.23Å; G641-N764 WeakPolarHBondContact O-CA 3.46Å; G641-N764 PolarHBondContact O-ND2 3.1Å; F642-N764 HydrophobicContact CD1-CB 3.74Å; F642-N764 WeakPolarHBondContact CD2-ND2 3.42Å; F642-N764 HydrophobicContact CE1-CB 3.76Å; F642-N764 WeakPolarHBondContact CE2-ND2 3.41Å; F642-N764 HydrophobicContact CG-CB 4.37Å; F642-N764 HydrophobicContact CZ-CB 4.4Å; L761-N764 HydrophobicContact CB-CB 4Å; L761-N764 WeakPolarHBondContact O-CB 3.1Å; L761-N764 PolarHBondContact O-N 3Å; P762-N764 VanDerWaalsContact C-N 3.31Å; N764-H766 PolarHBondContact O-N 3.25Å; N764-H766 PolarHBondContact OD1-CD2 2.84Å; N764-H766 VanDerWaalsContact OD1-CD2 3.29Å; N764-H766 PolarHBondContact OD1-N 3.45Å; N764-Y767 HydrophobicContact CB-CD2 4.24Å; N764-Y767 PolarHBondContact O-N 3.11Å; N764-A768 WeakPolarHBondContact O-CB 3.08Å; N764-A768 PolarHBondContact O-N 3.39Å
765	K	89.9	Confident	88.3	Confident	94 Å²	94	44.3 Å²	44.3	41%	0.409	27%	0.267	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.1	-23.8	-176.2	71.1	-169.5	-178.2	-169.8	0	115	Y637 G641	Y637-K765 HydrophobicContact CD1-CB 3.92Å; Y637-K765 HydrophobicContact CE1-CB 3.75Å; Y637-K765 HydrophobicContact CG-CB 4.38Å; Y637-K765 HydrophobicContact CG-CD 4.33Å; G641-K765 PolarHBondContact O-N 2.66Å
766	H	90.3	Very high	88.2	Confident	34 Å²	34	42.5 Å²	42.5	16%	0.157	26%	0.258	C	S	.	.	T	Hydrogen-bonded Turn	trans	-86.6	-7.9	-180	-57.4	-74.8	0	0	0	114.5	L205 N764 A772 G774	L205-H766 HydrophobicContact CB-CB 4.23Å; L205-H766 HydrophobicContact CD1-CB 4.07Å; L205-H766 PolarHBondContact O-CE1 3.09Å; L205-H766 PolarHBondContact O-NE2 3.33Å; N764-H766 PolarHBondContact O-N 3.25Å; N764-H766 PolarHBondContact OD1-CD2 2.84Å; N764-H766 VanDerWaalsContact OD1-CD2 3.29Å; N764-H766 PolarHBondContact OD1-N 3.45Å; H766-A772 VanDerWaalsContact O-CB 3.24Å; H766-A772 WeakPolarHBondContact O-CB 3.42Å; H766-G774 WeakPolarHBondContact O-CA 3.5Å; H766-G774 PolarHBondContact O-N 2.86Å
767	Y	92	Very high	88.3	Confident	2 Å²	2	44.4 Å²	44.4	1%	0.008	27%	0.266	C	S	.	.	T	Hydrogen-bonded Turn	trans	-131.5	-9.3	-179.6	-55	-71.1	0	0	0	113.9	L205 T760 L761 N764 S769 G774 I775 L778 A803 L806 L807	L205-Y767 HydrophobicContact CD1-CE1 4.25Å; L205-Y767 HydrophobicContact CD1-CE2 4.43Å; L205-Y767 VanDerWaalsContact CD1-OH 3.28Å; L205-Y767 WeakPolarHBondContact CD1-OH 3.41Å; T760-Y767 VanDerWaalsContact O-CB 3.31Å; T760-Y767 WeakPolarHBondContact O-CB 3.17Å; L761-Y767 HydrophobicContact CB-CD2 3.88Å; L761-Y767 HydrophobicContact CB-CG 4.48Å; L761-Y767 HydrophobicContact CD1-CD2 4.02Å; L761-Y767 HydrophobicContact CD1-CE2 3.92Å; L761-Y767 HydrophobicContact CG-CD2 4.42Å; N764-Y767 HydrophobicContact CB-CD2 4.24Å; N764-Y767 PolarHBondContact O-N 3.11Å; Y767-S769 PolarHBondContact O-N 3.2Å; Y767-G774 VanDerWaalsContact CE1-C 3.5Å; Y767-I775 HydrophobicContact CD1-CD1 4.12Å; Y767-L778 HydrophobicContact CD1-CD2 4.38Å; Y767-L778 HydrophobicContact CE1-CB 4.25Å; Y767-L778 HydrophobicContact CE1-CD2 4.22Å; Y767-A803 HydrophobicContact CE1-CB 4.27Å; Y767-A803 HydrophobicContact CE2-CB 3.93Å; Y767-A803 VanDerWaalsContact OH-CA 3.31Å; Y767-A803 WeakPolarHBondContact OH-CA 3.27Å; Y767-A803 PolarHBondContact OH-O 3.4Å; Y767-L806 WeakPolarHBondContact OH-CB 3.29Å; Y767-L807 HydrophobicContact CE2-CD2 3.93Å
768	A	85.8	Confident	88.5	Confident	56 Å²	56	44.4 Å²	44.4	46%	0.463	27%	0.266	S	S	.	.	S	Bend	trans	-63	-9.7	-175.8	0	0	0	0	0	116.1	P762 N764	P762-A768 WeakPolarHBondContact O-CB 3.26Å; N764-A768 WeakPolarHBondContact O-CB 3.08Å; N764-A768 PolarHBondContact O-N 3.39Å
769	S	83.2	Confident	88.9	Confident	43 Å²	43	43 Å²	43	30%	0.301	25%	0.254	S	S	.	.	S	Bend	trans	-138.1	154.4	174.7	78.9	0	0	0	0	112.3	Y767 S771 A772 I775	Y767-S769 PolarHBondContact O-N 3.2Å; S769-S771 PolarHBondContact O-N 3.07Å; S769-S771 VanDerWaalsContact O-N 3.15Å; S769-S771 PolarHBondContact OG-N 2.87Å; S769-S771 PolarHBondContact OG-OG 3.09Å; S769-A772 VanDerWaalsContact O-CB 3.28Å; S769-A772 WeakPolarHBondContact O-CB 3.46Å; S769-A772 PolarHBondContact O-N 2.9Å; S769-A772 PolarHBondContact OG-N 2.86Å; S769-A772 VanDerWaalsContact OG-N 3.17Å; S769-I775 WeakPolarHBondContact O-CG1 3.35Å
770	P	81.1	Confident	89.2	Confident	94 Å²	94	41.5 Å²	41.5	61%	0.61	25%	0.252	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61	-21.4	174.1	-22.2	32.9	0	0	0	114.4	L758	L758-P770 HydrophobicContact CD1-CG 4.15Å; L758-P770 HydrophobicContact CD2-CB 3.85Å; L758-P770 HydrophobicContact CD2-CG 3.89Å
771	S	78.5	Confident	89.5	Confident	108 Å²	108	41.5 Å²	41.5	76%	0.755	25%	0.252	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.4	-6.3	176.7	53.5	0	0	0	0	113.8	S769	S769-S771 PolarHBondContact O-N 3.07Å; S769-S771 VanDerWaalsContact O-N 3.15Å; S769-S771 PolarHBondContact OG-N 2.87Å; S769-S771 PolarHBondContact OG-OG 3.09Å
772	A	84.6	Confident	89.8	Confident	13 Å²	13	41.6 Å²	41.6	11%	0.107	25%	0.252	C	S	.	.	S	Bend	trans	-69	133.2	-177.8	0	0	0	0	0	111.4	H766 S769 G774 I775	H766-A772 VanDerWaalsContact O-CB 3.24Å; H766-A772 WeakPolarHBondContact O-CB 3.42Å; S769-A772 VanDerWaalsContact O-CB 3.28Å; S769-A772 WeakPolarHBondContact O-CB 3.46Å; S769-A772 PolarHBondContact O-N 2.9Å; S769-A772 PolarHBondContact OG-N 2.86Å; S769-A772 VanDerWaalsContact OG-N 3.17Å; A772-G774 PolarHBondContact O-N 2.86Å; A772-I775 WeakPolarHBondContact O-CB 3.42Å; A772-I775 PolarHBondContact O-N 3.23Å
773	G	81.4	Confident	90.3	Very high	51 Å²	51	38.6 Å²	38.6	53%	0.526	23%	0.233	S	C	.	.	H	α-helix	trans	-59.6	-20.4	-172.5	0	0	0	0	0	115.3
774	G	89.9	Confident	90.8	Very high	0 Å²	0	35.6 Å²	35.6	0%	0	22%	0.217	C	C	.	.	H	α-helix	trans	-67.2	-34.3	174	0	0	0	0	0	113.5	H766 Y767 A772 N776 K777 L778	H766-G774 WeakPolarHBondContact O-CA 3.5Å; H766-G774 PolarHBondContact O-N 2.86Å; Y767-G774 VanDerWaalsContact CE1-C 3.5Å; A772-G774 PolarHBondContact O-N 2.86Å; G774-N776 VanDerWaalsContact C-N 3.35Å; G774-N776 PolarHBondContact O-N 2.98Å; G774-K777 PolarHBondContact O-N 3.01Å; G774-L778 VanDerWaalsContact O-CB 3.27Å; G774-L778 WeakPolarHBondContact O-CB 3.26Å; G774-L778 PolarHBondContact O-N 2.67Å
775	I	93.2	Very high	91.1	Very high	2 Å²	2	35.7 Å²	35.7	1%	0.01	22%	0.217	C	C	.	.	H	α-helix	trans	-59.9	-43.4	-176.9	-64	-64.9	0	0	0	111.7	L757 L758 Y767 S769 A772 L778 R779	L757-I775 HydrophobicContact CB-CD1 4.5Å; L757-I775 HydrophobicContact CB-CG2 4.28Å; L757-I775 HydrophobicContact CD1-CG2 4.11Å; L758-I775 HydrophobicContact CD2-CD1 4.22Å; L758-I775 HydrophobicContact CD2-CG2 4.49Å; Y767-I775 HydrophobicContact CD1-CD1 4.12Å; S769-I775 WeakPolarHBondContact O-CG1 3.35Å; A772-I775 WeakPolarHBondContact O-CB 3.42Å; A772-I775 PolarHBondContact O-N 3.23Å; I775-L778 PolarHBondContact O-N 2.86Å; I775-R779 PolarHBondContact O-N 2.83Å
776	N	92.6	Very high	91.4	Very high	78 Å²	78	31.4 Å²	31.4	42%	0.417	20%	0.199	S	C	.	.	H	α-helix	trans	-71.7	-39.3	179.3	-69.3	-19.6	0	0	0	112.2	G774 L778 R779 N780	G774-N776 VanDerWaalsContact C-N 3.35Å; G774-N776 PolarHBondContact O-N 2.98Å; N776-L778 VanDerWaalsContact C-N 3.33Å; N776-R779 PolarHBondContact O-N 2.82Å; N776-R779 PolarHBondContact OD1-NH1 3.28Å; N776-N780 VanDerWaalsContact O-CG 3.3Å; N776-N780 PolarHBondContact O-N 3.05Å; N776-N780 PolarHBondContact O-ND2 2.96Å
777	K	95.2	Very high	91.6	Very high	40 Å²	40	32.7 Å²	32.7	17%	0.174	20%	0.202	C	C	.	.	H	α-helix	trans	-60.6	-44.1	172.3	-67.8	-167.7	-177.6	-175.3	0	111	L205 G774 N780 V781 L806 Q811	L205-K777 HydrophobicContact CD2-CD 4.08Å; L205-K777 HydrophobicContact CG-CD 4.39Å; G774-K777 PolarHBondContact O-N 3.01Å; K777-N780 PolarHBondContact O-N 3.44Å; K777-V781 WeakPolarHBondContact O-CG2 3.45Å; K777-V781 PolarHBondContact O-N 3.06Å; K777-V781 VanDerWaalsContact O-N 3.14Å; K777-L806 HydrophobicContact CB-CD1 3.9Å; K777-L806 HydrophobicContact CB-CD2 3.9Å; K777-L806 HydrophobicContact CD-CD2 4.15Å; K777-Q811 HydrophobicContact CB-CG 3.82Å; K777-Q811 HydrophobicContact CD-CG 4Å; K777-Q811 HydrophobicContact CG-CG 3.73Å
778	L	96.8	Very high	91.7	Very high	0 Å²	0	34.9 Å²	34.9	0%	0	21%	0.21	C	C	.	.	H	α-helix	trans	-63.4	-44.5	-179.8	-178.7	61.5	0	0	0	112.2	L757 T760 Y767 G774 I775 N776 N780 V781 L782 A802 A803 L806	L757-L778 HydrophobicContact CD2-CB 4.06Å; L757-L778 HydrophobicContact CD2-CD2 3.72Å; L757-L778 HydrophobicContact CD2-CG 3.63Å; T760-L778 HydrophobicContact CG2-CD2 3.83Å; Y767-L778 HydrophobicContact CD1-CD2 4.38Å; Y767-L778 HydrophobicContact CE1-CB 4.25Å; Y767-L778 HydrophobicContact CE1-CD2 4.22Å; G774-L778 VanDerWaalsContact O-CB 3.27Å; G774-L778 WeakPolarHBondContact O-CB 3.26Å; G774-L778 PolarHBondContact O-N 2.67Å; I775-L778 PolarHBondContact O-N 2.86Å; N776-L778 VanDerWaalsContact C-N 3.33Å; L778-N780 PolarHBondContact O-N 3.08Å; L778-V781 PolarHBondContact O-N 2.59Å; L778-L782 HydrophobicContact CD1-CD1 3.84Å; L778-L782 HydrophobicContact CD1-CG 4.09Å; L778-L782 HydrophobicContact CG-CD1 3.9Å; L778-L782 VanDerWaalsContact O-CG 3.28Å; L778-L782 WeakPolarHBondContact O-CG 3.27Å; L778-L782 PolarHBondContact O-N 3.24Å; L778-L782 VanDerWaalsContact O-N 3.1Å; L778-A802 HydrophobicContact CD1-CB 3.6Å; L778-A803 HydrophobicContact CD1-CB 4.07Å; L778-A803 HydrophobicContact CD2-CB 4.24Å; L778-L806 HydrophobicContact CB-CD1 4.03Å; L778-L806 HydrophobicContact CD1-CD1 4.27Å
779	R	95.9	Very high	92	Very high	68 Å²	68	33.4 Å²	33.4	26%	0.257	20%	0.195	S	C	.	.	H	α-helix	trans	-54	-52.3	173.6	-176.2	-175.9	-68.7	104	0.3	111.5	E754 L757 I775 N776 V781 L782 V783	E754-R779 VanDerWaalsContact CD-NE 3.32Å; E754-R779 VanDerWaalsContact OE1-CD 3.29Å; E754-R779 WeakPolarHBondContact OE1-CD 3.43Å; E754-R779 IonicContact OE1-CZ 2.84Å; E754-R779 IonicContact OE1-NE 3.94Å; E754-R779 PolarHBondContact OE1-NE 3.28Å; E754-R779 IonicContact OE1-NH2 2.64Å; E754-R779 IonicContact OE2-CZ 3.64Å; E754-R779 IonicContact OE2-NE 3.66Å; E754-R779 PolarHBondContact OE2-NE 3.42Å; E754-R779 VanDerWaalsContact OE2-NE 3.12Å; E754-R779 IonicContact OE2-NH2 3.72Å; E754-R779 PolarHBondContact OE2-NH2 2.67Å; L757-R779 HydrophobicContact CD1-CB 3.86Å; L757-R779 HydrophobicContact CD1-CG 4.25Å; L757-R779 VanDerWaalsContact CD1-NH2 3.35Å; L757-R779 HydrophobicContact CD2-CB 4.3Å; I775-R779 PolarHBondContact O-N 2.83Å; N776-R779 PolarHBondContact O-N 2.82Å; N776-R779 PolarHBondContact OD1-NH1 3.28Å; R779-V781 PolarHBondContact O-N 3.02Å; R779-L782 PolarHBondContact O-N 3.01Å; R779-V783 HydrophobicContact CG-CG2 4.19Å; R779-V783 WeakPolarHBondContact O-CB 3.48Å; R779-V783 VanDerWaalsContact O-CG2 3.25Å; R779-V783 WeakPolarHBondContact O-CG2 3.42Å; R779-V783 PolarHBondContact O-N 3.19Å
780	N	96	Very high	92.4	Very high	50 Å²	50	35.8 Å²	35.8	27%	0.267	21%	0.209	S	C	.	.	H	α-helix	trans	-58.4	-49.3	-177	-67.9	-13.1	0	0	0	111.4	Y735 L739 N776 K777 L778 L782 V783 A784 Q811	Y735-N780 WeakPolarHBondContact OH-CB 3.47Å; L739-N780 HydrophobicContact CD1-CB 4.34Å; L739-N780 HydrophobicContact CD2-CB 3.81Å; L739-N780 WeakPolarHBondContact CD2-O 3.35Å; N776-N780 VanDerWaalsContact O-CG 3.3Å; N776-N780 PolarHBondContact O-N 3.05Å; N776-N780 PolarHBondContact O-ND2 2.96Å; K777-N780 PolarHBondContact O-N 3.44Å; L778-N780 PolarHBondContact O-N 3.08Å; N780-L782 PolarHBondContact O-N 2.82Å; N780-V783 PolarHBondContact O-N 2.61Å; N780-A784 VanDerWaalsContact O-CB 3.3Å; N780-A784 WeakPolarHBondContact O-CB 3.23Å; N780-A784 PolarHBondContact O-N 3.16Å; N780-Q811 PolarHBondContact ND2-OE1 3.27Å
781	V	97.9	Very high	92.9	Very high	0 Å²	0	38.1 Å²	38.1	0%	0	22%	0.217	C	C	.	.	H	α-helix	trans	-58.3	-48.2	179.4	170.4	0	0	0	0	112.1	Y735 K777 L778 R779 F785 A802 L806 Q811 A814 F815 L818	Y735-V781 PolarHBondContact OH-N 3.41Å; K777-V781 WeakPolarHBondContact O-CG2 3.45Å; K777-V781 PolarHBondContact O-N 3.06Å; K777-V781 VanDerWaalsContact O-N 3.14Å; L778-V781 PolarHBondContact O-N 2.59Å; R779-V781 PolarHBondContact O-N 3.02Å; V781-F785 WeakPolarHBondContact O-CB 3.39Å; V781-F785 PolarHBondContact O-N 3.45Å; V781-A802 HydrophobicContact CG1-CB 3.82Å; V781-L806 HydrophobicContact CG2-CD1 4.3Å; V781-L806 HydrophobicContact CG2-CD2 4.26Å; V781-Q811 HydrophobicContact CG2-CB 4.44Å; V781-Q811 VanDerWaalsContact CG2-O 3.3Å; V781-Q811 WeakPolarHBondContact CG2-O 3.5Å; V781-A814 HydrophobicContact CG2-CB 4.23Å; V781-F815 HydrophobicContact CG1-CB 4.29Å; V781-L818 HydrophobicContact CG1-CD2 4.48Å
782	L	97.8	Very high	93.6	Very high	2 Å²	2	34 Å²	34	1%	0.01	19%	0.186	C	C	.	.	H	α-helix	trans	-69.3	-40.7	-177.7	-65.1	173.8	0	0	0	112.5	I753 L757 L778 R779 N780 F785 S786 Y794 L798 N799 A802 L818	I753-L782 HydrophobicContact CD1-CB 3.99Å; I753-L782 HydrophobicContact CG1-CB 4.23Å; I753-L782 HydrophobicContact CG2-CB 4.08Å; I753-L782 HydrophobicContact CG2-CD1 4.04Å; L757-L782 HydrophobicContact CD2-CD1 4.29Å; L778-L782 HydrophobicContact CD1-CD1 3.84Å; L778-L782 HydrophobicContact CD1-CG 4.09Å; L778-L782 HydrophobicContact CG-CD1 3.9Å; L778-L782 VanDerWaalsContact O-CG 3.28Å; L778-L782 WeakPolarHBondContact O-CG 3.27Å; L778-L782 PolarHBondContact O-N 3.24Å; L778-L782 VanDerWaalsContact O-N 3.1Å; R779-L782 PolarHBondContact O-N 3.01Å; N780-L782 PolarHBondContact O-N 2.82Å; L782-F785 PolarHBondContact O-N 3.22Å; L782-S786 PolarHBondContact O-N 2.95Å; L782-S786 PolarHBondContact O-OG 3.31Å; L782-Y794 HydrophobicContact CD1-CE2 4.07Å; L782-Y794 HydrophobicContact CD2-CD2 4.45Å; L782-Y794 HydrophobicContact CD2-CE2 4.05Å; L782-Y794 HydrophobicContact CG-CE2 4.47Å; L782-L798 HydrophobicContact CD2-CB 4.21Å; L782-N799 HydrophobicContact CD1-CB 3.84Å; L782-A802 HydrophobicContact CD2-CB 3.8Å; L782-A802 HydrophobicContact CG-CB 4.35Å; L782-L818 HydrophobicContact CD2-CD2 4.05Å
783	V	96.3	Very high	94	Very high	13 Å²	13	33.9 Å²	33.9	8%	0.079	19%	0.186	C	C	.	.	H	α-helix	trans	-68.1	-44.7	178.9	173.8	0	0	0	0	110.4	A742 I753 R779 N780 F785 S786 W787	A742-V783 HydrophobicContact CB-CG1 3.42Å; A742-V783 VanDerWaalsContact CB-CG1 3.42Å; I753-V783 HydrophobicContact CD1-CG2 3.75Å; I753-V783 HydrophobicContact CG2-CG2 4.31Å; R779-V783 HydrophobicContact CG-CG2 4.19Å; R779-V783 WeakPolarHBondContact O-CB 3.48Å; R779-V783 VanDerWaalsContact O-CG2 3.25Å; R779-V783 WeakPolarHBondContact O-CG2 3.42Å; R779-V783 PolarHBondContact O-N 3.19Å; N780-V783 PolarHBondContact O-N 2.61Å; V783-F785 VanDerWaalsContact C-N 3.34Å; V783-F785 PolarHBondContact O-N 3.25Å; V783-S786 PolarHBondContact O-N 2.82Å; V783-S786 PolarHBondContact O-OG 2.88Å; V783-W787 PolarHBondContact O-N 3.41Å
784	A	96.8	Very high	94.7	Very high	0 Å²	0	32.8 Å²	32.8	0%	0	17%	0.166	C	C	.	.	H	α-helix	trans	-59.5	-43.6	173.9	0	0	0	0	0	111.9	Y735 L738 L739 N780 S786 W787 R788 F815	Y735-A784 HydrophobicContact CD2-CB 3.91Å; Y735-A784 HydrophobicContact CE2-CB 3.56Å; L738-A784 HydrophobicContact CB-CB 4.06Å; L739-A784 HydrophobicContact CD2-CB 3.96Å; L739-A784 HydrophobicContact CG-CB 4.42Å; N780-A784 VanDerWaalsContact O-CB 3.3Å; N780-A784 WeakPolarHBondContact O-CB 3.23Å; N780-A784 PolarHBondContact O-N 3.16Å; A784-S786 VanDerWaalsContact C-N 3.35Å; A784-S786 PolarHBondContact O-N 3.47Å; A784-W787 PolarHBondContact O-N 2.84Å; A784-R788 PolarHBondContact O-N 3.3Å; A784-F815 HydrophobicContact CB-CD2 3.97Å; A784-F815 HydrophobicContact CB-CE2 4.06Å
785	F	97.2	Very high	94.9	Very high	2 Å²	2	33.7 Å²	33.7	1%	0.009	17%	0.172	C	C	.	.	H	α-helix	trans	-59.7	-43.3	175.6	-176.6	-90.8	0	0	0	112.5	V781 L782 V783 W787 R788 N789 I792 L798 F815 L818 V819 V822	V781-F785 WeakPolarHBondContact O-CB 3.39Å; V781-F785 PolarHBondContact O-N 3.45Å; L782-F785 PolarHBondContact O-N 3.22Å; V783-F785 VanDerWaalsContact C-N 3.34Å; V783-F785 PolarHBondContact O-N 3.25Å; F785-W787 PolarHBondContact O-N 3.48Å; F785-R788 WeakPolarHBondContact O-CA 3.21Å; F785-R788 WeakPolarHBondContact O-CB 3.22Å; F785-R788 PolarHBondContact O-N 2.88Å; F785-N789 HydrophobicContact CE1-CB 4.46Å; F785-N789 HydrophobicContact CZ-CB 4.24Å; F785-N789 PolarHBondContact O-N 2.67Å; F785-I792 HydrophobicContact CE1-CG2 4.31Å; F785-L798 HydrophobicContact CD1-CD1 4.14Å; F785-L798 HydrophobicContact CE1-CD1 3.92Å; F785-F815 HydrophobicContact CB-CD2 4.38Å; F785-F815 HydrophobicContact CB-CE2 4.44Å; F785-L818 HydrophobicContact CB-CD2 3.73Å; F785-L818 HydrophobicContact CD1-CD2 4.02Å; F785-L818 HydrophobicContact CD2-CB 4.21Å; F785-L818 HydrophobicContact CD2-CD2 3.83Å; F785-L818 HydrophobicContact CD2-CG 3.85Å; F785-L818 HydrophobicContact CE2-CG 4.19Å; F785-L818 HydrophobicContact CG-CD2 3.54Å; F785-L818 HydrophobicContact CG-CG 4.06Å; F785-V819 HydrophobicContact CD2-CG2 3.97Å; F785-V819 HydrophobicContact CE2-CG2 4.03Å; F785-V822 HydrophobicContact CE1-CG1 4.43Å; F785-V822 HydrophobicContact CE1-CG2 4.49Å; F785-V822 HydrophobicContact CE2-CB 4.18Å; F785-V822 HydrophobicContact CE2-CG2 4.35Å; F785-V822 HydrophobicContact CZ-CB 3.75Å; F785-V822 HydrophobicContact CZ-CG1 3.66Å; F785-V822 HydrophobicContact CZ-CG2 3.89Å
786	S	96.3	Very high	94.8	Very high	3 Å²	3	37.1 Å²	37.1	2%	0.021	19%	0.188	C	C	.	.	H	α-helix	trans	-66.6	-21.4	179.6	71	0	0	0	0	114.4	N747 L782 V783 A784 G793	N747-S786 PolarHBondContact ND2-OG 3.41Å; L782-S786 PolarHBondContact O-N 2.95Å; L782-S786 PolarHBondContact O-OG 3.31Å; V783-S786 PolarHBondContact O-N 2.82Å; V783-S786 PolarHBondContact O-OG 2.88Å; A784-S786 VanDerWaalsContact C-N 3.35Å; A784-S786 PolarHBondContact O-N 3.47Å; S786-G793 WeakPolarHBondContact CA-O 3.23Å; S786-G793 WeakPolarHBondContact CB-O 3.26Å
787	W	95.2	Very high	94.9	Very high	62 Å²	62	33.6 Å²	33.6	24%	0.235	17%	0.17	C	C	.	.	H	α-helix	trans	-84.5	-31.5	167.4	-76.4	109.7	0	0	0	113.1	L738 V741 R745 N747 V783 A784 F785 N789	L738-W787 HydrophobicContact CD2-CB 3.92Å; V741-W787 HydrophobicContact CG1-CD2 4.03Å; V741-W787 HydrophobicContact CG1-CE3 4.08Å; V741-W787 HydrophobicContact CG1-CZ2 4.46Å; V741-W787 HydrophobicContact CG1-CZ3 4.33Å; R745-W787 HydrophobicContact CB-CH2 3.81Å; R745-W787 HydrophobicContact CB-CZ2 3.73Å; N747-W787 HydrophobicContact CB-CZ2 3.77Å; N747-W787 VanDerWaalsContact ND2-CD1 3.33Å; N747-W787 PolarHBondContact ND2-NE1 3Å; N747-W787 VanDerWaalsContact ND2-NE1 3.15Å; V783-W787 PolarHBondContact O-N 3.41Å; A784-W787 PolarHBondContact O-N 2.84Å; F785-W787 PolarHBondContact O-N 3.48Å; W787-N789 VanDerWaalsContact C-N 3.33Å
788	R	94.2	Very high	95	Very high	47 Å²	47	31.7 Å²	31.7	18%	0.177	16%	0.162	C	C	.	.	H	α-helix	trans	-65.5	-33.1	175	173.1	55.2	-176.1	61.2	13.3	112.9	Y734 L738 A784 F785 F815 V819 E823	Y734-R788 WeakPolarHBondContact OH-CD 3.33Å; L738-R788 HydrophobicContact CD1-CB 3.94Å; A784-R788 PolarHBondContact O-N 3.3Å; F785-R788 WeakPolarHBondContact O-CA 3.21Å; F785-R788 WeakPolarHBondContact O-CB 3.22Å; F785-R788 PolarHBondContact O-N 2.88Å; R788-F815 HydrophobicContact CB-CE2 4.05Å; R788-F815 HydrophobicContact CB-CZ 4.09Å; R788-F815 HydrophobicContact CG-CE2 4.42Å; R788-F815 HydrophobicContact CG-CZ 4.09Å; R788-V819 HydrophobicContact CG-CG2 4.32Å; R788-E823 IonicContact CZ-OE1 2.88Å; R788-E823 IonicContact CZ-OE2 2.73Å; R788-E823 IonicContact NH1-OE1 3.82Å; R788-E823 PolarHBondContact NH1-OE1 3.12Å; R788-E823 IonicContact NH1-OE2 3.12Å; R788-E823 PolarHBondContact NH1-OE2 3.05Å; R788-E823 IonicContact NH2-OE1 3.21Å; R788-E823 IonicContact NH2-OE2 3.35Å; R788-E823 PolarHBondContact NH2-OE2 2.68Å
789	N	93	Very high	95	Very high	25 Å²	25	31.9 Å²	31.9	13%	0.134	16%	0.163	C	C	.	.			trans	-138.8	83.4	179.9	-168.4	-48.1	0	0	0	110.8	F785 W787 D791 I792 G793 E823	F785-N789 HydrophobicContact CE1-CB 4.46Å; F785-N789 HydrophobicContact CZ-CB 4.24Å; F785-N789 PolarHBondContact O-N 2.67Å; W787-N789 VanDerWaalsContact C-N 3.33Å; N789-D791 VanDerWaalsContact C-N 3.29Å; N789-D791 PolarHBondContact O-N 3.35Å; N789-I792 PolarHBondContact O-N 3.02Å; N789-I792 PolarHBondContact OD1-N 3.2Å; N789-G793 WeakPolarHBondContact O-CA 3.3Å; N789-G793 PolarHBondContact O-N 3.05Å; N789-E823 PolarHBondContact ND2-OE1 3.4Å
790	P	91.5	Very high	95.1	Very high	93 Å²	93	30 Å²	30	60%	0.604	16%	0.156	S	C	*	.	T	Hydrogen-bonded Turn	trans	-67.3	-22.7	-176.4	-23.8	36	0	0	0	115.1	I792 G793	P790-I792 VanDerWaalsContact C-N 3.34Å; P790-G793 PolarHBondContact O-N 2.93Å
791	D	89.9	Confident	95.2	Very high	144 Å²	144	27.7 Å²	27.7	77%	0.77	14%	0.144	S	C	*	.	T	Hydrogen-bonded Turn	trans	-66.7	-37.2	179.1	-63.8	-37.1	0	0	0	111.7	N789	N789-D791 VanDerWaalsContact C-N 3.29Å; N789-D791 PolarHBondContact O-N 3.35Å
792	I	93.4	Very high	95.2	Very high	20 Å²	20	27.7 Å²	27.7	10%	0.103	14%	0.144	C	C	.	.	T	Hydrogen-bonded Turn	trans	-84.3	-46.7	169.5	-66.3	175.1	0	0	0	110	F785 N789 P790 Y794 L798 V822 T832	F785-I792 HydrophobicContact CE1-CG2 4.31Å; N789-I792 PolarHBondContact O-N 3.02Å; N789-I792 PolarHBondContact OD1-N 3.2Å; P790-I792 VanDerWaalsContact C-N 3.34Å; I792-Y794 PolarHBondContact O-N 3.41Å; I792-L798 HydrophobicContact CG2-CD1 4.3Å; I792-V822 HydrophobicContact CD1-CG1 3.38Å; I792-T832 HydrophobicContact CG1-CG2 4.47Å
793	G	93.3	Very high	95.1	Very high	11 Å²	11	27.6 Å²	27.6	11%	0.113	14%	0.143	C	C	.	.			trans	61.9	-94.6	-174	0	0	0	0	0	110.9	S786 N789 P790	S786-G793 WeakPolarHBondContact CA-O 3.23Å; S786-G793 WeakPolarHBondContact CB-O 3.26Å; N789-G793 WeakPolarHBondContact O-CA 3.3Å; N789-G793 PolarHBondContact O-N 3.05Å; P790-G793 PolarHBondContact O-N 2.93Å
794	Y	95.4	Very high	95.2	Very high	29 Å²	29	27 Å²	27	11%	0.114	14%	0.139	C	C	.	.			trans	-140	122.9	173.8	177.5	-95.3	0	0	0	110.9	Q752 I753 D756 L782 I792 L798 N799	Q752-Y794 HydrophobicContact CB-CD1 4.12Å; Q752-Y794 HydrophobicContact CB-CE1 4.41Å; Q752-Y794 HydrophobicContact CG-CD1 3.82Å; Q752-Y794 HydrophobicContact CG-CE1 3.77Å; I753-Y794 HydrophobicContact CD1-CD2 4.19Å; I753-Y794 HydrophobicContact CD1-CG 4.38Å; I753-Y794 HydrophobicContact CG1-CD1 4.27Å; I753-Y794 HydrophobicContact CG1-CD2 3.63Å; I753-Y794 HydrophobicContact CG1-CE2 4.02Å; I753-Y794 HydrophobicContact CG1-CG 3.78Å; D756-Y794 WeakPolarHBondContact CB-OH 3Å; D756-Y794 VanDerWaalsContact CG-OH 3.29Å; D756-Y794 WeakPolarHBondContact OD2-CE1 3.23Å; D756-Y794 PolarHBondContact OD2-OH 3.3Å; L782-Y794 HydrophobicContact CD1-CE2 4.07Å; L782-Y794 HydrophobicContact CD2-CD2 4.45Å; L782-Y794 HydrophobicContact CD2-CE2 4.05Å; L782-Y794 HydrophobicContact CG-CE2 4.47Å; I792-Y794 PolarHBondContact O-N 3.41Å; Y794-L798 HydrophobicContact CD2-CB 4.36Å; Y794-L798 HydrophobicContact CE2-CB 4.09Å; Y794-N799 HydrophobicContact CE2-CB 4.43Å; Y794-N799 VanDerWaalsContact OH-CB 3.26Å; Y794-N799 WeakPolarHBondContact OH-CB 3.38Å; Y794-N799 PolarHBondContact OH-OD1 2.75Å
795	C	94.5	Very high	95.2	Very high	18 Å²	18	27 Å²	27	12%	0.122	14%	0.139	C	C	.	.			trans	-100.8	136.1	166.1	-179	0	0	0	0	109.3	G797 L798 Y831	C795-G797 PolarHBondContact O-N 3.1Å; C795-L798 HydrophobicContact CB-CD1 4.2Å; C795-L798 HydrophobicContact CB-CG 4.13Å; C795-L798 WeakPolarHBondContact O-CB 3.35Å; C795-L798 WeakPolarHBondContact O-CG 3.22Å; C795-L798 PolarHBondContact O-N 3.11Å; C795-L798 VanDerWaalsContact O-N 3.08Å; C795-Y831 HydrophobicContact CB-CD1 4.22Å
796	Q	92.1	Very high	95.2	Very high	74 Å²	74	26.9 Å²	26.9	35%	0.346	14%	0.139	S	C	.	.	T	Hydrogen-bonded Turn	trans	-55.1	128.9	168.1	-177.4	-178.3	-58.1	0	0	108.8	R759	R759-Q796 VanDerWaalsContact NH2-CD 3.34Å
797	G	93.7	Very high	95.1	Very high	4 Å²	4	26.8 Å²	26.8	4%	0.041	14%	0.138	C	C	.	.	T	Hydrogen-bonded Turn	trans	112.2	-29.6	-171.9	0	0	0	0	0	113.7	C795 N799 R800 L801 V877	C795-G797 PolarHBondContact O-N 3.1Å; G797-N799 WeakPolarHBondContact CA-OD1 3.32Å; G797-N799 PolarHBondContact N-OD1 2.95Å; G797-N799 PolarHBondContact O-N 3.5Å; G797-R800 WeakPolarHBondContact O-CB 3.25Å; G797-R800 PolarHBondContact O-N 3.08Å; G797-L801 PolarHBondContact O-N 3.42Å; G797-V877 VanDerWaalsContact CA-CG1 3.44Å
798	L	97.4	Very high	95	Very high	0 Å²	0	24 Å²	24	0%	0	13%	0.128	C	C	.	.	H	α-helix	trans	-62.8	-32.4	175	-62.2	-177	0	0	0	111.9	L782 F785 I792 Y794 C795 R800 L801 A802 L818 V822 Y831	L782-L798 HydrophobicContact CD2-CB 4.21Å; F785-L798 HydrophobicContact CD1-CD1 4.14Å; F785-L798 HydrophobicContact CE1-CD1 3.92Å; I792-L798 HydrophobicContact CG2-CD1 4.3Å; Y794-L798 HydrophobicContact CD2-CB 4.36Å; Y794-L798 HydrophobicContact CE2-CB 4.09Å; C795-L798 HydrophobicContact CB-CD1 4.2Å; C795-L798 HydrophobicContact CB-CG 4.13Å; C795-L798 WeakPolarHBondContact O-CB 3.35Å; C795-L798 WeakPolarHBondContact O-CG 3.22Å; C795-L798 PolarHBondContact O-N 3.11Å; C795-L798 VanDerWaalsContact O-N 3.08Å; L798-R800 VanDerWaalsContact C-N 3.29Å; L798-R800 PolarHBondContact O-N 3.06Å; L798-L801 HydrophobicContact CD2-CD1 4.08Å; L798-L801 PolarHBondContact O-N 2.9Å; L798-A802 WeakPolarHBondContact O-CB 3.39Å; L798-A802 PolarHBondContact O-N 3.06Å; L798-L818 HydrophobicContact CB-CD1 4.29Å; L798-L818 HydrophobicContact CD2-CD1 4.08Å; L798-V822 HydrophobicContact CD2-CG2 3.7Å; L798-Y831 HydrophobicContact CD2-CD1 3.84Å; L798-Y831 HydrophobicContact CD2-CD2 4.2Å; L798-Y831 HydrophobicContact CD2-CE1 3.95Å; L798-Y831 HydrophobicContact CD2-CE2 4.27Å; L798-Y831 HydrophobicContact CD2-CG 3.98Å
799	N	96.9	Very high	95.1	Very high	4 Å²	4	21.8 Å²	21.8	2%	0.021	12%	0.119	C	C	.	.	H	α-helix	trans	-52.6	-43.3	168.4	58.4	-36.3	0	0	0	113.3	D756 T760 L782 Y794 G797 A803	D756-N799 HydrophobicContact CB-CB 4.4Å; T760-N799 HydrophobicContact CG2-CB 4.29Å; T760-N799 PolarHBondContact OG1-ND2 2.93Å; L782-N799 HydrophobicContact CD1-CB 3.84Å; Y794-N799 HydrophobicContact CE2-CB 4.43Å; Y794-N799 VanDerWaalsContact OH-CB 3.26Å; Y794-N799 WeakPolarHBondContact OH-CB 3.38Å; Y794-N799 PolarHBondContact OH-OD1 2.75Å; G797-N799 WeakPolarHBondContact CA-OD1 3.32Å; G797-N799 PolarHBondContact N-OD1 2.95Å; G797-N799 PolarHBondContact O-N 3.5Å; N799-A803 WeakPolarHBondContact O-CB 3.42Å; N799-A803 PolarHBondContact O-N 3.07Å
800	R	97.5	Very high	95.1	Very high	29 Å²	29	22.3 Å²	22.3	11%	0.109	12%	0.122	C	C	.	.	H	α-helix	trans	-70.1	-37.8	-177.8	-64.9	-177.3	160.1	-77.6	12.8	111.6	G797 L798 I804 V877 V880 D881	G797-R800 WeakPolarHBondContact O-CB 3.25Å; G797-R800 PolarHBondContact O-N 3.08Å; L798-R800 VanDerWaalsContact C-N 3.29Å; L798-R800 PolarHBondContact O-N 3.06Å; R800-I804 WeakPolarHBondContact O-CG1 3.48Å; R800-I804 PolarHBondContact O-N 2.76Å; R800-V877 HydrophobicContact CB-CB 4.1Å; R800-V877 HydrophobicContact CB-CG1 4.14Å; R800-V880 HydrophobicContact CB-CB 4.33Å; R800-V880 HydrophobicContact CB-CG1 3.98Å; R800-V880 HydrophobicContact CG-CG1 4.49Å; R800-D881 IonicContact CZ-OD1 3.03Å; R800-D881 IonicContact CZ-OD2 3.31Å; R800-D881 IonicContact NH1-OD1 2.74Å; R800-D881 PolarHBondContact NH1-OD1 2.78Å; R800-D881 IonicContact NH1-OD2 3.46Å; R800-D881 PolarHBondContact NH1-OD2 2.94Å; R800-D881 IonicContact NH2-OD2 2.65Å; R800-D881 PolarHBondContact NH2-OD2 3.45Å
801	L	98.1	Very high	95.3	Very high	2 Å²	2	19.3 Å²	19.3	1%	0.01	10%	0.1	C	C	.	.	H	α-helix	trans	-65.8	-50.2	174.6	-58.6	176.4	0	0	0	111.7	G797 L798 A803 I804 A805 L818 I821 V878 W892	G797-L801 PolarHBondContact O-N 3.42Å; L798-L801 HydrophobicContact CD2-CD1 4.08Å; L798-L801 PolarHBondContact O-N 2.9Å; L801-A803 VanDerWaalsContact C-N 3.32Å; L801-A803 PolarHBondContact O-N 3.34Å; L801-I804 PolarHBondContact O-N 3.16Å; L801-A805 PolarHBondContact O-N 2.83Å; L801-A805 VanDerWaalsContact O-N 3.07Å; L801-L818 HydrophobicContact CB-CD1 3.91Å; L801-L818 HydrophobicContact CD1-CD1 4.11Å; L801-I821 HydrophobicContact CD1-CG2 3.98Å; L801-V878 HydrophobicContact CD2-CB 4.23Å; L801-V878 HydrophobicContact CD2-CG2 3.87Å; L801-W892 HydrophobicContact CB-CH2 4.25Å; L801-W892 HydrophobicContact CD2-CH2 4.04Å; L801-W892 HydrophobicContact CD2-CZ2 3.73Å; L801-W892 WeakPolarHBondContact O-CH2 3.27Å
802	A	98.1	Very high	95.5	Very high	0 Å²	0	15.3 Å²	15.3	0%	0	8%	0.077	C	C	.	.	H	α-helix	trans	-62.2	-39	178.7	0	0	0	0	0	112.1	L778 V781 L782 L798 I804 A805 L806 L818	L778-A802 HydrophobicContact CD1-CB 3.6Å; V781-A802 HydrophobicContact CG1-CB 3.82Å; L782-A802 HydrophobicContact CD2-CB 3.8Å; L782-A802 HydrophobicContact CG-CB 4.35Å; L798-A802 WeakPolarHBondContact O-CB 3.39Å; L798-A802 PolarHBondContact O-N 3.06Å; A802-I804 PolarHBondContact O-N 3.35Å; A802-A805 PolarHBondContact O-N 2.8Å; A802-L806 WeakPolarHBondContact O-CB 3.5Å; A802-L806 WeakPolarHBondContact O-CG 3.41Å; A802-L806 PolarHBondContact O-N 3.38Å; A802-L818 HydrophobicContact CB-CD2 4.45Å
803	A	97.1	Very high	95.7	Very high	0 Å²	0	15 Å²	15	0%	0	8%	0.075	C	C	.	.	H	α-helix	trans	-65.4	-35.9	179	0	0	0	0	0	113.1	T760 L761 Y767 L778 N799 L801 L807	T760-A803 HydrophobicContact CG2-CB 3.49Å; T760-A803 VanDerWaalsContact CG2-CB 3.49Å; L761-A803 HydrophobicContact CD1-CB 3.7Å; L761-A803 HydrophobicContact CG-CB 4.15Å; Y767-A803 HydrophobicContact CE1-CB 4.27Å; Y767-A803 HydrophobicContact CE2-CB 3.93Å; Y767-A803 VanDerWaalsContact OH-CA 3.31Å; Y767-A803 WeakPolarHBondContact OH-CA 3.27Å; Y767-A803 PolarHBondContact OH-O 3.4Å; L778-A803 HydrophobicContact CD1-CB 4.07Å; L778-A803 HydrophobicContact CD2-CB 4.24Å; N799-A803 WeakPolarHBondContact O-CB 3.42Å; N799-A803 PolarHBondContact O-N 3.07Å; L801-A803 VanDerWaalsContact C-N 3.32Å; L801-A803 PolarHBondContact O-N 3.34Å; A803-L807 WeakPolarHBondContact O-CG 3.29Å
804	I	97.2	Very high	95.9	Very high	0 Å²	0	14.5 Å²	14.5	0%	0	7%	0.07	C	C	.	.	H	α-helix	trans	-71.5	-42.7	173.3	-68.9	-61.5	0	0	0	111.8	F642 W715 L761 R800 L801 A802 L806 L807 V880 L888 F889 W892	F642-I804 HydrophobicContact CZ-CD1 3.96Å; W715-I804 HydrophobicContact CH2-CG2 3.96Å; W715-I804 HydrophobicContact CZ3-CG2 4.13Å; L761-I804 HydrophobicContact CD1-CD1 3.8Å; L761-I804 HydrophobicContact CD1-CG1 4.34Å; R800-I804 WeakPolarHBondContact O-CG1 3.48Å; R800-I804 PolarHBondContact O-N 2.76Å; L801-I804 PolarHBondContact O-N 3.16Å; A802-I804 PolarHBondContact O-N 3.35Å; I804-L806 VanDerWaalsContact C-N 3.31Å; I804-L806 PolarHBondContact O-N 3.08Å; I804-L807 HydrophobicContact CD1-CD1 3.88Å; I804-L807 WeakPolarHBondContact O-CB 3.48Å; I804-L807 PolarHBondContact O-N 3.19Å; I804-L807 VanDerWaalsContact O-N 3.1Å; I804-V880 HydrophobicContact CD1-CG2 4.34Å; I804-V880 HydrophobicContact CG1-CG1 4.24Å; I804-V880 HydrophobicContact CG1-CG2 3.57Å; I804-L888 HydrophobicContact CD1-CD2 3.9Å; I804-F889 HydrophobicContact CD1-CE1 4.49Å; I804-F889 HydrophobicContact CD1-CZ 4.39Å; I804-F889 HydrophobicContact CG2-CE1 4.04Å; I804-W892 HydrophobicContact CB-CH2 4Å; I804-W892 HydrophobicContact CB-CZ2 3.98Å; I804-W892 HydrophobicContact CB-CZ3 4.36Å; I804-W892 HydrophobicContact CG1-CZ2 4.47Å; I804-W892 HydrophobicContact CG2-CD2 3.68Å; I804-W892 HydrophobicContact CG2-CE3 3.74Å; I804-W892 HydrophobicContact CG2-CG 4.34Å; I804-W892 HydrophobicContact CG2-CH2 3.9Å; I804-W892 HydrophobicContact CG2-CZ2 3.84Å; I804-W892 HydrophobicContact CG2-CZ3 3.86Å
805	A	97.4	Very high	96	Very high	0 Å²	0	13.1 Å²	13.1	0%	0	7%	0.065	C	C	.	.	H	α-helix	trans	-57.2	-46.1	176.5	0	0	0	0	0	111.3	L801 A802 L807 Y808 L809 A814 T817	L801-A805 PolarHBondContact O-N 2.83Å; L801-A805 VanDerWaalsContact O-N 3.07Å; A802-A805 PolarHBondContact O-N 2.8Å; A805-L807 PolarHBondContact O-N 2.74Å; A805-L807 VanDerWaalsContact O-N 3.09Å; A805-Y808 PolarHBondContact O-N 3.03Å; A805-Y808 VanDerWaalsContact O-N 3.15Å; A805-L809 VanDerWaalsContact O-CB 3.31Å; A805-L809 WeakPolarHBondContact O-CB 3.23Å; A805-L809 PolarHBondContact O-N 3.43Å; A805-A814 HydrophobicContact CB-CB 3.82Å; A805-T817 HydrophobicContact CB-CG2 3.85Å
806	L	96.9	Very high	96.1	Very high	0 Å²	0	12.4 Å²	12.4	0%	0	6%	0.059	C	C	.	.	H	α-helix	trans	-62.1	-12.6	177.2	-77.6	170.7	0	0	0	115.2	L205 Y767 K777 L778 V781 A802 I804 Q811 A814	L205-L806 WeakPolarHBondContact CB-O 3.4Å; L205-L806 HydrophobicContact CD1-CB 3.98Å; L205-L806 WeakPolarHBondContact CD1-O 3.3Å; L205-L806 VanDerWaalsContact CG-O 3.28Å; L205-L806 WeakPolarHBondContact CG-O 3.3Å; L205-L806 PolarHBondContact N-O 3.34Å; Y767-L806 WeakPolarHBondContact OH-CB 3.29Å; K777-L806 HydrophobicContact CB-CD1 3.9Å; K777-L806 HydrophobicContact CB-CD2 3.9Å; K777-L806 HydrophobicContact CD-CD2 4.15Å; L778-L806 HydrophobicContact CB-CD1 4.03Å; L778-L806 HydrophobicContact CD1-CD1 4.27Å; V781-L806 HydrophobicContact CG2-CD1 4.3Å; V781-L806 HydrophobicContact CG2-CD2 4.26Å; A802-L806 WeakPolarHBondContact O-CB 3.5Å; A802-L806 WeakPolarHBondContact O-CG 3.41Å; A802-L806 PolarHBondContact O-N 3.38Å; I804-L806 VanDerWaalsContact C-N 3.31Å; I804-L806 PolarHBondContact O-N 3.08Å; L806-Q811 HydrophobicContact CD2-CG 4.31Å; L806-A814 HydrophobicContact CD2-CB 3.64Å; L806-A814 HydrophobicContact CG-CB 3.68Å
807	L	94.6	Very high	96.4	Very high	0 Å²	0	8.9 Å²	8.9	0%	0	4%	0.043	C	C	.	.	H	α-helix	trans	-70.2	-32.4	173.5	-64.6	179.2	0	0	0	112.1	G204 L205 V206 F642 Y767 A803 I804 A805 F889	G204-L807 CarbonylContact C-O 3.54Å; G204-L807 VanDerWaalsContact C-O 3.31Å; L205-L807 HydrophobicContact CB-CD2 4.47Å; L205-L807 PolarHBondContact N-O 2.8Å; V206-L807 WeakPolarHBondContact CB-O 3.24Å; V206-L807 HydrophobicContact CG2-CB 3.69Å; V206-L807 HydrophobicContact CG2-CD2 3.58Å; V206-L807 HydrophobicContact CG2-CG 4.08Å; V206-L807 PolarHBondContact N-O 2.67Å; F642-L807 HydrophobicContact CE2-CD1 4.07Å; F642-L807 HydrophobicContact CZ-CD1 4.12Å; Y767-L807 HydrophobicContact CE2-CD2 3.93Å; A803-L807 WeakPolarHBondContact O-CG 3.29Å; I804-L807 HydrophobicContact CD1-CD1 3.88Å; I804-L807 WeakPolarHBondContact O-CB 3.48Å; I804-L807 PolarHBondContact O-N 3.19Å; I804-L807 VanDerWaalsContact O-N 3.1Å; A805-L807 PolarHBondContact O-N 2.74Å; A805-L807 VanDerWaalsContact O-N 3.09Å; L807-F889 HydrophobicContact CD1-CE1 4.17Å; L807-F889 HydrophobicContact CD1-CZ 3.7Å
808	Y	93.8	Very high	96.6	Very high	5 Å²	5	8.8 Å²	8.8	2%	0.02	4%	0.042	C	C	.	.	H	α-helix	trans	-117.4	-21	-178	-71.8	-78.1	0	0	0	114.6	G204 Y640 H708 R711 S712 W715 A805 F889	G204-Y808 VanDerWaalsContact CA-C 3.45Å; G204-Y808 PolarHBondContact N-O 3.28Å; Y640-Y808 WeakPolarHBondContact CD1-OH 3.47Å; Y640-Y808 WeakPolarHBondContact CE1-OH 3.33Å; H708-Y808 AromaticContact CE1-CE1 3.82Å; H708-Y808 AromaticContact ND1-CE1 3.46Å; H708-Y808 WeakPolarHBondContact ND1-CE1 3.49Å; H708-Y808 AromaticContact ND1-CZ 3.61Å; H708-Y808 PolarHBondContact ND1-OH 2.74Å; H708-Y808 WeakPolarHBondContact O-CE1 3.48Å; R711-Y808 HydrophobicContact CB-CD1 3.55Å; R711-Y808 HydrophobicContact CB-CD2 4.39Å; R711-Y808 HydrophobicContact CB-CE1 3.61Å; R711-Y808 HydrophobicContact CB-CE2 4.44Å; R711-Y808 HydrophobicContact CB-CG 3.95Å; R711-Y808 HydrophobicContact CG-CE1 4.36Å; S712-Y808 VanDerWaalsContact CB-O 3.24Å; S712-Y808 WeakPolarHBondContact CB-O 3.3Å; W715-Y808 HydrophobicContact CE3-CD2 4.27Å; W715-Y808 AromaticContact CH2-CD2 3.97Å; W715-Y808 HydrophobicContact CH2-CD2 3.97Å; W715-Y808 HydrophobicContact CH2-CE2 4.38Å; W715-Y808 HydrophobicContact CZ2-CD2 4.37Å; W715-Y808 AromaticContact CZ3-CD2 3.89Å; W715-Y808 HydrophobicContact CZ3-CD2 3.89Å; A805-Y808 PolarHBondContact O-N 3.03Å; A805-Y808 VanDerWaalsContact O-N 3.15Å; Y808-F889 HydrophobicContact CD2-CD1 4.42Å; Y808-F889 HydrophobicContact CD2-CE1 4.22Å; Y808-F889 AromaticContact CE2-CD1 3.64Å; Y808-F889 HydrophobicContact CE2-CD1 3.64Å; Y808-F889 AromaticContact CE2-CE1 3.56Å; Y808-F889 HydrophobicContact CE2-CE1 3.56Å; Y808-F889 HydrophobicContact CE2-CG 4.31Å; Y808-F889 HydrophobicContact CE2-CZ 4.2Å
809	L	95.1	Very high	96.6	Very high	0 Å²	0	8.8 Å²	8.8	0%	0	4%	0.042	C	C	.	.	S	Bend	trans	-113.7	156.2	-174.9	-58.6	176.5	0	0	0	111.4	G204 W715 R716 A805 D813 T817	G204-L809 VanDerWaalsContact CA-O 3.27Å; G204-L809 WeakPolarHBondContact CA-O 3.48Å; W715-L809 HydrophobicContact CB-CD1 4.29Å; W715-L809 HydrophobicContact CB-CD2 4.13Å; W715-L809 HydrophobicContact CB-CG 4.47Å; W715-L809 HydrophobicContact CE3-CD1 4.49Å; R716-L809 HydrophobicContact CB-CD2 3.9Å; A805-L809 VanDerWaalsContact O-CB 3.31Å; A805-L809 WeakPolarHBondContact O-CB 3.23Å; A805-L809 PolarHBondContact O-N 3.43Å; L809-D813 HydrophobicContact CB-CB 3.75Å; L809-D813 HydrophobicContact CD1-CB 4.23Å; L809-D813 HydrophobicContact CD2-CB 4.19Å; L809-D813 HydrophobicContact CG-CB 4.27Å; L809-T817 WeakPolarHBondContact CD1-OG1 3.41Å
810	D	93.4	Very high	96.6	Very high	36 Å²	36	8.7 Å²	8.7	19%	0.193	4%	0.041	C	C	.	.			trans	-73	-176.1	170.7	66	57.1	0	0	0	111.9	R716 E812 D813 A814	R716-D810 IonicContact NH2-OD2 2.8Å; R716-D810 PolarHBondContact NH2-OD2 3.25Å; D810-E812 PolarHBondContact OD1-N 2.85Å; D810-D813 PolarHBondContact OD1-N 3.43Å; D810-A814 WeakPolarHBondContact O-CB 3.05Å; D810-A814 PolarHBondContact O-N 2.94Å
811	Q	94.9	Very high	96.6	Very high	29 Å²	29	7.3 Å²	7.3	14%	0.136	4%	0.036	C	C	.	.	H	α-helix	trans	-64.7	-39.9	-176.9	-74.1	179.9	92.8	0	0	113.3	Y735 K777 N780 V781 L806 F815	Y735-Q811 HydrophobicContact CE1-CB 4Å; K777-Q811 HydrophobicContact CB-CG 3.82Å; K777-Q811 HydrophobicContact CD-CG 4Å; K777-Q811 HydrophobicContact CG-CG 3.73Å; N780-Q811 PolarHBondContact ND2-OE1 3.27Å; V781-Q811 HydrophobicContact CG2-CB 4.44Å; V781-Q811 VanDerWaalsContact CG2-O 3.3Å; V781-Q811 WeakPolarHBondContact CG2-O 3.5Å; L806-Q811 HydrophobicContact CD2-CG 4.31Å; Q811-F815 WeakPolarHBondContact O-CB 3.33Å; Q811-F815 PolarHBondContact O-N 3.16Å
812	E	95.5	Very high	96.6	Very high	61 Å²	61	7.4 Å²	7.4	29%	0.285	4%	0.036	S	C	.	.	H	α-helix	trans	-78.8	-42.5	-177.1	176.3	161.3	-177.1	0	0	110.7	Y735 D810 A814 F815 W816	Y735-E812 HydrophobicContact CD1-CB 3.9Å; Y735-E812 HydrophobicContact CD1-CG 4.39Å; Y735-E812 HydrophobicContact CE1-CB 4.45Å; Y735-E812 HydrophobicContact CG-CB 4.18Å; Y735-E812 HydrophobicContact CG-CG 4.21Å; D810-E812 PolarHBondContact OD1-N 2.85Å; E812-A814 VanDerWaalsContact C-N 3.28Å; E812-A814 PolarHBondContact O-N 3.42Å; E812-F815 WeakPolarHBondContact O-CB 3.31Å; E812-F815 PolarHBondContact O-N 2.88Å; E812-F815 VanDerWaalsContact O-N 3.15Å; E812-W816 VanDerWaalsContact CG-CD1 3.46Å; E812-W816 PolarHBondContact O-N 3.41Å; E812-W816 PolarHBondContact OE1-NE1 2.99Å
813	D	95.9	Very high	96.4	Very high	14 Å²	14	9.8 Å²	9.8	8%	0.075	5%	0.048	C	C	.	.	H	α-helix	trans	-61.3	-36.8	173.3	-83.2	-39.2	0	0	0	112	R716 L809 D810 W816 T817	R716-D813 IonicContact CZ-OD2 2.68Å; R716-D813 VanDerWaalsContact CZ-OD2 3.25Å; R716-D813 IonicContact NE-OD2 2.81Å; R716-D813 PolarHBondContact NE-OD2 2.88Å; R716-D813 IonicContact NH2-OD2 2.79Å; R716-D813 PolarHBondContact NH2-OD2 3.33Å; L809-D813 HydrophobicContact CB-CB 3.75Å; L809-D813 HydrophobicContact CD1-CB 4.23Å; L809-D813 HydrophobicContact CD2-CB 4.19Å; L809-D813 HydrophobicContact CG-CB 4.27Å; D810-D813 PolarHBondContact OD1-N 3.43Å; D813-W816 PolarHBondContact O-N 2.73Å; D813-T817 WeakPolarHBondContact O-CB 3.34Å; D813-T817 PolarHBondContact O-N 3.42Å; D813-T817 PolarHBondContact O-OG1 3.46Å
814	A	97.8	Very high	96.3	Very high	0 Å²	0	12.3 Å²	12.3	0%	0	6%	0.063	C	C	.	.	H	α-helix	trans	-68.2	-35.9	174.1	0	0	0	0	0	112.8	V781 A805 L806 D810 E812 T817 L818	V781-A814 HydrophobicContact CG2-CB 4.23Å; A805-A814 HydrophobicContact CB-CB 3.82Å; L806-A814 HydrophobicContact CD2-CB 3.64Å; L806-A814 HydrophobicContact CG-CB 3.68Å; D810-A814 WeakPolarHBondContact O-CB 3.05Å; D810-A814 PolarHBondContact O-N 2.94Å; E812-A814 VanDerWaalsContact C-N 3.28Å; E812-A814 PolarHBondContact O-N 3.42Å; A814-T817 WeakPolarHBondContact O-CB 3.41Å; A814-T817 PolarHBondContact O-N 2.82Å; A814-L818 PolarHBondContact O-N 3.03Å
815	F	97.8	Very high	96.2	Very high	0 Å²	0	13.1 Å²	13.1	0%	0	7%	0.066	C	C	.	.	H	α-helix	trans	-62.7	-47.4	169.6	162.6	-92.7	0	0	0	111.6	Y734 Y735 L738 V781 A784 F785 R788 Q811 E812 T817 L818 V819	Y734-F815 HydrophobicContact CE1-CZ 4.4Å; Y735-F815 HydrophobicContact CD2-CB 3.72Å; Y735-F815 AromaticContact CD2-CD1 3.74Å; Y735-F815 HydrophobicContact CD2-CD1 3.74Å; Y735-F815 AromaticContact CD2-CD2 3.83Å; Y735-F815 HydrophobicContact CD2-CD2 3.83Å; Y735-F815 HydrophobicContact CD2-CE1 4.3Å; Y735-F815 HydrophobicContact CD2-CE2 4.36Å; Y735-F815 AromaticContact CD2-CG 3.48Å; Y735-F815 HydrophobicContact CD2-CG 3.48Å; Y735-F815 VanDerWaalsContact CD2-CG 3.48Å; Y735-F815 HydrophobicContact CE2-CB 3.61Å; Y735-F815 HydrophobicContact CE2-CD1 4.47Å; Y735-F815 AromaticContact CE2-CD2 3.98Å; Y735-F815 HydrophobicContact CE2-CD2 3.98Å; Y735-F815 AromaticContact CE2-CG 3.78Å; Y735-F815 HydrophobicContact CE2-CG 3.78Å; Y735-F815 HydrophobicContact CG-CD1 4.46Å; L738-F815 HydrophobicContact CD1-CE2 3.85Å; L738-F815 HydrophobicContact CD1-CZ 3.54Å; V781-F815 HydrophobicContact CG1-CB 4.29Å; A784-F815 HydrophobicContact CB-CD2 3.97Å; A784-F815 HydrophobicContact CB-CE2 4.06Å; F785-F815 HydrophobicContact CB-CD2 4.38Å; F785-F815 HydrophobicContact CB-CE2 4.44Å; R788-F815 HydrophobicContact CB-CE2 4.05Å; R788-F815 HydrophobicContact CB-CZ 4.09Å; R788-F815 HydrophobicContact CG-CE2 4.42Å; R788-F815 HydrophobicContact CG-CZ 4.09Å; Q811-F815 WeakPolarHBondContact O-CB 3.33Å; Q811-F815 PolarHBondContact O-N 3.16Å; E812-F815 WeakPolarHBondContact O-CB 3.31Å; E812-F815 PolarHBondContact O-N 2.88Å; E812-F815 VanDerWaalsContact O-N 3.15Å; F815-T817 VanDerWaalsContact C-N 3.25Å; F815-T817 PolarHBondContact O-N 3.23Å; F815-L818 PolarHBondContact O-N 3.28Å; F815-L818 VanDerWaalsContact O-N 3.12Å; F815-V819 HydrophobicContact CE1-CG2 4.19Å; F815-V819 HydrophobicContact CE2-CG2 4.29Å; F815-V819 HydrophobicContact CZ-CG2 4.03Å; F815-V819 WeakPolarHBondContact O-CG2 3.45Å; F815-V819 PolarHBondContact O-N 3.04Å
816	W	97.4	Very high	96.1	Very high	2 Å²	2	13.6 Å²	13.6	1%	0.008	7%	0.069	C	C	.	.	H	α-helix	trans	-64.2	-30.4	175.2	-72.4	117.2	0	0	0	112.6	V719 V723 R727 L730 Y734 E812 D813 V819 A820	V719-W816 HydrophobicContact CG1-CB 3.78Å; V723-W816 HydrophobicContact CB-CE3 4.05Å; V723-W816 HydrophobicContact CG1-CB 4.45Å; V723-W816 HydrophobicContact CG1-CE3 4.21Å; V723-W816 WeakPolarHBondContact CG1-O 3.37Å; V723-W816 HydrophobicContact CG2-CB 4.24Å; V723-W816 HydrophobicContact CG2-CD2 4.22Å; V723-W816 HydrophobicContact CG2-CE3 4.01Å; V723-W816 HydrophobicContact CG2-CG 4.31Å; R727-W816 HydrophobicContact CB-CH2 4.24Å; R727-W816 HydrophobicContact CB-CZ2 4.35Å; R727-W816 HydrophobicContact CB-CZ3 4.39Å; R727-W816 HydrophobicContact CG-CD2 4.48Å; R727-W816 HydrophobicContact CG-CH2 4.08Å; R727-W816 HydrophobicContact CG-CZ2 3.71Å; L730-W816 HydrophobicContact CD1-CH2 3.78Å; Y734-W816 HydrophobicContact CD1-CH2 4.06Å; Y734-W816 HydrophobicContact CD1-CZ2 4.18Å; Y734-W816 HydrophobicContact CE1-CH2 4.43Å; E812-W816 VanDerWaalsContact CG-CD1 3.46Å; E812-W816 PolarHBondContact O-N 3.41Å; E812-W816 PolarHBondContact OE1-NE1 2.99Å; D813-W816 PolarHBondContact O-N 2.73Å; W816-V819 HydrophobicContact CE3-CB 4.21Å; W816-V819 HydrophobicContact CE3-CG1 4.22Å; W816-V819 HydrophobicContact CE3-CG2 4.38Å; W816-V819 HydrophobicContact CZ3-CG1 4.27Å; W816-V819 PolarHBondContact O-N 3.41Å; W816-A820 WeakPolarHBondContact O-CB 3.45Å; W816-A820 PolarHBondContact O-N 3.01Å
817	T	98.2	Very high	96	Very high	1 Å²	1	15.4 Å²	15.4	1%	0.006	8%	0.081	C	C	.	.	H	α-helix	trans	-63.4	-44.8	171.8	-55	0	0	0	0	111	V719 A805 L809 D813 A814 F815 A820 I821 W892 L896	V719-T817 HydrophobicContact CG2-CG2 4.06Å; V719-T817 WeakPolarHBondContact CG2-OG1 3.4Å; A805-T817 HydrophobicContact CB-CG2 3.85Å; L809-T817 WeakPolarHBondContact CD1-OG1 3.41Å; D813-T817 WeakPolarHBondContact O-CB 3.34Å; D813-T817 PolarHBondContact O-N 3.42Å; D813-T817 PolarHBondContact O-OG1 3.46Å; A814-T817 WeakPolarHBondContact O-CB 3.41Å; A814-T817 PolarHBondContact O-N 2.82Å; F815-T817 VanDerWaalsContact C-N 3.25Å; F815-T817 PolarHBondContact O-N 3.23Å; T817-A820 PolarHBondContact O-N 3.49Å; T817-I821 HydrophobicContact CG2-CD1 4.03Å; T817-I821 WeakPolarHBondContact O-CG1 3.43Å; T817-I821 PolarHBondContact O-N 3.48Å; T817-W892 HydrophobicContact CG2-CZ3 4.39Å; T817-L896 HydrophobicContact CG2-CD2 4.13Å
818	L	97.7	Very high	95.8	Very high	2 Å²	2	25.9 Å²	25.9	1%	0.01	12%	0.12	C	C	.	.	H	α-helix	trans	-65.3	-40.2	177.3	-165.2	62.8	0	0	0	111.5	V781 L782 F785 L798 L801 A802 A814 F815 I821 V822	V781-L818 HydrophobicContact CG1-CD2 4.48Å; L782-L818 HydrophobicContact CD2-CD2 4.05Å; F785-L818 HydrophobicContact CB-CD2 3.73Å; F785-L818 HydrophobicContact CD1-CD2 4.02Å; F785-L818 HydrophobicContact CD2-CB 4.21Å; F785-L818 HydrophobicContact CD2-CD2 3.83Å; F785-L818 HydrophobicContact CD2-CG 3.85Å; F785-L818 HydrophobicContact CE2-CG 4.19Å; F785-L818 HydrophobicContact CG-CD2 3.54Å; F785-L818 HydrophobicContact CG-CG 4.06Å; L798-L818 HydrophobicContact CB-CD1 4.29Å; L798-L818 HydrophobicContact CD2-CD1 4.08Å; L801-L818 HydrophobicContact CB-CD1 3.91Å; L801-L818 HydrophobicContact CD1-CD1 4.11Å; A802-L818 HydrophobicContact CB-CD2 4.45Å; A814-L818 PolarHBondContact O-N 3.03Å; F815-L818 PolarHBondContact O-N 3.28Å; F815-L818 VanDerWaalsContact O-N 3.12Å; L818-I821 PolarHBondContact O-N 2.78Å; L818-V822 HydrophobicContact CD1-CG2 4.26Å; L818-V822 HydrophobicContact CG-CG2 4.41Å; L818-V822 WeakPolarHBondContact O-CB 3.42Å; L818-V822 VanDerWaalsContact O-CG2 3.3Å; L818-V822 WeakPolarHBondContact O-CG2 3.49Å; L818-V822 PolarHBondContact O-N 3.42Å
819	V	96.9	Very high	95.7	Very high	0 Å²	0	28.1 Å²	28.1	0%	0	13%	0.132	C	C	.	.	H	α-helix	trans	-61.6	-43.3	172	175.4	0	0	0	0	111.7	F785 R788 F815 W816 E823	F785-V819 HydrophobicContact CD2-CG2 3.97Å; F785-V819 HydrophobicContact CE2-CG2 4.03Å; R788-V819 HydrophobicContact CG-CG2 4.32Å; F815-V819 HydrophobicContact CE1-CG2 4.19Å; F815-V819 HydrophobicContact CE2-CG2 4.29Å; F815-V819 HydrophobicContact CZ-CG2 4.03Å; F815-V819 WeakPolarHBondContact O-CG2 3.45Å; F815-V819 PolarHBondContact O-N 3.04Å; W816-V819 HydrophobicContact CE3-CB 4.21Å; W816-V819 HydrophobicContact CE3-CG1 4.22Å; W816-V819 HydrophobicContact CE3-CG2 4.38Å; W816-V819 HydrophobicContact CZ3-CG1 4.27Å; W816-V819 PolarHBondContact O-N 3.41Å; V819-E823 HydrophobicContact CG1-CG 4.47Å; V819-E823 WeakPolarHBondContact O-CB 2.77Å; V819-E823 PolarHBondContact O-N 2.98Å
820	A	97.5	Very high	95.7	Very high	1 Å²	1	28.1 Å²	28.1	1%	0.008	13%	0.132	C	C	.	.	I	π-helix	trans	-60.6	-46.3	176.3	0	0	0	0	0	111.9	V723 W816 T817 V824 F825	V723-A820 HydrophobicContact CG1-CB 3.78Å; W816-A820 WeakPolarHBondContact O-CB 3.45Å; W816-A820 PolarHBondContact O-N 3.01Å; T817-A820 PolarHBondContact O-N 3.49Å; A820-V824 CarbonylContact O-C 3.58Å; A820-V824 WeakPolarHBondContact O-CA 3.33Å; A820-V824 VanDerWaalsContact O-CB 3.27Å; A820-V824 WeakPolarHBondContact O-CB 3.47Å; A820-V824 PolarHBondContact O-N 2.82Å; A820-V824 VanDerWaalsContact O-N 3.11Å; A820-F825 PolarHBondContact O-N 3.35Å
821	I	97.8	Very high	95.8	Very high	0 Å²	0	26.6 Å²	26.6	0%	0	12%	0.124	C	C	.	.	I	π-helix	trans	-65.4	-49.6	-179.9	-65.1	167.9	0	0	0	110.9	L801 T817 L818 F825 M826 W892 F895	L801-I821 HydrophobicContact CD1-CG2 3.98Å; T817-I821 HydrophobicContact CG2-CD1 4.03Å; T817-I821 WeakPolarHBondContact O-CG1 3.43Å; T817-I821 PolarHBondContact O-N 3.48Å; L818-I821 PolarHBondContact O-N 2.78Å; I821-F825 HydrophobicContact CG1-CD2 4.23Å; I821-M826 HydrophobicContact CG2-CG 4.31Å; I821-M826 WeakPolarHBondContact O-CB 3.13Å; I821-M826 WeakPolarHBondContact O-CG 3.41Å; I821-M826 PolarHBondContact O-N 3.34Å; I821-W892 HydrophobicContact CD1-CH2 3.96Å; I821-W892 HydrophobicContact CD1-CZ3 4.14Å; I821-F895 HydrophobicContact CD1-CE1 3.92Å; I821-F895 HydrophobicContact CG1-CE1 3.78Å; I821-F895 HydrophobicContact CG1-CZ 4.1Å; I821-F895 HydrophobicContact CG2-CE1 4.49Å; I821-F895 HydrophobicContact CG2-CZ 4.11Å
822	V	96.8	Very high	95.7	Very high	4 Å²	4	26.8 Å²	26.8	2%	0.024	13%	0.127	C	C	.	.	I	π-helix	trans	-78.7	-39.4	-171.5	178.6	0	0	0	0	113	F785 I792 L798 L818 Y831	F785-V822 HydrophobicContact CE1-CG1 4.43Å; F785-V822 HydrophobicContact CE1-CG2 4.49Å; F785-V822 HydrophobicContact CE2-CB 4.18Å; F785-V822 HydrophobicContact CE2-CG2 4.35Å; F785-V822 HydrophobicContact CZ-CB 3.75Å; F785-V822 HydrophobicContact CZ-CG1 3.66Å; F785-V822 HydrophobicContact CZ-CG2 3.89Å; I792-V822 HydrophobicContact CD1-CG1 3.38Å; L798-V822 HydrophobicContact CD2-CG2 3.7Å; L818-V822 HydrophobicContact CD1-CG2 4.26Å; L818-V822 HydrophobicContact CG-CG2 4.41Å; L818-V822 WeakPolarHBondContact O-CB 3.42Å; L818-V822 VanDerWaalsContact O-CG2 3.3Å; L818-V822 WeakPolarHBondContact O-CG2 3.49Å; L818-V822 PolarHBondContact O-N 3.42Å; V822-Y831 HydrophobicContact CB-CD2 4.28Å; V822-Y831 HydrophobicContact CG1-CD2 3.98Å; V822-Y831 HydrophobicContact CG2-CD2 3.81Å; V822-Y831 HydrophobicContact CG2-CE2 3.9Å
823	E	94.8	Very high	95.3	Very high	50 Å²	50	33.5 Å²	33.5	23%	0.234	16%	0.155	C	C	.	.	I	π-helix	trans	-102.6	-18	-173.4	-56.7	-163.8	168	0	0	114.7	R788 N789 V819	R788-E823 IonicContact CZ-OE1 2.88Å; R788-E823 IonicContact CZ-OE2 2.73Å; R788-E823 IonicContact NH1-OE1 3.82Å; R788-E823 PolarHBondContact NH1-OE1 3.12Å; R788-E823 IonicContact NH1-OE2 3.12Å; R788-E823 PolarHBondContact NH1-OE2 3.05Å; R788-E823 IonicContact NH2-OE1 3.21Å; R788-E823 IonicContact NH2-OE2 3.35Å; R788-E823 PolarHBondContact NH2-OE2 2.68Å; N789-E823 PolarHBondContact ND2-OE1 3.4Å; V819-E823 HydrophobicContact CG1-CG 4.47Å; V819-E823 WeakPolarHBondContact O-CB 2.77Å; V819-E823 PolarHBondContact O-N 2.98Å
824	V	94.8	Very high	94.9	Very high	54 Å²	54	36.5 Å²	36.5	33%	0.327	17%	0.174	S	C	.	.	I	π-helix	trans	-114.9	-39.5	-176.2	-168	0	0	0	0	112.9	F726 A820	F726-V824 HydrophobicContact CD2-CG2 4.37Å; F726-V824 HydrophobicContact CE2-CG2 3.82Å; A820-V824 CarbonylContact O-C 3.58Å; A820-V824 WeakPolarHBondContact O-CA 3.33Å; A820-V824 VanDerWaalsContact O-CB 3.27Å; A820-V824 WeakPolarHBondContact O-CB 3.47Å; A820-V824 PolarHBondContact O-N 2.82Å; A820-V824 VanDerWaalsContact O-N 3.11Å
825	F	95.6	Very high	94.7	Very high	16 Å²	16	38.4 Å²	38.4	7%	0.07	19%	0.185	C	C	.	.	I	π-helix	trans	-90	-50.8	-178.3	-66.8	-8.6	0	0	0	113.4	H722 A820 I821 F895 L896 P900	H722-F825 HydrophobicContact CB-CE1 4.34Å; H722-F825 AromaticContact CD2-CE1 3.58Å; H722-F825 AromaticContact CD2-CZ 3.53Å; H722-F825 AromaticContact CE1-CE1 3.87Å; H722-F825 AromaticContact CG-CE1 3.67Å; H722-F825 AromaticContact ND1-CE1 3.85Å; H722-F825 AromaticContact NE2-CE1 3.72Å; H722-F825 AromaticContact NE2-CZ 3.79Å; A820-F825 PolarHBondContact O-N 3.35Å; I821-F825 HydrophobicContact CG1-CD2 4.23Å; F825-F895 HydrophobicContact CD2-CE1 4.08Å; F825-F895 AromaticContact CD2-CE2 3.96Å; F825-F895 HydrophobicContact CD2-CE2 3.96Å; F825-F895 AromaticContact CD2-CZ 3.68Å; F825-F895 HydrophobicContact CD2-CZ 3.68Å; F825-F895 HydrophobicContact CE2-CE1 4.32Å; F825-F895 HydrophobicContact CE2-CZ 4.33Å; F825-L896 HydrophobicContact CE2-CD2 4.33Å; F825-P900 VanDerWaalsContact O-CG 3.32Å; F825-P900 WeakPolarHBondContact O-CG 3.45Å
826	M	95.6	Very high	94.5	Very high	10 Å²	10	39 Å²	39	5%	0.049	19%	0.188	C	C	.	.	S	Bend	trans	-80.9	154.3	-176.8	-65.1	-54.4	-159.2	0	0	112.1	I821 Y830 Y831 P900 I903	I821-M826 HydrophobicContact CG2-CG 4.31Å; I821-M826 WeakPolarHBondContact O-CB 3.13Å; I821-M826 WeakPolarHBondContact O-CG 3.41Å; I821-M826 PolarHBondContact O-N 3.34Å; M826-Y830 HydrophobicContact CB-CD1 4.11Å; M826-Y830 HydrophobicContact CB-CD2 4.47Å; M826-Y830 HydrophobicContact CB-CG 3.97Å; M826-Y830 HydrophobicContact CE-CD1 4.36Å; M826-Y830 HydrophobicContact CE-CE1 3.59Å; M826-Y830 HydrophobicContact CE-CE2 4.45Å; M826-Y830 HydrophobicContact CG-CD1 3.97Å; M826-Y830 HydrophobicContact CG-CE1 4.13Å; M826-Y830 HydrophobicContact CG-CG 4.26Å; M826-Y830 HydrophobicContact SD-CD1 4.24Å; M826-Y830 HydrophobicContact SD-CD2 4.33Å; M826-Y830 HydrophobicContact SD-CE1 3.91Å; M826-Y830 HydrophobicContact SD-CE2 4.01Å; M826-Y830 HydrophobicContact SD-CG 4.44Å; M826-Y831 HydrophobicContact CB-CE2 4.19Å; M826-Y831 HydrophobicContact CG-CE2 3.74Å; M826-P900 HydrophobicContact SD-CB 4.37Å; M826-I903 HydrophobicContact CE-CD1 3.45Å; M826-I903 VanDerWaalsContact CE-CD1 3.45Å; M826-I903 HydrophobicContact SD-CD1 4.37Å
827	P	93.5	Very high	94.4	Very high	39 Å²	39	39 Å²	39	25%	0.253	19%	0.189	S	C	.	.			trans	-54.7	144.9	165.1	-22.3	32.3	0	0	0	111.3	D829 Y830	P827-D829 PolarHBondContact O-N 3.09Å; P827-Y830 HydrophobicContact CG-CD2 4.11Å; P827-Y830 WeakPolarHBondContact O-CB 3.34Å; P827-Y830 PolarHBondContact O-N 2.99Å
828	R	90.5	Very high	94.2	Very high	220 Å²	220	39.1 Å²	39.1	83%	0.83	19%	0.189	S	C	*	.	T	Hydrogen-bonded Turn	trans	-53.5	-41.9	178.7	-66.4	-175.6	176.5	-162	-2.7	112.6	Y830 T832	R828-Y830 PolarHBondContact O-N 3.36Å; R828-Y830 VanDerWaalsContact O-N 3.16Å; R828-T832 WeakPolarHBondContact O-CG2 3.14Å
829	D	91.8	Very high	94.1	Very high	51 Å²	51	42 Å²	42	27%	0.273	20%	0.203	S	C	.	.	T	Hydrogen-bonded Turn	trans	-76.1	2.6	-176.1	-50.2	-4	0	0	0	113.1	P827 T832 L836 G837 R972	P827-D829 PolarHBondContact O-N 3.09Å; D829-T832 PolarHBondContact O-OG1 2.8Å; D829-L836 HydrophobicContact CB-CB 4.06Å; D829-L836 HydrophobicContact CB-CD2 4.23Å; D829-L836 HydrophobicContact CB-CG 4.29Å; D829-L836 PolarHBondContact O-N 3.37Å; D829-G837 PolarHBondContact O-N 3.43Å; D829-G837 VanDerWaalsContact O-N 3.16Å; D829-R972 IonicContact OD2-NH2 3.7Å; D829-R972 PolarHBondContact OD2-NH2 3.19Å
830	Y	95.8	Very high	94.1	Very high	0 Å²	0	42.2 Å²	42.2	0%	0	20%	0.204	C	C	.	.	S	Bend	trans	-74.5	-47.3	-167.2	-165.6	-88.7	0	0	0	114.9	M826 P827 R828 L835 G837 S838 D841 F875 L876	M826-Y830 HydrophobicContact CB-CD1 4.11Å; M826-Y830 HydrophobicContact CB-CD2 4.47Å; M826-Y830 HydrophobicContact CB-CG 3.97Å; M826-Y830 HydrophobicContact CE-CD1 4.36Å; M826-Y830 HydrophobicContact CE-CE1 3.59Å; M826-Y830 HydrophobicContact CE-CE2 4.45Å; M826-Y830 HydrophobicContact CG-CD1 3.97Å; M826-Y830 HydrophobicContact CG-CE1 4.13Å; M826-Y830 HydrophobicContact CG-CG 4.26Å; M826-Y830 HydrophobicContact SD-CD1 4.24Å; M826-Y830 HydrophobicContact SD-CD2 4.33Å; M826-Y830 HydrophobicContact SD-CE1 3.91Å; M826-Y830 HydrophobicContact SD-CE2 4.01Å; M826-Y830 HydrophobicContact SD-CG 4.44Å; P827-Y830 HydrophobicContact CG-CD2 4.11Å; P827-Y830 WeakPolarHBondContact O-CB 3.34Å; P827-Y830 PolarHBondContact O-N 2.99Å; R828-Y830 PolarHBondContact O-N 3.36Å; R828-Y830 VanDerWaalsContact O-N 3.16Å; Y830-L835 WeakPolarHBondContact O-CD2 3.44Å; Y830-G837 WeakPolarHBondContact CD2-O 3.41Å; Y830-S838 VanDerWaalsContact CD1-OG 3.26Å; Y830-S838 WeakPolarHBondContact CD1-OG 3.47Å; Y830-S838 VanDerWaalsContact CE1-OG 3.28Å; Y830-S838 WeakPolarHBondContact CE1-OG 3.48Å; Y830-S838 PolarHBondContact O-OG 3.15Å; Y830-D841 HydrophobicContact CE2-CB 4.19Å; Y830-D841 WeakPolarHBondContact CE2-OD2 3.46Å; Y830-F875 VanDerWaalsContact OH-C 3.31Å; Y830-F875 PolarHBondContact OH-O 3.19Å; Y830-L876 HydrophobicContact CE1-CD1 4.5Å
831	Y	95.7	Very high	94.1	Very high	4 Å²	4	42.2 Å²	42.2	2%	0.016	20%	0.204	C	C	.	.	S	Bend	trans	-99.6	12.8	177.3	-65.7	-70.8	0	0	0	113.1	C795 L798 V822 M826 L876	C795-Y831 HydrophobicContact CB-CD1 4.22Å; L798-Y831 HydrophobicContact CD2-CD1 3.84Å; L798-Y831 HydrophobicContact CD2-CD2 4.2Å; L798-Y831 HydrophobicContact CD2-CE1 3.95Å; L798-Y831 HydrophobicContact CD2-CE2 4.27Å; L798-Y831 HydrophobicContact CD2-CG 3.98Å; V822-Y831 HydrophobicContact CB-CD2 4.28Å; V822-Y831 HydrophobicContact CG1-CD2 3.98Å; V822-Y831 HydrophobicContact CG2-CD2 3.81Å; V822-Y831 HydrophobicContact CG2-CE2 3.9Å; M826-Y831 HydrophobicContact CB-CE2 4.19Å; M826-Y831 HydrophobicContact CG-CE2 3.74Å; Y831-L876 HydrophobicContact CD1-CD1 3.84Å; Y831-L876 HydrophobicContact CE1-CD1 3.6Å; Y831-L876 HydrophobicContact CE1-CG 4.16Å; Y831-L876 WeakPolarHBondContact CE1-O 3.39Å; Y831-L876 PolarHBondContact OH-O 3.36Å
832	T	92.1	Very high	94.1	Very high	33 Å²	33	42.7 Å²	42.7	20%	0.202	21%	0.206	C	C	.	.	S	Bend	trans	-73.2	167.4	174.6	67.2	0	0	0	0	111.4	I792 R828 D829 T834 L835	I792-T832 HydrophobicContact CG1-CG2 4.47Å; R828-T832 WeakPolarHBondContact O-CG2 3.14Å; D829-T832 PolarHBondContact O-OG1 2.8Å; T832-T834 PolarHBondContact O-N 3.48Å; T832-T834 PolarHBondContact OG1-OG1 3Å; T832-L835 WeakPolarHBondContact O-CD2 3.27Å; T832-L835 PolarHBondContact O-N 2.97Å
833	K	87.4	Confident	94.1	Very high	202 Å²	202	45.8 Å²	45.8	88%	0.878	22%	0.217	S	C	*	.	T	Hydrogen-bonded Turn	trans	-57.9	-20.7	-177.8	-63.4	172.9	-174.8	167.7	0	115
834	T	87.8	Confident	94.3	Very high	77 Å²	77	43.4 Å²	43.4	47%	0.472	21%	0.206	S	C	.	.	T	Hydrogen-bonded Turn	trans	-93	-11.5	175.3	57	0	0	0	0	113.3	T832 L836 Q839	T832-T834 PolarHBondContact O-N 3.48Å; T832-T834 PolarHBondContact OG1-OG1 3Å; T834-L836 PolarHBondContact O-N 2.91Å; T834-Q839 PolarHBondContact O-NE2 3.09Å
835	L	92.6	Very high	94.4	Very high	41 Å²	41	40.9 Å²	40.9	22%	0.215	19%	0.191	C	C	.	.			trans	49.8	29	-174.9	-57.9	170.9	0	0	0	113	Y830 T832 G837 S838 Q839 F872 L876	Y830-L835 WeakPolarHBondContact O-CD2 3.44Å; T832-L835 WeakPolarHBondContact O-CD2 3.27Å; T832-L835 PolarHBondContact O-N 2.97Å; L835-G837 VanDerWaalsContact C-N 3.32Å; L835-G837 PolarHBondContact O-N 2.91Å; L835-S838 WeakPolarHBondContact O-CA 3.44Å; L835-S838 VanDerWaalsContact O-CB 3.31Å; L835-S838 WeakPolarHBondContact O-CB 3.32Å; L835-S838 PolarHBondContact O-N 3.39Å; L835-Q839 PolarHBondContact O-N 3.07Å; L835-F872 HydrophobicContact CB-CZ 4.32Å; L835-F872 HydrophobicContact CD1-CE1 4.38Å; L835-F872 HydrophobicContact CD1-CZ 3.91Å; L835-L876 HydrophobicContact CD2-CD1 4.39Å
836	L	93.6	Very high	94.5	Very high	12 Å²	12	43.5 Å²	43.5	6%	0.063	20%	0.202	C	C	.	.	H	α-helix	trans	-55.3	-44.1	-171	170.7	60	0	0	0	112.2	D829 T834 S838 Q839 V840 L968 V971 R972 L975	D829-L836 HydrophobicContact CB-CB 4.06Å; D829-L836 HydrophobicContact CB-CD2 4.23Å; D829-L836 HydrophobicContact CB-CG 4.29Å; D829-L836 PolarHBondContact O-N 3.37Å; T834-L836 PolarHBondContact O-N 2.91Å; L836-S838 VanDerWaalsContact C-N 3.28Å; L836-S838 PolarHBondContact O-N 3.35Å; L836-Q839 PolarHBondContact O-N 3.33Å; L836-V840 HydrophobicContact CD1-CG2 4.18Å; L836-V840 WeakPolarHBondContact O-CB 3.38Å; L836-V840 VanDerWaalsContact O-CG2 3.27Å; L836-V840 WeakPolarHBondContact O-CG2 3.25Å; L836-V840 PolarHBondContact O-N 3.31Å; L836-L968 HydrophobicContact CD1-CD1 4.02Å; L836-L968 HydrophobicContact CD2-CD1 3.79Å; L836-L968 HydrophobicContact CG-CD1 3.78Å; L836-V971 HydrophobicContact CD1-CB 3.73Å; L836-V971 HydrophobicContact CD1-CG1 3.37Å; L836-R972 HydrophobicContact CD1-CG 4.35Å; L836-R972 HydrophobicContact CD2-CG 3.88Å; L836-L975 HydrophobicContact CD1-CD1 4.08Å
837	G	95.1	Very high	94.6	Very high	3 Å²	3	45 Å²	45	3%	0.031	21%	0.211	C	C	.	.	H	α-helix	trans	-62.7	-33.9	175.6	0	0	0	0	0	113.4	D829 Y830 L835 D841	D829-G837 PolarHBondContact O-N 3.43Å; D829-G837 VanDerWaalsContact O-N 3.16Å; Y830-G837 WeakPolarHBondContact CD2-O 3.41Å; L835-G837 VanDerWaalsContact C-N 3.32Å; L835-G837 PolarHBondContact O-N 2.91Å; G837-D841 PolarHBondContact O-N 3.17Å; G837-D841 VanDerWaalsContact O-N 3.1Å
838	S	95.4	Very high	94.8	Very high	2 Å²	2	43.6 Å²	43.6	1%	0.014	20%	0.2	C	C	.	.	H	α-helix	trans	-73.3	-40.9	178.5	-58.4	0	0	0	0	111.7	Y830 L835 L836 D841 Q842	Y830-S838 VanDerWaalsContact CD1-OG 3.26Å; Y830-S838 WeakPolarHBondContact CD1-OG 3.47Å; Y830-S838 VanDerWaalsContact CE1-OG 3.28Å; Y830-S838 WeakPolarHBondContact CE1-OG 3.48Å; Y830-S838 PolarHBondContact O-OG 3.15Å; L835-S838 WeakPolarHBondContact O-CA 3.44Å; L835-S838 VanDerWaalsContact O-CB 3.31Å; L835-S838 WeakPolarHBondContact O-CB 3.32Å; L835-S838 PolarHBondContact O-N 3.39Å; L836-S838 VanDerWaalsContact C-N 3.28Å; L836-S838 PolarHBondContact O-N 3.35Å; S838-D841 PolarHBondContact O-N 3Å; S838-Q842 PolarHBondContact O-N 3.26Å; S838-Q842 VanDerWaalsContact O-N 3.15Å
839	Q	95.2	Very high	95.1	Very high	63 Å²	63	33.1 Å²	33.1	29%	0.294	16%	0.161	S	C	.	.	H	α-helix	trans	-62.5	-44.3	174.4	-65.4	-170.6	58.1	0	0	111.9	T834 L835 L836 D841 Q842 R843 V971	T834-Q839 PolarHBondContact O-NE2 3.09Å; L835-Q839 PolarHBondContact O-N 3.07Å; L836-Q839 PolarHBondContact O-N 3.33Å; Q839-D841 VanDerWaalsContact C-N 3.33Å; Q839-D841 PolarHBondContact O-N 2.96Å; Q839-Q842 PolarHBondContact O-N 2.95Å; Q839-R843 PolarHBondContact O-N 3.12Å; Q839-V971 HydrophobicContact CB-CG1 4.21Å
840	V	97.2	Very high	95.3	Very high	4 Å²	4	33 Å²	33	2%	0.024	17%	0.165	C	C	.	.	H	α-helix	trans	-58.8	-45.1	174.3	167.3	0	0	0	0	110.9	L836 Q842 R843 V844 R964 H967 L968 V971	L836-V840 HydrophobicContact CD1-CG2 4.18Å; L836-V840 WeakPolarHBondContact O-CB 3.38Å; L836-V840 VanDerWaalsContact O-CG2 3.27Å; L836-V840 WeakPolarHBondContact O-CG2 3.25Å; L836-V840 PolarHBondContact O-N 3.31Å; V840-Q842 VanDerWaalsContact C-N 3.33Å; V840-Q842 PolarHBondContact O-N 3Å; V840-R843 PolarHBondContact O-N 3.28Å; V840-R843 VanDerWaalsContact O-N 3.1Å; V840-V844 HydrophobicContact CG1-CG2 4.29Å; V840-V844 WeakPolarHBondContact O-CG2 3.1Å; V840-V844 PolarHBondContact O-N 3.18Å; V840-R964 HydrophobicContact CG1-CB 4.11Å; V840-R964 HydrophobicContact CG1-CG 4.13Å; V840-R964 WeakPolarHBondContact CG1-O 3.48Å; V840-H967 HydrophobicContact CG1-CB 4.17Å; V840-L968 HydrophobicContact CG2-CB 4.14Å; V840-L968 HydrophobicContact CG2-CD1 4.04Å; V840-V971 HydrophobicContact CG2-CB 4.24Å; V840-V971 HydrophobicContact CG2-CG2 3.94Å
841	D	97.3	Very high	95.4	Very high	1 Å²	1	36.6 Å²	36.6	1%	0.005	18%	0.181	C	C	.	.	H	α-helix	trans	-64.3	-32.6	179.7	-88.7	12	0	0	0	113.6	Y830 G837 S838 Q839 R843 V844 F845 F875 F904 R964	Y830-D841 HydrophobicContact CE2-CB 4.19Å; Y830-D841 WeakPolarHBondContact CE2-OD2 3.46Å; G837-D841 PolarHBondContact O-N 3.17Å; G837-D841 VanDerWaalsContact O-N 3.1Å; S838-D841 PolarHBondContact O-N 3Å; Q839-D841 VanDerWaalsContact C-N 3.33Å; Q839-D841 PolarHBondContact O-N 2.96Å; D841-R843 VanDerWaalsContact C-N 3.34Å; D841-R843 PolarHBondContact O-N 2.91Å; D841-V844 PolarHBondContact O-N 2.9Å; D841-F845 WeakPolarHBondContact O-CB 3.28Å; D841-F845 PolarHBondContact O-N 3.1Å; D841-F875 HydrophobicContact CB-CD1 4.1Å; D841-F875 HydrophobicContact CB-CE1 4.31Å; D841-F904 HydrophobicContact CB-CE1 4.39Å; D841-F904 HydrophobicContact CB-CZ 3.91Å; D841-F904 VanDerWaalsContact CG-CZ 3.44Å; D841-F904 WeakPolarHBondContact O-CE1 3.25Å; D841-R964 WeakPolarHBondContact OD1-CG 3.18Å; D841-R964 IonicContact OD1-CZ 3.34Å; D841-R964 IonicContact OD1-NE 3.54Å; D841-R964 PolarHBondContact OD1-NE 3.49Å; D841-R964 IonicContact OD1-NH2 2.75Å; D841-R964 PolarHBondContact OD1-NH2 3.47Å; D841-R964 IonicContact OD2-CZ 2.7Å; D841-R964 IonicContact OD2-NE 3.84Å; D841-R964 IonicContact OD2-NH2 3.18Å; D841-R964 PolarHBondContact OD2-NH2 2.98Å
842	Q	97.6	Very high	95.4	Very high	11 Å²	11	38.8 Å²	38.8	5%	0.051	19%	0.191	C	C	.	.	H	α-helix	trans	-65.3	-36.6	172	-63.2	-48	-75	0	0	112.2	S838 Q839 V840 F845 K846 T871 F872 F875	S838-Q842 PolarHBondContact O-N 3.26Å; S838-Q842 VanDerWaalsContact O-N 3.15Å; Q839-Q842 PolarHBondContact O-N 2.95Å; V840-Q842 VanDerWaalsContact C-N 3.33Å; V840-Q842 PolarHBondContact O-N 3Å; Q842-F845 CarbonylContact O-C 3.57Å; Q842-F845 WeakPolarHBondContact O-CB 3.31Å; Q842-F845 PolarHBondContact O-N 3.41Å; Q842-K846 PolarHBondContact O-N 3.41Å; Q842-T871 PolarHBondContact OE1-OG1 3.43Å; Q842-F872 HydrophobicContact CG-CB 4.39Å; Q842-F872 HydrophobicContact CG-CD2 3.86Å; Q842-F875 VanDerWaalsContact NE2-CG 3.32Å
843	R	97	Very high	95.6	Very high	69 Å²	69	37.3 Å²	37.3	26%	0.26	18%	0.182	S	C	.	.	H	α-helix	trans	-69	-42.9	175.5	-62.5	-177.1	-177.5	-157.6	-2.3	112	Q839 V840 D841 F845 K846 D847 H967 E974	Q839-R843 PolarHBondContact O-N 3.12Å; V840-R843 PolarHBondContact O-N 3.28Å; V840-R843 VanDerWaalsContact O-N 3.1Å; D841-R843 VanDerWaalsContact C-N 3.34Å; D841-R843 PolarHBondContact O-N 2.91Å; R843-F845 PolarHBondContact O-N 3Å; R843-K846 PolarHBondContact O-N 3.39Å; R843-K846 VanDerWaalsContact O-N 3.15Å; R843-D847 PolarHBondContact O-N 3.47Å; R843-H967 HydrophobicContact CB-CB 4.12Å; R843-E974 IonicContact CZ-OE1 3.59Å; R843-E974 IonicContact CZ-OE2 2.69Å; R843-E974 VanDerWaalsContact NH1-CD 3.34Å; R843-E974 IonicContact NH1-OE1 2.59Å; R843-E974 PolarHBondContact NH1-OE1 2.92Å; R843-E974 IonicContact NH1-OE2 2.88Å; R843-E974 PolarHBondContact NH1-OE2 2.74Å; R843-E974 IonicContact NH2-OE1 2.67Å; R843-E974 IonicContact NH2-OE2 2.61Å; R843-E974 PolarHBondContact NH2-OE2 2.62Å
844	V	97.7	Very high	96.1	Very high	0 Å²	0	31.3 Å²	31.3	0%	0	16%	0.163	C	C	.	.	H	α-helix	trans	-60.1	-34.5	171.8	178.6	0	0	0	0	111	V840 D841 L848 F904 I960 R963 R964	V840-V844 HydrophobicContact CG1-CG2 4.29Å; V840-V844 WeakPolarHBondContact O-CG2 3.1Å; V840-V844 PolarHBondContact O-N 3.18Å; D841-V844 PolarHBondContact O-N 2.9Å; V844-L848 HydrophobicContact CG1-CD1 4.15Å; V844-L848 WeakPolarHBondContact O-CD1 3.49Å; V844-L848 VanDerWaalsContact O-CG 3.28Å; V844-L848 WeakPolarHBondContact O-CG 3.44Å; V844-L848 PolarHBondContact O-N 3.19Å; V844-L848 VanDerWaalsContact O-N 3.14Å; V844-F904 HydrophobicContact CB-CE1 3.8Å; V844-F904 HydrophobicContact CB-CZ 4.23Å; V844-F904 HydrophobicContact CG1-CD1 4.39Å; V844-F904 HydrophobicContact CG1-CE1 3.57Å; V844-F904 HydrophobicContact CG1-CZ 3.96Å; V844-I960 HydrophobicContact CG1-CG2 4.09Å; V844-R963 HydrophobicContact CB-CB 4.35Å; V844-R963 HydrophobicContact CG1-CB 3.85Å; V844-R963 HydrophobicContact CG2-CB 3.83Å; V844-R964 HydrophobicContact CG2-CB 4.48Å; V844-R964 HydrophobicContact CG2-CG 3.99Å
845	F	98	Very high	96.6	Very high	0 Å²	0	33.6 Å²	33.6	0%	0	16%	0.163	C	C	.	.	H	α-helix	trans	-71.8	-38.7	174.1	-176.8	-111.8	0	0	0	112.7	D841 Q842 R843 L848 M849 F867 T871 F875 F904 A907 L908 F911	D841-F845 WeakPolarHBondContact O-CB 3.28Å; D841-F845 PolarHBondContact O-N 3.1Å; Q842-F845 CarbonylContact O-C 3.57Å; Q842-F845 WeakPolarHBondContact O-CB 3.31Å; Q842-F845 PolarHBondContact O-N 3.41Å; R843-F845 PolarHBondContact O-N 3Å; F845-L848 CarbonylContact O-C 3.42Å; F845-L848 PolarHBondContact O-N 2.65Å; F845-L848 VanDerWaalsContact O-N 3.07Å; F845-M849 HydrophobicContact CD1-CG 4.18Å; F845-M849 HydrophobicContact CE1-CG 3.67Å; F845-M849 HydrophobicContact CE1-SD 4.04Å; F845-M849 HydrophobicContact CE2-CG 4.11Å; F845-M849 HydrophobicContact CE2-SD 4.21Å; F845-M849 HydrophobicContact CZ-CG 3.63Å; F845-M849 HydrophobicContact CZ-SD 3.55Å; F845-M849 VanDerWaalsContact CZ-SD 3.55Å; F845-M849 WeakPolarHBondContact O-CG 3.18Å; F845-M849 PolarHBondContact O-N 2.92Å; F845-F867 HydrophobicContact CD1-CD2 4.12Å; F845-F867 AromaticContact CD1-CE2 3.72Å; F845-F867 HydrophobicContact CD1-CE2 3.72Å; F845-F867 AromaticContact CE1-CD2 3.79Å; F845-F867 HydrophobicContact CE1-CD2 3.79Å; F845-F867 AromaticContact CE1-CE2 3.67Å; F845-F867 HydrophobicContact CE1-CE2 3.67Å; F845-T871 HydrophobicContact CD1-CG2 4.45Å; F845-T871 HydrophobicContact CE1-CG2 3.83Å; F845-F875 HydrophobicContact CB-CE1 4.4Å; F845-F875 HydrophobicContact CB-CZ 3.85Å; F845-F875 HydrophobicContact CD1-CE2 4.45Å; F845-F875 HydrophobicContact CD1-CZ 4.49Å; F845-F875 HydrophobicContact CD2-CE2 4.23Å; F845-F875 AromaticContact CD2-CZ 3.76Å; F845-F875 HydrophobicContact CD2-CZ 3.76Å; F845-F875 HydrophobicContact CG-CE2 4.14Å; F845-F875 AromaticContact CG-CZ 3.76Å; F845-F875 HydrophobicContact CG-CZ 3.76Å; F845-F904 HydrophobicContact CB-CD1 4.05Å; F845-F904 HydrophobicContact CB-CE1 4.19Å; F845-F904 HydrophobicContact CD2-CD1 4.22Å; F845-A907 HydrophobicContact CD2-CB 4.19Å; F845-A907 HydrophobicContact CE1-CB 4.49Å; F845-A907 HydrophobicContact CE2-CB 3.42Å; F845-A907 VanDerWaalsContact CE2-CB 3.42Å; F845-A907 HydrophobicContact CZ-CB 3.62Å; F845-L908 HydrophobicContact CE2-CD2 3.8Å; F845-L908 HydrophobicContact CE2-CG 3.93Å; F845-L908 HydrophobicContact CZ-CD2 4.41Å; F845-F911 HydrophobicContact CE1-CD2 4.43Å; F845-F911 HydrophobicContact CE1-CE2 4Å; F845-F911 AromaticContact CZ-CD2 3.9Å; F845-F911 HydrophobicContact CZ-CD2 3.9Å; F845-F911 AromaticContact CZ-CE2 3.9Å; F845-F911 HydrophobicContact CZ-CE2 3.9Å
846	K	97.4	Very high	96.8	Very high	71 Å²	71	31.6 Å²	31.6	31%	0.309	15%	0.153	S	C	.	.	H	α-helix	trans	-62.1	-40.4	172	179.7	157.5	165.8	151.7	0	112.2	Q842 R843 L848 M849 S850 E861 F867	Q842-K846 PolarHBondContact O-N 3.41Å; R843-K846 PolarHBondContact O-N 3.39Å; R843-K846 VanDerWaalsContact O-N 3.15Å; K846-L848 VanDerWaalsContact C-N 3.28Å; K846-L848 PolarHBondContact O-N 3.28Å; K846-M849 PolarHBondContact O-N 3.32Å; K846-S850 PolarHBondContact O-N 3.16Å; K846-S850 PolarHBondContact O-OG 3.29Å; K846-E861 WeakPolarHBondContact CE-OE1 3.47Å; K846-E861 IonicContact NZ-OE1 3.6Å; K846-E861 PolarHBondContact NZ-OE1 3.47Å; K846-E861 IonicContact NZ-OE2 3.09Å; K846-E861 PolarHBondContact NZ-OE2 2.82Å; K846-F867 HydrophobicContact CB-CZ 4.2Å; K846-F867 HydrophobicContact CG-CZ 4.25Å
847	D	97.3	Very high	97	Very high	43 Å²	43	32.3 Å²	32.3	23%	0.23	16%	0.156	C	C	.	.	H	α-helix	trans	-60.6	-34.9	170	-67.3	-3.7	0	0	0	112.9	R843 S850 E851 R963 H967	R843-D847 PolarHBondContact O-N 3.47Å; D847-S850 PolarHBondContact O-OG 3.05Å; D847-E851 WeakPolarHBondContact O-CB 3.31Å; D847-E851 PolarHBondContact O-N 2.99Å; D847-R963 PolarHBondContact O-NH1 3.4Å; D847-R963 WeakPolarHBondContact OD2-CD 3.42Å; D847-R963 IonicContact OD2-NE 2.65Å; D847-H967 VanDerWaalsContact CG-NE2 3.27Å; D847-H967 IonicContact OD1-CE1 2.66Å; D847-H967 IonicContact OD1-NE2 3.29Å; D847-H967 PolarHBondContact OD1-NE2 3.41Å; D847-H967 IonicContact OD2-CD2 3.68Å; D847-H967 IonicContact OD2-CE1 3.21Å; D847-H967 IonicContact OD2-NE2 3.25Å; D847-H967 PolarHBondContact OD2-NE2 2.85Å
848	L	97.3	Very high	97.2	Very high	8 Å²	8	35.1 Å²	35.1	4%	0.042	18%	0.179	C	C	.	.	H	α-helix	trans	-78.6	-34.1	179.9	-76.6	164.3	0	0	0	112.1	V844 F845 K846 K852 F904 L908 F955 R963	V844-L848 HydrophobicContact CG1-CD1 4.15Å; V844-L848 WeakPolarHBondContact O-CD1 3.49Å; V844-L848 VanDerWaalsContact O-CG 3.28Å; V844-L848 WeakPolarHBondContact O-CG 3.44Å; V844-L848 PolarHBondContact O-N 3.19Å; V844-L848 VanDerWaalsContact O-N 3.14Å; F845-L848 CarbonylContact O-C 3.42Å; F845-L848 PolarHBondContact O-N 2.65Å; F845-L848 VanDerWaalsContact O-N 3.07Å; K846-L848 VanDerWaalsContact C-N 3.28Å; K846-L848 PolarHBondContact O-N 3.28Å; L848-K852 VanDerWaalsContact O-CB 3.31Å; L848-K852 WeakPolarHBondContact O-CB 3.34Å; L848-K852 WeakPolarHBondContact O-CG 3.41Å; L848-K852 PolarHBondContact O-N 2.91Å; L848-F904 HydrophobicContact CD1-CB 4.14Å; L848-F904 HydrophobicContact CD1-CD1 3.57Å; L848-F904 HydrophobicContact CD1-CE1 4.22Å; L848-F904 HydrophobicContact CD1-CG 4.12Å; L848-L908 HydrophobicContact CB-CD1 4.32Å; L848-L908 HydrophobicContact CB-CD2 4.3Å; L848-F955 HydrophobicContact CD1-CE2 4.5Å; L848-F955 HydrophobicContact CD1-CZ 4.04Å; L848-F955 HydrophobicContact CD2-CE2 4.01Å; L848-F955 HydrophobicContact CD2-CZ 4.34Å; L848-R963 VanDerWaalsContact CD2-NH1 3.34Å
849	M	97.4	Very high	97.3	Very high	0 Å²	0	35.6 Å²	35.6	0%	0	18%	0.18	C	C	.	.	H	α-helix	trans	-63.1	-45	171.2	-74.5	-71.9	-70.7	0	0	110.8	F845 K846 E851 L853 L856 H857 F860 F867 L908 F911	F845-M849 HydrophobicContact CD1-CG 4.18Å; F845-M849 HydrophobicContact CE1-CG 3.67Å; F845-M849 HydrophobicContact CE1-SD 4.04Å; F845-M849 HydrophobicContact CE2-CG 4.11Å; F845-M849 HydrophobicContact CE2-SD 4.21Å; F845-M849 HydrophobicContact CZ-CG 3.63Å; F845-M849 HydrophobicContact CZ-SD 3.55Å; F845-M849 VanDerWaalsContact CZ-SD 3.55Å; F845-M849 WeakPolarHBondContact O-CG 3.18Å; F845-M849 PolarHBondContact O-N 2.92Å; K846-M849 PolarHBondContact O-N 3.32Å; M849-E851 PolarHBondContact O-N 3.02Å; M849-L853 HydrophobicContact CE-CD1 4.35Å; M849-L853 CarbonylContact O-C 3.31Å; M849-L853 WeakPolarHBondContact O-CA 3.33Å; M849-L853 PolarHBondContact O-N 3.22Å; M849-L853 HydrophobicContact SD-CD1 3.93Å; M849-L856 HydrophobicContact CE-CD2 4.13Å; M849-L856 HydrophobicContact CE-CG 4.43Å; M849-H857 HydrophobicContact CB-CB 4.47Å; M849-F860 HydrophobicContact CE-CD2 4.23Å; M849-F860 HydrophobicContact CE-CE2 3.96Å; M849-F867 HydrophobicContact CB-CZ 4.07Å; M849-F867 HydrophobicContact CG-CE2 3.9Å; M849-F867 HydrophobicContact CG-CZ 3.85Å; M849-L908 HydrophobicContact CG-CD2 4.18Å; M849-L908 HydrophobicContact SD-CD2 3.75Å; M849-F911 HydrophobicContact CE-CB 4.19Å; M849-F911 HydrophobicContact CE-CD1 4.21Å; M849-F911 HydrophobicContact CE-CD2 3.85Å; M849-F911 HydrophobicContact CE-CE2 4.28Å; M849-F911 HydrophobicContact CE-CG 3.83Å; M849-F911 HydrophobicContact SD-CB 4.3Å; M849-F911 HydrophobicContact SD-CD2 3.76Å; M849-F911 HydrophobicContact SD-CE2 4.39Å; M849-F911 HydrophobicContact SD-CG 4.15Å
850	S	97.3	Very high	97.4	Very high	50 Å²	50	32.6 Å²	32.6	35%	0.35	17%	0.166	S	C	.	.	H	α-helix	trans	-66.5	-34.7	178.5	70.6	0	0	0	0	113.2	K846 D847 H857	K846-S850 PolarHBondContact O-N 3.16Å; K846-S850 PolarHBondContact O-OG 3.29Å; D847-S850 PolarHBondContact O-OG 3.05Å; S850-H857 WeakPolarHBondContact CB-CD2 3.28Å
851	E	96.1	Very high	97.4	Very high	75 Å²	75	36.4 Å²	36.4	35%	0.35	18%	0.184	S	C	.	.	H	α-helix	trans	-75.1	-47.8	176.1	-174.1	-162.9	142.4	0	0	113.2	D847 M849 R963	D847-E851 WeakPolarHBondContact O-CB 3.31Å; D847-E851 PolarHBondContact O-N 2.99Å; M849-E851 PolarHBondContact O-N 3.02Å; E851-R963 IonicContact OE2-CZ 3.58Å; E851-R963 VanDerWaalsContact OE2-CZ 3.25Å; E851-R963 IonicContact OE2-NH1 2.93Å; E851-R963 PolarHBondContact OE2-NH1 3.05Å; E851-R963 IonicContact OE2-NH2 3.48Å; E851-R963 PolarHBondContact OE2-NH2 2.71Å
852	K	95.6	Very high	97.3	Very high	50 Å²	50	42.7 Å²	42.7	22%	0.217	21%	0.214	C	C	.	.	H	α-helix	trans	-93.7	-29.6	-169.4	-59	-53.4	-163.4	-162.9	0	113.7	L848 L908 M952	L848-K852 VanDerWaalsContact O-CB 3.31Å; L848-K852 WeakPolarHBondContact O-CB 3.34Å; L848-K852 WeakPolarHBondContact O-CG 3.41Å; L848-K852 PolarHBondContact O-N 2.91Å; K852-L908 HydrophobicContact CB-CD1 4.25Å; K852-L908 HydrophobicContact CB-CD2 4.37Å; K852-L908 HydrophobicContact CG-CD1 3.89Å; K852-M952 HydrophobicContact CB-SD 4.42Å
853	L	97.2	Very high	97.3	Very high	2 Å²	2	43.2 Å²	43.2	1%	0.01	22%	0.216	C	C	.	.			trans	-129.3	54.3	-176.9	-57.2	177.5	0	0	0	111.2	M849 R855 L856 H857 L908 F911 K912	M849-L853 HydrophobicContact CE-CD1 4.35Å; M849-L853 CarbonylContact O-C 3.31Å; M849-L853 WeakPolarHBondContact O-CA 3.33Å; M849-L853 PolarHBondContact O-N 3.22Å; M849-L853 HydrophobicContact SD-CD1 3.93Å; L853-R855 VanDerWaalsContact C-N 3.3Å; L853-R855 PolarHBondContact O-N 2.88Å; L853-L856 HydrophobicContact CB-CB 4.24Å; L853-L856 HydrophobicContact CD1-CD2 4.28Å; L853-L856 PolarHBondContact O-N 2.95Å; L853-L856 VanDerWaalsContact O-N 3.15Å; L853-H857 PolarHBondContact O-N 2.97Å; L853-L908 HydrophobicContact CD1-CD2 4.38Å; L853-F911 HydrophobicContact CD1-CB 3.64Å; L853-K912 HydrophobicContact CD1-CB 4.33Å; L853-K912 HydrophobicContact CD2-CB 3.86Å; L853-K912 HydrophobicContact CD2-CD 3.45Å; L853-K912 VanDerWaalsContact CD2-CD 3.45Å; L853-K912 HydrophobicContact CD2-CG 4.16Å
854	P	97.9	Very high	97.2	Very high	76 Å²	76	48.4 Å²	48.4	49%	0.494	24%	0.24	S	C	.	.	H	α-helix	trans	-58.9	-35.3	-170	22	-34	0	0	0	114	A858	P854-A858 VanDerWaalsContact O-CB 3.28Å; P854-A858 WeakPolarHBondContact O-CB 3.36Å; P854-A858 PolarHBondContact O-N 2.85Å
855	R	98	Very high	97	Very high	124 Å²	124	48.5 Å²	48.5	47%	0.468	24%	0.241	S	C	.	.	H	α-helix	trans	-59.1	-55.1	174.9	-72.1	167.6	67.1	-135.6	13.8	111.1	L853 A858 H859 E915 E916 L919	L853-R855 VanDerWaalsContact C-N 3.3Å; L853-R855 PolarHBondContact O-N 2.88Å; R855-A858 PolarHBondContact O-N 3Å; R855-H859 WeakPolarHBondContact O-CB 3.46Å; R855-H859 PolarHBondContact O-N 2.9Å; R855-E915 IonicContact CZ-OE1 2.79Å; R855-E915 IonicContact NE-OE1 3.99Å; R855-E915 VanDerWaalsContact NH1-CD 3.34Å; R855-E915 IonicContact NH1-OE1 3.94Å; R855-E915 PolarHBondContact NH1-OE1 3.07Å; R855-E916 IonicContact CZ-OE1 2.69Å; R855-E916 IonicContact CZ-OE2 3.18Å; R855-E916 IonicContact NH1-OE1 3.67Å; R855-E916 PolarHBondContact NH1-OE1 3.09Å; R855-E916 IonicContact NH1-OE2 2.72Å; R855-E916 IonicContact NH2-OE1 3.33Å; R855-E916 PolarHBondContact NH2-OE1 3.3Å; R855-E916 IonicContact NH2-OE2 2.76Å; R855-E916 PolarHBondContact NH2-OE2 2.79Å; R855-L919 HydrophobicContact CB-CD1 4.22Å; R855-L919 VanDerWaalsContact NH2-CD1 3.34Å
856	L	97.8	Very high	96.8	Very high	0 Å²	0	51.6 Å²	51.6	0%	0	26%	0.258	C	S	.	.	H	α-helix	trans	-65.5	-38.8	-178.9	-175	59.5	0	0	0	112.1	M849 L853 H859 F860 F911 E915 F918	M849-L856 HydrophobicContact CE-CD2 4.13Å; M849-L856 HydrophobicContact CE-CG 4.43Å; L853-L856 HydrophobicContact CB-CB 4.24Å; L853-L856 HydrophobicContact CD1-CD2 4.28Å; L853-L856 PolarHBondContact O-N 2.95Å; L853-L856 VanDerWaalsContact O-N 3.15Å; L856-H859 PolarHBondContact O-N 3.34Å; L856-F860 HydrophobicContact CD1-CD1 4.44Å; L856-F860 HydrophobicContact CD1-CD2 4.43Å; L856-F860 HydrophobicContact CD1-CE1 3.87Å; L856-F860 HydrophobicContact CD1-CE2 3.88Å; L856-F860 HydrophobicContact CD1-CZ 3.57Å; L856-F860 HydrophobicContact CD2-CE2 4.1Å; L856-F860 HydrophobicContact CD2-CZ 4.31Å; L856-F860 HydrophobicContact CG-CD2 4.16Å; L856-F860 HydrophobicContact CG-CE2 3.69Å; L856-F860 HydrophobicContact CG-CZ 3.91Å; L856-F860 WeakPolarHBondContact O-CG 3.5Å; L856-F860 PolarHBondContact O-N 2.66Å; L856-F911 HydrophobicContact CD2-CB 3.8Å; L856-F911 HydrophobicContact CD2-CD1 3.95Å; L856-F911 HydrophobicContact CD2-CG 4.22Å; L856-E915 HydrophobicContact CB-CG 4.28Å; L856-F918 HydrophobicContact CD1-CB 3.39Å; L856-F918 HydrophobicContact CD1-CD2 4.2Å; L856-F918 HydrophobicContact CD1-CG 3.91Å
857	H	98.1	Very high	96.6	Very high	27 Å²	27	48.3 Å²	48.3	13%	0.125	24%	0.243	C	C	.	.	H	α-helix	trans	-64.4	-49.5	176.3	-177.7	53.4	0	0	0	111.9	M849 S850 L853 H859 F860 E861	M849-H857 HydrophobicContact CB-CB 4.47Å; S850-H857 WeakPolarHBondContact CB-CD2 3.28Å; L853-H857 PolarHBondContact O-N 2.97Å; H857-H859 VanDerWaalsContact C-N 3.27Å; H857-H859 PolarHBondContact O-N 2.81Å; H857-F860 PolarHBondContact O-N 3.46Å; H857-F860 VanDerWaalsContact O-N 3.16Å; H857-E861 IonicContact CE1-OE1 2.69Å; H857-E861 PolarHBondContact CE1-OE1 3.46Å; H857-E861 VanDerWaalsContact CE1-OE1 3.3Å; H857-E861 IonicContact ND1-OE1 2.7Å; H857-E861 WeakPolarHBondContact O-CG 3.44Å; H857-E861 PolarHBondContact O-N 2.79Å
858	A	97.8	Very high	96.5	Very high	61 Å²	61	47.4 Å²	47.4	50%	0.504	24%	0.24	S	C	.	.	H	α-helix	trans	-59.6	-38.7	176.9	0	0	0	0	0	112	P854 R855 E861 Q862	P854-A858 VanDerWaalsContact O-CB 3.28Å; P854-A858 WeakPolarHBondContact O-CB 3.36Å; P854-A858 PolarHBondContact O-N 2.85Å; R855-A858 PolarHBondContact O-N 3Å; A858-E861 PolarHBondContact O-N 3.08Å; A858-Q862 WeakPolarHBondContact O-CB 3.34Å; A858-Q862 PolarHBondContact O-N 2.89Å
859	H	97.8	Very high	96.1	Very high	12 Å²	12	53 Å²	53	6%	0.056	27%	0.27	C	S	.	.	H	α-helix	trans	-63.2	-45.2	173.9	177.1	75.7	0	0	0	112.4	R855 L856 H857 E861 Q862 H863 F918 L919 L921 I927	R855-H859 WeakPolarHBondContact O-CB 3.46Å; R855-H859 PolarHBondContact O-N 2.9Å; L856-H859 PolarHBondContact O-N 3.34Å; H857-H859 VanDerWaalsContact C-N 3.27Å; H857-H859 PolarHBondContact O-N 2.81Å; H859-E861 PolarHBondContact O-N 3.25Å; H859-Q862 WeakPolarHBondContact O-CB 3.41Å; H859-Q862 PolarHBondContact O-N 2.92Å; H859-H863 AromaticContact CE1-CD2 3.27Å; H859-H863 PolarHBondContact CE1-CD2 3.04Å; H859-H863 AromaticContact CE1-NE2 3.39Å; H859-H863 PolarHBondContact CE1-NE2 3.49Å; H859-H863 AromaticContact ND1-CD2 3.41Å; H859-H863 PolarHBondContact ND1-CD2 2.96Å; H859-H863 AromaticContact ND1-NE2 3.59Å; H859-H863 AromaticContact NE2-CD2 3.87Å; H859-H863 PolarHBondContact O-CD2 3.01Å; H859-H863 VanDerWaalsContact O-CD2 3.28Å; H859-H863 PolarHBondContact O-N 2.74Å; H859-F918 PolarHBondContact NE2-O 2.65Å; H859-L919 HydrophobicContact CB-CD2 3.64Å; H859-L921 PolarHBondContact CE1-O 3.24Å; H859-L921 PolarHBondContact NE2-O 3.47Å; H859-I927 WeakPolarHBondContact NE2-CD1 3.38Å
860	F	97.3	Very high	95.9	Very high	0 Å²	0	54.4 Å²	54.4	0%	0	28%	0.277	C	S	.	.	H	α-helix	trans	-63	-39.7	174.6	-70.3	-26.8	0	0	0	112.8	M849 L856 H857 K864 V865 F867 F911 F918 I927	M849-F860 HydrophobicContact CE-CD2 4.23Å; M849-F860 HydrophobicContact CE-CE2 3.96Å; L856-F860 HydrophobicContact CD1-CD1 4.44Å; L856-F860 HydrophobicContact CD1-CD2 4.43Å; L856-F860 HydrophobicContact CD1-CE1 3.87Å; L856-F860 HydrophobicContact CD1-CE2 3.88Å; L856-F860 HydrophobicContact CD1-CZ 3.57Å; L856-F860 HydrophobicContact CD2-CE2 4.1Å; L856-F860 HydrophobicContact CD2-CZ 4.31Å; L856-F860 HydrophobicContact CG-CD2 4.16Å; L856-F860 HydrophobicContact CG-CE2 3.69Å; L856-F860 HydrophobicContact CG-CZ 3.91Å; L856-F860 WeakPolarHBondContact O-CG 3.5Å; L856-F860 PolarHBondContact O-N 2.66Å; H857-F860 PolarHBondContact O-N 3.46Å; H857-F860 VanDerWaalsContact O-N 3.16Å; F860-K864 PolarHBondContact O-N 3.29Å; F860-V865 HydrophobicContact CB-CB 4.29Å; F860-V865 HydrophobicContact CD1-CB 4.13Å; F860-V865 HydrophobicContact CD1-CG1 4.07Å; F860-V865 HydrophobicContact CE1-CG1 4.49Å; F860-V865 HydrophobicContact CG-CB 4.46Å; F860-V865 HydrophobicContact CG-CG1 4.49Å; F860-V865 PolarHBondContact O-N 3.37Å; F860-F867 HydrophobicContact CB-CD1 4.29Å; F860-F867 AromaticContact CD2-CD1 3.46Å; F860-F867 HydrophobicContact CD2-CD1 3.46Å; F860-F867 VanDerWaalsContact CD2-CD1 3.46Å; F860-F867 AromaticContact CD2-CE1 3.95Å; F860-F867 HydrophobicContact CD2-CE1 3.95Å; F860-F867 HydrophobicContact CD2-CG 4.34Å; F860-F867 HydrophobicContact CE2-CD1 4.07Å; F860-F867 HydrophobicContact CG-CD1 4.18Å; F860-F911 AromaticContact CE2-CD1 4Å; F860-F911 HydrophobicContact CE2-CD1 4Å; F860-F911 AromaticContact CE2-CE1 3.72Å; F860-F911 HydrophobicContact CE2-CE1 3.72Å; F860-F911 HydrophobicContact CE2-CZ 4.46Å; F860-F911 HydrophobicContact CZ-CD1 4.15Å; F860-F911 AromaticContact CZ-CE1 3.85Å; F860-F911 HydrophobicContact CZ-CE1 3.85Å; F860-F918 HydrophobicContact CE1-CB 4.44Å; F860-F918 AromaticContact CE1-CD1 3.65Å; F860-F918 HydrophobicContact CE1-CD1 3.65Å; F860-F918 HydrophobicContact CE1-CE1 4.09Å; F860-F918 HydrophobicContact CE1-CG 4.13Å; F860-F918 AromaticContact CZ-CD1 3.72Å; F860-F918 HydrophobicContact CZ-CD1 3.72Å; F860-F918 HydrophobicContact CZ-CD2 4.35Å; F860-F918 AromaticContact CZ-CE1 3.89Å; F860-F918 HydrophobicContact CZ-CE1 3.89Å; F860-F918 AromaticContact CZ-CG 3.97Å; F860-F918 HydrophobicContact CZ-CG 3.97Å; F860-F918 HydrophobicContact CZ-CZ 4.3Å; F860-I927 HydrophobicContact CD1-CG2 4.1Å; F860-I927 HydrophobicContact CE1-CG2 3.72Å
861	E	96.8	Very high	95.9	Very high	85 Å²	85	52 Å²	52	40%	0.397	26%	0.26	S	S	.	.	H	α-helix	trans	-65.9	-41.2	173.8	-58.6	-62.3	111.3	0	0	111.8	K846 H857 A858 H859 H863 K864	K846-E861 WeakPolarHBondContact CE-OE1 3.47Å; K846-E861 IonicContact NZ-OE1 3.6Å; K846-E861 PolarHBondContact NZ-OE1 3.47Å; K846-E861 IonicContact NZ-OE2 3.09Å; K846-E861 PolarHBondContact NZ-OE2 2.82Å; H857-E861 IonicContact CE1-OE1 2.69Å; H857-E861 PolarHBondContact CE1-OE1 3.46Å; H857-E861 VanDerWaalsContact CE1-OE1 3.3Å; H857-E861 IonicContact ND1-OE1 2.7Å; H857-E861 WeakPolarHBondContact O-CG 3.44Å; H857-E861 PolarHBondContact O-N 2.79Å; A858-E861 PolarHBondContact O-N 3.08Å; H859-E861 PolarHBondContact O-N 3.25Å; E861-H863 PolarHBondContact O-N 2.96Å; E861-K864 PolarHBondContact O-N 3.09Å; E861-K864 VanDerWaalsContact O-N 3.1Å
862	Q	96.8	Very high	95.9	Very high	133 Å²	133	50.7 Å²	50.7	62%	0.621	25%	0.253	S	S	*	.	H	α-helix	trans	-56.9	-46.7	176.1	172.4	-178	-31.1	0	0	111.9	A858 H859 K864	A858-Q862 WeakPolarHBondContact O-CB 3.34Å; A858-Q862 PolarHBondContact O-N 2.89Å; H859-Q862 WeakPolarHBondContact O-CB 3.41Å; H859-Q862 PolarHBondContact O-N 2.92Å; Q862-K864 VanDerWaalsContact C-N 3.29Å; Q862-K864 PolarHBondContact O-N 2.89Å
863	H	96.3	Very high	95.8	Very high	22 Å²	22	51.5 Å²	51.5	10%	0.102	26%	0.26	C	S	.	.	T	Hydrogen-bonded Turn	trans	-87.4	6.8	178.7	-66.7	-83.7	0	0	0	113.5	H859 E861 V865 Q922 T924 I927	H859-H863 AromaticContact CE1-CD2 3.27Å; H859-H863 PolarHBondContact CE1-CD2 3.04Å; H859-H863 AromaticContact CE1-NE2 3.39Å; H859-H863 PolarHBondContact CE1-NE2 3.49Å; H859-H863 AromaticContact ND1-CD2 3.41Å; H859-H863 PolarHBondContact ND1-CD2 2.96Å; H859-H863 AromaticContact ND1-NE2 3.59Å; H859-H863 AromaticContact NE2-CD2 3.87Å; H859-H863 PolarHBondContact O-CD2 3.01Å; H859-H863 VanDerWaalsContact O-CD2 3.28Å; H859-H863 PolarHBondContact O-N 2.74Å; E861-H863 PolarHBondContact O-N 2.96Å; H863-V865 VanDerWaalsContact C-N 3.26Å; H863-V865 HydrophobicContact CB-CG2 4Å; H863-V865 PolarHBondContact O-N 3.11Å; H863-Q922 PolarHBondContact CE1-O 2.68Å; H863-Q922 PolarHBondContact ND1-O 2.79Å; H863-T924 VanDerWaalsContact O-CG2 3.26Å; H863-T924 WeakPolarHBondContact O-CG2 3.49Å; H863-T924 PolarHBondContact O-OG1 3.04Å; H863-I927 HydrophobicContact CB-CD1 3.75Å
864	K	94.9	Very high	95.8	Very high	178 Å²	178	51.8 Å²	51.8	77%	0.774	26%	0.261	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.4	37.8	-179.2	-56.3	-176.6	-178.1	-179.2	0	113.8	F860 E861 Q862	F860-K864 PolarHBondContact O-N 3.29Å; E861-K864 PolarHBondContact O-N 3.09Å; E861-K864 VanDerWaalsContact O-N 3.1Å; Q862-K864 VanDerWaalsContact C-N 3.29Å; Q862-K864 PolarHBondContact O-N 2.89Å
865	V	94.6	Very high	95.8	Very high	2 Å²	2	48.2 Å²	48.2	1%	0.012	24%	0.237	C	C	.	.			trans	-90.8	102.3	-179.6	176.4	0	0	0	0	109.9	F860 H863 F867 T924 I927 F928 L931	F860-V865 HydrophobicContact CB-CB 4.29Å; F860-V865 HydrophobicContact CD1-CB 4.13Å; F860-V865 HydrophobicContact CD1-CG1 4.07Å; F860-V865 HydrophobicContact CE1-CG1 4.49Å; F860-V865 HydrophobicContact CG-CB 4.46Å; F860-V865 HydrophobicContact CG-CG1 4.49Å; F860-V865 PolarHBondContact O-N 3.37Å; H863-V865 VanDerWaalsContact C-N 3.26Å; H863-V865 HydrophobicContact CB-CG2 4Å; H863-V865 PolarHBondContact O-N 3.11Å; V865-F867 PolarHBondContact O-N 3.2Å; V865-T924 HydrophobicContact CG2-CG2 4.05Å; V865-I927 HydrophobicContact CB-CG2 4.35Å; V865-I927 HydrophobicContact CG1-CG2 3.85Å; V865-I927 HydrophobicContact CG2-CB 4.1Å; V865-I927 HydrophobicContact CG2-CD1 4.22Å; V865-I927 HydrophobicContact CG2-CG2 3.81Å; V865-F928 HydrophobicContact CB-CE2 4.24Å; V865-F928 HydrophobicContact CB-CZ 4.21Å; V865-F928 HydrophobicContact CG1-CD1 4.21Å; V865-F928 HydrophobicContact CG1-CD2 4.49Å; V865-F928 HydrophobicContact CG1-CE1 3.87Å; V865-F928 HydrophobicContact CG1-CE2 4.18Å; V865-F928 HydrophobicContact CG1-CZ 3.87Å; V865-F928 HydrophobicContact CG2-CD2 4.24Å; V865-F928 HydrophobicContact CG2-CE2 4.03Å; V865-F928 HydrophobicContact CG2-CZ 4.49Å; V865-L931 HydrophobicContact CG1-CD2 4.02Å
866	D	92.9	Very high	95.7	Very high	65 Å²	65	43.1 Å²	43.1	35%	0.348	22%	0.22	S	C	.	.			trans	-78.8	103.6	167.6	-178.2	25.7	0	0	0	111.3	S868 L869	D866-S868 PolarHBondContact O-N 3Å; D866-S868 WeakPolarHBondContact OD1-CB 3.39Å; D866-S868 PolarHBondContact OD1-N 3.01Å; D866-S868 PolarHBondContact OD1-OG 3.25Å; D866-S868 WeakPolarHBondContact OD2-CB 3.31Å; D866-L869 HydrophobicContact CB-CG 4.42Å
867	F	94.5	Very high	95.7	Very high	1 Å²	1	43.2 Å²	43.2	0%	0.004	22%	0.22	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.6	-15.6	174.6	51.7	-93.7	0	0	0	113.8	F845 K846 M849 F860 V865 L869 I870 T871 F911 L931	F845-F867 HydrophobicContact CD1-CD2 4.12Å; F845-F867 AromaticContact CD1-CE2 3.72Å; F845-F867 HydrophobicContact CD1-CE2 3.72Å; F845-F867 AromaticContact CE1-CD2 3.79Å; F845-F867 HydrophobicContact CE1-CD2 3.79Å; F845-F867 AromaticContact CE1-CE2 3.67Å; F845-F867 HydrophobicContact CE1-CE2 3.67Å; K846-F867 HydrophobicContact CB-CZ 4.2Å; K846-F867 HydrophobicContact CG-CZ 4.25Å; M849-F867 HydrophobicContact CB-CZ 4.07Å; M849-F867 HydrophobicContact CG-CE2 3.9Å; M849-F867 HydrophobicContact CG-CZ 3.85Å; F860-F867 HydrophobicContact CB-CD1 4.29Å; F860-F867 AromaticContact CD2-CD1 3.46Å; F860-F867 HydrophobicContact CD2-CD1 3.46Å; F860-F867 VanDerWaalsContact CD2-CD1 3.46Å; F860-F867 AromaticContact CD2-CE1 3.95Å; F860-F867 HydrophobicContact CD2-CE1 3.95Å; F860-F867 HydrophobicContact CD2-CG 4.34Å; F860-F867 HydrophobicContact CE2-CD1 4.07Å; F860-F867 HydrophobicContact CG-CD1 4.18Å; V865-F867 PolarHBondContact O-N 3.2Å; F867-L869 PolarHBondContact O-N 3.23Å; F867-L869 VanDerWaalsContact O-N 3.15Å; F867-I870 PolarHBondContact O-N 2.93Å; F867-T871 HydrophobicContact CD2-CG2 4.41Å; F867-T871 PolarHBondContact O-N 3.32Å; F867-T871 PolarHBondContact O-OG1 2.99Å; F867-F911 HydrophobicContact CB-CZ 4.02Å; F867-F911 HydrophobicContact CG-CZ 4.48Å; F867-L931 HydrophobicContact CB-CD2 4.22Å
868	S	93.9	Very high	95.7	Very high	24 Å²	24	41.9 Å²	41.9	17%	0.168	21%	0.214	C	C	.	.	H	α-helix	trans	-57.2	-31	177.3	-44.2	0	0	0	0	112	D866 I870 T871 F872	D866-S868 PolarHBondContact O-N 3Å; D866-S868 WeakPolarHBondContact OD1-CB 3.39Å; D866-S868 PolarHBondContact OD1-N 3.01Å; D866-S868 PolarHBondContact OD1-OG 3.25Å; D866-S868 WeakPolarHBondContact OD2-CB 3.31Å; S868-I870 PolarHBondContact O-N 2.96Å; S868-T871 WeakPolarHBondContact CA-OG1 3.45Å; S868-F872 WeakPolarHBondContact O-CB 3.37Å; S868-F872 PolarHBondContact O-N 3.25Å
869	L	90.3	Very high	95.7	Very high	126 Å²	126	39 Å²	39	66%	0.66	19%	0.19	S	C	*	.	H	α-helix	trans	-56	-21	175.7	-62.6	177.8	0	0	0	114.2	D866 F867 F928	D866-L869 HydrophobicContact CB-CG 4.42Å; F867-L869 PolarHBondContact O-N 3.23Å; F867-L869 VanDerWaalsContact O-N 3.15Å; L869-F928 HydrophobicContact CD1-CE1 4.02Å; L869-F928 HydrophobicContact CD1-CZ 4.24Å
870	I	92.5	Very high	95.5	Very high	30 Å²	30	38.4 Å²	38.4	15%	0.154	19%	0.187	C	C	.	.	H	α-helix	trans	-116.6	-41	179.3	-73.9	161.6	0	0	0	110.9	F867 S868 F872 N873 W874 L931 R932	F867-I870 PolarHBondContact O-N 2.93Å; S868-I870 PolarHBondContact O-N 2.96Å; I870-F872 VanDerWaalsContact C-N 3.26Å; I870-F872 PolarHBondContact O-N 3.39Å; I870-N873 PolarHBondContact O-N 3.44Å; I870-W874 HydrophobicContact CG2-CZ2 3.73Å; I870-L931 HydrophobicContact CD1-CB 4.15Å; I870-L931 HydrophobicContact CD1-CD2 3.86Å; I870-L931 HydrophobicContact CD1-CG 3.67Å; I870-R932 HydrophobicContact CD1-CB 4.48Å; I870-R932 HydrophobicContact CD1-CG 3.67Å
871	T	96.6	Very high	95.1	Very high	0 Å²	0	41.2 Å²	41.2	0%	0	20%	0.202	C	C	.	.	H	α-helix	trans	-68	-22.9	178.9	57.1	0	0	0	0	113.6	Q842 F845 F867 S868 N873 W874 F875 F911	Q842-T871 PolarHBondContact OE1-OG1 3.43Å; F845-T871 HydrophobicContact CD1-CG2 4.45Å; F845-T871 HydrophobicContact CE1-CG2 3.83Å; F867-T871 HydrophobicContact CD2-CG2 4.41Å; F867-T871 PolarHBondContact O-N 3.32Å; F867-T871 PolarHBondContact O-OG1 2.99Å; S868-T871 WeakPolarHBondContact CA-OG1 3.45Å; T871-N873 VanDerWaalsContact C-N 3.3Å; T871-N873 PolarHBondContact O-N 3.23Å; T871-W874 HydrophobicContact CG2-CD2 4.24Å; T871-W874 HydrophobicContact CG2-CE3 3.71Å; T871-W874 HydrophobicContact CG2-CH2 4.24Å; T871-W874 HydrophobicContact CG2-CZ3 3.73Å; T871-W874 PolarHBondContact O-N 2.98Å; T871-F875 WeakPolarHBondContact O-CD2 3.3Å; T871-F875 PolarHBondContact O-N 3.45Å; T871-F911 HydrophobicContact CG2-CE2 3.74Å; T871-F911 HydrophobicContact CG2-CZ 4.08Å
872	F	95.8	Very high	94.9	Very high	46 Å²	46	37.7 Å²	37.7	20%	0.202	19%	0.187	C	C	.	.	H	α-helix	trans	-56.5	-43.2	173.8	-173	-89.7	0	0	0	112.1	L835 Q842 S868 I870 F875 L876	L835-F872 HydrophobicContact CB-CZ 4.32Å; L835-F872 HydrophobicContact CD1-CE1 4.38Å; L835-F872 HydrophobicContact CD1-CZ 3.91Å; Q842-F872 HydrophobicContact CG-CB 4.39Å; Q842-F872 HydrophobicContact CG-CD2 3.86Å; S868-F872 WeakPolarHBondContact O-CB 3.37Å; S868-F872 PolarHBondContact O-N 3.25Å; I870-F872 VanDerWaalsContact C-N 3.26Å; I870-F872 PolarHBondContact O-N 3.39Å; F872-F875 PolarHBondContact O-N 2.98Å; F872-L876 HydrophobicContact CE1-CD2 4.21Å; F872-L876 VanDerWaalsContact O-CB 3.31Å; F872-L876 WeakPolarHBondContact O-CB 3.18Å; F872-L876 PolarHBondContact O-N 3.02Å
873	N	94.6	Very high	94.7	Very high	67 Å²	67	32 Å²	32	36%	0.358	16%	0.161	S	C	.	.	H	α-helix	trans	-66.7	-44.3	176.7	-177.7	71.5	0	0	0	111.6	I870 T871 F875 L876 V877 S882	I870-N873 PolarHBondContact O-N 3.44Å; T871-N873 VanDerWaalsContact C-N 3.3Å; T871-N873 PolarHBondContact O-N 3.23Å; N873-F875 PolarHBondContact O-N 3.37Å; N873-L876 PolarHBondContact O-N 2.66Å; N873-V877 VanDerWaalsContact O-CG2 3.32Å; N873-V877 WeakPolarHBondContact O-CG2 3.4Å; N873-V877 PolarHBondContact O-N 2.86Å; N873-S882 PolarHBondContact ND2-OG 3.15Å
874	W	97.3	Very high	94.5	Very high	8 Å²	8	32.2 Å²	32.2	3%	0.03	16%	0.164	C	C	.	.	H	α-helix	trans	-56.6	-37.9	179	-57.8	-3.3	0	0	0	112.1	I870 T871 V878 F879 S882 A907 L910 F911 F934 T935	I870-W874 HydrophobicContact CG2-CZ2 3.73Å; T871-W874 HydrophobicContact CG2-CD2 4.24Å; T871-W874 HydrophobicContact CG2-CE3 3.71Å; T871-W874 HydrophobicContact CG2-CH2 4.24Å; T871-W874 HydrophobicContact CG2-CZ3 3.73Å; T871-W874 PolarHBondContact O-N 2.98Å; W874-V878 CarbonylContact O-C 3.57Å; W874-V878 VanDerWaalsContact O-CA 3.24Å; W874-V878 WeakPolarHBondContact O-CA 3.1Å; W874-V878 PolarHBondContact O-N 3.07Å; W874-F879 HydrophobicContact CB-CD1 3.79Å; W874-F879 HydrophobicContact CB-CE1 3.77Å; W874-F879 HydrophobicContact CB-CG 4.38Å; W874-F879 HydrophobicContact CB-CZ 4.35Å; W874-F879 HydrophobicContact CD2-CD1 4.1Å; W874-F879 AromaticContact CD2-CE1 3.89Å; W874-F879 HydrophobicContact CD2-CE1 3.89Å; W874-F879 HydrophobicContact CE3-CD1 4.2Å; W874-F879 AromaticContact CE3-CE1 3.53Å; W874-F879 HydrophobicContact CE3-CE1 3.53Å; W874-F879 HydrophobicContact CE3-CZ 4.44Å; W874-F879 AromaticContact CG-CD1 3.95Å; W874-F879 HydrophobicContact CG-CD1 3.95Å; W874-F879 HydrophobicContact CG-CE1 4.03Å; W874-F879 HydrophobicContact CZ3-CE1 4.36Å; W874-F879 PolarHBondContact O-N 2.77Å; W874-S882 VanDerWaalsContact CD1-CB 3.43Å; W874-S882 VanDerWaalsContact CD1-OG 3.3Å; W874-A907 HydrophobicContact CE3-CB 4.19Å; W874-A907 HydrophobicContact CZ3-CB 4.37Å; W874-L910 HydrophobicContact CE3-CD1 4.37Å; W874-L910 HydrophobicContact CH2-CD1 4.45Å; W874-L910 HydrophobicContact CZ3-CD1 4.07Å; W874-F911 HydrophobicContact CH2-CE2 4.13Å; W874-F911 HydrophobicContact CH2-CZ 4.22Å; W874-F911 HydrophobicContact CZ3-CD2 4.47Å; W874-F911 AromaticContact CZ3-CE2 3.91Å; W874-F911 HydrophobicContact CZ3-CE2 3.91Å; W874-F911 HydrophobicContact CZ3-CZ 4.44Å; W874-F934 AromaticContact CH2-CE1 3.85Å; W874-F934 HydrophobicContact CH2-CE1 3.85Å; W874-F934 AromaticContact CH2-CZ 3.68Å; W874-F934 HydrophobicContact CH2-CZ 3.68Å; W874-F934 HydrophobicContact CZ2-CE1 4.04Å; W874-F934 HydrophobicContact CZ2-CZ 4.31Å; W874-T935 HydrophobicContact CH2-CG2 3.72Å; W874-T935 HydrophobicContact CZ2-CG2 3.45Å; W874-T935 VanDerWaalsContact CZ2-CG2 3.45Å
875	F	97.7	Very high	94.3	Very high	1 Å²	1	24.8 Å²	24.8	0%	0.004	13%	0.134	C	C	.	.	H	α-helix	trans	-74.5	-48.2	177.9	-85.6	-116.9	0	0	0	111.8	Y830 D841 Q842 F845 T871 F872 N873 V877 I903 F904 A907	Y830-F875 VanDerWaalsContact OH-C 3.31Å; Y830-F875 PolarHBondContact OH-O 3.19Å; D841-F875 HydrophobicContact CB-CD1 4.1Å; D841-F875 HydrophobicContact CB-CE1 4.31Å; Q842-F875 VanDerWaalsContact NE2-CG 3.32Å; F845-F875 HydrophobicContact CB-CE1 4.4Å; F845-F875 HydrophobicContact CB-CZ 3.85Å; F845-F875 HydrophobicContact CD1-CE2 4.45Å; F845-F875 HydrophobicContact CD1-CZ 4.49Å; F845-F875 HydrophobicContact CD2-CE2 4.23Å; F845-F875 AromaticContact CD2-CZ 3.76Å; F845-F875 HydrophobicContact CD2-CZ 3.76Å; F845-F875 HydrophobicContact CG-CE2 4.14Å; F845-F875 AromaticContact CG-CZ 3.76Å; F845-F875 HydrophobicContact CG-CZ 3.76Å; T871-F875 WeakPolarHBondContact O-CD2 3.3Å; T871-F875 PolarHBondContact O-N 3.45Å; F872-F875 PolarHBondContact O-N 2.98Å; N873-F875 PolarHBondContact O-N 3.37Å; F875-V877 VanDerWaalsContact C-N 3.31Å; F875-V877 PolarHBondContact O-N 2.86Å; F875-I903 HydrophobicContact CB-CG2 4.15Å; F875-I903 HydrophobicContact CD1-CG2 3.62Å; F875-I903 HydrophobicContact CD2-CG2 3.67Å; F875-I903 HydrophobicContact CE1-CG2 3.88Å; F875-I903 HydrophobicContact CE2-CG2 3.95Å; F875-I903 HydrophobicContact CG-CG2 3.52Å; F875-I903 HydrophobicContact CZ-CG2 4.05Å; F875-F904 AromaticContact CE1-CD1 3.6Å; F875-F904 HydrophobicContact CE1-CD1 3.6Å; F875-F904 HydrophobicContact CE1-CD2 4.07Å; F875-F904 AromaticContact CE1-CE1 3.63Å; F875-F904 HydrophobicContact CE1-CE1 3.63Å; F875-F904 HydrophobicContact CE1-CE2 4.09Å; F875-F904 AromaticContact CE1-CG 3.84Å; F875-F904 HydrophobicContact CE1-CG 3.84Å; F875-F904 AromaticContact CE1-CZ 3.9Å; F875-F904 HydrophobicContact CE1-CZ 3.9Å; F875-F904 HydrophobicContact CZ-CB 4.43Å; F875-F904 AromaticContact CZ-CD1 3.73Å; F875-F904 HydrophobicContact CZ-CD1 3.73Å; F875-F904 HydrophobicContact CZ-CE1 4.17Å; F875-F904 AromaticContact CZ-CG 3.99Å; F875-F904 HydrophobicContact CZ-CG 3.99Å; F875-A907 HydrophobicContact CE2-CB 3.71Å; F875-A907 HydrophobicContact CZ-CB 4.29Å
876	L	96.3	Very high	94.1	Very high	18 Å²	18	26 Å²	26	9%	0.094	14%	0.141	C	C	.	.	H	α-helix	trans	-59	-39.1	-178.7	-170.5	73	0	0	0	112.8	Y830 Y831 L835 F872 N873	Y830-L876 HydrophobicContact CE1-CD1 4.5Å; Y831-L876 HydrophobicContact CD1-CD1 3.84Å; Y831-L876 HydrophobicContact CE1-CD1 3.6Å; Y831-L876 HydrophobicContact CE1-CG 4.16Å; Y831-L876 WeakPolarHBondContact CE1-O 3.39Å; Y831-L876 PolarHBondContact OH-O 3.36Å; L835-L876 HydrophobicContact CD2-CD1 4.39Å; F872-L876 HydrophobicContact CE1-CD2 4.21Å; F872-L876 VanDerWaalsContact O-CB 3.31Å; F872-L876 WeakPolarHBondContact O-CB 3.18Å; F872-L876 PolarHBondContact O-N 3.02Å; N873-L876 PolarHBondContact O-N 2.66Å
877	V	96.9	Very high	94.2	Very high	1 Å²	1	23 Å²	23	1%	0.006	13%	0.125	C	C	.	.	T	Hydrogen-bonded Turn	trans	-121.4	20.1	-174.6	-54	0	0	0	0	114.9	G797 R800 N873 F875 F879 V880	G797-V877 VanDerWaalsContact CA-CG1 3.44Å; R800-V877 HydrophobicContact CB-CB 4.1Å; R800-V877 HydrophobicContact CB-CG1 4.14Å; N873-V877 VanDerWaalsContact O-CG2 3.32Å; N873-V877 WeakPolarHBondContact O-CG2 3.4Å; N873-V877 PolarHBondContact O-N 2.86Å; F875-V877 VanDerWaalsContact C-N 3.31Å; F875-V877 PolarHBondContact O-N 2.86Å; V877-F879 PolarHBondContact O-N 3.47Å; V877-V880 HydrophobicContact CB-CB 4.41Å; V877-V880 HydrophobicContact CG2-CB 4.06Å; V877-V880 WeakPolarHBondContact O-CB 3.48Å; V877-V880 WeakPolarHBondContact O-CG2 3.28Å; V877-V880 PolarHBondContact O-N 3.16Å
878	V	97.7	Very high	94.3	Very high	0 Å²	0	23.2 Å²	23.2	0%	0	13%	0.126	C	C	.	.	T	Hydrogen-bonded Turn	trans	49.7	59.8	175.4	-166	0	0	0	0	112.1	L801 W874 V880 L888 I891 W892 F895 I903	L801-V878 HydrophobicContact CD2-CB 4.23Å; L801-V878 HydrophobicContact CD2-CG2 3.87Å; W874-V878 CarbonylContact O-C 3.57Å; W874-V878 VanDerWaalsContact O-CA 3.24Å; W874-V878 WeakPolarHBondContact O-CA 3.1Å; W874-V878 PolarHBondContact O-N 3.07Å; V878-V880 PolarHBondContact O-N 2.85Å; V878-L888 WeakPolarHBondContact O-CD1 3.3Å; V878-I891 HydrophobicContact CG1-CG2 4.42Å; V878-W892 HydrophobicContact CB-CZ2 4.23Å; V878-W892 PolarHBondContact O-NE1 3.09Å; V878-F895 HydrophobicContact CG1-CB 4.45Å; V878-F895 HydrophobicContact CG1-CD1 3.86Å; V878-F895 HydrophobicContact CG1-CD2 4.39Å; V878-F895 HydrophobicContact CG1-CE1 4.1Å; V878-F895 HydrophobicContact CG1-CG 3.99Å; V878-F895 HydrophobicContact CG1-CZ 4.47Å; V878-F895 HydrophobicContact CG2-CD1 4.38Å; V878-F895 HydrophobicContact CG2-CE1 3.78Å; V878-F895 HydrophobicContact CG2-CE2 4.25Å; V878-F895 HydrophobicContact CG2-CZ 3.7Å; V878-I903 HydrophobicContact CG2-CD1 4.07Å
879	F	97.3	Very high	94.3	Very high	0 Å²	0	22.1 Å²	22.1	0%	0	12%	0.118	C	C	.	.	T	Hydrogen-bonded Turn	trans	58.7	9.3	178.3	-57.3	-91	0	0	0	117.6	W874 V877 D881 S882 V883 L888 I891 I903 F906 A907 L910	W874-F879 HydrophobicContact CB-CD1 3.79Å; W874-F879 HydrophobicContact CB-CE1 3.77Å; W874-F879 HydrophobicContact CB-CG 4.38Å; W874-F879 HydrophobicContact CB-CZ 4.35Å; W874-F879 HydrophobicContact CD2-CD1 4.1Å; W874-F879 AromaticContact CD2-CE1 3.89Å; W874-F879 HydrophobicContact CD2-CE1 3.89Å; W874-F879 HydrophobicContact CE3-CD1 4.2Å; W874-F879 AromaticContact CE3-CE1 3.53Å; W874-F879 HydrophobicContact CE3-CE1 3.53Å; W874-F879 HydrophobicContact CE3-CZ 4.44Å; W874-F879 AromaticContact CG-CD1 3.95Å; W874-F879 HydrophobicContact CG-CD1 3.95Å; W874-F879 HydrophobicContact CG-CE1 4.03Å; W874-F879 HydrophobicContact CZ3-CE1 4.36Å; W874-F879 PolarHBondContact O-N 2.77Å; V877-F879 PolarHBondContact O-N 3.47Å; F879-D881 PolarHBondContact O-N 3.15Å; F879-S882 WeakPolarHBondContact O-CA 3.08Å; F879-S882 WeakPolarHBondContact O-CB 3.49Å; F879-S882 PolarHBondContact O-N 2.91Å; F879-V883 HydrophobicContact CB-CG1 4.4Å; F879-V883 HydrophobicContact CB-CG2 4.02Å; F879-V883 HydrophobicContact CD1-CG1 4.22Å; F879-L888 HydrophobicContact CB-CD1 4.17Å; F879-I891 HydrophobicContact CB-CD1 4.35Å; F879-I891 HydrophobicContact CD2-CD1 4.01Å; F879-I891 HydrophobicContact CD2-CG2 3.86Å; F879-I891 HydrophobicContact CE2-CD1 4.46Å; F879-I891 HydrophobicContact CE2-CG2 4.28Å; F879-I891 HydrophobicContact CG-CD1 4.04Å; F879-I903 HydrophobicContact CE2-CG2 4.05Å; F879-I903 HydrophobicContact CZ-CG2 4.42Å; F879-I903 WeakPolarHBondContact CZ-O 3.24Å; F879-F906 HydrophobicContact CE2-CB 4.09Å; F879-F906 HydrophobicContact CZ-CB 3.95Å; F879-A907 HydrophobicContact CE1-CB 4.44Å; F879-A907 HydrophobicContact CZ-CB 4.07Å; F879-L910 HydrophobicContact CD1-CD1 3.86Å; F879-L910 HydrophobicContact CE1-CD1 3.49Å; F879-L910 VanDerWaalsContact CE1-CD1 3.49Å; F879-L910 HydrophobicContact CZ-CD1 4.44Å
880	V	95.2	Very high	94.6	Very high	0 Å²	0	16.7 Å²	16.7	0%	0	9%	0.09	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.2	140.2	176	178.7	0	0	0	0	111.2	L761 R800 I804 V877 V878 S882 L888 W892	L761-V880 HydrophobicContact CD2-CG1 3.52Å; R800-V880 HydrophobicContact CB-CB 4.33Å; R800-V880 HydrophobicContact CB-CG1 3.98Å; R800-V880 HydrophobicContact CG-CG1 4.49Å; I804-V880 HydrophobicContact CD1-CG2 4.34Å; I804-V880 HydrophobicContact CG1-CG1 4.24Å; I804-V880 HydrophobicContact CG1-CG2 3.57Å; V877-V880 HydrophobicContact CB-CB 4.41Å; V877-V880 HydrophobicContact CG2-CB 4.06Å; V877-V880 WeakPolarHBondContact O-CB 3.48Å; V877-V880 WeakPolarHBondContact O-CG2 3.28Å; V877-V880 PolarHBondContact O-N 3.16Å; V878-V880 PolarHBondContact O-N 2.85Å; V880-S882 PolarHBondContact O-N 3.43Å; V880-S882 PolarHBondContact O-OG 3.37Å; V880-L888 HydrophobicContact CG2-CD1 4.03Å; V880-L888 HydrophobicContact CG2-CD2 4.32Å; V880-W892 HydrophobicContact CG2-CZ2 4.3Å
881	D	89.3	Confident	94.9	Very high	58 Å²	58	15.3 Å²	15.3	31%	0.31	8%	0.082	S	C	.	.	T	Hydrogen-bonded Turn	trans	54	2.8	-166.7	-66.1	20.2	0	0	0	115.8	L761 R800 F879	L761-D881 WeakPolarHBondContact CD2-OD1 2.97Å; R800-D881 IonicContact CZ-OD1 3.03Å; R800-D881 IonicContact CZ-OD2 3.31Å; R800-D881 IonicContact NH1-OD1 2.74Å; R800-D881 PolarHBondContact NH1-OD1 2.78Å; R800-D881 IonicContact NH1-OD2 3.46Å; R800-D881 PolarHBondContact NH1-OD2 2.94Å; R800-D881 IonicContact NH2-OD2 2.65Å; R800-D881 PolarHBondContact NH2-OD2 3.45Å; F879-D881 PolarHBondContact O-N 3.15Å
882	S	91.4	Very high	94.9	Very high	11 Å²	11	15.3 Å²	15.3	8%	0.077	8%	0.082	C	C	.	.	T	Hydrogen-bonded Turn	trans	-103	-21.4	-169	-49.5	0	0	0	0	113.6	N873 W874 F879 V880 T935	N873-S882 PolarHBondContact ND2-OG 3.15Å; W874-S882 VanDerWaalsContact CD1-CB 3.43Å; W874-S882 VanDerWaalsContact CD1-OG 3.3Å; F879-S882 WeakPolarHBondContact O-CA 3.08Å; F879-S882 WeakPolarHBondContact O-CB 3.49Å; F879-S882 PolarHBondContact O-N 2.91Å; V880-S882 PolarHBondContact O-N 3.43Å; V880-S882 PolarHBondContact O-OG 3.37Å; S882-T935 WeakPolarHBondContact O-CB 3.25Å; S882-T935 PolarHBondContact O-OG1 3.3Å
883	V	93.4	Very high	95	Very high	14 Å²	14	13.2 Å²	13.2	9%	0.085	7%	0.073	C	C	.	.	S	Bend	trans	-135.3	165.2	177.9	-62.4	0	0	0	0	110	F879 I887 L888 I891 L910	F879-V883 HydrophobicContact CB-CG1 4.4Å; F879-V883 HydrophobicContact CB-CG2 4.02Å; F879-V883 HydrophobicContact CD1-CG1 4.22Å; V883-I887 HydrophobicContact CB-CB 4.38Å; V883-I887 HydrophobicContact CB-CG2 4.06Å; V883-I887 HydrophobicContact CG1-CG2 4.38Å; V883-I887 HydrophobicContact CG2-CB 4.28Å; V883-I887 HydrophobicContact CG2-CG2 3.97Å; V883-L888 HydrophobicContact CG2-CB 3.85Å; V883-L888 HydrophobicContact CG2-CD1 4.31Å; V883-I891 HydrophobicContact CG2-CD1 4.45Å; V883-L910 HydrophobicContact CG1-CD1 4.05Å; V883-L910 HydrophobicContact CG1-CD2 4.18Å
884	V	91.4	Very high	95.2	Very high	26 Å²	26	10 Å²	10	16%	0.158	6%	0.056	C	C	.	.			trans	-65.1	150.1	174	-63.2	0	0	0	0	111.9	L664 D886 I887 L888 L939	L664-V884 HydrophobicContact CD2-CG2 4.43Å; V884-D886 VanDerWaalsContact C-N 3.34Å; V884-D886 PolarHBondContact O-N 3.48Å; V884-I887 HydrophobicContact CG2-CB 4.18Å; V884-I887 HydrophobicContact CG2-CD1 3.81Å; V884-I887 HydrophobicContact CG2-CG1 3.95Å; V884-I887 PolarHBondContact O-N 3.14Å; V884-L888 PolarHBondContact O-N 3.39Å; V884-L939 HydrophobicContact CG1-CD2 3.85Å; V884-L939 HydrophobicContact CG2-CD2 4.32Å
885	S	91.2	Very high	95.2	Very high	22 Å²	22	9.6 Å²	9.6	15%	0.154	6%	0.055	C	C	.	.	H	α-helix	trans	-53.3	-43.8	-169.4	-41.7	0	0	0	0	114.3	D638 Y640 I887 L888 F889	D638-S885 WeakPolarHBondContact OD2-CB 3.48Å; D638-S885 PolarHBondContact OD2-OG 3.1Å; Y640-S885 VanDerWaalsContact CD2-CB 3.48Å; S885-I887 VanDerWaalsContact C-N 3.34Å; S885-I887 PolarHBondContact O-N 3.45Å; S885-L888 WeakPolarHBondContact O-CB 3.43Å; S885-L888 PolarHBondContact O-N 3.42Å; S885-L888 VanDerWaalsContact O-N 3.14Å; S885-F889 WeakPolarHBondContact O-CD2 3.48Å; S885-F889 PolarHBondContact O-N 2.99Å
886	D	89.4	Confident	95.2	Very high	28 Å²	28	9.7 Å²	9.7	15%	0.15	6%	0.055	C	C	.	.	H	α-helix	trans	-58.1	-45.5	178.8	179	59	0	0	0	112.2	V884 K890 S941	V884-D886 VanDerWaalsContact C-N 3.34Å; V884-D886 PolarHBondContact O-N 3.48Å; D886-K890 WeakPolarHBondContact O-CB 3.39Å; D886-K890 WeakPolarHBondContact O-CG 3.04Å; D886-K890 PolarHBondContact O-N 3.5Å; D886-K890 VanDerWaalsContact OD1-CE 3.31Å; D886-K890 WeakPolarHBondContact OD1-CE 3.49Å; D886-K890 IonicContact OD1-NZ 2.82Å; D886-K890 PolarHBondContact OD1-NZ 3.44Å; D886-K890 IonicContact OD2-NZ 2.74Å; D886-K890 PolarHBondContact OD2-NZ 3.44Å; D886-S941 WeakPolarHBondContact OD2-CB 3.47Å; D886-S941 PolarHBondContact OD2-OG 3.4Å
887	I	94.7	Very high	95.2	Very high	3 Å²	3	9.4 Å²	9.4	2%	0.015	5%	0.053	C	C	.	.	H	α-helix	trans	-67.4	-40.7	175.5	-66.8	176.5	0	0	0	110.4	V883 V884 S885 F889 K890 I891 I938 L944	V883-I887 HydrophobicContact CB-CB 4.38Å; V883-I887 HydrophobicContact CB-CG2 4.06Å; V883-I887 HydrophobicContact CG1-CG2 4.38Å; V883-I887 HydrophobicContact CG2-CB 4.28Å; V883-I887 HydrophobicContact CG2-CG2 3.97Å; V884-I887 HydrophobicContact CG2-CB 4.18Å; V884-I887 HydrophobicContact CG2-CD1 3.81Å; V884-I887 HydrophobicContact CG2-CG1 3.95Å; V884-I887 PolarHBondContact O-N 3.14Å; S885-I887 VanDerWaalsContact C-N 3.34Å; S885-I887 PolarHBondContact O-N 3.45Å; I887-F889 PolarHBondContact O-N 2.96Å; I887-K890 PolarHBondContact O-N 2.99Å; I887-I891 HydrophobicContact CG2-CD1 3.73Å; I887-I891 HydrophobicContact CG2-CG1 4.2Å; I887-I891 WeakPolarHBondContact O-CB 3.46Å; I887-I891 VanDerWaalsContact O-CG1 3.26Å; I887-I891 WeakPolarHBondContact O-CG1 3.19Å; I887-I891 PolarHBondContact O-N 2.84Å; I887-I938 HydrophobicContact CD1-CB 4.5Å; I887-I938 HydrophobicContact CD1-CG2 3.94Å; I887-I938 WeakPolarHBondContact CD1-O 3.29Å; I887-L944 HydrophobicContact CD1-CD2 3.9Å; I887-L944 HydrophobicContact CG1-CD2 4.34Å; I887-L944 HydrophobicContact CG2-CD2 3.57Å
888	L	96.3	Very high	95.1	Very high	5 Å²	5	10.3 Å²	10.3	3%	0.026	6%	0.057	C	C	.	.	H	α-helix	trans	-56.3	-49.7	178.3	-179.1	61.3	0	0	0	111.4	I804 V878 F879 V880 V883 V884 S885 I891 W892	I804-L888 HydrophobicContact CD1-CD2 3.9Å; V878-L888 WeakPolarHBondContact O-CD1 3.3Å; F879-L888 HydrophobicContact CB-CD1 4.17Å; V880-L888 HydrophobicContact CG2-CD1 4.03Å; V880-L888 HydrophobicContact CG2-CD2 4.32Å; V883-L888 HydrophobicContact CG2-CB 3.85Å; V883-L888 HydrophobicContact CG2-CD1 4.31Å; V884-L888 PolarHBondContact O-N 3.39Å; S885-L888 WeakPolarHBondContact O-CB 3.43Å; S885-L888 PolarHBondContact O-N 3.42Å; S885-L888 VanDerWaalsContact O-N 3.14Å; L888-I891 PolarHBondContact O-N 3.12Å; L888-W892 VanDerWaalsContact O-CD1 3.3Å; L888-W892 PolarHBondContact O-N 3.09Å
889	F	95.9	Very high	95	Very high	0 Å²	0	10.6 Å²	10.6	0%	0	6%	0.06	C	C	.	.	H	α-helix	trans	-70.6	-38.2	179.8	-65.6	-64.8	0	0	0	112.5	Y640 F642 R711 W715 I804 L807 Y808 S885 I887 I891 W892 D893	Y640-F889 VanDerWaalsContact CB-CE2 3.45Å; Y640-F889 AromaticContact CD1-CD2 3.72Å; Y640-F889 HydrophobicContact CD1-CD2 3.72Å; Y640-F889 AromaticContact CD1-CE2 3.76Å; Y640-F889 HydrophobicContact CD1-CE2 3.76Å; Y640-F889 AromaticContact CD2-CD2 3.68Å; Y640-F889 HydrophobicContact CD2-CD2 3.68Å; Y640-F889 AromaticContact CD2-CE2 3.71Å; Y640-F889 HydrophobicContact CD2-CE2 3.71Å; Y640-F889 AromaticContact CE1-CD2 3.87Å; Y640-F889 HydrophobicContact CE1-CD2 3.87Å; Y640-F889 HydrophobicContact CE1-CE2 4.38Å; Y640-F889 HydrophobicContact CE1-CG 4.49Å; Y640-F889 AromaticContact CE2-CD2 3.81Å; Y640-F889 HydrophobicContact CE2-CD2 3.81Å; Y640-F889 HydrophobicContact CE2-CE2 4.32Å; Y640-F889 AromaticContact CG-CD2 3.59Å; Y640-F889 HydrophobicContact CG-CD2 3.59Å; Y640-F889 AromaticContact CG-CE2 3.33Å; Y640-F889 HydrophobicContact CG-CE2 3.33Å; Y640-F889 HydrophobicContact CG-CZ 4.32Å; Y640-F889 AromaticContact CZ-CD2 3.87Å; F642-F889 AromaticContact CE2-CE2 3.99Å; F642-F889 HydrophobicContact CE2-CE2 3.99Å; F642-F889 AromaticContact CE2-CZ 3.94Å; F642-F889 HydrophobicContact CE2-CZ 3.94Å; R711-F889 VanDerWaalsContact CZ-CB 3.45Å; W715-F889 AromaticContact CH2-CD1 3.72Å; W715-F889 HydrophobicContact CH2-CD1 3.72Å; W715-F889 HydrophobicContact CH2-CE1 4.07Å; W715-F889 AromaticContact CZ2-CD1 3.94Å; W715-F889 HydrophobicContact CZ2-CD1 3.94Å; I804-F889 HydrophobicContact CD1-CE1 4.49Å; I804-F889 HydrophobicContact CD1-CZ 4.39Å; I804-F889 HydrophobicContact CG2-CE1 4.04Å; L807-F889 HydrophobicContact CD1-CE1 4.17Å; L807-F889 HydrophobicContact CD1-CZ 3.7Å; Y808-F889 HydrophobicContact CD2-CD1 4.42Å; Y808-F889 HydrophobicContact CD2-CE1 4.22Å; Y808-F889 AromaticContact CE2-CD1 3.64Å; Y808-F889 HydrophobicContact CE2-CD1 3.64Å; Y808-F889 AromaticContact CE2-CE1 3.56Å; Y808-F889 HydrophobicContact CE2-CE1 3.56Å; Y808-F889 HydrophobicContact CE2-CG 4.31Å; Y808-F889 HydrophobicContact CE2-CZ 4.2Å; S885-F889 WeakPolarHBondContact O-CD2 3.48Å; S885-F889 PolarHBondContact O-N 2.99Å; I887-F889 PolarHBondContact O-N 2.96Å; F889-I891 VanDerWaalsContact C-N 3.27Å; F889-I891 PolarHBondContact O-N 3.36Å; F889-W892 PolarHBondContact O-N 3.14Å; F889-W892 VanDerWaalsContact O-N 3.13Å; F889-D893 WeakPolarHBondContact O-CB 3.42Å; F889-D893 PolarHBondContact O-N 2.72Å
890	K	95.9	Very high	94.8	Very high	13 Å²	13	11.1 Å²	11.1	6%	0.057	6%	0.063	C	C	.	.	H	α-helix	trans	-61.5	-31.4	172.4	-80.2	166.4	175.6	156.4	0	112.7	E673 D886 I887 S941 M945	E673-K890 IonicContact OE1-NZ 2.98Å; E673-K890 PolarHBondContact OE1-NZ 3.46Å; D886-K890 WeakPolarHBondContact O-CB 3.39Å; D886-K890 WeakPolarHBondContact O-CG 3.04Å; D886-K890 PolarHBondContact O-N 3.5Å; D886-K890 VanDerWaalsContact OD1-CE 3.31Å; D886-K890 WeakPolarHBondContact OD1-CE 3.49Å; D886-K890 IonicContact OD1-NZ 2.82Å; D886-K890 PolarHBondContact OD1-NZ 3.44Å; D886-K890 IonicContact OD2-NZ 2.74Å; D886-K890 PolarHBondContact OD2-NZ 3.44Å; I887-K890 PolarHBondContact O-N 2.99Å; K890-S941 PolarHBondContact NZ-OG 3.09Å; K890-S941 VanDerWaalsContact NZ-OG 3.07Å; K890-M945 HydrophobicContact CB-CE 3.65Å; K890-M945 HydrophobicContact CB-SD 4.21Å; K890-M945 HydrophobicContact CG-CE 4.09Å
891	I	97.9	Very high	94.8	Very high	0 Å²	0	12.6 Å²	12.6	0%	0	7%	0.07	C	C	.	.	H	α-helix	trans	-71.5	-45.5	170.1	-69.1	172.6	0	0	0	111.3	V878 F879 V883 I887 L888 F889 A894 F895 I902 F906	V878-I891 HydrophobicContact CG1-CG2 4.42Å; F879-I891 HydrophobicContact CB-CD1 4.35Å; F879-I891 HydrophobicContact CD2-CD1 4.01Å; F879-I891 HydrophobicContact CD2-CG2 3.86Å; F879-I891 HydrophobicContact CE2-CD1 4.46Å; F879-I891 HydrophobicContact CE2-CG2 4.28Å; F879-I891 HydrophobicContact CG-CD1 4.04Å; V883-I891 HydrophobicContact CG2-CD1 4.45Å; I887-I891 HydrophobicContact CG2-CD1 3.73Å; I887-I891 HydrophobicContact CG2-CG1 4.2Å; I887-I891 WeakPolarHBondContact O-CB 3.46Å; I887-I891 VanDerWaalsContact O-CG1 3.26Å; I887-I891 WeakPolarHBondContact O-CG1 3.19Å; I887-I891 PolarHBondContact O-N 2.84Å; L888-I891 PolarHBondContact O-N 3.12Å; F889-I891 VanDerWaalsContact C-N 3.27Å; F889-I891 PolarHBondContact O-N 3.36Å; I891-A894 PolarHBondContact O-N 2.88Å; I891-F895 VanDerWaalsContact O-CB 3.3Å; I891-F895 WeakPolarHBondContact O-CB 3.19Å; I891-F895 PolarHBondContact O-N 2.91Å; I891-I902 HydrophobicContact CG2-CG2 4.34Å; I891-F906 HydrophobicContact CB-CD2 4.49Å; I891-F906 HydrophobicContact CD1-CB 3.98Å; I891-F906 HydrophobicContact CD1-CD1 3.92Å; I891-F906 HydrophobicContact CD1-CG 3.89Å; I891-F906 HydrophobicContact CG1-CB 4.25Å; I891-F906 HydrophobicContact CG1-CD1 3.67Å; I891-F906 HydrophobicContact CG1-CD2 3.86Å; I891-F906 HydrophobicContact CG1-CE1 3.9Å; I891-F906 HydrophobicContact CG1-CE2 4.08Å; I891-F906 HydrophobicContact CG1-CG 3.65Å; I891-F906 HydrophobicContact CG1-CZ 4.1Å; I891-F906 HydrophobicContact CG2-CD2 4.25Å
892	W	98.1	Very high	95.2	Very high	0 Å²	0	9.9 Å²	9.9	0%	0	6%	0.055	C	C	.	.	H	α-helix	trans	-64.5	-41.7	179.9	-89.3	64.6	0	0	0	112.9	W715 L801 I804 T817 I821 V878 V880 L888 F889 A894 F895 L896	W715-W892 HydrophobicContact CH2-CB 3.8Å; W715-W892 HydrophobicContact CH2-CD2 4.2Å; W715-W892 AromaticContact CH2-CE3 3.81Å; W715-W892 HydrophobicContact CH2-CE3 3.81Å; W715-W892 HydrophobicContact CH2-CG 4.24Å; W715-W892 HydrophobicContact CZ2-CB 3.6Å; W715-W892 AromaticContact CZ3-CE3 3.88Å; W715-W892 HydrophobicContact CZ3-CE3 3.88Å; W715-W892 HydrophobicContact CZ3-CZ3 4.44Å; L801-W892 HydrophobicContact CB-CH2 4.25Å; L801-W892 HydrophobicContact CD2-CH2 4.04Å; L801-W892 HydrophobicContact CD2-CZ2 3.73Å; L801-W892 WeakPolarHBondContact O-CH2 3.27Å; I804-W892 HydrophobicContact CB-CH2 4Å; I804-W892 HydrophobicContact CB-CZ2 3.98Å; I804-W892 HydrophobicContact CB-CZ3 4.36Å; I804-W892 HydrophobicContact CG1-CZ2 4.47Å; I804-W892 HydrophobicContact CG2-CD2 3.68Å; I804-W892 HydrophobicContact CG2-CE3 3.74Å; I804-W892 HydrophobicContact CG2-CG 4.34Å; I804-W892 HydrophobicContact CG2-CH2 3.9Å; I804-W892 HydrophobicContact CG2-CZ2 3.84Å; I804-W892 HydrophobicContact CG2-CZ3 3.86Å; T817-W892 HydrophobicContact CG2-CZ3 4.39Å; I821-W892 HydrophobicContact CD1-CH2 3.96Å; I821-W892 HydrophobicContact CD1-CZ3 4.14Å; V878-W892 HydrophobicContact CB-CZ2 4.23Å; V878-W892 PolarHBondContact O-NE1 3.09Å; V880-W892 HydrophobicContact CG2-CZ2 4.3Å; L888-W892 VanDerWaalsContact O-CD1 3.3Å; L888-W892 PolarHBondContact O-N 3.09Å; F889-W892 PolarHBondContact O-N 3.14Å; F889-W892 VanDerWaalsContact O-N 3.13Å; W892-A894 VanDerWaalsContact C-N 3.27Å; W892-A894 PolarHBondContact O-N 3.21Å; W892-F895 PolarHBondContact O-N 3.15Å; W892-F895 VanDerWaalsContact O-N 3.13Å; W892-L896 HydrophobicContact CE3-CD1 4.28Å; W892-L896 HydrophobicContact CE3-CG 4.45Å; W892-L896 WeakPolarHBondContact O-CG 3.39Å; W892-L896 PolarHBondContact O-N 3.17Å
893	D	97.7	Very high	95.5	Very high	2 Å²	2	9.4 Å²	9.4	1%	0.011	5%	0.052	C	C	.	.	H	α-helix	trans	-49	-50	172.1	-69.4	-23.8	0	0	0	110.6	I702 V706 R711 W715 F889	I702-D893 HydrophobicContact CG2-CB 4.32Å; I702-D893 VanDerWaalsContact CG2-O 3.23Å; I702-D893 WeakPolarHBondContact CG2-O 3.41Å; V706-D893 HydrophobicContact CG2-CB 3.81Å; V706-D893 VanDerWaalsContact CG2-CG 3.48Å; V706-D893 PolarHBondContact N-OD2 2.99Å; R711-D893 WeakPolarHBondContact CD-OD1 3.17Å; R711-D893 IonicContact CZ-OD1 3.02Å; R711-D893 IonicContact CZ-OD2 2.66Å; R711-D893 IonicContact NE-OD1 3.25Å; R711-D893 PolarHBondContact NE-OD1 2.73Å; R711-D893 IonicContact NE-OD2 3.53Å; R711-D893 PolarHBondContact NE-OD2 3.36Å; R711-D893 VanDerWaalsContact NE-OD2 3.09Å; R711-D893 IonicContact NH2-OD2 3.32Å; R711-D893 PolarHBondContact NH2-OD2 3Å; W715-D893 PolarHBondContact NE1-OD1 3.12Å; F889-D893 WeakPolarHBondContact O-CB 3.42Å; F889-D893 PolarHBondContact O-N 2.72Å
894	A	97.6	Very high	95.8	Very high	0 Å²	0	8.7 Å²	8.7	0%	0	5%	0.048	C	C	.	.	H	α-helix	trans	-73.3	-38	178.3	0	0	0	0	0	113.3	I891 W892 F897 E898 I902 F949	I891-A894 PolarHBondContact O-N 2.88Å; W892-A894 VanDerWaalsContact C-N 3.27Å; W892-A894 PolarHBondContact O-N 3.21Å; A894-F897 PolarHBondContact O-N 3.35Å; A894-E898 WeakPolarHBondContact O-CB 3.49Å; A894-E898 PolarHBondContact O-N 3.01Å; A894-I902 HydrophobicContact CB-CD1 4.26Å; A894-I902 HydrophobicContact CB-CG1 4.37Å; A894-I902 HydrophobicContact CB-CG2 4.11Å; A894-F949 HydrophobicContact CB-CE1 4.49Å; A894-F949 HydrophobicContact CB-CZ 3.68Å
895	F	98.1	Very high	96	Very high	0 Å²	0	7.7 Å²	7.7	0%	0	4%	0.041	C	C	.	.	H	α-helix	trans	-66.7	-42.3	-177.9	167.2	-109.3	0	0	0	112.3	I821 F825 V878 I891 W892 F897 G899 I902 I903	I821-F895 HydrophobicContact CD1-CE1 3.92Å; I821-F895 HydrophobicContact CG1-CE1 3.78Å; I821-F895 HydrophobicContact CG1-CZ 4.1Å; I821-F895 HydrophobicContact CG2-CE1 4.49Å; I821-F895 HydrophobicContact CG2-CZ 4.11Å; F825-F895 HydrophobicContact CD2-CE1 4.08Å; F825-F895 AromaticContact CD2-CE2 3.96Å; F825-F895 HydrophobicContact CD2-CE2 3.96Å; F825-F895 AromaticContact CD2-CZ 3.68Å; F825-F895 HydrophobicContact CD2-CZ 3.68Å; F825-F895 HydrophobicContact CE2-CE1 4.32Å; F825-F895 HydrophobicContact CE2-CZ 4.33Å; V878-F895 HydrophobicContact CG1-CB 4.45Å; V878-F895 HydrophobicContact CG1-CD1 3.86Å; V878-F895 HydrophobicContact CG1-CD2 4.39Å; V878-F895 HydrophobicContact CG1-CE1 4.1Å; V878-F895 HydrophobicContact CG1-CG 3.99Å; V878-F895 HydrophobicContact CG1-CZ 4.47Å; V878-F895 HydrophobicContact CG2-CD1 4.38Å; V878-F895 HydrophobicContact CG2-CE1 3.78Å; V878-F895 HydrophobicContact CG2-CE2 4.25Å; V878-F895 HydrophobicContact CG2-CZ 3.7Å; I891-F895 VanDerWaalsContact O-CB 3.3Å; I891-F895 WeakPolarHBondContact O-CB 3.19Å; I891-F895 PolarHBondContact O-N 2.91Å; W892-F895 PolarHBondContact O-N 3.15Å; W892-F895 VanDerWaalsContact O-N 3.13Å; F895-F897 PolarHBondContact O-N 3.03Å; F895-G899 VanDerWaalsContact O-CA 3.27Å; F895-G899 WeakPolarHBondContact O-CA 3.08Å; F895-G899 PolarHBondContact O-N 3.46Å; F895-I902 HydrophobicContact CB-CB 4.27Å; F895-I902 HydrophobicContact CB-CG2 3.97Å; F895-I903 HydrophobicContact CD2-CD1 4.32Å; F895-I903 HydrophobicContact CD2-CG1 4.07Å; F895-I903 HydrophobicContact CE2-CD1 3.79Å; F895-I903 HydrophobicContact CE2-CG1 4.06Å; F895-I903 HydrophobicContact CZ-CD1 4.48Å
896	L	97.7	Very high	96.3	Very high	2 Å²	2	6.7 Å²	6.7	1%	0.01	3%	0.034	C	C	.	.	H	α-helix	trans	-66.2	-22.3	176.9	-67.4	176.5	0	0	0	113.3	W715 C718 V719 H722 T817 F825 W892	W715-L896 HydrophobicContact CB-CD1 3.93Å; W715-L896 HydrophobicContact CD2-CD1 3.43Å; W715-L896 VanDerWaalsContact CD2-CD1 3.43Å; W715-L896 HydrophobicContact CE3-CD1 3.78Å; W715-L896 HydrophobicContact CG-CD1 3.5Å; W715-L896 HydrophobicContact CZ2-CD1 4.49Å; W715-L896 HydrophobicContact CZ3-CD1 4.43Å; C718-L896 HydrophobicContact CB-CB 4.15Å; V719-L896 HydrophobicContact CG2-CD2 4.39Å; H722-L896 PolarHBondContact CD2-O 3.46Å; H722-L896 PolarHBondContact NE2-O 3.01Å; T817-L896 HydrophobicContact CG2-CD2 4.13Å; F825-L896 HydrophobicContact CE2-CD2 4.33Å; W892-L896 HydrophobicContact CE3-CD1 4.28Å; W892-L896 HydrophobicContact CE3-CG 4.45Å; W892-L896 WeakPolarHBondContact O-CG 3.39Å; W892-L896 PolarHBondContact O-N 3.17Å
897	F	96.9	Very high	96.8	Very high	12 Å²	12	5.4 Å²	5.4	5%	0.053	3%	0.027	C	C	.	.	H	α-helix	trans	-101.1	-37.3	179.9	-174.7	-88.7	0	0	0	114.2	H694 L698 K699 I702 W717 A894 F895	H694-F897 AromaticContact CD2-CE1 3.91Å; H694-F897 AromaticContact CD2-CE2 3.84Å; H694-F897 AromaticContact CD2-CZ 3.35Å; H694-F897 WeakPolarHBondContact CD2-CZ 3.36Å; H694-F897 AromaticContact NE2-CE1 3.83Å; H694-F897 AromaticContact NE2-CZ 3.7Å; L698-F897 HydrophobicContact CD2-CE2 3.88Å; L698-F897 HydrophobicContact CG-CE2 3.96Å; L698-F897 HydrophobicContact CG-CZ 4.42Å; K699-F897 HydrophobicContact CB-CE1 3.56Å; K699-F897 HydrophobicContact CB-CZ 3.94Å; K699-F897 HydrophobicContact CD-CE1 4.13Å; K699-F897 HydrophobicContact CG-CD1 4.43Å; K699-F897 HydrophobicContact CG-CE1 3.72Å; I702-F897 HydrophobicContact CD1-CB 3.93Å; I702-F897 HydrophobicContact CD1-CD1 4.31Å; I702-F897 HydrophobicContact CD1-CD2 3.31Å; I702-F897 HydrophobicContact CD1-CE2 3.84Å; I702-F897 HydrophobicContact CD1-CG 3.58Å; I702-F897 HydrophobicContact CG2-CB 4.15Å; I702-F897 HydrophobicContact CG2-CG 4.5Å; W717-F897 HydrophobicContact CH2-CE2 4.14Å; W717-F897 AromaticContact CZ3-CD2 3.94Å; W717-F897 HydrophobicContact CZ3-CD2 3.94Å; W717-F897 AromaticContact CZ3-CE2 3.82Å; W717-F897 HydrophobicContact CZ3-CE2 3.82Å; A894-F897 PolarHBondContact O-N 3.35Å; F895-F897 PolarHBondContact O-N 3.03Å
898	E	94.8	Very high	96.9	Very high	21 Å²	21	5.2 Å²	5.2	10%	0.098	3%	0.026	C	C	.	.	H	α-helix	trans	-106.1	-7.5	-175.9	-78.3	-133.8	-105.8	0	0	114.5	K699 R703 A894 K901 I902 R905	K699-E898 VanDerWaalsContact CE-OE2 3.23Å; K699-E898 WeakPolarHBondContact CE-OE2 3.43Å; K699-E898 VanDerWaalsContact NZ-CD 3.32Å; K699-E898 IonicContact NZ-OE1 2.68Å; K699-E898 IonicContact NZ-OE2 3.63Å; K699-E898 PolarHBondContact NZ-OE2 3.26Å; R703-E898 IonicContact CZ-OE1 2.76Å; R703-E898 VanDerWaalsContact CZ-OE1 3.27Å; R703-E898 IonicContact NE-OE1 3.33Å; R703-E898 PolarHBondContact NE-OE1 3.46Å; R703-E898 IonicContact NH2-OE1 2.78Å; R703-E898 PolarHBondContact NH2-OE1 3.09Å; R703-E898 IonicContact NH2-OE2 3.98Å; A894-E898 WeakPolarHBondContact O-CB 3.49Å; A894-E898 PolarHBondContact O-N 3.01Å; E898-K901 PolarHBondContact O-NZ 2.84Å; E898-K901 WeakPolarHBondContact OE2-CE 3.12Å; E898-K901 IonicContact OE2-NZ 3.64Å; E898-K901 PolarHBondContact OE2-NZ 3.5Å; E898-I902 HydrophobicContact CB-CD1 3.73Å; E898-I902 HydrophobicContact CB-CG1 3.65Å; E898-I902 HydrophobicContact CG-CD1 4.42Å; E898-R905 IonicContact OE1-NH1 2.64Å
899	G	94.4	Very high	97	Very high	5 Å²	5	5 Å²	5	5%	0.052	3%	0.025	C	C	.	.			trans	76.8	-166.7	175.4	0	0	0	0	0	115.4	F895 K901 I902	F895-G899 VanDerWaalsContact O-CA 3.27Å; F895-G899 WeakPolarHBondContact O-CA 3.08Å; F895-G899 PolarHBondContact O-N 3.46Å; G899-K901 VanDerWaalsContact C-N 3.26Å; G899-K901 PolarHBondContact O-N 3.35Å; G899-I902 WeakPolarHBondContact O-CB 3.35Å; G899-I902 WeakPolarHBondContact O-CG1 3.27Å; G899-I902 PolarHBondContact O-N 3.04Å; G899-I902 VanDerWaalsContact O-N 3.12Å
900	P	94.5	Very high	97.1	Very high	11 Å²	11	5 Å²	5	7%	0.071	3%	0.025	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.4	-20.8	-161.3	29.9	-41.5	0	0	0	115.2	F825 M826 I902 I903 M957	F825-P900 VanDerWaalsContact O-CG 3.32Å; F825-P900 WeakPolarHBondContact O-CG 3.45Å; M826-P900 HydrophobicContact SD-CB 4.37Å; P900-I902 PolarHBondContact O-N 3.06Å; P900-I902 VanDerWaalsContact O-N 3.11Å; P900-I903 WeakPolarHBondContact O-CB 3.41Å; P900-I903 PolarHBondContact O-N 2.71Å; P900-M957 HydrophobicContact CG-CE 3.71Å; P900-M957 HydrophobicContact CG-SD 4.5Å
901	K	95.3	Very high	97.2	Very high	32 Å²	32	4.4 Å²	4.4	14%	0.139	2%	0.022	C	C	.	.	H	α-helix	trans	-57.8	-24.8	175.3	69	-179.4	-169.4	-90.7	0	113.3	E898 G899 I903 R905 F955 M957 I960	E898-K901 PolarHBondContact O-NZ 2.84Å; E898-K901 WeakPolarHBondContact OE2-CE 3.12Å; E898-K901 IonicContact OE2-NZ 3.64Å; E898-K901 PolarHBondContact OE2-NZ 3.5Å; G899-K901 VanDerWaalsContact C-N 3.26Å; G899-K901 PolarHBondContact O-N 3.35Å; K901-I903 PolarHBondContact O-N 3.09Å; K901-R905 WeakPolarHBondContact O-CB 3.3Å; K901-R905 PolarHBondContact O-N 3.03Å; K901-R905 VanDerWaalsContact O-N 3.15Å; K901-F955 HydrophobicContact CB-CD1 4.41Å; K901-F955 HydrophobicContact CB-CE1 4.44Å; K901-F955 WeakPolarHBondContact O-CE1 2.93Å; K901-M957 HydrophobicContact CB-SD 3.87Å; K901-M957 HydrophobicContact CD-CB 4.48Å; K901-I960 HydrophobicContact CB-CD1 3.58Å
902	I	97.3	Very high	97.2	Very high	0 Å²	0	7.9 Å²	7.9	0%	0	4%	0.037	C	C	.	.	H	α-helix	trans	-61.3	-33.1	177.2	-66.3	-56.2	0	0	0	111.2	I891 A894 F895 E898 G899 P900 R905 F906 F949	I891-I902 HydrophobicContact CG2-CG2 4.34Å; A894-I902 HydrophobicContact CB-CD1 4.26Å; A894-I902 HydrophobicContact CB-CG1 4.37Å; A894-I902 HydrophobicContact CB-CG2 4.11Å; F895-I902 HydrophobicContact CB-CB 4.27Å; F895-I902 HydrophobicContact CB-CG2 3.97Å; E898-I902 HydrophobicContact CB-CD1 3.73Å; E898-I902 HydrophobicContact CB-CG1 3.65Å; E898-I902 HydrophobicContact CG-CD1 4.42Å; G899-I902 WeakPolarHBondContact O-CB 3.35Å; G899-I902 WeakPolarHBondContact O-CG1 3.27Å; G899-I902 PolarHBondContact O-N 3.04Å; G899-I902 VanDerWaalsContact O-N 3.12Å; P900-I902 PolarHBondContact O-N 3.06Å; P900-I902 VanDerWaalsContact O-N 3.11Å; I902-R905 PolarHBondContact O-N 2.99Å; I902-F906 HydrophobicContact CG2-CD2 3.59Å; I902-F906 HydrophobicContact CG2-CE2 3.76Å; I902-F906 WeakPolarHBondContact O-CD2 3.43Å; I902-F906 PolarHBondContact O-N 2.84Å; I902-F949 HydrophobicContact CD1-CE1 3.87Å; I902-F949 HydrophobicContact CD1-CZ 4.36Å
903	I	97.8	Very high	97.2	Very high	1 Å²	1	9.7 Å²	9.7	1%	0.005	4%	0.044	C	C	.	.	H	α-helix	trans	-62.6	-55	-179.6	-56.1	176.9	0	0	0	110.9	M826 F875 V878 F879 F895 P900 K901 R905 F906 A907	M826-I903 HydrophobicContact CE-CD1 3.45Å; M826-I903 VanDerWaalsContact CE-CD1 3.45Å; M826-I903 HydrophobicContact SD-CD1 4.37Å; F875-I903 HydrophobicContact CB-CG2 4.15Å; F875-I903 HydrophobicContact CD1-CG2 3.62Å; F875-I903 HydrophobicContact CD2-CG2 3.67Å; F875-I903 HydrophobicContact CE1-CG2 3.88Å; F875-I903 HydrophobicContact CE2-CG2 3.95Å; F875-I903 HydrophobicContact CG-CG2 3.52Å; F875-I903 HydrophobicContact CZ-CG2 4.05Å; V878-I903 HydrophobicContact CG2-CD1 4.07Å; F879-I903 HydrophobicContact CE2-CG2 4.05Å; F879-I903 HydrophobicContact CZ-CG2 4.42Å; F879-I903 WeakPolarHBondContact CZ-O 3.24Å; F895-I903 HydrophobicContact CD2-CD1 4.32Å; F895-I903 HydrophobicContact CD2-CG1 4.07Å; F895-I903 HydrophobicContact CE2-CD1 3.79Å; F895-I903 HydrophobicContact CE2-CG1 4.06Å; F895-I903 HydrophobicContact CZ-CD1 4.48Å; P900-I903 WeakPolarHBondContact O-CB 3.41Å; P900-I903 PolarHBondContact O-N 2.71Å; K901-I903 PolarHBondContact O-N 3.09Å; I903-R905 VanDerWaalsContact C-N 3.31Å; I903-R905 PolarHBondContact O-N 3.21Å; I903-F906 PolarHBondContact O-N 3.43Å; I903-A907 WeakPolarHBondContact O-CB 3.47Å; I903-A907 PolarHBondContact O-N 3.08Å
904	F	97.9	Very high	97.1	Very high	0 Å²	0	11 Å²	11	0%	0	5%	0.05	C	C	.	.	H	α-helix	trans	-57.3	-43.3	175.3	-62.1	-95.7	0	0	0	112.4	D841 V844 F845 L848 F875 A907 L908 F955 I960	D841-F904 HydrophobicContact CB-CE1 4.39Å; D841-F904 HydrophobicContact CB-CZ 3.91Å; D841-F904 VanDerWaalsContact CG-CZ 3.44Å; D841-F904 WeakPolarHBondContact O-CE1 3.25Å; V844-F904 HydrophobicContact CB-CE1 3.8Å; V844-F904 HydrophobicContact CB-CZ 4.23Å; V844-F904 HydrophobicContact CG1-CD1 4.39Å; V844-F904 HydrophobicContact CG1-CE1 3.57Å; V844-F904 HydrophobicContact CG1-CZ 3.96Å; F845-F904 HydrophobicContact CB-CD1 4.05Å; F845-F904 HydrophobicContact CB-CE1 4.19Å; F845-F904 HydrophobicContact CD2-CD1 4.22Å; L848-F904 HydrophobicContact CD1-CB 4.14Å; L848-F904 HydrophobicContact CD1-CD1 3.57Å; L848-F904 HydrophobicContact CD1-CE1 4.22Å; L848-F904 HydrophobicContact CD1-CG 4.12Å; F875-F904 AromaticContact CE1-CD1 3.6Å; F875-F904 HydrophobicContact CE1-CD1 3.6Å; F875-F904 HydrophobicContact CE1-CD2 4.07Å; F875-F904 AromaticContact CE1-CE1 3.63Å; F875-F904 HydrophobicContact CE1-CE1 3.63Å; F875-F904 HydrophobicContact CE1-CE2 4.09Å; F875-F904 AromaticContact CE1-CG 3.84Å; F875-F904 HydrophobicContact CE1-CG 3.84Å; F875-F904 AromaticContact CE1-CZ 3.9Å; F875-F904 HydrophobicContact CE1-CZ 3.9Å; F875-F904 HydrophobicContact CZ-CB 4.43Å; F875-F904 AromaticContact CZ-CD1 3.73Å; F875-F904 HydrophobicContact CZ-CD1 3.73Å; F875-F904 HydrophobicContact CZ-CE1 4.17Å; F875-F904 AromaticContact CZ-CG 3.99Å; F875-F904 HydrophobicContact CZ-CG 3.99Å; F904-A907 PolarHBondContact O-N 3.36Å; F904-L908 WeakPolarHBondContact O-CG 3.29Å; F904-L908 PolarHBondContact O-N 2.88Å; F904-F955 HydrophobicContact CB-CE1 3.87Å; F904-F955 HydrophobicContact CB-CZ 3.66Å; F904-I960 HydrophobicContact CD2-CD1 4.29Å; F904-I960 HydrophobicContact CD2-CG2 4.27Å; F904-I960 HydrophobicContact CE2-CG2 3.68Å; F904-I960 HydrophobicContact CZ-CG2 3.79Å
905	R	97.1	Very high	97.1	Very high	5 Å²	5	11.4 Å²	11.4	2%	0.019	5%	0.052	C	C	.	.	H	α-helix	trans	-60.5	-46.8	-179.3	166.6	-180	-89	160.6	-8.2	112	E898 K901 I902 I903 A909 A948 N953 F955	E898-R905 IonicContact OE1-NH1 2.64Å; K901-R905 WeakPolarHBondContact O-CB 3.3Å; K901-R905 PolarHBondContact O-N 3.03Å; K901-R905 VanDerWaalsContact O-N 3.15Å; I902-R905 PolarHBondContact O-N 2.99Å; I903-R905 VanDerWaalsContact C-N 3.31Å; I903-R905 PolarHBondContact O-N 3.21Å; R905-A909 WeakPolarHBondContact O-CB 3.27Å; R905-A909 PolarHBondContact O-N 3.33Å; R905-A948 WeakPolarHBondContact CD-O 3.44Å; R905-A948 HydrophobicContact CG-CB 3.92Å; R905-A948 VanDerWaalsContact CG-O 3.23Å; R905-A948 WeakPolarHBondContact CG-O 3.28Å; R905-A948 PolarHBondContact NE-O 2.9Å; R905-N953 PolarHBondContact NH2-OD1 2.83Å; R905-F955 HydrophobicContact CB-CD1 4.2Å; R905-F955 HydrophobicContact CB-CE1 4.01Å; R905-F955 HydrophobicContact CB-CZ 4.41Å
906	F	97.9	Very high	97	Very high	1 Å²	1	15.8 Å²	15.8	0%	0.004	7%	0.073	C	C	.	.	H	α-helix	trans	-74.8	-32.6	178.3	-82.7	-80.3	0	0	0	112.9	F879 I891 I902 I903 L908 A909 L910 L944 M945 A948 F949	F879-F906 HydrophobicContact CE2-CB 4.09Å; F879-F906 HydrophobicContact CZ-CB 3.95Å; I891-F906 HydrophobicContact CB-CD2 4.49Å; I891-F906 HydrophobicContact CD1-CB 3.98Å; I891-F906 HydrophobicContact CD1-CD1 3.92Å; I891-F906 HydrophobicContact CD1-CG 3.89Å; I891-F906 HydrophobicContact CG1-CB 4.25Å; I891-F906 HydrophobicContact CG1-CD1 3.67Å; I891-F906 HydrophobicContact CG1-CD2 3.86Å; I891-F906 HydrophobicContact CG1-CE1 3.9Å; I891-F906 HydrophobicContact CG1-CE2 4.08Å; I891-F906 HydrophobicContact CG1-CG 3.65Å; I891-F906 HydrophobicContact CG1-CZ 4.1Å; I891-F906 HydrophobicContact CG2-CD2 4.25Å; I902-F906 HydrophobicContact CG2-CD2 3.59Å; I902-F906 HydrophobicContact CG2-CE2 3.76Å; I902-F906 WeakPolarHBondContact O-CD2 3.43Å; I902-F906 PolarHBondContact O-N 2.84Å; I903-F906 PolarHBondContact O-N 3.43Å; F906-L908 PolarHBondContact O-N 3.45Å; F906-A909 PolarHBondContact O-N 3.25Å; F906-L910 VanDerWaalsContact O-CG 3.25Å; F906-L910 WeakPolarHBondContact O-CG 3.33Å; F906-L910 PolarHBondContact O-N 2.92Å; F906-L944 HydrophobicContact CD1-CD2 4.26Å; F906-L944 HydrophobicContact CD1-CG 4.23Å; F906-L944 HydrophobicContact CE1-CD2 4.5Å; F906-L944 HydrophobicContact CE1-CG 4.31Å; F906-M945 HydrophobicContact CE1-SD 3.84Å; F906-M945 HydrophobicContact CZ-SD 3.53Å; F906-M945 VanDerWaalsContact CZ-SD 3.53Å; F906-A948 HydrophobicContact CD1-CB 3.94Å; F906-A948 HydrophobicContact CE1-CB 3.61Å; F906-A948 HydrophobicContact CE2-CB 4.3Å; F906-A948 HydrophobicContact CG-CB 4.42Å; F906-A948 HydrophobicContact CZ-CB 3.8Å; F906-F949 HydrophobicContact CE2-CE2 4.16Å; F906-F949 AromaticContact CE2-CZ 3.79Å; F906-F949 HydrophobicContact CE2-CZ 3.79Å; F906-F949 AromaticContact CZ-CE2 3.73Å; F906-F949 HydrophobicContact CZ-CE2 3.73Å; F906-F949 AromaticContact CZ-CZ 3.86Å; F906-F949 HydrophobicContact CZ-CZ 3.86Å
907	A	98.1	Very high	97	Very high	0 Å²	0	19.2 Å²	19.2	0%	0	9%	0.089	C	C	.	.	H	α-helix	trans	-59.6	-46.9	172.3	0	0	0	0	0	111.1	F845 W874 F875 F879 I903 F904 F911	F845-A907 HydrophobicContact CD2-CB 4.19Å; F845-A907 HydrophobicContact CE1-CB 4.49Å; F845-A907 HydrophobicContact CE2-CB 3.42Å; F845-A907 VanDerWaalsContact CE2-CB 3.42Å; F845-A907 HydrophobicContact CZ-CB 3.62Å; W874-A907 HydrophobicContact CE3-CB 4.19Å; W874-A907 HydrophobicContact CZ3-CB 4.37Å; F875-A907 HydrophobicContact CE2-CB 3.71Å; F875-A907 HydrophobicContact CZ-CB 4.29Å; F879-A907 HydrophobicContact CE1-CB 4.44Å; F879-A907 HydrophobicContact CZ-CB 4.07Å; I903-A907 WeakPolarHBondContact O-CB 3.47Å; I903-A907 PolarHBondContact O-N 3.08Å; F904-A907 PolarHBondContact O-N 3.36Å; A907-F911 VanDerWaalsContact O-CD2 3.23Å; A907-F911 WeakPolarHBondContact O-CD2 3.28Å; A907-F911 PolarHBondContact O-N 2.84Å
908	L	98.1	Very high	97	Very high	0 Å²	0	18.7 Å²	18.7	0%	0	9%	0.086	C	C	.	.	H	α-helix	trans	-60.3	-44.7	171.7	-68.7	175.2	0	0	0	112.1	F845 L848 M849 K852 L853 F904 F906 L910 F911 K912 M952 F955	F845-L908 HydrophobicContact CE2-CD2 3.8Å; F845-L908 HydrophobicContact CE2-CG 3.93Å; F845-L908 HydrophobicContact CZ-CD2 4.41Å; L848-L908 HydrophobicContact CB-CD1 4.32Å; L848-L908 HydrophobicContact CB-CD2 4.3Å; M849-L908 HydrophobicContact CG-CD2 4.18Å; M849-L908 HydrophobicContact SD-CD2 3.75Å; K852-L908 HydrophobicContact CB-CD1 4.25Å; K852-L908 HydrophobicContact CB-CD2 4.37Å; K852-L908 HydrophobicContact CG-CD1 3.89Å; L853-L908 HydrophobicContact CD1-CD2 4.38Å; F904-L908 WeakPolarHBondContact O-CG 3.29Å; F904-L908 PolarHBondContact O-N 2.88Å; F906-L908 PolarHBondContact O-N 3.45Å; L908-L910 PolarHBondContact O-N 3.24Å; L908-F911 PolarHBondContact O-N 3.27Å; L908-K912 WeakPolarHBondContact O-CB 3.24Å; L908-K912 PolarHBondContact O-N 2.71Å; L908-M952 HydrophobicContact CB-CG 4.25Å; L908-M952 HydrophobicContact CB-SD 3.72Å; L908-M952 HydrophobicContact CD1-SD 4.16Å; L908-F955 HydrophobicContact CD1-CE2 3.58Å; L908-F955 HydrophobicContact CD1-CZ 4.06Å
909	A	98.1	Very high	97.1	Very high	0 Å²	0	19.4 Å²	19.4	0%	0	9%	0.091	C	C	.	.	H	α-helix	trans	-64.1	-37.5	-177.4	0	0	0	0	0	112.9	R905 F906 K912 Y913 L944 I947 A948	R905-A909 WeakPolarHBondContact O-CB 3.27Å; R905-A909 PolarHBondContact O-N 3.33Å; F906-A909 PolarHBondContact O-N 3.25Å; A909-K912 PolarHBondContact O-N 2.99Å; A909-Y913 WeakPolarHBondContact O-CB 3.47Å; A909-Y913 PolarHBondContact O-N 2.93Å; A909-L944 HydrophobicContact CB-CD1 3.74Å; A909-I947 HydrophobicContact CB-CB 4.32Å; A909-I947 HydrophobicContact CB-CG2 3.81Å; A909-A948 HydrophobicContact CB-CB 3.82Å
910	L	98.1	Very high	97.2	Very high	0 Å²	0	25.2 Å²	25.2	0%	0	11%	0.114	C	C	.	.	H	α-helix	trans	-63.4	-46	174.5	-69.4	163.4	0	0	0	111.1	W874 F879 V883 F906 L908 Y913 F934 T935 I938 L944	W874-L910 HydrophobicContact CE3-CD1 4.37Å; W874-L910 HydrophobicContact CH2-CD1 4.45Å; W874-L910 HydrophobicContact CZ3-CD1 4.07Å; F879-L910 HydrophobicContact CD1-CD1 3.86Å; F879-L910 HydrophobicContact CE1-CD1 3.49Å; F879-L910 VanDerWaalsContact CE1-CD1 3.49Å; F879-L910 HydrophobicContact CZ-CD1 4.44Å; V883-L910 HydrophobicContact CG1-CD1 4.05Å; V883-L910 HydrophobicContact CG1-CD2 4.18Å; F906-L910 VanDerWaalsContact O-CG 3.25Å; F906-L910 WeakPolarHBondContact O-CG 3.33Å; F906-L910 PolarHBondContact O-N 2.92Å; L908-L910 PolarHBondContact O-N 3.24Å; L910-Y913 WeakPolarHBondContact O-CB 3.45Å; L910-Y913 PolarHBondContact O-N 3.13Å; L910-F934 HydrophobicContact CB-CE2 4.46Å; L910-T935 HydrophobicContact CD1-CG2 4.21Å; L910-T935 HydrophobicContact CD2-CG2 4.39Å; L910-I938 HydrophobicContact CB-CD1 4.37Å; L910-I938 HydrophobicContact CD2-CD1 3.62Å; L910-L944 HydrophobicContact CD2-CD1 4.05Å; L910-L944 HydrophobicContact CD2-CD2 3.75Å; L910-L944 HydrophobicContact CG-CD1 4.28Å; L910-L944 HydrophobicContact CG-CD2 4.46Å
911	F	98	Very high	97.2	Very high	0 Å²	0	26.9 Å²	26.9	0%	0	12%	0.123	C	C	.	.	H	α-helix	trans	-64.6	-40.8	174.6	-80.9	-65.3	0	0	0	112.8	F845 M849 L853 L856 F860 F867 T871 W874 A907 L908 Y913 Q914 E915 F918 L931 F934	F845-F911 HydrophobicContact CE1-CD2 4.43Å; F845-F911 HydrophobicContact CE1-CE2 4Å; F845-F911 AromaticContact CZ-CD2 3.9Å; F845-F911 HydrophobicContact CZ-CD2 3.9Å; F845-F911 AromaticContact CZ-CE2 3.9Å; F845-F911 HydrophobicContact CZ-CE2 3.9Å; M849-F911 HydrophobicContact CE-CB 4.19Å; M849-F911 HydrophobicContact CE-CD1 4.21Å; M849-F911 HydrophobicContact CE-CD2 3.85Å; M849-F911 HydrophobicContact CE-CE2 4.28Å; M849-F911 HydrophobicContact CE-CG 3.83Å; M849-F911 HydrophobicContact SD-CB 4.3Å; M849-F911 HydrophobicContact SD-CD2 3.76Å; M849-F911 HydrophobicContact SD-CE2 4.39Å; M849-F911 HydrophobicContact SD-CG 4.15Å; L853-F911 HydrophobicContact CD1-CB 3.64Å; L856-F911 HydrophobicContact CD2-CB 3.8Å; L856-F911 HydrophobicContact CD2-CD1 3.95Å; L856-F911 HydrophobicContact CD2-CG 4.22Å; F860-F911 AromaticContact CE2-CD1 4Å; F860-F911 HydrophobicContact CE2-CD1 4Å; F860-F911 AromaticContact CE2-CE1 3.72Å; F860-F911 HydrophobicContact CE2-CE1 3.72Å; F860-F911 HydrophobicContact CE2-CZ 4.46Å; F860-F911 HydrophobicContact CZ-CD1 4.15Å; F860-F911 AromaticContact CZ-CE1 3.85Å; F860-F911 HydrophobicContact CZ-CE1 3.85Å; F867-F911 HydrophobicContact CB-CZ 4.02Å; F867-F911 HydrophobicContact CG-CZ 4.48Å; T871-F911 HydrophobicContact CG2-CE2 3.74Å; T871-F911 HydrophobicContact CG2-CZ 4.08Å; W874-F911 HydrophobicContact CH2-CE2 4.13Å; W874-F911 HydrophobicContact CH2-CZ 4.22Å; W874-F911 HydrophobicContact CZ3-CD2 4.47Å; W874-F911 AromaticContact CZ3-CE2 3.91Å; W874-F911 HydrophobicContact CZ3-CE2 3.91Å; W874-F911 HydrophobicContact CZ3-CZ 4.44Å; A907-F911 VanDerWaalsContact O-CD2 3.23Å; A907-F911 WeakPolarHBondContact O-CD2 3.28Å; A907-F911 PolarHBondContact O-N 2.84Å; L908-F911 PolarHBondContact O-N 3.27Å; F911-Y913 VanDerWaalsContact C-N 3.29Å; F911-Y913 PolarHBondContact O-N 2.77Å; F911-Q914 CarbonylContact O-C 3.18Å; F911-Q914 PolarHBondContact O-N 3.06Å; F911-E915 WeakPolarHBondContact O-CA 3.47Å; F911-E915 PolarHBondContact O-N 3.43Å; F911-F918 HydrophobicContact CD1-CD2 4.41Å; F911-F918 AromaticContact CD1-CE2 3.81Å; F911-F918 HydrophobicContact CD1-CE2 3.81Å; F911-F918 HydrophobicContact CD1-CZ 4.23Å; F911-F918 HydrophobicContact CE1-CE2 4.1Å; F911-F918 HydrophobicContact CE1-CZ 4.04Å; F911-L931 HydrophobicContact CE1-CD1 3.49Å; F911-L931 VanDerWaalsContact CE1-CD1 3.49Å; F911-L931 HydrophobicContact CZ-CD1 3.79Å; F911-F934 HydrophobicContact CD1-CE2 4.4Å; F911-F934 AromaticContact CD1-CZ 3.91Å; F911-F934 HydrophobicContact CD1-CZ 3.91Å; F911-F934 HydrophobicContact CE1-CE1 4.32Å; F911-F934 AromaticContact CE1-CZ 3.79Å; F911-F934 HydrophobicContact CE1-CZ 3.79Å; F911-F934 HydrophobicContact CG-CZ 4.48Å; F911-F934 HydrophobicContact CZ-CZ 4.25Å
912	K	97.8	Very high	97.1	Very high	73 Å²	73	31.2 Å²	31.2	32%	0.317	14%	0.143	S	C	.	.	H	α-helix	trans	-63.4	-35.5	176.3	-179.5	62.9	-154.7	171	0	112.1	L853 L908 A909 Q914 E915 I947 M952	L853-K912 HydrophobicContact CD1-CB 4.33Å; L853-K912 HydrophobicContact CD2-CB 3.86Å; L853-K912 HydrophobicContact CD2-CD 3.45Å; L853-K912 VanDerWaalsContact CD2-CD 3.45Å; L853-K912 HydrophobicContact CD2-CG 4.16Å; L908-K912 WeakPolarHBondContact O-CB 3.24Å; L908-K912 PolarHBondContact O-N 2.71Å; A909-K912 PolarHBondContact O-N 2.99Å; K912-Q914 VanDerWaalsContact C-N 3.34Å; K912-Q914 PolarHBondContact O-N 2.89Å; K912-E915 WeakPolarHBondContact CD-OE2 3.3Å; K912-E915 WeakPolarHBondContact CE-OE2 3.28Å; K912-E915 IonicContact NZ-OE2 3.09Å; K912-E915 PolarHBondContact NZ-OE2 3.32Å; K912-E915 PolarHBondContact O-N 3.08Å; K912-I947 HydrophobicContact CB-CG2 3.85Å; K912-I947 HydrophobicContact CG-CG2 3.69Å; K912-M952 HydrophobicContact CB-CE 4.32Å; K912-M952 HydrophobicContact CD-CE 4.42Å; K912-M952 HydrophobicContact CG-CE 4.02Å
913	Y	97.6	Very high	96.9	Very high	39 Å²	39	35 Å²	35	15%	0.153	16%	0.163	C	C	.	.	H	α-helix	trans	-61.3	-41.1	180	-166.9	-69.9	0	0	0	112.1	A909 L910 F911 I938 K943 L944 I947	A909-Y913 WeakPolarHBondContact O-CB 3.47Å; A909-Y913 PolarHBondContact O-N 2.93Å; L910-Y913 WeakPolarHBondContact O-CB 3.45Å; L910-Y913 PolarHBondContact O-N 3.13Å; F911-Y913 VanDerWaalsContact C-N 3.29Å; F911-Y913 PolarHBondContact O-N 2.77Å; Y913-I938 HydrophobicContact CD1-CD1 4.11Å; Y913-I938 HydrophobicContact CD1-CG1 3.81Å; Y913-I938 HydrophobicContact CD1-CG2 4.26Å; Y913-I938 HydrophobicContact CD2-CG2 3.87Å; Y913-I938 HydrophobicContact CE1-CG1 4.14Å; Y913-I938 HydrophobicContact CE1-CG2 4.24Å; Y913-I938 HydrophobicContact CE2-CG2 3.84Å; Y913-I938 HydrophobicContact CG-CD1 4.08Å; Y913-I938 HydrophobicContact CG-CG1 4.17Å; Y913-I938 HydrophobicContact CG-CG2 4.1Å; Y913-K943 HydrophobicContact CD2-CD 4.16Å; Y913-K943 HydrophobicContact CD2-CG 4.09Å; Y913-K943 HydrophobicContact CE2-CB 3.97Å; Y913-K943 HydrophobicContact CE2-CD 3.47Å; Y913-K943 VanDerWaalsContact CE2-CD 3.47Å; Y913-K943 HydrophobicContact CE2-CG 3.62Å; Y913-L944 HydrophobicContact CD2-CB 4.39Å; Y913-L944 HydrophobicContact CD2-CD1 4.34Å; Y913-I947 HydrophobicContact CD2-CD1 3.91Å; Y913-I947 HydrophobicContact CG-CD1 4.41Å
914	Q	96.6	Very high	96.7	Very high	29 Å²	29	37.3 Å²	37.3	14%	0.136	18%	0.178	C	C	.	.	T	Hydrogen-bonded Turn	trans	-109.4	24.3	-179.7	-59.5	-64.1	28.6	0	0	113.5	F911 K912 E916 E917 F918 Y930 F934 T937 I938	F911-Q914 CarbonylContact O-C 3.18Å; F911-Q914 PolarHBondContact O-N 3.06Å; K912-Q914 VanDerWaalsContact C-N 3.34Å; K912-Q914 PolarHBondContact O-N 2.89Å; Q914-E916 PolarHBondContact O-N 3.41Å; Q914-E917 HydrophobicContact CB-CB 4.4Å; Q914-E917 PolarHBondContact O-N 2.97Å; Q914-E917 VanDerWaalsContact O-N 3.11Å; Q914-F918 HydrophobicContact CB-CD2 4.37Å; Q914-F918 HydrophobicContact CB-CE2 4.36Å; Q914-F918 WeakPolarHBondContact O-CD2 3.39Å; Q914-F918 PolarHBondContact O-N 3.23Å; Q914-F918 VanDerWaalsContact O-N 3.11Å; Q914-Y930 HydrophobicContact CB-CE1 4.31Å; Q914-Y930 WeakPolarHBondContact CG-OH 3.3Å; Q914-F934 HydrophobicContact CB-CD2 4.04Å; Q914-F934 HydrophobicContact CG-CD2 3.9Å; Q914-T937 PolarHBondContact NE2-OG1 2.76Å; Q914-I938 HydrophobicContact CG-CD1 4.13Å; Q914-I938 HydrophobicContact CG-CG1 4.19Å
915	E	96.8	Very high	96.5	Very high	9 Å²	9	41.2 Å²	41.2	4%	0.042	20%	0.202	C	C	.	.	H	α-helix	trans	-54.5	-48.4	-176.3	177.9	176.1	174.4	0	0	112.1	R855 L856 F911 K912 E917 F918 L919	R855-E915 IonicContact CZ-OE1 2.79Å; R855-E915 IonicContact NE-OE1 3.99Å; R855-E915 VanDerWaalsContact NH1-CD 3.34Å; R855-E915 IonicContact NH1-OE1 3.94Å; R855-E915 PolarHBondContact NH1-OE1 3.07Å; L856-E915 HydrophobicContact CB-CG 4.28Å; F911-E915 WeakPolarHBondContact O-CA 3.47Å; F911-E915 PolarHBondContact O-N 3.43Å; K912-E915 WeakPolarHBondContact CD-OE2 3.3Å; K912-E915 WeakPolarHBondContact CE-OE2 3.28Å; K912-E915 IonicContact NZ-OE2 3.09Å; K912-E915 PolarHBondContact NZ-OE2 3.32Å; K912-E915 PolarHBondContact O-N 3.08Å; E915-E917 VanDerWaalsContact C-N 3.31Å; E915-E917 PolarHBondContact O-N 2.88Å; E915-F918 PolarHBondContact O-N 3.05Å; E915-L919 HydrophobicContact CG-CD1 3.88Å; E915-L919 VanDerWaalsContact O-CG 3.3Å; E915-L919 WeakPolarHBondContact O-CG 3.49Å; E915-L919 PolarHBondContact O-N 3.15Å; E915-L919 VanDerWaalsContact O-N 3.09Å
916	E	97.1	Very high	96.4	Very high	91 Å²	91	42.5 Å²	42.5	43%	0.425	21%	0.214	S	C	.	.	H	α-helix	trans	-71.1	-24.2	-178.7	-51.6	-52.3	140.5	0	0	113	R855 Q914 K920	R855-E916 IonicContact CZ-OE1 2.69Å; R855-E916 IonicContact CZ-OE2 3.18Å; R855-E916 IonicContact NH1-OE1 3.67Å; R855-E916 PolarHBondContact NH1-OE1 3.09Å; R855-E916 IonicContact NH1-OE2 2.72Å; R855-E916 IonicContact NH2-OE1 3.33Å; R855-E916 PolarHBondContact NH2-OE1 3.3Å; R855-E916 IonicContact NH2-OE2 2.76Å; R855-E916 PolarHBondContact NH2-OE2 2.79Å; Q914-E916 PolarHBondContact O-N 3.41Å; E916-K920 WeakPolarHBondContact O-CE 3.44Å; E916-K920 VanDerWaalsContact O-CG 3.32Å; E916-K920 WeakPolarHBondContact O-CG 3.14Å; E916-K920 PolarHBondContact O-N 2.88Å
917	E	96.3	Very high	96.2	Very high	75 Å²	75	42.5 Å²	42.5	35%	0.35	21%	0.213	S	C	.	.	H	α-helix	trans	-74.8	-38.9	175.2	-58.8	-48.4	131.1	0	0	111.4	Q914 E915 K920 Y930	Q914-E917 HydrophobicContact CB-CB 4.4Å; Q914-E917 PolarHBondContact O-N 2.97Å; Q914-E917 VanDerWaalsContact O-N 3.11Å; E915-E917 VanDerWaalsContact C-N 3.31Å; E915-E917 PolarHBondContact O-N 2.88Å; E917-K920 IonicContact OE1-NZ 3.64Å; E917-K920 PolarHBondContact OE1-NZ 3.01Å; E917-K920 IonicContact OE2-NZ 2.74Å; E917-K920 PolarHBondContact OE2-NZ 3.05Å; E917-Y930 HydrophobicContact CB-CE1 4.04Å
918	F	96.8	Very high	96	Very high	0 Å²	0	44.4 Å²	44.4	0%	0	22%	0.222	C	C	.	.	H	α-helix	trans	-61.3	-47.2	170.3	-80.2	-71.2	0	0	0	111.7	L856 H859 F860 F911 Q914 E915 K920 L921 I927 Y930 L931 F934	L856-F918 HydrophobicContact CD1-CB 3.39Å; L856-F918 HydrophobicContact CD1-CD2 4.2Å; L856-F918 HydrophobicContact CD1-CG 3.91Å; H859-F918 PolarHBondContact NE2-O 2.65Å; F860-F918 HydrophobicContact CE1-CB 4.44Å; F860-F918 AromaticContact CE1-CD1 3.65Å; F860-F918 HydrophobicContact CE1-CD1 3.65Å; F860-F918 HydrophobicContact CE1-CE1 4.09Å; F860-F918 HydrophobicContact CE1-CG 4.13Å; F860-F918 AromaticContact CZ-CD1 3.72Å; F860-F918 HydrophobicContact CZ-CD1 3.72Å; F860-F918 HydrophobicContact CZ-CD2 4.35Å; F860-F918 AromaticContact CZ-CE1 3.89Å; F860-F918 HydrophobicContact CZ-CE1 3.89Å; F860-F918 AromaticContact CZ-CG 3.97Å; F860-F918 HydrophobicContact CZ-CG 3.97Å; F860-F918 HydrophobicContact CZ-CZ 4.3Å; F911-F918 HydrophobicContact CD1-CD2 4.41Å; F911-F918 AromaticContact CD1-CE2 3.81Å; F911-F918 HydrophobicContact CD1-CE2 3.81Å; F911-F918 HydrophobicContact CD1-CZ 4.23Å; F911-F918 HydrophobicContact CE1-CE2 4.1Å; F911-F918 HydrophobicContact CE1-CZ 4.04Å; Q914-F918 HydrophobicContact CB-CD2 4.37Å; Q914-F918 HydrophobicContact CB-CE2 4.36Å; Q914-F918 WeakPolarHBondContact O-CD2 3.39Å; Q914-F918 PolarHBondContact O-N 3.23Å; Q914-F918 VanDerWaalsContact O-N 3.11Å; E915-F918 PolarHBondContact O-N 3.05Å; F918-K920 PolarHBondContact O-N 3.3Å; F918-K920 VanDerWaalsContact O-N 3.16Å; F918-L921 WeakPolarHBondContact O-CB 3.46Å; F918-L921 PolarHBondContact O-N 3.16Å; F918-I927 HydrophobicContact CD1-CG2 4.17Å; F918-I927 HydrophobicContact CE1-CG2 4.4Å; F918-Y930 AromaticContact CD1-CD1 3.79Å; F918-Y930 HydrophobicContact CD1-CD1 3.79Å; F918-Y930 HydrophobicContact CD1-CE1 4.29Å; F918-Y930 HydrophobicContact CD2-CD1 4.46Å; F918-Y930 HydrophobicContact CD2-CE1 4.17Å; F918-Y930 AromaticContact CE1-CD1 3.54Å; F918-Y930 HydrophobicContact CE1-CD1 3.54Å; F918-Y930 HydrophobicContact CE1-CE1 4.15Å; F918-Y930 HydrophobicContact CE2-CD1 4.23Å; F918-Y930 HydrophobicContact CE2-CE1 4.01Å; F918-Y930 HydrophobicContact CG-CD1 4.25Å; F918-Y930 HydrophobicContact CG-CE1 4.3Å; F918-Y930 AromaticContact CZ-CD1 3.77Å; F918-Y930 HydrophobicContact CZ-CD1 3.77Å; F918-Y930 AromaticContact CZ-CE1 3.99Å; F918-Y930 HydrophobicContact CZ-CE1 3.99Å; F918-L931 HydrophobicContact CE1-CB 4.14Å; F918-L931 HydrophobicContact CE1-CD1 3.82Å; F918-L931 HydrophobicContact CZ-CD1 3.69Å; F918-F934 HydrophobicContact CE2-CD1 4.35Å; F918-F934 AromaticContact CE2-CD2 3.76Å; F918-F934 HydrophobicContact CE2-CD2 3.76Å; F918-F934 HydrophobicContact CE2-CE1 4.25Å; F918-F934 AromaticContact CE2-CE2 3.63Å; F918-F934 HydrophobicContact CE2-CE2 3.63Å; F918-F934 HydrophobicContact CE2-CG 4.09Å; F918-F934 AromaticContact CE2-CZ 3.84Å; F918-F934 HydrophobicContact CE2-CZ 3.84Å; F918-F934 AromaticContact CZ-CD1 3.76Å; F918-F934 HydrophobicContact CZ-CD1 3.76Å; F918-F934 HydrophobicContact CZ-CD2 4.01Å; F918-F934 AromaticContact CZ-CE1 3.74Å; F918-F934 HydrophobicContact CZ-CE1 3.74Å; F918-F934 AromaticContact CZ-CE2 3.98Å; F918-F934 HydrophobicContact CZ-CE2 3.98Å; F918-F934 AromaticContact CZ-CG 3.86Å; F918-F934 HydrophobicContact CZ-CG 3.86Å; F918-F934 AromaticContact CZ-CZ 3.81Å; F918-F934 HydrophobicContact CZ-CZ 3.81Å
919	L	96.8	Very high	95.7	Very high	36 Å²	36	51 Å²	51	19%	0.188	25%	0.25	C	S	.	.	H	α-helix	trans	-65.7	-16.9	-175.7	-69	172.3	0	0	0	114.5	R855 H859 E915 Q922	R855-L919 HydrophobicContact CB-CD1 4.22Å; R855-L919 VanDerWaalsContact NH2-CD1 3.34Å; H859-L919 HydrophobicContact CB-CD2 3.64Å; E915-L919 HydrophobicContact CG-CD1 3.88Å; E915-L919 VanDerWaalsContact O-CG 3.3Å; E915-L919 WeakPolarHBondContact O-CG 3.49Å; E915-L919 PolarHBondContact O-N 3.15Å; E915-L919 VanDerWaalsContact O-N 3.09Å; L919-Q922 PolarHBondContact O-NE2 3.13Å; L919-Q922 VanDerWaalsContact O-NE2 3.14Å
920	K	96.6	Very high	95.5	Very high	127 Å²	127	52.2 Å²	52.2	55%	0.552	26%	0.255	S	S	*	.	H	α-helix	trans	-73.3	-30.7	170.6	-70.4	167	-157.8	175.2	0	112.7	E916 E917 F918 Q922	E916-K920 WeakPolarHBondContact O-CE 3.44Å; E916-K920 VanDerWaalsContact O-CG 3.32Å; E916-K920 WeakPolarHBondContact O-CG 3.14Å; E916-K920 PolarHBondContact O-N 2.88Å; E917-K920 IonicContact OE1-NZ 3.64Å; E917-K920 PolarHBondContact OE1-NZ 3.01Å; E917-K920 IonicContact OE2-NZ 2.74Å; E917-K920 PolarHBondContact OE2-NZ 3.05Å; F918-K920 PolarHBondContact O-N 3.3Å; F918-K920 VanDerWaalsContact O-N 3.16Å; K920-Q922 PolarHBondContact O-N 3.29Å
921	L	95.7	Very high	95.3	Very high	46 Å²	46	52.3 Å²	52.3	24%	0.241	26%	0.256	C	S	.	.			trans	-77.3	122.2	-174.1	-57.8	175	0	0	0	110.2	H859 F918 A926 I927 Y930	H859-L921 PolarHBondContact CE1-O 3.24Å; H859-L921 PolarHBondContact NE2-O 3.47Å; F918-L921 WeakPolarHBondContact O-CB 3.46Å; F918-L921 PolarHBondContact O-N 3.16Å; L921-A926 HydrophobicContact CD2-CB 4.39Å; L921-I927 HydrophobicContact CB-CD1 4.5Å; L921-I927 HydrophobicContact CB-CG1 3.6Å; L921-I927 HydrophobicContact CD1-CG1 4.21Å; L921-Y930 HydrophobicContact CD1-CD1 4.07Å; L921-Y930 HydrophobicContact CD1-CG 4.05Å
922	Q	93.3	Very high	94.9	Very high	124 Å²	124	60 Å²	60	58%	0.579	29%	0.285	S	S	*	.			trans	-105.8	1.7	-178.6	-57.1	-58.7	-50	0	0	113.8	H863 L919 K920	H863-Q922 PolarHBondContact CE1-O 2.68Å; H863-Q922 PolarHBondContact ND1-O 2.79Å; L919-Q922 PolarHBondContact O-NE2 3.13Å; L919-Q922 VanDerWaalsContact O-NE2 3.14Å; K920-Q922 PolarHBondContact O-N 3.29Å
923	D	92.9	Very high	94.4	Very high	78 Å²	78	62 Å²	62	42%	0.417	29%	0.291	S	S	.	.			trans	-114.1	129.8	177.4	161.7	46.3	0	0	0	111	T925 A926 I927	D923-T925 VanDerWaalsContact CG-N 3.27Å; D923-T925 PolarHBondContact O-N 2.84Å; D923-T925 PolarHBondContact OD1-N 2.88Å; D923-T925 PolarHBondContact OD1-OG1 3.5Å; D923-T925 WeakPolarHBondContact OD2-CA 3.3Å; D923-T925 WeakPolarHBondContact OD2-CB 3.41Å; D923-T925 PolarHBondContact OD2-N 3.36Å; D923-A926 HydrophobicContact CB-CB 4.09Å; D923-A926 PolarHBondContact O-N 3.22Å; D923-A926 PolarHBondContact OD2-N 2.81Å; D923-I927 VanDerWaalsContact O-CG1 3.29Å; D923-I927 WeakPolarHBondContact O-CG1 3.17Å; D923-I927 PolarHBondContact O-N 3.34Å
924	T	94.1	Very high	94.3	Very high	50 Å²	50	60.2 Å²	60.2	31%	0.307	28%	0.284	S	S	.	.	H	α-helix	trans	-52.6	-37.7	174.7	-57.5	0	0	0	0	112.2	H863 V865 F928	H863-T924 VanDerWaalsContact O-CG2 3.26Å; H863-T924 WeakPolarHBondContact O-CG2 3.49Å; H863-T924 PolarHBondContact O-OG1 3.04Å; V865-T924 HydrophobicContact CG2-CG2 4.05Å; T924-F928 HydrophobicContact CG2-CD2 3.8Å; T924-F928 HydrophobicContact CG2-CE2 3.88Å; T924-F928 WeakPolarHBondContact O-CB 3.43Å; T924-F928 VanDerWaalsContact O-CD2 3.3Å; T924-F928 WeakPolarHBondContact O-CD2 3.46Å; T924-F928 PolarHBondContact O-N 3.42Å
925	T	93.1	Very high	94.1	Very high	83 Å²	83	59.1 Å²	59.1	51%	0.509	28%	0.279	S	S	.	.	H	α-helix	trans	-72.2	-43.6	-179.7	-39.3	0	0	0	0	111.8	D923 F928 K929	D923-T925 VanDerWaalsContact CG-N 3.27Å; D923-T925 PolarHBondContact O-N 2.84Å; D923-T925 PolarHBondContact OD1-N 2.88Å; D923-T925 PolarHBondContact OD1-OG1 3.5Å; D923-T925 WeakPolarHBondContact OD2-CA 3.3Å; D923-T925 WeakPolarHBondContact OD2-CB 3.41Å; D923-T925 PolarHBondContact OD2-N 3.36Å; T925-F928 PolarHBondContact O-N 2.97Å; T925-K929 WeakPolarHBondContact O-CG 3.44Å; T925-K929 PolarHBondContact O-N 3.03Å
926	A	94.1	Very high	93.6	Very high	32 Å²	32	64.4 Å²	64.4	26%	0.264	30%	0.299	S	S	.	.	H	α-helix	trans	-60.7	-44.6	173.7	0	0	0	0	0	111.5	L921 D923 K929 Y930	L921-A926 HydrophobicContact CD2-CB 4.39Å; D923-A926 HydrophobicContact CB-CB 4.09Å; D923-A926 PolarHBondContact O-N 3.22Å; D923-A926 PolarHBondContact OD2-N 2.81Å; A926-K929 PolarHBondContact O-N 3.48Å; A926-Y930 PolarHBondContact O-N 3.47Å
927	I	94.9	Very high	93.2	Very high	0 Å²	0	62.3 Å²	62.3	0%	0	29%	0.293	C	S	.	.	H	α-helix	trans	-59.1	-50.5	174	-62.2	160.4	0	0	0	110.2	H859 F860 H863 V865 F918 L921 D923 K929 Y930 L931	H859-I927 WeakPolarHBondContact NE2-CD1 3.38Å; F860-I927 HydrophobicContact CD1-CG2 4.1Å; F860-I927 HydrophobicContact CE1-CG2 3.72Å; H863-I927 HydrophobicContact CB-CD1 3.75Å; V865-I927 HydrophobicContact CB-CG2 4.35Å; V865-I927 HydrophobicContact CG1-CG2 3.85Å; V865-I927 HydrophobicContact CG2-CB 4.1Å; V865-I927 HydrophobicContact CG2-CD1 4.22Å; V865-I927 HydrophobicContact CG2-CG2 3.81Å; F918-I927 HydrophobicContact CD1-CG2 4.17Å; F918-I927 HydrophobicContact CE1-CG2 4.4Å; L921-I927 HydrophobicContact CB-CD1 4.5Å; L921-I927 HydrophobicContact CB-CG1 3.6Å; L921-I927 HydrophobicContact CD1-CG1 4.21Å; D923-I927 VanDerWaalsContact O-CG1 3.29Å; D923-I927 WeakPolarHBondContact O-CG1 3.17Å; D923-I927 PolarHBondContact O-N 3.34Å; I927-K929 VanDerWaalsContact C-N 3.28Å; I927-K929 PolarHBondContact O-N 3.43Å; I927-Y930 PolarHBondContact O-N 2.89Å; I927-L931 WeakPolarHBondContact O-CB 3.44Å; I927-L931 PolarHBondContact O-N 3.38Å
928	F	93.2	Very high	93	Very high	41 Å²	41	58.8 Å²	58.8	18%	0.18	28%	0.276	C	S	.	.	H	α-helix	trans	-66.6	-22.2	178.4	-89.1	-59.9	0	0	0	114.8	V865 L869 T924 T925 L931 R932	V865-F928 HydrophobicContact CB-CE2 4.24Å; V865-F928 HydrophobicContact CB-CZ 4.21Å; V865-F928 HydrophobicContact CG1-CD1 4.21Å; V865-F928 HydrophobicContact CG1-CD2 4.49Å; V865-F928 HydrophobicContact CG1-CE1 3.87Å; V865-F928 HydrophobicContact CG1-CE2 4.18Å; V865-F928 HydrophobicContact CG1-CZ 3.87Å; V865-F928 HydrophobicContact CG2-CD2 4.24Å; V865-F928 HydrophobicContact CG2-CE2 4.03Å; V865-F928 HydrophobicContact CG2-CZ 4.49Å; L869-F928 HydrophobicContact CD1-CE1 4.02Å; L869-F928 HydrophobicContact CD1-CZ 4.24Å; T924-F928 HydrophobicContact CG2-CD2 3.8Å; T924-F928 HydrophobicContact CG2-CE2 3.88Å; T924-F928 WeakPolarHBondContact O-CB 3.43Å; T924-F928 VanDerWaalsContact O-CD2 3.3Å; T924-F928 WeakPolarHBondContact O-CD2 3.46Å; T924-F928 PolarHBondContact O-N 3.42Å; T925-F928 PolarHBondContact O-N 2.97Å; F928-L931 HydrophobicContact CD1-CD2 4.08Å; F928-L931 HydrophobicContact CE1-CD2 4.31Å; F928-R932 PolarHBondContact O-NH1 3.3Å; F928-R932 VanDerWaalsContact O-NH1 3.17Å
929	K	91.6	Very high	92.6	Very high	137 Å²	137	59.1 Å²	59.1	60%	0.596	28%	0.278	S	S	*	.	H	α-helix	trans	-73	-55.2	169.1	-78	176	175.9	-176.6	0	110.1	T925 A926 I927 L931 R932 Y933	T925-K929 WeakPolarHBondContact O-CG 3.44Å; T925-K929 PolarHBondContact O-N 3.03Å; A926-K929 PolarHBondContact O-N 3.48Å; I927-K929 VanDerWaalsContact C-N 3.28Å; I927-K929 PolarHBondContact O-N 3.43Å; K929-L931 VanDerWaalsContact C-N 3.32Å; K929-L931 PolarHBondContact O-N 3.31Å; K929-R932 WeakPolarHBondContact O-CB 3.29Å; K929-R932 PolarHBondContact O-N 3.25Å; K929-R932 VanDerWaalsContact O-N 3.1Å; K929-Y933 VanDerWaalsContact O-CD1 3.25Å; K929-Y933 WeakPolarHBondContact O-CD1 3.2Å
930	Y	94.4	Very high	92.3	Very high	27 Å²	27	59.7 Å²	59.7	11%	0.106	28%	0.281	C	S	.	.	H	α-helix	trans	-57.9	-44	-180	-173	-114.6	0	0	0	112.1	Q914 E917 F918 L921 A926 I927 R932 Y933 F934	Q914-Y930 HydrophobicContact CB-CE1 4.31Å; Q914-Y930 WeakPolarHBondContact CG-OH 3.3Å; E917-Y930 HydrophobicContact CB-CE1 4.04Å; F918-Y930 AromaticContact CD1-CD1 3.79Å; F918-Y930 HydrophobicContact CD1-CD1 3.79Å; F918-Y930 HydrophobicContact CD1-CE1 4.29Å; F918-Y930 HydrophobicContact CD2-CD1 4.46Å; F918-Y930 HydrophobicContact CD2-CE1 4.17Å; F918-Y930 AromaticContact CE1-CD1 3.54Å; F918-Y930 HydrophobicContact CE1-CD1 3.54Å; F918-Y930 HydrophobicContact CE1-CE1 4.15Å; F918-Y930 HydrophobicContact CE2-CD1 4.23Å; F918-Y930 HydrophobicContact CE2-CE1 4.01Å; F918-Y930 HydrophobicContact CG-CD1 4.25Å; F918-Y930 HydrophobicContact CG-CE1 4.3Å; F918-Y930 AromaticContact CZ-CD1 3.77Å; F918-Y930 HydrophobicContact CZ-CD1 3.77Å; F918-Y930 AromaticContact CZ-CE1 3.99Å; F918-Y930 HydrophobicContact CZ-CE1 3.99Å; L921-Y930 HydrophobicContact CD1-CD1 4.07Å; L921-Y930 HydrophobicContact CD1-CG 4.05Å; A926-Y930 PolarHBondContact O-N 3.47Å; I927-Y930 PolarHBondContact O-N 2.89Å; Y930-R932 PolarHBondContact O-N 3.33Å; Y930-Y933 HydrophobicContact CD2-CE1 4.28Å; Y930-Y933 HydrophobicContact CD2-CE2 4.11Å; Y930-Y933 AromaticContact CD2-CZ 3.78Å; Y930-Y933 HydrophobicContact CE2-CE2 4.37Å; Y930-Y933 PolarHBondContact O-N 2.97Å; Y930-F934 HydrophobicContact CD1-CB 3.95Å; Y930-F934 HydrophobicContact CD2-CB 4.2Å; Y930-F934 HydrophobicContact CE1-CB 3.57Å; Y930-F934 HydrophobicContact CE1-CG 4.26Å; Y930-F934 HydrophobicContact CE2-CB 3.85Å; Y930-F934 HydrophobicContact CG-CB 4.24Å; Y930-F934 WeakPolarHBondContact O-CB 3.43Å; Y930-F934 PolarHBondContact O-N 3.39Å
931	L	94.1	Very high	92	Very high	1 Å²	1	54.2 Å²	54.2	1%	0.005	26%	0.259	C	S	.	.	H	α-helix	trans	-55.3	-26.1	177.5	-169.6	67.9	0	0	0	113.9	V865 F867 I870 F911 F918 I927 F928 K929 F934	V865-L931 HydrophobicContact CG1-CD2 4.02Å; F867-L931 HydrophobicContact CB-CD2 4.22Å; I870-L931 HydrophobicContact CD1-CB 4.15Å; I870-L931 HydrophobicContact CD1-CD2 3.86Å; I870-L931 HydrophobicContact CD1-CG 3.67Å; F911-L931 HydrophobicContact CE1-CD1 3.49Å; F911-L931 VanDerWaalsContact CE1-CD1 3.49Å; F911-L931 HydrophobicContact CZ-CD1 3.79Å; F918-L931 HydrophobicContact CE1-CB 4.14Å; F918-L931 HydrophobicContact CE1-CD1 3.82Å; F918-L931 HydrophobicContact CZ-CD1 3.69Å; I927-L931 WeakPolarHBondContact O-CB 3.44Å; I927-L931 PolarHBondContact O-N 3.38Å; F928-L931 HydrophobicContact CD1-CD2 4.08Å; F928-L931 HydrophobicContact CE1-CD2 4.31Å; K929-L931 VanDerWaalsContact C-N 3.32Å; K929-L931 PolarHBondContact O-N 3.31Å; L931-F934 HydrophobicContact CD1-CE1 3.88Å; L931-F934 WeakPolarHBondContact O-CD1 3.35Å
932	R	89.7	Confident	91.6	Very high	163 Å²	163	58 Å²	58	62%	0.615	27%	0.27	S	S	*	.	H	α-helix	trans	-78.5	-22.5	177.2	-77.9	-178.7	168.7	92.9	-7	114.6	I870 F928 K929 Y930	I870-R932 HydrophobicContact CD1-CB 4.48Å; I870-R932 HydrophobicContact CD1-CG 3.67Å; F928-R932 PolarHBondContact O-NH1 3.3Å; F928-R932 VanDerWaalsContact O-NH1 3.17Å; K929-R932 WeakPolarHBondContact O-CB 3.29Å; K929-R932 PolarHBondContact O-N 3.25Å; K929-R932 VanDerWaalsContact O-N 3.1Å; Y930-R932 PolarHBondContact O-N 3.33Å
933	Y	87.8	Confident	91.6	Very high	115 Å²	115	56.3 Å²	56.3	45%	0.451	26%	0.261	S	S	.	.	H	α-helix	trans	-130.3	-12.1	-173.3	75.9	-96.4	0	0	0	115.6	K929 Y930 T935 R936 T937	K929-Y933 VanDerWaalsContact O-CD1 3.25Å; K929-Y933 WeakPolarHBondContact O-CD1 3.2Å; Y930-Y933 HydrophobicContact CD2-CE1 4.28Å; Y930-Y933 HydrophobicContact CD2-CE2 4.11Å; Y930-Y933 AromaticContact CD2-CZ 3.78Å; Y930-Y933 HydrophobicContact CE2-CE2 4.37Å; Y930-Y933 PolarHBondContact O-N 2.97Å; Y933-T935 PolarHBondContact O-N 3.37Å; Y933-R936 WeakPolarHBondContact O-CB 3.49Å; Y933-R936 PolarHBondContact O-N 3.41Å; Y933-T937 HydrophobicContact CD2-CG2 4.15Å; Y933-T937 HydrophobicContact CE2-CG2 4.22Å
934	F	93.9	Very high	91.8	Very high	0 Å²	0	52.7 Å²	52.7	0%	0	24%	0.241	C	C	.	.	G	3₁₀ helix	trans	-55.4	-32	-174.5	80.9	-75	0	0	0	113.8	W874 L910 F911 Q914 F918 Y930 L931 R936 T937 I938	W874-F934 AromaticContact CH2-CE1 3.85Å; W874-F934 HydrophobicContact CH2-CE1 3.85Å; W874-F934 AromaticContact CH2-CZ 3.68Å; W874-F934 HydrophobicContact CH2-CZ 3.68Å; W874-F934 HydrophobicContact CZ2-CE1 4.04Å; W874-F934 HydrophobicContact CZ2-CZ 4.31Å; L910-F934 HydrophobicContact CB-CE2 4.46Å; F911-F934 HydrophobicContact CD1-CE2 4.4Å; F911-F934 AromaticContact CD1-CZ 3.91Å; F911-F934 HydrophobicContact CD1-CZ 3.91Å; F911-F934 HydrophobicContact CE1-CE1 4.32Å; F911-F934 AromaticContact CE1-CZ 3.79Å; F911-F934 HydrophobicContact CE1-CZ 3.79Å; F911-F934 HydrophobicContact CG-CZ 4.48Å; F911-F934 HydrophobicContact CZ-CZ 4.25Å; Q914-F934 HydrophobicContact CB-CD2 4.04Å; Q914-F934 HydrophobicContact CG-CD2 3.9Å; F918-F934 HydrophobicContact CE2-CD1 4.35Å; F918-F934 AromaticContact CE2-CD2 3.76Å; F918-F934 HydrophobicContact CE2-CD2 3.76Å; F918-F934 HydrophobicContact CE2-CE1 4.25Å; F918-F934 AromaticContact CE2-CE2 3.63Å; F918-F934 HydrophobicContact CE2-CE2 3.63Å; F918-F934 HydrophobicContact CE2-CG 4.09Å; F918-F934 AromaticContact CE2-CZ 3.84Å; F918-F934 HydrophobicContact CE2-CZ 3.84Å; F918-F934 AromaticContact CZ-CD1 3.76Å; F918-F934 HydrophobicContact CZ-CD1 3.76Å; F918-F934 HydrophobicContact CZ-CD2 4.01Å; F918-F934 AromaticContact CZ-CE1 3.74Å; F918-F934 HydrophobicContact CZ-CE1 3.74Å; F918-F934 AromaticContact CZ-CE2 3.98Å; F918-F934 HydrophobicContact CZ-CE2 3.98Å; F918-F934 AromaticContact CZ-CG 3.86Å; F918-F934 HydrophobicContact CZ-CG 3.86Å; F918-F934 AromaticContact CZ-CZ 3.81Å; F918-F934 HydrophobicContact CZ-CZ 3.81Å; Y930-F934 HydrophobicContact CD1-CB 3.95Å; Y930-F934 HydrophobicContact CD2-CB 4.2Å; Y930-F934 HydrophobicContact CE1-CB 3.57Å; Y930-F934 HydrophobicContact CE1-CG 4.26Å; Y930-F934 HydrophobicContact CE2-CB 3.85Å; Y930-F934 HydrophobicContact CG-CB 4.24Å; Y930-F934 WeakPolarHBondContact O-CB 3.43Å; Y930-F934 PolarHBondContact O-N 3.39Å; L931-F934 HydrophobicContact CD1-CE1 3.88Å; L931-F934 WeakPolarHBondContact O-CD1 3.35Å; F934-R936 PolarHBondContact O-N 3.1Å; F934-T937 WeakPolarHBondContact O-CB 3.41Å; F934-T937 PolarHBondContact O-N 2.95Å; F934-T937 PolarHBondContact O-OG1 2.67Å; F934-I938 HydrophobicContact CD2-CD1 4.39Å
935	T	93	Very high	91.8	Very high	6 Å²	6	51.1 Å²	51.1	4%	0.037	23%	0.23	C	C	.	.	G	3₁₀ helix	trans	-63.4	-22.2	175.8	52.3	0	0	0	0	114.1	W874 S882 L910 Y933 T937	W874-T935 HydrophobicContact CH2-CG2 3.72Å; W874-T935 HydrophobicContact CZ2-CG2 3.45Å; W874-T935 VanDerWaalsContact CZ2-CG2 3.45Å; S882-T935 WeakPolarHBondContact O-CB 3.25Å; S882-T935 PolarHBondContact O-OG1 3.3Å; L910-T935 HydrophobicContact CD1-CG2 4.21Å; L910-T935 HydrophobicContact CD2-CG2 4.39Å; Y933-T935 PolarHBondContact O-N 3.37Å; T935-T937 VanDerWaalsContact C-N 3.31Å
936	R	86.9	Confident	91.8	Very high	121 Å²	121	51.2 Å²	51.2	46%	0.457	23%	0.228	S	C	.	.	G	3₁₀ helix	trans	-80.1	-10	171.4	-60.4	-178.9	173.7	-168.5	-3.3	113.2	E648 Y933 F934	E648-R936 IonicContact OE1-NH1 3.84Å; Y933-R936 WeakPolarHBondContact O-CB 3.49Å; Y933-R936 PolarHBondContact O-N 3.41Å; F934-R936 PolarHBondContact O-N 3.1Å
937	T	88.7	Confident	92	Very high	47 Å²	47	50.3 Å²	50.3	29%	0.288	22%	0.219	S	C	.	.	S	Bend	trans	-90.5	-11.4	175.5	73.4	0	0	0	0	113	Q914 Y933 F934 T935 L939	Q914-T937 PolarHBondContact NE2-OG1 2.76Å; Y933-T937 HydrophobicContact CD2-CG2 4.15Å; Y933-T937 HydrophobicContact CE2-CG2 4.22Å; F934-T937 WeakPolarHBondContact O-CB 3.41Å; F934-T937 PolarHBondContact O-N 2.95Å; F934-T937 PolarHBondContact O-OG1 2.67Å; T935-T937 VanDerWaalsContact C-N 3.31Å; T937-L939 PolarHBondContact O-N 2.81Å
938	I	91.4	Very high	92.1	Very high	0 Å²	0	50.3 Å²	50.3	0%	0	22%	0.219	C	C	.	.			trans	-90.5	103.4	-178.8	-58.7	173.3	0	0	0	107.6	I887 L910 Y913 Q914 F934 L944	I887-I938 HydrophobicContact CD1-CB 4.5Å; I887-I938 HydrophobicContact CD1-CG2 3.94Å; I887-I938 WeakPolarHBondContact CD1-O 3.29Å; L910-I938 HydrophobicContact CB-CD1 4.37Å; L910-I938 HydrophobicContact CD2-CD1 3.62Å; Y913-I938 HydrophobicContact CD1-CD1 4.11Å; Y913-I938 HydrophobicContact CD1-CG1 3.81Å; Y913-I938 HydrophobicContact CD1-CG2 4.26Å; Y913-I938 HydrophobicContact CD2-CG2 3.87Å; Y913-I938 HydrophobicContact CE1-CG1 4.14Å; Y913-I938 HydrophobicContact CE1-CG2 4.24Å; Y913-I938 HydrophobicContact CE2-CG2 3.84Å; Y913-I938 HydrophobicContact CG-CD1 4.08Å; Y913-I938 HydrophobicContact CG-CG1 4.17Å; Y913-I938 HydrophobicContact CG-CG2 4.1Å; Q914-I938 HydrophobicContact CG-CD1 4.13Å; Q914-I938 HydrophobicContact CG-CG1 4.19Å; F934-I938 HydrophobicContact CD2-CD1 4.39Å; I938-L944 HydrophobicContact CG2-CB 4.46Å; I938-L944 HydrophobicContact CG2-CD2 4.26Å
939	L	88.5	Confident	92.2	Very high	7 Å²	7	49.1 Å²	49.1	4%	0.037	21%	0.213	C	C	.	.			trans	-109.1	-31.1	-178.3	-54.2	-176.7	0	0	0	113	R660 E663 L664 L667 V884 T937 S941	R660-L939 HydrophobicContact CB-CD1 3.96Å; R660-L939 HydrophobicContact CB-CD2 4.5Å; R660-L939 HydrophobicContact CG-CD1 4.1Å; E663-L939 HydrophobicContact CB-CD1 4.11Å; E663-L939 HydrophobicContact CG-CD1 4.16Å; E663-L939 WeakPolarHBondContact OE2-CD1 3.27Å; L664-L939 HydrophobicContact CD1-CD2 4.15Å; L664-L939 HydrophobicContact CD2-CB 3.98Å; L664-L939 HydrophobicContact CD2-CD2 4.09Å; L664-L939 HydrophobicContact CG-CB 4.42Å; L664-L939 HydrophobicContact CG-CD1 4.49Å; L664-L939 HydrophobicContact CG-CD2 4.07Å; L667-L939 HydrophobicContact CD1-CB 4.17Å; V884-L939 HydrophobicContact CG1-CD2 3.85Å; V884-L939 HydrophobicContact CG2-CD2 4.32Å; T937-L939 PolarHBondContact O-N 2.81Å; L939-S941 PolarHBondContact O-N 2.92Å
940	D	89.4	Confident	92.3	Very high	49 Å²	49	46.4 Å²	46.4	26%	0.262	21%	0.208	S	C	.	.			trans	-72.3	88.8	174	-177.8	-2	0	0	0	110.8	R942 K943 L944	D940-R942 PolarHBondContact O-N 3.34Å; D940-R942 WeakPolarHBondContact OD1-CA 3.36Å; D940-R942 WeakPolarHBondContact OD1-CB 3.43Å; D940-R942 PolarHBondContact OD1-N 3.45Å; D940-K943 HydrophobicContact CB-CB 4.25Å; D940-K943 VanDerWaalsContact CG-CB 3.49Å; D940-K943 PolarHBondContact OD1-N 3.32Å; D940-K943 WeakPolarHBondContact OD2-CB 3.42Å; D940-L944 PolarHBondContact O-N 2.81Å
941	S	90.4	Very high	92.2	Very high	12 Å²	12	49.1 Å²	49.1	8%	0.084	23%	0.225	C	C	.	.	H	α-helix	trans	-64.2	-27.1	174.3	59.8	0	0	0	0	112.4	D886 K890 L939 L944 M945	D886-S941 WeakPolarHBondContact OD2-CB 3.47Å; D886-S941 PolarHBondContact OD2-OG 3.4Å; K890-S941 PolarHBondContact NZ-OG 3.09Å; K890-S941 VanDerWaalsContact NZ-OG 3.07Å; L939-S941 PolarHBondContact O-N 2.92Å; S941-L944 PolarHBondContact O-N 2.84Å; S941-M945 WeakPolarHBondContact O-CB 3.46Å; S941-M945 WeakPolarHBondContact O-CG 3.25Å; S941-M945 PolarHBondContact O-N 2.87Å
942	R	88.9	Confident	92.1	Very high	124 Å²	124	49.6 Å²	49.6	47%	0.468	23%	0.227	S	C	.	.	H	α-helix	trans	-67.3	-47.9	178.7	-169.4	-167.6	-50.7	-175.8	7.2	111.4	T670 D940 M945 N946	T670-R942 PolarHBondContact OG1-NH2 3.46Å; D940-R942 PolarHBondContact O-N 3.34Å; D940-R942 WeakPolarHBondContact OD1-CA 3.36Å; D940-R942 WeakPolarHBondContact OD1-CB 3.43Å; D940-R942 PolarHBondContact OD1-N 3.45Å; R942-M945 PolarHBondContact O-N 3.17Å; R942-N946 WeakPolarHBondContact O-CB 3.23Å; R942-N946 PolarHBondContact O-N 3.48Å
943	K	93.3	Very high	92	Very high	90 Å²	90	45.2 Å²	45.2	39%	0.391	22%	0.216	S	C	.	.	H	α-helix	trans	-63	-40.7	174	174.9	179.3	165.1	-162.4	0	111.3	Y913 D940 N946 I947	Y913-K943 HydrophobicContact CD2-CD 4.16Å; Y913-K943 HydrophobicContact CD2-CG 4.09Å; Y913-K943 HydrophobicContact CE2-CB 3.97Å; Y913-K943 HydrophobicContact CE2-CD 3.47Å; Y913-K943 VanDerWaalsContact CE2-CD 3.47Å; Y913-K943 HydrophobicContact CE2-CG 3.62Å; D940-K943 HydrophobicContact CB-CB 4.25Å; D940-K943 VanDerWaalsContact CG-CB 3.49Å; D940-K943 PolarHBondContact OD1-N 3.32Å; D940-K943 WeakPolarHBondContact OD2-CB 3.42Å; K943-N946 WeakPolarHBondContact O-CB 3.28Å; K943-N946 PolarHBondContact O-N 3.08Å; K943-I947 HydrophobicContact CG-CD1 4.04Å; K943-I947 WeakPolarHBondContact O-CG1 3.48Å; K943-I947 PolarHBondContact O-N 2.95Å
944	L	95.8	Very high	91.9	Very high	2 Å²	2	44.2 Å²	44.2	1%	0.01	22%	0.223	C	C	.	.	H	α-helix	trans	-64.8	-43.3	175.9	-173.6	67.3	0	0	0	112.7	I887 F906 A909 L910 Y913 I938 D940 S941 N946 I947 A948	I887-L944 HydrophobicContact CD1-CD2 3.9Å; I887-L944 HydrophobicContact CG1-CD2 4.34Å; I887-L944 HydrophobicContact CG2-CD2 3.57Å; F906-L944 HydrophobicContact CD1-CD2 4.26Å; F906-L944 HydrophobicContact CD1-CG 4.23Å; F906-L944 HydrophobicContact CE1-CD2 4.5Å; F906-L944 HydrophobicContact CE1-CG 4.31Å; A909-L944 HydrophobicContact CB-CD1 3.74Å; L910-L944 HydrophobicContact CD2-CD1 4.05Å; L910-L944 HydrophobicContact CD2-CD2 3.75Å; L910-L944 HydrophobicContact CG-CD1 4.28Å; L910-L944 HydrophobicContact CG-CD2 4.46Å; Y913-L944 HydrophobicContact CD2-CB 4.39Å; Y913-L944 HydrophobicContact CD2-CD1 4.34Å; I938-L944 HydrophobicContact CG2-CB 4.46Å; I938-L944 HydrophobicContact CG2-CD2 4.26Å; D940-L944 PolarHBondContact O-N 2.81Å; S941-L944 PolarHBondContact O-N 2.84Å; L944-N946 VanDerWaalsContact C-N 3.29Å; L944-N946 PolarHBondContact O-N 3.49Å; L944-I947 PolarHBondContact O-N 2.71Å; L944-A948 VanDerWaalsContact O-CB 3.26Å; L944-A948 WeakPolarHBondContact O-CB 3.16Å; L944-A948 PolarHBondContact O-N 3.27Å
945	M	93.9	Very high	91.6	Very high	16 Å²	16	45 Å²	45	8%	0.079	23%	0.227	C	C	.	.	H	α-helix	trans	-60.2	-39.4	173.5	-69.8	-55.4	-121.3	0	0	111.3	R703 K890 F906 S941 R942 A948 F949	R703-M945 WeakPolarHBondContact O-CE 3.44Å; K890-M945 HydrophobicContact CB-CE 3.65Å; K890-M945 HydrophobicContact CB-SD 4.21Å; K890-M945 HydrophobicContact CG-CE 4.09Å; F906-M945 HydrophobicContact CE1-SD 3.84Å; F906-M945 HydrophobicContact CZ-SD 3.53Å; F906-M945 VanDerWaalsContact CZ-SD 3.53Å; S941-M945 WeakPolarHBondContact O-CB 3.46Å; S941-M945 WeakPolarHBondContact O-CG 3.25Å; S941-M945 PolarHBondContact O-N 2.87Å; R942-M945 PolarHBondContact O-N 3.17Å; M945-A948 PolarHBondContact O-N 3.35Å; M945-F949 HydrophobicContact CB-CD2 4.33Å; M945-F949 HydrophobicContact CE-CE2 4.01Å; M945-F949 WeakPolarHBondContact O-CB 3.36Å; M945-F949 VanDerWaalsContact O-CD2 3.3Å; M945-F949 WeakPolarHBondContact O-CD2 3.07Å; M945-F949 PolarHBondContact O-N 3.49Å; M945-F949 HydrophobicContact SD-CD2 4.3Å; M945-F949 HydrophobicContact SD-CE2 3.71Å
946	N	94.8	Very high	91.4	Very high	86 Å²	86	47.3 Å²	47.3	46%	0.46	24%	0.242	S	C	.	.	H	α-helix	trans	-63.5	-52.3	177.8	-171.5	-99.6	0	0	0	111.4	R942 K943 L944 A948 F949 V950	R942-N946 WeakPolarHBondContact O-CB 3.23Å; R942-N946 PolarHBondContact O-N 3.48Å; K943-N946 WeakPolarHBondContact O-CB 3.28Å; K943-N946 PolarHBondContact O-N 3.08Å; L944-N946 VanDerWaalsContact C-N 3.29Å; L944-N946 PolarHBondContact O-N 3.49Å; N946-A948 VanDerWaalsContact C-N 3.31Å; N946-A948 PolarHBondContact O-N 3.41Å; N946-F949 PolarHBondContact O-N 2.95Å; N946-V950 WeakPolarHBondContact O-CA 3.44Å; N946-V950 VanDerWaalsContact O-CB 3.22Å; N946-V950 WeakPolarHBondContact O-CB 3.41Å; N946-V950 PolarHBondContact O-N 2.97Å
947	I	96.6	Very high	91.5	Very high	13 Å²	13	44 Å²	44	7%	0.067	23%	0.232	C	C	.	.	I	π-helix	trans	-55.9	-47.1	175.5	-64.5	164.3	0	0	0	110.6	A909 K912 Y913 K943 L944 D951 M952	A909-I947 HydrophobicContact CB-CB 4.32Å; A909-I947 HydrophobicContact CB-CG2 3.81Å; K912-I947 HydrophobicContact CB-CG2 3.85Å; K912-I947 HydrophobicContact CG-CG2 3.69Å; Y913-I947 HydrophobicContact CD2-CD1 3.91Å; Y913-I947 HydrophobicContact CG-CD1 4.41Å; K943-I947 HydrophobicContact CG-CD1 4.04Å; K943-I947 WeakPolarHBondContact O-CG1 3.48Å; K943-I947 PolarHBondContact O-N 2.95Å; L944-I947 PolarHBondContact O-N 2.71Å; I947-D951 HydrophobicContact CG2-CB 4.4Å; I947-D951 PolarHBondContact O-N 2.91Å; I947-M952 HydrophobicContact CG2-CE 4.34Å; I947-M952 HydrophobicContact CG2-CG 4.37Å; I947-M952 WeakPolarHBondContact O-CG 3.46Å; I947-M952 PolarHBondContact O-N 3.06Å
948	A	96.6	Very high	91.7	Very high	0 Å²	0	50.8 Å²	50.8	0%	0	25%	0.252	C	S	.	.	I	π-helix	trans	-62.5	-47.7	-179.3	0	0	0	0	0	113	R905 F906 A909 L944 M945 N946	R905-A948 WeakPolarHBondContact CD-O 3.44Å; R905-A948 HydrophobicContact CG-CB 3.92Å; R905-A948 VanDerWaalsContact CG-O 3.23Å; R905-A948 WeakPolarHBondContact CG-O 3.28Å; R905-A948 PolarHBondContact NE-O 2.9Å; F906-A948 HydrophobicContact CD1-CB 3.94Å; F906-A948 HydrophobicContact CE1-CB 3.61Å; F906-A948 HydrophobicContact CE2-CB 4.3Å; F906-A948 HydrophobicContact CG-CB 4.42Å; F906-A948 HydrophobicContact CZ-CB 3.8Å; A909-A948 HydrophobicContact CB-CB 3.82Å; L944-A948 VanDerWaalsContact O-CB 3.26Å; L944-A948 WeakPolarHBondContact O-CB 3.16Å; L944-A948 PolarHBondContact O-N 3.27Å; M945-A948 PolarHBondContact O-N 3.35Å; N946-A948 VanDerWaalsContact C-N 3.31Å; N946-A948 PolarHBondContact O-N 3.41Å
949	F	95.4	Very high	91.8	Very high	16 Å²	16	55.1 Å²	55.1	7%	0.07	27%	0.273	C	S	.	.	I	π-helix	trans	-98	-9.6	-171.4	-66.3	-60.5	0	0	0	115.5	R703 A894 I902 F906 M945 N946 N953	R703-F949 HydrophobicContact CB-CD2 4Å; R703-F949 HydrophobicContact CB-CE2 4.07Å; R703-F949 HydrophobicContact CB-CG 4.31Å; R703-F949 HydrophobicContact CB-CZ 4.44Å; R703-F949 HydrophobicContact CG-CD1 3.85Å; R703-F949 HydrophobicContact CG-CD2 4.03Å; R703-F949 HydrophobicContact CG-CE1 3.76Å; R703-F949 HydrophobicContact CG-CE2 3.94Å; R703-F949 HydrophobicContact CG-CG 4.01Å; R703-F949 HydrophobicContact CG-CZ 3.82Å; A894-F949 HydrophobicContact CB-CE1 4.49Å; A894-F949 HydrophobicContact CB-CZ 3.68Å; I902-F949 HydrophobicContact CD1-CE1 3.87Å; I902-F949 HydrophobicContact CD1-CZ 4.36Å; F906-F949 HydrophobicContact CE2-CE2 4.16Å; F906-F949 AromaticContact CE2-CZ 3.79Å; F906-F949 HydrophobicContact CE2-CZ 3.79Å; F906-F949 AromaticContact CZ-CE2 3.73Å; F906-F949 HydrophobicContact CZ-CE2 3.73Å; F906-F949 AromaticContact CZ-CZ 3.86Å; F906-F949 HydrophobicContact CZ-CZ 3.86Å; M945-F949 HydrophobicContact CB-CD2 4.33Å; M945-F949 HydrophobicContact CE-CE2 4.01Å; M945-F949 WeakPolarHBondContact O-CB 3.36Å; M945-F949 VanDerWaalsContact O-CD2 3.3Å; M945-F949 WeakPolarHBondContact O-CD2 3.07Å; M945-F949 PolarHBondContact O-N 3.49Å; M945-F949 HydrophobicContact SD-CD2 4.3Å; M945-F949 HydrophobicContact SD-CE2 3.71Å; N946-F949 PolarHBondContact O-N 2.95Å; F949-N953 PolarHBondContact O-ND2 2.88Å
950	V	93.8	Very high	92	Very high	80 Å²	80	55 Å²	55	49%	0.485	27%	0.272	S	S	.	.	I	π-helix	trans	-114.2	-70.8	175.7	-172.6	0	0	0	0	109.9	N946 M952 N953	N946-V950 WeakPolarHBondContact O-CA 3.44Å; N946-V950 VanDerWaalsContact O-CB 3.22Å; N946-V950 WeakPolarHBondContact O-CB 3.41Å; N946-V950 PolarHBondContact O-N 2.97Å; V950-M952 PolarHBondContact O-N 3.21Å; V950-N953 VanDerWaalsContact O-CB 3.3Å; V950-N953 WeakPolarHBondContact O-CB 3.43Å; V950-N953 PolarHBondContact O-N 2.77Å; V950-N953 PolarHBondContact O-ND2 2.93Å
951	D	92.4	Very high	92.3	Very high	84 Å²	84	57.4 Å²	57.4	45%	0.449	28%	0.282	S	S	.	.	I	π-helix	trans	-63.3	-38.4	-168.2	-57.6	-10.3	0	0	0	113.7	I947 N953	I947-D951 HydrophobicContact CG2-CB 4.4Å; I947-D951 PolarHBondContact O-N 2.91Å; D951-N953 PolarHBondContact O-N 2.96Å; D951-N953 VanDerWaalsContact O-N 3.13Å
952	M	91.7	Very high	92.5	Very high	11 Å²	11	61.4 Å²	61.4	5%	0.054	30%	0.302	C	S	.	.	T	Hydrogen-bonded Turn	trans	-76.7	10	-179.2	-62.9	-61.3	98.5	0	0	114	K852 L908 K912 I947 V950 F955	K852-M952 HydrophobicContact CB-SD 4.42Å; L908-M952 HydrophobicContact CB-CG 4.25Å; L908-M952 HydrophobicContact CB-SD 3.72Å; L908-M952 HydrophobicContact CD1-SD 4.16Å; K912-M952 HydrophobicContact CB-CE 4.32Å; K912-M952 HydrophobicContact CD-CE 4.42Å; K912-M952 HydrophobicContact CG-CE 4.02Å; I947-M952 HydrophobicContact CG2-CE 4.34Å; I947-M952 HydrophobicContact CG2-CG 4.37Å; I947-M952 WeakPolarHBondContact O-CG 3.46Å; I947-M952 PolarHBondContact O-N 3.06Å; V950-M952 PolarHBondContact O-N 3.21Å; M952-F955 WeakPolarHBondContact O-CD2 3.24Å
953	N	88.5	Confident	92.8	Very high	71 Å²	71	58.6 Å²	58.6	38%	0.38	29%	0.291	S	S	.	.			trans	-85.9	157.6	175.9	-69.5	-42.8	0	0	0	113.1	R905 F949 V950 D951	R905-N953 PolarHBondContact NH2-OD1 2.83Å; F949-N953 PolarHBondContact O-ND2 2.88Å; V950-N953 VanDerWaalsContact O-CB 3.3Å; V950-N953 WeakPolarHBondContact O-CB 3.43Å; V950-N953 PolarHBondContact O-N 2.77Å; V950-N953 PolarHBondContact O-ND2 2.93Å; D951-N953 PolarHBondContact O-N 2.96Å; D951-N953 VanDerWaalsContact O-N 3.13Å
954	P	86.2	Confident	92.9	Very high	94 Å²	94	55.7 Å²	55.7	61%	0.61	28%	0.278	S	S	*	.			cis	-72.8	145.1	-7.8	31.1	-35.4	0	0	0	111.9	P956	P954-P956 VanDerWaalsContact C-CD 3.49Å
955	F	87.2	Confident	92.9	Very high	16 Å²	16	59.6 Å²	59.6	7%	0.07	31%	0.305	C	S	.	.			trans	-130.2	62.4	-177.9	-144.8	-100	0	0	0	113	L848 K901 F904 R905 L908 M952 I960	L848-F955 HydrophobicContact CD1-CE2 4.5Å; L848-F955 HydrophobicContact CD1-CZ 4.04Å; L848-F955 HydrophobicContact CD2-CE2 4.01Å; L848-F955 HydrophobicContact CD2-CZ 4.34Å; K901-F955 HydrophobicContact CB-CD1 4.41Å; K901-F955 HydrophobicContact CB-CE1 4.44Å; K901-F955 WeakPolarHBondContact O-CE1 2.93Å; F904-F955 HydrophobicContact CB-CE1 3.87Å; F904-F955 HydrophobicContact CB-CZ 3.66Å; R905-F955 HydrophobicContact CB-CD1 4.2Å; R905-F955 HydrophobicContact CB-CE1 4.01Å; R905-F955 HydrophobicContact CB-CZ 4.41Å; L908-F955 HydrophobicContact CD1-CE2 3.58Å; L908-F955 HydrophobicContact CD1-CZ 4.06Å; M952-F955 WeakPolarHBondContact O-CD2 3.24Å; F955-I960 HydrophobicContact CD1-CD1 4.13Å; F955-I960 HydrophobicContact CE1-CD1 3.66Å; F955-I960 HydrophobicContact CZ-CD1 4.4Å
956	P	88.1	Confident	92.9	Very high	55 Å²	55	64.5 Å²	64.5	36%	0.357	33%	0.327	S	S	.	.			trans	-79.3	129.6	-173.6	32.8	-35	0	0	0	112.3	P954 R958 Q959	P954-P956 VanDerWaalsContact C-CD 3.49Å; P956-R958 PolarHBondContact O-N 3.38Å; P956-Q959 VanDerWaalsContact CD-OE1 3.27Å; P956-Q959 HydrophobicContact CG-CB 4.18Å; P956-Q959 VanDerWaalsContact CG-CD 3.47Å; P956-Q959 HydrophobicContact CG-CG 3.81Å; P956-Q959 PolarHBondContact O-N 2.64Å
957	M	90.5	Very high	93	Very high	51 Å²	51	61.1 Å²	61.1	25%	0.251	31%	0.308	S	S	.	.	H	α-helix	trans	-54.7	-30.2	-179.5	-172.5	61	-174.2	0	0	113.5	P900 K901 Q959 I960 Q961	P900-M957 HydrophobicContact CG-CE 3.71Å; P900-M957 HydrophobicContact CG-SD 4.5Å; K901-M957 HydrophobicContact CB-SD 3.87Å; K901-M957 HydrophobicContact CD-CB 4.48Å; M957-Q959 VanDerWaalsContact C-N 3.32Å; M957-Q959 PolarHBondContact O-N 2.83Å; M957-I960 WeakPolarHBondContact O-CB 3.45Å; M957-I960 PolarHBondContact O-N 3.05Å; M957-I960 HydrophobicContact SD-CB 4.31Å; M957-I960 HydrophobicContact SD-CD1 4.13Å; M957-Q961 HydrophobicContact CE-CG 4.13Å; M957-Q961 HydrophobicContact CG-CG 4.31Å; M957-Q961 WeakPolarHBondContact O-CG 3.45Å; M957-Q961 PolarHBondContact O-N 2.81Å
958	R	92.1	Very high	92.9	Very high	190 Å²	190	62.4 Å²	62.4	72%	0.717	32%	0.315	S	S	*	.	H	α-helix	trans	-60.5	-35.5	176.5	-172.5	175.9	179.3	-179.1	-0.7	113.2	P956 Q961 N962	P956-R958 PolarHBondContact O-N 3.38Å; R958-Q961 PolarHBondContact O-N 3.08Å; R958-N962 WeakPolarHBondContact O-CB 3.42Å; R958-N962 PolarHBondContact O-N 3.34Å; R958-N962 PolarHBondContact O-OD1 3.05Å; R958-N962 VanDerWaalsContact O-OD1 3.12Å
959	Q	92.8	Very high	92.6	Very high	91 Å²	91	68.4 Å²	68.4	43%	0.425	34%	0.343	S	S	.	.	H	α-helix	trans	-69.6	-40.7	176.2	-76.6	174.3	-19.6	0	0	111.2	P956 M957 N962 R963	P956-Q959 VanDerWaalsContact CD-OE1 3.27Å; P956-Q959 HydrophobicContact CG-CB 4.18Å; P956-Q959 VanDerWaalsContact CG-CD 3.47Å; P956-Q959 HydrophobicContact CG-CG 3.81Å; P956-Q959 PolarHBondContact O-N 2.64Å; M957-Q959 VanDerWaalsContact C-N 3.32Å; M957-Q959 PolarHBondContact O-N 2.83Å; Q959-N962 PolarHBondContact O-N 3.3Å; Q959-R963 PolarHBondContact O-N 3.26Å
960	I	94.3	Very high	92.5	Very high	5 Å²	5	72 Å²	72	3%	0.026	36%	0.359	C	S	.	.	H	α-helix	trans	-61.8	-45	174.6	-53.1	176.5	0	0	0	110	V844 K901 F904 F955 M957 R963 R964	V844-I960 HydrophobicContact CG1-CG2 4.09Å; K901-I960 HydrophobicContact CB-CD1 3.58Å; F904-I960 HydrophobicContact CD2-CD1 4.29Å; F904-I960 HydrophobicContact CD2-CG2 4.27Å; F904-I960 HydrophobicContact CE2-CG2 3.68Å; F904-I960 HydrophobicContact CZ-CG2 3.79Å; F955-I960 HydrophobicContact CD1-CD1 4.13Å; F955-I960 HydrophobicContact CE1-CD1 3.66Å; F955-I960 HydrophobicContact CZ-CD1 4.4Å; M957-I960 WeakPolarHBondContact O-CB 3.45Å; M957-I960 PolarHBondContact O-N 3.05Å; M957-I960 HydrophobicContact SD-CB 4.31Å; M957-I960 HydrophobicContact SD-CD1 4.13Å; I960-R963 PolarHBondContact O-N 3.23Å; I960-R964 HydrophobicContact CG2-CG 4.47Å; I960-R964 WeakPolarHBondContact O-CB 3.21Å; I960-R964 VanDerWaalsContact O-CG 3.31Å; I960-R964 WeakPolarHBondContact O-CG 3.24Å; I960-R964 PolarHBondContact O-N 3.06Å
961	Q	94.5	Very high	92.4	Very high	98 Å²	98	68.3 Å²	68.3	46%	0.458	34%	0.336	S	S	.	.	H	α-helix	trans	-60.8	-45.8	175.6	-72.7	168.9	-33.8	0	0	112.2	M957 R958 R963 R964 S965	M957-Q961 HydrophobicContact CE-CG 4.13Å; M957-Q961 HydrophobicContact CG-CG 4.31Å; M957-Q961 WeakPolarHBondContact O-CG 3.45Å; M957-Q961 PolarHBondContact O-N 2.81Å; R958-Q961 PolarHBondContact O-N 3.08Å; Q961-R963 PolarHBondContact O-N 3.03Å; Q961-R964 WeakPolarHBondContact O-CB 3.3Å; Q961-R964 PolarHBondContact O-N 3.46Å; Q961-S965 PolarHBondContact O-N 2.91Å; Q961-S965 PolarHBondContact O-OG 3.14Å
962	N	94.6	Very high	92.3	Very high	97 Å²	97	68.9 Å²	68.9	52%	0.519	33%	0.332	S	S	.	.	H	α-helix	trans	-59.8	-45.8	176.1	-70.5	5.1	0	0	0	112.1	R958 Q959 S965 F966	R958-N962 WeakPolarHBondContact O-CB 3.42Å; R958-N962 PolarHBondContact O-N 3.34Å; R958-N962 PolarHBondContact O-OD1 3.05Å; R958-N962 VanDerWaalsContact O-OD1 3.12Å; Q959-N962 PolarHBondContact O-N 3.3Å; N962-S965 PolarHBondContact O-N 3.36Å; N962-F966 PolarHBondContact O-N 3.46Å
963	R	95.7	Very high	92.2	Very high	64 Å²	64	73.1 Å²	73.1	24%	0.242	35%	0.354	C	S	.	.	H	α-helix	trans	-67	-38.6	177.6	-70.4	-174.6	176.5	158.9	11.7	112	V844 D847 L848 E851 Q959 I960 Q961 S965 F966 H967	V844-R963 HydrophobicContact CB-CB 4.35Å; V844-R963 HydrophobicContact CG1-CB 3.85Å; V844-R963 HydrophobicContact CG2-CB 3.83Å; D847-R963 PolarHBondContact O-NH1 3.4Å; D847-R963 WeakPolarHBondContact OD2-CD 3.42Å; D847-R963 IonicContact OD2-NE 2.65Å; L848-R963 VanDerWaalsContact CD2-NH1 3.34Å; E851-R963 IonicContact OE2-CZ 3.58Å; E851-R963 VanDerWaalsContact OE2-CZ 3.25Å; E851-R963 IonicContact OE2-NH1 2.93Å; E851-R963 PolarHBondContact OE2-NH1 3.05Å; E851-R963 IonicContact OE2-NH2 3.48Å; E851-R963 PolarHBondContact OE2-NH2 2.71Å; Q959-R963 PolarHBondContact O-N 3.26Å; I960-R963 PolarHBondContact O-N 3.23Å; Q961-R963 PolarHBondContact O-N 3.03Å; R963-S965 PolarHBondContact O-N 3.28Å; R963-F966 PolarHBondContact O-N 3.4Å; R963-H967 PolarHBondContact O-CD2 3.2Å; R963-H967 PolarHBondContact O-N 3.02Å
964	R	96.2	Very high	92.3	Very high	29 Å²	29	72 Å²	72	11%	0.109	35%	0.346	C	S	.	.	H	α-helix	trans	-55.7	-50.3	171.4	-79.8	175.3	167.7	-178	-4.9	110.6	V840 D841 V844 I960 Q961 F966 H967 L968	V840-R964 HydrophobicContact CG1-CB 4.11Å; V840-R964 HydrophobicContact CG1-CG 4.13Å; V840-R964 WeakPolarHBondContact CG1-O 3.48Å; D841-R964 WeakPolarHBondContact OD1-CG 3.18Å; D841-R964 IonicContact OD1-CZ 3.34Å; D841-R964 IonicContact OD1-NE 3.54Å; D841-R964 PolarHBondContact OD1-NE 3.49Å; D841-R964 IonicContact OD1-NH2 2.75Å; D841-R964 PolarHBondContact OD1-NH2 3.47Å; D841-R964 IonicContact OD2-CZ 2.7Å; D841-R964 IonicContact OD2-NE 3.84Å; D841-R964 IonicContact OD2-NH2 3.18Å; D841-R964 PolarHBondContact OD2-NH2 2.98Å; V844-R964 HydrophobicContact CG2-CB 4.48Å; V844-R964 HydrophobicContact CG2-CG 3.99Å; I960-R964 HydrophobicContact CG2-CG 4.47Å; I960-R964 WeakPolarHBondContact O-CB 3.21Å; I960-R964 VanDerWaalsContact O-CG 3.31Å; I960-R964 WeakPolarHBondContact O-CG 3.24Å; I960-R964 PolarHBondContact O-N 3.06Å; Q961-R964 WeakPolarHBondContact O-CB 3.3Å; Q961-R964 PolarHBondContact O-N 3.46Å; R964-F966 VanDerWaalsContact C-N 3.34Å; R964-F966 PolarHBondContact O-N 3.47Å; R964-H967 PolarHBondContact O-N 2.86Å; R964-L968 WeakPolarHBondContact O-CB 3.46Å; R964-L968 PolarHBondContact O-N 3.41Å
965	S	94.6	Very high	92.4	Very high	84 Å²	84	70 Å²	70	59%	0.587	33%	0.331	S	S	*	.	H	α-helix	trans	-60.3	-39.6	177.7	-63.7	0	0	0	0	113.3	Q961 N962 R963	Q961-S965 PolarHBondContact O-N 2.91Å; Q961-S965 PolarHBondContact O-OG 3.14Å; N962-S965 PolarHBondContact O-N 3.36Å; R963-S965 PolarHBondContact O-N 3.28Å
966	F	95.3	Very high	92.4	Very high	120 Å²	120	73.8 Å²	73.8	53%	0.526	36%	0.355	S	S	.	.	H	α-helix	trans	-67.6	-44.4	178.3	175.1	-107.4	0	0	0	113.3	N962 R963 R964	N962-F966 PolarHBondContact O-N 3.46Å; R963-F966 PolarHBondContact O-N 3.4Å; R964-F966 VanDerWaalsContact C-N 3.34Å; R964-F966 PolarHBondContact O-N 3.47Å
967	H	96.4	Very high	92.6	Very high	14 Å²	14	76.1 Å²	76.1	7%	0.065	36%	0.361	C	S	.	.	H	α-helix	trans	-78.2	-27.4	179.7	-74.3	-65.1	0	0	0	113.3	V840 R843 D847 R963 R964 E969 K970 V971	V840-H967 HydrophobicContact CG1-CB 4.17Å; R843-H967 HydrophobicContact CB-CB 4.12Å; D847-H967 VanDerWaalsContact CG-NE2 3.27Å; D847-H967 IonicContact OD1-CE1 2.66Å; D847-H967 IonicContact OD1-NE2 3.29Å; D847-H967 PolarHBondContact OD1-NE2 3.41Å; D847-H967 IonicContact OD2-CD2 3.68Å; D847-H967 IonicContact OD2-CE1 3.21Å; D847-H967 IonicContact OD2-NE2 3.25Å; D847-H967 PolarHBondContact OD2-NE2 2.85Å; R963-H967 PolarHBondContact O-CD2 3.2Å; R963-H967 PolarHBondContact O-N 3.02Å; R964-H967 PolarHBondContact O-N 2.86Å; H967-E969 VanDerWaalsContact C-N 3.29Å; H967-E969 PolarHBondContact O-N 2.94Å; H967-K970 PolarHBondContact O-N 2.75Å; H967-V971 WeakPolarHBondContact O-CG2 3.28Å; H967-V971 PolarHBondContact O-N 3.24Å
968	L	94.4	Very high	92.4	Very high	40 Å²	40	76.7 Å²	76.7	21%	0.209	37%	0.365	C	S	.	.	H	α-helix	trans	-56.3	-42	177.8	179.9	63.6	0	0	0	112.5	L836 V840 R964 R972	L836-L968 HydrophobicContact CD1-CD1 4.02Å; L836-L968 HydrophobicContact CD2-CD1 3.79Å; L836-L968 HydrophobicContact CG-CD1 3.78Å; V840-L968 HydrophobicContact CG2-CB 4.14Å; V840-L968 HydrophobicContact CG2-CD1 4.04Å; R964-L968 WeakPolarHBondContact O-CB 3.46Å; R964-L968 PolarHBondContact O-N 3.41Å; L968-R972 WeakPolarHBondContact O-CB 3.12Å; L968-R972 VanDerWaalsContact O-CG 3.27Å; L968-R972 WeakPolarHBondContact O-CG 3.35Å; L968-R972 PolarHBondContact O-N 3.02Å
969	E	90.6	Very high	92.2	Very high	127 Å²	127	71 Å²	71	59%	0.593	35%	0.347	S	S	*	.	H	α-helix	trans	-69.4	-39.4	180	-158.4	60.6	-162.7	0	0	111.9	H967 R972 L973	H967-E969 VanDerWaalsContact C-N 3.29Å; H967-E969 PolarHBondContact O-N 2.94Å; E969-R972 PolarHBondContact O-N 2.96Å; E969-L973 PolarHBondContact O-N 3.05Å
970	K	91.8	Very high	92.1	Very high	92 Å²	92	69.3 Å²	69.3	40%	0.4	35%	0.348	S	S	.	.	H	α-helix	trans	-62.3	-49.9	175.3	-64.6	-175.6	174.6	-170.6	0	112.1	H967 R972 L973 E974	H967-K970 PolarHBondContact O-N 2.75Å; K970-R972 VanDerWaalsContact C-N 3.27Å; K970-R972 PolarHBondContact O-N 2.72Å; K970-L973 PolarHBondContact O-N 2.81Å; K970-E974 WeakPolarHBondContact O-CG 3.35Å; K970-E974 PolarHBondContact O-N 2.82Å
971	V	92.5	Very high	92	Very high	1 Å²	1	74.2 Å²	74.2	1%	0.006	37%	0.373	C	S	.	.	H	α-helix	trans	-63.8	-34.3	179	-175.7	0	0	0	0	111	L836 Q839 V840 H967 L975	L836-V971 HydrophobicContact CD1-CB 3.73Å; L836-V971 HydrophobicContact CD1-CG1 3.37Å; Q839-V971 HydrophobicContact CB-CG1 4.21Å; V840-V971 HydrophobicContact CG2-CB 4.24Å; V840-V971 HydrophobicContact CG2-CG2 3.94Å; H967-V971 WeakPolarHBondContact O-CG2 3.28Å; H967-V971 PolarHBondContact O-N 3.24Å; V971-L975 HydrophobicContact CG1-CD1 3.93Å; V971-L975 HydrophobicContact CG1-CG 4.22Å; V971-L975 WeakPolarHBondContact O-CB 3.48Å; V971-L975 VanDerWaalsContact O-CG 3.23Å; V971-L975 WeakPolarHBondContact O-CG 3.43Å; V971-L975 PolarHBondContact O-N 3.31Å
972	R	90	Very high	91.7	Very high	97 Å²	97	76.8 Å²	76.8	37%	0.366	38%	0.379	S	S	.	.	H	α-helix	trans	-65.7	-42.9	174.2	-78.7	174.4	175.9	168.2	0.5	112.7	D829 L836 L968 E969 K970 T976	D829-R972 IonicContact OD2-NH2 3.7Å; D829-R972 PolarHBondContact OD2-NH2 3.19Å; L836-R972 HydrophobicContact CD1-CG 4.35Å; L836-R972 HydrophobicContact CD2-CG 3.88Å; L968-R972 WeakPolarHBondContact O-CB 3.12Å; L968-R972 VanDerWaalsContact O-CG 3.27Å; L968-R972 WeakPolarHBondContact O-CG 3.35Å; L968-R972 PolarHBondContact O-N 3.02Å; E969-R972 PolarHBondContact O-N 2.96Å; K970-R972 VanDerWaalsContact C-N 3.27Å; K970-R972 PolarHBondContact O-N 2.72Å; R972-T976 WeakPolarHBondContact O-CB 3.42Å; R972-T976 PolarHBondContact O-N 3.29Å; R972-T976 PolarHBondContact O-OG1 3.44Å
973	L	90.7	Very high	91.4	Very high	100 Å²	100	76 Å²	76	52%	0.524	37%	0.372	S	S	.	.	H	α-helix	trans	-61.2	-52.6	175.2	-178.2	63.2	0	0	0	110.7	E969 K970 L975 T976 E977	E969-L973 PolarHBondContact O-N 3.05Å; K970-L973 PolarHBondContact O-N 2.81Å; L973-L975 PolarHBondContact O-N 2.89Å; L973-T976 CarbonylContact O-C 3.57Å; L973-T976 WeakPolarHBondContact O-CA 3.36Å; L973-T976 WeakPolarHBondContact O-CB 3.33Å; L973-T976 PolarHBondContact O-N 2.94Å; L973-E977 WeakPolarHBondContact O-CG 3.41Å; L973-E977 PolarHBondContact O-N 3.31Å
974	E	90.3	Very high	91.2	Very high	46 Å²	46	76.5 Å²	76.5	22%	0.215	38%	0.382	C	S	.	.	H	α-helix	trans	-59.6	-41.2	179.7	-68.2	163.8	-138.9	0	0	112.8	Y12 R843 K970 T976 E977 L978	Y12-E974 PolarHBondContact OH-OE2 2.84Å; R843-E974 IonicContact CZ-OE1 3.59Å; R843-E974 IonicContact CZ-OE2 2.69Å; R843-E974 VanDerWaalsContact NH1-CD 3.34Å; R843-E974 IonicContact NH1-OE1 2.59Å; R843-E974 PolarHBondContact NH1-OE1 2.92Å; R843-E974 IonicContact NH1-OE2 2.88Å; R843-E974 PolarHBondContact NH1-OE2 2.74Å; R843-E974 IonicContact NH2-OE1 2.67Å; R843-E974 IonicContact NH2-OE2 2.61Å; R843-E974 PolarHBondContact NH2-OE2 2.62Å; K970-E974 WeakPolarHBondContact O-CG 3.35Å; K970-E974 PolarHBondContact O-N 2.82Å; E974-T976 VanDerWaalsContact C-N 3.3Å; E974-T976 PolarHBondContact O-N 3.2Å; E974-E977 PolarHBondContact O-N 3.31Å; E974-L978 WeakPolarHBondContact O-CB 3.16Å; E974-L978 VanDerWaalsContact O-CG 3.26Å; E974-L978 WeakPolarHBondContact O-CG 3.28Å; E974-L978 PolarHBondContact O-N 3.03Å
975	L	86.9	Confident	90.8	Very high	53 Å²	53	81.4 Å²	81.4	28%	0.277	40%	0.404	S	S	.	.	H	α-helix	trans	-66.1	-32	173.9	-74.2	173.4	0	0	0	112.6	L836 V971 L973 E979	L836-L975 HydrophobicContact CD1-CD1 4.08Å; V971-L975 HydrophobicContact CG1-CD1 3.93Å; V971-L975 HydrophobicContact CG1-CG 4.22Å; V971-L975 WeakPolarHBondContact O-CB 3.48Å; V971-L975 VanDerWaalsContact O-CG 3.23Å; V971-L975 WeakPolarHBondContact O-CG 3.43Å; V971-L975 PolarHBondContact O-N 3.31Å; L973-L975 PolarHBondContact O-N 2.89Å; L975-E979 WeakPolarHBondContact O-CB 3.32Å; L975-E979 PolarHBondContact O-N 2.98Å
976	T	89.1	Confident	90.4	Very high	96 Å²	96	80.2 Å²	80.2	59%	0.589	39%	0.391	S	S	*	.	H	α-helix	trans	-72.2	-40.5	176.3	-55.2	0	0	0	0	110.9	R972 L973 E974 A980	R972-T976 WeakPolarHBondContact O-CB 3.42Å; R972-T976 PolarHBondContact O-N 3.29Å; R972-T976 PolarHBondContact O-OG1 3.44Å; L973-T976 CarbonylContact O-C 3.57Å; L973-T976 WeakPolarHBondContact O-CA 3.36Å; L973-T976 WeakPolarHBondContact O-CB 3.33Å; L973-T976 PolarHBondContact O-N 2.94Å; E974-T976 VanDerWaalsContact C-N 3.3Å; E974-T976 PolarHBondContact O-N 3.2Å; T976-A980 WeakPolarHBondContact O-CB 3.47Å; T976-A980 PolarHBondContact O-N 2.98Å
977	E	90.9	Very high	90.1	Very high	104 Å²	104	80.5 Å²	80.5	49%	0.486	39%	0.392	S	S	.	.	H	α-helix	trans	-64.1	-45.3	173.2	-70	174.4	-177.4	0	0	111.6	L973 E974 A980 I981	L973-E977 WeakPolarHBondContact O-CG 3.41Å; L973-E977 PolarHBondContact O-N 3.31Å; E974-E977 PolarHBondContact O-N 3.31Å; E977-A980 WeakPolarHBondContact O-CB 3.12Å; E977-A980 PolarHBondContact O-N 3.45Å; E977-I981 VanDerWaalsContact O-CG1 3.28Å; E977-I981 WeakPolarHBondContact O-CG1 3.29Å; E977-I981 PolarHBondContact O-N 2.86Å
978	L	87.4	Confident	89.5	Confident	62 Å²	62	85.5 Å²	85.5	33%	0.325	42%	0.416	S	S	.	.	H	α-helix	trans	-62.9	-41.8	177	-75.1	170	0	0	0	112.8	Y12 E974 I981 R982	Y12-L978 HydrophobicContact CE2-CD1 4.1Å; E974-L978 WeakPolarHBondContact O-CB 3.16Å; E974-L978 VanDerWaalsContact O-CG 3.26Å; E974-L978 WeakPolarHBondContact O-CG 3.28Å; E974-L978 PolarHBondContact O-N 3.03Å; L978-I981 PolarHBondContact O-N 3.41Å; L978-R982 WeakPolarHBondContact O-CB 3.31Å; L978-R982 PolarHBondContact O-N 2.89Å
979	E	87.8	Confident	88.9	Confident	71 Å²	71	90.8 Å²	90.8	33%	0.332	43%	0.433	S	S	.	.	H	α-helix	trans	-70.7	-33.9	174.5	-173.3	60.2	-147.5	0	0	111.2	L975 R982 Q983	L975-E979 WeakPolarHBondContact O-CB 3.32Å; L975-E979 PolarHBondContact O-N 2.98Å; E979-R982 WeakPolarHBondContact O-CB 3.38Å; E979-R982 PolarHBondContact O-N 2.83Å; E979-R982 IonicContact OE1-NH1 3.64Å; E979-R982 WeakPolarHBondContact OE2-CD 3.46Å; E979-R982 IonicContact OE2-CZ 2.67Å; E979-R982 IonicContact OE2-NE 3.49Å; E979-R982 IonicContact OE2-NH1 3.28Å; E979-R982 PolarHBondContact OE2-NH1 2.92Å; E979-Q983 HydrophobicContact CG-CG 4.36Å; E979-Q983 WeakPolarHBondContact O-CB 3.39Å; E979-Q983 WeakPolarHBondContact O-CG 3.32Å; E979-Q983 PolarHBondContact O-N 2.99Å; E979-Q983 PolarHBondContact OE1-NE2 2.9Å
980	A	90.4	Very high	88.3	Confident	55 Å²	55	90.2 Å²	90.2	46%	0.455	43%	0.43	S	S	.	.	H	α-helix	trans	-61.3	-45.9	172	0	0	0	0	0	112.1	T976 E977 R982 Q983 T984	T976-A980 WeakPolarHBondContact O-CB 3.47Å; T976-A980 PolarHBondContact O-N 2.98Å; E977-A980 WeakPolarHBondContact O-CB 3.12Å; E977-A980 PolarHBondContact O-N 3.45Å; A980-R982 VanDerWaalsContact C-N 3.31Å; A980-R982 PolarHBondContact O-N 2.88Å; A980-Q983 PolarHBondContact O-N 2.9Å; A980-T984 PolarHBondContact O-N 2.84Å; A980-T984 PolarHBondContact O-OG1 2.88Å
981	I	90.9	Very high	87.5	Confident	109 Å²	109	89.9 Å²	89.9	56%	0.559	44%	0.436	S	S	*	.	H	α-helix	trans	-61.4	-39.1	174.9	-68.5	162.4	0	0	0	111.2	E977 L978 T984 F985	E977-I981 VanDerWaalsContact O-CG1 3.28Å; E977-I981 WeakPolarHBondContact O-CG1 3.29Å; E977-I981 PolarHBondContact O-N 2.86Å; L978-I981 PolarHBondContact O-N 3.41Å; I981-T984 PolarHBondContact O-OG1 2.86Å; I981-F985 WeakPolarHBondContact O-CB 3.46Å; I981-F985 PolarHBondContact O-N 3.35Å
982	R	88.8	Confident	86.2	Confident	152 Å²	152	92.9 Å²	92.9	57%	0.574	46%	0.457	S	S	*	.	H	α-helix	trans	-64.7	-41.8	174.7	-171.6	-164.5	-173.4	-177	0.9	111.8	L978 E979 A980 F985 L986	L978-R982 WeakPolarHBondContact O-CB 3.31Å; L978-R982 PolarHBondContact O-N 2.89Å; E979-R982 WeakPolarHBondContact O-CB 3.38Å; E979-R982 PolarHBondContact O-N 2.83Å; E979-R982 IonicContact OE1-NH1 3.64Å; E979-R982 WeakPolarHBondContact OE2-CD 3.46Å; E979-R982 IonicContact OE2-CZ 2.67Å; E979-R982 IonicContact OE2-NE 3.49Å; E979-R982 IonicContact OE2-NH1 3.28Å; E979-R982 PolarHBondContact OE2-NH1 2.92Å; A980-R982 VanDerWaalsContact C-N 3.31Å; A980-R982 PolarHBondContact O-N 2.88Å; R982-F985 PolarHBondContact O-N 3.02Å; R982-L986 HydrophobicContact CG-CD1 4.4Å; R982-L986 WeakPolarHBondContact O-CG 3.43Å; R982-L986 PolarHBondContact O-N 2.93Å
983	Q	88.6	Confident	84.7	Confident	81 Å²	81	92.7 Å²	92.7	38%	0.379	46%	0.463	S	S	.	.	H	α-helix	trans	-71	-32.1	179.5	-69.2	-68.3	-29	0	0	112.4	E979 A980 K987	E979-Q983 HydrophobicContact CG-CG 4.36Å; E979-Q983 WeakPolarHBondContact O-CB 3.39Å; E979-Q983 WeakPolarHBondContact O-CG 3.32Å; E979-Q983 PolarHBondContact O-N 2.99Å; E979-Q983 PolarHBondContact OE1-NE2 2.9Å; A980-Q983 PolarHBondContact O-N 2.9Å; Q983-K987 WeakPolarHBondContact O-CD 3.38Å; Q983-K987 VanDerWaalsContact O-CG 3.28Å; Q983-K987 WeakPolarHBondContact O-CG 3.39Å; Q983-K987 PolarHBondContact O-N 2.87Å
984	T	90.6	Very high	83	Confident	73 Å²	73	92.2 Å²	92.2	45%	0.448	46%	0.461	S	S	.	.	H	α-helix	trans	-68.4	-46.3	169.3	53.5	0	0	0	0	111	A980 I981 L986 K987 E988	A980-T984 PolarHBondContact O-N 2.84Å; A980-T984 PolarHBondContact O-OG1 2.88Å; I981-T984 PolarHBondContact O-OG1 2.86Å; T984-L986 VanDerWaalsContact C-N 3.3Å; T984-L986 PolarHBondContact O-N 2.82Å; T984-K987 PolarHBondContact O-N 3.12Å; T984-K987 VanDerWaalsContact O-N 3.12Å; T984-E988 WeakPolarHBondContact O-CB 3.27Å; T984-E988 WeakPolarHBondContact O-CG 3.49Å; T984-E988 PolarHBondContact O-N 3.45Å
985	F	88.9	Confident	81.4	Confident	132 Å²	132	99.9 Å²	99.9	58%	0.579	49%	0.488	S	S	*	.	H	α-helix	trans	-59.8	-37.1	177.4	-176.4	-97.3	0	0	0	113.1	I981 R982 R989	I981-F985 WeakPolarHBondContact O-CB 3.46Å; I981-F985 PolarHBondContact O-N 3.35Å; R982-F985 PolarHBondContact O-N 3.02Å; F985-R989 WeakPolarHBondContact O-CB 3.18Å; F985-R989 PolarHBondContact O-N 2.77Å
986	L	87.1	Confident	79.6	Confident	60 Å²	60	107.3 Å²	107.3	31%	0.314	51%	0.512	S	S	.	.	H	α-helix	trans	-65	-45	173.9	-75.1	170.5	0	0	0	112	R982 T984 R989 E990	R982-L986 HydrophobicContact CG-CD1 4.4Å; R982-L986 WeakPolarHBondContact O-CG 3.43Å; R982-L986 PolarHBondContact O-N 2.93Å; T984-L986 VanDerWaalsContact C-N 3.3Å; T984-L986 PolarHBondContact O-N 2.82Å; L986-R989 WeakPolarHBondContact O-CB 3.47Å; L986-R989 PolarHBondContact O-N 3.48Å; L986-E990 WeakPolarHBondContact O-CG 3.45Å; L986-E990 PolarHBondContact O-N 3.07Å
987	K	86.9	Confident	77.6	Confident	125 Å²	125	106.4 Å²	106.4	54%	0.543	51%	0.51	S	S	.	.	H	α-helix	trans	-66.9	-37.9	177.1	-70.2	168.2	-175.5	176.2	0	113	Q983 T984 R989 E990 T991	Q983-K987 WeakPolarHBondContact O-CD 3.38Å; Q983-K987 VanDerWaalsContact O-CG 3.28Å; Q983-K987 WeakPolarHBondContact O-CG 3.39Å; Q983-K987 PolarHBondContact O-N 2.87Å; T984-K987 PolarHBondContact O-N 3.12Å; T984-K987 VanDerWaalsContact O-N 3.12Å; K987-R989 VanDerWaalsContact C-N 3.34Å; K987-E990 PolarHBondContact O-N 3.3Å; K987-T991 WeakPolarHBondContact O-CB 3.44Å; K987-T991 WeakPolarHBondContact O-CG2 3.08Å; K987-T991 PolarHBondContact O-N 2.87Å; K987-T991 PolarHBondContact O-OG1 3.42Å
988	E	84.4	Confident	75.7	Confident	120 Å²	120	110 Å²	110	56%	0.561	52%	0.524	S	S	*	.	H	α-helix	trans	-63	-42.4	172.7	-74.6	169.5	-170.5	0	0	110.6	T984 T991 S992	T984-E988 WeakPolarHBondContact O-CB 3.27Å; T984-E988 WeakPolarHBondContact O-CG 3.49Å; T984-E988 PolarHBondContact O-N 3.45Å; E988-T991 PolarHBondContact O-OG1 3.19Å; E988-S992 VanDerWaalsContact O-CB 3.24Å; E988-S992 WeakPolarHBondContact O-CB 3.46Å; E988-S992 PolarHBondContact O-N 3.23Å; E988-S992 PolarHBondContact O-OG 3.01Å
989	R	81.6	Confident	73.9	Confident	151 Å²	151	112.9 Å²	112.9	57%	0.57	54%	0.544	S	S	*	.	H	α-helix	trans	-63.1	-46.8	174.1	174.9	177.4	159.8	172.6	-5.7	112.2	F985 L986 K987 S992 L993	F985-R989 WeakPolarHBondContact O-CB 3.18Å; F985-R989 PolarHBondContact O-N 2.77Å; L986-R989 WeakPolarHBondContact O-CB 3.47Å; L986-R989 PolarHBondContact O-N 3.48Å; K987-R989 VanDerWaalsContact C-N 3.34Å; R989-S992 PolarHBondContact O-N 2.79Å; R989-S992 PolarHBondContact O-OG 3.28Å; R989-L993 HydrophobicContact CG-CD1 4.17Å; R989-L993 WeakPolarHBondContact O-CG 3.34Å; R989-L993 PolarHBondContact O-N 3.18Å
990	E	78.8	Confident	72	Confident	115 Å²	115	113.5 Å²	113.5	54%	0.537	56%	0.556	S	S	.	*	H	α-helix	trans	-61	-51.6	178.2	-73.4	167	175	0	0	111.1	L986 K987 S992 L993 D994	L986-E990 WeakPolarHBondContact O-CG 3.45Å; L986-E990 PolarHBondContact O-N 3.07Å; K987-E990 PolarHBondContact O-N 3.3Å; E990-S992 PolarHBondContact O-N 3.5Å; E990-L993 WeakPolarHBondContact O-CA 3.42Å; E990-L993 WeakPolarHBondContact O-CB 3.45Å; E990-L993 PolarHBondContact O-N 3.1Å; E990-D994 PolarHBondContact O-N 3.41Å
991	T	74.2	Confident	69.9	Low	84 Å²	84	118.1 Å²	118.1	52%	0.515	57%	0.573	S	S	.	*	H	α-helix	trans	-64.5	-25.3	176.2	54.2	0	0	0	0	113.5	K987 E988 R995	K987-T991 WeakPolarHBondContact O-CB 3.44Å; K987-T991 WeakPolarHBondContact O-CG2 3.08Å; K987-T991 PolarHBondContact O-N 2.87Å; K987-T991 PolarHBondContact O-OG1 3.42Å; E988-T991 PolarHBondContact O-OG1 3.19Å; T991-R995 WeakPolarHBondContact O-CB 3.31Å; T991-R995 PolarHBondContact O-N 3.03Å
992	S	65.1	Low	67.9	Low	64 Å²	64	120.6 Å²	120.6	45%	0.448	59%	0.588	S	S	.	*	H	α-helix	trans	-75.3	-25.6	171.4	79.1	0	0	0	0	113.8	E988 R989 E990 R996	E988-S992 VanDerWaalsContact O-CB 3.24Å; E988-S992 WeakPolarHBondContact O-CB 3.46Å; E988-S992 PolarHBondContact O-N 3.23Å; E988-S992 PolarHBondContact O-OG 3.01Å; R989-S992 PolarHBondContact O-N 2.79Å; R989-S992 PolarHBondContact O-OG 3.28Å; E990-S992 PolarHBondContact O-N 3.5Å; S992-R996 PolarHBondContact O-N 2.71Å
993	L	58.9	Low	66	Low	93 Å²	93	122.6 Å²	122.6	49%	0.487	60%	0.604	S	S	.	*	H	α-helix	trans	-78.1	-41.8	173.2	-72.1	163.4	0	0	0	110.7	R989 E990 R995 R996 S997	R989-L993 HydrophobicContact CG-CD1 4.17Å; R989-L993 WeakPolarHBondContact O-CG 3.34Å; R989-L993 PolarHBondContact O-N 3.18Å; E990-L993 WeakPolarHBondContact O-CA 3.42Å; E990-L993 WeakPolarHBondContact O-CB 3.45Å; E990-L993 PolarHBondContact O-N 3.1Å; L993-R995 PolarHBondContact O-N 2.89Å; L993-R996 CarbonylContact O-C 3.55Å; L993-R996 WeakPolarHBondContact O-CA 3.1Å; L993-R996 WeakPolarHBondContact O-CB 3.23Å; L993-R996 PolarHBondContact O-N 2.65Å; L993-S997 PolarHBondContact O-N 3.3Å; L993-S997 VanDerWaalsContact O-N 3.08Å
994	D	56.1	Low	63.8	Low	91 Å²	91	128.3 Å²	128.3	49%	0.487	63%	0.63	S	S	.	*	H	α-helix	trans	-63.6	-40.1	172.6	-70.4	-28.4	0	0	0	111.6	E990 R996 S997 F998	E990-D994 PolarHBondContact O-N 3.41Å; D994-R996 PolarHBondContact O-N 2.94Å; D994-S997 WeakPolarHBondContact CA-OG 3.46Å; D994-S997 PolarHBondContact O-N 3.26Å; D994-S997 PolarHBondContact O-OG 2.98Å; D994-F998 WeakPolarHBondContact O-CD2 3.46Å; D994-F998 PolarHBondContact O-N 3.33Å
995	R	55.1	Low	61.6	Low	206 Å²	206	132.2 Å²	132.2	78%	0.777	65%	0.648	S	S	*	*	H	α-helix	trans	-61.7	-11.5	169.5	-90.3	-172.4	166.9	-171.2	-3.1	114.7	T991 L993 V999	T991-R995 WeakPolarHBondContact O-CB 3.31Å; T991-R995 PolarHBondContact O-N 3.03Å; L993-R995 PolarHBondContact O-N 2.89Å; R995-V999 WeakPolarHBondContact O-CG2 3.49Å
996	R	51	Low	59.1	Low	209 Å²	209	137.7 Å²	137.7	79%	0.789	68%	0.683	S	S	*	*	H	α-helix	trans	-99.8	-18.8	172.3	-102.5	-178.1	172.8	173.7	-1.4	113.9	S992 L993 D994	S992-R996 PolarHBondContact O-N 2.71Å; L993-R996 CarbonylContact O-C 3.55Å; L993-R996 WeakPolarHBondContact O-CA 3.1Å; L993-R996 WeakPolarHBondContact O-CB 3.23Å; L993-R996 PolarHBondContact O-N 2.65Å; D994-R996 PolarHBondContact O-N 2.94Å
997	S	47.1	Very low	57.7	Low	77 Å²	77	141.6 Å²	141.6	54%	0.538	70%	0.702	S	S	.	*	H	α-helix	trans	-86.6	-26.4	170.3	58.9	0	0	0	0	112.4	L993 D994 V999	L993-S997 PolarHBondContact O-N 3.3Å; L993-S997 VanDerWaalsContact O-N 3.08Å; D994-S997 WeakPolarHBondContact CA-OG 3.46Å; D994-S997 PolarHBondContact O-N 3.26Å; D994-S997 PolarHBondContact O-OG 2.98Å; S997-V999 VanDerWaalsContact C-N 3.26Å; S997-V999 PolarHBondContact O-N 3.4Å
998	F	50.1	Low	56.1	Low	180 Å²	180	142.4 Å²	142.4	79%	0.789	71%	0.71	S	S	*	*	S	Bend	trans	-83	13.7	171.6	-79.7	-75.6	0	0	0	114.7	D994	D994-F998 WeakPolarHBondContact O-CD2 3.46Å; D994-F998 PolarHBondContact O-N 3.33Å
999	V	50.1	Low	54.6	Low	122 Å²	122	143.7 Å²	143.7	74%	0.739	72%	0.719	S	S	*	*			trans	-117.8	84.5	168.7	179.8	0	0	0	0	107.9	R995 S997	R995-V999 WeakPolarHBondContact O-CG2 3.49Å; S997-V999 VanDerWaalsContact C-N 3.26Å; S997-V999 PolarHBondContact O-N 3.4Å
1000	S	47.6	Very low	53	Low	84 Å²	84	143.2 Å²	143.2	59%	0.587	73%	0.727	S	S	*	*			trans	-140.7	131.2	174.3	-152.7	0	0	0	0	108.5
1001	D	47	Very low	51.4	Low	152 Å²	152	145 Å²	145	81%	0.813	74%	0.739	S	S	*	*	S	Bend	trans	53.6	60.1	156.3	-44.9	-35.3	0	0	0	119
1002	D	49.2	Very low	49.8	Very low	162 Å²	162	149.1 Å²	149.1	87%	0.866	75%	0.754	S	S	*	*	S	Bend	trans	-145.6	7.5	167	-110.3	-27.7	0	0	0	115.9
1003	E	48.4	Very low	48.8	Very low	194 Å²	194	155.1 Å²	155.1	91%	0.907	78%	0.776	S	S	*	*	S	Bend	trans	-137.5	56.1	173	-75.6	-162.4	173.1	0	0	113.7
1004	E	42.5	Very low	48	Very low	201 Å²	201	159.9 Å²	159.9	94%	0.939	80%	0.798	S	S	*	*	S	Bend	trans	-132	52.4	157.9	-80.4	-154.5	146.6	0	0	111.6
1005	D	43.3	Very low	47.3	Very low	155 Å²	155	165.7 Å²	165.7	83%	0.829	82%	0.824	S	S	*	*			trans	-157.5	65.7	166.8	-131.5	-7.8	0	0	0	114
1006	N	36.4	Very low	46.6	Very low	246 Å²	246	162 Å²	162	100%	1.316	83%	0.828	S	S	*	*			trans	-168.2	0	154.4	-106.9	-84.8	0	0	0	112.5

Retrieved 1,006 of 1,006 residues in 2266.6 ms (Link to these results)

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