PDE4D_HUMAN Loading...

3',5'-cyclic-AMP phosphodiesterase 4D

Hydrolyzes the second messenger cAMP, which is a key regulator of many important physiological processes.

AlphaFold DB , UniProt , Accession Q08499, Species HUMAN (Homo sapiens, Human), Gene PDE4D, Length 809 aa.

						>PDE4D_HUMAN|Q08499|PDE4D
MEAEGSSAPARAGSGEGSDSAGGATLKAPKHLWRHEQHHQYPLRQPQFRLLHPHHHLPPPPPPSPQPQPQCPLQPPPPPPLPPPPPPPGAARGRYASSGATGRVRHRGYSDTERYLYCRAMDRTSYAVETGHRPGLKKSRMSWPSSFQGLRRFDVDNGTSAGRSPLDPMTSPGSGLILQANFVHSQRRESFLYRSDSDYDLSPKSMSRNSSIASDIHGDDLIVTPFAQVLASLRTVRNNFAALTNLQDRAPSKRSPMCNQPSINKATITEEAYQKLASETLEELDWCLDQLETLQTRHSVSEMASNKFKRMLNRELTHLSEMSRSGNQVSEFISNTFLDKQHEVEIPSPTQKEKEKKKRPMSQISGVKKLMHSSSLTNSSIPRFGVKTEQEDVLAKELEDVNKWGLHVFRIAELSGNRPLTVIMHTIFQERDLLKTFKIPVDTLITYLMTLEDHYHADVAYHNNIHAADVVQSTHVLLSTPALEAVFTDLEILAAIFASAIHDVDHPGVSNQFLINTNSELALMYNDSSVLENHHLAVGFKLLQEENCDIFQNLTKKQRQSLRKMVIDIVLATDMSKHMNLLADLKTMVETKKVTSSGVLLLDNYSDRIQVLQNMVHCADLSNPTKPLQLYRQWTDRIMEEFFRQGDRERERGMEISPMCDKHNASVEKSQVGFIDYIVHPLWETWADLVHPDAQDILDTLEDNREWYQSTIPQSPSPAPDDPEEGRQGQTEKFQFELTLEEDGESDTEKDSGSQVEEDTSCSDSKTLCTQDSESTEIPLDEQVEEEAVGEEEESQPEACVIDDRSPDT
					

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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	35.9	Very low	38.5	Very low	212 Å²	212	146 Å²	146	100%	1.044	88%	0.882	S	S	*	*				0	60.2	0	-57.1	177.6	-172.1	0	0	107.7
2	E	36	Very low	38.4	Very low	187 Å²	187	142.3 Å²	142.3	87%	0.874	88%	0.879	S	S	*	*				71.1	132.6	55.1	-69.4	145.6	-126.9	0	0	112.5
3	A	35.4	Very low	38.4	Very low	98 Å²	98	137.6 Å²	137.6	81%	0.81	88%	0.875	S	S	*	*			cis	-154.1	167	-9.7	0	0	0	0	0	110.9
4	E	35.3	Very low	38.3	Very low	200 Å²	200	137 Å²	137	94%	0.935	88%	0.877	S	S	*	*			trans	-76.2	156.2	176.2	-59	178.9	126	0	0	112.3
5	G	44.5	Very low	38.3	Very low	84 Å²	84	133.2 Å²	133.2	87%	0.866	87%	0.874	S	S	*	*			trans	-152.6	111.2	170.8	0	0	0	0	0	110.8
6	S	35.7	Very low	38.1	Very low	126 Å²	126	137.7 Å²	137.7	88%	0.881	88%	0.879	S	S	*	*			trans	-128.3	138.4	-175.9	178.4	0	0	0	0	111.1
7	S	44	Very low	38.1	Very low	122 Å²	122	134.2 Å²	134.2	85%	0.853	88%	0.875	S	S	*	*			trans	-155.7	156.4	162.7	63.3	0	0	0	0	110.8
8	A	37.4	Very low	38	Very low	92 Å²	92	133.3 Å²	133.3	76%	0.76	87%	0.872	S	S	*	*			trans	-123.8	162.6	-169.6	0	0	0	0	0	111.4
9	P	42.3	Very low	38	Very low	133 Å²	133	135.3 Å²	135.3	86%	0.864	87%	0.874	S	S	*	*			trans	-84.1	164.4	-163.6	33.5	-36.7	0	0	0	115.3
10	A	41	Very low	37.9	Very low	108 Å²	108	134.5 Å²	134.5	89%	0.893	87%	0.872	S	S	*	*			trans	-105.7	169.7	175.4	0	0	0	0	0	112.7
11	R	35.7	Very low	38.1	Very low	244 Å²	244	132.7 Å²	132.7	92%	0.921	87%	0.869	S	S	*	*			trans	-112.8	158.5	-161.1	-161.8	175.1	-178.4	-171	1.2	113.2
12	A	37.5	Very low	38	Very low	102 Å²	102	126.7 Å²	126.7	84%	0.843	86%	0.861	S	S	*	*			trans	-52.8	156.3	-170.6	0	0	0	0	0	117.6
13	G	38	Very low	37.8	Very low	81 Å²	81	121 Å²	121	84%	0.835	85%	0.853	S	S	*	*			trans	-130.6	144.1	156.1	0	0	0	0	0	109.7
14	S	38	Very low	37.9	Very low	129 Å²	129	121.2 Å²	121.2	90%	0.902	85%	0.854	S	S	*	*			trans	-106.3	145.6	-175.6	51	0	0	0	0	112
15	G	37.9	Very low	37.9	Very low	80 Å²	80	117.7 Å²	117.7	83%	0.825	85%	0.847	S	S	*	*			trans	-155.9	130.9	169.7	0	0	0	0	0	110.3
16	E	34.8	Very low	37.5	Very low	205 Å²	205	120.3 Å²	120.3	96%	0.958	84%	0.84	S	S	*	*			trans	-86.6	150.6	179.2	-65	169.4	113.2	0	0	110.8
17	G	37.5	Very low	37.4	Very low	78 Å²	78	123.8 Å²	123.8	80%	0.804	84%	0.839	S	S	*	*			trans	-167.3	97.6	178.9	0	0	0	0	0	110
18	S	36.9	Very low	37	Very low	118 Å²	118	121 Å²	121	83%	0.825	82%	0.824	S	S	*	*			trans	-82.8	131.7	178.2	55.5	0	0	0	0	111
19	D	38.8	Very low	37	Very low	171 Å²	171	122.3 Å²	122.3	91%	0.914	83%	0.825	S	S	*	*			trans	-147.8	156.7	158.7	-125.5	-35.9	0	0	0	111.9
20	S	36.3	Very low	36.4	Very low	119 Å²	119	125.3 Å²	125.3	83%	0.832	82%	0.824	S	S	*	*			trans	-113.9	120.2	-160.5	-175.7	0	0	0	0	113.8
21	A	41	Very low	36.2	Very low	98 Å²	98	129 Å²	129	81%	0.81	82%	0.823	S	S	*	*			trans	-145.4	134.2	165.1	0	0	0	0	0	110
22	G	34	Very low	36	Very low	85 Å²	85	124.7 Å²	124.7	88%	0.876	82%	0.817	S	S	*	*			trans	-79.8	130.6	-169.7	0	0	0	0	0	114.3
23	G	32.1	Very low	35.6	Very low	69 Å²	69	131.8 Å²	131.8	71%	0.711	82%	0.822	S	S	*	*			trans	-86.5	126.1	170.4	0	0	0	0	0	112.5	T25	G23-T25 PolarHBondContact O-N 3.08Å
24	A	36.2	Very low	35.3	Very low	101 Å²	101	139.3 Å²	139.3	84%	0.835	83%	0.825	S	S	*	*			trans	-87.1	78.5	173.9	0	0	0	0	0	111.1	L26	A24-L26 PolarHBondContact O-N 3.27Å
25	T	36.4	Very low	34.9	Very low	127 Å²	127	139.9 Å²	139.9	78%	0.779	81%	0.813	S	S	*	*			trans	-75.1	90.4	-176.1	-44.5	0	0	0	0	112.2	G23 K27	G23-T25 PolarHBondContact O-N 3.08Å; T25-K27 PolarHBondContact O-N 2.98Å; T25-K27 VanDerWaalsContact O-N 3.1Å
26	L	36	Very low	34.6	Very low	139 Å²	139	144.4 Å²	144.4	73%	0.728	81%	0.813	S	S	*	*			trans	-64.3	106.8	172.1	-84.2	167.8	0	0	0	111	A24 A28	A24-L26 PolarHBondContact O-N 3.27Å; L26-A28 PolarHBondContact O-N 3.13Å; L26-A28 VanDerWaalsContact O-N 3.14Å
27	K	33.3	Very low	34.4	Very low	198 Å²	198	140.8 Å²	140.8	86%	0.861	80%	0.796	S	S	*	*			trans	-73.1	99.7	172.8	-76.4	-176	174.5	-177.6	0	110.4	T25	T25-K27 PolarHBondContact O-N 2.98Å; T25-K27 VanDerWaalsContact O-N 3.1Å
28	A	35.9	Very low	34.4	Very low	63 Å²	63	146 Å²	146	52%	0.521	80%	0.799	S	S	.	*			trans	-62.9	134.6	171.3	0	0	0	0	0	111.6	L26 K30	L26-A28 PolarHBondContact O-N 3.13Å; L26-A28 VanDerWaalsContact O-N 3.14Å; A28-K30 PolarHBondContact O-N 3.44Å
29	P	36.7	Very low	34.2	Very low	120 Å²	120	147.5 Å²	147.5	78%	0.779	79%	0.793	S	S	*	*			trans	-75.7	117.1	177.8	29.7	-33.1	0	0	0	111	H31	P29-H31 PolarHBondContact O-N 3.14Å; P29-H31 VanDerWaalsContact O-N 3.12Å
30	K	31.6	Very low	33.9	Very low	197 Å²	197	144.9 Å²	144.9	86%	0.857	78%	0.775	S	S	*	*			trans	-64.8	108.5	166.4	-65.7	177.5	179.9	177.1	0	108.9	A28	A28-K30 PolarHBondContact O-N 3.44Å
31	H	35.3	Very low	33.8	Very low	186 Å²	186	148.8 Å²	148.8	86%	0.861	77%	0.773	S	S	*	*			trans	159	89.3	148.5	-84	-54.5	0	0	0	111.7	P29	P29-H31 PolarHBondContact O-N 3.14Å; P29-H31 VanDerWaalsContact O-N 3.12Å
32	L	30.9	Very low	33.4	Very low	152 Å²	152	149 Å²	149	80%	0.796	77%	0.766	S	S	*	*	S	Bend	trans	-163.9	32.5	155.5	-116.8	160.9	0	0	0	117.3
33	W	30.7	Very low	33.2	Very low	252 Å²	252	153.6 Å²	153.6	96%	0.955	77%	0.77	S	S	*	*			trans	-139.1	114.4	156.7	-84.3	103.7	0	0	0	108.8
34	R	31	Very low	33.2	Very low	238 Å²	238	161.2 Å²	161.2	90%	0.898	78%	0.777	S	S	*	*			trans	-126.5	97	-174.7	-164.6	-174.9	-155.5	-144	7.7	111
35	H	30.7	Very low	32.9	Very low	141 Å²	141	164 Å²	164	65%	0.653	77%	0.773	S	S	*	*			trans	49.2	97	171.3	-74.3	-58.7	0	0	0	116.6	Q37	H35-Q37 HydrophobicContact CB-CG 4.41Å
36	E	30.1	Very low	32.8	Very low	175 Å²	175	163.2 Å²	163.2	82%	0.818	77%	0.77	S	S	*	*				-88.9	121.2	119	-70.7	-158.7	95	0	0	108.1
37	Q	32	Very low	32.6	Very low	129 Å²	129	164 Å²	164	60%	0.603	77%	0.77	S	S	*	*			trans	-87.3	141.2	163.5	-66.6	-171.2	4.4	0	0	107.6	H35 H39	H35-Q37 HydrophobicContact CB-CG 4.41Å; Q37-H39 PolarHBondContact O-N 3.3Å
38	H	35.7	Very low	32.5	Very low	188 Å²	188	163.8 Å²	163.8	87%	0.87	77%	0.769	S	S	*	*			trans	-57.2	100.2	166.3	-75.3	-67.9	0	0	0	109.7	Q40	H38-Q40 PolarHBondContact O-N 3.14Å
39	H	32.8	Very low	32.3	Very low	150 Å²	150	171 Å²	171	69%	0.694	78%	0.783	S	S	*	*			trans	-71.7	78.4	161.6	-88.8	-14	0	0	0	108.5	Q37 Y41	Q37-H39 PolarHBondContact O-N 3.3Å; H39-Y41 HydrophobicContact CB-CE2 4.31Å; H39-Y41 WeakPolarHBondContact O-CD2 3.34Å; H39-Y41 PolarHBondContact O-N 3.38Å
40	Q	33.2	Very low	32	Very low	116 Å²	116	172.5 Å²	172.5	54%	0.542	78%	0.784	S	S	.	*			trans	-67.7	79.9	172.5	-167.2	174.5	57	0	0	108.4	H38 P42 H298	H38-Q40 PolarHBondContact O-N 3.14Å; Q40-P42 VanDerWaalsContact O-CD 3.25Å; Q40-P42 WeakPolarHBondContact O-CD 3.39Å; Q40-P42 VanDerWaalsContact O-N 3.08Å; Q40-H298 PolarHBondContact NE2-NE2 2.79Å
41	Y	35	Very low	32.1	Very low	200 Å²	200	170.5 Å²	170.5	78%	0.784	78%	0.781	S	S	*	*			trans	-51.9	113.2	-176.7	-85	-91	0	0	0	110.6	H39 L43	H39-Y41 HydrophobicContact CB-CE2 4.31Å; H39-Y41 WeakPolarHBondContact O-CD2 3.34Å; H39-Y41 PolarHBondContact O-N 3.38Å; Y41-L43 PolarHBondContact O-N 3.14Å
42	P	32	Very low	31.9	Very low	104 Å²	104	169.1 Å²	169.1	68%	0.675	78%	0.775	S	S	*	*			trans	-69.9	127.1	173.7	28.6	-32.3	0	0	0	108.3	Q40 R44	Q40-P42 VanDerWaalsContact O-CD 3.25Å; Q40-P42 WeakPolarHBondContact O-CD 3.39Å; Q40-P42 VanDerWaalsContact O-N 3.08Å; P42-R44 PolarHBondContact O-N 3.28Å
43	L	30.7	Very low	32.4	Very low	181 Å²	181	167.5 Å²	167.5	95%	0.948	77%	0.774	S	S	*	*			trans	-64	75	177	-79.3	167.2	0	0	0	111.9	Y41 Q45	Y41-L43 PolarHBondContact O-N 3.14Å; L43-Q45 PolarHBondContact O-N 3.37Å
44	R	31.2	Very low	32.5	Very low	228 Å²	228	162.8 Å²	162.8	86%	0.86	76%	0.762	S	S	*	*			trans	-74.5	106.9	169.3	-84.2	-166.6	169.7	-160.9	-0.5	109.3	P42	P42-R44 PolarHBondContact O-N 3.28Å
45	Q	30.2	Very low	33.1	Very low	160 Å²	160	160.2 Å²	160.2	75%	0.748	76%	0.76	S	S	*	*			trans	-49.6	131.7	161.7	-64.6	177.8	-8	0	0	109.7	L43 Q47	L43-Q45 PolarHBondContact O-N 3.37Å; Q45-Q47 VanDerWaalsContact C-N 3.27Å; Q45-Q47 PolarHBondContact O-N 3.37Å
46	P	34.5	Very low	33.4	Very low	111 Å²	111	161.9 Å²	161.9	72%	0.721	77%	0.768	S	S	*	*			trans	-74.7	78.7	177.3	30.2	-34.7	0	0	0	110.8	F48	P46-F48 PolarHBondContact O-N 2.84Å
47	Q	32.2	Very low	34.1	Very low	154 Å²	154	161.4 Å²	161.4	72%	0.72	77%	0.77	S	S	*	*			trans	-67.5	96	162.9	-75.8	-163.6	4.1	0	0	109.1	Q45 R49	Q45-Q47 VanDerWaalsContact C-N 3.27Å; Q45-Q47 PolarHBondContact O-N 3.37Å; Q47-R49 PolarHBondContact O-N 3.42Å
48	F	29.6	Very low	34.9	Very low	195 Å²	195	160.6 Å²	160.6	86%	0.855	78%	0.775	S	S	*	*			trans	-60.1	92.9	170	-90.4	-96	0	0	0	110.8	P46	P46-F48 PolarHBondContact O-N 2.84Å
49	R	31.8	Very low	36	Very low	214 Å²	214	157.1 Å²	157.1	81%	0.808	77%	0.77	S	S	*	*			trans	-100.2	107	161.8	-91.2	-169.8	172.8	-169.5	-0.6	109.8	Q47 L51	Q47-R49 PolarHBondContact O-N 3.42Å; R49-L51 PolarHBondContact O-N 3.44Å
50	L	30.9	Very low	37	Very low	151 Å²	151	155.6 Å²	155.6	79%	0.791	77%	0.773	S	S	*	*			trans	-61	116.5	168.2	-76	158	0	0	0	110.1
51	L	34.6	Very low	38.1	Very low	155 Å²	155	155.5 Å²	155.5	81%	0.812	78%	0.783	S	S	*	*			trans	-130.7	119.1	163.3	-72	175.8	0	0	0	108	R49	R49-L51 PolarHBondContact O-N 3.44Å
52	H	30.8	Very low	39.2	Very low	158 Å²	158	151.4 Å²	151.4	73%	0.731	78%	0.781	S	S	*	*			trans	-87.1	134.9	176.3	-75.3	45.7	0	0	0	110.5
53	P	40.3	Very low	40.5	Very low	117 Å²	117	152.5 Å²	152.5	76%	0.76	79%	0.788	S	S	*	*			trans	-104.4	126	146.9	-1.5	22.1	0	0	0	109.6	H55	P53-H55 PolarHBondContact O-N 3.3Å
54	H	33.9	Very low	41.7	Very low	153 Å²	153	149 Å²	149	71%	0.708	78%	0.778	S	S	*	*			trans	-76.5	106.2	173.1	-86.6	-98.2	0	0	0	111
55	H	42.6	Very low	42.4	Very low	185 Å²	185	144.3 Å²	144.3	86%	0.856	78%	0.777	S	S	*	*			trans	-136.2	128	154.3	-86.3	-75.9	0	0	0	110.4	P53	P53-H55 PolarHBondContact O-N 3.3Å
56	H	36.6	Very low	43.3	Very low	176 Å²	176	145.4 Å²	145.4	82%	0.815	78%	0.782	S	S	*	*			trans	-84.2	120.2	-175.9	-72.5	-89.2	0	0	0	111.2
57	L	46.3	Very low	43.6	Very low	164 Å²	164	145.7 Å²	145.7	86%	0.859	79%	0.785	S	S	*	*			trans	-114.4	143.6	158.4	-75.9	168.5	0	0	0	108.8
58	P	48.7	Very low	43.8	Very low	112 Å²	112	147.3 Å²	147.3	73%	0.727	79%	0.792	S	S	*	*	P	Polyproline II helix	trans	-73.6	151.7	-175.8	30.6	-35.2	0	0	0	111.9
59	P	58.5	Low	44.5	Very low	115 Å²	115	143.6 Å²	143.6	75%	0.747	79%	0.788	S	S	*	*	P	Polyproline II helix	trans	-68.3	150.4	175	30.1	-35.2	0	0	0	111.5
60	P	54.4	Low	44.9	Very low	118 Å²	118	142.4 Å²	142.4	77%	0.766	79%	0.791	S	S	*	*	P	Polyproline II helix	trans	-65	152.8	174.5	28.5	-35.1	0	0	0	111.6
61	P	55.1	Low	45.1	Very low	115 Å²	115	141.1 Å²	141.1	75%	0.747	79%	0.793	S	S	*	*	P	Polyproline II helix	trans	-67.6	152.4	-179.3	29.1	-35.5	0	0	0	112.2
62	P	59.2	Low	45.6	Very low	114 Å²	114	139.5 Å²	139.5	74%	0.74	79%	0.792	S	S	*	*	P	Polyproline II helix	trans	-66.8	147.9	176	29.3	-35.1	0	0	0	111.4	S64	P62-S64 PolarHBondContact O-N 2.7Å
63	P	59.3	Low	46.2	Very low	127 Å²	127	140.4 Å²	140.4	83%	0.825	80%	0.801	S	S	*	*	P	Polyproline II helix	trans	-63.6	135.3	179.3	26.6	-34.5	0	0	0	111.3
64	S	55	Low	46.4	Very low	106 Å²	106	143.6 Å²	143.6	74%	0.741	81%	0.806	S	S	*	*	P	Polyproline II helix	trans	-66.6	144.8	-179.4	-47.9	0	0	0	0	112	P62 Q66	P62-S64 PolarHBondContact O-N 2.7Å; S64-Q66 PolarHBondContact O-N 2.69Å; S64-Q66 VanDerWaalsContact O-N 3.16Å
65	P	45.9	Very low	47.1	Very low	131 Å²	131	141.3 Å²	141.3	85%	0.851	81%	0.805	S	S	*	*			trans	-70.9	111	-179.5	28.6	-34	0	0	0	111
66	Q	49.2	Very low	47.8	Very low	182 Å²	182	138.1 Å²	138.1	85%	0.85	80%	0.8	S	S	*	*	P	Polyproline II helix	trans	-71.6	146.4	169.8	-78.3	-166.4	-18.9	0	0	111.4	S64	S64-Q66 PolarHBondContact O-N 2.69Å; S64-Q66 VanDerWaalsContact O-N 3.16Å
67	P	40.9	Very low	48.6	Very low	118 Å²	118	135.2 Å²	135.2	77%	0.766	80%	0.797	S	S	*	*	P	Polyproline II helix	trans	-70.6	149.2	-178.1	29.8	-35.6	0	0	0	112.3	P69	P67-P69 WeakPolarHBondContact O-CD 3.31Å
68	Q	36.2	Very low	48.9	Very low	187 Å²	187	133 Å²	133	87%	0.874	79%	0.792	S	S	*	*	P	Polyproline II helix	trans	-68.3	125.9	179.5	-68.2	-178.3	-17.5	0	0	111.9
69	P	44.9	Very low	49.5	Very low	118 Å²	118	132.9 Å²	132.9	77%	0.766	79%	0.792	S	S	*	*	P	Polyproline II helix	trans	-72.3	139.6	161.6	31	-32.5	0	0	0	109.9	P67	P67-P69 WeakPolarHBondContact O-CD 3.31Å
70	Q	40	Very low	49.5	Very low	189 Å²	189	133.5 Å²	133.5	88%	0.883	80%	0.796	S	S	*	*	P	Polyproline II helix	trans	-71.5	140.7	-178.3	-64.7	176.3	-3.9	0	0	111.5	P72	Q70-P72 VanDerWaalsContact O-CD 3.32Å; Q70-P72 WeakPolarHBondContact O-CD 3.46Å
71	C	35.3	Very low	49.7	Very low	124 Å²	124	135.7 Å²	135.7	84%	0.838	80%	0.8	S	S	*	*	P	Polyproline II helix	trans	-68.9	123	-175.8	-58.8	0	0	0	0	113.2
72	P	45.3	Very low	50	Low	120 Å²	120	135.3 Å²	135.3	78%	0.779	80%	0.798	S	S	*	*	P	Polyproline II helix	trans	-70.8	148.3	156.1	-9.6	27.8	0	0	0	109.7	Q70	Q70-P72 VanDerWaalsContact O-CD 3.32Å; Q70-P72 WeakPolarHBondContact O-CD 3.46Å
73	L	43.1	Very low	50.1	Low	177 Å²	177	135.4 Å²	135.4	93%	0.927	80%	0.799	S	S	*	*	P	Polyproline II helix	trans	-66.3	133.7	-179	-72	162.7	0	0	0	111.8
74	Q	45.1	Very low	49.8	Very low	185 Å²	185	134.9 Å²	134.9	86%	0.864	80%	0.795	S	S	*	*	P	Polyproline II helix	trans	-77.6	126.2	-179.1	-167.8	173.8	29.9	0	0	110.6
75	P	48.4	Very low	49.9	Very low	105 Å²	105	135.5 Å²	135.5	68%	0.682	80%	0.796	S	S	*	*	P	Polyproline II helix	trans	-70.3	151.5	176.6	29.2	-34.6	0	0	0	111.4
76	P	55.4	Low	50.3	Low	117 Å²	117	134.7 Å²	134.7	76%	0.76	79%	0.791	S	S	*	*	P	Polyproline II helix	trans	-67	154.3	179.4	29	-35.5	0	0	0	112
77	P	55.2	Low	50.4	Low	116 Å²	116	131.6 Å²	131.6	75%	0.753	79%	0.787	S	S	*	*	P	Polyproline II helix	trans	-65.9	147.7	177	28.8	-35.2	0	0	0	111.5
78	P	52.6	Low	51	Low	116 Å²	116	132.4 Å²	132.4	75%	0.753	79%	0.792	S	S	*	*	P	Polyproline II helix	trans	-66.1	151.9	175.7	28.9	-35.1	0	0	0	111.5
79	P	60.8	Low	51.2	Low	111 Å²	111	127 Å²	127	72%	0.721	79%	0.787	S	S	*	*	P	Polyproline II helix	trans	-64.8	156.1	175.8	29	-35.5	0	0	0	111.6	L81	P79-L81 PolarHBondContact O-N 3.46Å
80	P	58.3	Low	50.6	Low	127 Å²	127	126.3 Å²	126.3	83%	0.825	79%	0.791	S	S	*	*	P	Polyproline II helix	trans	-63.5	136	177.7	27.3	-34.6	0	0	0	111.1
81	L	59.4	Low	50.6	Low	165 Å²	165	122.3 Å²	122.3	86%	0.864	79%	0.79	S	S	*	*	P	Polyproline II helix	trans	-65.5	144.5	172.8	-72.4	167.6	0	0	0	110.6	P79	P79-L81 PolarHBondContact O-N 3.46Å
82	P	60.3	Low	50.6	Low	107 Å²	107	128.2 Å²	128.2	70%	0.695	80%	0.795	S	S	*	*	P	Polyproline II helix	trans	-65.3	152.5	173.8	29.3	-35.1	0	0	0	111
83	P	60.4	Low	50.2	Low	116 Å²	116	125.8 Å²	125.8	75%	0.753	79%	0.791	S	S	*	*	P	Polyproline II helix	trans	-64.5	149.9	176.3	28.5	-35.1	0	0	0	111.3
84	P	54	Low	49.8	Very low	116 Å²	116	127 Å²	127	75%	0.753	78%	0.784	S	S	*	*	P	Polyproline II helix	trans	-64.6	150.8	176.4	28.5	-35.2	0	0	0	111.3
85	P	56.3	Low	49.4	Very low	118 Å²	118	128.1 Å²	128.1	77%	0.766	78%	0.781	S	S	*	*	P	Polyproline II helix	trans	-64.5	147.8	176	28.4	-34.9	0	0	0	111.1
86	P	55.9	Low	48.9	Very low	115 Å²	115	127.9 Å²	127.9	75%	0.747	79%	0.788	S	S	*	*	P	Polyproline II helix	trans	-66.5	150.8	177	29.1	-35.1	0	0	0	111.4
87	P	51.4	Low	47.8	Very low	116 Å²	116	127.7 Å²	127.7	75%	0.753	79%	0.79	S	S	*	*	P	Polyproline II helix	trans	-64.3	147.8	177.3	27.8	-35	0	0	0	111.3	G89	P87-G89 PolarHBondContact O-N 2.97Å; P87-G89 VanDerWaalsContact O-N 3.14Å
88	P	52.5	Low	46.9	Very low	136 Å²	136	128.2 Å²	128.2	88%	0.883	80%	0.796	S	S	*	*	P	Polyproline II helix	trans	-57.7	118	178	-25.2	34.9	0	0	0	112.2
89	G	39.9	Very low	45.9	Very low	74 Å²	74	126.3 Å²	126.3	76%	0.763	80%	0.798	S	S	*	*	P	Polyproline II helix	trans	-66.8	133.7	-178.6	0	0	0	0	0	112.6	P87 A91	P87-G89 PolarHBondContact O-N 2.97Å; P87-G89 VanDerWaalsContact O-N 3.14Å; G89-A91 PolarHBondContact O-N 3.28Å; G89-A91 VanDerWaalsContact O-N 3.13Å
90	A	33.9	Very low	44.7	Very low	103 Å²	103	126 Å²	126	85%	0.851	80%	0.804	S	S	*	*			trans	-67.4	108.2	-176.9	0	0	0	0	0	112.8
91	A	39.7	Very low	43.4	Very low	105 Å²	105	127 Å²	127	87%	0.868	81%	0.809	S	S	*	*			trans	-80.4	131	169.8	0	0	0	0	0	111.1	G89	G89-A91 PolarHBondContact O-N 3.28Å; G89-A91 VanDerWaalsContact O-N 3.13Å
92	R	35.3	Very low	42.2	Very low	248 Å²	248	122.8 Å²	122.8	94%	0.936	81%	0.805	S	S	*	*			trans	-91.4	133.6	-177.2	-74.8	172.1	159.7	179.1	-5.2	112.8
93	G	37.1	Very low	40.9	Very low	68 Å²	68	129.2 Å²	129.2	70%	0.701	82%	0.815	S	S	*	*			trans	-176.3	95	158.1	0	0	0	0	0	109.2
94	R	34.6	Very low	39.4	Very low	203 Å²	203	130 Å²	130	77%	0.766	82%	0.817	S	S	*	*				71.5	139	71.8	-75.9	-162.7	170.4	-157	-0.1	114
95	Y	36.2	Very low	38.5	Very low	208 Å²	208	136 Å²	136	82%	0.816	83%	0.825	S	S	*	*			trans	73.3	135.4	178.6	-53	-76.9	0	0	0	114.5
96	A	37.3	Very low	37.3	Very low	100 Å²	100	139.3 Å²	139.3	83%	0.826	83%	0.83	S	S	*	*			cis	-152.1	170.4	-11.4	0	0	0	0	0	111
97	S	32.1	Very low	36.2	Very low	113 Å²	113	145.6 Å²	145.6	79%	0.79	84%	0.839	S	S	*	*			trans	-105.6	130.8	-168.7	54.3	0	0	0	0	115.3
98	S	36.7	Very low	35.2	Very low	127 Å²	127	142.7 Å²	142.7	89%	0.888	83%	0.829	S	S	*	*			trans	-169.6	150.8	141.2	-87.4	0	0	0	0	110.8
99	G	31.7	Very low	34.3	Very low	77 Å²	77	147.1 Å²	147.1	79%	0.794	83%	0.83	S	S	*	*			cis	123.5	53.8	-5	0	0	0	0	0	115.6
100	A	35.2	Very low	33.8	Very low	103 Å²	103	147.7 Å²	147.7	85%	0.851	82%	0.823	S	S	*	*			trans	-151.6	152.7	170.5	0	0	0	0	0	112.3
101	T	32.5	Very low	33.8	Very low	149 Å²	149	149.2 Å²	149.2	91%	0.914	82%	0.816	S	S	*	*			trans	-110.9	152.4	178.8	50.5	0	0	0	0	111.1
102	G	33	Very low	33.4	Very low	76 Å²	76	150.5 Å²	150.5	78%	0.784	81%	0.813	S	S	*	*			trans	-167.5	79	-172.1	0	0	0	0	0	118.4
103	R	33.2	Very low	33.3	Very low	242 Å²	242	147.4 Å²	147.4	91%	0.913	81%	0.81	S	S	*	*			trans	31.9	117.7	148.8	-68.1	179.3	173.9	162.9	-2.3	121.2
104	V	29.3	Very low	33	Very low	132 Å²	132	156.1 Å²	156.1	80%	0.8	82%	0.822	S	S	*	*			trans	-5.6	129.3	132.6	-178.8	0	0	0	0	116.8
105	R	34.3	Very low	32.8	Very low	244 Å²	244	157.1 Å²	157.1	92%	0.921	83%	0.827	S	S	*	*			trans	-143.8	131.7	143.5	-84.3	-163.8	167.1	-174.5	-4.8	111.2
106	H	31	Very low	32.6	Very low	186 Å²	186	154.3 Å²	154.3	86%	0.861	83%	0.825	S	S	*	*			trans	-66.3	146.8	159.3	-87.8	-109.4	0	0	0	110.3
107	R	34.3	Very low	32.3	Very low	248 Å²	248	159 Å²	159	94%	0.936	82%	0.823	S	S	*	*			trans	-150.6	132.2	148.9	-148.5	175.4	-170.3	-178.8	0.4	108.2
108	G	29.5	Very low	32	Very low	54 Å²	54	159.3 Å²	159.3	56%	0.557	82%	0.824	S	S	*	*			trans	-127.5	-166	172.1	0	0	0	0	0	109.9
109	Y	33.4	Very low	31.7	Very low	230 Å²	230	162.9 Å²	162.9	90%	0.902	82%	0.818	S	S	*	*			trans	68.7	140.9	-167.9	-59.8	-92.6	0	0	0	113.5
110	S	29.8	Very low	31.6	Very low	86 Å²	86	163.3 Å²	163.3	60%	0.601	81%	0.814	S	S	*	*			cis	-166	-158.9	-14.7	45.9	0	0	0	0	109.3
111	D	34.5	Very low	31.5	Very low	134 Å²	134	166 Å²	166	72%	0.717	81%	0.811	S	S	*	*			trans	83.9	100.1	164.1	-41.3	-11.5	0	0	0	113.4
112	T	31.2	Very low	31.4	Very low	132 Å²	132	165.1 Å²	165.1	81%	0.81	80%	0.8	S	S	*	*				71.9	151.4	63	64.3	0	0	0	0	116
113	E	31.9	Very low	31.2	Very low	183 Å²	183	173.6 Å²	173.6	86%	0.855	81%	0.809	S	S	*	*			trans	76	86.6	177.1	-55.1	-163.3	159.8	0	0	118.7
114	R	32.1	Very low	31.1	Very low	252 Å²	252	167.8 Å²	167.8	95%	0.951	80%	0.8	S	S	*	*				-158.1	82.2	120.2	-111.5	173.5	-173.5	165.1	3.6	112.2
115	Y	30.8	Very low	31.1	Very low	223 Å²	223	166 Å²	166	88%	0.875	79%	0.794	S	S	*	*			trans	-88.3	175.7	156.1	-107.1	-102.6	0	0	0	109.3
116	L	31.1	Very low	30.9	Very low	149 Å²	149	164.3 Å²	164.3	78%	0.78	79%	0.789	S	S	*	*			trans	70.3	87.5	170.8	-50.5	-178.6	0	0	0	116.8
117	Y	30.1	Very low	30.8	Very low	198 Å²	198	160.4 Å²	160.4	78%	0.776	79%	0.788	S	S	*	*				-140.6	93	123.1	-149.2	-94.2	0	0	0	110.3	R119	Y117-R119 HydrophobicContact CE1-CB 4.4Å
118	C	27.5	Very low	30.8	Very low	120 Å²	120	153.7 Å²	153.7	81%	0.811	78%	0.775	S	S	*	*			trans	-95.6	126.8	172.2	-65.1	0	0	0	0	109.2
119	R	29.7	Very low	30.7	Very low	203 Å²	203	160.5 Å²	160.5	77%	0.766	79%	0.792	S	S	*	*			trans	-151.2	88.2	165.3	-153.5	170.9	-172.9	168.5	0.5	106.9	Y117	Y117-R119 HydrophobicContact CE1-CB 4.4Å
120	A	29.5	Very low	30.8	Very low	86 Å²	86	155.7 Å²	155.7	71%	0.711	79%	0.787	S	S	*	*				62.5	84.1	76.6	0	0	0	0	0	111.3
121	M	33.1	Very low	30.9	Very low	159 Å²	159	154.9 Å²	154.9	78%	0.783	79%	0.792	S	S	*	*			trans	-134.1	98.8	160.5	-73.8	-88	68.7	0	0	107.8
122	D	31.1	Very low	30.8	Very low	131 Å²	131	157.6 Å²	157.6	70%	0.701	80%	0.8	S	S	*	*			trans	35.7	102.1	149.1	-50.9	-29.7	0	0	0	120.5
123	R	28.8	Very low	30.9	Very low	254 Å²	254	163.3 Å²	163.3	96%	0.958	81%	0.807	S	S	*	*			trans	-87	83.3	150	-104.5	-174	164.7	-167.9	-2.7	109.7
124	T	30	Very low	30.9	Very low	120 Å²	120	160.7 Å²	160.7	74%	0.736	81%	0.806	S	S	*	*			trans	-162.1	138.6	163.2	10.9	0	0	0	0	111.9
125	S	29.4	Very low	30.9	Very low	95 Å²	95	151.7 Å²	151.7	66%	0.664	79%	0.792	S	S	*	*			trans	65.7	132.8	-173.7	-151.4	0	0	0	0	113.9
126	Y	29.6	Very low	31	Very low	208 Å²	208	150.1 Å²	150.1	82%	0.816	80%	0.797	S	S	*	*			cis	-114	139.7	9.1	-76.6	-102	0	0	0	112.4
127	A	29.6	Very low	31	Very low	103 Å²	103	152.1 Å²	152.1	85%	0.851	80%	0.8	S	S	*	*			trans	-96.6	115.4	154.1	0	0	0	0	0	107
128	V	34.7	Very low	31.1	Very low	107 Å²	107	152.7 Å²	152.7	65%	0.648	81%	0.806	S	S	*	*			trans	-118.3	117.4	170	174.5	0	0	0	0	107.3	T130	V128-T130 HydrophobicContact CG1-CG2 4.27Å; V128-T130 PolarHBondContact O-N 3.15Å
129	E	26.8	Very low	31.2	Very low	198 Å²	198	151.9 Å²	151.9	93%	0.925	80%	0.802	S	S	*	*			trans	-77.7	102.4	172.6	-66.4	-179.8	112.5	0	0	109.8
130	T	35	Very low	31.1	Very low	129 Å²	129	150.9 Å²	150.9	79%	0.791	80%	0.798	S	S	*	*			trans	-112.4	112.7	160.1	42.5	0	0	0	0	108.9	V128	V128-T130 HydrophobicContact CG1-CG2 4.27Å; V128-T130 PolarHBondContact O-N 3.15Å
131	G	32.5	Very low	31.1	Very low	69 Å²	69	154.2 Å²	154.2	71%	0.711	80%	0.801	S	S	*	*			trans	-81	157.4	-164.4	0	0	0	0	0	115.8
132	H	32.3	Very low	31	Very low	191 Å²	191	151.5 Å²	151.5	88%	0.884	80%	0.797	S	S	*	*			trans	37.7	93	156	-63.5	-50	0	0	0	119
133	R	33.5	Very low	31	Very low	252 Å²	252	155.5 Å²	155.5	95%	0.951	80%	0.802	S	S	*	*			trans	-109.7	113.8	140.7	-89.9	-168.7	174.4	-173.9	2	110.2
134	P	32.6	Very low	31.2	Very low	127 Å²	127	148.5 Å²	148.5	83%	0.825	79%	0.79	S	S	*	*			trans	-85.8	143.6	170.3	33.3	-31.8	0	0	0	111.4
135	G	31.2	Very low	31.2	Very low	64 Å²	64	146.9 Å²	146.9	66%	0.66	78%	0.784	S	S	*	*			trans	116	59.9	154.8	0	0	0	0	0	118.6	K137	G135-K137 PolarHBondContact O-N 2.64Å
136	L	32.4	Very low	31.3	Very low	189 Å²	189	147.3 Å²	147.3	99%	0.99	79%	0.786	S	S	*	*			trans	-68.2	69.1	151.9	-87.5	170.2	0	0	0	110.6
137	K	32.3	Very low	31.4	Very low	192 Å²	192	147.1 Å²	147.1	84%	0.835	79%	0.79	S	S	*	*			trans	-87.5	124.3	162.8	-82.2	-175.3	176	176.9	0	108	G135 S139	G135-K137 PolarHBondContact O-N 2.64Å; K137-S139 PolarHBondContact O-N 3.21Å
138	K	31.1	Very low	31.5	Very low	210 Å²	210	151.2 Å²	151.2	91%	0.913	79%	0.792	S	S	*	*			trans	-59.7	103.4	176.3	-63.6	-175.9	177.1	-171	0	110.1	R140	K138-R140 PolarHBondContact O-N 3.3Å; K138-R140 VanDerWaalsContact O-N 3.16Å
139	S	29.5	Very low	31.3	Very low	102 Å²	102	149.8 Å²	149.8	71%	0.713	80%	0.798	S	S	*	*			trans	-75.9	100	170.5	-166.5	0	0	0	0	108.6	K137 M141	K137-S139 PolarHBondContact O-N 3.21Å; S139-M141 VanDerWaalsContact C-N 3.26Å; S139-M141 PolarHBondContact O-N 3.32Å
140	R	28.8	Very low	31.3	Very low	183 Å²	183	148.8 Å²	148.8	69%	0.691	80%	0.799	S	S	*	*			trans	-67.7	88.6	169.7	-176.8	-177.6	-175.4	-175	1.5	106.4	K138 S142 E283	K138-R140 PolarHBondContact O-N 3.3Å; K138-R140 VanDerWaalsContact O-N 3.16Å; R140-S142 PolarHBondContact O-N 3.39Å; R140-E283 IonicContact CZ-OE1 2.71Å; R140-E283 IonicContact NH1-OE1 2.73Å; R140-E283 PolarHBondContact NH1-OE1 3.12Å; R140-E283 VanDerWaalsContact NH1-OE1 3.12Å; R140-E283 IonicContact NH2-OE1 3.55Å; R140-E283 PolarHBondContact NH2-OE1 2.89Å
141	M	29.5	Very low	31.2	Very low	156 Å²	156	153.4 Å²	153.4	77%	0.768	80%	0.802	S	S	*	*			trans	-66.9	80	179.4	-69.4	-172.1	88.1	0	0	110.5	S139 W143	S139-M141 VanDerWaalsContact C-N 3.26Å; S139-M141 PolarHBondContact O-N 3.32Å; M141-W143 PolarHBondContact O-N 2.75Å
142	S	30	Very low	30.9	Very low	101 Å²	101	159.7 Å²	159.7	71%	0.706	80%	0.804	S	S	*	*			trans	-65.4	101.6	164.3	52.9	0	0	0	0	108.1	R140	R140-S142 PolarHBondContact O-N 3.39Å
143	W	32.2	Very low	30.7	Very low	215 Å²	215	160.4 Å²	160.4	81%	0.814	81%	0.805	S	S	*	*			trans	-56.6	133.8	170.7	-75.8	62	0	0	0	109	M141 S145	M141-W143 PolarHBondContact O-N 2.75Å; W143-S145 PolarHBondContact O-N 3.06Å
144	P	32	Very low	30.7	Very low	108 Å²	108	153.8 Å²	153.8	70%	0.701	79%	0.788	S	S	*	*			trans	-69.4	101.2	174.6	27.9	-32.6	0	0	0	108.9	S146	P144-S146 PolarHBondContact O-N 3.28Å
145	S	30	Very low	30.8	Very low	86 Å²	86	153.7 Å²	153.7	60%	0.601	79%	0.785	S	S	*	*			trans	-68.9	63.3	170.5	-69.8	0	0	0	0	111	W143 F147	W143-S145 PolarHBondContact O-N 3.06Å; S145-F147 PolarHBondContact O-N 3.33Å
146	S	31.4	Very low	30.7	Very low	103 Å²	103	158.2 Å²	158.2	72%	0.72	79%	0.794	S	S	*	*			trans	-74.5	56.8	179.4	-60.4	0	0	0	0	112	P144	P144-S146 PolarHBondContact O-N 3.28Å
147	F	31.5	Very low	30.8	Very low	204 Å²	204	156.3 Å²	156.3	90%	0.895	79%	0.785	S	S	*	*			trans	-124.2	37.8	171.2	-110.4	-78.2	0	0	0	111.4	S145	S145-F147 PolarHBondContact O-N 3.33Å
148	Q	33.2	Very low	30.8	Very low	190 Å²	190	149.6 Å²	149.6	89%	0.888	77%	0.77	S	S	*	*			trans	-66.6	151.5	158.4	-65.3	-175.4	-4.8	0	0	109.7
149	G	29	Very low	30.9	Very low	76 Å²	76	146.1 Å²	146.1	78%	0.784	77%	0.767	S	S	*	*			trans	122.5	19.1	164.4	0	0	0	0	0	119
150	L	28.2	Very low	31.1	Very low	177 Å²	177	146.9 Å²	146.9	93%	0.927	77%	0.772	S	S	*	*			trans	-143.6	51.3	170.6	-121	148.5	0	0	0	115.4
151	R	32.1	Very low	31.6	Very low	227 Å²	227	143.5 Å²	143.5	86%	0.857	78%	0.783	S	S	*	*			trans	-96.2	108.8	162.3	-75.2	-88.6	-169.1	175.3	1.3	110.1
152	R	26.9	Very low	31.7	Very low	200 Å²	200	139.3 Å²	139.3	76%	0.755	78%	0.78	S	S	*	*			trans	60.4	100.4	141.7	-165.1	-179.4	-161.5	166.2	5.5	119.1	D154	R152-D154 HydrophobicContact CG-CB 4.3Å; R152-D154 IonicContact CZ-OD2 2.74Å; R152-D154 IonicContact NE-OD2 3.75Å; R152-D154 PolarHBondContact NE-OD2 2.79Å; R152-D154 IonicContact NH2-OD2 3.35Å; R152-D154 PolarHBondContact NH2-OD2 2.98Å
153	F	27.4	Very low	31.9	Very low	206 Å²	206	146.3 Å²	146.3	90%	0.904	79%	0.791	S	S	*	*			trans	-89.9	101	143.8	-92	-86.2	0	0	0	109.3	V155	F153-V155 HydrophobicContact CD1-CG2 4.49Å
154	D	34.3	Very low	32	Very low	114 Å²	114	141.9 Å²	141.9	61%	0.61	79%	0.793	S	S	*	*			trans	-99.1	121.2	155.7	-103.6	-47.3	0	0	0	106.7	R152 D156	R152-D154 HydrophobicContact CG-CB 4.3Å; R152-D154 IonicContact CZ-OD2 2.74Å; R152-D154 IonicContact NE-OD2 3.75Å; R152-D154 PolarHBondContact NE-OD2 2.79Å; R152-D154 IonicContact NH2-OD2 3.35Å; R152-D154 PolarHBondContact NH2-OD2 2.98Å; D154-D156 PolarHBondContact O-N 2.98Å
155	V	33.1	Very low	32.3	Very low	124 Å²	124	142.5 Å²	142.5	75%	0.752	80%	0.797	S	S	*	*			trans	-97.5	94.8	-178.4	179	0	0	0	0	109.4	F153	F153-V155 HydrophobicContact CD1-CG2 4.49Å
156	D	30	Very low	32.7	Very low	159 Å²	159	146.6 Å²	146.6	85%	0.85	81%	0.811	S	S	*	*			trans	-81.6	118.8	173.1	-148.2	-24	0	0	0	109.7	D154	D154-D156 PolarHBondContact O-N 2.98Å
157	N	33.6	Very low	32.8	Very low	150 Å²	150	148.9 Å²	148.9	80%	0.802	82%	0.815	S	S	*	*			trans	-154.9	87.7	176.4	-163.6	57.6	0	0	0	115.2
158	G	32.5	Very low	33.3	Very low	50 Å²	50	144.2 Å²	144.2	52%	0.515	81%	0.806	S	S	.	*				91	83.7	124.4	0	0	0	0	0	120.6
159	T	33.4	Very low	33.3	Very low	138 Å²	138	143.4 Å²	143.4	85%	0.847	80%	0.804	S	S	*	*			trans	79.7	138.7	137.3	77.6	0	0	0	0	122.3
160	S	35	Very low	33.6	Very low	118 Å²	118	146.4 Å²	146.4	83%	0.825	81%	0.807	S	S	*	*			trans	121.6	126.9	137.2	-59.7	0	0	0	0	118.1
161	A	37.8	Very low	33.9	Very low	111 Å²	111	143.5 Å²	143.5	92%	0.917	80%	0.801	S	S	*	*			trans	-56.1	162.3	-170.4	0	0	0	0	0	117.8
162	G	32.1	Very low	34.4	Very low	69 Å²	69	139 Å²	139	71%	0.711	80%	0.801	S	S	*	*			cis	155.4	-170.7	-2.4	0	0	0	0	0	113.7
163	R	34.5	Very low	34.7	Very low	247 Å²	247	132.6 Å²	132.6	93%	0.932	80%	0.798	S	S	*	*			trans	80.9	83.3	176.4	-60.5	-173.7	170.8	-143.2	-3	119.5
164	S	34.1	Very low	35.3	Very low	123 Å²	123	129 Å²	129	86%	0.86	80%	0.799	S	S	*	*				50.5	153.6	114.2	-53.5	0	0	0	0	123.9
165	P	38.5	Very low	35.3	Very low	121 Å²	121	127 Å²	127	79%	0.786	81%	0.805	S	S	*	*			trans	-116.2	-176.1	-158.2	44.1	-33.1	0	0	0	115.3
166	L	38	Very low	35.6	Very low	171 Å²	171	128.5 Å²	128.5	90%	0.895	81%	0.808	S	S	*	*			trans	-155.6	145.5	157.8	-111.9	167	0	0	0	113.6
167	D	34.4	Very low	35.8	Very low	152 Å²	152	127.8 Å²	127.8	81%	0.813	80%	0.802	S	S	*	*			trans	-66.5	175.4	-161.7	-89.5	-48.2	0	0	0	120.9
168	P	41.9	Very low	36	Very low	106 Å²	106	128.8 Å²	128.8	69%	0.688	81%	0.807	S	S	*	*			trans	-100.4	177.9	-172	41.1	-38	0	0	0	115.1
169	M	33.2	Very low	35.8	Very low	172 Å²	172	134.9 Å²	134.9	85%	0.847	82%	0.822	S	S	*	*			trans	168	141.2	139	-94.3	-69.6	172.4	0	0	112.8
170	T	35.2	Very low	35.8	Very low	139 Å²	139	133.1 Å²	133.1	85%	0.853	82%	0.822	S	S	*	*			trans	153	149.5	134.9	43.4	0	0	0	0	113.8
171	S	33.5	Very low	35.5	Very low	116 Å²	116	134.5 Å²	134.5	81%	0.811	82%	0.82	S	S	*	*			trans	-133.4	-152.1	-175.5	-58.5	0	0	0	0	111
172	P	43.4	Very low	35.2	Very low	132 Å²	132	138.8 Å²	138.8	86%	0.857	82%	0.818	S	S	*	*				-122	-177.2	-94	39.1	-23.3	0	0	0	114.2
173	G	33.4	Very low	35.2	Very low	66 Å²	66	141.3 Å²	141.3	68%	0.68	82%	0.819	S	S	*	*			trans	163.1	149.5	157	0	0	0	0	0	119.3
174	S	38.8	Very low	35	Very low	132 Å²	132	138 Å²	138	92%	0.923	81%	0.814	S	S	*	*			trans	66.2	138.8	167.6	-52.3	0	0	0	0	117.3
175	G	35.4	Very low	34.8	Very low	71 Å²	71	137.7 Å²	137.7	73%	0.732	81%	0.812	S	S	*	*			cis	167.3	176.6	0.3	0	0	0	0	0	109.1
176	L	38.5	Very low	34.6	Very low	155 Å²	155	140.9 Å²	140.9	81%	0.812	82%	0.816	S	S	*	*			cis	-154.6	145.6	0.3	-77.3	174.1	0	0	0	111.2
177	I	34.3	Very low	34.2	Very low	144 Å²	144	144 Å²	144	74%	0.738	82%	0.816	S	S	*	*			trans	34.4	118.5	143.3	-48.3	173.5	0	0	0	121
178	L	37.6	Very low	34.6	Very low	171 Å²	171	147.2 Å²	147.2	90%	0.895	82%	0.817	S	S	*	*				-168.9	152.7	114.1	-104.2	176.1	0	0	0	112.6
179	Q	28.2	Very low	34.4	Very low	178 Å²	178	149.9 Å²	149.9	83%	0.832	82%	0.82	S	S	*	*			trans	-108.3	146.8	-173.7	-63.7	173.6	-77.4	0	0	113.3
180	A	34.1	Very low	34.8	Very low	102 Å²	102	145 Å²	145	84%	0.843	80%	0.803	S	S	*	*			trans	-151.5	126.6	153.6	0	0	0	0	0	110.1
181	N	28.4	Very low	35.5	Very low	147 Å²	147	146 Å²	146	79%	0.786	80%	0.796	S	S	*	*			trans	-87.6	132.1	179.1	-72.6	-20.2	0	0	0	111.1
182	F	32.3	Very low	36.2	Very low	201 Å²	201	144.9 Å²	144.9	88%	0.882	78%	0.78	S	S	*	*			trans	-149.1	95.3	155.8	-122.3	-78.9	0	0	0	114.3
183	V	31	Very low	36	Very low	122 Å²	122	147 Å²	147	74%	0.739	77%	0.772	S	S	*	*			trans	19	112.3	142.3	-173.3	0	0	0	0	118.8
184	H	29.9	Very low	36.5	Very low	177 Å²	177	154 Å²	154	82%	0.819	78%	0.778	S	S	*	*			trans	56.2	105.4	144.5	-115.1	62.1	0	0	0	119.8
185	S	31.6	Very low	36.5	Very low	117 Å²	117	153 Å²	153	82%	0.818	77%	0.771	S	S	*	*			trans	-146.6	127.9	138.4	62.9	0	0	0	0	110	R187	S185-R187 PolarHBondContact O-N 3.15Å
186	Q	32.7	Very low	36.5	Very low	187 Å²	187	157.5 Å²	157.5	87%	0.874	78%	0.778	S	S	*	*			trans	-92.8	96.7	-170.4	-162.1	171.6	9.7	0	0	109.8	R188	Q186-R188 PolarHBondContact O-N 2.77Å
187	R	31.3	Very low	36.4	Very low	238 Å²	238	154.8 Å²	154.8	90%	0.898	77%	0.772	S	S	*	*			trans	-77.4	107.1	-175.8	-162.3	179.9	-161.3	-133.8	5.1	110.1	S185 E189	S185-R187 PolarHBondContact O-N 3.15Å; R187-E189 PolarHBondContact O-N 2.84Å
188	R	42.3	Very low	36.5	Very low	218 Å²	218	155.6 Å²	155.6	82%	0.823	78%	0.778	S	S	*	*	P	Polyproline II helix	trans	-59.4	123	179.7	-172.2	-179.3	-175.1	-169.6	1.4	111.1	Q186	Q186-R188 PolarHBondContact O-N 2.77Å
189	E	37.1	Very low	36.5	Very low	163 Å²	163	158.9 Å²	158.9	76%	0.762	78%	0.78	S	S	*	*	P	Polyproline II helix	trans	-75.3	154.7	177.6	-61.3	-173.4	144.3	0	0	112.1	R187	R187-E189 PolarHBondContact O-N 2.84Å
190	S	42.1	Very low	36.8	Very low	70 Å²	70	157.5 Å²	157.5	49%	0.49	78%	0.779	S	S	.	*	P	Polyproline II helix	trans	-83.4	135.3	-174.4	54.5	0	0	0	0	112.4	L192 Y193	S190-L192 PolarHBondContact O-N 3.38Å; S190-Y193 PolarHBondContact O-N 3.33Å
191	F	48.6	Very low	37	Very low	158 Å²	158	160.2 Å²	160.2	69%	0.693	78%	0.778	S	S	*	*	T	Hydrogen-bonded Turn	trans	-51.6	-17.5	-178.9	71.9	-85.6	0	0	0	117.4	Y193	F191-Y193 VanDerWaalsContact C-N 3.27Å; F191-Y193 PolarHBondContact O-N 3.01Å
192	L	48.8	Very low	37.3	Very low	93 Å²	93	158.8 Å²	158.8	49%	0.487	78%	0.779	S	S	.	*	T	Hydrogen-bonded Turn	trans	-74.4	-14.7	177.3	-68.8	172	0	0	0	113.7	S190 I222	S190-L192 PolarHBondContact O-N 3.38Å; L192-I222 HydrophobicContact CD2-CD1 3.77Å
193	Y	40.2	Very low	37.5	Very low	177 Å²	177	154.2 Å²	154.2	69%	0.694	77%	0.77	S	S	*	*			trans	-141.9	122.9	176.8	-63	-84.8	0	0	0	109.6	S190 F191	S190-Y193 PolarHBondContact O-N 3.33Å; F191-Y193 VanDerWaalsContact C-N 3.27Å; F191-Y193 PolarHBondContact O-N 3.01Å
194	R	43.1	Very low	37.7	Very low	214 Å²	214	158.2 Å²	158.2	81%	0.808	78%	0.778	S	S	*	*			trans	-137.1	133.4	161.3	-79.3	-167.2	177.4	178.5	3.4	108.4
195	S	39.8	Very low	38.1	Very low	109 Å²	109	155.6 Å²	155.6	76%	0.762	78%	0.779	S	S	*	*			trans	-105.7	114.8	169.8	-55.5	0	0	0	0	107.9	S197	S195-S197 PolarHBondContact O-N 3.11Å; S195-S197 VanDerWaalsContact O-N 3.08Å
196	D	35.4	Very low	38.1	Very low	166 Å²	166	158.4 Å²	158.4	89%	0.888	78%	0.782	S	S	*	*			trans	-74.5	98.3	174.4	-87.4	-17	0	0	0	109.8
197	S	36.1	Very low	38.4	Very low	98 Å²	98	155.3 Å²	155.3	69%	0.685	78%	0.781	S	S	*	*			trans	-142.7	67.5	175.9	68.8	0	0	0	0	112	S195	S195-S197 PolarHBondContact O-N 3.11Å; S195-S197 VanDerWaalsContact O-N 3.08Å
198	D	35.3	Very low	38.6	Very low	161 Å²	161	154.3 Å²	154.3	86%	0.861	78%	0.777	S	S	*	*			trans	-159.4	61.9	168.4	-113.5	-20.6	0	0	0	112.7
199	Y	37.9	Very low	38.3	Very low	241 Å²	241	151.3 Å²	151.3	95%	0.945	78%	0.777	S	S	*	*			trans	-153	97.6	160.1	-109.2	-73.4	0	0	0	111.1
200	D	35	Very low	38.3	Very low	149 Å²	149	149.3 Å²	149.3	80%	0.797	78%	0.781	S	S	*	*			trans	-110.6	178.1	173.2	-162.1	-5.9	0	0	0	110
201	L	37.4	Very low	37.6	Very low	158 Å²	158	151.3 Å²	151.3	83%	0.827	80%	0.795	S	S	*	*			trans	83.8	81.9	178.4	-48.9	-179.3	0	0	0	116.9
202	S	34.9	Very low	36.9	Very low	117 Å²	117	151.7 Å²	151.7	82%	0.818	80%	0.803	S	S	*	*				-177.6	121.7	113.3	-171.7	0	0	0	0	113.2
203	P	36.8	Very low	36.2	Very low	106 Å²	106	151.8 Å²	151.8	69%	0.688	82%	0.817	S	S	*	*			trans	-101.9	137.2	178.7	35.7	-31.1	0	0	0	114.1
204	K	35	Very low	35.8	Very low	205 Å²	205	148 Å²	148	89%	0.891	82%	0.816	S	S	*	*			trans	151.1	111.3	139.1	-81.9	153.6	-170.4	169.2	0	113.2
205	S	39.1	Very low	35.2	Very low	123 Å²	123	145.3 Å²	145.3	86%	0.86	82%	0.818	S	S	*	*				-169.4	165.6	106.3	63	0	0	0	0	109.8
206	M	32.4	Very low	35.3	Very low	176 Å²	176	147.8 Å²	147.8	87%	0.867	82%	0.821	S	S	*	*			trans	-108.8	131.7	-175.9	-66.2	163.9	58.1	0	0	111
207	S	37.2	Very low	35.3	Very low	122 Å²	122	149.1 Å²	149.1	85%	0.853	82%	0.821	S	S	*	*			trans	-146.5	155.5	143.1	-163.2	0	0	0	0	110.1
208	R	36.8	Very low	35	Very low	217 Å²	217	147.5 Å²	147.5	82%	0.819	82%	0.82	S	S	*	*			trans	-109.7	142.9	-179.5	-67.9	169.3	168.2	153.9	-6.6	109
209	N	36.2	Very low	35.2	Very low	155 Å²	155	146.8 Å²	146.8	83%	0.829	82%	0.816	S	S	*	*			trans	-174.5	157	131.5	-97.2	-1.6	0	0	0	111.9
210	S	35.6	Very low	35.6	Very low	120 Å²	120	143.3 Å²	143.3	84%	0.839	81%	0.814	S	S	*	*			trans	47.7	101.9	164.1	48.6	0	0	0	0	118.6
211	S	29	Very low	36.7	Very low	113 Å²	113	142 Å²	142	79%	0.79	81%	0.806	S	S	*	*			trans	-81	175.2	162.6	53.4	0	0	0	0	113
212	I	33.4	Very low	37.5	Very low	166 Å²	166	139.2 Å²	139.2	85%	0.851	79%	0.791	S	S	*	*			trans	80.5	96.8	-179.2	-61	176.1	0	0	0	113.6
213	A	34.4	Very low	39.2	Very low	94 Å²	94	136.9 Å²	136.9	78%	0.777	77%	0.772	S	S	*	*	S	Bend	trans	173.4	-20.6	153.1	0	0	0	0	0	113.1	D215	A213-D215 PolarHBondContact O-N 3.46Å
214	S	30.6	Very low	41.3	Very low	97 Å²	97	134.6 Å²	134.6	68%	0.678	76%	0.756	S	S	*	*			trans	-94.5	13.7	-154.3	55.8	0	0	0	0	117.8	I216	S214-I216 PolarHBondContact O-N 3.32Å
215	D	31.7	Very low	43.7	Very low	158 Å²	158	126.3 Å²	126.3	85%	0.845	72%	0.723	S	S	*	*			trans	-101.2	48.2	-173.2	-63.8	-44.6	0	0	0	113.4	A213	A213-D215 PolarHBondContact O-N 3.46Å
216	I	41.8	Very low	45.9	Very low	161 Å²	161	121.3 Å²	121.3	83%	0.826	69%	0.686	S	S	*	*			trans	-130	48.9	170.1	-39.6	-178.7	0	0	0	110.9	S214	S214-I216 PolarHBondContact O-N 3.32Å
217	H	33.8	Very low	48.5	Very low	195 Å²	195	114.4 Å²	114.4	90%	0.903	66%	0.657	S	S	*	*			trans	-109.9	102	158	-85.4	-71.6	0	0	0	108.3
218	G	31.7	Very low	50.8	Low	64 Å²	64	113.9 Å²	113.9	66%	0.66	64%	0.641	S	S	*	*			trans	-145.2	100.5	179.4	0	0	0	0	0	110.7
219	D	38.6	Very low	53.4	Low	145 Å²	145	107.4 Å²	107.4	78%	0.775	63%	0.625	S	S	*	*			trans	56.7	126	170.8	-56.2	-29.9	0	0	0	118.7	L221	D219-L221 HydrophobicContact CB-CD1 3.86Å; D219-L221 HydrophobicContact CB-CG 4.35Å; D219-L221 PolarHBondContact O-N 2.92Å
220	D	45.7	Very low	55.9	Low	168 Å²	168	100.5 Å²	100.5	90%	0.898	59%	0.588	S	S	*	*			trans	-72.5	57.6	172.2	-97.2	-44.4	0	0	0	112.4
221	L	58.7	Low	58.4	Low	121 Å²	121	97.2 Å²	97.2	63%	0.634	57%	0.569	S	S	*	*			trans	-64.7	142.2	168.7	-72.7	133.1	0	0	0	110	D219 V223	D219-L221 HydrophobicContact CB-CD1 3.86Å; D219-L221 HydrophobicContact CB-CG 4.35Å; D219-L221 PolarHBondContact O-N 2.92Å; L221-V223 PolarHBondContact O-N 3.27Å
222	I	54.5	Low	61.4	Low	101 Å²	101	95.1 Å²	95.1	52%	0.518	55%	0.554	S	S	.	*			trans	-73.3	80.8	176	-57.4	176.2	0	0	0	109.4	L192	L192-I222 HydrophobicContact CD2-CD1 3.77Å
223	V	70.3	Confident	64.2	Low	67 Å²	67	89.8 Å²	89.8	41%	0.406	53%	0.527	S	S	.	.			trans	-70.3	132.7	176.8	-172.4	0	0	0	0	109.8	L221 A227 Q228 K307	L221-V223 PolarHBondContact O-N 3.27Å; V223-A227 HydrophobicContact CG1-CB 3.87Å; V223-Q228 HydrophobicContact CG1-CB 4.04Å; V223-K307 PolarHBondContact O-NZ 3.01Å
224	T	80.9	Confident	66.9	Low	59 Å²	59	90.4 Å²	90.4	36%	0.362	51%	0.509	S	S	.	.			trans	-60.7	144.8	174.5	63.2	0	0	0	0	109.7	F226 A227 Q228 A304	T224-F226 PolarHBondContact O-N 2.65Å; T224-A227 PolarHBondContact O-N 2.97Å; T224-A227 VanDerWaalsContact OG1-CB 3.32Å; T224-A227 WeakPolarHBondContact OG1-CB 3.13Å; T224-A227 PolarHBondContact OG1-N 3.17Å; T224-Q228 WeakPolarHBondContact O-CB 3.24Å; T224-Q228 PolarHBondContact O-N 2.95Å; T224-A304 HydrophobicContact CG2-CB 3.96Å
225	P	84.7	Confident	69.8	Low	30 Å²	30	89.5 Å²	89.5	20%	0.195	50%	0.499	C	S	.	.	H	α-helix	trans	-58.4	-37.3	-175.8	22.8	-31.2	0	0	0	111.8	Q228 V229 M303 K307	P225-Q228 PolarHBondContact O-N 3.34Å; P225-V229 WeakPolarHBondContact O-CG2 3.16Å; P225-V229 PolarHBondContact O-N 2.81Å; P225-M303 HydrophobicContact CG-CB 3.81Å; P225-M303 WeakPolarHBondContact CG-O 3.34Å; P225-K307 HydrophobicContact CB-CD 4.05Å; P225-K307 HydrophobicContact CG-CB 4.28Å; P225-K307 HydrophobicContact CG-CD 4.07Å
226	F	86.1	Confident	72.8	Confident	18 Å²	18	85.6 Å²	85.6	8%	0.079	48%	0.481	C	S	.	.	H	α-helix	trans	-62.8	-48.5	177.3	-167.8	-100.6	0	0	0	112.7	T224 Q228 V229 L230 L291 L294 Q295 V300 M303	T224-F226 PolarHBondContact O-N 2.65Å; F226-Q228 VanDerWaalsContact C-N 3.3Å; F226-Q228 PolarHBondContact O-N 3.26Å; F226-V229 PolarHBondContact O-N 3.27Å; F226-L230 HydrophobicContact CE1-CD1 4.47Å; F226-L230 WeakPolarHBondContact O-CB 3.26Å; F226-L230 PolarHBondContact O-N 2.6Å; F226-L291 HydrophobicContact CE2-CD2 4.22Å; F226-L291 HydrophobicContact CZ-CB 4.33Å; F226-L291 HydrophobicContact CZ-CD2 4.38Å; F226-L291 WeakPolarHBondContact CZ-O 3.24Å; F226-L294 HydrophobicContact CZ-CB 4.36Å; F226-Q295 HydrophobicContact CD1-CG 4.46Å; F226-Q295 HydrophobicContact CE1-CB 4.12Å; F226-Q295 HydrophobicContact CE1-CG 4.34Å; F226-V300 HydrophobicContact CB-CG1 3.81Å; F226-V300 HydrophobicContact CB-CG2 4.43Å; F226-V300 HydrophobicContact CD1-CG1 4Å; F226-V300 HydrophobicContact CD1-CG2 3.95Å; F226-V300 HydrophobicContact CD2-CG2 4.04Å; F226-V300 HydrophobicContact CE1-CG2 4.23Å; F226-V300 HydrophobicContact CE2-CG2 4.31Å; F226-V300 HydrophobicContact CG-CG1 3.98Å; F226-V300 HydrophobicContact CG-CG2 3.86Å; F226-V300 HydrophobicContact CZ-CG2 4.4Å; F226-M303 HydrophobicContact CD2-CE 4.13Å; F226-M303 HydrophobicContact CD2-SD 4.3Å
227	A	86	Confident	75.2	Confident	31 Å²	31	81.4 Å²	81.4	26%	0.256	46%	0.455	S	S	.	.	H	α-helix	trans	-65.8	-33.9	177.8	0	0	0	0	0	112.4	V223 T224 L230 A231	V223-A227 HydrophobicContact CG1-CB 3.87Å; T224-A227 PolarHBondContact O-N 2.97Å; T224-A227 VanDerWaalsContact OG1-CB 3.32Å; T224-A227 WeakPolarHBondContact OG1-CB 3.13Å; T224-A227 PolarHBondContact OG1-N 3.17Å; A227-L230 PolarHBondContact O-N 2.65Å; A227-A231 WeakPolarHBondContact O-CB 3.35Å; A227-A231 PolarHBondContact O-N 2.89Å
228	Q	87.2	Confident	77.9	Confident	112 Å²	112	75.9 Å²	75.9	52%	0.523	43%	0.432	S	S	.	.	H	α-helix	trans	-64.9	-43.3	174.4	-172.9	177.2	4.3	0	0	111.7	V223 T224 P225 F226 S232	V223-Q228 HydrophobicContact CG1-CB 4.04Å; T224-Q228 WeakPolarHBondContact O-CB 3.24Å; T224-Q228 PolarHBondContact O-N 2.95Å; P225-Q228 PolarHBondContact O-N 3.34Å; F226-Q228 VanDerWaalsContact C-N 3.3Å; F226-Q228 PolarHBondContact O-N 3.26Å; Q228-S232 WeakPolarHBondContact O-CB 3.24Å; Q228-S232 PolarHBondContact O-N 1.8Å; Q228-S232 VanDerWaalsContact O-N 3.1Å
229	V	89.6	Confident	80.9	Confident	81 Å²	81	77.3 Å²	77.3	49%	0.491	43%	0.425	S	S	.	.	H	α-helix	trans	-66.1	-45.6	173.9	169.6	0	0	0	0	111.1	P225 F226 A231 S232 L233	P225-V229 WeakPolarHBondContact O-CG2 3.16Å; P225-V229 PolarHBondContact O-N 2.81Å; F226-V229 PolarHBondContact O-N 3.27Å; V229-A231 PolarHBondContact O-N 3.03Å; V229-S232 WeakPolarHBondContact O-CB 3.19Å; V229-S232 PolarHBondContact O-N 3.4Å; V229-S232 VanDerWaalsContact O-N 3.17Å; V229-L233 HydrophobicContact CG1-CD1 3.81Å; V229-L233 HydrophobicContact CG1-CG 4.24Å; V229-L233 WeakPolarHBondContact O-CG 3.49Å; V229-L233 PolarHBondContact O-N 2.99Å
230	L	88.9	Confident	83.4	Confident	9 Å²	9	73.4 Å²	73.4	5%	0.047	40%	0.401	C	S	.	.	H	α-helix	trans	-60.3	-44.5	179.4	-163	88	0	0	0	112.1	F226 A227 S232 L233 R234 L291 E292	F226-L230 HydrophobicContact CE1-CD1 4.47Å; F226-L230 WeakPolarHBondContact O-CB 3.26Å; F226-L230 PolarHBondContact O-N 2.6Å; A227-L230 PolarHBondContact O-N 2.65Å; L230-S232 VanDerWaalsContact C-N 3.35Å; L230-L233 PolarHBondContact O-N 3.35Å; L230-R234 WeakPolarHBondContact O-CB 3.43Å; L230-R234 WeakPolarHBondContact O-CG 3.03Å; L230-R234 PolarHBondContact O-N 2.82Å; L230-L291 HydrophobicContact CD1-CB 4.11Å; L230-E292 HydrophobicContact CD1-CG 3.84Å; L230-E292 HydrophobicContact CD2-CG 4Å; L230-E292 HydrophobicContact CG-CG 4.45Å
231	A	89	Confident	85.5	Confident	52 Å²	52	65.5 Å²	65.5	43%	0.43	36%	0.359	S	S	.	.	H	α-helix	trans	-64.4	-38.6	175.5	0	0	0	0	0	112.3	A227 V229 T235	A227-A231 WeakPolarHBondContact O-CB 3.35Å; A227-A231 PolarHBondContact O-N 2.89Å; V229-A231 PolarHBondContact O-N 3.03Å; A231-T235 WeakPolarHBondContact O-CB 3.31Å; A231-T235 PolarHBondContact O-N 2.9Å; A231-T235 PolarHBondContact O-OG1 3.39Å
232	S	91.3	Very high	87	Confident	69 Å²	69	62 Å²	62	48%	0.483	35%	0.348	S	S	.	.	H	α-helix	trans	-63.2	-48.7	173.8	-171.2	0	0	0	0	111.6	Q228 V229 L230 R234 T235 V236	Q228-S232 WeakPolarHBondContact O-CB 3.24Å; Q228-S232 PolarHBondContact O-N 1.8Å; Q228-S232 VanDerWaalsContact O-N 3.1Å; V229-S232 WeakPolarHBondContact O-CB 3.19Å; V229-S232 PolarHBondContact O-N 3.4Å; V229-S232 VanDerWaalsContact O-N 3.17Å; L230-S232 VanDerWaalsContact C-N 3.35Å; S232-R234 PolarHBondContact O-N 2.77Å; S232-T235 CarbonylContact O-C 3.59Å; S232-T235 WeakPolarHBondContact O-CA 3.29Å; S232-T235 WeakPolarHBondContact O-CB 3.33Å; S232-T235 PolarHBondContact O-N 3.48Å; S232-V236 WeakPolarHBondContact O-CG2 3.44Å; S232-V236 PolarHBondContact O-N 2.91Å
233	L	92.3	Very high	88.7	Confident	54 Å²	54	63.6 Å²	63.6	28%	0.283	36%	0.356	S	S	.	.	H	α-helix	trans	-63.7	-42.5	179.2	-69.6	172.7	0	0	0	112.4	V229 L230 T235 V236 R237 L288 L291	V229-L233 HydrophobicContact CG1-CD1 3.81Å; V229-L233 HydrophobicContact CG1-CG 4.24Å; V229-L233 WeakPolarHBondContact O-CG 3.49Å; V229-L233 PolarHBondContact O-N 2.99Å; L230-L233 PolarHBondContact O-N 3.35Å; L233-T235 PolarHBondContact O-N 3.42Å; L233-V236 PolarHBondContact O-N 3.17Å; L233-R237 WeakPolarHBondContact O-CB 3.3Å; L233-R237 PolarHBondContact O-N 2.95Å; L233-L288 HydrophobicContact CB-CD2 3.75Å; L233-L291 HydrophobicContact CD1-CD1 3.76Å
234	R	91.3	Very high	89.4	Confident	107 Å²	107	60.6 Å²	60.6	40%	0.404	34%	0.338	S	S	.	.	H	α-helix	trans	-59.3	-34.9	171.4	-73.8	168.5	167.5	-172.6	-6.8	112.2	L230 S232 N238 L288 E292	L230-R234 WeakPolarHBondContact O-CB 3.43Å; L230-R234 WeakPolarHBondContact O-CG 3.03Å; L230-R234 PolarHBondContact O-N 2.82Å; S232-R234 PolarHBondContact O-N 2.77Å; R234-N238 VanDerWaalsContact O-CG 3.29Å; R234-N238 PolarHBondContact O-N 3.48Å; R234-N238 VanDerWaalsContact O-N 3.08Å; R234-N238 PolarHBondContact O-ND2 2.93Å; R234-L288 HydrophobicContact CG-CD1 4.45Å; R234-L288 HydrophobicContact CG-CD2 4.15Å; R234-E292 IonicContact CZ-OE1 3.14Å; R234-E292 IonicContact CZ-OE2 3.87Å; R234-E292 IonicContact NE-OE1 2.72Å; R234-E292 PolarHBondContact NE-OE1 2.97Å; R234-E292 IonicContact NH2-OE1 2.7Å; R234-E292 PolarHBondContact NH2-OE1 3.48Å; R234-E292 IonicContact NH2-OE2 3.77Å; R234-E292 PolarHBondContact NH2-OE2 2.84Å
235	T	92.5	Very high	89.3	Confident	77 Å²	77	63.7 Å²	63.7	47%	0.472	35%	0.353	S	S	.	.	H	α-helix	trans	-70.8	-43.3	174.9	-55.6	0	0	0	0	111.6	A231 S232 L233 R237 N238 N239	A231-T235 WeakPolarHBondContact O-CB 3.31Å; A231-T235 PolarHBondContact O-N 2.9Å; A231-T235 PolarHBondContact O-OG1 3.39Å; S232-T235 CarbonylContact O-C 3.59Å; S232-T235 WeakPolarHBondContact O-CA 3.29Å; S232-T235 WeakPolarHBondContact O-CB 3.33Å; S232-T235 PolarHBondContact O-N 3.48Å; L233-T235 PolarHBondContact O-N 3.42Å; T235-R237 PolarHBondContact O-N 3.04Å; T235-N238 PolarHBondContact O-N 3.39Å; T235-N239 WeakPolarHBondContact O-CB 3.41Å; T235-N239 VanDerWaalsContact O-CG 3.28Å; T235-N239 PolarHBondContact O-N 3.41Å; T235-N239 PolarHBondContact O-ND2 3.21Å
236	V	93.2	Very high	88.6	Confident	77 Å²	77	64.6 Å²	64.6	47%	0.467	36%	0.356	S	S	.	.	H	α-helix	trans	-58.9	-45.8	173	171.3	0	0	0	0	110.9	S232 L233 N238 N239 F240	S232-V236 WeakPolarHBondContact O-CG2 3.44Å; S232-V236 PolarHBondContact O-N 2.91Å; L233-V236 PolarHBondContact O-N 3.17Å; V236-N238 PolarHBondContact O-N 3.48Å; V236-N239 PolarHBondContact O-N 3.28Å; V236-F240 WeakPolarHBondContact O-CB 3.47Å; V236-F240 PolarHBondContact O-N 3.45Å
237	R	92.9	Very high	87.3	Confident	72 Å²	72	69.2 Å²	69.2	27%	0.272	38%	0.378	S	S	.	.	H	α-helix	trans	-57.4	-48.5	176.1	-177.1	-84.4	-174.4	-166.5	-5.9	112.3	L233 T235 N239 F240 A241 L281 L284 D285 L288	L233-R237 WeakPolarHBondContact O-CB 3.3Å; L233-R237 PolarHBondContact O-N 2.95Å; T235-R237 PolarHBondContact O-N 3.04Å; R237-N239 VanDerWaalsContact C-N 3.35Å; R237-N239 PolarHBondContact O-N 3.11Å; R237-F240 PolarHBondContact O-N 2.8Å; R237-A241 PolarHBondContact O-N 3.44Å; R237-L281 HydrophobicContact CG-CD1 3.95Å; R237-L284 HydrophobicContact CB-CD2 3.77Å; R237-L284 HydrophobicContact CB-CG 4.3Å; R237-L284 HydrophobicContact CG-CD2 4.01Å; R237-L284 HydrophobicContact CG-CG 4.3Å; R237-D285 WeakPolarHBondContact CD-OD1 3.36Å; R237-D285 VanDerWaalsContact CG-OD1 3.23Å; R237-D285 WeakPolarHBondContact CG-OD1 3.31Å; R237-D285 IonicContact CZ-OD1 2.82Å; R237-D285 IonicContact CZ-OD2 2.7Å; R237-D285 IonicContact NE-OD1 3.95Å; R237-D285 PolarHBondContact NE-OD1 3.23Å; R237-D285 IonicContact NE-OD2 2.87Å; R237-D285 PolarHBondContact NE-OD2 3.37Å; R237-D285 IonicContact NH2-OD1 3.54Å; R237-D285 IonicContact NH2-OD2 3.16Å; R237-D285 PolarHBondContact NH2-OD2 3.41Å; R237-L288 HydrophobicContact CB-CD1 3.9Å; R237-L288 HydrophobicContact CG-CD1 3.91Å
238	N	91.5	Very high	85.6	Confident	79 Å²	79	75 Å²	75	42%	0.422	40%	0.404	S	S	.	.	H	α-helix	trans	-64.8	-39.1	179.1	-72.5	-19.4	0	0	0	112.3	R234 T235 V236 A242 Q247	R234-N238 VanDerWaalsContact O-CG 3.29Å; R234-N238 PolarHBondContact O-N 3.48Å; R234-N238 VanDerWaalsContact O-N 3.08Å; R234-N238 PolarHBondContact O-ND2 2.93Å; T235-N238 PolarHBondContact O-N 3.39Å; V236-N238 PolarHBondContact O-N 3.48Å; N238-A242 PolarHBondContact O-N 3.47Å; N238-Q247 PolarHBondContact O-NE2 2.75Å
239	N	93.2	Very high	83.3	Confident	95 Å²	95	80.7 Å²	80.7	51%	0.508	42%	0.421	S	S	.	.	H	α-helix	trans	-67.5	-39.2	174.1	-69.7	-19	0	0	0	112	T235 V236 R237 A242 L243	T235-N239 WeakPolarHBondContact O-CB 3.41Å; T235-N239 VanDerWaalsContact O-CG 3.28Å; T235-N239 PolarHBondContact O-N 3.41Å; T235-N239 PolarHBondContact O-ND2 3.21Å; V236-N239 PolarHBondContact O-N 3.28Å; R237-N239 VanDerWaalsContact C-N 3.35Å; R237-N239 PolarHBondContact O-N 3.11Å; N239-A242 PolarHBondContact O-N 3.42Å; N239-L243 WeakPolarHBondContact O-CB 3.15Å; N239-L243 VanDerWaalsContact O-CG 3.27Å; N239-L243 WeakPolarHBondContact O-CG 3.4Å; N239-L243 PolarHBondContact O-N 3.02Å
240	F	92	Very high	80.6	Confident	62 Å²	62	80.2 Å²	80.2	27%	0.272	43%	0.425	S	S	.	.	H	α-helix	trans	-62.5	-48.4	177.2	-175.3	-93.6	0	0	0	111.5	V236 R237 A242 L243 T244 T280 L281	V236-F240 WeakPolarHBondContact O-CB 3.47Å; V236-F240 PolarHBondContact O-N 3.45Å; R237-F240 PolarHBondContact O-N 2.8Å; F240-A242 PolarHBondContact O-N 3.04Å; F240-L243 PolarHBondContact O-N 2.88Å; F240-L243 VanDerWaalsContact O-N 3.14Å; F240-T244 HydrophobicContact CD1-CG2 4.17Å; F240-T244 HydrophobicContact CD2-CG2 4.45Å; F240-T244 HydrophobicContact CE1-CG2 3.8Å; F240-T244 HydrophobicContact CE2-CG2 4.11Å; F240-T244 HydrophobicContact CG-CG2 4.48Å; F240-T244 HydrophobicContact CZ-CG2 3.76Å; F240-T244 WeakPolarHBondContact O-CG2 3.23Å; F240-T244 PolarHBondContact O-N 2.94Å; F240-T244 PolarHBondContact O-OG1 3.32Å; F240-T280 WeakPolarHBondContact CZ-OG1 3.38Å; F240-L281 HydrophobicContact CD1-CB 4.3Å; F240-L281 HydrophobicContact CD1-CD1 4.27Å; F240-L281 HydrophobicContact CE1-CB 4.08Å
241	A	89.9	Confident	78.1	Confident	3 Å²	3	85.7 Å²	85.7	3%	0.025	46%	0.462	C	S	.	.	H	α-helix	trans	-61.4	-31.1	176.8	0	0	0	0	0	113.2	R237 N245 L246 Q247 L281	R237-A241 PolarHBondContact O-N 3.44Å; A241-N245 PolarHBondContact O-N 2.79Å; A241-L246 PolarHBondContact O-N 3.36Å; A241-Q247 HydrophobicContact CB-CG 3.91Å; A241-Q247 PolarHBondContact O-N 2.8Å; A241-L281 HydrophobicContact CB-CD2 4.13Å
242	A	89.8	Confident	75.5	Confident	47 Å²	47	88 Å²	88	39%	0.388	48%	0.475	S	S	.	.	H	α-helix	trans	-72.8	-43.3	172.6	0	0	0	0	0	112.2	N238 N239 F240 T244 N245	N238-A242 PolarHBondContact O-N 3.47Å; N239-A242 PolarHBondContact O-N 3.42Å; F240-A242 PolarHBondContact O-N 3.04Å; A242-T244 VanDerWaalsContact C-N 3.31Å; A242-T244 PolarHBondContact O-N 3.32Å; A242-N245 PolarHBondContact O-N 2.96Å
243	L	89.8	Confident	72.7	Confident	134 Å²	134	94.7 Å²	94.7	70%	0.702	50%	0.495	S	S	*	.	H	α-helix	trans	-66.2	-30.3	179	-73.2	167.2	0	0	0	113.2	N239 F240	N239-L243 WeakPolarHBondContact O-CB 3.15Å; N239-L243 VanDerWaalsContact O-CG 3.27Å; N239-L243 WeakPolarHBondContact O-CG 3.4Å; N239-L243 PolarHBondContact O-N 3.02Å; F240-L243 PolarHBondContact O-N 2.88Å; F240-L243 VanDerWaalsContact O-N 3.14Å
244	T	86.4	Confident	70.1	Confident	4 Å²	4	102.7 Å²	102.7	3%	0.025	52%	0.522	C	S	.	.	T	Hydrogen-bonded Turn	trans	-95.8	4.2	-178.6	58.9	0	0	0	0	114.2	F240 A242 L246 Q274 A277	F240-T244 HydrophobicContact CD1-CG2 4.17Å; F240-T244 HydrophobicContact CD2-CG2 4.45Å; F240-T244 HydrophobicContact CE1-CG2 3.8Å; F240-T244 HydrophobicContact CE2-CG2 4.11Å; F240-T244 HydrophobicContact CG-CG2 4.48Å; F240-T244 HydrophobicContact CZ-CG2 3.76Å; F240-T244 WeakPolarHBondContact O-CG2 3.23Å; F240-T244 PolarHBondContact O-N 2.94Å; F240-T244 PolarHBondContact O-OG1 3.32Å; A242-T244 VanDerWaalsContact C-N 3.31Å; A242-T244 PolarHBondContact O-N 3.32Å; T244-L246 PolarHBondContact O-N 3.15Å; T244-L246 WeakPolarHBondContact OG1-CD1 3.48Å; T244-L246 WeakPolarHBondContact OG1-CG 3.49Å; T244-Q274 PolarHBondContact O-NE2 3.44Å; T244-Q274 VanDerWaalsContact O-NE2 3.14Å; T244-A277 HydrophobicContact CG2-CB 3.77Å
245	N	78.8	Confident	67.4	Low	125 Å²	125	103.1 Å²	103.1	67%	0.668	54%	0.541	S	S	*	.	T	Hydrogen-bonded Turn	trans	55	27.9	-175	-56.7	-79	0	0	0	114.3	A241 A242	A241-N245 PolarHBondContact O-N 2.79Å; A242-N245 PolarHBondContact O-N 2.96Å
246	L	69.6	Low	65	Low	48 Å²	48	105.5 Å²	105.5	25%	0.251	56%	0.558	S	S	.	*			trans	-85.5	-8.8	179.4	-75.3	175.5	0	0	0	113.8	A241 T244 D248 Q274 A277 L281	A241-L246 PolarHBondContact O-N 3.36Å; T244-L246 PolarHBondContact O-N 3.15Å; T244-L246 WeakPolarHBondContact OG1-CD1 3.48Å; T244-L246 WeakPolarHBondContact OG1-CG 3.49Å; L246-D248 PolarHBondContact O-N 3.32Å; L246-Q274 VanDerWaalsContact CD2-NE2 3.34Å; L246-A277 HydrophobicContact CD1-CB 4.07Å; L246-A277 WeakPolarHBondContact CD1-O 3.42Å; L246-L281 HydrophobicContact CB-CD2 4.06Å; L246-L281 HydrophobicContact CD1-CB 4.19Å; L246-L281 HydrophobicContact CD1-CD2 3.75Å
247	Q	59	Low	62.5	Low	116 Å²	116	110.5 Å²	110.5	54%	0.542	58%	0.578	S	S	.	*	S	Bend	trans	-66.5	112.4	174.5	-72	-179	-7.5	0	0	111.8	N238 A241	N238-Q247 PolarHBondContact O-NE2 2.75Å; A241-Q247 HydrophobicContact CB-CG 3.91Å; A241-Q247 PolarHBondContact O-N 2.8Å
248	D	49	Very low	59.8	Low	153 Å²	153	112.1 Å²	112.1	82%	0.818	60%	0.599	S	S	*	*			trans	42.4	71.2	167.2	-72	-38.4	0	0	0	116.8	L246 A250	L246-D248 PolarHBondContact O-N 3.32Å; D248-A250 PolarHBondContact O-N 3.05Å
249	R	40.1	Very low	57.4	Low	230 Å²	230	115.2 Å²	115.2	87%	0.868	62%	0.616	S	S	*	*			trans	-69.2	61	150.3	-82.1	-164.3	177.3	-171.9	3.9	111.2
250	A	32.4	Very low	55.1	Low	71 Å²	71	119.6 Å²	119.6	59%	0.587	63%	0.633	S	S	*	*			trans	-55.7	136.2	166.9	0	0	0	0	0	109.5	D248 S252	D248-A250 PolarHBondContact O-N 3.05Å; A250-S252 VanDerWaalsContact C-N 3.29Å; A250-S252 PolarHBondContact O-N 2.94Å
251	P	36	Very low	52.6	Low	125 Å²	125	122.2 Å²	122.2	81%	0.812	66%	0.656	S	S	*	*			trans	-73	79.6	-171.3	28.6	-35.7	0	0	0	112	K253	P251-K253 PolarHBondContact O-N 2.82Å
252	S	33.8	Very low	50.6	Low	100 Å²	100	126.5 Å²	126.5	70%	0.699	69%	0.686	S	S	*	*			trans	-68.5	100.8	179.2	-162.7	0	0	0	0	110.3	A250 R254	A250-S252 VanDerWaalsContact C-N 3.29Å; A250-S252 PolarHBondContact O-N 2.94Å; S252-R254 PolarHBondContact O-N 3.36Å
253	K	33.2	Very low	48.5	Very low	209 Å²	209	131.8 Å²	131.8	91%	0.909	71%	0.706	S	S	*	*			trans	-59.3	98	-179.1	-68.2	179	178.1	177.4	0	111.4	P251	P251-K253 PolarHBondContact O-N 2.82Å
254	R	37.7	Very low	46.4	Very low	223 Å²	223	130.1 Å²	130.1	84%	0.842	70%	0.698	S	S	*	*			trans	-129.8	123.6	163.9	-69.2	-170.2	178.7	-175.6	1.4	109.6	S252	S252-R254 PolarHBondContact O-N 3.36Å
255	S	35.6	Very low	44.6	Very low	116 Å²	116	139.2 Å²	139.2	81%	0.811	74%	0.737	S	S	*	*			trans	-65.2	136.4	-176.9	-45.2	0	0	0	0	111.5
256	P	40.7	Very low	43.3	Very low	127 Å²	127	136.2 Å²	136.2	83%	0.825	73%	0.73	S	S	*	*			trans	-76.3	133.8	174.1	30.9	-33.4	0	0	0	110.9
257	M	40.9	Very low	42.6	Very low	181 Å²	181	136.8 Å²	136.8	89%	0.892	74%	0.735	S	S	*	*			trans	-142.5	141.6	163.2	-83.8	-168.1	70.4	0	0	110.4
258	C	37.2	Very low	42.5	Very low	106 Å²	106	136.7 Å²	136.7	72%	0.716	74%	0.738	S	S	*	*			trans	73.3	85.1	166.3	-141.9	0	0	0	0	118.5
259	N	40.9	Very low	43.4	Very low	145 Å²	145	134.1 Å²	134.1	78%	0.775	73%	0.727	S	S	*	*				76	135.9	122.7	-64.6	-2.2	0	0	0	123.5
260	Q	43.7	Very low	45.1	Very low	186 Å²	186	129.3 Å²	129.3	87%	0.869	72%	0.715	S	S	*	*			trans	72.6	112.7	157.8	-70.5	-168.4	-28.7	0	0	119.4
261	P	40.4	Very low	47.3	Very low	117 Å²	117	131.7 Å²	131.7	76%	0.76	71%	0.714	S	S	*	*			trans	-83.7	130.6	166.9	33.5	-31	0	0	0	111.2
262	S	46.6	Very low	49.6	Very low	94 Å²	94	128.7 Å²	128.7	66%	0.657	70%	0.7	S	S	*	*			trans	-104.6	98.7	160.7	48	0	0	0	0	108.6	N264	S262-N264 VanDerWaalsContact C-N 3.3Å; S262-N264 PolarHBondContact O-N 3.37Å
263	I	45.8	Very low	52.1	Low	157 Å²	157	130 Å²	130	81%	0.805	69%	0.69	S	S	*	*			trans	-73	87.7	-179.6	-58	176	0	0	0	108.7
264	N	46	Very low	54.7	Low	100 Å²	100	122.5 Å²	122.5	54%	0.535	66%	0.659	S	S	.	*			trans	-88.6	137.8	174.2	-69	-41.2	0	0	0	109.5	S262 A266 T267	S262-N264 VanDerWaalsContact C-N 3.3Å; S262-N264 PolarHBondContact O-N 3.37Å; N264-A266 PolarHBondContact O-N 2.58Å; N264-T267 PolarHBondContact O-N 3.2Å; N264-T267 VanDerWaalsContact O-N 3.11Å; N264-T267 PolarHBondContact O-OG1 3.14Å
265	K	49.8	Very low	57	Low	194 Å²	194	117.9 Å²	117.9	84%	0.843	65%	0.645	S	S	*	*	T	Hydrogen-bonded Turn	trans	-61.5	-9.4	-177.1	-69.4	-175.2	175.4	-177.1	0	114.9
266	A	50	Low	59.7	Low	62 Å²	62	117.3 Å²	117.3	51%	0.512	63%	0.632	S	S	.	*	H	α-helix	trans	-68.2	-28.8	173.6	0	0	0	0	0	113.8	N264 I268 T269 E270	N264-A266 PolarHBondContact O-N 2.58Å; A266-I268 VanDerWaalsContact C-N 3.34Å; A266-I268 PolarHBondContact O-N 2.94Å; A266-T269 PolarHBondContact O-N 2.89Å; A266-T269 PolarHBondContact O-OG1 3.43Å; A266-E270 PolarHBondContact O-N 2.93Å; A266-E270 VanDerWaalsContact O-N 3.15Å
267	T	56.1	Low	62	Low	60 Å²	60	111.4 Å²	111.4	37%	0.368	59%	0.594	S	S	.	*	H	α-helix	trans	-64.9	-37.5	-175.5	-48.4	0	0	0	0	112.2	N264 T269 E270 E271	N264-T267 PolarHBondContact O-N 3.2Å; N264-T267 VanDerWaalsContact O-N 3.11Å; N264-T267 PolarHBondContact O-OG1 3.14Å; T267-T269 VanDerWaalsContact C-N 3.3Å; T267-T269 PolarHBondContact O-N 3.34Å; T267-E270 PolarHBondContact O-N 3.41Å; T267-E270 VanDerWaalsContact O-N 3.11Å; T267-E271 HydrophobicContact CG2-CG 4.5Å; T267-E271 WeakPolarHBondContact O-CG 3.44Å; T267-E271 PolarHBondContact O-N 2.66Å
268	I	56.2	Low	64.3	Low	114 Å²	114	104.6 Å²	104.6	59%	0.585	56%	0.564	S	S	*	*	H	α-helix	trans	-64.9	-34.7	179.2	-58.7	173.8	0	0	0	111.5	A266 A272	A266-I268 VanDerWaalsContact C-N 3.34Å; A266-I268 PolarHBondContact O-N 2.94Å; I268-A272 WeakPolarHBondContact O-CB 3.42Å; I268-A272 PolarHBondContact O-N 2.89Å; I268-A272 VanDerWaalsContact O-N 3.17Å
269	T	68.6	Low	67	Low	99 Å²	99	103.8 Å²	103.8	61%	0.607	55%	0.55	S	S	*	*	H	α-helix	trans	-73.4	-31.6	174	36	0	0	0	0	112.9	A266 T267 Y273	A266-T269 PolarHBondContact O-N 2.89Å; A266-T269 PolarHBondContact O-OG1 3.43Å; T267-T269 VanDerWaalsContact C-N 3.3Å; T267-T269 PolarHBondContact O-N 3.34Å; T269-Y273 WeakPolarHBondContact O-CB 3.27Å; T269-Y273 PolarHBondContact O-N 2.67Å
270	E	75.6	Confident	69.4	Low	129 Å²	129	99.5 Å²	99.5	60%	0.603	53%	0.529	S	S	*	.	H	α-helix	trans	-72.7	-42.3	176.8	-167.2	173.2	-174.4	0	0	111.4	A266 T267 Y273 Q274	A266-E270 PolarHBondContact O-N 2.93Å; A266-E270 VanDerWaalsContact O-N 3.15Å; T267-E270 PolarHBondContact O-N 3.41Å; T267-E270 VanDerWaalsContact O-N 3.11Å; E270-Y273 PolarHBondContact O-N 2.7Å; E270-Q274 WeakPolarHBondContact O-CB 3.44Å; E270-Q274 PolarHBondContact O-N 3.1Å
271	E	78.4	Confident	71.7	Confident	121 Å²	121	91.6 Å²	91.6	57%	0.565	49%	0.492	S	S	*	.	H	α-helix	trans	-60.5	-44.9	172.3	-72.6	169.7	-174.6	0	0	112.2	T267 Q274 K275	T267-E271 HydrophobicContact CG2-CG 4.5Å; T267-E271 WeakPolarHBondContact O-CG 3.44Å; T267-E271 PolarHBondContact O-N 2.66Å; E271-Q274 PolarHBondContact O-N 2.75Å; E271-K275 WeakPolarHBondContact O-CB 3.39Å; E271-K275 PolarHBondContact O-N 3.38Å
272	A	84	Confident	74.1	Confident	63 Å²	63	92.2 Å²	92.2	52%	0.521	49%	0.485	S	S	.	.	H	α-helix	trans	-65.1	-39.8	177.4	0	0	0	0	0	112.4	I268 L276	I268-A272 WeakPolarHBondContact O-CB 3.42Å; I268-A272 PolarHBondContact O-N 2.89Å; I268-A272 VanDerWaalsContact O-N 3.17Å; A272-L276 WeakPolarHBondContact O-CB 3.26Å; A272-L276 PolarHBondContact O-N 2.79Å; A272-L276 VanDerWaalsContact O-N 3.09Å
273	Y	86.6	Confident	76.3	Confident	127 Å²	127	92.3 Å²	92.3	50%	0.498	48%	0.475	S	S	.	.	H	α-helix	trans	-64.4	-47.8	173.8	172.4	-96.6	0	0	0	111.8	T269 E270 K275 L276 A277	T269-Y273 WeakPolarHBondContact O-CB 3.27Å; T269-Y273 PolarHBondContact O-N 2.67Å; E270-Y273 PolarHBondContact O-N 2.7Å; Y273-K275 VanDerWaalsContact C-N 3.33Å; Y273-K275 PolarHBondContact O-N 3.5Å; Y273-L276 PolarHBondContact O-N 2.78Å; Y273-A277 WeakPolarHBondContact O-CB 3.45Å; Y273-A277 PolarHBondContact O-N 3.49Å
274	Q	86.9	Confident	78.5	Confident	52 Å²	52	86.8 Å²	86.8	24%	0.243	45%	0.447	C	S	.	.	H	α-helix	trans	-64.7	-39.1	-178.9	-165.4	71.9	78.5	0	0	111.5	T244 L246 E270 E271 A277 S278	T244-Q274 PolarHBondContact O-NE2 3.44Å; T244-Q274 VanDerWaalsContact O-NE2 3.14Å; L246-Q274 VanDerWaalsContact CD2-NE2 3.34Å; E270-Q274 WeakPolarHBondContact O-CB 3.44Å; E270-Q274 PolarHBondContact O-N 3.1Å; E271-Q274 PolarHBondContact O-N 2.75Å; Q274-A277 PolarHBondContact O-N 3.03Å; Q274-S278 PolarHBondContact O-N 2.9Å; Q274-S278 PolarHBondContact O-OG 3.33Å
275	K	88.1	Confident	80.7	Confident	125 Å²	125	84.6 Å²	84.6	54%	0.543	44%	0.435	S	S	.	.	H	α-helix	trans	-61.5	-50.8	174	173.2	166.5	171.9	161.1	0	111.5	E271 Y273 A277 S278 E279	E271-K275 WeakPolarHBondContact O-CB 3.39Å; E271-K275 PolarHBondContact O-N 3.38Å; Y273-K275 VanDerWaalsContact C-N 3.33Å; Y273-K275 PolarHBondContact O-N 3.5Å; K275-A277 VanDerWaalsContact C-N 3.25Å; K275-A277 PolarHBondContact O-N 3.39Å; K275-S278 PolarHBondContact O-N 3.03Å; K275-S278 VanDerWaalsContact O-N 3.12Å; K275-E279 WeakPolarHBondContact CE-OE1 3.27Å; K275-E279 WeakPolarHBondContact CE-OE2 3.27Å; K275-E279 HydrophobicContact CG-CG 4.41Å; K275-E279 IonicContact NZ-OE1 3.57Å; K275-E279 PolarHBondContact NZ-OE1 2.71Å; K275-E279 PolarHBondContact O-N 2.89Å
276	L	90.3	Very high	82.7	Confident	104 Å²	104	82.1 Å²	82.1	55%	0.545	42%	0.421	S	S	.	.	H	α-helix	trans	-60.7	-36.3	178.2	-179.5	62.8	0	0	0	111.9	A272 Y273 T280	A272-L276 WeakPolarHBondContact O-CB 3.26Å; A272-L276 PolarHBondContact O-N 2.79Å; A272-L276 VanDerWaalsContact O-N 3.09Å; Y273-L276 PolarHBondContact O-N 2.78Å; L276-T280 HydrophobicContact CD1-CG2 4.14Å; L276-T280 WeakPolarHBondContact O-CB 3.36Å; L276-T280 WeakPolarHBondContact O-CG2 3.33Å; L276-T280 PolarHBondContact O-N 2.95Å; L276-T280 PolarHBondContact O-OG1 2.91Å
277	A	91	Very high	84.6	Confident	4 Å²	4	81.8 Å²	81.8	3%	0.033	41%	0.414	C	S	.	.	H	α-helix	trans	-65.4	-38.7	174.6	0	0	0	0	0	113	T244 L246 Y273 Q274 K275 T280 L281	T244-A277 HydrophobicContact CG2-CB 3.77Å; L246-A277 HydrophobicContact CD1-CB 4.07Å; L246-A277 WeakPolarHBondContact CD1-O 3.42Å; Y273-A277 WeakPolarHBondContact O-CB 3.45Å; Y273-A277 PolarHBondContact O-N 3.49Å; Q274-A277 PolarHBondContact O-N 3.03Å; K275-A277 VanDerWaalsContact C-N 3.25Å; K275-A277 PolarHBondContact O-N 3.39Å; A277-T280 PolarHBondContact O-OG1 3.48Å; A277-L281 WeakPolarHBondContact O-CB 3.49Å; A277-L281 PolarHBondContact O-N 3.16Å; A277-L281 VanDerWaalsContact O-N 3.09Å
278	S	89.2	Confident	86.3	Confident	38 Å²	38	79.5 Å²	79.5	27%	0.266	40%	0.4	S	S	.	.	H	α-helix	trans	-66.3	-52.1	172.5	-68.8	0	0	0	0	111.4	Q274 K275 T280 L281 E282	Q274-S278 PolarHBondContact O-N 2.9Å; Q274-S278 PolarHBondContact O-OG 3.33Å; K275-S278 PolarHBondContact O-N 3.03Å; K275-S278 VanDerWaalsContact O-N 3.12Å; S278-T280 VanDerWaalsContact C-N 3.27Å; S278-T280 PolarHBondContact O-N 3.34Å; S278-L281 PolarHBondContact O-N 3.27Å; S278-E282 WeakPolarHBondContact O-CG 3.37Å; S278-E282 PolarHBondContact O-N 2.88Å
279	E	92.1	Very high	87.8	Confident	89 Å²	89	77.7 Å²	77.7	42%	0.416	39%	0.391	S	S	.	.	H	α-helix	trans	-57.4	-39.6	-178.5	-71.3	175.7	141.4	0	0	111.8	K275 E283	K275-E279 WeakPolarHBondContact CE-OE1 3.27Å; K275-E279 WeakPolarHBondContact CE-OE2 3.27Å; K275-E279 HydrophobicContact CG-CG 4.41Å; K275-E279 IonicContact NZ-OE1 3.57Å; K275-E279 PolarHBondContact NZ-OE1 2.71Å; K275-E279 PolarHBondContact O-N 2.89Å; E279-E283 PolarHBondContact O-N 2.94Å
280	T	92.5	Very high	88.6	Confident	54 Å²	54	75.4 Å²	75.4	33%	0.331	37%	0.374	S	S	.	.	H	α-helix	trans	-77.7	-25.9	177.1	51.3	0	0	0	0	114.4	F240 L276 A277 S278 L284	F240-T280 WeakPolarHBondContact CZ-OG1 3.38Å; L276-T280 HydrophobicContact CD1-CG2 4.14Å; L276-T280 WeakPolarHBondContact O-CB 3.36Å; L276-T280 WeakPolarHBondContact O-CG2 3.33Å; L276-T280 PolarHBondContact O-N 2.95Å; L276-T280 PolarHBondContact O-OG1 2.91Å; A277-T280 PolarHBondContact O-OG1 3.48Å; S278-T280 VanDerWaalsContact C-N 3.27Å; S278-T280 PolarHBondContact O-N 3.34Å; T280-L284 VanDerWaalsContact O-CB 3.27Å; T280-L284 WeakPolarHBondContact O-CB 3.31Å; T280-L284 PolarHBondContact O-N 3.17Å; T280-L284 VanDerWaalsContact O-N 3.14Å
281	L	91.9	Very high	89.1	Confident	20 Å²	20	71.7 Å²	71.7	11%	0.105	36%	0.358	C	S	.	.	H	α-helix	trans	-72.8	-37.7	169.5	-178.9	57.5	0	0	0	111	R237 F240 A241 L246 A277 S278 L284 D285	R237-L281 HydrophobicContact CG-CD1 3.95Å; F240-L281 HydrophobicContact CD1-CB 4.3Å; F240-L281 HydrophobicContact CD1-CD1 4.27Å; F240-L281 HydrophobicContact CE1-CB 4.08Å; A241-L281 HydrophobicContact CB-CD2 4.13Å; L246-L281 HydrophobicContact CB-CD2 4.06Å; L246-L281 HydrophobicContact CD1-CB 4.19Å; L246-L281 HydrophobicContact CD1-CD2 3.75Å; A277-L281 WeakPolarHBondContact O-CB 3.49Å; A277-L281 PolarHBondContact O-N 3.16Å; A277-L281 VanDerWaalsContact O-N 3.09Å; S278-L281 PolarHBondContact O-N 3.27Å; L281-L284 PolarHBondContact O-N 3.06Å; L281-D285 WeakPolarHBondContact O-CB 3.21Å; L281-D285 PolarHBondContact O-N 3.16Å
282	E	91.2	Very high	89.4	Confident	130 Å²	130	69.3 Å²	69.3	61%	0.607	35%	0.346	S	S	*	.	H	α-helix	trans	-67.1	-45.4	176	-72.5	167.9	-155.6	0	0	111.8	S278 L284 D285 W286	S278-E282 WeakPolarHBondContact O-CG 3.37Å; S278-E282 PolarHBondContact O-N 2.88Å; E282-L284 VanDerWaalsContact C-N 3.29Å; E282-L284 PolarHBondContact O-N 3.34Å; E282-D285 PolarHBondContact O-N 2.72Å; E282-W286 WeakPolarHBondContact O-CB 3.29Å; E282-W286 PolarHBondContact O-N 3Å
283	E	92	Very high	89.4	Confident	97 Å²	97	69.6 Å²	69.6	45%	0.453	34%	0.342	S	S	.	.	H	α-helix	trans	-60.7	-37.6	170.9	-83.7	-156.5	131.9	0	0	111.7	R140 E279 C287	R140-E283 IonicContact CZ-OE1 2.71Å; R140-E283 IonicContact NH1-OE1 2.73Å; R140-E283 PolarHBondContact NH1-OE1 3.12Å; R140-E283 VanDerWaalsContact NH1-OE1 3.12Å; R140-E283 IonicContact NH2-OE1 3.55Å; R140-E283 PolarHBondContact NH2-OE1 2.89Å; E279-E283 PolarHBondContact O-N 2.94Å; E283-C287 WeakPolarHBondContact O-CB 3.48Å; E283-C287 PolarHBondContact O-N 2.93Å; E283-C287 PolarHBondContact O-SG 2.99Å
284	L	92.1	Very high	89	Confident	41 Å²	41	66 Å²	66	22%	0.215	33%	0.331	C	S	.	.	H	α-helix	trans	-69.8	-42.1	179.1	179.4	59.4	0	0	0	112.9	R237 T280 L281 E282 C287 L288	R237-L284 HydrophobicContact CB-CD2 3.77Å; R237-L284 HydrophobicContact CB-CG 4.3Å; R237-L284 HydrophobicContact CG-CD2 4.01Å; R237-L284 HydrophobicContact CG-CG 4.3Å; T280-L284 VanDerWaalsContact O-CB 3.27Å; T280-L284 WeakPolarHBondContact O-CB 3.31Å; T280-L284 PolarHBondContact O-N 3.17Å; T280-L284 VanDerWaalsContact O-N 3.14Å; L281-L284 PolarHBondContact O-N 3.06Å; E282-L284 VanDerWaalsContact C-N 3.29Å; E282-L284 PolarHBondContact O-N 3.34Å; L284-C287 PolarHBondContact O-N 2.91Å; L284-L288 WeakPolarHBondContact O-CG 3.4Å; L284-L288 PolarHBondContact O-N 2.93Å
285	D	92.1	Very high	88.3	Confident	53 Å²	53	68.2 Å²	68.2	28%	0.283	34%	0.341	S	S	.	.	H	α-helix	trans	-67.9	-37.9	176.4	-80.4	-11.8	0	0	0	111.4	R237 L281 E282 L288 D289	R237-D285 WeakPolarHBondContact CD-OD1 3.36Å; R237-D285 VanDerWaalsContact CG-OD1 3.23Å; R237-D285 WeakPolarHBondContact CG-OD1 3.31Å; R237-D285 IonicContact CZ-OD1 2.82Å; R237-D285 IonicContact CZ-OD2 2.7Å; R237-D285 IonicContact NE-OD1 3.95Å; R237-D285 PolarHBondContact NE-OD1 3.23Å; R237-D285 IonicContact NE-OD2 2.87Å; R237-D285 PolarHBondContact NE-OD2 3.37Å; R237-D285 IonicContact NH2-OD1 3.54Å; R237-D285 IonicContact NH2-OD2 3.16Å; R237-D285 PolarHBondContact NH2-OD2 3.41Å; L281-D285 WeakPolarHBondContact O-CB 3.21Å; L281-D285 PolarHBondContact O-N 3.16Å; E282-D285 PolarHBondContact O-N 2.72Å; D285-L288 PolarHBondContact O-N 3.44Å; D285-D289 PolarHBondContact O-N 3.03Å
286	W	91.3	Very high	87.4	Confident	143 Å²	143	67.6 Å²	67.6	54%	0.542	35%	0.348	S	S	.	.	H	α-helix	trans	-61.6	-46.6	170	180	85.9	0	0	0	111.7	E282 L288 D289 Q290	E282-W286 WeakPolarHBondContact O-CB 3.29Å; E282-W286 PolarHBondContact O-N 3Å; W286-L288 VanDerWaalsContact C-N 3.28Å; W286-L288 PolarHBondContact O-N 3.48Å; W286-D289 PolarHBondContact O-N 2.89Å; W286-Q290 HydrophobicContact CD2-CG 4.02Å; W286-Q290 HydrophobicContact CE3-CG 4.36Å; W286-Q290 HydrophobicContact CH2-CG 4.11Å; W286-Q290 HydrophobicContact CZ2-CG 3.75Å; W286-Q290 HydrophobicContact CZ3-CG 4.4Å; W286-Q290 WeakPolarHBondContact O-CG 3.08Å; W286-Q290 PolarHBondContact O-N 3.43Å
287	C	91.3	Very high	86.7	Confident	55 Å²	55	69.5 Å²	69.5	37%	0.372	35%	0.348	S	S	.	.	H	α-helix	trans	-59.9	-38.3	176	-71.8	0	0	0	0	112.3	E283 L284 L291	E283-C287 WeakPolarHBondContact O-CB 3.48Å; E283-C287 PolarHBondContact O-N 2.93Å; E283-C287 PolarHBondContact O-SG 2.99Å; L284-C287 PolarHBondContact O-N 2.91Å; C287-L291 WeakPolarHBondContact O-CB 3.34Å; C287-L291 VanDerWaalsContact O-CG 3.27Å; C287-L291 WeakPolarHBondContact O-CG 3.25Å; C287-L291 PolarHBondContact O-N 3.26Å
288	L	90.2	Very high	86	Confident	11 Å²	11	75.3 Å²	75.3	6%	0.058	37%	0.374	C	S	.	.	H	α-helix	trans	-66.3	-47.2	176.4	-81.3	171.1	0	0	0	112.2	L233 R234 R237 L284 D285 W286 Q290 L291 E292	L233-L288 HydrophobicContact CB-CD2 3.75Å; R234-L288 HydrophobicContact CG-CD1 4.45Å; R234-L288 HydrophobicContact CG-CD2 4.15Å; R237-L288 HydrophobicContact CB-CD1 3.9Å; R237-L288 HydrophobicContact CG-CD1 3.91Å; L284-L288 WeakPolarHBondContact O-CG 3.4Å; L284-L288 PolarHBondContact O-N 2.93Å; D285-L288 PolarHBondContact O-N 3.44Å; W286-L288 VanDerWaalsContact C-N 3.28Å; W286-L288 PolarHBondContact O-N 3.48Å; L288-Q290 PolarHBondContact O-N 3.19Å; L288-L291 PolarHBondContact O-N 3Å; L288-E292 WeakPolarHBondContact O-CG 3.42Å; L288-E292 PolarHBondContact O-N 3.43Å
289	D	89	Confident	85.5	Confident	77 Å²	77	76.1 Å²	76.1	41%	0.412	38%	0.38	S	S	.	.	H	α-helix	trans	-59.3	-46.7	176.1	179	83.8	0	0	0	111.3	D285 W286 L291 E292 T293	D285-D289 PolarHBondContact O-N 3.03Å; W286-D289 PolarHBondContact O-N 2.89Å; D289-L291 VanDerWaalsContact C-N 3.35Å; D289-L291 PolarHBondContact O-N 3.27Å; D289-E292 PolarHBondContact O-N 2.79Å; D289-E292 VanDerWaalsContact O-N 3.07Å; D289-T293 WeakPolarHBondContact O-CG2 3.28Å; D289-T293 PolarHBondContact O-N 3.44Å; D289-T293 VanDerWaalsContact O-N 3.1Å
290	Q	85.4	Confident	84.9	Confident	51 Å²	51	72.6 Å²	72.6	24%	0.238	36%	0.364	C	S	.	.	H	α-helix	trans	-59.9	-42.8	176.8	-65.2	-53.1	-85.8	0	0	112.1	W286 L288 E292 T293	W286-Q290 HydrophobicContact CD2-CG 4.02Å; W286-Q290 HydrophobicContact CE3-CG 4.36Å; W286-Q290 HydrophobicContact CH2-CG 4.11Å; W286-Q290 HydrophobicContact CZ2-CG 3.75Å; W286-Q290 HydrophobicContact CZ3-CG 4.4Å; W286-Q290 WeakPolarHBondContact O-CG 3.08Å; W286-Q290 PolarHBondContact O-N 3.43Å; L288-Q290 PolarHBondContact O-N 3.19Å; Q290-E292 PolarHBondContact O-N 3.14Å; Q290-T293 PolarHBondContact O-N 3.15Å; Q290-T293 PolarHBondContact O-OG1 2.83Å
291	L	86.1	Confident	84.2	Confident	51 Å²	51	73.4 Å²	73.4	27%	0.267	37%	0.373	S	S	.	.	H	α-helix	trans	-61.3	-40.5	173.2	-75.4	171.2	0	0	0	112.2	F226 L230 L233 C287 L288 D289 T293 L294	F226-L291 HydrophobicContact CE2-CD2 4.22Å; F226-L291 HydrophobicContact CZ-CB 4.33Å; F226-L291 HydrophobicContact CZ-CD2 4.38Å; F226-L291 WeakPolarHBondContact CZ-O 3.24Å; L230-L291 HydrophobicContact CD1-CB 4.11Å; L233-L291 HydrophobicContact CD1-CD1 3.76Å; C287-L291 WeakPolarHBondContact O-CB 3.34Å; C287-L291 VanDerWaalsContact O-CG 3.27Å; C287-L291 WeakPolarHBondContact O-CG 3.25Å; C287-L291 PolarHBondContact O-N 3.26Å; L288-L291 PolarHBondContact O-N 3Å; D289-L291 VanDerWaalsContact C-N 3.35Å; D289-L291 PolarHBondContact O-N 3.27Å; L291-T293 VanDerWaalsContact C-N 3.28Å; L291-T293 PolarHBondContact O-N 2.79Å; L291-L294 HydrophobicContact CD2-CD1 4.3Å; L291-L294 WeakPolarHBondContact O-CB 3.44Å; L291-L294 PolarHBondContact O-N 3.32Å
292	E	84	Confident	83.8	Confident	70 Å²	70	77.8 Å²	77.8	33%	0.327	39%	0.392	S	S	.	.	H	α-helix	trans	-63.3	-32.7	178.2	-71.2	-175.4	-155.3	0	0	112.2	L230 R234 L288 D289 Q290 L294 Q295	L230-E292 HydrophobicContact CD1-CG 3.84Å; L230-E292 HydrophobicContact CD2-CG 4Å; L230-E292 HydrophobicContact CG-CG 4.45Å; R234-E292 IonicContact CZ-OE1 3.14Å; R234-E292 IonicContact CZ-OE2 3.87Å; R234-E292 IonicContact NE-OE1 2.72Å; R234-E292 PolarHBondContact NE-OE1 2.97Å; R234-E292 IonicContact NH2-OE1 2.7Å; R234-E292 PolarHBondContact NH2-OE1 3.48Å; R234-E292 IonicContact NH2-OE2 3.77Å; R234-E292 PolarHBondContact NH2-OE2 2.84Å; L288-E292 WeakPolarHBondContact O-CG 3.42Å; L288-E292 PolarHBondContact O-N 3.43Å; D289-E292 PolarHBondContact O-N 2.79Å; D289-E292 VanDerWaalsContact O-N 3.07Å; Q290-E292 PolarHBondContact O-N 3.14Å; E292-L294 PolarHBondContact O-N 3.04Å; E292-Q295 WeakPolarHBondContact O-CB 3.41Å; E292-Q295 PolarHBondContact O-N 2.98Å
293	T	83	Confident	83.2	Confident	69 Å²	69	75.5 Å²	75.5	42%	0.423	38%	0.383	S	S	.	.	H	α-helix	trans	-64.5	-18.9	171.5	77.3	0	0	0	0	114.4	D289 Q290 L291	D289-T293 WeakPolarHBondContact O-CG2 3.28Å; D289-T293 PolarHBondContact O-N 3.44Å; D289-T293 VanDerWaalsContact O-N 3.1Å; Q290-T293 PolarHBondContact O-N 3.15Å; Q290-T293 PolarHBondContact O-OG1 2.83Å; L291-T293 VanDerWaalsContact C-N 3.28Å; L291-T293 PolarHBondContact O-N 2.79Å
294	L	78.8	Confident	82.7	Confident	52 Å²	52	72.1 Å²	72.1	27%	0.272	37%	0.371	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.1	-12.8	178.5	-52.5	-176.5	0	0	0	113	F226 L291 E292 T296 R297 V300	F226-L294 HydrophobicContact CZ-CB 4.36Å; L291-L294 HydrophobicContact CD2-CD1 4.3Å; L291-L294 WeakPolarHBondContact O-CB 3.44Å; L291-L294 PolarHBondContact O-N 3.32Å; E292-L294 PolarHBondContact O-N 3.04Å; L294-T296 PolarHBondContact O-N 3.39Å; L294-R297 VanDerWaalsContact CD2-CZ 3.46Å; L294-R297 WeakPolarHBondContact O-CB 3.32Å; L294-R297 PolarHBondContact O-N 3.38Å; L294-V300 WeakPolarHBondContact O-CG2 3.5Å
295	Q	72.3	Confident	82.2	Confident	98 Å²	98	72.8 Å²	72.8	46%	0.458	38%	0.379	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.7	-26.6	-166.1	-171.6	173.2	-8.8	0	0	114.6	F226 E292	F226-Q295 HydrophobicContact CD1-CG 4.46Å; F226-Q295 HydrophobicContact CE1-CB 4.12Å; F226-Q295 HydrophobicContact CE1-CG 4.34Å; E292-Q295 WeakPolarHBondContact O-CB 3.41Å; E292-Q295 PolarHBondContact O-N 2.98Å
296	T	70.4	Confident	81.8	Confident	112 Å²	112	72 Å²	72	69%	0.687	38%	0.375	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.3	-4.1	-179.6	54.5	0	0	0	0	114.3	L294	L294-T296 PolarHBondContact O-N 3.39Å
297	R	75.4	Confident	81.3	Confident	144 Å²	144	68.4 Å²	68.4	54%	0.543	36%	0.363	S	S	.	.	S	Bend	trans	-76.5	154	-176.4	-61.1	-170.6	-173	-163.1	5.2	112	L294 S299 V300	L294-R297 VanDerWaalsContact CD2-CZ 3.46Å; L294-R297 WeakPolarHBondContact O-CB 3.32Å; L294-R297 PolarHBondContact O-N 3.38Å; R297-S299 PolarHBondContact O-N 2.82Å; R297-S299 VanDerWaalsContact O-N 3.16Å; R297-V300 PolarHBondContact O-N 3.11Å
298	H	76.4	Confident	80.9	Confident	127 Å²	127	70.6 Å²	70.6	59%	0.588	37%	0.367	S	S	*	.	H	α-helix	trans	-56.8	-32.8	-179.2	-75	-85.6	0	0	0	113.3	Q40 V300 S301 E302	Q40-H298 PolarHBondContact NE2-NE2 2.79Å; H298-V300 VanDerWaalsContact C-N 3.28Å; H298-V300 PolarHBondContact O-N 3.43Å; H298-S301 WeakPolarHBondContact O-CA 3.4Å; H298-S301 WeakPolarHBondContact O-CB 3.43Å; H298-S301 PolarHBondContact O-N 2.91Å; H298-S301 PolarHBondContact O-OG 3.49Å; H298-E302 PolarHBondContact O-N 2.88Å
299	S	77.5	Confident	80.6	Confident	54 Å²	54	72 Å²	72	38%	0.378	37%	0.372	S	S	.	.	H	α-helix	trans	-55.8	-35.7	174.6	54	0	0	0	0	113.8	R297 E302 M303	R297-S299 PolarHBondContact O-N 2.82Å; R297-S299 VanDerWaalsContact O-N 3.16Å; S299-E302 PolarHBondContact O-N 2.89Å; S299-M303 WeakPolarHBondContact O-CG 3.48Å; S299-M303 PolarHBondContact O-N 2.86Å
300	V	79	Confident	80.4	Confident	15 Å²	15	77.3 Å²	77.3	9%	0.091	39%	0.387	C	S	.	.	H	α-helix	trans	-69.8	-38.6	176.3	174.8	0	0	0	0	111.3	F226 L294 R297 H298 E302 M303 A304	F226-V300 HydrophobicContact CB-CG1 3.81Å; F226-V300 HydrophobicContact CB-CG2 4.43Å; F226-V300 HydrophobicContact CD1-CG1 4Å; F226-V300 HydrophobicContact CD1-CG2 3.95Å; F226-V300 HydrophobicContact CD2-CG2 4.04Å; F226-V300 HydrophobicContact CE1-CG2 4.23Å; F226-V300 HydrophobicContact CE2-CG2 4.31Å; F226-V300 HydrophobicContact CG-CG1 3.98Å; F226-V300 HydrophobicContact CG-CG2 3.86Å; F226-V300 HydrophobicContact CZ-CG2 4.4Å; L294-V300 WeakPolarHBondContact O-CG2 3.5Å; R297-V300 PolarHBondContact O-N 3.11Å; H298-V300 VanDerWaalsContact C-N 3.28Å; H298-V300 PolarHBondContact O-N 3.43Å; V300-E302 VanDerWaalsContact C-N 3.32Å; V300-M303 HydrophobicContact CG2-CE 4.41Å; V300-A304 PolarHBondContact O-N 2.69Å
301	S	79.7	Confident	80.3	Confident	72 Å²	72	79.2 Å²	79.2	50%	0.503	40%	0.397	S	S	.	.	H	α-helix	trans	-66.9	-35.1	173.2	79.5	0	0	0	0	111.8	H298 A304 S305	H298-S301 WeakPolarHBondContact O-CA 3.4Å; H298-S301 WeakPolarHBondContact O-CB 3.43Å; H298-S301 PolarHBondContact O-N 2.91Å; H298-S301 PolarHBondContact O-OG 3.49Å; S301-A304 PolarHBondContact O-N 2.91Å; S301-S305 WeakPolarHBondContact O-CB 3.37Å; S301-S305 PolarHBondContact O-N 3.15Å
302	E	81.8	Confident	80.3	Confident	111 Å²	111	78.7 Å²	78.7	52%	0.519	39%	0.394	S	S	.	.	H	α-helix	trans	-70.8	-44.5	177.9	-157.5	-152.5	144.6	0	0	111.8	H298 S299 V300 A304 S305 N306	H298-E302 PolarHBondContact O-N 2.88Å; S299-E302 PolarHBondContact O-N 2.89Å; V300-E302 VanDerWaalsContact C-N 3.32Å; E302-A304 PolarHBondContact O-N 2.73Å; E302-S305 CarbonylContact O-C 3.59Å; E302-S305 WeakPolarHBondContact O-CB 3.46Å; E302-S305 PolarHBondContact O-N 2.9Å; E302-S305 VanDerWaalsContact O-N 3.14Å; E302-N306 WeakPolarHBondContact O-CB 3.33Å; E302-N306 PolarHBondContact O-N 3.3Å; E302-N306 PolarHBondContact OE1-ND2 3Å
303	M	78.5	Confident	80.4	Confident	83 Å²	83	78.9 Å²	78.9	41%	0.409	40%	0.397	S	S	.	.	H	α-helix	trans	-55.7	-41.7	173.1	-71.7	-178.4	-123.6	0	0	111.6	P225 F226 S299 V300 K307	P225-M303 HydrophobicContact CG-CB 3.81Å; P225-M303 WeakPolarHBondContact CG-O 3.34Å; F226-M303 HydrophobicContact CD2-CE 4.13Å; F226-M303 HydrophobicContact CD2-SD 4.3Å; S299-M303 WeakPolarHBondContact O-CG 3.48Å; S299-M303 PolarHBondContact O-N 2.86Å; V300-M303 HydrophobicContact CG2-CE 4.41Å; M303-K307 WeakPolarHBondContact O-CB 3.46Å; M303-K307 PolarHBondContact O-N 2.83Å
304	A	82.6	Confident	80.5	Confident	26 Å²	26	84.9 Å²	84.9	22%	0.215	41%	0.412	C	S	.	.	H	α-helix	trans	-66.5	-45.8	175.6	0	0	0	0	0	112.1	T224 V300 S301 E302 N306 K307 F308	T224-A304 HydrophobicContact CG2-CB 3.96Å; V300-A304 PolarHBondContact O-N 2.69Å; S301-A304 PolarHBondContact O-N 2.91Å; E302-A304 PolarHBondContact O-N 2.73Å; A304-N306 PolarHBondContact O-N 2.99Å; A304-K307 PolarHBondContact O-N 3.45Å; A304-F308 PolarHBondContact O-N 3.48Å
305	S	81.4	Confident	80.9	Confident	54 Å²	54	87.7 Å²	87.7	38%	0.378	42%	0.424	S	S	.	.	H	α-helix	trans	-57.6	-47	174.9	-173.4	0	0	0	0	111.6	S301 E302 F308 K309	S301-S305 WeakPolarHBondContact O-CB 3.37Å; S301-S305 PolarHBondContact O-N 3.15Å; E302-S305 CarbonylContact O-C 3.59Å; E302-S305 WeakPolarHBondContact O-CB 3.46Å; E302-S305 PolarHBondContact O-N 2.9Å; E302-S305 VanDerWaalsContact O-N 3.14Å; S305-F308 CarbonylContact O-C 3.23Å; S305-F308 PolarHBondContact O-N 2.93Å; S305-F308 VanDerWaalsContact O-N 3.16Å; S305-K309 WeakPolarHBondContact O-CB 3.48Å; S305-K309 WeakPolarHBondContact O-CG 3.32Å; S305-K309 PolarHBondContact O-N 3.12Å
306	N	82.8	Confident	81.6	Confident	38 Å²	38	83.4 Å²	83.4	20%	0.203	40%	0.404	C	S	.	.	H	α-helix	trans	-69.6	-34.6	179.9	-71.3	-23.8	0	0	0	112.6	E302 A304 R310	E302-N306 WeakPolarHBondContact O-CB 3.33Å; E302-N306 PolarHBondContact O-N 3.3Å; E302-N306 PolarHBondContact OE1-ND2 3Å; A304-N306 PolarHBondContact O-N 2.99Å; N306-R310 WeakPolarHBondContact O-CB 3.5Å; N306-R310 VanDerWaalsContact O-CG 3.24Å; N306-R310 WeakPolarHBondContact O-CG 3.49Å; N306-R310 PolarHBondContact O-N 3.05Å; N306-R310 VanDerWaalsContact O-N 3.11Å
307	K	82.4	Confident	82.4	Confident	67 Å²	67	81.8 Å²	81.8	29%	0.291	39%	0.394	S	S	.	.	H	α-helix	trans	-59.9	-45.6	168.1	-174.9	-178.4	-178.1	178.9	0	110.5	V223 P225 M303 A304 M311	V223-K307 PolarHBondContact O-NZ 3.01Å; P225-K307 HydrophobicContact CB-CD 4.05Å; P225-K307 HydrophobicContact CG-CB 4.28Å; P225-K307 HydrophobicContact CG-CD 4.07Å; M303-K307 WeakPolarHBondContact O-CB 3.46Å; M303-K307 PolarHBondContact O-N 2.83Å; A304-K307 PolarHBondContact O-N 3.45Å; K307-M311 WeakPolarHBondContact O-CB 3.31Å; K307-M311 PolarHBondContact O-N 3.24Å
308	F	83	Confident	83	Confident	100 Å²	100	79.9 Å²	79.9	44%	0.439	39%	0.391	S	S	.	.	H	α-helix	trans	-67.7	-47.5	179.1	-175.3	-98.5	0	0	0	112.8	A304 S305 R310 M311 L312	A304-F308 PolarHBondContact O-N 3.48Å; S305-F308 CarbonylContact O-C 3.23Å; S305-F308 PolarHBondContact O-N 2.93Å; S305-F308 VanDerWaalsContact O-N 3.16Å; F308-R310 VanDerWaalsContact C-N 3.31Å; F308-R310 PolarHBondContact O-N 3.07Å; F308-M311 PolarHBondContact O-N 3.18Å; F308-L312 HydrophobicContact CE1-CD2 4.12Å; F308-L312 WeakPolarHBondContact O-CB 3.13Å; F308-L312 PolarHBondContact O-N 3.36Å
309	K	83.2	Confident	83.4	Confident	41 Å²	41	75.5 Å²	75.5	18%	0.178	37%	0.372	C	S	.	.	H	α-helix	trans	-53.8	-45.6	175.2	-72.4	-178.5	177.3	-174.4	0	111.1	S305 N313 L338 D339	S305-K309 WeakPolarHBondContact O-CB 3.48Å; S305-K309 WeakPolarHBondContact O-CG 3.32Å; S305-K309 PolarHBondContact O-N 3.12Å; K309-N313 WeakPolarHBondContact O-CB 3.45Å; K309-N313 PolarHBondContact O-N 2.76Å; K309-N313 PolarHBondContact O-ND2 2.86Å; K309-L338 HydrophobicContact CB-CD2 3.89Å; K309-L338 HydrophobicContact CG-CD2 4.04Å; K309-D339 IonicContact NZ-OD2 2.76Å; K309-D339 PolarHBondContact NZ-OD2 3.36Å
310	R	84	Confident	83.9	Confident	189 Å²	189	74.7 Å²	74.7	71%	0.713	37%	0.366	S	S	*	.	H	α-helix	trans	-66.3	-43	177.3	-70.5	172.8	-172.3	171.7	4.3	113	N306 F308 N313 R314	N306-R310 WeakPolarHBondContact O-CB 3.5Å; N306-R310 VanDerWaalsContact O-CG 3.24Å; N306-R310 WeakPolarHBondContact O-CG 3.49Å; N306-R310 PolarHBondContact O-N 3.05Å; N306-R310 VanDerWaalsContact O-N 3.11Å; F308-R310 VanDerWaalsContact C-N 3.31Å; F308-R310 PolarHBondContact O-N 3.07Å; R310-N313 PolarHBondContact O-N 3.1Å; R310-R314 PolarHBondContact O-N 3.27Å
311	M	84.5	Confident	84.4	Confident	91 Å²	91	81.1 Å²	81.1	45%	0.448	40%	0.395	S	S	.	.	H	α-helix	trans	-62.9	-47	176.6	-178.8	-176.3	-75.2	0	0	111.4	K307 F308 R314 E315	K307-M311 WeakPolarHBondContact O-CB 3.31Å; K307-M311 PolarHBondContact O-N 3.24Å; F308-M311 PolarHBondContact O-N 3.18Å; M311-R314 PolarHBondContact O-N 3Å; M311-E315 PolarHBondContact O-N 3.17Å
312	L	85.5	Confident	84.8	Confident	39 Å²	39	82.6 Å²	82.6	20%	0.204	40%	0.395	C	S	.	.	H	α-helix	trans	-61.3	-46.5	176.8	-179.1	60.3	0	0	0	111.2	F308 R314 E315 L316 I333 L338	F308-L312 HydrophobicContact CE1-CD2 4.12Å; F308-L312 WeakPolarHBondContact O-CB 3.13Å; F308-L312 PolarHBondContact O-N 3.36Å; L312-R314 VanDerWaalsContact C-N 3.29Å; L312-R314 PolarHBondContact O-N 3.46Å; L312-E315 PolarHBondContact O-N 3.26Å; L312-E315 VanDerWaalsContact O-N 3.16Å; L312-L316 HydrophobicContact CD1-CD1 4.12Å; L312-L316 HydrophobicContact CD1-CD2 4.31Å; L312-L316 HydrophobicContact CD1-CG 3.98Å; L312-L316 HydrophobicContact CG-CD1 3.92Å; L312-L316 HydrophobicContact CG-CG 4.18Å; L312-L316 WeakPolarHBondContact O-CB 3.26Å; L312-L316 VanDerWaalsContact O-CG 3.28Å; L312-L316 WeakPolarHBondContact O-CG 3.47Å; L312-L316 PolarHBondContact O-N 3.13Å; L312-I333 HydrophobicContact CD2-CG2 4.44Å; L312-L338 HydrophobicContact CD2-CD1 3.9Å; L312-L338 HydrophobicContact CD2-CD2 4.27Å; L312-L338 HydrophobicContact CD2-CG 3.88Å; L312-L338 HydrophobicContact CG-CD1 4.01Å; L312-L338 HydrophobicContact CG-CG 4.45Å
313	N	85.4	Confident	85	Confident	75 Å²	75	79.7 Å²	79.7	40%	0.401	39%	0.387	S	S	.	.	H	α-helix	trans	-53.5	-44.1	175.4	-83.7	-25.1	0	0	0	112.4	K309 R310 L316 T317 L338	K309-N313 WeakPolarHBondContact O-CB 3.45Å; K309-N313 PolarHBondContact O-N 2.76Å; K309-N313 PolarHBondContact O-ND2 2.86Å; R310-N313 PolarHBondContact O-N 3.1Å; N313-L316 PolarHBondContact O-N 3.4Å; N313-T317 PolarHBondContact O-N 3.31Å; N313-T317 PolarHBondContact O-OG1 3.29Å; N313-L338 WeakPolarHBondContact OD1-CD1 3.48Å
314	R	87.2	Confident	85.2	Confident	194 Å²	194	85.7 Å²	85.7	73%	0.732	41%	0.405	S	S	*	.	H	α-helix	trans	-61	-45.8	177.5	179.6	178.5	173.8	175.7	-2.5	112.5	R310 M311 L312 L316 T317 H318	R310-R314 PolarHBondContact O-N 3.27Å; M311-R314 PolarHBondContact O-N 3Å; L312-R314 VanDerWaalsContact C-N 3.29Å; L312-R314 PolarHBondContact O-N 3.46Å; R314-L316 VanDerWaalsContact C-N 3.32Å; R314-L316 PolarHBondContact O-N 3.3Å; R314-T317 PolarHBondContact O-N 3.04Å; R314-H318 PolarHBondContact O-N 3.41Å; R314-H318 VanDerWaalsContact O-N 3.16Å
315	E	86.6	Confident	85.4	Confident	111 Å²	111	88 Å²	88	52%	0.519	42%	0.42	S	S	.	.	H	α-helix	trans	-66.1	-34.4	176.5	-70.1	-58.5	126	0	0	112.2	M311 L312 L319	M311-E315 PolarHBondContact O-N 3.17Å; L312-E315 PolarHBondContact O-N 3.26Å; L312-E315 VanDerWaalsContact O-N 3.16Å; E315-L319 VanDerWaalsContact O-CB 3.27Å; E315-L319 WeakPolarHBondContact O-CB 3.49Å; E315-L319 PolarHBondContact O-N 2.89Å
316	L	87.3	Confident	85.6	Confident	8 Å²	8	85.7 Å²	85.7	4%	0.042	41%	0.405	C	S	.	.	H	α-helix	trans	-73.6	-32.5	176.7	-67.3	-174.5	0	0	0	113	L312 N313 R314 L319 S320 S330 I333 S334 L338	L312-L316 HydrophobicContact CD1-CD1 4.12Å; L312-L316 HydrophobicContact CD1-CD2 4.31Å; L312-L316 HydrophobicContact CD1-CG 3.98Å; L312-L316 HydrophobicContact CG-CD1 3.92Å; L312-L316 HydrophobicContact CG-CG 4.18Å; L312-L316 WeakPolarHBondContact O-CB 3.26Å; L312-L316 VanDerWaalsContact O-CG 3.28Å; L312-L316 WeakPolarHBondContact O-CG 3.47Å; L312-L316 PolarHBondContact O-N 3.13Å; N313-L316 PolarHBondContact O-N 3.4Å; R314-L316 VanDerWaalsContact C-N 3.32Å; R314-L316 PolarHBondContact O-N 3.3Å; L316-L319 HydrophobicContact CD2-CD2 4.04Å; L316-L319 PolarHBondContact O-N 2.81Å; L316-S320 WeakPolarHBondContact O-CB 3.27Å; L316-S320 PolarHBondContact O-N 3.12Å; L316-S330 WeakPolarHBondContact CB-OG 3.44Å; L316-S330 WeakPolarHBondContact O-CB 3.19Å; L316-S330 PolarHBondContact O-OG 2.77Å; L316-I333 HydrophobicContact CD1-CB 3.95Å; L316-I333 HydrophobicContact CD1-CG2 3.62Å; L316-I333 HydrophobicContact CD2-CB 4.1Å; L316-I333 HydrophobicContact CD2-CD1 3.9Å; L316-I333 HydrophobicContact CD2-CG2 4.09Å; L316-I333 HydrophobicContact CG-CG2 4.47Å; L316-S334 WeakPolarHBondContact CD1-OG 3.33Å; L316-L338 HydrophobicContact CD1-CD1 3.46Å; L316-L338 VanDerWaalsContact CD1-CD1 3.46Å
317	T	87.3	Confident	85.9	Confident	79 Å²	79	86.1 Å²	86.1	49%	0.485	41%	0.407	S	S	.	.	H	α-helix	trans	-61.3	-51.4	168.8	-55.8	0	0	0	0	110.4	N313 R314 L319 S320 E321	N313-T317 PolarHBondContact O-N 3.31Å; N313-T317 PolarHBondContact O-OG1 3.29Å; R314-T317 PolarHBondContact O-N 3.04Å; T317-L319 VanDerWaalsContact C-N 3.34Å; T317-L319 PolarHBondContact O-N 3.29Å; T317-S320 WeakPolarHBondContact O-CB 3.4Å; T317-S320 PolarHBondContact O-N 3.14Å; T317-S320 VanDerWaalsContact O-N 3.07Å; T317-E321 PolarHBondContact O-N 3.33Å; T317-E321 VanDerWaalsContact O-N 3.09Å
318	H	87.9	Confident	86.1	Confident	103 Å²	103	88.4 Å²	88.4	48%	0.477	42%	0.419	S	S	.	.	H	α-helix	trans	-60	-42.5	177.2	-177	-127.6	0	0	0	111.9	R314 S320 E321 M322	R314-H318 PolarHBondContact O-N 3.41Å; R314-H318 VanDerWaalsContact O-N 3.16Å; H318-S320 VanDerWaalsContact C-N 3.29Å; H318-S320 PolarHBondContact O-N 2.85Å; H318-E321 PolarHBondContact O-N 3.45Å; H318-M322 WeakPolarHBondContact O-CG 3.49Å; H318-M322 PolarHBondContact O-N 2.95Å
319	L	83.9	Confident	86.3	Confident	36 Å²	36	87 Å²	87	19%	0.188	42%	0.418	C	S	.	.	H	α-helix	trans	-61.4	-34	174.6	-176.3	63	0	0	0	113.2	E315 L316 T317 M322 G326 V329	E315-L319 VanDerWaalsContact O-CB 3.27Å; E315-L319 WeakPolarHBondContact O-CB 3.49Å; E315-L319 PolarHBondContact O-N 2.89Å; L316-L319 HydrophobicContact CD2-CD2 4.04Å; L316-L319 PolarHBondContact O-N 2.81Å; T317-L319 VanDerWaalsContact C-N 3.34Å; T317-L319 PolarHBondContact O-N 3.29Å; L319-M322 HydrophobicContact CD1-CE 3.99Å; L319-G326 CarbonylContact O-C 3.5Å; L319-G326 VanDerWaalsContact O-C 3.23Å; L319-G326 WeakPolarHBondContact O-CA 3.35Å; L319-V329 HydrophobicContact CD2-CB 4.42Å; L319-V329 HydrophobicContact CD2-CG1 3.98Å
320	S	87.8	Confident	86.4	Confident	36 Å²	36	85.4 Å²	85.4	25%	0.252	41%	0.412	S	S	.	.	H	α-helix	trans	-66.4	-48.4	175.2	173.9	0	0	0	0	111.6	L316 T317 H318 M322 N327	L316-S320 WeakPolarHBondContact O-CB 3.27Å; L316-S320 PolarHBondContact O-N 3.12Å; T317-S320 WeakPolarHBondContact O-CB 3.4Å; T317-S320 PolarHBondContact O-N 3.14Å; T317-S320 VanDerWaalsContact O-N 3.07Å; H318-S320 VanDerWaalsContact C-N 3.29Å; H318-S320 PolarHBondContact O-N 2.85Å; S320-M322 VanDerWaalsContact C-N 3.29Å; S320-M322 PolarHBondContact O-N 3.19Å; S320-N327 WeakPolarHBondContact CB-OD1 3.36Å; S320-N327 PolarHBondContact OG-OD1 2.81Å
321	E	90.8	Very high	86.4	Confident	151 Å²	151	81 Å²	81	71%	0.706	40%	0.4	S	S	*	.	H	α-helix	trans	-62.6	-34.2	179.1	-67.5	172.3	-178.6	0	0	112.7	T317 H318 S323	T317-E321 PolarHBondContact O-N 3.33Å; T317-E321 VanDerWaalsContact O-N 3.09Å; H318-E321 PolarHBondContact O-N 3.45Å; E321-S323 PolarHBondContact O-N 3.47Å
322	M	87	Confident	86.6	Confident	102 Å²	102	82.6 Å²	82.6	50%	0.502	41%	0.405	S	S	.	.	H	α-helix	trans	-61.8	-32.7	-176.6	-77.9	160.3	49.8	0	0	114.9	H318 L319 S320	H318-M322 WeakPolarHBondContact O-CG 3.49Å; H318-M322 PolarHBondContact O-N 2.95Å; L319-M322 HydrophobicContact CD1-CE 3.99Å; S320-M322 VanDerWaalsContact C-N 3.29Å; S320-M322 PolarHBondContact O-N 3.19Å
323	S	85.6	Confident	86.6	Confident	50 Å²	50	82.7 Å²	82.7	35%	0.35	41%	0.405	S	S	.	.			trans	-173.3	159.5	178.7	57	0	0	0	0	113.2	E321 S325 G326 N327	E321-S323 PolarHBondContact O-N 3.47Å; S323-S325 VanDerWaalsContact C-N 3.28Å; S323-S325 PolarHBondContact O-N 3.3Å; S323-S325 PolarHBondContact OG-OG 3.44Å; S323-G326 CarbonylContact O-C 3.6Å; S323-G326 WeakPolarHBondContact O-CA 3.15Å; S323-G326 PolarHBondContact O-N 2.95Å; S323-G326 WeakPolarHBondContact OG-CA 3.38Å; S323-G326 PolarHBondContact OG-N 3.35Å; S323-N327 PolarHBondContact O-N 3.02Å
324	R	83.8	Confident	86.6	Confident	210 Å²	210	80.3 Å²	80.3	79%	0.792	39%	0.394	S	S	*	.	H	α-helix	trans	-56.9	-37.8	173.9	-175.3	177.3	179.6	-178.6	1.2	113.4	Q328	R324-Q328 WeakPolarHBondContact O-CG 3.4Å; R324-Q328 PolarHBondContact O-N 3.32Å; R324-Q328 VanDerWaalsContact O-N 3.17Å
325	S	86.4	Confident	86.5	Confident	74 Å²	74	75.8 Å²	75.8	52%	0.517	38%	0.384	S	S	.	.	H	α-helix	trans	-71.6	-36.6	173.6	40.7	0	0	0	0	112	S323 N327 Q328 V329	S323-S325 VanDerWaalsContact C-N 3.28Å; S323-S325 PolarHBondContact O-N 3.3Å; S323-S325 PolarHBondContact OG-OG 3.44Å; S325-N327 VanDerWaalsContact C-N 3.35Å; S325-Q328 PolarHBondContact O-N 3.08Å; S325-V329 WeakPolarHBondContact O-CG2 3.34Å; S325-V329 PolarHBondContact O-N 2.94Å
326	G	85.5	Confident	86.4	Confident	6 Å²	6	74.1 Å²	74.1	6%	0.062	38%	0.382	C	S	.	.	H	α-helix	trans	-58.1	-44	169.6	0	0	0	0	0	112.3	L319 S323 V329 S330	L319-G326 CarbonylContact O-C 3.5Å; L319-G326 VanDerWaalsContact O-C 3.23Å; L319-G326 WeakPolarHBondContact O-CA 3.35Å; S323-G326 CarbonylContact O-C 3.6Å; S323-G326 WeakPolarHBondContact O-CA 3.15Å; S323-G326 PolarHBondContact O-N 2.95Å; S323-G326 WeakPolarHBondContact OG-CA 3.38Å; S323-G326 PolarHBondContact OG-N 3.35Å; G326-V329 PolarHBondContact O-N 3.3Å; G326-S330 VanDerWaalsContact O-CB 3.26Å; G326-S330 WeakPolarHBondContact O-CB 3.48Å; G326-S330 PolarHBondContact O-N 3.21Å
327	N	88.3	Confident	86.1	Confident	47 Å²	47	80.6 Å²	80.6	25%	0.251	41%	0.41	S	S	.	.	H	α-helix	trans	-61.5	-44.8	173.2	-174.6	55.8	0	0	0	112.7	S320 S323 S325 V329 S330 E331	S320-N327 WeakPolarHBondContact CB-OD1 3.36Å; S320-N327 PolarHBondContact OG-OD1 2.81Å; S323-N327 PolarHBondContact O-N 3.02Å; S325-N327 VanDerWaalsContact C-N 3.35Å; N327-V329 VanDerWaalsContact C-N 3.3Å; N327-V329 PolarHBondContact O-N 3.18Å; N327-S330 CarbonylContact O-C 3.58Å; N327-S330 WeakPolarHBondContact O-CB 3.29Å; N327-S330 PolarHBondContact O-N 3.46Å; N327-S330 VanDerWaalsContact O-N 3.12Å; N327-E331 PolarHBondContact ND2-OE1 3.22Å; N327-E331 WeakPolarHBondContact O-CB 3.46Å; N327-E331 WeakPolarHBondContact O-CG 3.36Å; N327-E331 PolarHBondContact O-N 3.4Å
328	Q	86.3	Confident	85.6	Confident	115 Å²	115	77.6 Å²	77.6	54%	0.537	39%	0.391	S	S	.	.	H	α-helix	trans	-62.3	-36.6	177	-70.2	178.4	-53.7	0	0	112.9	R324 S325 F332	R324-Q328 WeakPolarHBondContact O-CG 3.4Å; R324-Q328 PolarHBondContact O-N 3.32Å; R324-Q328 VanDerWaalsContact O-N 3.17Å; S325-Q328 PolarHBondContact O-N 3.08Å; Q328-F332 WeakPolarHBondContact O-CB 3.47Å; Q328-F332 PolarHBondContact O-N 3.3Å
329	V	87.5	Confident	84.6	Confident	70 Å²	70	77.4 Å²	77.4	42%	0.424	39%	0.393	S	S	.	.	H	α-helix	trans	-71.2	-37.8	173.5	173.8	0	0	0	0	111.1	L319 S325 G326 N327 F332 I333	L319-V329 HydrophobicContact CD2-CB 4.42Å; L319-V329 HydrophobicContact CD2-CG1 3.98Å; S325-V329 WeakPolarHBondContact O-CG2 3.34Å; S325-V329 PolarHBondContact O-N 2.94Å; G326-V329 PolarHBondContact O-N 3.3Å; N327-V329 VanDerWaalsContact C-N 3.3Å; N327-V329 PolarHBondContact O-N 3.18Å; V329-F332 PolarHBondContact O-N 2.8Å; V329-I333 HydrophobicContact CG1-CD1 3.74Å; V329-I333 HydrophobicContact CG1-CG1 4.37Å; V329-I333 VanDerWaalsContact O-CG1 3.29Å; V329-I333 WeakPolarHBondContact O-CG1 3.32Å; V329-I333 PolarHBondContact O-N 3.15Å
330	S	85.6	Confident	83.3	Confident	8 Å²	8	80 Å²	80	6%	0.056	40%	0.403	C	S	.	.	H	α-helix	trans	-63.4	-48.9	176.3	-179.4	0	0	0	0	111.9	L316 G326 N327 F332 I333 S334	L316-S330 WeakPolarHBondContact CB-OG 3.44Å; L316-S330 WeakPolarHBondContact O-CB 3.19Å; L316-S330 PolarHBondContact O-OG 2.77Å; G326-S330 VanDerWaalsContact O-CB 3.26Å; G326-S330 WeakPolarHBondContact O-CB 3.48Å; G326-S330 PolarHBondContact O-N 3.21Å; N327-S330 CarbonylContact O-C 3.58Å; N327-S330 WeakPolarHBondContact O-CB 3.29Å; N327-S330 PolarHBondContact O-N 3.46Å; N327-S330 VanDerWaalsContact O-N 3.12Å; S330-F332 PolarHBondContact O-N 2.85Å; S330-I333 PolarHBondContact O-N 2.76Å; S330-S334 WeakPolarHBondContact O-CB 3.17Å; S330-S334 PolarHBondContact O-N 2.98Å; S330-S334 PolarHBondContact O-OG 3.03Å
331	E	85.4	Confident	81.5	Confident	96 Å²	96	84.4 Å²	84.4	45%	0.449	42%	0.42	S	S	.	.	H	α-helix	trans	-57.4	-46.3	172.1	-72.8	170.7	-178.9	0	0	111.4	N327 S334 N335	N327-E331 PolarHBondContact ND2-OE1 3.22Å; N327-E331 WeakPolarHBondContact O-CB 3.46Å; N327-E331 WeakPolarHBondContact O-CG 3.36Å; N327-E331 PolarHBondContact O-N 3.4Å; E331-S334 PolarHBondContact O-N 3.06Å; E331-N335 VanDerWaalsContact O-CB 3.31Å; E331-N335 WeakPolarHBondContact O-CB 3.42Å; E331-N335 PolarHBondContact O-N 3.37Å; E331-N335 PolarHBondContact O-ND2 3.13Å; E331-N335 VanDerWaalsContact O-ND2 3.08Å
332	F	86.8	Confident	79.4	Confident	125 Å²	125	84.6 Å²	84.6	55%	0.548	42%	0.42	S	S	.	.	H	α-helix	trans	-60.6	-48.4	178.3	174.8	-104.3	0	0	0	112.5	Q328 V329 S330 N335 T336 F337	Q328-F332 WeakPolarHBondContact O-CB 3.47Å; Q328-F332 PolarHBondContact O-N 3.3Å; V329-F332 PolarHBondContact O-N 2.8Å; S330-F332 PolarHBondContact O-N 2.85Å; F332-N335 PolarHBondContact O-N 2.96Å; F332-T336 HydrophobicContact CZ-CG2 4.46Å; F332-T336 VanDerWaalsContact O-CB 3.24Å; F332-T336 WeakPolarHBondContact O-CB 3.19Å; F332-T336 PolarHBondContact O-N 2.9Å; F332-T336 VanDerWaalsContact O-N 3.12Å; F332-T336 PolarHBondContact O-OG1 2.68Å; F332-F337 HydrophobicContact CE1-CE2 4.34Å
333	I	86.7	Confident	76.9	Confident	41 Å²	41	85 Å²	85	21%	0.21	42%	0.421	C	S	.	.	H	α-helix	trans	-66.3	-42	178.8	-62.8	167.5	0	0	0	110.3	L312 L316 V329 S330 N335 T336 F337 L338	L312-I333 HydrophobicContact CD2-CG2 4.44Å; L316-I333 HydrophobicContact CD1-CB 3.95Å; L316-I333 HydrophobicContact CD1-CG2 3.62Å; L316-I333 HydrophobicContact CD2-CB 4.1Å; L316-I333 HydrophobicContact CD2-CD1 3.9Å; L316-I333 HydrophobicContact CD2-CG2 4.09Å; L316-I333 HydrophobicContact CG-CG2 4.47Å; V329-I333 HydrophobicContact CG1-CD1 3.74Å; V329-I333 HydrophobicContact CG1-CG1 4.37Å; V329-I333 VanDerWaalsContact O-CG1 3.29Å; V329-I333 WeakPolarHBondContact O-CG1 3.32Å; V329-I333 PolarHBondContact O-N 3.15Å; S330-I333 PolarHBondContact O-N 2.76Å; I333-N335 VanDerWaalsContact C-N 3.28Å; I333-N335 PolarHBondContact O-N 3.33Å; I333-T336 PolarHBondContact O-N 2.76Å; I333-F337 HydrophobicContact CB-CD2 4.46Å; I333-F337 HydrophobicContact CG2-CB 4.42Å; I333-F337 HydrophobicContact CG2-CD2 4.03Å; I333-F337 PolarHBondContact O-N 3.31Å; I333-L338 PolarHBondContact O-N 2.69Å
334	S	84.9	Confident	74.6	Confident	25 Å²	25	87.8 Å²	87.8	18%	0.175	44%	0.435	C	S	.	.	H	α-helix	trans	-65.1	-26.7	179.1	-57.6	0	0	0	0	114	L316 S330 E331	L316-S334 WeakPolarHBondContact CD1-OG 3.33Å; S330-S334 WeakPolarHBondContact O-CB 3.17Å; S330-S334 PolarHBondContact O-N 2.98Å; S330-S334 PolarHBondContact O-OG 3.03Å; E331-S334 PolarHBondContact O-N 3.06Å
335	N	84.8	Confident	72.1	Confident	98 Å²	98	84.1 Å²	84.1	52%	0.524	43%	0.427	S	S	.	.	H	α-helix	trans	-93.2	-12.5	176.5	-67.1	-31.4	0	0	0	113.5	E331 F332 I333 K340	E331-N335 VanDerWaalsContact O-CB 3.31Å; E331-N335 WeakPolarHBondContact O-CB 3.42Å; E331-N335 PolarHBondContact O-N 3.37Å; E331-N335 PolarHBondContact O-ND2 3.13Å; E331-N335 VanDerWaalsContact O-ND2 3.08Å; F332-N335 PolarHBondContact O-N 2.96Å; I333-N335 VanDerWaalsContact C-N 3.28Å; I333-N335 PolarHBondContact O-N 3.33Å; N335-K340 WeakPolarHBondContact OD1-CE 3.28Å; N335-K340 PolarHBondContact OD1-NZ 3.46Å
336	T	85	Confident	69.7	Low	76 Å²	76	84.4 Å²	84.4	47%	0.466	42%	0.422	S	S	.	.	H	α-helix	trans	-113.6	-36.9	-172	-51.2	0	0	0	0	113.8	F332 I333	F332-T336 HydrophobicContact CZ-CG2 4.46Å; F332-T336 VanDerWaalsContact O-CB 3.24Å; F332-T336 WeakPolarHBondContact O-CB 3.19Å; F332-T336 PolarHBondContact O-N 2.9Å; F332-T336 VanDerWaalsContact O-N 3.12Å; F332-T336 PolarHBondContact O-OG1 2.68Å; I333-T336 PolarHBondContact O-N 2.76Å
337	F	82.1	Confident	67.2	Low	145 Å²	145	89.7 Å²	89.7	64%	0.636	46%	0.455	S	S	*	.	T	Hydrogen-bonded Turn	trans	-119.9	-14.5	-173.7	-57.5	-77	0	0	0	113.6	F332 I333	F332-F337 HydrophobicContact CE1-CE2 4.34Å; I333-F337 HydrophobicContact CB-CD2 4.46Å; I333-F337 HydrophobicContact CG2-CB 4.42Å; I333-F337 HydrophobicContact CG2-CD2 4.03Å; I333-F337 PolarHBondContact O-N 3.31Å
338	L	76.7	Confident	64.3	Low	15 Å²	15	91.6 Å²	91.6	8%	0.079	47%	0.472	C	S	.	.	S	Bend	trans	-98.3	117.9	168.6	-80.2	150.1	0	0	0	108.8	K309 L312 N313 L316 I333 K340	K309-L338 HydrophobicContact CB-CD2 3.89Å; K309-L338 HydrophobicContact CG-CD2 4.04Å; L312-L338 HydrophobicContact CD2-CD1 3.9Å; L312-L338 HydrophobicContact CD2-CD2 4.27Å; L312-L338 HydrophobicContact CD2-CG 3.88Å; L312-L338 HydrophobicContact CG-CD1 4.01Å; L312-L338 HydrophobicContact CG-CG 4.45Å; N313-L338 WeakPolarHBondContact OD1-CD1 3.48Å; L316-L338 HydrophobicContact CD1-CD1 3.46Å; L316-L338 VanDerWaalsContact CD1-CD1 3.46Å; I333-L338 PolarHBondContact O-N 2.69Å; L338-K340 PolarHBondContact O-N 2.81Å
339	D	65.9	Low	61.7	Low	99 Å²	99	92.2 Å²	92.2	53%	0.529	49%	0.487	S	S	.	.			trans	-67.8	97.1	173.5	163.6	36.2	0	0	0	109.9	K309 Q341	K309-D339 IonicContact NZ-OD2 2.76Å; K309-D339 PolarHBondContact NZ-OD2 3.36Å; D339-Q341 PolarHBondContact O-N 2.77Å; D339-Q341 VanDerWaalsContact O-N 3.08Å
340	K	56.8	Low	59.2	Low	90 Å²	90	94.9 Å²	94.9	39%	0.391	50%	0.503	S	S	.	.			trans	-72.4	88.3	174.2	-82.3	-175.7	161.6	-174.5	0	110.1	N335 L338 H342 E343	N335-K340 WeakPolarHBondContact OD1-CE 3.28Å; N335-K340 PolarHBondContact OD1-NZ 3.46Å; L338-K340 PolarHBondContact O-N 2.81Å; K340-H342 PolarHBondContact O-N 3.23Å; K340-E343 HydrophobicContact CD-CB 4.36Å; K340-E343 IonicContact NZ-OE2 3.57Å; K340-E343 PolarHBondContact NZ-OE2 3Å; K340-E343 PolarHBondContact O-N 3.03Å
341	Q	48.9	Very low	56.7	Low	130 Å²	130	103.3 Å²	103.3	61%	0.607	54%	0.541	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61	15.3	172.3	-64.9	178.7	-51.4	0	0	115.2	D339	D339-Q341 PolarHBondContact O-N 2.77Å; D339-Q341 VanDerWaalsContact O-N 3.08Å
342	H	47.1	Very low	54.2	Low	155 Å²	155	108.7 Å²	108.7	72%	0.718	56%	0.563	S	S	*	*	T	Hydrogen-bonded Turn	trans	-138.5	-9.4	-172.5	-92.7	32.5	0	0	0	115.7	K340	K340-H342 PolarHBondContact O-N 3.23Å
343	E	34.2	Very low	51.7	Low	111 Å²	111	111.7 Å²	111.7	52%	0.519	58%	0.579	S	S	.	*			trans	-135.6	83.5	-179	-71.3	-168.3	122.5	0	0	113.4	K340 E345	K340-E343 HydrophobicContact CD-CB 4.36Å; K340-E343 IonicContact NZ-OE2 3.57Å; K340-E343 PolarHBondContact NZ-OE2 3Å; K340-E343 PolarHBondContact O-N 3.03Å; E343-E345 PolarHBondContact O-N 3.34Å
344	V	38.1	Very low	49.1	Very low	107 Å²	107	119.4 Å²	119.4	65%	0.648	61%	0.611	S	S	*	*			trans	-82.5	106.4	157.7	-178.5	0	0	0	0	108.2	I346 Q560	V344-I346 PolarHBondContact O-N 2.95Å; V344-Q560 PolarHBondContact O-NE2 3.21Å
345	E	31.9	Very low	46.8	Very low	133 Å²	133	126.8 Å²	126.8	62%	0.621	64%	0.643	S	S	*	*			trans	-75.4	102.7	170.2	-78.5	-115.4	93.8	0	0	110.1	E343 K556	E343-E345 PolarHBondContact O-N 3.34Å; E345-K556 IonicContact OE1-NZ 3.57Å; E345-K556 PolarHBondContact OE1-NZ 3.19Å
346	I	35.6	Very low	44.4	Very low	80 Å²	80	130.7 Å²	130.7	41%	0.41	66%	0.655	S	S	.	*	P	Polyproline II helix	trans	-74.6	128.1	168.6	-45.8	173.1	0	0	0	108	V344 S348	V344-I346 PolarHBondContact O-N 2.95Å; I346-S348 PolarHBondContact O-N 3.39Å
347	P	32.7	Very low	41.9	Very low	117 Å²	117	137.4 Å²	137.4	76%	0.76	68%	0.678	S	S	*	*	P	Polyproline II helix	trans	-57.8	121.2	167	-22	33.4	0	0	0	109.6
348	S	27.7	Very low	39.6	Very low	87 Å²	87	139.8 Å²	139.8	61%	0.608	69%	0.688	S	S	*	*	P	Polyproline II helix	trans	-62.8	143.4	174.3	49	0	0	0	0	110	I346 T350	I346-S348 PolarHBondContact O-N 3.39Å; S348-T350 VanDerWaalsContact C-N 3.29Å; S348-T350 PolarHBondContact O-N 2.75Å
349	P	31.8	Very low	37.8	Very low	129 Å²	129	150.5 Å²	150.5	84%	0.838	73%	0.728	S	S	*	*			trans	-71.3	85	-179.5	28.7	-34.6	0	0	0	110.5
350	T	34.1	Very low	36.4	Very low	126 Å²	126	149.3 Å²	149.3	77%	0.773	73%	0.725	S	S	*	*			trans	-65.6	143	174	44.1	0	0	0	0	110.7	S348 K352	S348-T350 VanDerWaalsContact C-N 3.29Å; S348-T350 PolarHBondContact O-N 2.75Å; T350-K352 PolarHBondContact O-N 3.16Å; T350-K352 VanDerWaalsContact O-N 3.17Å
351	Q	34.4	Very low	35.7	Very low	184 Å²	184	154.2 Å²	154.2	86%	0.86	75%	0.752	S	S	*	*			trans	-73.7	110	-164.6	-66.8	175.9	-23.8	0	0	112.7	E353	Q351-E353 PolarHBondContact O-N 2.92Å
352	K	32.7	Very low	35.5	Very low	209 Å²	209	152.2 Å²	152.2	91%	0.909	75%	0.752	S	S	*	*			trans	30.1	69.7	154.8	-67.3	-179.9	177.5	171	0	117	T350	T350-K352 PolarHBondContact O-N 3.16Å; T350-K352 VanDerWaalsContact O-N 3.17Å
353	E	34.2	Very low	35.4	Very low	189 Å²	189	151.7 Å²	151.7	88%	0.883	75%	0.75	S	S	*	*			trans	-89.2	143.1	157.1	-72.6	-151.7	112.3	0	0	112	Q351	Q351-E353 PolarHBondContact O-N 2.92Å
354	K	32.2	Very low	36.6	Very low	203 Å²	203	148.3 Å²	148.3	88%	0.883	74%	0.735	S	S	*	*			trans	-101.1	81.4	-171.8	-70.7	179.6	177.4	175.1	0	112.3
355	E	36.8	Very low	37.2	Very low	179 Å²	179	147.6 Å²	147.6	84%	0.836	74%	0.735	S	S	*	*			trans	-102.9	160.1	173.2	-84.5	-86.7	86.2	0	0	112.8
356	K	34.1	Very low	38.1	Very low	181 Å²	181	143 Å²	143	79%	0.787	72%	0.723	S	S	*	*			trans	-111.5	137.8	-156.9	-64.6	163.1	-175.3	158.4	0	114.4	K358	K356-K358 PolarHBondContact O-N 2.99Å
357	K	32.4	Very low	39.1	Very low	216 Å²	216	140.8 Å²	140.8	94%	0.939	71%	0.713	S	S	*	*			trans	45.8	61.8	153	-69.7	-168.9	173	-173.4	0	117
358	K	33.3	Very low	40.2	Very low	196 Å²	196	142.6 Å²	142.6	85%	0.852	71%	0.709	S	S	*	*			trans	-130.7	134.9	142.2	-69	-174.6	179.5	178.1	0	107.6	K356 P360	K356-K358 PolarHBondContact O-N 2.99Å; K358-P360 WeakPolarHBondContact O-CD 3.33Å
359	R	38.9	Very low	41.4	Very low	240 Å²	240	144.4 Å²	144.4	91%	0.906	71%	0.706	S	S	*	*			trans	-75.1	116.5	172.2	-70.6	-177.8	178.4	174.6	-2.2	107.5
360	P	36.3	Very low	42.5	Very low	74 Å²	74	141.5 Å²	141.5	48%	0.481	68%	0.683	S	S	.	*			trans	-85.4	158.2	170.9	16.8	0.1	0	0	0	109.9	K358 S362	K358-P360 WeakPolarHBondContact O-CD 3.33Å; P360-S362 PolarHBondContact O-N 2.86Å
361	M	42.1	Very low	43.1	Very low	193 Å²	193	142.9 Å²	142.9	95%	0.951	68%	0.682	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69	3.7	172.4	-54.3	-166.4	-50.7	0	0	113.3	Q363	M361-Q363 VanDerWaalsContact C-N 3.27Å; M361-Q363 PolarHBondContact O-N 3.1Å
362	S	45.4	Very low	43.9	Very low	87 Å²	87	137.6 Å²	137.6	61%	0.608	66%	0.658	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.5	16.4	-179.4	70	0	0	0	0	114.2	P360	P360-S362 PolarHBondContact O-N 2.86Å
363	Q	45.7	Very low	44.5	Very low	145 Å²	145	130.5 Å²	130.5	68%	0.678	64%	0.635	S	S	*	*			trans	-110.5	96.2	169.5	-65.7	-164.7	-74.8	0	0	108.4	M361 S365	M361-Q363 VanDerWaalsContact C-N 3.27Å; M361-Q363 PolarHBondContact O-N 3.1Å; Q363-S365 PolarHBondContact O-N 3.41Å
364	I	58.5	Low	45.1	Very low	39 Å²	39	126.9 Å²	126.9	20%	0.2	63%	0.63	C	S	.	*			trans	-62.4	117.4	168.9	-56.7	172.3	0	0	0	107	G366 V367 A537 V538 K541	I364-G366 PolarHBondContact O-N 3.49Å; I364-V367 HydrophobicContact CB-CG2 4.14Å; I364-V367 HydrophobicContact CG2-CG2 4.17Å; I364-A537 HydrophobicContact CD1-CB 3.77Å; I364-V538 HydrophobicContact CD1-CG2 4.44Å; I364-V538 HydrophobicContact CG2-CG2 4.32Å; I364-K541 HydrophobicContact CD1-CB 4.11Å; I364-K541 HydrophobicContact CD1-CG 4.33Å
365	S	50	Low	45.9	Very low	93 Å²	93	121.2 Å²	121.2	65%	0.65	62%	0.616	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.4	65.7	-172.6	-163.2	0	0	0	0	111.3	Q363	Q363-S365 PolarHBondContact O-N 3.41Å
366	G	50.5	Low	46.7	Very low	36 Å²	36	115 Å²	115	37%	0.371	59%	0.588	S	S	.	*	T	Hydrogen-bonded Turn	trans	-171.8	-37.8	-176.8	0	0	0	0	0	114.3	I364 K368	I364-G366 PolarHBondContact O-N 3.49Å; G366-K368 PolarHBondContact O-N 2.94Å
367	V	57.6	Low	47.5	Very low	34 Å²	34	110.8 Å²	110.8	21%	0.206	58%	0.577	C	S	.	*			trans	-58.4	101.4	-177.9	-178.5	0	0	0	0	111	I364 V538 K541 L542	I364-V367 HydrophobicContact CB-CG2 4.14Å; I364-V367 HydrophobicContact CG2-CG2 4.17Å; V367-V538 HydrophobicContact CG2-CG1 4.49Å; V367-V538 HydrophobicContact CG2-CG2 4.21Å; V367-K541 HydrophobicContact CG2-CG 4.4Å; V367-L542 HydrophobicContact CG1-CD2 3.87Å
368	K	55.4	Low	48.4	Very low	155 Å²	155	106.6 Å²	106.6	67%	0.674	57%	0.565	S	S	*	*			trans	-78.9	128.3	178.9	-70.3	163.6	-168.7	154.5	0	108.2	G366 L370 H454	G366-K368 PolarHBondContact O-N 2.94Å; K368-L370 VanDerWaalsContact C-N 3.33Å; K368-L370 HydrophobicContact CB-CD1 4.37Å; K368-L370 PolarHBondContact O-N 2.88Å; K368-H454 PolarHBondContact N-NE2 3.24Å
369	K	52.2	Low	49.5	Very low	125 Å²	125	102.2 Å²	102.2	54%	0.543	56%	0.56	S	S	.	*			trans	-75.1	88.6	172.6	-173	167.2	178.2	137.3	0	110.8	E545	K369-E545 WeakPolarHBondContact CE-OE2 2.88Å; K369-E545 IonicContact NZ-OE2 2.62Å; K369-E545 PolarHBondContact NZ-OE2 3.45Å
370	L	55.7	Low	50.9	Low	67 Å²	67	93.8 Å²	93.8	35%	0.351	54%	0.538	S	S	.	.			trans	-72.2	144.5	169.1	-65.7	127.3	0	0	0	109.7	K368 D453	K368-L370 VanDerWaalsContact C-N 3.33Å; K368-L370 HydrophobicContact CB-CD1 4.37Å; K368-L370 PolarHBondContact O-N 2.88Å; L370-D453 HydrophobicContact CD1-CB 3.68Å; L370-D453 HydrophobicContact CD2-CB 4.26Å; L370-D453 HydrophobicContact CG-CB 4.46Å
371	M	47	Very low	52.8	Low	155 Å²	155	92.9 Å²	92.9	76%	0.764	53%	0.528	S	S	*	.			trans	-117.9	84.6	-169.1	-74.4	-172.8	60.6	0	0	112.3
372	H	51.9	Low	54.8	Low	74 Å²	74	84.6 Å²	84.6	34%	0.343	49%	0.489	S	S	.	.			trans	-99.6	-5.5	173.1	-64.4	-50.6	0	0	0	114.5	S374 D453	H372-S374 PolarHBondContact O-N 3.23Å; H372-D453 IonicContact CD2-OD2 3.82Å; H372-D453 IonicContact CE1-OD2 2.67Å; H372-D453 IonicContact NE2-OD2 3.15Å; H372-D453 PolarHBondContact NE2-OD2 3.34Å
373	S	43.4	Very low	56.8	Low	60 Å²	60	87.5 Å²	87.5	42%	0.42	49%	0.486	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.8	31.4	-164.9	62.6	0	0	0	0	116.8	E546	S373-E546 WeakPolarHBondContact CB-OE2 3.3Å; S373-E546 PolarHBondContact OG-OE2 2.7Å
374	S	47.3	Very low	58.8	Low	113 Å²	113	81.5 Å²	81.5	79%	0.79	46%	0.458	S	S	*	.	T	Hydrogen-bonded Turn	trans	-140.5	-4.9	-175.5	64.5	0	0	0	0	117.2	H372	H372-S374 PolarHBondContact O-N 3.23Å
375	S	48.9	Very low	60.2	Low	83 Å²	83	79.7 Å²	79.7	58%	0.58	45%	0.449	S	S	*	.	S	Bend	trans	-107.7	-18.5	-172.9	-161.4	0	0	0	0	116
376	L	53.4	Low	62.1	Low	50 Å²	50	75.5 Å²	75.5	26%	0.262	42%	0.42	S	S	.	.			trans	-102.8	97.5	-178.5	-66.7	176	0	0	0	111.3	I445	L376-I445 HydrophobicContact CD1-CB 4.43Å; L376-I445 HydrophobicContact CD1-CG2 3.85Å
377	T	51	Low	63.9	Low	91 Å²	91	80.6 Å²	80.6	56%	0.558	43%	0.431	S	S	*	.			trans	-93.1	149.6	159	54.9	0	0	0	0	109.5	S379 S380	T377-S379 PolarHBondContact O-N 2.9Å; T377-S379 PolarHBondContact OG1-OG 2.98Å; T377-S380 PolarHBondContact O-N 3.37Å
378	N	52.3	Low	65.3	Low	128 Å²	128	80.6 Å²	80.6	68%	0.684	43%	0.432	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.8	0.2	-171.5	-64.5	15.5	0	0	0	116
379	S	55.7	Low	66.9	Low	105 Å²	105	82.8 Å²	82.8	73%	0.734	44%	0.444	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.4	-7.3	179.2	47.9	0	0	0	0	115.2	T377	T377-S379 PolarHBondContact O-N 2.9Å; T377-S379 PolarHBondContact OG1-OG 2.98Å
380	S	68.2	Low	68.6	Low	63 Å²	63	81.4 Å²	81.4	44%	0.441	44%	0.44	S	S	.	.			trans	-155.1	48.5	-175.6	53.4	0	0	0	0	115	T377	T377-S380 PolarHBondContact O-N 3.37Å
381	I	77.1	Confident	70.3	Confident	54 Å²	54	81.4 Å²	81.4	28%	0.277	44%	0.438	S	S	.	.			trans	-71.5	127.4	166.9	-55.4	-179.1	0	0	0	108.5	V441 D442	I381-V441 HydrophobicContact CD1-CB 3.88Å; I381-V441 HydrophobicContact CD1-CG1 4.11Å; I381-V441 HydrophobicContact CG2-CG1 4.1Å; I381-D442 HydrophobicContact CD1-CB 4.38Å
382	P	83.9	Confident	72.5	Confident	20 Å²	20	80.4 Å²	80.4	13%	0.13	44%	0.436	C	S	.	.			trans	-67.4	154.9	177.3	-18.5	32.1	0	0	0	112.7	F384 G385 V386 K387	P382-F384 PolarHBondContact O-N 2.89Å; P382-F384 VanDerWaalsContact O-N 3.15Å; P382-G385 PolarHBondContact O-N 3.01Å; P382-V386 WeakPolarHBondContact CB-O 3.43Å; P382-K387 HydrophobicContact CB-CG 4.45Å; P382-K387 HydrophobicContact CG-CG 3.52Å
383	R	87.3	Confident	74.6	Confident	148 Å²	148	79.7 Å²	79.7	56%	0.558	44%	0.437	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.5	-41	-178.3	-176.8	178.7	173.3	-166.7	-5	113.5	E391 H425	R383-E391 WeakPolarHBondContact CB-OE1 3.43Å; R383-E391 VanDerWaalsContact CD-OE1 3.31Å; R383-E391 WeakPolarHBondContact CD-OE1 3.46Å; R383-H425 PolarHBondContact O-CE1 2.98Å; R383-H425 VanDerWaalsContact O-CE1 3.28Å
384	F	88.2	Confident	77.1	Confident	18 Å²	18	76.9 Å²	76.9	8%	0.079	42%	0.417	C	S	.	.	T	Hydrogen-bonded Turn	trans	-108.4	22.1	-179.8	-54.6	-67	0	0	0	113	P382 V386 E391 L394 A395 L398 V422	P382-F384 PolarHBondContact O-N 2.89Å; P382-F384 VanDerWaalsContact O-N 3.15Å; F384-V386 PolarHBondContact O-N 2.89Å; F384-E391 HydrophobicContact CD2-CG 3.86Å; F384-E391 HydrophobicContact CE2-CG 3.75Å; F384-L394 HydrophobicContact CB-CD2 4.34Å; F384-L394 HydrophobicContact CD2-CD2 4.2Å; F384-L394 HydrophobicContact CD2-CG 4.44Å; F384-L394 HydrophobicContact CG-CD2 4.47Å; F384-A395 HydrophobicContact CE2-CB 3.77Å; F384-A395 HydrophobicContact CZ-CB 3.5Å; F384-A395 VanDerWaalsContact CZ-CB 3.5Å; F384-L398 HydrophobicContact CD1-CD1 3.45Å; F384-L398 VanDerWaalsContact CD1-CD1 3.45Å; F384-L398 HydrophobicContact CE1-CD1 3.65Å; F384-L398 HydrophobicContact CG-CD1 3.94Å; F384-L398 HydrophobicContact CZ-CD1 4.28Å; F384-V422 HydrophobicContact CB-CG1 4.3Å
385	G	86.8	Confident	79.4	Confident	1 Å²	1	72.1 Å²	72.1	1%	0.01	38%	0.384	C	S	.	.	S	Bend	trans	76	-28.3	-178	0	0	0	0	0	115.4	P382	P382-G385 PolarHBondContact O-N 3.01Å
386	V	89.9	Confident	81.6	Confident	6 Å²	6	74.9 Å²	74.9	4%	0.036	39%	0.386	C	S	.	.	S	Bend	trans	-107.2	154.4	-180	-51.4	0	0	0	0	112.2	P382 F384 L394 R418 T421 V422 M449	P382-V386 WeakPolarHBondContact CB-O 3.43Å; F384-V386 PolarHBondContact O-N 2.89Å; V386-L394 HydrophobicContact CG2-CD2 4.38Å; V386-R418 HydrophobicContact CG1-CB 3.73Å; V386-R418 HydrophobicContact CG1-CG 4.27Å; V386-T421 HydrophobicContact CG1-CG2 3.8Å; V386-V422 HydrophobicContact CB-CG2 4.16Å; V386-V422 HydrophobicContact CG1-CG2 3.64Å; V386-V422 HydrophobicContact CG2-CG2 3.39Å; V386-M449 HydrophobicContact CG1-CE 4.36Å
387	K	88.1	Confident	83.7	Confident	142 Å²	142	74.7 Å²	74.7	62%	0.617	38%	0.384	S	S	*	.			trans	-96	119.8	173.9	-65.9	175.3	-177.1	169.1	0	108.9	P382	P382-K387 HydrophobicContact CB-CG 4.45Å; P382-K387 HydrophobicContact CG-CG 3.52Å
388	T	88.1	Confident	85.8	Confident	35 Å²	35	70.9 Å²	70.9	22%	0.215	36%	0.36	C	S	.	.			trans	-137	151.7	175.4	176.9	0	0	0	0	109.9	Q390 E391 L394 L414	T388-Q390 PolarHBondContact OG1-N 2.73Å; T388-Q390 VanDerWaalsContact OG1-N 3.13Å; T388-E391 HydrophobicContact CG2-CB 4.24Å; T388-L394 HydrophobicContact CG2-CD2 3.93Å; T388-L414 VanDerWaalsContact CB-O 3.26Å; T388-L414 WeakPolarHBondContact CB-O 3.49Å; T388-L414 PolarHBondContact OG1-O 3.4Å
389	E	87.5	Confident	87.9	Confident	201 Å²	201	71.5 Å²	71.5	94%	0.939	36%	0.359	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.5	-10.2	172.3	-61.2	-175.1	168.6	0	0	112.1
390	Q	88.8	Confident	89.9	Confident	96 Å²	96	69.4 Å²	69.4	45%	0.449	34%	0.339	S	S	.	.	T	Hydrogen-bonded Turn	trans	-111.9	34.9	-175	-56.3	-174.5	-67.8	0	0	112.1	T388 D392 V393 L394 L414	T388-Q390 PolarHBondContact OG1-N 2.73Å; T388-Q390 VanDerWaalsContact OG1-N 3.13Å; Q390-D392 VanDerWaalsContact C-N 3.32Å; Q390-D392 PolarHBondContact O-N 2.94Å; Q390-V393 PolarHBondContact O-N 3.47Å; Q390-V393 VanDerWaalsContact O-N 3.08Å; Q390-L394 PolarHBondContact O-N 3.2Å; Q390-L414 HydrophobicContact CB-CD2 3.9Å; Q390-L414 HydrophobicContact CG-CD2 4.48Å
391	E	91.8	Very high	91.3	Very high	67 Å²	67	66.7 Å²	66.7	31%	0.313	32%	0.32	S	S	.	.	H	α-helix	trans	-56.6	-39.6	-171.8	-169.9	175.2	141.8	0	0	113.3	R383 F384 T388 L394 A395	R383-E391 WeakPolarHBondContact CB-OE1 3.43Å; R383-E391 VanDerWaalsContact CD-OE1 3.31Å; R383-E391 WeakPolarHBondContact CD-OE1 3.46Å; F384-E391 HydrophobicContact CD2-CG 3.86Å; F384-E391 HydrophobicContact CE2-CG 3.75Å; T388-E391 HydrophobicContact CG2-CB 4.24Å; E391-L394 PolarHBondContact O-N 3.02Å; E391-A395 WeakPolarHBondContact O-CB 3.24Å; E391-A395 PolarHBondContact O-N 3.11Å
392	D	93.5	Very high	92.3	Very high	133 Å²	133	67.4 Å²	67.4	71%	0.711	32%	0.324	S	S	*	.	H	α-helix	trans	-70.2	-31.5	178.9	-64.2	-48	0	0	0	113.2	Q390 K396	Q390-D392 VanDerWaalsContact C-N 3.32Å; Q390-D392 PolarHBondContact O-N 2.94Å; D392-K396 PolarHBondContact O-N 3.1Å
393	V	95.2	Very high	93	Very high	60 Å²	60	72 Å²	72	36%	0.364	34%	0.342	S	S	.	.	H	α-helix	trans	-74.6	-42.9	175.6	-169.7	0	0	0	0	109.4	Q390 A395 K396 E397 L414	Q390-V393 PolarHBondContact O-N 3.47Å; Q390-V393 VanDerWaalsContact O-N 3.08Å; V393-A395 VanDerWaalsContact C-N 3.29Å; V393-A395 PolarHBondContact O-N 2.89Å; V393-K396 PolarHBondContact O-N 2.98Å; V393-K396 VanDerWaalsContact O-N 3.14Å; V393-E397 PolarHBondContact O-N 2.78Å; V393-E397 VanDerWaalsContact O-N 3.14Å; V393-L414 HydrophobicContact CB-CD1 4.25Å; V393-L414 HydrophobicContact CB-CD2 4.08Å; V393-L414 HydrophobicContact CG1-CD1 3.76Å; V393-L414 HydrophobicContact CG1-CD2 3.93Å
394	L	95.8	Very high	93.5	Very high	0 Å²	0	67.5 Å²	67.5	0%	0	33%	0.325	C	S	.	.	H	α-helix	trans	-60.2	-40.3	173.8	-177.9	60.5	0	0	0	111.6	F384 V386 T388 Q390 E391 K396 E397 L398 I411 L414 V422	F384-L394 HydrophobicContact CB-CD2 4.34Å; F384-L394 HydrophobicContact CD2-CD2 4.2Å; F384-L394 HydrophobicContact CD2-CG 4.44Å; F384-L394 HydrophobicContact CG-CD2 4.47Å; V386-L394 HydrophobicContact CG2-CD2 4.38Å; T388-L394 HydrophobicContact CG2-CD2 3.93Å; Q390-L394 PolarHBondContact O-N 3.2Å; E391-L394 PolarHBondContact O-N 3.02Å; L394-K396 VanDerWaalsContact C-N 3.28Å; L394-K396 PolarHBondContact O-N 3.43Å; L394-E397 PolarHBondContact O-N 2.87Å; L394-L398 HydrophobicContact CD1-CD1 4.18Å; L394-L398 HydrophobicContact CD1-CG 4.41Å; L394-L398 HydrophobicContact CG-CD1 3.95Å; L394-L398 WeakPolarHBondContact O-CB 3.4Å; L394-L398 WeakPolarHBondContact O-CD1 3.34Å; L394-L398 VanDerWaalsContact O-CG 3.24Å; L394-L398 WeakPolarHBondContact O-CG 3.42Å; L394-L398 PolarHBondContact O-N 2.85Å; L394-L398 VanDerWaalsContact O-N 3.12Å; L394-I411 HydrophobicContact CD1-CB 4.42Å; L394-I411 HydrophobicContact CD1-CG1 4.24Å; L394-I411 HydrophobicContact CD1-CG2 4.09Å; L394-L414 HydrophobicContact CB-CB 4.18Å; L394-L414 HydrophobicContact CD1-CB 4.02Å; L394-V422 HydrophobicContact CD1-CG1 4.24Å; L394-V422 HydrophobicContact CD2-CG1 4.29Å; L394-V422 HydrophobicContact CD2-CG2 4.32Å
395	A	95.5	Very high	93.8	Very high	13 Å²	13	67.6 Å²	67.6	11%	0.107	33%	0.331	C	S	.	.	H	α-helix	trans	-57.3	-41.6	174.8	0	0	0	0	0	112.2	F384 E391 V393 L398 E399	F384-A395 HydrophobicContact CE2-CB 3.77Å; F384-A395 HydrophobicContact CZ-CB 3.5Å; F384-A395 VanDerWaalsContact CZ-CB 3.5Å; E391-A395 WeakPolarHBondContact O-CB 3.24Å; E391-A395 PolarHBondContact O-N 3.11Å; V393-A395 VanDerWaalsContact C-N 3.29Å; V393-A395 PolarHBondContact O-N 2.89Å; A395-L398 PolarHBondContact O-N 2.88Å; A395-E399 PolarHBondContact O-N 3.38Å
396	K	96.1	Very high	94.3	Very high	141 Å²	141	67.7 Å²	67.7	61%	0.613	33%	0.331	S	S	*	.	H	α-helix	trans	-69.2	-44.8	-179.5	-169.7	-175.8	177.8	-171.5	0	112.6	D392 V393 L394 L398 E399	D392-K396 PolarHBondContact O-N 3.1Å; V393-K396 PolarHBondContact O-N 2.98Å; V393-K396 VanDerWaalsContact O-N 3.14Å; L394-K396 VanDerWaalsContact C-N 3.28Å; L394-K396 PolarHBondContact O-N 3.43Å; K396-L398 PolarHBondContact O-N 3.34Å; K396-E399 WeakPolarHBondContact O-CB 3.31Å; K396-E399 PolarHBondContact O-N 3.18Å; K396-E399 VanDerWaalsContact O-N 3.14Å
397	E	96	Very high	94.7	Very high	47 Å²	47	70 Å²	70	22%	0.22	34%	0.341	C	S	.	.	H	α-helix	trans	-60.9	-33.2	175.1	-55.3	-72.3	143.1	0	0	111	V393 L394 E399 D400 L406 R410 I411 L414	V393-E397 PolarHBondContact O-N 2.78Å; V393-E397 VanDerWaalsContact O-N 3.14Å; L394-E397 PolarHBondContact O-N 2.87Å; E397-E399 VanDerWaalsContact C-N 3.29Å; E397-E399 PolarHBondContact O-N 2.65Å; E397-D400 PolarHBondContact O-N 2.9Å; E397-L406 WeakPolarHBondContact O-CD1 3.42Å; E397-R410 HydrophobicContact CG-CG 4.11Å; E397-I411 HydrophobicContact CB-CD1 4.34Å; E397-I411 HydrophobicContact CB-CG1 3.89Å; E397-L414 HydrophobicContact CG-CD1 3.62Å
398	L	96.6	Very high	95.1	Very high	10 Å²	10	63.2 Å²	63.2	5%	0.052	31%	0.312	C	S	.	.	G	3₁₀ helix	trans	-75.2	-8.7	178.3	-68.5	168.4	0	0	0	114.6	F384 L394 A395 K396 D400 V401 I411 V422 I423 T426	F384-L398 HydrophobicContact CD1-CD1 3.45Å; F384-L398 VanDerWaalsContact CD1-CD1 3.45Å; F384-L398 HydrophobicContact CE1-CD1 3.65Å; F384-L398 HydrophobicContact CG-CD1 3.94Å; F384-L398 HydrophobicContact CZ-CD1 4.28Å; L394-L398 HydrophobicContact CD1-CD1 4.18Å; L394-L398 HydrophobicContact CD1-CG 4.41Å; L394-L398 HydrophobicContact CG-CD1 3.95Å; L394-L398 WeakPolarHBondContact O-CB 3.4Å; L394-L398 WeakPolarHBondContact O-CD1 3.34Å; L394-L398 VanDerWaalsContact O-CG 3.24Å; L394-L398 WeakPolarHBondContact O-CG 3.42Å; L394-L398 PolarHBondContact O-N 2.85Å; L394-L398 VanDerWaalsContact O-N 3.12Å; A395-L398 PolarHBondContact O-N 2.88Å; K396-L398 PolarHBondContact O-N 3.34Å; L398-D400 PolarHBondContact O-N 3.25Å; L398-V401 WeakPolarHBondContact O-CB 3.44Å; L398-V401 VanDerWaalsContact O-CG1 3.29Å; L398-V401 WeakPolarHBondContact O-CG1 3.17Å; L398-V401 PolarHBondContact O-N 3.21Å; L398-I411 HydrophobicContact CD2-CD1 3.82Å; L398-I411 HydrophobicContact CG-CD1 4.46Å; L398-V422 HydrophobicContact CD1-CG1 3.64Å; L398-V422 HydrophobicContact CD2-CG1 3.96Å; L398-V422 HydrophobicContact CG-CG1 4.35Å; L398-I423 HydrophobicContact CD2-CG1 4.45Å; L398-T426 HydrophobicContact CD2-CG2 4.37Å
399	E	96.6	Very high	95.6	Very high	142 Å²	142	62.1 Å²	62.1	66%	0.664	30%	0.304	S	S	*	.	G	3₁₀ helix	trans	-64.3	-23.6	168.7	-64	179.2	175.3	0	0	111.5	A395 K396 E397 V401	A395-E399 PolarHBondContact O-N 3.38Å; K396-E399 WeakPolarHBondContact O-CB 3.31Å; K396-E399 PolarHBondContact O-N 3.18Å; K396-E399 VanDerWaalsContact O-N 3.14Å; E397-E399 VanDerWaalsContact C-N 3.29Å; E397-E399 PolarHBondContact O-N 2.65Å; E399-V401 VanDerWaalsContact C-N 3.35Å
400	D	96.9	Very high	96.1	Very high	60 Å²	60	56.6 Å²	56.6	32%	0.321	28%	0.275	S	S	.	.	G	3₁₀ helix	trans	-89.6	7.9	177.6	-68.8	-19.1	0	0	0	113.3	E397 L398 N402 K403 L406	E397-D400 PolarHBondContact O-N 2.9Å; L398-D400 PolarHBondContact O-N 3.25Å; D400-N402 PolarHBondContact O-N 3.04Å; D400-K403 HydrophobicContact CB-CD 4.2Å; D400-K403 WeakPolarHBondContact O-CB 3.26Å; D400-K403 PolarHBondContact O-N 2.77Å; D400-K403 WeakPolarHBondContact OD1-CD 3.43Å; D400-K403 VanDerWaalsContact OD1-CE 3.24Å; D400-K403 WeakPolarHBondContact OD1-CE 3.34Å; D400-K403 IonicContact OD1-NZ 3.66Å; D400-K403 PolarHBondContact OD1-NZ 3.42Å; D400-L406 HydrophobicContact CB-CD1 3.67Å
401	V	97.8	Very high	96.5	Very high	6 Å²	6	52 Å²	52	4%	0.036	25%	0.254	C	S	.	.	T	Hydrogen-bonded Turn	trans	-56.6	-25.5	-178.6	70.6	0	0	0	0	113.9	L398 E399 T426 I427 Q472 H475	L398-V401 WeakPolarHBondContact O-CB 3.44Å; L398-V401 VanDerWaalsContact O-CG1 3.29Å; L398-V401 WeakPolarHBondContact O-CG1 3.17Å; L398-V401 PolarHBondContact O-N 3.21Å; E399-V401 VanDerWaalsContact C-N 3.35Å; V401-T426 HydrophobicContact CB-CG2 4.44Å; V401-T426 HydrophobicContact CG1-CG2 4.23Å; V401-T426 HydrophobicContact CG2-CG2 4.22Å; V401-I427 HydrophobicContact CG2-CD1 4.45Å; V401-I427 HydrophobicContact CG2-CG1 3.89Å; V401-Q472 HydrophobicContact CG2-CG 4.45Å; V401-Q472 PolarHBondContact O-NE2 2.73Å; V401-H475 PolarHBondContact O-CD2 3.42Å; V401-H475 PolarHBondContact O-NE2 3.02Å
402	N	97.9	Very high	96.8	Very high	70 Å²	70	49.1 Å²	49.1	37%	0.374	24%	0.241	S	C	.	.	T	Hydrogen-bonded Turn	trans	-91.9	4.5	177.8	-67.4	-25.2	0	0	0	114.1	D400 E430 H475	D400-N402 PolarHBondContact O-N 3.04Å; N402-E430 PolarHBondContact ND2-OE1 3.48Å; N402-H475 WeakPolarHBondContact CA-NE2 3.27Å; N402-H475 CovalentContact OD1-NE2 1.8Å; N402-H475 PolarHBondContact OD1-NE2 2.85Å
403	K	97.9	Very high	96.9	Very high	117 Å²	117	48.6 Å²	48.6	51%	0.509	23%	0.234	S	C	.	.	S	Bend	trans	-113.4	150.1	-174.2	-58.1	-179.2	-169.8	165.4	0	112.3	D400 Q472	D400-K403 HydrophobicContact CB-CD 4.2Å; D400-K403 WeakPolarHBondContact O-CB 3.26Å; D400-K403 PolarHBondContact O-N 2.77Å; D400-K403 WeakPolarHBondContact OD1-CD 3.43Å; D400-K403 VanDerWaalsContact OD1-CE 3.24Å; D400-K403 WeakPolarHBondContact OD1-CE 3.34Å; D400-K403 IonicContact OD1-NZ 3.66Å; D400-K403 PolarHBondContact OD1-NZ 3.42Å; K403-Q472 PolarHBondContact O-NE2 3.14Å
404	W	97.8	Very high	97	Very high	53 Å²	53	45.8 Å²	45.8	20%	0.201	22%	0.217	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68.9	143.3	167.5	-155.9	-116.2	0	0	0	110.5	V476 L477 T625 K626 W683 I697	W404-V476 HydrophobicContact CE3-CB 4.09Å; W404-V476 HydrophobicContact CE3-CG1 3.99Å; W404-V476 HydrophobicContact CZ3-CB 4.4Å; W404-L477 HydrophobicContact CZ3-CG 4.27Å; W404-T625 VanDerWaalsContact CZ2-OG1 3.27Å; W404-T625 WeakPolarHBondContact CZ2-OG1 3.42Å; W404-T625 PolarHBondContact NE1-O 2.69Å; W404-T625 PolarHBondContact NE1-OG1 3.19Å; W404-K626 HydrophobicContact CD2-CD 4.49Å; W404-K626 HydrophobicContact CZ2-CD 4.29Å; W404-W683 AromaticContact CH2-CH2 3.59Å; W404-W683 HydrophobicContact CH2-CH2 3.59Å; W404-W683 AromaticContact CH2-CZ2 3.95Å; W404-W683 HydrophobicContact CH2-CZ2 3.95Å; W404-W683 AromaticContact CZ2-CH2 3.64Å; W404-W683 HydrophobicContact CZ2-CH2 3.64Å; W404-W683 AromaticContact CZ2-CZ2 3.82Å; W404-W683 HydrophobicContact CZ2-CZ2 3.82Å; W404-I697 HydrophobicContact CD2-CD1 4.16Å; W404-I697 HydrophobicContact CG-CD1 4.38Å; W404-I697 HydrophobicContact CG-CG1 4.38Å; W404-I697 HydrophobicContact CZ2-CG2 4.29Å
405	G	95.4	Very high	96.9	Very high	19 Å²	19	45.9 Å²	45.9	20%	0.196	22%	0.218	C	C	.	.	T	Hydrogen-bonded Turn	trans	80.2	21.2	179.3	0	0	0	0	0	115.9	H407 L630	G405-H407 PolarHBondContact O-N 3.46Å; G405-L630 WeakPolarHBondContact O-CD1 3.34Å
406	L	97.5	Very high	96.9	Very high	4 Å²	4	48.1 Å²	48.1	2%	0.021	24%	0.242	C	C	.	.			trans	-49.2	133.1	168.3	178.6	66.7	0	0	0	111	E397 D400 V408 I411 I423 Q472 L630	E397-L406 WeakPolarHBondContact O-CD1 3.42Å; D400-L406 HydrophobicContact CB-CD1 3.67Å; L406-V408 PolarHBondContact O-N 3.08Å; L406-I411 HydrophobicContact CD1-CD1 3.85Å; L406-I411 HydrophobicContact CD2-CD1 3.72Å; L406-I411 HydrophobicContact CG-CD1 3.88Å; L406-I423 HydrophobicContact CD2-CD1 4.32Å; L406-Q472 HydrophobicContact CD2-CB 4.41Å; L406-Q472 HydrophobicContact CD2-CG 3.6Å; L406-L630 WeakPolarHBondContact O-CD1 3.16Å
407	H	97.1	Very high	96.9	Very high	53 Å²	53	44.9 Å²	44.9	25%	0.245	23%	0.232	C	C	.	.			trans	-79.4	65.1	-175	-157.6	-67.9	0	0	0	112.7	G405 F409 R410 I411 Q629 L630	G405-H407 PolarHBondContact O-N 3.46Å; H407-F409 VanDerWaalsContact C-N 3.25Å; H407-F409 PolarHBondContact O-N 3.09Å; H407-R410 HydrophobicContact CB-CB 4.27Å; H407-R410 VanDerWaalsContact ND1-CB 3.3Å; H407-R410 WeakPolarHBondContact ND1-CB 3.47Å; H407-R410 PolarHBondContact ND1-N 3.09Å; H407-R410 WeakPolarHBondContact O-CA 3.28Å; H407-R410 VanDerWaalsContact O-CB 3.31Å; H407-R410 WeakPolarHBondContact O-CB 3.41Å; H407-R410 PolarHBondContact O-N 2.94Å; H407-I411 PolarHBondContact O-N 2.94Å; H407-Q629 PolarHBondContact NE2-NE2 3.25Å; H407-L630 HydrophobicContact CB-CD2 4.5Å
408	V	98	Very high	97	Very high	1 Å²	1	45.4 Å²	45.4	1%	0.006	23%	0.232	C	C	.	.	H	α-helix	trans	-49.6	-36.5	-173.5	64.9	0	0	0	0	114.6	L406 R410 I411 A412 I423 I465 A468 D469 W634	L406-V408 PolarHBondContact O-N 3.08Å; V408-R410 VanDerWaalsContact C-N 3.27Å; V408-R410 PolarHBondContact O-N 3.28Å; V408-I411 PolarHBondContact O-N 3.01Å; V408-A412 PolarHBondContact O-N 3.43Å; V408-I423 HydrophobicContact CG2-CD1 4.02Å; V408-I465 HydrophobicContact CG1-CG2 4.43Å; V408-I465 HydrophobicContact CG2-CG2 4.07Å; V408-A468 HydrophobicContact CG2-CB 4.18Å; V408-D469 HydrophobicContact CB-CB 4.48Å; V408-D469 HydrophobicContact CG1-CB 4.1Å; V408-D469 HydrophobicContact CG2-CB 4.26Å; V408-W634 HydrophobicContact CG1-CZ2 3.94Å
409	F	98.1	Very high	97.1	Very high	11 Å²	11	45 Å²	45	5%	0.048	23%	0.229	C	C	.	.	H	α-helix	trans	-61.8	-33.5	174.8	-57.2	-64.2	0	0	0	113	H407 A412 E413 I465 L630 Q633 W634 R637	H407-F409 VanDerWaalsContact C-N 3.25Å; H407-F409 PolarHBondContact O-N 3.09Å; F409-A412 WeakPolarHBondContact O-CB 3.41Å; F409-A412 PolarHBondContact O-N 3.21Å; F409-E413 PolarHBondContact O-N 2.87Å; F409-E413 VanDerWaalsContact O-N 3.11Å; F409-I465 HydrophobicContact CD1-CG2 3.81Å; F409-I465 HydrophobicContact CE1-CG2 3.99Å; F409-L630 HydrophobicContact CD2-CD2 3.65Å; F409-L630 HydrophobicContact CE2-CB 4.49Å; F409-L630 HydrophobicContact CE2-CD2 3.92Å; F409-Q633 HydrophobicContact CD2-CB 4.14Å; F409-Q633 HydrophobicContact CD2-CG 4.5Å; F409-Q633 HydrophobicContact CE2-CB 3.47Å; F409-Q633 VanDerWaalsContact CE2-CB 3.47Å; F409-Q633 HydrophobicContact CE2-CG 4.28Å; F409-Q633 HydrophobicContact CZ-CB 3.68Å; F409-W634 HydrophobicContact CE1-CD2 4.27Å; F409-W634 HydrophobicContact CE1-CE3 4.2Å; F409-W634 AromaticContact CE1-CH2 3.68Å; F409-W634 HydrophobicContact CE1-CH2 3.68Å; F409-W634 AromaticContact CE1-CZ2 3.79Å; F409-W634 HydrophobicContact CE1-CZ2 3.79Å; F409-W634 AromaticContact CE1-CZ3 3.93Å; F409-W634 HydrophobicContact CE1-CZ3 3.93Å; F409-W634 HydrophobicContact CE2-CZ2 4.48Å; F409-W634 AromaticContact CZ-CD2 3.57Å; F409-W634 HydrophobicContact CZ-CD2 3.57Å; F409-W634 AromaticContact CZ-CE2 3.43Å; F409-W634 VanDerWaalsContact CZ-CE2 3.43Å; F409-W634 AromaticContact CZ-CE3 3.93Å; F409-W634 HydrophobicContact CZ-CE3 3.93Å; F409-W634 HydrophobicContact CZ-CG 4.08Å; F409-W634 AromaticContact CZ-CH2 3.92Å; F409-W634 HydrophobicContact CZ-CH2 3.92Å; F409-W634 AromaticContact CZ-CZ2 3.62Å; F409-W634 HydrophobicContact CZ-CZ2 3.62Å; F409-W634 HydrophobicContact CZ-CZ3 4.09Å; F409-W634 AromaticContact CZ-NE1 3.95Å; F409-R637 VanDerWaalsContact CE1-NE 3.34Å
410	R	97.3	Very high	97.1	Very high	86 Å²	86	38.2 Å²	38.2	33%	0.325	20%	0.198	S	C	.	.	H	α-helix	trans	-75.5	-37.5	178.5	-176.8	55.4	172.1	174.8	1.1	111.1	E397 H407 V408 A412 E413 L414	E397-R410 HydrophobicContact CG-CG 4.11Å; H407-R410 HydrophobicContact CB-CB 4.27Å; H407-R410 VanDerWaalsContact ND1-CB 3.3Å; H407-R410 WeakPolarHBondContact ND1-CB 3.47Å; H407-R410 PolarHBondContact ND1-N 3.09Å; H407-R410 WeakPolarHBondContact O-CA 3.28Å; H407-R410 VanDerWaalsContact O-CB 3.31Å; H407-R410 WeakPolarHBondContact O-CB 3.41Å; H407-R410 PolarHBondContact O-N 2.94Å; V408-R410 VanDerWaalsContact C-N 3.27Å; V408-R410 PolarHBondContact O-N 3.28Å; R410-A412 VanDerWaalsContact C-N 3.28Å; R410-A412 PolarHBondContact O-N 3.37Å; R410-E413 WeakPolarHBondContact CD-OE2 3.21Å; R410-E413 IonicContact CZ-OE2 2.75Å; R410-E413 IonicContact NE-OE2 3.93Å; R410-E413 IonicContact NH1-OE2 3.09Å; R410-E413 PolarHBondContact NH1-OE2 2.78Å; R410-E413 PolarHBondContact O-N 3.45Å; R410-L414 HydrophobicContact CG-CD1 3.88Å; R410-L414 HydrophobicContact CG-CG 4.38Å; R410-L414 WeakPolarHBondContact O-CB 3.47Å; R410-L414 VanDerWaalsContact O-CG 3.24Å; R410-L414 WeakPolarHBondContact O-CG 3.38Å; R410-L414 PolarHBondContact O-N 3Å
411	I	97.7	Very high	97.2	Very high	0 Å²	0	35.3 Å²	35.3	0%	0	18%	0.182	C	C	.	.	H	α-helix	trans	-60.8	-39.6	168.4	-71.5	170.5	0	0	0	110.5	L394 E397 L398 L406 H407 V408 L414 S415 P419 V422 I423	L394-I411 HydrophobicContact CD1-CB 4.42Å; L394-I411 HydrophobicContact CD1-CG1 4.24Å; L394-I411 HydrophobicContact CD1-CG2 4.09Å; E397-I411 HydrophobicContact CB-CD1 4.34Å; E397-I411 HydrophobicContact CB-CG1 3.89Å; L398-I411 HydrophobicContact CD2-CD1 3.82Å; L398-I411 HydrophobicContact CG-CD1 4.46Å; L406-I411 HydrophobicContact CD1-CD1 3.85Å; L406-I411 HydrophobicContact CD2-CD1 3.72Å; L406-I411 HydrophobicContact CG-CD1 3.88Å; H407-I411 PolarHBondContact O-N 2.94Å; V408-I411 PolarHBondContact O-N 3.01Å; I411-L414 PolarHBondContact O-N 3.44Å; I411-S415 WeakPolarHBondContact O-CB 3.47Å; I411-S415 PolarHBondContact O-N 3.49Å; I411-S415 PolarHBondContact O-OG 2.85Å; I411-P419 HydrophobicContact CG2-CB 4.17Å; I411-V422 HydrophobicContact CG2-CG1 4.31Å; I411-I423 HydrophobicContact CD1-CD1 4.16Å; I411-I423 HydrophobicContact CD1-CG1 4.37Å; I411-I423 HydrophobicContact CG2-CD1 4.03Å; I411-I423 HydrophobicContact CG2-CG1 4.21Å
412	A	97.4	Very high	97.2	Very high	6 Å²	6	35 Å²	35	5%	0.05	18%	0.181	C	C	.	.	H	α-helix	trans	-61.4	-44.5	175.9	0	0	0	0	0	112.3	V408 F409 R410 S415 N417 P419 I465	V408-A412 PolarHBondContact O-N 3.43Å; F409-A412 WeakPolarHBondContact O-CB 3.41Å; F409-A412 PolarHBondContact O-N 3.21Å; R410-A412 VanDerWaalsContact C-N 3.28Å; R410-A412 PolarHBondContact O-N 3.37Å; A412-S415 PolarHBondContact O-OG 3.4Å; A412-N417 VanDerWaalsContact O-CA 3.23Å; A412-N417 WeakPolarHBondContact O-CA 3.36Å; A412-N417 PolarHBondContact O-N 3.45Å; A412-P419 HydrophobicContact CB-CB 4.02Å; A412-P419 HydrophobicContact CB-CG 3.8Å; A412-I465 HydrophobicContact CB-CD1 4.26Å; A412-I465 HydrophobicContact CB-CG1 4.24Å; A412-I465 HydrophobicContact CB-CG2 4.39Å
413	E	96.4	Very high	97.2	Very high	121 Å²	121	31.7 Å²	31.7	57%	0.565	16%	0.163	S	C	*	.	H	α-helix	trans	-59.2	-57.1	172.8	-67.4	173.7	164.9	0	0	112	F409 R410 S415 G416	F409-E413 PolarHBondContact O-N 2.87Å; F409-E413 VanDerWaalsContact O-N 3.11Å; R410-E413 WeakPolarHBondContact CD-OE2 3.21Å; R410-E413 IonicContact CZ-OE2 2.75Å; R410-E413 IonicContact NE-OE2 3.93Å; R410-E413 IonicContact NH1-OE2 3.09Å; R410-E413 PolarHBondContact NH1-OE2 2.78Å; R410-E413 PolarHBondContact O-N 3.45Å; E413-S415 VanDerWaalsContact C-N 3.27Å; E413-S415 PolarHBondContact O-N 2.72Å; E413-G416 PolarHBondContact O-N 2.69Å; E413-G416 VanDerWaalsContact O-N 3.15Å
414	L	96.5	Very high	97.3	Very high	1 Å²	1	26.2 Å²	26.2	1%	0.005	14%	0.139	C	C	.	.	H	α-helix	trans	-67	-24	-172.5	-66.1	171.1	0	0	0	113.8	T388 Q390 V393 L394 E397 R410 I411	T388-L414 VanDerWaalsContact CB-O 3.26Å; T388-L414 WeakPolarHBondContact CB-O 3.49Å; T388-L414 PolarHBondContact OG1-O 3.4Å; Q390-L414 HydrophobicContact CB-CD2 3.9Å; Q390-L414 HydrophobicContact CG-CD2 4.48Å; V393-L414 HydrophobicContact CB-CD1 4.25Å; V393-L414 HydrophobicContact CB-CD2 4.08Å; V393-L414 HydrophobicContact CG1-CD1 3.76Å; V393-L414 HydrophobicContact CG1-CD2 3.93Å; L394-L414 HydrophobicContact CB-CB 4.18Å; L394-L414 HydrophobicContact CD1-CB 4.02Å; E397-L414 HydrophobicContact CG-CD1 3.62Å; R410-L414 HydrophobicContact CG-CD1 3.88Å; R410-L414 HydrophobicContact CG-CG 4.38Å; R410-L414 WeakPolarHBondContact O-CB 3.47Å; R410-L414 VanDerWaalsContact O-CG 3.24Å; R410-L414 WeakPolarHBondContact O-CG 3.38Å; R410-L414 PolarHBondContact O-N 3Å; I411-L414 PolarHBondContact O-N 3.44Å
415	S	95.5	Very high	97.3	Very high	3 Å²	3	24.1 Å²	24.1	2%	0.021	13%	0.131	C	C	.	.	T	Hydrogen-bonded Turn	trans	-86.9	-5	177.6	61.6	0	0	0	0	114.3	I411 A412 E413 R418	I411-S415 WeakPolarHBondContact O-CB 3.47Å; I411-S415 PolarHBondContact O-N 3.49Å; I411-S415 PolarHBondContact O-OG 2.85Å; A412-S415 PolarHBondContact O-OG 3.4Å; E413-S415 VanDerWaalsContact C-N 3.27Å; E413-S415 PolarHBondContact O-N 2.72Å; S415-R418 VanDerWaalsContact OG-C 3.24Å; S415-R418 WeakPolarHBondContact OG-CA 3.43Å; S415-R418 PolarHBondContact OG-N 3.25Å
416	G	94.7	Very high	97.4	Very high	60 Å²	60	24.2 Å²	24.2	62%	0.619	13%	0.128	S	C	*	.	T	Hydrogen-bonded Turn	trans	75.6	42.4	-173.3	0	0	0	0	0	112.8	E413	E413-G416 PolarHBondContact O-N 2.69Å; E413-G416 VanDerWaalsContact O-N 3.15Å
417	N	96.2	Very high	97.4	Very high	73 Å²	73	24 Å²	24	39%	0.39	13%	0.127	S	C	.	.	S	Bend	trans	56.2	46.4	-170	-159.7	62.1	0	0	0	113.5	A412 N464	A412-N417 VanDerWaalsContact O-CA 3.23Å; A412-N417 WeakPolarHBondContact O-CA 3.36Å; A412-N417 PolarHBondContact O-N 3.45Å; N417-N464 PolarHBondContact O-ND2 2.81Å
418	R	97.4	Very high	97.5	Very high	58 Å²	58	21.5 Å²	21.5	22%	0.219	12%	0.115	C	C	.	.			trans	-124.7	41.8	175	-64.7	-67.7	-179.1	175.9	-6.4	114.3	V386 S415 L420 T421 V422 M449 E452 D453	V386-R418 HydrophobicContact CG1-CB 3.73Å; V386-R418 HydrophobicContact CG1-CG 4.27Å; S415-R418 VanDerWaalsContact OG-C 3.24Å; S415-R418 WeakPolarHBondContact OG-CA 3.43Å; S415-R418 PolarHBondContact OG-N 3.25Å; R418-L420 VanDerWaalsContact C-N 3.32Å; R418-L420 PolarHBondContact O-N 3.37Å; R418-T421 PolarHBondContact O-N 2.69Å; R418-V422 WeakPolarHBondContact O-CG2 3.45Å; R418-V422 PolarHBondContact O-N 3.33Å; R418-V422 VanDerWaalsContact O-N 3.14Å; R418-M449 PolarHBondContact NH1-O 3.21Å; R418-E452 VanDerWaalsContact CA-OE1 3.29Å; R418-E452 WeakPolarHBondContact CA-OE1 3.32Å; R418-E452 WeakPolarHBondContact CA-OE2 3.33Å; R418-E452 WeakPolarHBondContact CD-OE2 3.39Å; R418-E452 IonicContact NH1-OE2 2.78Å; R418-D453 IonicContact CZ-OD1 2.64Å; R418-D453 IonicContact NH1-OD1 2.65Å; R418-D453 PolarHBondContact NH1-OD1 3.18Å; R418-D453 IonicContact NH2-OD1 2.6Å; R418-D453 PolarHBondContact NH2-OD1 2.97Å
419	P	98.1	Very high	97.4	Very high	0 Å²	0	26 Å²	26	0%	0	14%	0.136	C	C	.	.	H	α-helix	trans	-60.4	-38.9	-176.5	28.4	-36.5	0	0	0	112.6	I411 A412 V422 I423 E452 N464 I465 A468	I411-P419 HydrophobicContact CG2-CB 4.17Å; A412-P419 HydrophobicContact CB-CB 4.02Å; A412-P419 HydrophobicContact CB-CG 3.8Å; P419-V422 PolarHBondContact O-N 3.41Å; P419-I423 VanDerWaalsContact O-CB 3.27Å; P419-I423 WeakPolarHBondContact O-CB 3.41Å; P419-I423 PolarHBondContact O-N 3.14Å; P419-E452 VanDerWaalsContact CD-OE1 3.31Å; P419-E452 WeakPolarHBondContact CD-OE1 3.49Å; P419-N464 WeakPolarHBondContact CD-ND2 3.44Å; P419-I465 HydrophobicContact CG-CB 4.47Å; P419-I465 HydrophobicContact CG-CG1 4.19Å; P419-A468 HydrophobicContact CB-CB 3.88Å; P419-A468 HydrophobicContact CG-CB 4.3Å
420	L	98.6	Very high	97.3	Very high	0 Å²	0	30.5 Å²	30.5	0%	0	16%	0.158	C	C	.	.	H	α-helix	trans	-67.8	-43.8	-177	-177.9	62.9	0	0	0	110.9	R418 V422 M424 L451 E452 Y455 N464 A467 A468 V471 A500	R418-L420 VanDerWaalsContact C-N 3.32Å; R418-L420 PolarHBondContact O-N 3.37Å; L420-V422 PolarHBondContact O-N 2.8Å; L420-M424 HydrophobicContact CD1-CG 3.89Å; L420-M424 HydrophobicContact CG-CG 4.44Å; L420-M424 WeakPolarHBondContact O-CB 3.32Å; L420-M424 WeakPolarHBondContact O-CG 3.24Å; L420-M424 PolarHBondContact O-N 3.09Å; L420-L451 HydrophobicContact CD2-CD2 4.12Å; L420-L451 HydrophobicContact CD2-CG 4.08Å; L420-E452 HydrophobicContact CB-CG 4.38Å; L420-E452 WeakPolarHBondContact CB-OE1 3.09Å; L420-E452 HydrophobicContact CD2-CB 4.46Å; L420-E452 PolarHBondContact N-OE1 2.93Å; L420-Y455 HydrophobicContact CD2-CD2 4.04Å; L420-Y455 HydrophobicContact CD2-CE2 3.64Å; L420-N464 HydrophobicContact CB-CB 4.39Å; L420-A467 HydrophobicContact CD1-CB 4.21Å; L420-A467 HydrophobicContact CD2-CB 4.2Å; L420-A468 HydrophobicContact CB-CB 4.22Å; L420-A468 HydrophobicContact CD1-CB 4.38Å; L420-V471 HydrophobicContact CD1-CG2 4.03Å; L420-A500 HydrophobicContact CD1-CB 4.27Å
421	T	98.3	Very high	97.4	Very high	0 Å²	0	28.8 Å²	28.8	0%	0	15%	0.151	C	C	.	.	H	α-helix	trans	-60.8	-44.5	175.6	-62.2	0	0	0	0	111.6	V386 R418 H425 I445 L448 M449 E452	V386-T421 HydrophobicContact CG1-CG2 3.8Å; R418-T421 PolarHBondContact O-N 2.69Å; T421-H425 VanDerWaalsContact O-CB 3.27Å; T421-H425 WeakPolarHBondContact O-CB 3.34Å; T421-H425 PolarHBondContact O-N 3.28Å; T421-I445 HydrophobicContact CG2-CD1 4.11Å; T421-L448 HydrophobicContact CG2-CB 4.09Å; T421-M449 HydrophobicContact CG2-CE 4.45Å; T421-M449 HydrophobicContact CG2-CG 4.17Å; T421-E452 VanDerWaalsContact CB-OE2 3.25Å; T421-E452 WeakPolarHBondContact CB-OE2 3.16Å; T421-E452 PolarHBondContact N-OE2 2.94Å; T421-E452 PolarHBondContact OG1-OE2 2.97Å
422	V	97.9	Very high	97.4	Very high	0 Å²	0	31.9 Å²	31.9	0%	0	17%	0.168	C	C	.	.	H	α-helix	trans	-69.2	-48.8	-177.5	170.2	0	0	0	0	112.3	F384 V386 L394 L398 I411 R418 P419 L420 H425 T426	F384-V422 HydrophobicContact CB-CG1 4.3Å; V386-V422 HydrophobicContact CB-CG2 4.16Å; V386-V422 HydrophobicContact CG1-CG2 3.64Å; V386-V422 HydrophobicContact CG2-CG2 3.39Å; L394-V422 HydrophobicContact CD1-CG1 4.24Å; L394-V422 HydrophobicContact CD2-CG1 4.29Å; L394-V422 HydrophobicContact CD2-CG2 4.32Å; L398-V422 HydrophobicContact CD1-CG1 3.64Å; L398-V422 HydrophobicContact CD2-CG1 3.96Å; L398-V422 HydrophobicContact CG-CG1 4.35Å; I411-V422 HydrophobicContact CG2-CG1 4.31Å; R418-V422 WeakPolarHBondContact O-CG2 3.45Å; R418-V422 PolarHBondContact O-N 3.33Å; R418-V422 VanDerWaalsContact O-N 3.14Å; P419-V422 PolarHBondContact O-N 3.41Å; L420-V422 PolarHBondContact O-N 2.8Å; V422-H425 PolarHBondContact O-N 2.97Å; V422-T426 WeakPolarHBondContact O-CB 3.23Å; V422-T426 PolarHBondContact O-N 3.22Å; V422-T426 PolarHBondContact O-OG1 3.39Å
423	I	98.5	Very high	97.4	Very high	0 Å²	0	31.7 Å²	31.7	0%	0	17%	0.166	C	C	.	.	H	α-helix	trans	-66.8	-45.1	-177.6	-77.5	166.6	0	0	0	110.1	L398 L406 V408 I411 P419 H425 T426 I427 A468 V471 Q472	L398-I423 HydrophobicContact CD2-CG1 4.45Å; L406-I423 HydrophobicContact CD2-CD1 4.32Å; V408-I423 HydrophobicContact CG2-CD1 4.02Å; I411-I423 HydrophobicContact CD1-CD1 4.16Å; I411-I423 HydrophobicContact CD1-CG1 4.37Å; I411-I423 HydrophobicContact CG2-CD1 4.03Å; I411-I423 HydrophobicContact CG2-CG1 4.21Å; P419-I423 VanDerWaalsContact O-CB 3.27Å; P419-I423 WeakPolarHBondContact O-CB 3.41Å; P419-I423 PolarHBondContact O-N 3.14Å; I423-H425 PolarHBondContact O-N 3Å; I423-T426 PolarHBondContact O-N 3.13Å; I423-I427 HydrophobicContact CG2-CD1 3.53Å; I423-I427 HydrophobicContact CG2-CG1 4.49Å; I423-I427 WeakPolarHBondContact O-CB 3.41Å; I423-I427 WeakPolarHBondContact O-CG1 3.34Å; I423-I427 PolarHBondContact O-N 3.29Å; I423-A468 HydrophobicContact CD1-CB 3.96Å; I423-V471 HydrophobicContact CG2-CG1 3.86Å; I423-Q472 HydrophobicContact CG2-CB 3.98Å
424	M	98.5	Very high	97.5	Very high	1 Å²	1	26.7 Å²	26.7	1%	0.005	14%	0.143	C	C	.	.	H	α-helix	trans	-61.6	-43.7	174.7	-77.4	-75.4	-78.2	0	0	112.6	L420 T426 F428 L448 V471 I496 A500	L420-M424 HydrophobicContact CD1-CG 3.89Å; L420-M424 HydrophobicContact CG-CG 4.44Å; L420-M424 WeakPolarHBondContact O-CB 3.32Å; L420-M424 WeakPolarHBondContact O-CG 3.24Å; L420-M424 PolarHBondContact O-N 3.09Å; M424-T426 VanDerWaalsContact C-N 3.34Å; M424-T426 PolarHBondContact O-N 2.94Å; M424-F428 HydrophobicContact CE-CD2 4.41Å; M424-F428 HydrophobicContact CE-CE2 3.49Å; M424-F428 VanDerWaalsContact CE-CE2 3.49Å; M424-F428 HydrophobicContact CE-CZ 3.93Å; M424-F428 WeakPolarHBondContact O-CB 3.42Å; M424-F428 WeakPolarHBondContact O-CD2 3.41Å; M424-F428 PolarHBondContact O-N 2.9Å; M424-F428 HydrophobicContact SD-CE2 4.03Å; M424-L448 HydrophobicContact CB-CD1 3.61Å; M424-L448 HydrophobicContact CB-CD2 3.51Å; M424-L448 HydrophobicContact CB-CG 4.23Å; M424-L448 HydrophobicContact CE-CD2 3.85Å; M424-L448 HydrophobicContact CG-CD2 3.73Å; M424-V471 HydrophobicContact CG-CG1 4.04Å; M424-V471 HydrophobicContact CG-CG2 4.43Å; M424-V471 HydrophobicContact SD-CB 4.46Å; M424-V471 HydrophobicContact SD-CG1 3.6Å; M424-V471 VanDerWaalsContact SD-CG1 3.6Å; M424-V471 HydrophobicContact SD-CG2 3.92Å; M424-I496 HydrophobicContact CE-CG2 4.3Å; M424-I496 HydrophobicContact SD-CG2 3.66Å; M424-A500 HydrophobicContact CE-CB 3.53Å; M424-A500 HydrophobicContact CG-CB 4.27Å; M424-A500 HydrophobicContact SD-CB 3.71Å
425	H	97.7	Very high	97.5	Very high	9 Å²	9	33.4 Å²	33.4	4%	0.042	17%	0.172	C	C	.	.	H	α-helix	trans	-61.4	-44.7	176.4	178.6	-102.3	0	0	0	111.4	R383 T421 V422 I423 F428 Q429 I445	R383-H425 PolarHBondContact O-CE1 2.98Å; R383-H425 VanDerWaalsContact O-CE1 3.28Å; T421-H425 VanDerWaalsContact O-CB 3.27Å; T421-H425 WeakPolarHBondContact O-CB 3.34Å; T421-H425 PolarHBondContact O-N 3.28Å; V422-H425 PolarHBondContact O-N 2.97Å; I423-H425 PolarHBondContact O-N 3Å; H425-F428 PolarHBondContact O-N 3.06Å; H425-Q429 PolarHBondContact NE2-NE2 3.32Å; H425-Q429 VanDerWaalsContact O-CG 3.26Å; H425-Q429 WeakPolarHBondContact O-CG 3.47Å; H425-Q429 PolarHBondContact O-N 3.48Å; H425-Q429 VanDerWaalsContact O-N 3.11Å; H425-I445 HydrophobicContact CB-CD1 3.94Å
426	T	97.8	Very high	97.6	Very high	21 Å²	21	36 Å²	36	13%	0.129	19%	0.188	C	C	.	.	H	α-helix	trans	-63.2	-48.9	-179.8	-53.7	0	0	0	0	111.3	L398 V401 V422 I423 M424 F428 Q429 E430	L398-T426 HydrophobicContact CD2-CG2 4.37Å; V401-T426 HydrophobicContact CB-CG2 4.44Å; V401-T426 HydrophobicContact CG1-CG2 4.23Å; V401-T426 HydrophobicContact CG2-CG2 4.22Å; V422-T426 WeakPolarHBondContact O-CB 3.23Å; V422-T426 PolarHBondContact O-N 3.22Å; V422-T426 PolarHBondContact O-OG1 3.39Å; I423-T426 PolarHBondContact O-N 3.13Å; M424-T426 VanDerWaalsContact C-N 3.34Å; M424-T426 PolarHBondContact O-N 2.94Å; T426-F428 VanDerWaalsContact C-N 3.34Å; T426-F428 PolarHBondContact O-N 3.42Å; T426-Q429 PolarHBondContact O-N 2.89Å; T426-Q429 VanDerWaalsContact O-N 3.17Å; T426-E430 WeakPolarHBondContact O-CB 3.47Å; T426-E430 PolarHBondContact O-N 2.74Å
427	I	98.4	Very high	97.8	Very high	0 Å²	0	33.8 Å²	33.8	0%	0	16%	0.161	C	C	.	.	H	α-helix	trans	-61.1	-39.5	177.4	-73.8	165.7	0	0	0	112.1	V401 I423 Q429 E430 R431 V471 Q472 H475 I496	V401-I427 HydrophobicContact CG2-CD1 4.45Å; V401-I427 HydrophobicContact CG2-CG1 3.89Å; I423-I427 HydrophobicContact CG2-CD1 3.53Å; I423-I427 HydrophobicContact CG2-CG1 4.49Å; I423-I427 WeakPolarHBondContact O-CB 3.41Å; I423-I427 WeakPolarHBondContact O-CG1 3.34Å; I423-I427 PolarHBondContact O-N 3.29Å; I427-Q429 VanDerWaalsContact C-N 3.33Å; I427-Q429 PolarHBondContact O-N 2.88Å; I427-E430 PolarHBondContact O-N 3.48Å; I427-R431 WeakPolarHBondContact O-CB 3.4Å; I427-R431 PolarHBondContact O-N 2.72Å; I427-V471 HydrophobicContact CD1-CG1 3.65Å; I427-Q472 HydrophobicContact CD1-CB 4.48Å; I427-H475 HydrophobicContact CD1-CB 3.67Å; I427-H475 HydrophobicContact CG1-CB 4.11Å; I427-H475 HydrophobicContact CG2-CB 4.27Å; I427-H475 WeakPolarHBondContact CG2-ND1 3.35Å; I427-I496 HydrophobicContact CG2-CD1 3.82Å; I427-I496 HydrophobicContact CG2-CG2 4.11Å
428	F	97.9	Very high	97.9	Very high	0 Å²	0	37.5 Å²	37.5	0%	0	17%	0.174	C	C	.	.	H	α-helix	trans	-65.8	-36.6	177.4	-88	-129	0	0	0	112	M424 H425 T426 D432 L433 L434 I439 L444 L493 I496	M424-F428 HydrophobicContact CE-CD2 4.41Å; M424-F428 HydrophobicContact CE-CE2 3.49Å; M424-F428 VanDerWaalsContact CE-CE2 3.49Å; M424-F428 HydrophobicContact CE-CZ 3.93Å; M424-F428 WeakPolarHBondContact O-CB 3.42Å; M424-F428 WeakPolarHBondContact O-CD2 3.41Å; M424-F428 PolarHBondContact O-N 2.9Å; M424-F428 HydrophobicContact SD-CE2 4.03Å; H425-F428 PolarHBondContact O-N 3.06Å; T426-F428 VanDerWaalsContact C-N 3.34Å; T426-F428 PolarHBondContact O-N 3.42Å; F428-D432 CarbonylContact O-C 3.59Å; F428-D432 PolarHBondContact O-N 3.13Å; F428-L433 HydrophobicContact CB-CB 4.43Å; F428-L433 HydrophobicContact CD1-CB 4.04Å; F428-L433 HydrophobicContact CD2-CD1 4.07Å; F428-L433 HydrophobicContact CE2-CD1 4.26Å; F428-L433 HydrophobicContact CG-CB 4.22Å; F428-L433 HydrophobicContact CG-CD1 4.2Å; F428-L433 PolarHBondContact O-N 3.34Å; F428-L434 VanDerWaalsContact C-CD1 3.41Å; F428-L434 HydrophobicContact CB-CD1 3.77Å; F428-L434 HydrophobicContact CB-CG 4.24Å; F428-L434 VanDerWaalsContact O-CD1 3.31Å; F428-L434 WeakPolarHBondContact O-CD1 3.36Å; F428-I439 HydrophobicContact CD1-CD1 4.19Å; F428-I439 HydrophobicContact CE1-CD1 3.78Å; F428-L444 HydrophobicContact CB-CD2 4.01Å; F428-L444 HydrophobicContact CD1-CD1 3.87Å; F428-L444 HydrophobicContact CD1-CD2 3.69Å; F428-L444 HydrophobicContact CD1-CG 4.46Å; F428-L444 HydrophobicContact CE1-CD1 3.76Å; F428-L444 HydrophobicContact CE1-CD2 4.44Å; F428-L444 HydrophobicContact CG-CD2 4.02Å; F428-L444 HydrophobicContact CZ-CD1 4.35Å; F428-L493 HydrophobicContact CE1-CD1 3.92Å; F428-L493 HydrophobicContact CZ-CD1 3.71Å; F428-I496 HydrophobicContact CD2-CG2 4.5Å; F428-I496 HydrophobicContact CE2-CG2 3.87Å
429	Q	96.5	Very high	97.9	Very high	96 Å²	96	35.1 Å²	35.1	45%	0.449	17%	0.165	S	C	.	.	H	α-helix	trans	-70.2	-48.1	175.3	-62.9	-76.2	-1.7	0	0	110.9	H425 T426 I427 R431 D432 L434	H425-Q429 PolarHBondContact NE2-NE2 3.32Å; H425-Q429 VanDerWaalsContact O-CG 3.26Å; H425-Q429 WeakPolarHBondContact O-CG 3.47Å; H425-Q429 PolarHBondContact O-N 3.48Å; H425-Q429 VanDerWaalsContact O-N 3.11Å; T426-Q429 PolarHBondContact O-N 2.89Å; T426-Q429 VanDerWaalsContact O-N 3.17Å; I427-Q429 VanDerWaalsContact C-N 3.33Å; I427-Q429 PolarHBondContact O-N 2.88Å; Q429-R431 VanDerWaalsContact C-N 3.31Å; Q429-R431 PolarHBondContact O-N 3.12Å; Q429-D432 PolarHBondContact O-N 3.39Å; Q429-L434 HydrophobicContact CB-CD1 4.41Å; Q429-L434 HydrophobicContact CG-CD1 3.93Å
430	E	97.2	Very high	97.8	Very high	105 Å²	105	37 Å²	37	49%	0.491	18%	0.177	S	C	.	.	H	α-helix	trans	-57.3	-41.7	-179.9	-174.8	68.3	177.1	0	0	112.2	N402 T426 I427 H475	N402-E430 PolarHBondContact ND2-OE1 3.48Å; T426-E430 WeakPolarHBondContact O-CB 3.47Å; T426-E430 PolarHBondContact O-N 2.74Å; I427-E430 PolarHBondContact O-N 3.48Å; E430-H475 VanDerWaalsContact CG-CE1 3.44Å; E430-H475 WeakPolarHBondContact CG-CE1 3.4Å
431	R	97.7	Very high	97.7	Very high	51 Å²	51	39.1 Å²	39.1	19%	0.192	19%	0.19	C	C	.	.	T	Hydrogen-bonded Turn	trans	-91.4	11.8	176.3	-65.4	-171.2	178.4	-85.5	-2.9	114.2	I427 Q429 L433 H475 S479	I427-R431 WeakPolarHBondContact O-CB 3.4Å; I427-R431 PolarHBondContact O-N 2.72Å; Q429-R431 VanDerWaalsContact C-N 3.31Å; Q429-R431 PolarHBondContact O-N 3.12Å; R431-L433 HydrophobicContact CB-CD1 4.16Å; R431-L433 HydrophobicContact CB-CD2 4.2Å; R431-L433 HydrophobicContact CB-CG 3.78Å; R431-L433 PolarHBondContact O-N 2.93Å; R431-H475 WeakPolarHBondContact CG-CE1 3.2Å; R431-H475 PolarHBondContact NE-CE1 3.02Å; R431-H475 VanDerWaalsContact NE-CE1 3.27Å; R431-H475 PolarHBondContact NE-ND1 2.75Å; R431-H475 PolarHBondContact NH2-O 3.27Å; R431-S479 PolarHBondContact NH2-OG 3.45Å
432	D	97.7	Very high	97.5	Very high	64 Å²	64	40.5 Å²	40.5	34%	0.342	20%	0.198	S	C	.	.	T	Hydrogen-bonded Turn	trans	54	17.7	178.9	-168.9	56.7	0	0	0	115.4	F428 Q429 L434 K435 T436	F428-D432 CarbonylContact O-C 3.59Å; F428-D432 PolarHBondContact O-N 3.13Å; Q429-D432 PolarHBondContact O-N 3.39Å; D432-L434 VanDerWaalsContact C-N 3.25Å; D432-L434 PolarHBondContact O-N 3.37Å; D432-L434 VanDerWaalsContact O-N 3.16Å; D432-K435 PolarHBondContact O-N 2.95Å; D432-K435 VanDerWaalsContact OD1-CB 3.27Å; D432-K435 WeakPolarHBondContact OD1-CB 3.37Å; D432-K435 IonicContact OD1-NZ 3.84Å; D432-K435 PolarHBondContact OD1-NZ 2.67Å; D432-K435 IonicContact OD2-NZ 2.7Å; D432-K435 PolarHBondContact OD2-NZ 2.78Å; D432-T436 PolarHBondContact O-N 2.94Å; D432-T436 PolarHBondContact O-OG1 2.69Å
433	L	98.2	Very high	97.5	Very high	2 Å²	2	40.5 Å²	40.5	1%	0.01	20%	0.198	C	C	.	.	H	α-helix	trans	-62	-31.8	-170	-61.7	178.2	0	0	0	112.3	F428 R431 K435 F437 I492 L493 I496	F428-L433 HydrophobicContact CB-CB 4.43Å; F428-L433 HydrophobicContact CD1-CB 4.04Å; F428-L433 HydrophobicContact CD2-CD1 4.07Å; F428-L433 HydrophobicContact CE2-CD1 4.26Å; F428-L433 HydrophobicContact CG-CB 4.22Å; F428-L433 HydrophobicContact CG-CD1 4.2Å; F428-L433 PolarHBondContact O-N 3.34Å; R431-L433 HydrophobicContact CB-CD1 4.16Å; R431-L433 HydrophobicContact CB-CD2 4.2Å; R431-L433 HydrophobicContact CB-CG 3.78Å; R431-L433 PolarHBondContact O-N 2.93Å; L433-K435 VanDerWaalsContact C-N 3.3Å; L433-K435 PolarHBondContact O-N 3.39Å; L433-F437 HydrophobicContact CB-CD2 4.48Å; L433-F437 HydrophobicContact CD2-CD2 4.4Å; L433-F437 HydrophobicContact CD2-CE2 4.06Å; L433-F437 WeakPolarHBondContact O-CB 3.29Å; L433-F437 PolarHBondContact O-N 3.48Å; L433-I492 HydrophobicContact CD2-CG2 4.25Å; L433-L493 HydrophobicContact CD1-CD1 4.49Å; L433-I496 HydrophobicContact CD1-CD1 4.18Å
434	L	97.2	Very high	97.4	Very high	16 Å²	16	40.5 Å²	40.5	8%	0.084	20%	0.198	C	C	.	.	H	α-helix	trans	-61.5	-38.8	174.8	-52.7	98.2	0	0	0	111.6	F428 Q429 D432 K438 I439 V441 L444	F428-L434 VanDerWaalsContact C-CD1 3.41Å; F428-L434 HydrophobicContact CB-CD1 3.77Å; F428-L434 HydrophobicContact CB-CG 4.24Å; F428-L434 VanDerWaalsContact O-CD1 3.31Å; F428-L434 WeakPolarHBondContact O-CD1 3.36Å; Q429-L434 HydrophobicContact CB-CD1 4.41Å; Q429-L434 HydrophobicContact CG-CD1 3.93Å; D432-L434 VanDerWaalsContact C-N 3.25Å; D432-L434 PolarHBondContact O-N 3.37Å; D432-L434 VanDerWaalsContact O-N 3.16Å; L434-K438 CarbonylContact O-C 3.59Å; L434-K438 WeakPolarHBondContact O-CA 3.4Å; L434-K438 PolarHBondContact O-N 3.4Å; L434-I439 PolarHBondContact O-N 2.92Å; L434-V441 HydrophobicContact CD2-CB 4.37Å; L434-V441 HydrophobicContact CD2-CG1 4.31Å; L434-V441 HydrophobicContact CD2-CG2 3.91Å; L434-L444 HydrophobicContact CD2-CD2 3.7Å; L434-L444 HydrophobicContact CG-CD2 4.1Å
435	K	97.7	Very high	97.3	Very high	143 Å²	143	40.5 Å²	40.5	62%	0.622	20%	0.198	S	C	*	.	H	α-helix	trans	-78.6	-46.4	-179.3	-168.8	159.2	95.3	-75.6	0	111	D432 L433 F437 K438	D432-K435 PolarHBondContact O-N 2.95Å; D432-K435 VanDerWaalsContact OD1-CB 3.27Å; D432-K435 WeakPolarHBondContact OD1-CB 3.37Å; D432-K435 IonicContact OD1-NZ 3.84Å; D432-K435 PolarHBondContact OD1-NZ 2.67Å; D432-K435 IonicContact OD2-NZ 2.7Å; D432-K435 PolarHBondContact OD2-NZ 2.78Å; L433-K435 VanDerWaalsContact C-N 3.3Å; L433-K435 PolarHBondContact O-N 3.39Å; K435-F437 VanDerWaalsContact C-N 3.34Å; K435-F437 PolarHBondContact O-N 3.17Å; K435-K438 PolarHBondContact O-N 2.92Å
436	T	97.9	Very high	97.3	Very high	58 Å²	58	40.8 Å²	40.8	36%	0.356	20%	0.2	S	C	.	.	H	α-helix	trans	-57.7	-44.3	178.5	-65	0	0	0	0	112.1	D432 D489	D432-T436 PolarHBondContact O-N 2.94Å; D432-T436 PolarHBondContact O-OG1 2.69Å; T436-D489 HydrophobicContact CG2-CB 3.91Å
437	F	98.2	Very high	97.3	Very high	13 Å²	13	39.8 Å²	39.8	6%	0.057	19%	0.194	C	C	.	.	H	α-helix	trans	-101.5	2.1	-178.9	-62.5	-59.9	0	0	0	115.2	L433 K435 I439 D489 L490 L493 L554	L433-F437 HydrophobicContact CB-CD2 4.48Å; L433-F437 HydrophobicContact CD2-CD2 4.4Å; L433-F437 HydrophobicContact CD2-CE2 4.06Å; L433-F437 WeakPolarHBondContact O-CB 3.29Å; L433-F437 PolarHBondContact O-N 3.48Å; K435-F437 VanDerWaalsContact C-N 3.34Å; K435-F437 PolarHBondContact O-N 3.17Å; F437-I439 VanDerWaalsContact C-N 3.31Å; F437-I439 HydrophobicContact CB-CD1 4.07Å; F437-I439 HydrophobicContact CB-CG1 3.84Å; F437-I439 PolarHBondContact O-N 3.06Å; F437-D489 HydrophobicContact CE2-CB 3.8Å; F437-D489 WeakPolarHBondContact CE2-O 3.47Å; F437-D489 VanDerWaalsContact CZ-C 3.48Å; F437-D489 HydrophobicContact CZ-CB 3.52Å; F437-D489 WeakPolarHBondContact CZ-O 3.29Å; F437-L490 HydrophobicContact CE1-CD1 3.99Å; F437-L490 HydrophobicContact CZ-CB 4.25Å; F437-L490 HydrophobicContact CZ-CD1 4.16Å; F437-L493 HydrophobicContact CD2-CB 4.47Å; F437-L493 HydrophobicContact CD2-CD2 3.74Å; F437-L493 HydrophobicContact CD2-CG 4.48Å; F437-L493 HydrophobicContact CE2-CB 3.89Å; F437-L493 HydrophobicContact CE2-CD2 3.81Å; F437-L493 HydrophobicContact CE2-CG 4.36Å; F437-L493 HydrophobicContact CG-CD2 4.12Å; F437-L493 HydrophobicContact CZ-CB 4.47Å; F437-L493 HydrophobicContact CZ-CD2 4.25Å; F437-L554 HydrophobicContact CB-CD2 3.98Å; F437-L554 HydrophobicContact CD1-CD2 3.29Å; F437-L554 HydrophobicContact CE1-CD2 4.04Å; F437-L554 HydrophobicContact CG-CD2 3.92Å
438	K	98.1	Very high	97.3	Very high	150 Å²	150	39.8 Å²	39.8	65%	0.652	19%	0.194	S	C	*	.	T	Hydrogen-bonded Turn	trans	55.8	45.1	178.2	-54.4	172.4	-174	171.4	0	111.9	L434 K435 P440 N553	L434-K438 CarbonylContact O-C 3.59Å; L434-K438 WeakPolarHBondContact O-CA 3.4Å; L434-K438 PolarHBondContact O-N 3.4Å; K435-K438 PolarHBondContact O-N 2.92Å; K438-P440 WeakPolarHBondContact O-CD 3.37Å; K438-N553 HydrophobicContact CB-CB 4.14Å; K438-N553 PolarHBondContact O-ND2 3.46Å
439	I	97.8	Very high	97.2	Very high	8 Å²	8	41.5 Å²	41.5	4%	0.041	20%	0.203	C	C	.	.			trans	-83.5	119.5	179.7	-47.9	-178.3	0	0	0	107.6	F428 L434 F437 V441 L444 I550	F428-I439 HydrophobicContact CD1-CD1 4.19Å; F428-I439 HydrophobicContact CE1-CD1 3.78Å; L434-I439 PolarHBondContact O-N 2.92Å; F437-I439 VanDerWaalsContact C-N 3.31Å; F437-I439 HydrophobicContact CB-CD1 4.07Å; F437-I439 HydrophobicContact CB-CG1 3.84Å; F437-I439 PolarHBondContact O-N 3.06Å; I439-V441 PolarHBondContact O-N 2.98Å; I439-L444 HydrophobicContact CG2-CB 4.07Å; I439-I550 HydrophobicContact CG2-CB 3.83Å; I439-I550 HydrophobicContact CG2-CG2 3.91Å
440	P	96.7	Very high	97.3	Very high	39 Å²	39	37.4 Å²	37.4	25%	0.253	18%	0.184	S	C	.	.			trans	-63.7	135.8	173.8	-17	30.6	0	0	0	110	K438 D442 T443 L444	K438-P440 WeakPolarHBondContact O-CD 3.37Å; P440-D442 WeakPolarHBondContact CB-OD1 3.4Å; P440-D442 PolarHBondContact O-N 3.15Å; P440-T443 WeakPolarHBondContact CB-OG1 3.25Å; P440-T443 WeakPolarHBondContact CG-OG1 3.35Å; P440-T443 WeakPolarHBondContact O-CB 3.32Å; P440-T443 PolarHBondContact O-N 2.86Å; P440-T443 VanDerWaalsContact O-N 3.12Å; P440-L444 PolarHBondContact O-N 2.78Å
441	V	95.6	Very high	97.3	Very high	45 Å²	45	32.4 Å²	32.4	27%	0.273	16%	0.161	S	C	.	.	H	α-helix	trans	-61.8	-37.4	-176.4	-165.8	0	0	0	0	110.8	I381 L434 I439 L444 I445	I381-V441 HydrophobicContact CD1-CB 3.88Å; I381-V441 HydrophobicContact CD1-CG1 4.11Å; I381-V441 HydrophobicContact CG2-CG1 4.1Å; L434-V441 HydrophobicContact CD2-CB 4.37Å; L434-V441 HydrophobicContact CD2-CG1 4.31Å; L434-V441 HydrophobicContact CD2-CG2 3.91Å; I439-V441 PolarHBondContact O-N 2.98Å; V441-L444 PolarHBondContact O-N 2.86Å; V441-I445 HydrophobicContact CG1-CG1 4.48Å; V441-I445 WeakPolarHBondContact O-CG1 3.49Å; V441-I445 PolarHBondContact O-N 3.03Å
442	D	95	Very high	97.4	Very high	29 Å²	29	30.3 Å²	30.3	16%	0.155	15%	0.153	C	C	.	.	H	α-helix	trans	-64.7	-41.4	174.5	60.6	-69.5	0	0	0	112.6	I381 P440 T446 N547	I381-D442 HydrophobicContact CD1-CB 4.38Å; P440-D442 WeakPolarHBondContact CB-OD1 3.4Å; P440-D442 PolarHBondContact O-N 3.15Å; D442-T446 VanDerWaalsContact O-CB 3.28Å; D442-T446 WeakPolarHBondContact O-CB 3.28Å; D442-T446 PolarHBondContact O-N 3.12Å; D442-T446 PolarHBondContact O-OG1 3.32Å; D442-N547 PolarHBondContact OD2-ND2 3.08Å
443	T	96.8	Very high	97.4	Very high	1 Å²	1	29.3 Å²	29.3	1%	0.006	15%	0.148	C	C	.	.	H	α-helix	trans	-62.6	-42.9	172.1	-52.6	0	0	0	0	111.2	P440 T446 Y447 N547 I550	P440-T443 WeakPolarHBondContact CB-OG1 3.25Å; P440-T443 WeakPolarHBondContact CG-OG1 3.35Å; P440-T443 WeakPolarHBondContact O-CB 3.32Å; P440-T443 PolarHBondContact O-N 2.86Å; P440-T443 VanDerWaalsContact O-N 3.12Å; T443-T446 PolarHBondContact O-N 2.87Å; T443-Y447 WeakPolarHBondContact O-CB 3.17Å; T443-Y447 PolarHBondContact O-N 3.02Å; T443-N547 WeakPolarHBondContact CA-O 3.44Å; T443-N547 VanDerWaalsContact CG2-O 3.28Å; T443-N547 WeakPolarHBondContact CG2-O 3.34Å; T443-N547 PolarHBondContact OG1-OD1 3.11Å; T443-I550 HydrophobicContact CG2-CG2 3.96Å
444	L	97.6	Very high	97.4	Very high	0 Å²	0	29.7 Å²	29.7	0%	0	15%	0.15	C	C	.	.	H	α-helix	trans	-62	-51.8	178.8	-178.5	62.6	0	0	0	111.5	F428 L434 I439 P440 V441 T446 Y447 L448 I550	F428-L444 HydrophobicContact CB-CD2 4.01Å; F428-L444 HydrophobicContact CD1-CD1 3.87Å; F428-L444 HydrophobicContact CD1-CD2 3.69Å; F428-L444 HydrophobicContact CD1-CG 4.46Å; F428-L444 HydrophobicContact CE1-CD1 3.76Å; F428-L444 HydrophobicContact CE1-CD2 4.44Å; F428-L444 HydrophobicContact CG-CD2 4.02Å; F428-L444 HydrophobicContact CZ-CD1 4.35Å; L434-L444 HydrophobicContact CD2-CD2 3.7Å; L434-L444 HydrophobicContact CG-CD2 4.1Å; I439-L444 HydrophobicContact CG2-CB 4.07Å; P440-L444 PolarHBondContact O-N 2.78Å; V441-L444 PolarHBondContact O-N 2.86Å; L444-T446 VanDerWaalsContact C-N 3.35Å; L444-T446 PolarHBondContact O-N 3.33Å; L444-Y447 PolarHBondContact O-N 3.06Å; L444-L448 HydrophobicContact CD1-CD1 3.89Å; L444-L448 HydrophobicContact CD1-CG 4.12Å; L444-L448 HydrophobicContact CG-CD1 3.82Å; L444-L448 HydrophobicContact CG-CG 4.41Å; L444-L448 WeakPolarHBondContact O-CB 3.17Å; L444-L448 VanDerWaalsContact O-CG 3.27Å; L444-L448 WeakPolarHBondContact O-CG 3.47Å; L444-L448 PolarHBondContact O-N 2.63Å; L444-I550 HydrophobicContact CB-CG2 4.42Å; L444-I550 HydrophobicContact CD1-CG2 4.13Å
445	I	96.5	Very high	97.4	Very high	0 Å²	0	29.4 Å²	29.4	0%	0	15%	0.147	C	C	.	.	H	α-helix	trans	-65.4	-37.6	179.6	-62.8	-53.8	0	0	0	111.6	L376 T421 H425 V441 L448 M449	L376-I445 HydrophobicContact CD1-CB 4.43Å; L376-I445 HydrophobicContact CD1-CG2 3.85Å; T421-I445 HydrophobicContact CG2-CD1 4.11Å; H425-I445 HydrophobicContact CB-CD1 3.94Å; V441-I445 HydrophobicContact CG1-CG1 4.48Å; V441-I445 WeakPolarHBondContact O-CG1 3.49Å; V441-I445 PolarHBondContact O-N 3.03Å; I445-L448 HydrophobicContact CD1-CD1 4.45Å; I445-L448 PolarHBondContact O-N 3.45Å; I445-M449 HydrophobicContact CG2-CE 3.61Å; I445-M449 HydrophobicContact CG2-CG 4.2Å; I445-M449 HydrophobicContact CG2-SD 3.81Å; I445-M449 WeakPolarHBondContact O-CB 3.18Å; I445-M449 WeakPolarHBondContact O-CG 3.46Å; I445-M449 PolarHBondContact O-N 3.44Å
446	T	96.6	Very high	97.4	Very high	15 Å²	15	24.9 Å²	24.9	9%	0.092	13%	0.128	C	C	.	.	H	α-helix	trans	-64.1	-43.6	176.4	-53.7	0	0	0	0	111.3	D442 T443 L444 T450 N547	D442-T446 VanDerWaalsContact O-CB 3.28Å; D442-T446 WeakPolarHBondContact O-CB 3.28Å; D442-T446 PolarHBondContact O-N 3.12Å; D442-T446 PolarHBondContact O-OG1 3.32Å; T443-T446 PolarHBondContact O-N 2.87Å; L444-T446 VanDerWaalsContact C-N 3.35Å; L444-T446 PolarHBondContact O-N 3.33Å; T446-T450 WeakPolarHBondContact O-CB 3.36Å; T446-T450 PolarHBondContact O-N 2.83Å; T446-T450 VanDerWaalsContact O-N 3.15Å; T446-T450 PolarHBondContact O-OG1 3.34Å; T446-N547 HydrophobicContact CG2-CB 4.38Å
447	Y	98.3	Very high	97.4	Very high	0 Å²	0	26.2 Å²	26.2	0%	0	15%	0.146	C	C	.	.	H	α-helix	trans	-63.4	-48.4	174.6	179.3	-98.1	0	0	0	111.8	T443 L444 T450 L451 F497 G539 L542 L543 C548 I550	T443-Y447 WeakPolarHBondContact O-CB 3.17Å; T443-Y447 PolarHBondContact O-N 3.02Å; L444-Y447 PolarHBondContact O-N 3.06Å; Y447-T450 PolarHBondContact O-N 2.81Å; Y447-L451 HydrophobicContact CE1-CB 4.28Å; Y447-L451 HydrophobicContact CE1-CD2 3.82Å; Y447-L451 WeakPolarHBondContact O-CB 3.3Å; Y447-L451 PolarHBondContact O-N 2.74Å; Y447-F497 HydrophobicContact CE1-CD2 4.43Å; Y447-F497 AromaticContact CE1-CE2 3.62Å; Y447-F497 HydrophobicContact CE1-CE2 3.62Å; Y447-F497 HydrophobicContact CE1-CZ 4.47Å; Y447-F497 AromaticContact CZ-CE2 3.69Å; Y447-F497 VanDerWaalsContact OH-CE2 3.32Å; Y447-F497 WeakPolarHBondContact OH-CE2 3.28Å; Y447-F497 WeakPolarHBondContact OH-CZ 3.46Å; Y447-G539 PolarHBondContact OH-O 2.81Å; Y447-L542 HydrophobicContact CD2-CB 4.45Å; Y447-L542 HydrophobicContact CE2-CB 3.81Å; Y447-L543 HydrophobicContact CD2-CD2 3.81Å; Y447-L543 HydrophobicContact CD2-CG 4.45Å; Y447-L543 HydrophobicContact CE2-CD2 3.51Å; Y447-L543 HydrophobicContact CE2-CG 3.82Å; Y447-C548 HydrophobicContact CD2-CB 4.13Å; Y447-C548 VanDerWaalsContact CD2-O 3.31Å; Y447-C548 WeakPolarHBondContact CD2-O 3.32Å; Y447-I550 HydrophobicContact CD1-CD1 4.03Å; Y447-I550 HydrophobicContact CD1-CG1 4.48Å; Y447-I550 HydrophobicContact CD1-CG2 4.5Å; Y447-I550 HydrophobicContact CE1-CD1 4.25Å; Y447-I550 HydrophobicContact CG-CG2 4.23Å
448	L	98.2	Very high	97.4	Very high	0 Å²	0	30.4 Å²	30.4	0%	0	17%	0.168	C	C	.	.	H	α-helix	trans	-63.1	-44.2	-177.7	-71.7	173.5	0	0	0	112.6	T421 M424 L444 I445 T450 L451 E452	T421-L448 HydrophobicContact CG2-CB 4.09Å; M424-L448 HydrophobicContact CB-CD1 3.61Å; M424-L448 HydrophobicContact CB-CD2 3.51Å; M424-L448 HydrophobicContact CB-CG 4.23Å; M424-L448 HydrophobicContact CE-CD2 3.85Å; M424-L448 HydrophobicContact CG-CD2 3.73Å; L444-L448 HydrophobicContact CD1-CD1 3.89Å; L444-L448 HydrophobicContact CD1-CG 4.12Å; L444-L448 HydrophobicContact CG-CD1 3.82Å; L444-L448 HydrophobicContact CG-CG 4.41Å; L444-L448 WeakPolarHBondContact O-CB 3.17Å; L444-L448 VanDerWaalsContact O-CG 3.27Å; L444-L448 WeakPolarHBondContact O-CG 3.47Å; L444-L448 PolarHBondContact O-N 2.63Å; I445-L448 HydrophobicContact CD1-CD1 4.45Å; I445-L448 PolarHBondContact O-N 3.45Å; L448-T450 VanDerWaalsContact C-N 3.3Å; L448-T450 PolarHBondContact O-N 2.83Å; L448-L451 HydrophobicContact CD2-CD2 4.49Å; L448-L451 PolarHBondContact O-N 3.46Å; L448-E452 VanDerWaalsContact O-CB 3.26Å; L448-E452 WeakPolarHBondContact O-CB 3.46Å; L448-E452 PolarHBondContact O-N 3.37Å
449	M	96.6	Very high	97.4	Very high	36 Å²	36	23.5 Å²	23.5	18%	0.177	14%	0.139	C	C	.	.	H	α-helix	trans	-63.2	-37.2	174.9	-71.5	179.4	172	0	0	111.9	V386 R418 T421 I445 D453	V386-M449 HydrophobicContact CG1-CE 4.36Å; R418-M449 PolarHBondContact NH1-O 3.21Å; T421-M449 HydrophobicContact CG2-CE 4.45Å; T421-M449 HydrophobicContact CG2-CG 4.17Å; I445-M449 HydrophobicContact CG2-CE 3.61Å; I445-M449 HydrophobicContact CG2-CG 4.2Å; I445-M449 HydrophobicContact CG2-SD 3.81Å; I445-M449 WeakPolarHBondContact O-CB 3.18Å; I445-M449 WeakPolarHBondContact O-CG 3.46Å; I445-M449 PolarHBondContact O-N 3.44Å; M449-D453 WeakPolarHBondContact O-CB 3.37Å; M449-D453 VanDerWaalsContact O-CG 3.23Å; M449-D453 PolarHBondContact O-N 3.08Å
450	T	97.3	Very high	97.4	Very high	11 Å²	11	23.4 Å²	23.4	7%	0.067	14%	0.14	C	C	.	.	H	α-helix	trans	-71.6	-35.9	177	-56.4	0	0	0	0	112.3	T446 Y447 L448 H454 L542	T446-T450 WeakPolarHBondContact O-CB 3.36Å; T446-T450 PolarHBondContact O-N 2.83Å; T446-T450 VanDerWaalsContact O-N 3.15Å; T446-T450 PolarHBondContact O-OG1 3.34Å; Y447-T450 PolarHBondContact O-N 2.81Å; L448-T450 VanDerWaalsContact C-N 3.3Å; L448-T450 PolarHBondContact O-N 2.83Å; T450-H454 PolarHBondContact O-ND1 3.47Å; T450-L542 HydrophobicContact CG2-CD1 4.45Å; T450-L542 HydrophobicContact CG2-CD2 4.13Å
451	L	98.4	Very high	97.5	Very high	0 Å²	0	22.2 Å²	22.2	0%	0	13%	0.13	C	C	.	.	H	α-helix	trans	-66.2	-48.7	174	171.7	61.3	0	0	0	111	L420 Y447 L448 D453 H454 Y455 A500 I501 V504 L542	L420-L451 HydrophobicContact CD2-CD2 4.12Å; L420-L451 HydrophobicContact CD2-CG 4.08Å; Y447-L451 HydrophobicContact CE1-CB 4.28Å; Y447-L451 HydrophobicContact CE1-CD2 3.82Å; Y447-L451 WeakPolarHBondContact O-CB 3.3Å; Y447-L451 PolarHBondContact O-N 2.74Å; L448-L451 HydrophobicContact CD2-CD2 4.49Å; L448-L451 PolarHBondContact O-N 3.46Å; L451-D453 VanDerWaalsContact C-N 3.31Å; L451-D453 PolarHBondContact O-N 2.74Å; L451-H454 PolarHBondContact O-N 2.87Å; L451-Y455 HydrophobicContact CD1-CE2 4.05Å; L451-Y455 HydrophobicContact CG-CE2 4.23Å; L451-Y455 WeakPolarHBondContact O-CD2 3.3Å; L451-A500 HydrophobicContact CD2-CB 4.15Å; L451-I501 HydrophobicContact CD1-CG2 3.9Å; L451-I501 HydrophobicContact CD2-CG2 3.96Å; L451-V504 HydrophobicContact CD1-CB 3.87Å; L451-V504 HydrophobicContact CD1-CG1 4.35Å; L451-V504 HydrophobicContact CD1-CG2 3.61Å; L451-L542 HydrophobicContact CB-CD1 4.34Å; L451-L542 HydrophobicContact CD1-CD1 4.29Å
452	E	98.4	Very high	97.7	Very high	6 Å²	6	21.7 Å²	21.7	3%	0.028	12%	0.124	C	C	.	.	H	α-helix	trans	-63	-34.9	178.9	-175.6	155.2	-134.8	0	0	112.4	R418 P419 L420 T421 L448 H454 Y455 N464	R418-E452 VanDerWaalsContact CA-OE1 3.29Å; R418-E452 WeakPolarHBondContact CA-OE1 3.32Å; R418-E452 WeakPolarHBondContact CA-OE2 3.33Å; R418-E452 WeakPolarHBondContact CD-OE2 3.39Å; R418-E452 IonicContact NH1-OE2 2.78Å; P419-E452 VanDerWaalsContact CD-OE1 3.31Å; P419-E452 WeakPolarHBondContact CD-OE1 3.49Å; L420-E452 HydrophobicContact CB-CG 4.38Å; L420-E452 WeakPolarHBondContact CB-OE1 3.09Å; L420-E452 HydrophobicContact CD2-CB 4.46Å; L420-E452 PolarHBondContact N-OE1 2.93Å; T421-E452 VanDerWaalsContact CB-OE2 3.25Å; T421-E452 WeakPolarHBondContact CB-OE2 3.16Å; T421-E452 PolarHBondContact N-OE2 2.94Å; T421-E452 PolarHBondContact OG1-OE2 2.97Å; L448-E452 VanDerWaalsContact O-CB 3.26Å; L448-E452 WeakPolarHBondContact O-CB 3.46Å; L448-E452 PolarHBondContact O-N 3.37Å; E452-H454 PolarHBondContact O-N 3.2Å; E452-Y455 PolarHBondContact O-N 2.97Å; E452-N464 HydrophobicContact CG-CB 3.75Å; E452-N464 PolarHBondContact OE1-ND2 3.08Å
453	D	97.6	Very high	97.8	Very high	44 Å²	44	20.6 Å²	20.6	24%	0.235	12%	0.119	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68.6	-13.2	172.2	-76.4	6.6	0	0	0	114.6	L370 H372 R418 M449 L451	L370-D453 HydrophobicContact CD1-CB 3.68Å; L370-D453 HydrophobicContact CD2-CB 4.26Å; L370-D453 HydrophobicContact CG-CB 4.46Å; H372-D453 IonicContact CD2-OD2 3.82Å; H372-D453 IonicContact CE1-OD2 2.67Å; H372-D453 IonicContact NE2-OD2 3.15Å; H372-D453 PolarHBondContact NE2-OD2 3.34Å; R418-D453 IonicContact CZ-OD1 2.64Å; R418-D453 IonicContact NH1-OD1 2.65Å; R418-D453 PolarHBondContact NH1-OD1 3.18Å; R418-D453 IonicContact NH2-OD1 2.6Å; R418-D453 PolarHBondContact NH2-OD1 2.97Å; M449-D453 WeakPolarHBondContact O-CB 3.37Å; M449-D453 VanDerWaalsContact O-CG 3.23Å; M449-D453 PolarHBondContact O-N 3.08Å; L451-D453 VanDerWaalsContact C-N 3.31Å; L451-D453 PolarHBondContact O-N 2.74Å
454	H	98.2	Very high	97.9	Very high	9 Å²	9	20.9 Å²	20.9	4%	0.042	12%	0.12	C	C	.	.	T	Hydrogen-bonded Turn	trans	-96.1	-2.6	174.2	-76.5	79.4	0	0	0	113.1	K368 T450 L451 E452 H456 V504 D505 L542	K368-H454 PolarHBondContact N-NE2 3.24Å; T450-H454 PolarHBondContact O-ND1 3.47Å; L451-H454 PolarHBondContact O-N 2.87Å; E452-H454 PolarHBondContact O-N 3.2Å; H454-H456 PolarHBondContact O-CD2 2.85Å; H454-V504 HydrophobicContact CB-CG2 3.53Å; H454-D505 VanDerWaalsContact O-CA 3.23Å; H454-D505 WeakPolarHBondContact O-CA 3.45Å; H454-D505 PolarHBondContact O-N 3.32Å; H454-L542 HydrophobicContact CB-CD1 4.27Å
455	Y	98.6	Very high	98	Very high	10 Å²	10	21.3 Å²	21.3	4%	0.039	12%	0.122	C	C	.	.	S	Bend	trans	-82.5	137	161.8	-75.7	-86.3	0	0	0	109.7	L420 L451 E452 A457 N464 A467 A500 D503 V504	L420-Y455 HydrophobicContact CD2-CD2 4.04Å; L420-Y455 HydrophobicContact CD2-CE2 3.64Å; L451-Y455 HydrophobicContact CD1-CE2 4.05Å; L451-Y455 HydrophobicContact CG-CE2 4.23Å; L451-Y455 WeakPolarHBondContact O-CD2 3.3Å; E452-Y455 PolarHBondContact O-N 2.97Å; Y455-A457 PolarHBondContact O-N 3.36Å; Y455-N464 HydrophobicContact CD2-CB 4.33Å; Y455-N464 HydrophobicContact CG-CB 4.18Å; Y455-A467 HydrophobicContact CD1-CB 4.45Å; Y455-A467 HydrophobicContact CE1-CB 3.69Å; Y455-A467 HydrophobicContact CE2-CB 3.96Å; Y455-A467 VanDerWaalsContact CZ-CB 3.41Å; Y455-A467 WeakPolarHBondContact OH-CB 3.49Å; Y455-A500 PolarHBondContact OH-O 2.99Å; Y455-D503 VanDerWaalsContact CE1-C 3.41Å; Y455-D503 HydrophobicContact CE1-CB 3.64Å; Y455-D503 WeakPolarHBondContact CE1-O 3.5Å; Y455-V504 HydrophobicContact CD2-CG2 4.4Å; Y455-V504 HydrophobicContact CE1-CB 4.47Å; Y455-V504 HydrophobicContact CE2-CB 3.98Å; Y455-V504 HydrophobicContact CE2-CG2 4.22Å; Y455-V504 PolarHBondContact OH-N 3.17Å
456	H	98.1	Very high	98.1	Very high	48 Å²	48	21.3 Å²	21.3	22%	0.222	12%	0.122	C	C	.	.			trans	-84.2	110.8	-169.8	-68.9	-164.6	0	0	0	110.1	H454 D458 V459 D505	H454-H456 PolarHBondContact O-CD2 2.85Å; H456-D458 PolarHBondContact O-N 3.3Å; H456-D458 VanDerWaalsContact O-N 3.13Å; H456-V459 HydrophobicContact CB-CB 4.05Å; H456-V459 HydrophobicContact CB-CG2 3.56Å; H456-V459 WeakPolarHBondContact O-CB 3.32Å; H456-V459 PolarHBondContact O-N 3.09Å; H456-D505 IonicContact CD2-OD1 2.69Å; H456-D505 IonicContact CE1-OD1 3.58Å; H456-D505 IonicContact NE2-OD1 3.4Å; H456-D505 PolarHBondContact NE2-OD1 2.96Å
457	A	97	Very high	98.2	Very high	87 Å²	87	20.6 Å²	20.6	72%	0.719	12%	0.118	S	C	*	.	T	Hydrogen-bonded Turn	trans	-66.6	-11.5	-178.4	0	0	0	0	0	114.3	Y455	Y455-A457 PolarHBondContact O-N 3.36Å
458	D	97.5	Very high	98.2	Very high	100 Å²	100	20.6 Å²	20.6	54%	0.535	12%	0.118	S	C	.	.	T	Hydrogen-bonded Turn	trans	-91.3	-5.1	170.7	61.5	-63.1	0	0	0	113.9	H456 R644	H456-D458 PolarHBondContact O-N 3.3Å; H456-D458 VanDerWaalsContact O-N 3.13Å; D458-R644 PolarHBondContact O-NH1 3.38Å
459	V	98.4	Very high	98.2	Very high	6 Å²	6	20.6 Å²	20.6	4%	0.036	12%	0.118	C	C	.	.			trans	-90	131.5	174.7	173.8	0	0	0	0	109.5	H456 H462 N463 E641	H456-V459 HydrophobicContact CB-CB 4.05Å; H456-V459 HydrophobicContact CB-CG2 3.56Å; H456-V459 WeakPolarHBondContact O-CB 3.32Å; H456-V459 PolarHBondContact O-N 3.09Å; V459-H462 HydrophobicContact CG1-CB 4.19Å; V459-H462 WeakPolarHBondContact CG1-O 3.44Å; V459-N463 PolarHBondContact O-ND2 2.74Å; V459-E641 VanDerWaalsContact CG1-CD 3.48Å; V459-E641 HydrophobicContact CG1-CG 4.45Å; V459-E641 WeakPolarHBondContact CG1-OE2 3.22Å
460	A	98.4	Very high	98.3	Very high	6 Å²	6	18.9 Å²	18.9	5%	0.05	11%	0.109	C	C	.	.	S	Bend	trans	-82.2	-37.2	-161.5	0	0	0	0	0	113.8	N463 R637 E640 E641	A460-N463 PolarHBondContact O-ND2 3.32Å; A460-N463 VanDerWaalsContact O-ND2 3.08Å; A460-R637 WeakPolarHBondContact O-CB 3.38Å; A460-R637 WeakPolarHBondContact O-CD 3.46Å; A460-R637 WeakPolarHBondContact O-CG 3.49Å; A460-R637 PolarHBondContact O-NH1 2.95Å; A460-E640 HydrophobicContact CB-CB 4.07Å; A460-E640 HydrophobicContact CB-CG 4.33Å; A460-E641 HydrophobicContact CB-CB 4.26Å; A460-E641 PolarHBondContact N-OE2 2.81Å
461	Y	98.7	Very high	98.4	Very high	13 Å²	13	18.3 Å²	18.3	5%	0.051	11%	0.106	C	C	.	.	S	Bend	trans	-109.9	-62	179.2	176.9	-85	0	0	0	111.8	N463 H466 N623 W634 R637 I638 E641	Y461-N463 PolarHBondContact O-N 3Å; Y461-N463 PolarHBondContact O-ND2 3.48Å; Y461-H466 AromaticContact CE1-CD2 3.55Å; Y461-H466 AromaticContact CE1-CE1 3.73Å; Y461-H466 AromaticContact CE1-CG 3.81Å; Y461-H466 AromaticContact CE1-ND1 3.91Å; Y461-H466 AromaticContact CE1-NE2 3.48Å; Y461-H466 WeakPolarHBondContact CE1-NE2 3.31Å; Y461-H466 AromaticContact CZ-CE1 3.55Å; Y461-H466 AromaticContact CZ-CG 3.99Å; Y461-H466 AromaticContact CZ-ND1 3.64Å; Y461-H466 AromaticContact CZ-NE2 3.81Å; Y461-H466 WeakPolarHBondContact O-CB 3.38Å; Y461-H466 PolarHBondContact OH-CE1 3.42Å; Y461-H466 PolarHBondContact OH-ND1 3.17Å; Y461-N623 WeakPolarHBondContact CE2-ND2 3.22Å; Y461-N623 PolarHBondContact OH-ND2 3.34Å; Y461-W634 AromaticContact CD2-CE3 3.66Å; Y461-W634 HydrophobicContact CD2-CE3 3.66Å; Y461-W634 HydrophobicContact CD2-CZ3 4.24Å; Y461-W634 HydrophobicContact CE2-CB 4.42Å; Y461-W634 HydrophobicContact CE2-CD2 4.28Å; Y461-W634 AromaticContact CE2-CE3 3.73Å; Y461-W634 HydrophobicContact CE2-CE3 3.73Å; Y461-W634 HydrophobicContact CE2-CZ3 4.44Å; Y461-R637 HydrophobicContact CD2-CB 4.34Å; Y461-I638 HydrophobicContact CD1-CD1 3.75Å; Y461-I638 HydrophobicContact CD2-CB 3.75Å; Y461-I638 HydrophobicContact CD2-CD1 4.24Å; Y461-I638 HydrophobicContact CD2-CG1 4.47Å; Y461-I638 HydrophobicContact CE1-CD1 4.27Å; Y461-I638 HydrophobicContact CE2-CB 4.31Å; Y461-I638 HydrophobicContact CG-CB 4.02Å; Y461-I638 HydrophobicContact CG-CD1 3.74Å; Y461-I638 HydrophobicContact CG-CG1 4.43Å; Y461-E641 WeakPolarHBondContact CA-OE2 3.28Å; Y461-E641 WeakPolarHBondContact CB-OE2 3.29Å; Y461-E641 PolarHBondContact N-OE2 3.33Å
462	H	98.7	Very high	98.4	Very high	34 Å²	34	18.4 Å²	18.4	16%	0.157	11%	0.106	C	C	.	.	T	Hydrogen-bonded Turn	trans	-76.6	71	-172.7	-55.6	96.9	0	0	0	111.2	V459 D503 H506 E641	V459-H462 HydrophobicContact CG1-CB 4.19Å; V459-H462 WeakPolarHBondContact CG1-O 3.44Å; H462-D503 WeakPolarHBondContact CB-OD2 3.49Å; H462-D503 IonicContact CD2-OD2 3.71Å; H462-D503 PolarHBondContact CD2-OD2 3.01Å; H462-D503 IonicContact CG-OD2 2.6Å; H462-H506 HydrophobicContact CB-CB 4.05Å; H462-H506 VanDerWaalsContact CB-ND1 3.25Å; H462-H506 WeakPolarHBondContact CB-ND1 3.4Å; H462-H506 AromaticContact CE1-CE1 3.96Å; H462-H506 AromaticContact CG-CE1 3.59Å; H462-H506 AromaticContact CG-ND1 3.58Å; H462-H506 AromaticContact ND1-CE1 3.33Å; H462-H506 PolarHBondContact ND1-CE1 3.41Å; H462-H506 VanDerWaalsContact ND1-CE1 3.33Å; H462-H506 AromaticContact ND1-ND1 3.67Å; H462-E641 IonicContact CE1-OE1 2.67Å; H462-E641 IonicContact CG-OE1 3.79Å; H462-E641 PolarHBondContact N-OE2 3.44Å; H462-E641 VanDerWaalsContact N-OE2 3.09Å; H462-E641 IonicContact ND1-OE1 3.86Å; H462-E641 PolarHBondContact ND1-OE1 2.94Å; H462-E641 IonicContact ND1-OE2 3.85Å
463	N	98.6	Very high	98.5	Very high	6 Å²	6	18.1 Å²	18.1	3%	0.032	11%	0.105	C	C	.	.	T	Hydrogen-bonded Turn	trans	-136.3	-173.8	-175.3	63.2	46.3	0	0	0	111.3	V459 A460 Y461 I465 H466 A467	V459-N463 PolarHBondContact O-ND2 2.74Å; A460-N463 PolarHBondContact O-ND2 3.32Å; A460-N463 VanDerWaalsContact O-ND2 3.08Å; Y461-N463 PolarHBondContact O-N 3Å; Y461-N463 PolarHBondContact O-ND2 3.48Å; N463-I465 PolarHBondContact O-N 3.15Å; N463-I465 WeakPolarHBondContact OD1-CB 3.42Å; N463-I465 WeakPolarHBondContact OD1-CG1 3.48Å; N463-I465 PolarHBondContact OD1-N 3.13Å; N463-H466 PolarHBondContact O-N 2.74Å; N463-H466 VanDerWaalsContact O-N 3.12Å; N463-A467 PolarHBondContact O-N 3.24Å
464	N	98.6	Very high	98.5	Very high	7 Å²	7	16 Å²	16	4%	0.037	9%	0.094	C	C	.	.	H	α-helix	trans	-63.7	-21.9	-176.2	63.6	-46.5	0	0	0	114.4	N417 P419 L420 E452 Y455 A468	N417-N464 PolarHBondContact O-ND2 2.81Å; P419-N464 WeakPolarHBondContact CD-ND2 3.44Å; L420-N464 HydrophobicContact CB-CB 4.39Å; E452-N464 HydrophobicContact CG-CB 3.75Å; E452-N464 PolarHBondContact OE1-ND2 3.08Å; Y455-N464 HydrophobicContact CD2-CB 4.33Å; Y455-N464 HydrophobicContact CG-CB 4.18Å; N464-A468 VanDerWaalsContact O-CB 3.31Å; N464-A468 WeakPolarHBondContact O-CB 3.44Å; N464-A468 PolarHBondContact O-N 3.05Å; N464-A468 VanDerWaalsContact O-N 3.14Å
465	I	98.8	Very high	98.5	Very high	9 Å²	9	15.7 Å²	15.7	5%	0.046	9%	0.093	C	C	.	.	H	α-helix	trans	-72.5	-43.9	174.8	-44.7	177.5	0	0	0	109.6	V408 F409 A412 P419 N463 A468 D469 W634	V408-I465 HydrophobicContact CG1-CG2 4.43Å; V408-I465 HydrophobicContact CG2-CG2 4.07Å; F409-I465 HydrophobicContact CD1-CG2 3.81Å; F409-I465 HydrophobicContact CE1-CG2 3.99Å; A412-I465 HydrophobicContact CB-CD1 4.26Å; A412-I465 HydrophobicContact CB-CG1 4.24Å; A412-I465 HydrophobicContact CB-CG2 4.39Å; P419-I465 HydrophobicContact CG-CB 4.47Å; P419-I465 HydrophobicContact CG-CG1 4.19Å; N463-I465 PolarHBondContact O-N 3.15Å; N463-I465 WeakPolarHBondContact OD1-CB 3.42Å; N463-I465 WeakPolarHBondContact OD1-CG1 3.48Å; N463-I465 PolarHBondContact OD1-N 3.13Å; I465-A468 PolarHBondContact O-N 3.1Å; I465-D469 PolarHBondContact O-N 3.2Å; I465-W634 HydrophobicContact CB-CH2 4.08Å; I465-W634 HydrophobicContact CG2-CH2 3.81Å; I465-W634 HydrophobicContact CG2-CZ2 4.35Å
466	H	98.8	Very high	98.5	Very high	0 Å²	0	16.3 Å²	16.3	0%	0	10%	0.097	C	C	.	.	H	α-helix	trans	-66	-47.5	177.7	174.7	50.7	0	0	0	110.8	Y461 N463 A468 D469 V470 H502 D503 D620 W634	Y461-H466 AromaticContact CE1-CD2 3.55Å; Y461-H466 AromaticContact CE1-CE1 3.73Å; Y461-H466 AromaticContact CE1-CG 3.81Å; Y461-H466 AromaticContact CE1-ND1 3.91Å; Y461-H466 AromaticContact CE1-NE2 3.48Å; Y461-H466 WeakPolarHBondContact CE1-NE2 3.31Å; Y461-H466 AromaticContact CZ-CE1 3.55Å; Y461-H466 AromaticContact CZ-CG 3.99Å; Y461-H466 AromaticContact CZ-ND1 3.64Å; Y461-H466 AromaticContact CZ-NE2 3.81Å; Y461-H466 WeakPolarHBondContact O-CB 3.38Å; Y461-H466 PolarHBondContact OH-CE1 3.42Å; Y461-H466 PolarHBondContact OH-ND1 3.17Å; N463-H466 PolarHBondContact O-N 2.74Å; N463-H466 VanDerWaalsContact O-N 3.12Å; H466-A468 PolarHBondContact O-N 3.17Å; H466-A468 VanDerWaalsContact O-N 3.17Å; H466-D469 PolarHBondContact O-N 2.93Å; H466-V470 WeakPolarHBondContact CE1-CG2 3.43Å; H466-V470 WeakPolarHBondContact O-CG2 3.45Å; H466-V470 PolarHBondContact O-N 2.91Å; H466-H502 AromaticContact NE2-NE2 3.57Å; H466-D503 IonicContact CD2-OD2 2.78Å; H466-D503 PolarHBondContact CD2-OD2 2.89Å; H466-D503 IonicContact NE2-OD2 3.4Å; H466-D620 IonicContact CE1-OD1 3.72Å; H466-D620 IonicContact NE2-OD1 3.87Å; H466-W634 VanDerWaalsContact CA-CH2 3.5Å; H466-W634 HydrophobicContact CB-CH2 3.9Å; H466-W634 HydrophobicContact CB-CZ3 3.95Å
467	A	98.8	Very high	98.6	Very high	0 Å²	0	14.1 Å²	14.1	0%	0	9%	0.087	C	C	.	.	H	α-helix	trans	-55.3	-35.7	174	0	0	0	0	0	113	L420 Y455 N463 V471	L420-A467 HydrophobicContact CD1-CB 4.21Å; L420-A467 HydrophobicContact CD2-CB 4.2Å; Y455-A467 HydrophobicContact CD1-CB 4.45Å; Y455-A467 HydrophobicContact CE1-CB 3.69Å; Y455-A467 HydrophobicContact CE2-CB 3.96Å; Y455-A467 VanDerWaalsContact CZ-CB 3.41Å; Y455-A467 WeakPolarHBondContact OH-CB 3.49Å; N463-A467 PolarHBondContact O-N 3.24Å; A467-V471 VanDerWaalsContact O-CB 3.32Å; A467-V471 WeakPolarHBondContact O-CB 3.44Å; A467-V471 WeakPolarHBondContact O-CG2 3.11Å; A467-V471 PolarHBondContact O-N 3.35Å
468	A	98.8	Very high	98.6	Very high	0 Å²	0	10.7 Å²	10.7	0%	0	6%	0.056	C	C	.	.	H	α-helix	trans	-71.2	-36.7	175.5	0	0	0	0	0	113.1	V408 P419 L420 I423 N464 I465 H466 Q472	V408-A468 HydrophobicContact CG2-CB 4.18Å; P419-A468 HydrophobicContact CB-CB 3.88Å; P419-A468 HydrophobicContact CG-CB 4.3Å; L420-A468 HydrophobicContact CB-CB 4.22Å; L420-A468 HydrophobicContact CD1-CB 4.38Å; I423-A468 HydrophobicContact CD1-CB 3.96Å; N464-A468 VanDerWaalsContact O-CB 3.31Å; N464-A468 WeakPolarHBondContact O-CB 3.44Å; N464-A468 PolarHBondContact O-N 3.05Å; N464-A468 VanDerWaalsContact O-N 3.14Å; I465-A468 PolarHBondContact O-N 3.1Å; H466-A468 PolarHBondContact O-N 3.17Å; H466-A468 VanDerWaalsContact O-N 3.17Å; A468-Q472 WeakPolarHBondContact O-CB 3.39Å; A468-Q472 PolarHBondContact O-N 2.82Å
469	D	98.8	Very high	98.6	Very high	0 Å²	0	9 Å²	9	0%	0	5%	0.053	C	C	.	.	H	α-helix	trans	-69	-42.3	175.5	-164.5	18	0	0	0	111.6	V408 I465 H466 Q472 S473 K626 W634	V408-D469 HydrophobicContact CB-CB 4.48Å; V408-D469 HydrophobicContact CG1-CB 4.1Å; V408-D469 HydrophobicContact CG2-CB 4.26Å; I465-D469 PolarHBondContact O-N 3.2Å; H466-D469 PolarHBondContact O-N 2.93Å; D469-Q472 PolarHBondContact O-N 3.1Å; D469-S473 WeakPolarHBondContact O-CB 3.45Å; D469-S473 PolarHBondContact O-N 2.99Å; D469-S473 PolarHBondContact O-OG 2.9Å; D469-K626 IonicContact OD1-NZ 3.67Å; D469-K626 PolarHBondContact OD1-NZ 3.12Å; D469-K626 IonicContact OD2-NZ 2.75Å; D469-K626 PolarHBondContact OD2-NZ 3.28Å; D469-W634 HydrophobicContact CB-CZ2 3.8Å; D469-W634 PolarHBondContact OD2-NE1 2.99Å
470	V	98.9	Very high	98.5	Very high	0 Å²	0	9.5 Å²	9.5	0%	0	6%	0.056	C	C	.	.	H	α-helix	trans	-64.9	-41.8	174.6	-178.2	0	0	0	0	111	H466 Q472 S473 T474 V616 A619	H466-V470 WeakPolarHBondContact CE1-CG2 3.43Å; H466-V470 WeakPolarHBondContact O-CG2 3.45Å; H466-V470 PolarHBondContact O-N 2.91Å; V470-Q472 PolarHBondContact O-N 2.89Å; V470-S473 PolarHBondContact O-N 2.9Å; V470-T474 WeakPolarHBondContact O-CB 3.47Å; V470-T474 PolarHBondContact O-N 3.32Å; V470-T474 PolarHBondContact O-OG1 3.23Å; V470-T474 VanDerWaalsContact O-OG1 3.11Å; V470-V616 HydrophobicContact CG1-CG1 4.43Å; V470-A619 HydrophobicContact CG1-CB 3.94Å
471	V	98.9	Very high	98.3	Very high	0 Å²	0	12.8 Å²	12.8	0%	0	8%	0.077	C	C	.	.	H	α-helix	trans	-56.8	-47.3	172.3	160.4	0	0	0	0	112	L420 I423 M424 I427 A467 H475 I496 A500	L420-V471 HydrophobicContact CD1-CG2 4.03Å; I423-V471 HydrophobicContact CG2-CG1 3.86Å; M424-V471 HydrophobicContact CG-CG1 4.04Å; M424-V471 HydrophobicContact CG-CG2 4.43Å; M424-V471 HydrophobicContact SD-CB 4.46Å; M424-V471 HydrophobicContact SD-CG1 3.6Å; M424-V471 VanDerWaalsContact SD-CG1 3.6Å; M424-V471 HydrophobicContact SD-CG2 3.92Å; I427-V471 HydrophobicContact CD1-CG1 3.65Å; A467-V471 VanDerWaalsContact O-CB 3.32Å; A467-V471 WeakPolarHBondContact O-CB 3.44Å; A467-V471 WeakPolarHBondContact O-CG2 3.11Å; A467-V471 PolarHBondContact O-N 3.35Å; V471-H475 WeakPolarHBondContact O-CB 3.46Å; V471-H475 PolarHBondContact O-N 3.06Å; V471-I496 HydrophobicContact CG1-CG2 4.42Å; V471-A500 VanDerWaalsContact CG2-CA 3.4Å; V471-A500 HydrophobicContact CG2-CB 3.65Å; V471-A500 VanDerWaalsContact CG2-N 3.29Å
472	Q	98.8	Very high	98.1	Very high	1 Å²	1	12.6 Å²	12.6	1%	0.005	8%	0.077	C	C	.	.	H	α-helix	trans	-73.1	-37.1	-178.2	-168.7	-96.2	-14.8	0	0	112.1	V401 K403 L406 I423 I427 A468 D469 V470 H475 V476	V401-Q472 HydrophobicContact CG2-CG 4.45Å; V401-Q472 PolarHBondContact O-NE2 2.73Å; K403-Q472 PolarHBondContact O-NE2 3.14Å; L406-Q472 HydrophobicContact CD2-CB 4.41Å; L406-Q472 HydrophobicContact CD2-CG 3.6Å; I423-Q472 HydrophobicContact CG2-CB 3.98Å; I427-Q472 HydrophobicContact CD1-CB 4.48Å; A468-Q472 WeakPolarHBondContact O-CB 3.39Å; A468-Q472 PolarHBondContact O-N 2.82Å; D469-Q472 PolarHBondContact O-N 3.1Å; V470-Q472 PolarHBondContact O-N 2.89Å; Q472-H475 CarbonylContact O-C 3.45Å; Q472-H475 WeakPolarHBondContact O-CA 3.42Å; Q472-H475 WeakPolarHBondContact O-CB 3.25Å; Q472-H475 PolarHBondContact O-N 3.08Å; Q472-H475 VanDerWaalsContact O-N 3.14Å; Q472-V476 WeakPolarHBondContact O-CG2 3.45Å; Q472-V476 PolarHBondContact O-N 2.82Å
473	S	98.8	Very high	97.9	Very high	0 Å²	0	11.2 Å²	11.2	0%	0	7%	0.071	C	C	.	.	H	α-helix	trans	-61.8	-48.4	174.9	-59.9	0	0	0	0	110.9	D469 V470 H475 V476 L477 K626	D469-S473 WeakPolarHBondContact O-CB 3.45Å; D469-S473 PolarHBondContact O-N 2.99Å; D469-S473 PolarHBondContact O-OG 2.9Å; V470-S473 PolarHBondContact O-N 2.9Å; S473-H475 VanDerWaalsContact C-N 3.29Å; S473-H475 PolarHBondContact O-N 3.09Å; S473-V476 PolarHBondContact O-N 3.5Å; S473-L477 WeakPolarHBondContact O-CG 3.35Å; S473-L477 PolarHBondContact O-N 3Å; S473-K626 WeakPolarHBondContact OG-CE 3.35Å; S473-K626 PolarHBondContact OG-NZ 2.83Å
474	T	98.8	Very high	97.6	Very high	0 Å²	0	17.6 Å²	17.6	0%	0	10%	0.101	C	C	.	.	H	α-helix	trans	-58.7	-39.9	171.3	-66	0	0	0	0	111.7	V470 V476 L477 L478 A495 S499 M615 V616 A619	V470-T474 WeakPolarHBondContact O-CB 3.47Å; V470-T474 PolarHBondContact O-N 3.32Å; V470-T474 PolarHBondContact O-OG1 3.23Å; V470-T474 VanDerWaalsContact O-OG1 3.11Å; T474-V476 PolarHBondContact O-N 2.94Å; T474-L477 PolarHBondContact O-N 2.97Å; T474-L478 HydrophobicContact CG2-CD1 3.99Å; T474-L478 HydrophobicContact CG2-CG 4.32Å; T474-L478 WeakPolarHBondContact O-CB 3.07Å; T474-L478 VanDerWaalsContact O-CG 3.28Å; T474-L478 WeakPolarHBondContact O-CG 3.25Å; T474-L478 PolarHBondContact O-N 3.03Å; T474-A495 HydrophobicContact CG2-CB 3.96Å; T474-S499 WeakPolarHBondContact CB-OG 3.43Å; T474-S499 PolarHBondContact OG1-OG 3.14Å; T474-M615 HydrophobicContact CG2-SD 4.44Å; T474-V616 HydrophobicContact CG2-CG2 4.01Å; T474-A619 WeakPolarHBondContact OG1-CB 3.31Å
475	H	98.7	Very high	97.3	Very high	3 Å²	3	22 Å²	22	1%	0.014	14%	0.139	C	C	.	.	H	α-helix	trans	-63.8	-36.8	176.1	166.6	84.4	0	0	0	113	V401 N402 I427 E430 R431 V471 Q472 S473	V401-H475 PolarHBondContact O-CD2 3.42Å; V401-H475 PolarHBondContact O-NE2 3.02Å; N402-H475 WeakPolarHBondContact CA-NE2 3.27Å; N402-H475 CovalentContact OD1-NE2 1.8Å; N402-H475 PolarHBondContact OD1-NE2 2.85Å; I427-H475 HydrophobicContact CD1-CB 3.67Å; I427-H475 HydrophobicContact CG1-CB 4.11Å; I427-H475 HydrophobicContact CG2-CB 4.27Å; I427-H475 WeakPolarHBondContact CG2-ND1 3.35Å; E430-H475 VanDerWaalsContact CG-CE1 3.44Å; E430-H475 WeakPolarHBondContact CG-CE1 3.4Å; R431-H475 WeakPolarHBondContact CG-CE1 3.2Å; R431-H475 PolarHBondContact NE-CE1 3.02Å; R431-H475 VanDerWaalsContact NE-CE1 3.27Å; R431-H475 PolarHBondContact NE-ND1 2.75Å; R431-H475 PolarHBondContact NH2-O 3.27Å; V471-H475 WeakPolarHBondContact O-CB 3.46Å; V471-H475 PolarHBondContact O-N 3.06Å; Q472-H475 CarbonylContact O-C 3.45Å; Q472-H475 WeakPolarHBondContact O-CA 3.42Å; Q472-H475 WeakPolarHBondContact O-CB 3.25Å; Q472-H475 PolarHBondContact O-N 3.08Å; Q472-H475 VanDerWaalsContact O-N 3.14Å; S473-H475 VanDerWaalsContact C-N 3.29Å; S473-H475 PolarHBondContact O-N 3.09Å
476	V	98.6	Very high	97.2	Very high	22 Å²	22	22.3 Å²	22.3	13%	0.133	14%	0.141	C	C	.	.	H	α-helix	trans	-70.2	-43.7	174.1	176.8	0	0	0	0	110.9	W404 Q472 S473 T474 L478 S479 T480	W404-V476 HydrophobicContact CE3-CB 4.09Å; W404-V476 HydrophobicContact CE3-CG1 3.99Å; W404-V476 HydrophobicContact CZ3-CB 4.4Å; Q472-V476 WeakPolarHBondContact O-CG2 3.45Å; Q472-V476 PolarHBondContact O-N 2.82Å; S473-V476 PolarHBondContact O-N 3.5Å; T474-V476 PolarHBondContact O-N 2.94Å; V476-L478 VanDerWaalsContact C-N 3.28Å; V476-L478 PolarHBondContact O-N 2.85Å; V476-S479 WeakPolarHBondContact O-CA 3.44Å; V476-S479 WeakPolarHBondContact O-CB 3.23Å; V476-S479 PolarHBondContact O-N 3.06Å; V476-T480 PolarHBondContact O-N 3.21Å
477	L	98.4	Very high	97.1	Very high	2 Å²	2	23.2 Å²	23.2	1%	0.01	15%	0.145	C	C	.	.	H	α-helix	trans	-65.5	-27.8	177.6	-64.3	174.2	0	0	0	113.3	W404 S473 T474 S479 T480 M615 C618 A619 W683 W686	W404-L477 HydrophobicContact CZ3-CG 4.27Å; S473-L477 WeakPolarHBondContact O-CG 3.35Å; S473-L477 PolarHBondContact O-N 3Å; T474-L477 PolarHBondContact O-N 2.97Å; L477-S479 PolarHBondContact O-N 3.48Å; L477-T480 WeakPolarHBondContact O-CB 3.33Å; L477-T480 PolarHBondContact O-N 2.76Å; L477-T480 PolarHBondContact O-OG1 2.86Å; L477-T480 VanDerWaalsContact O-OG1 3.1Å; L477-M615 HydrophobicContact CB-CE 4.17Å; L477-M615 HydrophobicContact CB-CG 3.64Å; L477-M615 HydrophobicContact CB-SD 3.96Å; L477-M615 HydrophobicContact CD1-CG 3.97Å; L477-M615 HydrophobicContact CG-CG 4.47Å; L477-M615 VanDerWaalsContact O-CE 3.32Å; L477-M615 WeakPolarHBondContact O-CE 3Å; L477-C618 HydrophobicContact CD1-CB 4.22Å; L477-A619 HydrophobicContact CD1-CB 4.34Å; L477-W683 HydrophobicContact CD1-CH2 4.14Å; L477-W683 HydrophobicContact CD2-CH2 4.06Å; L477-W683 HydrophobicContact CD2-CZ3 4.11Å; L477-W686 HydrophobicContact CB-CZ2 4.45Å; L477-W686 HydrophobicContact CD2-CZ2 4.32Å
478	L	98.1	Very high	97	Very high	15 Å²	15	26.8 Å²	26.8	8%	0.079	17%	0.166	C	C	.	.	T	Hydrogen-bonded Turn	trans	-73	-4.4	169.3	-75.4	171.6	0	0	0	113.9	T474 V476 F487 I492 A495 I496 L612 M615	T474-L478 HydrophobicContact CG2-CD1 3.99Å; T474-L478 HydrophobicContact CG2-CG 4.32Å; T474-L478 WeakPolarHBondContact O-CB 3.07Å; T474-L478 VanDerWaalsContact O-CG 3.28Å; T474-L478 WeakPolarHBondContact O-CG 3.25Å; T474-L478 PolarHBondContact O-N 3.03Å; V476-L478 VanDerWaalsContact C-N 3.28Å; V476-L478 PolarHBondContact O-N 2.85Å; L478-F487 HydrophobicContact CD2-CD2 4.1Å; L478-I492 HydrophobicContact CD1-CG2 4.32Å; L478-I492 HydrophobicContact CD2-CG1 4.33Å; L478-A495 HydrophobicContact CD1-CB 4.24Å; L478-I496 HydrophobicContact CD1-CD1 3.96Å; L478-I496 HydrophobicContact CD1-CG1 3.72Å; L478-L612 HydrophobicContact CD2-CD2 4.14Å; L478-M615 HydrophobicContact CB-SD 4.49Å; L478-M615 HydrophobicContact CD2-CE 4.02Å; L478-M615 HydrophobicContact CD2-SD 3.55Å; L478-M615 VanDerWaalsContact CD2-SD 3.55Å; L478-M615 HydrophobicContact CG-CE 4.4Å; L478-M615 HydrophobicContact CG-SD 3.59Å; L478-M615 VanDerWaalsContact CG-SD 3.59Å
479	S	96.8	Very high	97	Very high	66 Å²	66	30.7 Å²	30.7	46%	0.462	19%	0.188	S	C	.	.	T	Hydrogen-bonded Turn	trans	-109.5	3.6	174.1	-66.9	0	0	0	0	113.5	R431 V476 L477 P481	R431-S479 PolarHBondContact NH2-OG 3.45Å; V476-S479 WeakPolarHBondContact O-CA 3.44Å; V476-S479 WeakPolarHBondContact O-CB 3.23Å; V476-S479 PolarHBondContact O-N 3.06Å; L477-S479 PolarHBondContact O-N 3.48Å; S479-P481 WeakPolarHBondContact O-CD 3.29Å
480	T	95.9	Very high	97	Very high	15 Å²	15	31.9 Å²	31.9	9%	0.092	19%	0.193	C	C	.	.			trans	-56.9	123.6	175.1	-65.7	0	0	0	0	111.2	V476 L477 A482 L483 E484 V690 D693	V476-T480 PolarHBondContact O-N 3.21Å; L477-T480 WeakPolarHBondContact O-CB 3.33Å; L477-T480 PolarHBondContact O-N 2.76Å; L477-T480 PolarHBondContact O-OG1 2.86Å; L477-T480 VanDerWaalsContact O-OG1 3.1Å; T480-A482 VanDerWaalsContact C-N 3.33Å; T480-A482 HydrophobicContact CG2-CB 4.38Å; T480-A482 PolarHBondContact O-N 3.3Å; T480-L483 CarbonylContact O-C 3.45Å; T480-L483 WeakPolarHBondContact O-CA 3.46Å; T480-L483 WeakPolarHBondContact O-CB 3.23Å; T480-L483 PolarHBondContact O-N 3.23Å; T480-E484 PolarHBondContact O-N 2.86Å; T480-V690 HydrophobicContact CG2-CB 3.71Å; T480-V690 HydrophobicContact CG2-CG1 3.99Å; T480-V690 HydrophobicContact CG2-CG2 3.95Å; T480-D693 HydrophobicContact CG2-CB 3.67Å; T480-D693 VanDerWaalsContact CG2-OD2 3.24Å; T480-D693 WeakPolarHBondContact CG2-OD2 3.35Å
481	P	95.5	Very high	97	Very high	76 Å²	76	32.5 Å²	32.5	49%	0.494	20%	0.197	S	C	.	.	G	3₁₀ helix	trans	-50.7	-40.9	-177.5	-30.9	34.3	0	0	0	115.9	S479 L483 E484 D693	S479-P481 WeakPolarHBondContact O-CD 3.29Å; P481-L483 PolarHBondContact O-N 2.85Å; P481-E484 WeakPolarHBondContact O-CB 3.49Å; P481-E484 PolarHBondContact O-N 2.99Å; P481-D693 WeakPolarHBondContact CB-OD2 3.46Å; P481-D693 VanDerWaalsContact CD-OD2 3.23Å; P481-D693 WeakPolarHBondContact CD-OD2 3.33Å
482	A	94.6	Very high	97	Very high	8 Å²	8	33.6 Å²	33.6	7%	0.066	20%	0.202	C	C	.	.	G	3₁₀ helix	trans	-61.5	-13.3	175.6	0	0	0	0	0	113.9	T480 L600 V690 D693	T480-A482 VanDerWaalsContact C-N 3.33Å; T480-A482 HydrophobicContact CG2-CB 4.38Å; T480-A482 PolarHBondContact O-N 3.3Å; A482-L600 HydrophobicContact CB-CD1 4.24Å; A482-L600 WeakPolarHBondContact O-CB 3.34Å; A482-L600 PolarHBondContact O-N 3.46Å; A482-V690 HydrophobicContact CB-CB 3.97Å; A482-V690 HydrophobicContact CB-CG1 4.41Å; A482-D693 WeakPolarHBondContact CB-OD2 3.44Å; A482-D693 PolarHBondContact N-OD2 3.48Å
483	L	95	Very high	97	Very high	5 Å²	5	33.5 Å²	33.5	3%	0.026	20%	0.202	C	C	.	.	G	3₁₀ helix	trans	-112.8	7.4	177.5	-60.9	172.8	0	0	0	112.9	T480 P481 A485 V486 F487 L600 V611 M615 W686 V690	T480-L483 CarbonylContact O-C 3.45Å; T480-L483 WeakPolarHBondContact O-CA 3.46Å; T480-L483 WeakPolarHBondContact O-CB 3.23Å; T480-L483 PolarHBondContact O-N 3.23Å; P481-L483 PolarHBondContact O-N 2.85Å; L483-A485 PolarHBondContact O-N 3.5Å; L483-V486 WeakPolarHBondContact O-CB 3.29Å; L483-V486 WeakPolarHBondContact O-CG2 3.47Å; L483-V486 PolarHBondContact O-N 2.74Å; L483-V486 VanDerWaalsContact O-N 3.11Å; L483-F487 HydrophobicContact CB-CE2 4.43Å; L483-F487 HydrophobicContact CD1-CE2 4.33Å; L483-F487 HydrophobicContact CD2-CE2 4.14Å; L483-L600 HydrophobicContact CD2-CB 4.37Å; L483-L600 HydrophobicContact CD2-CD1 3.71Å; L483-L600 HydrophobicContact CG-CD1 4.44Å; L483-V611 HydrophobicContact CD2-CG1 4.36Å; L483-M615 HydrophobicContact CD1-CE 3.49Å; L483-M615 VanDerWaalsContact CD1-CE 3.49Å; L483-W686 HydrophobicContact CD1-CH2 4.09Å; L483-W686 HydrophobicContact CD1-CZ2 4.06Å; L483-V690 HydrophobicContact CD1-CG1 4.19Å; L483-V690 HydrophobicContact CG-CG1 4.33Å
484	E	92.2	Very high	97	Very high	141 Å²	141	33.5 Å²	33.5	66%	0.659	20%	0.202	S	C	*	.	T	Hydrogen-bonded Turn	trans	-56.4	129.4	179.1	-169.2	-172.9	174.9	0	0	111.4	T480 P481 V486 V599	T480-E484 PolarHBondContact O-N 2.86Å; P481-E484 WeakPolarHBondContact O-CB 3.49Å; P481-E484 PolarHBondContact O-N 2.99Å; E484-V486 PolarHBondContact O-N 2.91Å; E484-V599 WeakPolarHBondContact O-CG1 3.31Å
485	A	91.8	Very high	97	Very high	100 Å²	100	33.5 Å²	33.5	83%	0.826	20%	0.202	S	C	*	.	T	Hydrogen-bonded Turn	trans	55.6	9.9	-177.4	0	0	0	0	0	116.1	L483	L483-A485 PolarHBondContact O-N 3.5Å
486	V	95.3	Very high	97	Very high	15 Å²	15	33.4 Å²	33.4	9%	0.091	20%	0.201	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.2	-45.8	176.9	177	0	0	0	0	110.8	L483 E484 V599 L600 L602 R608	L483-V486 WeakPolarHBondContact O-CB 3.29Å; L483-V486 WeakPolarHBondContact O-CG2 3.47Å; L483-V486 PolarHBondContact O-N 2.74Å; L483-V486 VanDerWaalsContact O-N 3.11Å; E484-V486 PolarHBondContact O-N 2.91Å; V486-V599 HydrophobicContact CG2-CG1 3.38Å; V486-L600 VanDerWaalsContact CG2-O 3.29Å; V486-L600 WeakPolarHBondContact CG2-O 3.3Å; V486-L602 HydrophobicContact CG1-CB 4.34Å; V486-L602 HydrophobicContact CG1-CD1 3.73Å; V486-L602 HydrophobicContact CG1-CG 4.02Å; V486-R608 PolarHBondContact O-NH1 3.29Å; V486-R608 PolarHBondContact O-NH2 2.96Å
487	F	97.5	Very high	97	Very high	19 Å²	19	32.3 Å²	32.3	8%	0.083	20%	0.195	C	C	.	.	S	Bend	trans	-92.6	142.9	-176.6	-62.9	-65.1	0	0	0	113	L478 L483 E491 I492 L602 R608 V611 L612 M615	L478-F487 HydrophobicContact CD2-CD2 4.1Å; L483-F487 HydrophobicContact CB-CE2 4.43Å; L483-F487 HydrophobicContact CD1-CE2 4.33Å; L483-F487 HydrophobicContact CD2-CE2 4.14Å; F487-E491 HydrophobicContact CB-CB 4.19Å; F487-E491 HydrophobicContact CD1-CB 4.22Å; F487-I492 HydrophobicContact CB-CG1 4.06Å; F487-L602 HydrophobicContact CE1-CD1 4.26Å; F487-L602 HydrophobicContact CZ-CD1 4.07Å; F487-R608 HydrophobicContact CE1-CB 4.36Å; F487-V611 HydrophobicContact CE2-CG1 4.31Å; F487-V611 HydrophobicContact CZ-CB 4.07Å; F487-V611 HydrophobicContact CZ-CG1 3.76Å; F487-L612 HydrophobicContact CD1-CD1 3.95Å; F487-L612 HydrophobicContact CD1-CD2 3.88Å; F487-L612 HydrophobicContact CD1-CG 4.06Å; F487-L612 HydrophobicContact CD2-CD2 4.2Å; F487-L612 HydrophobicContact CE1-CD1 3.81Å; F487-L612 HydrophobicContact CE1-CD2 3.67Å; F487-L612 HydrophobicContact CE1-CG 3.56Å; F487-L612 HydrophobicContact CE2-CD2 4Å; F487-L612 HydrophobicContact CG-CD2 4.14Å; F487-L612 HydrophobicContact CZ-CD2 3.74Å; F487-L612 HydrophobicContact CZ-CG 3.89Å; F487-M615 HydrophobicContact CE2-CE 4.23Å
488	T	97.6	Very high	97	Very high	74 Å²	74	32.2 Å²	32.2	45%	0.454	19%	0.194	S	C	.	.			trans	-79	159.3	171.3	66.2	0	0	0	0	110.9	L490 E491 I492	T488-L490 PolarHBondContact O-N 3.49Å; T488-E491 VanDerWaalsContact CB-OE2 3.28Å; T488-E491 WeakPolarHBondContact CB-OE2 3.21Å; T488-E491 WeakPolarHBondContact CG2-OE2 3.48Å; T488-E491 PolarHBondContact N-OE2 3.37Å; T488-E491 PolarHBondContact O-N 3.48Å; T488-E491 PolarHBondContact OG1-OE2 2.93Å; T488-I492 PolarHBondContact O-N 2.96Å
489	D	98.2	Very high	97	Very high	83 Å²	83	31.5 Å²	31.5	44%	0.444	19%	0.191	S	C	.	.	H	α-helix	trans	-49.9	-31.4	175.1	-46.6	-51.2	0	0	0	113.1	T436 F437 L493	T436-D489 HydrophobicContact CG2-CB 3.91Å; F437-D489 HydrophobicContact CE2-CB 3.8Å; F437-D489 WeakPolarHBondContact CE2-O 3.47Å; F437-D489 VanDerWaalsContact CZ-C 3.48Å; F437-D489 HydrophobicContact CZ-CB 3.52Å; F437-D489 WeakPolarHBondContact CZ-O 3.29Å; D489-L493 VanDerWaalsContact O-CB 3.25Å; D489-L493 WeakPolarHBondContact O-CB 3.32Å; D489-L493 PolarHBondContact O-N 2.84Å
490	L	98.4	Very high	97.1	Very high	24 Å²	24	28.4 Å²	28.4	13%	0.126	17%	0.169	C	C	.	.	H	α-helix	trans	-78.9	-29.3	-177.7	-167.3	72.7	0	0	0	112.4	F437 T488 L493 A494 L554 Q558 L562 M565	F437-L490 HydrophobicContact CE1-CD1 3.99Å; F437-L490 HydrophobicContact CZ-CB 4.25Å; F437-L490 HydrophobicContact CZ-CD1 4.16Å; T488-L490 PolarHBondContact O-N 3.49Å; L490-L493 HydrophobicContact CD1-CD2 4.46Å; L490-A494 WeakPolarHBondContact O-CB 3.49Å; L490-A494 PolarHBondContact O-N 3.36Å; L490-A494 VanDerWaalsContact O-N 3.08Å; L490-L554 HydrophobicContact CD1-CD1 4.34Å; L490-Q558 HydrophobicContact CD1-CB 4.16Å; L490-Q558 HydrophobicContact CD1-CG 4.39Å; L490-Q558 HydrophobicContact CD2-CB 4.17Å; L490-Q558 HydrophobicContact CD2-CG 4.08Å; L490-L562 HydrophobicContact CD1-CB 4.3Å; L490-L562 HydrophobicContact CD1-CD1 4.45Å; L490-M565 HydrophobicContact CD2-CE 4.27Å; L490-M565 HydrophobicContact CG-CE 4.09Å
491	E	98.5	Very high	97.3	Very high	14 Å²	14	27.7 Å²	27.7	7%	0.065	16%	0.164	C	C	.	.	H	α-helix	trans	-77.2	-40.7	172.3	-74.2	152.6	135.3	0	0	110.5	F487 T488 A494 A495 M565 R608 L612	F487-E491 HydrophobicContact CB-CB 4.19Å; F487-E491 HydrophobicContact CD1-CB 4.22Å; T488-E491 VanDerWaalsContact CB-OE2 3.28Å; T488-E491 WeakPolarHBondContact CB-OE2 3.21Å; T488-E491 WeakPolarHBondContact CG2-OE2 3.48Å; T488-E491 PolarHBondContact N-OE2 3.37Å; T488-E491 PolarHBondContact O-N 3.48Å; T488-E491 PolarHBondContact OG1-OE2 2.93Å; E491-A494 WeakPolarHBondContact O-CB 3.38Å; E491-A494 PolarHBondContact O-N 3.27Å; E491-A494 VanDerWaalsContact O-N 3.08Å; E491-A495 PolarHBondContact O-N 3.39Å; E491-M565 HydrophobicContact CG-CE 4.05Å; E491-M565 HydrophobicContact CG-SD 3.52Å; E491-M565 VanDerWaalsContact CG-SD 3.52Å; E491-R608 VanDerWaalsContact CD-NH2 3.27Å; E491-R608 IonicContact OE1-CZ 3.61Å; E491-R608 IonicContact OE1-NE 2.82Å; E491-R608 PolarHBondContact OE1-NE 2.81Å; E491-R608 IonicContact OE1-NH2 2.74Å; E491-R608 PolarHBondContact OE1-NH2 2.77Å; E491-R608 VanDerWaalsContact OE1-NH2 3.09Å; E491-R608 IonicContact OE2-CZ 2.69Å; E491-R608 IonicContact OE2-NE 3.17Å; E491-R608 IonicContact OE2-NH2 3.6Å; E491-R608 PolarHBondContact OE2-NH2 2.95Å; E491-L612 HydrophobicContact CB-CD1 3.93Å; E491-L612 HydrophobicContact CG-CD1 4.16Å
492	I	98.6	Very high	97.4	Very high	22 Å²	22	24 Å²	24	11%	0.113	14%	0.141	C	C	.	.	H	α-helix	trans	-57	-50.2	170.3	-70.7	168.6	0	0	0	110.4	L433 L478 F487 T488 A494 A495 I496	L433-I492 HydrophobicContact CD2-CG2 4.25Å; L478-I492 HydrophobicContact CD1-CG2 4.32Å; L478-I492 HydrophobicContact CD2-CG1 4.33Å; F487-I492 HydrophobicContact CB-CG1 4.06Å; T488-I492 PolarHBondContact O-N 2.96Å; I492-A494 VanDerWaalsContact C-N 3.26Å; I492-A494 PolarHBondContact O-N 2.82Å; I492-A495 PolarHBondContact O-N 2.67Å; I492-I496 HydrophobicContact CG2-CD1 3.73Å; I492-I496 WeakPolarHBondContact O-CB 3.23Å; I492-I496 WeakPolarHBondContact O-CG1 3.37Å; I492-I496 PolarHBondContact O-N 2.67Å; I492-I496 VanDerWaalsContact O-N 3.1Å
493	L	98.7	Very high	97.6	Very high	0 Å²	0	24.3 Å²	24.3	0%	0	14%	0.141	C	C	.	.	H	α-helix	trans	-59.2	-37.2	173.8	-179.1	67.1	0	0	0	112	F428 L433 F437 D489 L490 F497 F551 L554 L562	F428-L493 HydrophobicContact CE1-CD1 3.92Å; F428-L493 HydrophobicContact CZ-CD1 3.71Å; L433-L493 HydrophobicContact CD1-CD1 4.49Å; F437-L493 HydrophobicContact CD2-CB 4.47Å; F437-L493 HydrophobicContact CD2-CD2 3.74Å; F437-L493 HydrophobicContact CD2-CG 4.48Å; F437-L493 HydrophobicContact CE2-CB 3.89Å; F437-L493 HydrophobicContact CE2-CD2 3.81Å; F437-L493 HydrophobicContact CE2-CG 4.36Å; F437-L493 HydrophobicContact CG-CD2 4.12Å; F437-L493 HydrophobicContact CZ-CB 4.47Å; F437-L493 HydrophobicContact CZ-CD2 4.25Å; D489-L493 VanDerWaalsContact O-CB 3.25Å; D489-L493 WeakPolarHBondContact O-CB 3.32Å; D489-L493 PolarHBondContact O-N 2.84Å; L490-L493 HydrophobicContact CD1-CD2 4.46Å; L493-F497 WeakPolarHBondContact O-CB 3.28Å; L493-F497 PolarHBondContact O-N 2.88Å; L493-F551 HydrophobicContact CD1-CE1 4.34Å; L493-F551 HydrophobicContact CD2-CD1 4.34Å; L493-F551 HydrophobicContact CD2-CE1 3.94Å; L493-F551 HydrophobicContact CG-CE1 4.29Å; L493-L554 HydrophobicContact CD2-CD1 4.41Å; L493-L562 HydrophobicContact CB-CD1 4.49Å; L493-L562 HydrophobicContact CD2-CD1 4.17Å; L493-L562 HydrophobicContact CD2-CD2 4.24Å; L493-L562 HydrophobicContact CG-CD1 4.14Å
494	A	98.8	Very high	97.8	Very high	0 Å²	0	24.1 Å²	24.1	0%	0	14%	0.14	C	C	.	.	H	α-helix	trans	-67.2	-48.1	179.7	0	0	0	0	0	112.4	L490 E491 I492 A498 L562 M565 V566	L490-A494 WeakPolarHBondContact O-CB 3.49Å; L490-A494 PolarHBondContact O-N 3.36Å; L490-A494 VanDerWaalsContact O-N 3.08Å; E491-A494 WeakPolarHBondContact O-CB 3.38Å; E491-A494 PolarHBondContact O-N 3.27Å; E491-A494 VanDerWaalsContact O-N 3.08Å; I492-A494 VanDerWaalsContact C-N 3.26Å; I492-A494 PolarHBondContact O-N 2.82Å; A494-A498 WeakPolarHBondContact O-CB 3.08Å; A494-A498 PolarHBondContact O-N 3.44Å; A494-L562 HydrophobicContact CB-CD1 3.76Å; A494-M565 HydrophobicContact CB-CB 3.8Å; A494-M565 HydrophobicContact CB-CE 3.94Å; A494-V566 HydrophobicContact CB-CG2 4.06Å
495	A	98.8	Very high	98.1	Very high	0 Å²	0	18.5 Å²	18.5	0%	0	11%	0.114	C	C	.	.	H	α-helix	trans	-67.7	-42	-178.6	0	0	0	0	0	112.2	T474 L478 E491 I492 A498 S499 I569 L612 V616	T474-A495 HydrophobicContact CG2-CB 3.96Å; L478-A495 HydrophobicContact CD1-CB 4.24Å; E491-A495 PolarHBondContact O-N 3.39Å; I492-A495 PolarHBondContact O-N 2.67Å; A495-A498 PolarHBondContact O-N 2.75Å; A495-S499 WeakPolarHBondContact O-CB 3.31Å; A495-S499 PolarHBondContact O-N 3.09Å; A495-S499 PolarHBondContact O-OG 2.78Å; A495-I569 HydrophobicContact CB-CD1 4.45Å; A495-L612 HydrophobicContact CB-CD2 4.12Å; A495-V616 HydrophobicContact CB-CG2 4.27Å
496	I	98.8	Very high	98.4	Very high	0 Å²	0	14.1 Å²	14.1	0%	0	8%	0.077	C	C	.	.	H	α-helix	trans	-66.1	-44.4	176.4	-64.3	166.4	0	0	0	110.6	M424 I427 F428 L433 V471 L478 I492 S499 A500	M424-I496 HydrophobicContact CE-CG2 4.3Å; M424-I496 HydrophobicContact SD-CG2 3.66Å; I427-I496 HydrophobicContact CG2-CD1 3.82Å; I427-I496 HydrophobicContact CG2-CG2 4.11Å; F428-I496 HydrophobicContact CD2-CG2 4.5Å; F428-I496 HydrophobicContact CE2-CG2 3.87Å; L433-I496 HydrophobicContact CD1-CD1 4.18Å; V471-I496 HydrophobicContact CG1-CG2 4.42Å; L478-I496 HydrophobicContact CD1-CD1 3.96Å; L478-I496 HydrophobicContact CD1-CG1 3.72Å; I492-I496 HydrophobicContact CG2-CD1 3.73Å; I492-I496 WeakPolarHBondContact O-CB 3.23Å; I492-I496 WeakPolarHBondContact O-CG1 3.37Å; I492-I496 PolarHBondContact O-N 2.67Å; I492-I496 VanDerWaalsContact O-N 3.1Å; I496-S499 PolarHBondContact O-N 3.4Å; I496-A500 PolarHBondContact O-N 3.05Å
497	F	98.8	Very high	98.5	Very high	0 Å²	0	14.9 Å²	14.9	0%	0	8%	0.082	C	C	.	.	H	α-helix	trans	-67.3	-40	176.8	-179.9	-98.3	0	0	0	112.7	Y447 L493 A500 I501 F540 L543 I550 F551 V566	Y447-F497 HydrophobicContact CE1-CD2 4.43Å; Y447-F497 AromaticContact CE1-CE2 3.62Å; Y447-F497 HydrophobicContact CE1-CE2 3.62Å; Y447-F497 HydrophobicContact CE1-CZ 4.47Å; Y447-F497 AromaticContact CZ-CE2 3.69Å; Y447-F497 VanDerWaalsContact OH-CE2 3.32Å; Y447-F497 WeakPolarHBondContact OH-CE2 3.28Å; Y447-F497 WeakPolarHBondContact OH-CZ 3.46Å; L493-F497 WeakPolarHBondContact O-CB 3.28Å; L493-F497 PolarHBondContact O-N 2.88Å; F497-A500 PolarHBondContact O-N 3.47Å; F497-I501 HydrophobicContact CD1-CD1 4.3Å; F497-I501 HydrophobicContact CE1-CD1 3.7Å; F497-I501 HydrophobicContact CE1-CG1 4.3Å; F497-I501 HydrophobicContact CE1-CG2 4.25Å; F497-I501 HydrophobicContact CE2-CG2 4.13Å; F497-I501 HydrophobicContact CZ-CD1 4.27Å; F497-I501 HydrophobicContact CZ-CG2 3.96Å; F497-I501 WeakPolarHBondContact O-CG1 3.37Å; F497-I501 PolarHBondContact O-N 3.22Å; F497-F540 HydrophobicContact CE1-CE1 4.32Å; F497-F540 HydrophobicContact CE1-CE2 4.46Å; F497-F540 HydrophobicContact CE1-CZ 4.14Å; F497-L543 HydrophobicContact CZ-CD1 4.44Å; F497-I550 HydrophobicContact CD2-CD1 3.99Å; F497-I550 HydrophobicContact CE2-CD1 3.91Å; F497-F551 HydrophobicContact CB-CZ 4.44Å; F497-F551 HydrophobicContact CD1-CE2 4.26Å; F497-F551 HydrophobicContact CD1-CZ 4.03Å; F497-F551 HydrophobicContact CD2-CE2 4.17Å; F497-F551 AromaticContact CD2-CZ 3.54Å; F497-F551 HydrophobicContact CD2-CZ 3.54Å; F497-F551 AromaticContact CE1-CE2 3.91Å; F497-F551 HydrophobicContact CE1-CE2 3.91Å; F497-F551 HydrophobicContact CE1-CZ 4.11Å; F497-F551 AromaticContact CE2-CE2 3.8Å; F497-F551 HydrophobicContact CE2-CE2 3.8Å; F497-F551 AromaticContact CE2-CZ 3.62Å; F497-F551 HydrophobicContact CE2-CZ 3.62Å; F497-F551 HydrophobicContact CG-CE2 4.37Å; F497-F551 AromaticContact CG-CZ 3.73Å; F497-F551 HydrophobicContact CG-CZ 3.73Å; F497-F551 AromaticContact CZ-CE2 3.66Å; F497-F551 HydrophobicContact CZ-CE2 3.66Å; F497-F551 AromaticContact CZ-CZ 3.92Å; F497-F551 HydrophobicContact CZ-CZ 3.92Å; F497-V566 HydrophobicContact CD1-CB 4.49Å; F497-V566 HydrophobicContact CD1-CG1 3.85Å; F497-V566 HydrophobicContact CD1-CG2 3.8Å; F497-V566 HydrophobicContact CE1-CG1 4.07Å
498	A	98.9	Very high	98.6	Very high	0 Å²	0	14.1 Å²	14.1	0%	0	8%	0.08	C	C	.	.	H	α-helix	trans	-58.7	-50.3	174.2	0	0	0	0	0	110.7	A494 A495 A500 I501 H502 V566 I569 V570	A494-A498 WeakPolarHBondContact O-CB 3.08Å; A494-A498 PolarHBondContact O-N 3.44Å; A495-A498 PolarHBondContact O-N 2.75Å; A498-A500 PolarHBondContact O-N 3.05Å; A498-I501 CarbonylContact O-C 3.59Å; A498-I501 PolarHBondContact O-N 3.16Å; A498-H502 WeakPolarHBondContact O-CB 3.46Å; A498-H502 PolarHBondContact O-N 3.36Å; A498-V566 HydrophobicContact CB-CG1 4.14Å; A498-I569 HydrophobicContact CB-CB 3.98Å; A498-I569 HydrophobicContact CB-CG2 3.55Å; A498-V570 HydrophobicContact CB-CG2 3.84Å
499	S	98.9	Very high	98.6	Very high	0 Å²	0	10.9 Å²	10.9	0%	0	6%	0.06	C	C	.	.	H	α-helix	trans	-54.8	-39	174.9	-55.4	0	0	0	0	112.1	T474 A495 I496 I501 H502	T474-S499 WeakPolarHBondContact CB-OG 3.43Å; T474-S499 PolarHBondContact OG1-OG 3.14Å; A495-S499 WeakPolarHBondContact O-CB 3.31Å; A495-S499 PolarHBondContact O-N 3.09Å; A495-S499 PolarHBondContact O-OG 2.78Å; I496-S499 PolarHBondContact O-N 3.4Å; S499-I501 VanDerWaalsContact C-N 3.33Å; S499-I501 PolarHBondContact O-N 3.48Å; S499-H502 PolarHBondContact O-ND1 2.78Å
500	A	98.9	Very high	98.6	Very high	0 Å²	0	9.1 Å²	9.1	0%	0	5%	0.054	C	C	.	.	H	α-helix	trans	-70.7	-25.4	179.7	0	0	0	0	0	114.2	L420 M424 L451 Y455 V471 I496 F497 A498	L420-A500 HydrophobicContact CD1-CB 4.27Å; M424-A500 HydrophobicContact CE-CB 3.53Å; M424-A500 HydrophobicContact CG-CB 4.27Å; M424-A500 HydrophobicContact SD-CB 3.71Å; L451-A500 HydrophobicContact CD2-CB 4.15Å; Y455-A500 PolarHBondContact OH-O 2.99Å; V471-A500 VanDerWaalsContact CG2-CA 3.4Å; V471-A500 HydrophobicContact CG2-CB 3.65Å; V471-A500 VanDerWaalsContact CG2-N 3.29Å; I496-A500 PolarHBondContact O-N 3.05Å; F497-A500 PolarHBondContact O-N 3.47Å; A498-A500 PolarHBondContact O-N 3.05Å
501	I	98.8	Very high	98.5	Very high	0 Å²	0	9.3 Å²	9.3	0%	0	6%	0.055	C	C	.	.	H	α-helix	trans	-110.9	-0	-177.4	73.9	161.1	0	0	0	114.3	L451 F497 A498 S499 D503 V504 L536 F540 V566 V570	L451-I501 HydrophobicContact CD1-CG2 3.9Å; L451-I501 HydrophobicContact CD2-CG2 3.96Å; F497-I501 HydrophobicContact CD1-CD1 4.3Å; F497-I501 HydrophobicContact CE1-CD1 3.7Å; F497-I501 HydrophobicContact CE1-CG1 4.3Å; F497-I501 HydrophobicContact CE1-CG2 4.25Å; F497-I501 HydrophobicContact CE2-CG2 4.13Å; F497-I501 HydrophobicContact CZ-CD1 4.27Å; F497-I501 HydrophobicContact CZ-CG2 3.96Å; F497-I501 WeakPolarHBondContact O-CG1 3.37Å; F497-I501 PolarHBondContact O-N 3.22Å; A498-I501 CarbonylContact O-C 3.59Å; A498-I501 PolarHBondContact O-N 3.16Å; S499-I501 VanDerWaalsContact C-N 3.33Å; S499-I501 PolarHBondContact O-N 3.48Å; I501-D503 PolarHBondContact O-N 3.34Å; I501-D503 VanDerWaalsContact O-N 3.09Å; I501-V504 HydrophobicContact CB-CG1 4.29Å; I501-V504 WeakPolarHBondContact O-CG1 3.39Å; I501-V504 PolarHBondContact O-N 2.9Å; I501-L536 HydrophobicContact CD1-CD2 4.25Å; I501-F540 HydrophobicContact CD1-CD2 4.36Å; I501-F540 HydrophobicContact CD1-CE2 4.38Å; I501-V566 HydrophobicContact CD1-CG1 3.96Å; I501-V570 HydrophobicContact CG1-CG2 4.27Å
502	H	98.8	Very high	98.4	Very high	0 Å²	0	12.8 Å²	12.8	0%	0	7%	0.071	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.1	-26.6	-165.9	76.2	-73.5	0	0	0	114.2	H466 A498 S499 H535 V570	H466-H502 AromaticContact NE2-NE2 3.57Å; A498-H502 WeakPolarHBondContact O-CB 3.46Å; A498-H502 PolarHBondContact O-N 3.36Å; S499-H502 PolarHBondContact O-ND1 2.78Å; H502-H535 WeakPolarHBondContact O-CB 3.14Å; H502-H535 PolarHBondContact O-CD2 3.44Å; H502-V570 HydrophobicContact CB-CG1 4.26Å; H502-V570 HydrophobicContact CB-CG2 4.28Å
503	D	98.8	Very high	98.4	Very high	14 Å²	14	12.1 Å²	12.1	8%	0.075	7%	0.067	C	C	.	.	T	Hydrogen-bonded Turn	trans	-122	10.3	-175.5	-98.1	4	0	0	0	114	Y455 H462 H466 I501 D505 H506 H535	Y455-D503 VanDerWaalsContact CE1-C 3.41Å; Y455-D503 HydrophobicContact CE1-CB 3.64Å; Y455-D503 WeakPolarHBondContact CE1-O 3.5Å; H462-D503 WeakPolarHBondContact CB-OD2 3.49Å; H462-D503 IonicContact CD2-OD2 3.71Å; H462-D503 PolarHBondContact CD2-OD2 3.01Å; H462-D503 IonicContact CG-OD2 2.6Å; H466-D503 IonicContact CD2-OD2 2.78Å; H466-D503 PolarHBondContact CD2-OD2 2.89Å; H466-D503 IonicContact NE2-OD2 3.4Å; I501-D503 PolarHBondContact O-N 3.34Å; I501-D503 VanDerWaalsContact O-N 3.09Å; D503-D505 PolarHBondContact O-N 3.3Å; D503-H506 VanDerWaalsContact O-CB 3.22Å; D503-H506 WeakPolarHBondContact O-CB 3.45Å; D503-H506 PolarHBondContact O-N 2.92Å; D503-H535 VanDerWaalsContact C-ND1 3.33Å
504	V	98.6	Very high	98.3	Very high	0 Å²	0	12.7 Å²	12.7	0%	0	7%	0.07	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.2	130.3	-171.7	64.5	0	0	0	0	112	L451 H454 Y455 I501 H535 V538	L451-V504 HydrophobicContact CD1-CB 3.87Å; L451-V504 HydrophobicContact CD1-CG1 4.35Å; L451-V504 HydrophobicContact CD1-CG2 3.61Å; H454-V504 HydrophobicContact CB-CG2 3.53Å; Y455-V504 HydrophobicContact CD2-CG2 4.4Å; Y455-V504 HydrophobicContact CE1-CB 4.47Å; Y455-V504 HydrophobicContact CE2-CB 3.98Å; Y455-V504 HydrophobicContact CE2-CG2 4.22Å; Y455-V504 PolarHBondContact OH-N 3.17Å; I501-V504 HydrophobicContact CB-CG1 4.29Å; I501-V504 WeakPolarHBondContact O-CG1 3.39Å; I501-V504 PolarHBondContact O-N 2.9Å; V504-H535 HydrophobicContact CG1-CB 4.38Å; V504-H535 VanDerWaalsContact CG1-O 3.25Å; V504-H535 WeakPolarHBondContact CG1-O 3.31Å; V504-H535 PolarHBondContact O-ND1 3.03Å; V504-V538 HydrophobicContact CG1-CB 4Å; V504-V538 HydrophobicContact CG1-CG1 3.93Å; V504-V538 HydrophobicContact CG2-CG1 3.86Å
505	D	98.5	Very high	98.2	Very high	23 Å²	23	14.5 Å²	14.5	12%	0.123	8%	0.08	C	C	.	.	T	Hydrogen-bonded Turn	trans	69.9	23.6	-173.7	-152.7	45.1	0	0	0	114.4	H454 H456 D503 H534 V538	H454-D505 VanDerWaalsContact O-CA 3.23Å; H454-D505 WeakPolarHBondContact O-CA 3.45Å; H454-D505 PolarHBondContact O-N 3.32Å; H456-D505 IonicContact CD2-OD1 2.69Å; H456-D505 IonicContact CE1-OD1 3.58Å; H456-D505 IonicContact NE2-OD1 3.4Å; H456-D505 PolarHBondContact NE2-OD1 2.96Å; D503-D505 PolarHBondContact O-N 3.3Å; D505-H534 IonicContact OD2-CD2 3.42Å; D505-H534 IonicContact OD2-CE1 3.8Å; D505-H534 IonicContact OD2-NE2 2.78Å; D505-H534 PolarHBondContact OD2-NE2 2.86Å; D505-V538 HydrophobicContact CB-CG1 4.33Å; D505-V538 HydrophobicContact CB-CG2 4.17Å
506	H	98.5	Very high	98.1	Very high	9 Å²	9	18.5 Å²	18.5	4%	0.042	10%	0.101	C	C	.	.			trans	-62	124.9	173.6	-171.7	-94.9	0	0	0	112.7	H462 D503 G508 H535 E641	H462-H506 HydrophobicContact CB-CB 4.05Å; H462-H506 VanDerWaalsContact CB-ND1 3.25Å; H462-H506 WeakPolarHBondContact CB-ND1 3.4Å; H462-H506 AromaticContact CE1-CE1 3.96Å; H462-H506 AromaticContact CG-CE1 3.59Å; H462-H506 AromaticContact CG-ND1 3.58Å; H462-H506 AromaticContact ND1-CE1 3.33Å; H462-H506 PolarHBondContact ND1-CE1 3.41Å; H462-H506 VanDerWaalsContact ND1-CE1 3.33Å; H462-H506 AromaticContact ND1-ND1 3.67Å; D503-H506 VanDerWaalsContact O-CB 3.22Å; D503-H506 WeakPolarHBondContact O-CB 3.45Å; D503-H506 PolarHBondContact O-N 2.92Å; H506-G508 VanDerWaalsContact C-N 3.3Å; H506-G508 PolarHBondContact ND1-N 2.8Å; H506-G508 PolarHBondContact O-N 3.42Å; H506-H535 AromaticContact CD2-NE2 3.79Å; H506-E641 IonicContact CE1-OE1 2.66Å; H506-E641 PolarHBondContact CE1-OE1 3.29Å; H506-E641 IonicContact ND1-OE1 2.87Å
507	P	98.1	Very high	98	Very high	31 Å²	31	20 Å²	20	20%	0.201	11%	0.11	C	C	.	.			trans	-85.4	6.8	-170.6	35.3	-37.7	0	0	0	114.8	V509 L514 L531 R648	P507-V509 HydrophobicContact CB-CG2 4.16Å; P507-V509 HydrophobicContact CG-CG2 3.76Å; P507-L514 HydrophobicContact CG-CD1 4.35Å; P507-L514 HydrophobicContact CG-CD2 4.37Å; P507-L531 VanDerWaalsContact CD-CD2 3.49Å; P507-L531 HydrophobicContact CG-CD2 4.03Å; P507-R648 PolarHBondContact O-NH1 3.2Å
508	G	98	Very high	97.9	Very high	3 Å²	3	25.6 Å²	25.6	3%	0.031	14%	0.14	C	C	.	.	S	Bend	trans	71.5	32.4	-177.6	0	0	0	0	0	114.6	H506 E641	H506-G508 VanDerWaalsContact C-N 3.3Å; H506-G508 PolarHBondContact ND1-N 2.8Å; H506-G508 PolarHBondContact O-N 3.42Å; G508-E641 VanDerWaalsContact CA-OE1 3.25Å; G508-E641 WeakPolarHBondContact CA-OE1 3.24Å
509	V	98.1	Very high	97.7	Very high	5 Å²	5	26.6 Å²	26.6	3%	0.03	15%	0.147	C	C	.	.	S	Bend	trans	-153.5	146.2	177.8	-78.7	0	0	0	0	110.7	P507 F513 L514 Q645	P507-V509 HydrophobicContact CB-CG2 4.16Å; P507-V509 HydrophobicContact CG-CG2 3.76Å; V509-F513 HydrophobicContact CB-CB 4.1Å; V509-F513 HydrophobicContact CB-CD1 3.57Å; V509-F513 HydrophobicContact CB-CE1 4.16Å; V509-F513 HydrophobicContact CB-CG 3.9Å; V509-F513 HydrophobicContact CG1-CD1 3.71Å; V509-F513 HydrophobicContact CG1-CD2 4.35Å; V509-F513 HydrophobicContact CG1-CE1 3.86Å; V509-F513 HydrophobicContact CG1-CE2 4.48Å; V509-F513 HydrophobicContact CG1-CG 3.97Å; V509-F513 HydrophobicContact CG1-CZ 4.24Å; V509-F513 HydrophobicContact CG2-CD1 3.61Å; V509-F513 HydrophobicContact CG2-CE1 4.02Å; V509-F513 HydrophobicContact CG2-CG 4.42Å; V509-L514 HydrophobicContact CG2-CD2 3.99Å; V509-L514 HydrophobicContact CG2-CG 4.36Å; V509-Q645 VanDerWaalsContact CA-OE1 3.3Å; V509-Q645 HydrophobicContact CG1-CB 3.98Å; V509-Q645 HydrophobicContact CG1-CG 3.93Å
510	S	97.6	Very high	97.6	Very high	46 Å²	46	32.4 Å²	32.4	32%	0.322	18%	0.175	S	C	.	.			trans	-70.7	161.6	-174.3	74.7	0	0	0	0	115.2	Q512 F513 L514	S510-Q512 PolarHBondContact O-N 3.31Å; S510-F513 WeakPolarHBondContact O-CB 3.34Å; S510-F513 PolarHBondContact O-N 3.37Å; S510-F513 PolarHBondContact OG-N 3.26Å; S510-L514 PolarHBondContact O-N 3.36Å; S510-L514 VanDerWaalsContact O-N 3.09Å
511	N	97.5	Very high	97.5	Very high	29 Å²	29	34 Å²	34	16%	0.155	18%	0.183	C	C	.	.	H	α-helix	trans	-45.5	-46.1	169.9	-84.1	-35	0	0	0	112	F513 L514 I515 V530 L531 E532	N511-F513 PolarHBondContact O-N 2.99Å; N511-L514 WeakPolarHBondContact O-CB 3.47Å; N511-L514 PolarHBondContact O-N 2.93Å; N511-I515 WeakPolarHBondContact O-CD1 3.46Å; N511-I515 VanDerWaalsContact O-CG1 3.29Å; N511-I515 WeakPolarHBondContact O-CG1 3.35Å; N511-I515 PolarHBondContact O-N 3.33Å; N511-V530 WeakPolarHBondContact OD1-CB 3.37Å; N511-V530 PolarHBondContact OD1-N 3.46Å; N511-L531 WeakPolarHBondContact OD1-CB 3.05Å; N511-L531 VanDerWaalsContact OD1-CG 3.29Å; N511-L531 WeakPolarHBondContact OD1-CG 3.3Å; N511-L531 PolarHBondContact OD1-N 2.94Å; N511-E532 PolarHBondContact ND2-OE1 3.19Å; N511-E532 PolarHBondContact ND2-OE2 3.43Å
512	Q	96.4	Very high	97.4	Very high	86 Å²	86	34 Å²	34	40%	0.402	18%	0.183	S	C	.	.	H	α-helix	trans	-66.3	-36	-178.8	-166.8	60.3	45.3	0	0	113	S510 I515 N516	S510-Q512 PolarHBondContact O-N 3.31Å; Q512-I515 PolarHBondContact O-N 3.29Å; Q512-N516 PolarHBondContact NE2-OD1 2.99Å; Q512-N516 VanDerWaalsContact O-CB 3.28Å; Q512-N516 WeakPolarHBondContact O-CB 3.43Å; Q512-N516 PolarHBondContact O-N 3.38Å; Q512-N516 PolarHBondContact O-ND2 3.34Å; Q512-N516 PolarHBondContact O-OD1 2.89Å
513	F	97.3	Very high	97.3	Very high	8 Å²	8	39.6 Å²	39.6	4%	0.035	21%	0.212	C	C	.	.	H	α-helix	trans	-64.8	-42.1	173.3	178.8	-83.9	0	0	0	111.1	V509 S510 N511 I515 N516 T517 Q645 R648 E649 M654	V509-F513 HydrophobicContact CB-CB 4.1Å; V509-F513 HydrophobicContact CB-CD1 3.57Å; V509-F513 HydrophobicContact CB-CE1 4.16Å; V509-F513 HydrophobicContact CB-CG 3.9Å; V509-F513 HydrophobicContact CG1-CD1 3.71Å; V509-F513 HydrophobicContact CG1-CD2 4.35Å; V509-F513 HydrophobicContact CG1-CE1 3.86Å; V509-F513 HydrophobicContact CG1-CE2 4.48Å; V509-F513 HydrophobicContact CG1-CG 3.97Å; V509-F513 HydrophobicContact CG1-CZ 4.24Å; V509-F513 HydrophobicContact CG2-CD1 3.61Å; V509-F513 HydrophobicContact CG2-CE1 4.02Å; V509-F513 HydrophobicContact CG2-CG 4.42Å; S510-F513 WeakPolarHBondContact O-CB 3.34Å; S510-F513 PolarHBondContact O-N 3.37Å; S510-F513 PolarHBondContact OG-N 3.26Å; N511-F513 PolarHBondContact O-N 2.99Å; F513-I515 VanDerWaalsContact C-N 3.32Å; F513-I515 PolarHBondContact O-N 3.5Å; F513-N516 PolarHBondContact O-N 3.45Å; F513-T517 HydrophobicContact CD1-CG2 4.14Å; F513-T517 HydrophobicContact CD2-CG2 4.41Å; F513-T517 HydrophobicContact CE1-CG2 3.81Å; F513-T517 HydrophobicContact CE2-CG2 4.11Å; F513-T517 HydrophobicContact CG-CG2 4.43Å; F513-T517 HydrophobicContact CZ-CG2 3.8Å; F513-T517 WeakPolarHBondContact O-CB 3.3Å; F513-T517 WeakPolarHBondContact O-CG2 3.46Å; F513-T517 PolarHBondContact O-N 2.97Å; F513-T517 PolarHBondContact O-OG1 2.82Å; F513-Q645 HydrophobicContact CD2-CG 4.06Å; F513-R648 HydrophobicContact CE2-CB 4.11Å; F513-R648 HydrophobicContact CZ-CB 4Å; F513-E649 HydrophobicContact CD2-CG 3.58Å; F513-E649 HydrophobicContact CE2-CG 3.62Å; F513-M654 HydrophobicContact CD2-CE 4.14Å; F513-M654 HydrophobicContact CE2-CE 4.36Å; F513-M654 HydrophobicContact CE2-SD 4.42Å
514	L	97.5	Very high	97.2	Very high	12 Å²	12	42.4 Å²	42.4	6%	0.063	23%	0.226	C	C	.	.	H	α-helix	trans	-63.9	-35.5	177.8	-68.9	-179.6	0	0	0	112.9	P507 V509 S510 N511 N518 S519 L521 A522 V530 L531	P507-L514 HydrophobicContact CG-CD1 4.35Å; P507-L514 HydrophobicContact CG-CD2 4.37Å; V509-L514 HydrophobicContact CG2-CD2 3.99Å; V509-L514 HydrophobicContact CG2-CG 4.36Å; S510-L514 PolarHBondContact O-N 3.36Å; S510-L514 VanDerWaalsContact O-N 3.09Å; N511-L514 WeakPolarHBondContact O-CB 3.47Å; N511-L514 PolarHBondContact O-N 2.93Å; L514-N518 PolarHBondContact O-N 3.31Å; L514-S519 WeakPolarHBondContact CB-OG 3.45Å; L514-S519 WeakPolarHBondContact O-CB 3.18Å; L514-S519 PolarHBondContact O-N 3.14Å; L514-S519 PolarHBondContact O-OG 2.93Å; L514-L521 HydrophobicContact CD1-CD1 4.23Å; L514-A522 WeakPolarHBondContact O-CB 3.39Å; L514-V530 HydrophobicContact CD1-CG1 4.12Å; L514-L531 HydrophobicContact CD1-CD1 4.44Å; L514-L531 HydrophobicContact CD1-CD2 3.62Å; L514-L531 HydrophobicContact CD1-CG 3.83Å
515	I	97.2	Very high	97.1	Very high	38 Å²	38	44.2 Å²	44.2	20%	0.195	23%	0.233	C	C	.	.	H	α-helix	trans	-71	-55.3	174.2	-65.1	162.3	0	0	0	110.1	N511 Q512 F513 T517 N518 A522 D527 V530	N511-I515 WeakPolarHBondContact O-CD1 3.46Å; N511-I515 VanDerWaalsContact O-CG1 3.29Å; N511-I515 WeakPolarHBondContact O-CG1 3.35Å; N511-I515 PolarHBondContact O-N 3.33Å; Q512-I515 PolarHBondContact O-N 3.29Å; F513-I515 VanDerWaalsContact C-N 3.32Å; F513-I515 PolarHBondContact O-N 3.5Å; I515-T517 PolarHBondContact O-N 3.17Å; I515-T517 VanDerWaalsContact O-N 3.14Å; I515-N518 PolarHBondContact O-N 3.43Å; I515-A522 HydrophobicContact CG1-CB 4.12Å; I515-D527 HydrophobicContact CD1-CB 3.94Å; I515-D527 HydrophobicContact CG1-CB 3.93Å; I515-D527 HydrophobicContact CG2-CB 4.33Å; I515-V530 HydrophobicContact CG1-CG2 4.34Å
516	N	96.3	Very high	97	Very high	84 Å²	84	48.9 Å²	48.9	45%	0.449	26%	0.258	S	S	.	.	H	α-helix	trans	-55.8	-35.8	-179.7	-72	-8.7	0	0	0	112.4	Q512 F513 N518 M654	Q512-N516 PolarHBondContact NE2-OD1 2.99Å; Q512-N516 VanDerWaalsContact O-CB 3.28Å; Q512-N516 WeakPolarHBondContact O-CB 3.43Å; Q512-N516 PolarHBondContact O-N 3.38Å; Q512-N516 PolarHBondContact O-ND2 3.34Å; Q512-N516 PolarHBondContact O-OD1 2.89Å; F513-N516 PolarHBondContact O-N 3.45Å; N516-N518 VanDerWaalsContact C-N 3.34Å; N516-N518 PolarHBondContact O-ND2 2.93Å; N516-M654 HydrophobicContact CB-CE 3.75Å
517	T	96.4	Very high	97	Very high	32 Å²	32	52.8 Å²	52.8	20%	0.196	28%	0.279	C	S	.	.	T	Hydrogen-bonded Turn	trans	-85.4	2	178.5	59	0	0	0	0	114.9	F513 I515 S519 M654	F513-T517 HydrophobicContact CD1-CG2 4.14Å; F513-T517 HydrophobicContact CD2-CG2 4.41Å; F513-T517 HydrophobicContact CE1-CG2 3.81Å; F513-T517 HydrophobicContact CE2-CG2 4.11Å; F513-T517 HydrophobicContact CG-CG2 4.43Å; F513-T517 HydrophobicContact CZ-CG2 3.8Å; F513-T517 WeakPolarHBondContact O-CB 3.3Å; F513-T517 WeakPolarHBondContact O-CG2 3.46Å; F513-T517 PolarHBondContact O-N 2.97Å; F513-T517 PolarHBondContact O-OG1 2.82Å; I515-T517 PolarHBondContact O-N 3.17Å; I515-T517 VanDerWaalsContact O-N 3.14Å; T517-S519 VanDerWaalsContact C-N 3.31Å; T517-S519 PolarHBondContact O-N 3.1Å; T517-M654 HydrophobicContact CG2-CE 4.09Å; T517-M654 HydrophobicContact CG2-SD 3.72Å
518	N	96.1	Very high	96.8	Very high	118 Å²	118	54.9 Å²	54.9	63%	0.631	29%	0.294	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.7	45	-178.9	-67.3	-112.5	0	0	0	112.3	L514 I515 N516	L514-N518 PolarHBondContact O-N 3.31Å; I515-N518 PolarHBondContact O-N 3.43Å; N516-N518 VanDerWaalsContact C-N 3.34Å; N516-N518 PolarHBondContact O-ND2 2.93Å
519	S	96.4	Very high	96.7	Very high	21 Å²	21	55.7 Å²	55.7	15%	0.147	30%	0.3	C	S	.	.			trans	-65.6	157.4	-176.9	67.6	0	0	0	0	113.4	L514 T517 L521 A522 L523	L514-S519 WeakPolarHBondContact CB-OG 3.45Å; L514-S519 WeakPolarHBondContact O-CB 3.18Å; L514-S519 PolarHBondContact O-N 3.14Å; L514-S519 PolarHBondContact O-OG 2.93Å; T517-S519 VanDerWaalsContact C-N 3.31Å; T517-S519 PolarHBondContact O-N 3.1Å; S519-L521 PolarHBondContact O-N 3.28Å; S519-A522 PolarHBondContact O-N 3.25Å; S519-A522 WeakPolarHBondContact OG-CB 3.22Å; S519-A522 PolarHBondContact OG-N 3.19Å; S519-A522 VanDerWaalsContact OG-N 3.14Å; S519-L523 WeakPolarHBondContact O-CG 3.22Å; S519-L523 PolarHBondContact O-N 2.93Å
520	E	96.8	Very high	96.7	Very high	122 Å²	122	55.5 Å²	55.5	57%	0.57	30%	0.298	S	S	*	.	H	α-helix	trans	-59.2	-32.1	175.1	-173.3	172.7	178.1	0	0	111.9	M524	E520-M524 HydrophobicContact CG-CE 4.37Å; E520-M524 WeakPolarHBondContact O-CB 3.47Å; E520-M524 PolarHBondContact O-N 3.42Å
521	L	96.5	Very high	96.8	Very high	33 Å²	33	53.7 Å²	53.7	17%	0.173	29%	0.285	C	S	.	.	H	α-helix	trans	-68.2	-49.4	175.4	-59.2	-177.9	0	0	0	111.8	L514 S519 L523 M524 Y525 V530	L514-L521 HydrophobicContact CD1-CD1 4.23Å; S519-L521 PolarHBondContact O-N 3.28Å; L521-L523 VanDerWaalsContact C-N 3.32Å; L521-L523 PolarHBondContact O-N 3.27Å; L521-M524 WeakPolarHBondContact O-CB 3.11Å; L521-M524 PolarHBondContact O-N 3.45Å; L521-Y525 HydrophobicContact CB-CD2 4.5Å; L521-Y525 HydrophobicContact CD2-CE2 4.31Å; L521-Y525 VanDerWaalsContact O-CD2 3.26Å; L521-Y525 WeakPolarHBondContact O-CD2 3.48Å; L521-Y525 PolarHBondContact O-N 2.97Å; L521-V530 VanDerWaalsContact C-CG1 3.45Å; L521-V530 HydrophobicContact CB-CG1 3.65Å
522	A	96.5	Very high	96.8	Very high	0 Å²	0	53.1 Å²	53.1	0%	0	28%	0.281	C	S	.	.	H	α-helix	trans	-60.2	-43.2	179.3	0	0	0	0	0	111.7	L514 I515 S519 M524 Y525 N526 D527 V530	L514-A522 WeakPolarHBondContact O-CB 3.39Å; I515-A522 HydrophobicContact CG1-CB 4.12Å; S519-A522 PolarHBondContact O-N 3.25Å; S519-A522 WeakPolarHBondContact OG-CB 3.22Å; S519-A522 PolarHBondContact OG-N 3.19Å; S519-A522 VanDerWaalsContact OG-N 3.14Å; A522-M524 VanDerWaalsContact C-N 3.3Å; A522-M524 PolarHBondContact O-N 3Å; A522-Y525 PolarHBondContact O-N 3.37Å; A522-N526 WeakPolarHBondContact O-CA 3.25Å; A522-N526 PolarHBondContact O-N 3.49Å; A522-D527 PolarHBondContact O-N 3.08Å; A522-D527 VanDerWaalsContact O-N 3.14Å; A522-V530 HydrophobicContact CB-CG1 4.29Å; A522-V530 HydrophobicContact CB-CG2 4.34Å
523	L	96.2	Very high	96.9	Very high	117 Å²	117	51.5 Å²	51.5	61%	0.613	28%	0.276	S	S	*	.	H	α-helix	trans	-65.4	-27.7	173.9	-66.1	172.1	0	0	0	113.7	S519 L521	S519-L523 WeakPolarHBondContact O-CG 3.22Å; S519-L523 PolarHBondContact O-N 2.93Å; L521-L523 VanDerWaalsContact C-N 3.32Å; L521-L523 PolarHBondContact O-N 3.27Å
524	M	96.1	Very high	97	Very high	73 Å²	73	51.3 Å²	51.3	36%	0.36	28%	0.275	S	S	.	.	H	α-helix	trans	-79.6	-40.6	177.9	-172.2	177.6	-51.3	0	0	112.2	E520 L521 A522 N526	E520-M524 HydrophobicContact CG-CE 4.37Å; E520-M524 WeakPolarHBondContact O-CB 3.47Å; E520-M524 PolarHBondContact O-N 3.42Å; L521-M524 WeakPolarHBondContact O-CB 3.11Å; L521-M524 PolarHBondContact O-N 3.45Å; A522-M524 VanDerWaalsContact C-N 3.3Å; A522-M524 PolarHBondContact O-N 3Å; M524-N526 PolarHBondContact O-ND2 3.12Å
525	Y	97.1	Very high	97.1	Very high	39 Å²	39	50.9 Å²	50.9	15%	0.153	27%	0.272	C	S	.	.	H	α-helix	trans	-98.7	2.6	-176.3	-59.1	-63.2	0	0	0	114	L521 A522 V530 N533 H534 A537	L521-Y525 HydrophobicContact CB-CD2 4.5Å; L521-Y525 HydrophobicContact CD2-CE2 4.31Å; L521-Y525 VanDerWaalsContact O-CD2 3.26Å; L521-Y525 WeakPolarHBondContact O-CD2 3.48Å; L521-Y525 PolarHBondContact O-N 2.97Å; A522-Y525 PolarHBondContact O-N 3.37Å; Y525-V530 HydrophobicContact CD2-CG1 4.22Å; Y525-V530 VanDerWaalsContact CD2-O 3.23Å; Y525-V530 WeakPolarHBondContact CD2-O 3.38Å; Y525-N533 HydrophobicContact CD1-CB 3.46Å; Y525-N533 VanDerWaalsContact CD1-CB 3.46Å; Y525-N533 HydrophobicContact CD2-CB 4.38Å; Y525-N533 HydrophobicContact CE1-CB 3.7Å; Y525-N533 HydrophobicContact CG-CB 3.84Å; Y525-H534 HydrophobicContact CE2-CB 3.69Å; Y525-A537 WeakPolarHBondContact OH-CB 3.32Å
526	N	96.8	Very high	97.1	Very high	120 Å²	120	49.5 Å²	49.5	64%	0.642	27%	0.265	S	S	*	.	T	Hydrogen-bonded Turn	trans	59.3	50.6	174.6	-47.8	-99.7	0	0	0	111.6	A522 M524 S528	A522-N526 WeakPolarHBondContact O-CA 3.25Å; A522-N526 PolarHBondContact O-N 3.49Å; M524-N526 PolarHBondContact O-ND2 3.12Å; N526-S528 PolarHBondContact O-N 3.36Å; N526-S528 PolarHBondContact O-OG 3.12Å
527	D	97.3	Very high	97.2	Very high	92 Å²	92	47 Å²	47	49%	0.492	26%	0.256	S	S	.	.	T	Hydrogen-bonded Turn	trans	56.4	13.7	175.9	-50.1	-35.2	0	0	0	115.3	I515 A522	I515-D527 HydrophobicContact CD1-CB 3.94Å; I515-D527 HydrophobicContact CG1-CB 3.93Å; I515-D527 HydrophobicContact CG2-CB 4.33Å; A522-D527 PolarHBondContact O-N 3.08Å; A522-D527 VanDerWaalsContact O-N 3.14Å
528	S	95.3	Very high	97.3	Very high	74 Å²	74	45.4 Å²	45.4	52%	0.517	25%	0.247	S	C	.	.	S	Bend	trans	-119.1	104.8	-170.3	-58	0	0	0	0	110.9	N526 V530 N533	N526-S528 PolarHBondContact O-N 3.36Å; N526-S528 PolarHBondContact O-OG 3.12Å; S528-V530 PolarHBondContact O-N 2.93Å; S528-N533 PolarHBondContact O-ND2 2.83Å
529	S	96.5	Very high	97.4	Very high	21 Å²	21	39.8 Å²	39.8	15%	0.147	22%	0.216	C	C	.	.	S	Bend	trans	49.5	57.6	-176.5	-46.2	0	0	0	0	111.8	E532 N533 D574 K577	S529-E532 WeakPolarHBondContact CA-OE2 3.22Å; S529-E532 VanDerWaalsContact CB-OE2 3.3Å; S529-E532 WeakPolarHBondContact CB-OE2 3.27Å; S529-N533 WeakPolarHBondContact O-CB 3.41Å; S529-N533 PolarHBondContact O-N 3.17Å; S529-N533 VanDerWaalsContact O-N 3.08Å; S529-N533 PolarHBondContact O-ND2 3.21Å; S529-D574 VanDerWaalsContact CB-OD2 3.32Å; S529-D574 WeakPolarHBondContact CB-OD2 3.5Å; S529-D574 PolarHBondContact OG-OD2 2.74Å; S529-K577 PolarHBondContact OG-NZ 3.03Å
530	V	98.2	Very high	97.5	Very high	0 Å²	0	40 Å²	40	0%	0	22%	0.215	C	C	.	.	H	α-helix	trans	-66.6	-43.3	-164.6	174.3	0	0	0	0	111.3	N511 L514 I515 L521 A522 Y525 S528 E532 H534	N511-V530 WeakPolarHBondContact OD1-CB 3.37Å; N511-V530 PolarHBondContact OD1-N 3.46Å; L514-V530 HydrophobicContact CD1-CG1 4.12Å; I515-V530 HydrophobicContact CG1-CG2 4.34Å; L521-V530 VanDerWaalsContact C-CG1 3.45Å; L521-V530 HydrophobicContact CB-CG1 3.65Å; A522-V530 HydrophobicContact CB-CG1 4.29Å; A522-V530 HydrophobicContact CB-CG2 4.34Å; Y525-V530 HydrophobicContact CD2-CG1 4.22Å; Y525-V530 VanDerWaalsContact CD2-O 3.23Å; Y525-V530 WeakPolarHBondContact CD2-O 3.38Å; S528-V530 PolarHBondContact O-N 2.93Å; V530-E532 PolarHBondContact N-OE2 2.79Å; V530-H534 WeakPolarHBondContact O-CB 3.38Å; V530-H534 PolarHBondContact O-N 2.89Å
531	L	98.5	Very high	97.6	Very high	9 Å²	9	37.1 Å²	37.1	5%	0.047	20%	0.2	C	C	.	.	H	α-helix	trans	-71.1	-49.2	177.8	-76.4	169	0	0	0	111.3	P507 N511 L514 N533 H534 H535	P507-L531 VanDerWaalsContact CD-CD2 3.49Å; P507-L531 HydrophobicContact CG-CD2 4.03Å; N511-L531 WeakPolarHBondContact OD1-CB 3.05Å; N511-L531 VanDerWaalsContact OD1-CG 3.29Å; N511-L531 WeakPolarHBondContact OD1-CG 3.3Å; N511-L531 PolarHBondContact OD1-N 2.94Å; L514-L531 HydrophobicContact CD1-CD1 4.44Å; L514-L531 HydrophobicContact CD1-CD2 3.62Å; L514-L531 HydrophobicContact CD1-CG 3.83Å; L531-N533 VanDerWaalsContact C-N 3.35Å; L531-N533 PolarHBondContact O-N 3.41Å; L531-H534 CarbonylContact O-C 3.59Å; L531-H534 VanDerWaalsContact O-CA 3.31Å; L531-H534 WeakPolarHBondContact O-CA 3.38Å; L531-H534 VanDerWaalsContact O-CB 3.24Å; L531-H534 WeakPolarHBondContact O-CB 3.43Å; L531-H534 PolarHBondContact O-N 2.82Å; L531-H535 WeakPolarHBondContact CB-NE2 3.35Å; L531-H535 PolarHBondContact O-CD2 3.08Å; L531-H535 PolarHBondContact O-N 3.42Å; L531-H535 PolarHBondContact O-NE2 2.91Å
532	E	98.6	Very high	97.6	Very high	16 Å²	16	35.6 Å²	35.6	8%	0.075	19%	0.192	C	C	.	.	H	α-helix	trans	-68.2	-35.1	-171.6	-52.2	82.8	176.8	0	0	111.7	N511 S529 V530 L536 L571 D574	N511-E532 PolarHBondContact ND2-OE1 3.19Å; N511-E532 PolarHBondContact ND2-OE2 3.43Å; S529-E532 WeakPolarHBondContact CA-OE2 3.22Å; S529-E532 VanDerWaalsContact CB-OE2 3.3Å; S529-E532 WeakPolarHBondContact CB-OE2 3.27Å; V530-E532 PolarHBondContact N-OE2 2.79Å; E532-L536 WeakPolarHBondContact O-CB 3.35Å; E532-L536 WeakPolarHBondContact O-CG 3.44Å; E532-L536 PolarHBondContact O-N 3.07Å; E532-L571 HydrophobicContact CB-CD2 4.12Å; E532-D574 HydrophobicContact CG-CB 3.84Å; E532-D574 WeakPolarHBondContact OE1-CA 3.35Å; E532-D574 WeakPolarHBondContact OE1-CB 3.44Å
533	N	98.4	Very high	97.7	Very high	53 Å²	53	36.3 Å²	36.3	28%	0.283	20%	0.196	S	C	.	.	H	α-helix	trans	-66	-36.3	167.7	-81.4	-76.5	0	0	0	112.5	Y525 S528 S529 L531 A537	Y525-N533 HydrophobicContact CD1-CB 3.46Å; Y525-N533 VanDerWaalsContact CD1-CB 3.46Å; Y525-N533 HydrophobicContact CD2-CB 4.38Å; Y525-N533 HydrophobicContact CE1-CB 3.7Å; Y525-N533 HydrophobicContact CG-CB 3.84Å; S528-N533 PolarHBondContact O-ND2 2.83Å; S529-N533 WeakPolarHBondContact O-CB 3.41Å; S529-N533 PolarHBondContact O-N 3.17Å; S529-N533 VanDerWaalsContact O-N 3.08Å; S529-N533 PolarHBondContact O-ND2 3.21Å; L531-N533 VanDerWaalsContact C-N 3.35Å; L531-N533 PolarHBondContact O-N 3.41Å; N533-A537 VanDerWaalsContact O-CB 3.27Å; N533-A537 WeakPolarHBondContact O-CB 3.45Å; N533-A537 PolarHBondContact O-N 3.2Å
534	H	98.4	Very high	97.7	Very high	4 Å²	4	37 Å²	37	2%	0.019	20%	0.196	C	C	.	.	H	α-helix	trans	-69.1	-45.1	178.2	-173.3	61.9	0	0	0	112.1	D505 Y525 V530 L531 L536 A537 V538	D505-H534 IonicContact OD2-CD2 3.42Å; D505-H534 IonicContact OD2-CE1 3.8Å; D505-H534 IonicContact OD2-NE2 2.78Å; D505-H534 PolarHBondContact OD2-NE2 2.86Å; Y525-H534 HydrophobicContact CE2-CB 3.69Å; V530-H534 WeakPolarHBondContact O-CB 3.38Å; V530-H534 PolarHBondContact O-N 2.89Å; L531-H534 CarbonylContact O-C 3.59Å; L531-H534 VanDerWaalsContact O-CA 3.31Å; L531-H534 WeakPolarHBondContact O-CA 3.38Å; L531-H534 VanDerWaalsContact O-CB 3.24Å; L531-H534 WeakPolarHBondContact O-CB 3.43Å; L531-H534 PolarHBondContact O-N 2.82Å; H534-L536 VanDerWaalsContact C-N 3.34Å; H534-L536 PolarHBondContact O-N 3.17Å; H534-A537 CarbonylContact O-C 3.54Å; H534-A537 WeakPolarHBondContact O-CA 3.21Å; H534-A537 WeakPolarHBondContact O-CB 3.33Å; H534-A537 PolarHBondContact O-N 3.49Å; H534-V538 WeakPolarHBondContact O-CG2 3.42Å; H534-V538 PolarHBondContact O-N 2.82Å
535	H	98.7	Very high	97.6	Very high	2 Å²	2	36 Å²	36	1%	0.009	19%	0.191	C	C	.	.	H	α-helix	trans	-57.7	-46.1	175.6	-56.7	-35.4	0	0	0	111.1	H502 D503 V504 H506 L531 A537 G539 V570	H502-H535 WeakPolarHBondContact O-CB 3.14Å; H502-H535 PolarHBondContact O-CD2 3.44Å; D503-H535 VanDerWaalsContact C-ND1 3.33Å; V504-H535 HydrophobicContact CG1-CB 4.38Å; V504-H535 VanDerWaalsContact CG1-O 3.25Å; V504-H535 WeakPolarHBondContact CG1-O 3.31Å; V504-H535 PolarHBondContact O-ND1 3.03Å; H506-H535 AromaticContact CD2-NE2 3.79Å; L531-H535 WeakPolarHBondContact CB-NE2 3.35Å; L531-H535 PolarHBondContact O-CD2 3.08Å; L531-H535 PolarHBondContact O-N 3.42Å; L531-H535 PolarHBondContact O-NE2 2.91Å; H535-A537 PolarHBondContact O-N 3.35Å; H535-G539 PolarHBondContact O-N 3.46Å; H535-V570 HydrophobicContact CB-CG1 4.42Å
536	L	98.7	Very high	97.5	Very high	10 Å²	10	39.9 Å²	39.9	5%	0.052	21%	0.21	C	C	.	.	H	α-helix	trans	-60.1	-44.4	170	-79.5	167.4	0	0	0	113.3	I501 E532 H534 F540 V566 I567 V570 L571	I501-L536 HydrophobicContact CD1-CD2 4.25Å; E532-L536 WeakPolarHBondContact O-CB 3.35Å; E532-L536 WeakPolarHBondContact O-CG 3.44Å; E532-L536 PolarHBondContact O-N 3.07Å; H534-L536 VanDerWaalsContact C-N 3.34Å; H534-L536 PolarHBondContact O-N 3.17Å; L536-F540 HydrophobicContact CD2-CD2 4.18Å; L536-F540 HydrophobicContact CD2-CE2 3.88Å; L536-F540 WeakPolarHBondContact O-CB 3.5Å; L536-F540 WeakPolarHBondContact O-CD2 3.3Å; L536-F540 PolarHBondContact O-N 3.03Å; L536-F540 VanDerWaalsContact O-N 3.14Å; L536-V566 HydrophobicContact CD2-CG1 3.97Å; L536-I567 HydrophobicContact CD1-CB 4.3Å; L536-I567 HydrophobicContact CD1-CG1 4.19Å; L536-I567 HydrophobicContact CD1-CG2 4.22Å; L536-I567 HydrophobicContact CD2-CG1 3.97Å; L536-V570 HydrophobicContact CD1-CB 4.02Å; L536-V570 HydrophobicContact CD1-CG1 4.27Å; L536-V570 HydrophobicContact CD2-CB 3.82Å; L536-V570 HydrophobicContact CD2-CG1 4.35Å; L536-V570 HydrophobicContact CD2-CG2 4Å; L536-V570 HydrophobicContact CG-CB 3.74Å; L536-V570 HydrophobicContact CG-CG1 3.81Å; L536-V570 HydrophobicContact CG-CG2 4.38Å; L536-L571 HydrophobicContact CD1-CD2 3.94Å; L536-L571 HydrophobicContact CD1-CG 3.74Å
537	A	98.3	Very high	97.4	Very high	30 Å²	30	37.4 Å²	37.4	25%	0.248	20%	0.197	C	C	.	.	H	α-helix	trans	-64.2	-43.8	-178.8	0	0	0	0	0	111.7	I364 Y525 N533 H534 H535 K541	I364-A537 HydrophobicContact CD1-CB 3.77Å; Y525-A537 WeakPolarHBondContact OH-CB 3.32Å; N533-A537 VanDerWaalsContact O-CB 3.27Å; N533-A537 WeakPolarHBondContact O-CB 3.45Å; N533-A537 PolarHBondContact O-N 3.2Å; H534-A537 CarbonylContact O-C 3.54Å; H534-A537 WeakPolarHBondContact O-CA 3.21Å; H534-A537 WeakPolarHBondContact O-CB 3.33Å; H534-A537 PolarHBondContact O-N 3.49Å; H535-A537 PolarHBondContact O-N 3.35Å; A537-K541 WeakPolarHBondContact O-CB 3.3Å; A537-K541 PolarHBondContact O-N 3.2Å
538	V	98.2	Very high	97.4	Very high	0 Å²	0	33 Å²	33	0%	0	17%	0.174	C	C	.	.	H	α-helix	trans	-69.4	-54	176.8	173	0	0	0	0	110.8	I364 V367 V504 D505 H534 F540 K541 L542	I364-V538 HydrophobicContact CD1-CG2 4.44Å; I364-V538 HydrophobicContact CG2-CG2 4.32Å; V367-V538 HydrophobicContact CG2-CG1 4.49Å; V367-V538 HydrophobicContact CG2-CG2 4.21Å; V504-V538 HydrophobicContact CG1-CB 4Å; V504-V538 HydrophobicContact CG1-CG1 3.93Å; V504-V538 HydrophobicContact CG2-CG1 3.86Å; D505-V538 HydrophobicContact CB-CG1 4.33Å; D505-V538 HydrophobicContact CB-CG2 4.17Å; H534-V538 WeakPolarHBondContact O-CG2 3.42Å; H534-V538 PolarHBondContact O-N 2.82Å; V538-F540 VanDerWaalsContact C-N 3.31Å; V538-F540 PolarHBondContact O-N 3.43Å; V538-K541 CarbonylContact O-C 3.55Å; V538-K541 WeakPolarHBondContact O-CA 3.46Å; V538-K541 WeakPolarHBondContact O-CB 3.22Å; V538-K541 PolarHBondContact O-N 3.09Å; V538-L542 HydrophobicContact CG1-CD1 4.29Å; V538-L542 HydrophobicContact CG1-CG 4.25Å; V538-L542 WeakPolarHBondContact O-CG 3.41Å; V538-L542 PolarHBondContact O-N 3.37Å
539	G	98.2	Very high	97.5	Very high	0 Å²	0	31.4 Å²	31.4	0%	0	16%	0.159	C	C	.	.	H	α-helix	trans	-55.7	-41.7	-177.3	0	0	0	0	0	113.6	Y447 H535	Y447-G539 PolarHBondContact OH-O 2.81Å; H535-G539 PolarHBondContact O-N 3.46Å
540	F	98.5	Very high	97.6	Very high	24 Å²	24	30.5 Å²	30.5	11%	0.105	15%	0.153	C	C	.	.	H	α-helix	trans	-77.7	-21.3	172.6	-81	-77.3	0	0	0	114.4	F497 I501 L536 V538 L543 R563 V566 I567	F497-F540 HydrophobicContact CE1-CE1 4.32Å; F497-F540 HydrophobicContact CE1-CE2 4.46Å; F497-F540 HydrophobicContact CE1-CZ 4.14Å; I501-F540 HydrophobicContact CD1-CD2 4.36Å; I501-F540 HydrophobicContact CD1-CE2 4.38Å; L536-F540 HydrophobicContact CD2-CD2 4.18Å; L536-F540 HydrophobicContact CD2-CE2 3.88Å; L536-F540 WeakPolarHBondContact O-CB 3.5Å; L536-F540 WeakPolarHBondContact O-CD2 3.3Å; L536-F540 PolarHBondContact O-N 3.03Å; L536-F540 VanDerWaalsContact O-N 3.14Å; V538-F540 VanDerWaalsContact C-N 3.31Å; V538-F540 PolarHBondContact O-N 3.43Å; F540-L543 HydrophobicContact CD1-CD1 3.7Å; F540-L543 HydrophobicContact CE1-CD1 4.33Å; F540-R563 HydrophobicContact CE1-CB 4.2Å; F540-R563 HydrophobicContact CE1-CG 4.13Å; F540-R563 HydrophobicContact CE2-CG 4.44Å; F540-R563 HydrophobicContact CZ-CB 4.15Å; F540-R563 HydrophobicContact CZ-CG 3.96Å; F540-V566 HydrophobicContact CE2-CB 4.09Å; F540-V566 HydrophobicContact CE2-CG1 3.58Å; F540-V566 HydrophobicContact CZ-CB 3.89Å; F540-V566 HydrophobicContact CZ-CG1 3.77Å; F540-V566 HydrophobicContact CZ-CG2 4.44Å; F540-I567 HydrophobicContact CE2-CG1 4.46Å
541	K	97.9	Very high	97.6	Very high	63 Å²	63	30.8 Å²	30.8	27%	0.274	15%	0.154	S	C	.	.	H	α-helix	trans	-74.2	-37.3	174.4	173.6	62.3	-161.8	174	0	111.8	I364 V367 A537 V538 L543 Q544	I364-K541 HydrophobicContact CD1-CB 4.11Å; I364-K541 HydrophobicContact CD1-CG 4.33Å; V367-K541 HydrophobicContact CG2-CG 4.4Å; A537-K541 WeakPolarHBondContact O-CB 3.3Å; A537-K541 PolarHBondContact O-N 3.2Å; V538-K541 CarbonylContact O-C 3.55Å; V538-K541 WeakPolarHBondContact O-CA 3.46Å; V538-K541 WeakPolarHBondContact O-CB 3.22Å; V538-K541 PolarHBondContact O-N 3.09Å; K541-L543 PolarHBondContact O-N 2.63Å; K541-Q544 VanDerWaalsContact O-CB 3.3Å; K541-Q544 WeakPolarHBondContact O-CB 3.45Å; K541-Q544 PolarHBondContact O-N 2.94Å
542	L	97.8	Very high	97.5	Very high	1 Å²	1	34.5 Å²	34.5	1%	0.005	17%	0.171	C	C	.	.	H	α-helix	trans	-61.8	-29.2	-179.8	-63.8	-176	0	0	0	112.9	V367 Y447 T450 L451 H454 V538 Q544 E545 C548	V367-L542 HydrophobicContact CG1-CD2 3.87Å; Y447-L542 HydrophobicContact CD2-CB 4.45Å; Y447-L542 HydrophobicContact CE2-CB 3.81Å; T450-L542 HydrophobicContact CG2-CD1 4.45Å; T450-L542 HydrophobicContact CG2-CD2 4.13Å; L451-L542 HydrophobicContact CB-CD1 4.34Å; L451-L542 HydrophobicContact CD1-CD1 4.29Å; H454-L542 HydrophobicContact CB-CD1 4.27Å; V538-L542 HydrophobicContact CG1-CD1 4.29Å; V538-L542 HydrophobicContact CG1-CG 4.25Å; V538-L542 WeakPolarHBondContact O-CG 3.41Å; V538-L542 PolarHBondContact O-N 3.37Å; L542-Q544 PolarHBondContact O-N 2.79Å; L542-E545 PolarHBondContact O-N 3.48Å; L542-C548 WeakPolarHBondContact O-CB 3.47Å
543	L	97.6	Very high	97.5	Very high	14 Å²	14	38 Å²	38	7%	0.073	19%	0.19	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57.5	-14.6	171.6	-62.4	168.7	0	0	0	113.9	Y447 F497 F540 K541 C548 D549 I550 F551	Y447-L543 HydrophobicContact CD2-CD2 3.81Å; Y447-L543 HydrophobicContact CD2-CG 4.45Å; Y447-L543 HydrophobicContact CE2-CD2 3.51Å; Y447-L543 HydrophobicContact CE2-CG 3.82Å; F497-L543 HydrophobicContact CZ-CD1 4.44Å; F540-L543 HydrophobicContact CD1-CD1 3.7Å; F540-L543 HydrophobicContact CE1-CD1 4.33Å; K541-L543 PolarHBondContact O-N 2.63Å; L543-C548 WeakPolarHBondContact CD2-O 3.45Å; L543-D549 WeakPolarHBondContact O-CB 3.4Å; L543-D549 PolarHBondContact O-N 3.18Å; L543-I550 HydrophobicContact CD2-CD1 4.5Å; L543-I550 HydrophobicContact CD2-CG1 3.68Å; L543-F551 HydrophobicContact CD1-CD2 3.74Å; L543-F551 HydrophobicContact CD1-CE2 3.89Å; L543-F551 HydrophobicContact CD2-CD2 4.05Å; L543-F551 HydrophobicContact CD2-CE2 4.1Å
544	Q	96.8	Very high	97.5	Very high	131 Å²	131	36.2 Å²	36.2	61%	0.612	18%	0.18	S	C	*	.	T	Hydrogen-bonded Turn	trans	-94.6	-2.8	-179.6	-53.9	177.5	10	0	0	113.6	K541 L542	K541-Q544 VanDerWaalsContact O-CB 3.3Å; K541-Q544 WeakPolarHBondContact O-CB 3.45Å; K541-Q544 PolarHBondContact O-N 2.94Å; L542-Q544 PolarHBondContact O-N 2.79Å
545	E	94.2	Very high	97.4	Very high	54 Å²	54	39.9 Å²	39.9	25%	0.252	20%	0.203	S	C	.	.	S	Bend	trans	-77.9	172.1	172.4	-75.2	-60.1	153.1	0	0	112.3	K369 L542 N547 C548	K369-E545 WeakPolarHBondContact CE-OE2 2.88Å; K369-E545 IonicContact NZ-OE2 2.62Å; K369-E545 PolarHBondContact NZ-OE2 3.45Å; L542-E545 PolarHBondContact O-N 3.48Å; E545-N547 PolarHBondContact O-N 3.22Å; E545-C548 HydrophobicContact CB-CB 4.15Å; E545-C548 PolarHBondContact O-N 3.02Å
546	E	94.2	Very high	97.3	Very high	120 Å²	120	45.5 Å²	45.5	56%	0.561	23%	0.228	S	C	*	.	T	Hydrogen-bonded Turn	trans	-66.4	121.3	-174.5	-172.4	162.8	-117.7	0	0	111.8	S373 C548	S373-E546 WeakPolarHBondContact CB-OE2 3.3Å; S373-E546 PolarHBondContact OG-OE2 2.7Å; E546-C548 VanDerWaalsContact C-N 3.31Å; E546-C548 PolarHBondContact O-N 3.5Å
547	N	95.8	Very high	97.3	Very high	67 Å²	67	53.2 Å²	53.2	36%	0.358	26%	0.261	S	S	.	.	T	Hydrogen-bonded Turn	trans	58.3	31.7	-173	-156.4	25.1	0	0	0	115.3	D442 T443 T446 E545	D442-N547 PolarHBondContact OD2-ND2 3.08Å; T443-N547 WeakPolarHBondContact CA-O 3.44Å; T443-N547 VanDerWaalsContact CG2-O 3.28Å; T443-N547 WeakPolarHBondContact CG2-O 3.34Å; T443-N547 PolarHBondContact OG1-OD1 3.11Å; T446-N547 HydrophobicContact CG2-CB 4.38Å; E545-N547 PolarHBondContact O-N 3.22Å
548	C	97.3	Very high	97.2	Very high	1 Å²	1	54.7 Å²	54.7	1%	0.007	26%	0.263	C	S	.	.			trans	-107.5	-9	-177.3	-71.8	0	0	0	0	116	Y447 L542 L543 E545 E546 I550	Y447-C548 HydrophobicContact CD2-CB 4.13Å; Y447-C548 VanDerWaalsContact CD2-O 3.31Å; Y447-C548 WeakPolarHBondContact CD2-O 3.32Å; L542-C548 WeakPolarHBondContact O-CB 3.47Å; L543-C548 WeakPolarHBondContact CD2-O 3.45Å; E545-C548 HydrophobicContact CB-CB 4.15Å; E545-C548 PolarHBondContact O-N 3.02Å; E546-C548 VanDerWaalsContact C-N 3.31Å; E546-C548 PolarHBondContact O-N 3.5Å; C548-I550 PolarHBondContact O-N 3.06Å
549	D	97.8	Very high	97.2	Very high	39 Å²	39	58.4 Å²	58.4	21%	0.209	28%	0.276	C	S	.	.			trans	-79.5	81.4	-178.9	-168.8	7.2	0	0	0	111.9	L543 F551 Q552 R559	L543-D549 WeakPolarHBondContact O-CB 3.4Å; L543-D549 PolarHBondContact O-N 3.18Å; D549-F551 PolarHBondContact O-N 3.44Å; D549-F551 VanDerWaalsContact O-N 3.09Å; D549-F551 WeakPolarHBondContact OD1-CA 3.29Å; D549-F551 PolarHBondContact OD1-N 3.35Å; D549-F551 VanDerWaalsContact OD1-N 3.08Å; D549-Q552 HydrophobicContact CB-CB 4.16Å; D549-Q552 VanDerWaalsContact O-CB 3.29Å; D549-Q552 WeakPolarHBondContact O-CB 3.42Å; D549-Q552 VanDerWaalsContact O-CG 3.28Å; D549-Q552 WeakPolarHBondContact O-CG 3.37Å; D549-Q552 PolarHBondContact O-N 3.16Å; D549-Q552 VanDerWaalsContact O-N 3.09Å; D549-Q552 PolarHBondContact O-NE2 3.23Å; D549-Q552 PolarHBondContact OD1-N 3.35Å; D549-R559 IonicContact OD1-CZ 2.69Å; D549-R559 IonicContact OD1-NH1 2.94Å; D549-R559 IonicContact OD1-NH2 3.63Å; D549-R559 PolarHBondContact OD1-NH2 2.72Å; D549-R559 IonicContact OD2-CZ 2.72Å; D549-R559 VanDerWaalsContact OD2-CZ 3.28Å; D549-R559 IonicContact OD2-NH1 3.54Å; D549-R559 PolarHBondContact OD2-NH1 3.34Å; D549-R559 IonicContact OD2-NH2 3.77Å; D549-R559 PolarHBondContact OD2-NH2 2.89Å
550	I	98.1	Very high	97.2	Very high	3 Å²	3	60.5 Å²	60.5	2%	0.015	29%	0.286	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60.7	-14.2	173.1	57.2	165.1	0	0	0	113.2	I439 T443 L444 Y447 F497 L543 C548	I439-I550 HydrophobicContact CG2-CB 3.83Å; I439-I550 HydrophobicContact CG2-CG2 3.91Å; T443-I550 HydrophobicContact CG2-CG2 3.96Å; L444-I550 HydrophobicContact CB-CG2 4.42Å; L444-I550 HydrophobicContact CD1-CG2 4.13Å; Y447-I550 HydrophobicContact CD1-CD1 4.03Å; Y447-I550 HydrophobicContact CD1-CG1 4.48Å; Y447-I550 HydrophobicContact CD1-CG2 4.5Å; Y447-I550 HydrophobicContact CE1-CD1 4.25Å; Y447-I550 HydrophobicContact CG-CG2 4.23Å; F497-I550 HydrophobicContact CD2-CD1 3.99Å; F497-I550 HydrophobicContact CE2-CD1 3.91Å; L543-I550 HydrophobicContact CD2-CD1 4.5Å; L543-I550 HydrophobicContact CD2-CG1 3.68Å; C548-I550 PolarHBondContact O-N 3.06Å
551	F	98.1	Very high	97.1	Very high	5 Å²	5	61.7 Å²	61.7	2%	0.022	30%	0.298	C	S	.	.	T	Hydrogen-bonded Turn	trans	-102.3	10.9	178.2	-53.5	-40	0	0	0	113.4	L493 F497 L543 D549 N553 L554 R559 L562	L493-F551 HydrophobicContact CD1-CE1 4.34Å; L493-F551 HydrophobicContact CD2-CD1 4.34Å; L493-F551 HydrophobicContact CD2-CE1 3.94Å; L493-F551 HydrophobicContact CG-CE1 4.29Å; F497-F551 HydrophobicContact CB-CZ 4.44Å; F497-F551 HydrophobicContact CD1-CE2 4.26Å; F497-F551 HydrophobicContact CD1-CZ 4.03Å; F497-F551 HydrophobicContact CD2-CE2 4.17Å; F497-F551 AromaticContact CD2-CZ 3.54Å; F497-F551 HydrophobicContact CD2-CZ 3.54Å; F497-F551 AromaticContact CE1-CE2 3.91Å; F497-F551 HydrophobicContact CE1-CE2 3.91Å; F497-F551 HydrophobicContact CE1-CZ 4.11Å; F497-F551 AromaticContact CE2-CE2 3.8Å; F497-F551 HydrophobicContact CE2-CE2 3.8Å; F497-F551 AromaticContact CE2-CZ 3.62Å; F497-F551 HydrophobicContact CE2-CZ 3.62Å; F497-F551 HydrophobicContact CG-CE2 4.37Å; F497-F551 AromaticContact CG-CZ 3.73Å; F497-F551 HydrophobicContact CG-CZ 3.73Å; F497-F551 AromaticContact CZ-CE2 3.66Å; F497-F551 HydrophobicContact CZ-CE2 3.66Å; F497-F551 AromaticContact CZ-CZ 3.92Å; F497-F551 HydrophobicContact CZ-CZ 3.92Å; L543-F551 HydrophobicContact CD1-CD2 3.74Å; L543-F551 HydrophobicContact CD1-CE2 3.89Å; L543-F551 HydrophobicContact CD2-CD2 4.05Å; L543-F551 HydrophobicContact CD2-CE2 4.1Å; D549-F551 PolarHBondContact O-N 3.44Å; D549-F551 VanDerWaalsContact O-N 3.09Å; D549-F551 WeakPolarHBondContact OD1-CA 3.29Å; D549-F551 PolarHBondContact OD1-N 3.35Å; D549-F551 VanDerWaalsContact OD1-N 3.08Å; F551-N553 PolarHBondContact O-N 3.43Å; F551-L554 HydrophobicContact CB-CD1 3.93Å; F551-L554 HydrophobicContact CB-CG 4.27Å; F551-L554 HydrophobicContact CD1-CD1 3.84Å; F551-L554 HydrophobicContact CG-CD1 4.11Å; F551-L554 WeakPolarHBondContact O-CB 3.48Å; F551-L554 PolarHBondContact O-N 2.86Å; F551-L554 VanDerWaalsContact O-N 3.15Å; F551-R559 WeakPolarHBondContact O-CD 3.4Å; F551-R559 PolarHBondContact O-NH1 3.47Å; F551-R559 VanDerWaalsContact O-NH1 3.08Å; F551-L562 HydrophobicContact CD1-CD2 3.66Å; F551-L562 HydrophobicContact CD2-CD2 3.85Å; F551-L562 HydrophobicContact CE1-CD2 3.62Å; F551-L562 HydrophobicContact CE2-CD2 3.79Å; F551-L562 HydrophobicContact CG-CD2 3.79Å; F551-L562 HydrophobicContact CZ-CD2 3.68Å
552	Q	96.7	Very high	97.1	Very high	88 Å²	88	58.8 Å²	58.8	41%	0.411	29%	0.285	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.4	-34.2	-178.7	66.8	-171.3	-86.6	0	0	113.9	D549	D549-Q552 HydrophobicContact CB-CB 4.16Å; D549-Q552 VanDerWaalsContact O-CB 3.29Å; D549-Q552 WeakPolarHBondContact O-CB 3.42Å; D549-Q552 VanDerWaalsContact O-CG 3.28Å; D549-Q552 WeakPolarHBondContact O-CG 3.37Å; D549-Q552 PolarHBondContact O-N 3.16Å; D549-Q552 VanDerWaalsContact O-N 3.09Å; D549-Q552 PolarHBondContact O-NE2 3.23Å; D549-Q552 PolarHBondContact OD1-N 3.35Å
553	N	97.6	Very high	97.2	Very high	90 Å²	90	62.4 Å²	62.4	48%	0.481	30%	0.299	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.1	0.8	-176.6	-72.1	-43	0	0	0	114.3	K438 F551	K438-N553 HydrophobicContact CB-CB 4.14Å; K438-N553 PolarHBondContact O-ND2 3.46Å; F551-N553 PolarHBondContact O-N 3.43Å
554	L	97.8	Very high	97.2	Very high	14 Å²	14	65.1 Å²	65.1	7%	0.073	31%	0.31	C	S	.	.	S	Bend	trans	-79.5	142.9	173.5	-62.2	-171.5	0	0	0	111.6	F437 L490 L493 F551 Q558 R559 L562	F437-L554 HydrophobicContact CB-CD2 3.98Å; F437-L554 HydrophobicContact CD1-CD2 3.29Å; F437-L554 HydrophobicContact CE1-CD2 4.04Å; F437-L554 HydrophobicContact CG-CD2 3.92Å; L490-L554 HydrophobicContact CD1-CD1 4.34Å; L493-L554 HydrophobicContact CD2-CD1 4.41Å; F551-L554 HydrophobicContact CB-CD1 3.93Å; F551-L554 HydrophobicContact CB-CG 4.27Å; F551-L554 HydrophobicContact CD1-CD1 3.84Å; F551-L554 HydrophobicContact CG-CD1 4.11Å; F551-L554 WeakPolarHBondContact O-CB 3.48Å; F551-L554 PolarHBondContact O-N 2.86Å; F551-L554 VanDerWaalsContact O-N 3.15Å; L554-Q558 HydrophobicContact CB-CB 4.08Å; L554-R559 HydrophobicContact CB-CG 3.54Å; L554-R559 HydrophobicContact CD1-CG 4.35Å; L554-L562 HydrophobicContact CD1-CD2 3.67Å
555	T	97.9	Very high	97.3	Very high	81 Å²	81	59 Å²	59	50%	0.497	28%	0.282	S	S	.	.			trans	-64.4	156.7	172.9	63.3	0	0	0	0	111.9	K557 Q558 R559	T555-K557 PolarHBondContact O-N 3.21Å; T555-K557 VanDerWaalsContact O-N 3.17Å; T555-Q558 PolarHBondContact O-N 2.6Å; T555-Q558 WeakPolarHBondContact OG1-CG 3.33Å; T555-Q558 PolarHBondContact OG1-N 3.26Å; T555-Q558 PolarHBondContact OG1-OE1 2.9Å; T555-R559 PolarHBondContact O-N 2.97Å
556	K	96.9	Very high	97.5	Very high	121 Å²	121	56.5 Å²	56.5	53%	0.526	27%	0.27	S	S	.	.	H	α-helix	trans	-50.6	-43.7	177.3	-171.2	-171.3	173.2	-174.3	0	111.9	E345 R559 Q560	E345-K556 IonicContact OE1-NZ 3.57Å; E345-K556 PolarHBondContact OE1-NZ 3.19Å; K556-R559 PolarHBondContact O-N 3.22Å; K556-Q560 WeakPolarHBondContact O-CG 3.35Å; K556-Q560 PolarHBondContact O-N 3.14Å
557	K	96.7	Very high	97.7	Very high	171 Å²	171	52.8 Å²	52.8	74%	0.743	25%	0.253	S	S	*	.	H	α-helix	trans	-63.1	-45.1	177.5	-171.1	-179.3	179.3	-174.5	0	112.1	T555 Q560 S561	T555-K557 PolarHBondContact O-N 3.21Å; T555-K557 VanDerWaalsContact O-N 3.17Å; K557-Q560 PolarHBondContact O-N 2.9Å; K557-S561 WeakPolarHBondContact O-CB 3.18Å; K557-S561 PolarHBondContact O-N 3.31Å
558	Q	98	Very high	97.8	Very high	62 Å²	62	51.2 Å²	51.2	29%	0.29	25%	0.245	S	C	.	.	H	α-helix	trans	-61.7	-44.9	175.1	-74.7	165.2	-60.8	0	0	111.5	L490 L554 T555 Q560 S561 L562	L490-Q558 HydrophobicContact CD1-CB 4.16Å; L490-Q558 HydrophobicContact CD1-CG 4.39Å; L490-Q558 HydrophobicContact CD2-CB 4.17Å; L490-Q558 HydrophobicContact CD2-CG 4.08Å; L554-Q558 HydrophobicContact CB-CB 4.08Å; T555-Q558 PolarHBondContact O-N 2.6Å; T555-Q558 WeakPolarHBondContact OG1-CG 3.33Å; T555-Q558 PolarHBondContact OG1-N 3.26Å; T555-Q558 PolarHBondContact OG1-OE1 2.9Å; Q558-Q560 VanDerWaalsContact C-N 3.35Å; Q558-Q560 PolarHBondContact O-N 2.7Å; Q558-S561 PolarHBondContact O-N 3.5Å; Q558-L562 WeakPolarHBondContact O-CB 3.39Å; Q558-L562 PolarHBondContact O-N 3.23Å
559	R	98.1	Very high	97.9	Very high	77 Å²	77	51.2 Å²	51.2	29%	0.291	25%	0.245	S	C	.	.	H	α-helix	trans	-63.1	-37.6	177.7	-64.8	-172.3	74.8	147.4	4.2	112.8	D549 F551 L554 T555 K556 R563	D549-R559 IonicContact OD1-CZ 2.69Å; D549-R559 IonicContact OD1-NH1 2.94Å; D549-R559 IonicContact OD1-NH2 3.63Å; D549-R559 PolarHBondContact OD1-NH2 2.72Å; D549-R559 IonicContact OD2-CZ 2.72Å; D549-R559 VanDerWaalsContact OD2-CZ 3.28Å; D549-R559 IonicContact OD2-NH1 3.54Å; D549-R559 PolarHBondContact OD2-NH1 3.34Å; D549-R559 IonicContact OD2-NH2 3.77Å; D549-R559 PolarHBondContact OD2-NH2 2.89Å; F551-R559 WeakPolarHBondContact O-CD 3.4Å; F551-R559 PolarHBondContact O-NH1 3.47Å; F551-R559 VanDerWaalsContact O-NH1 3.08Å; L554-R559 HydrophobicContact CB-CG 3.54Å; L554-R559 HydrophobicContact CD1-CG 4.35Å; T555-R559 PolarHBondContact O-N 2.97Å; K556-R559 PolarHBondContact O-N 3.22Å; R559-R563 WeakPolarHBondContact O-CB 3.21Å; R559-R563 PolarHBondContact O-N 2.82Å
560	Q	96.8	Very high	97.9	Very high	44 Å²	44	49.4 Å²	49.4	21%	0.206	24%	0.235	C	C	.	.	H	α-helix	trans	-68.5	-44.9	174.7	-73.7	177	-73	0	0	111.8	V344 K556 K557 Q558 R563 K564	V344-Q560 PolarHBondContact O-NE2 3.21Å; K556-Q560 WeakPolarHBondContact O-CG 3.35Å; K556-Q560 PolarHBondContact O-N 3.14Å; K557-Q560 PolarHBondContact O-N 2.9Å; Q558-Q560 VanDerWaalsContact C-N 3.35Å; Q558-Q560 PolarHBondContact O-N 2.7Å; Q560-R563 PolarHBondContact O-N 3.39Å; Q560-K564 PolarHBondContact O-N 2.98Å
561	S	97.4	Very high	97.9	Very high	49 Å²	49	51.5 Å²	51.5	34%	0.343	25%	0.246	S	C	.	.	H	α-helix	trans	-63.3	-49.1	177.6	-156.4	0	0	0	0	111.7	K557 Q558 R563 K564 M565	K557-S561 WeakPolarHBondContact O-CB 3.18Å; K557-S561 PolarHBondContact O-N 3.31Å; Q558-S561 PolarHBondContact O-N 3.5Å; S561-R563 PolarHBondContact O-N 3.24Å; S561-K564 PolarHBondContact O-N 3.34Å; S561-M565 WeakPolarHBondContact O-CG 3.4Å; S561-M565 PolarHBondContact O-N 2.85Å
562	L	98.5	Very high	97.9	Very high	2 Å²	2	51.4 Å²	51.4	1%	0.01	25%	0.246	C	C	.	.	H	α-helix	trans	-56.6	-50.2	175.3	180	70.9	0	0	0	110.9	L490 L493 A494 F551 L554 Q558 K564 M565 V566	L490-L562 HydrophobicContact CD1-CB 4.3Å; L490-L562 HydrophobicContact CD1-CD1 4.45Å; L493-L562 HydrophobicContact CB-CD1 4.49Å; L493-L562 HydrophobicContact CD2-CD1 4.17Å; L493-L562 HydrophobicContact CD2-CD2 4.24Å; L493-L562 HydrophobicContact CG-CD1 4.14Å; A494-L562 HydrophobicContact CB-CD1 3.76Å; F551-L562 HydrophobicContact CD1-CD2 3.66Å; F551-L562 HydrophobicContact CD2-CD2 3.85Å; F551-L562 HydrophobicContact CE1-CD2 3.62Å; F551-L562 HydrophobicContact CE2-CD2 3.79Å; F551-L562 HydrophobicContact CG-CD2 3.79Å; F551-L562 HydrophobicContact CZ-CD2 3.68Å; L554-L562 HydrophobicContact CD1-CD2 3.67Å; Q558-L562 WeakPolarHBondContact O-CB 3.39Å; Q558-L562 PolarHBondContact O-N 3.23Å; L562-K564 VanDerWaalsContact C-N 3.32Å; L562-K564 PolarHBondContact O-N 2.93Å; L562-M565 PolarHBondContact O-N 3.38Å; L562-V566 HydrophobicContact CD1-CG2 4.22Å; L562-V566 HydrophobicContact CG-CG2 4.4Å; L562-V566 WeakPolarHBondContact O-CB 3.36Å; L562-V566 VanDerWaalsContact O-CG2 3.26Å; L562-V566 WeakPolarHBondContact O-CG2 3.4Å; L562-V566 PolarHBondContact O-N 2.94Å
563	R	98.6	Very high	98	Very high	78 Å²	78	47.7 Å²	47.7	29%	0.294	23%	0.23	S	C	.	.	H	α-helix	trans	-60.1	-40.7	178.8	179.1	172.3	177.6	73.7	2.5	112.1	F540 R559 Q560 S561 I567	F540-R563 HydrophobicContact CE1-CB 4.2Å; F540-R563 HydrophobicContact CE1-CG 4.13Å; F540-R563 HydrophobicContact CE2-CG 4.44Å; F540-R563 HydrophobicContact CZ-CB 4.15Å; F540-R563 HydrophobicContact CZ-CG 3.96Å; R559-R563 WeakPolarHBondContact O-CB 3.21Å; R559-R563 PolarHBondContact O-N 2.82Å; Q560-R563 PolarHBondContact O-N 3.39Å; S561-R563 PolarHBondContact O-N 3.24Å; R563-I567 HydrophobicContact CG-CD1 3.69Å; R563-I567 HydrophobicContact CG-CG1 4.39Å; R563-I567 WeakPolarHBondContact O-CB 3.5Å; R563-I567 WeakPolarHBondContact O-CD1 3.16Å; R563-I567 WeakPolarHBondContact O-CG1 3.26Å; R563-I567 PolarHBondContact O-N 3.18Å; R563-I567 VanDerWaalsContact O-N 3.08Å
564	K	97.8	Very high	98	Very high	70 Å²	70	43.9 Å²	43.9	30%	0.304	21%	0.209	S	C	.	.	H	α-helix	trans	-63.2	-52.3	176.2	176	164	166.1	44.8	0	110.9	Q560 S561 L562 V566 I567 D568	Q560-K564 PolarHBondContact O-N 2.98Å; S561-K564 PolarHBondContact O-N 3.34Å; L562-K564 VanDerWaalsContact C-N 3.32Å; L562-K564 PolarHBondContact O-N 2.93Å; K564-V566 PolarHBondContact O-N 3.24Å; K564-I567 PolarHBondContact O-N 3.43Å; K564-I567 VanDerWaalsContact O-N 3.12Å; K564-D568 WeakPolarHBondContact CE-OD2 3.21Å; K564-D568 VanDerWaalsContact CG-OD2 3.22Å; K564-D568 WeakPolarHBondContact CG-OD2 3.31Å; K564-D568 IonicContact NZ-OD1 3.52Å; K564-D568 PolarHBondContact NZ-OD1 2.75Å; K564-D568 IonicContact NZ-OD2 3.35Å; K564-D568 PolarHBondContact NZ-OD2 3.28Å; K564-D568 PolarHBondContact O-N 2.91Å
565	M	98.6	Very high	97.8	Very high	4 Å²	4	47.2 Å²	47.2	2%	0.02	23%	0.226	C	C	.	.	H	α-helix	trans	-57.7	-45.3	-179.4	-66.4	-179.3	-55.3	0	0	112.3	L490 E491 A494 S561 L562 I567 D568 I569 Y605 I609	L490-M565 HydrophobicContact CD2-CE 4.27Å; L490-M565 HydrophobicContact CG-CE 4.09Å; E491-M565 HydrophobicContact CG-CE 4.05Å; E491-M565 HydrophobicContact CG-SD 3.52Å; E491-M565 VanDerWaalsContact CG-SD 3.52Å; A494-M565 HydrophobicContact CB-CB 3.8Å; A494-M565 HydrophobicContact CB-CE 3.94Å; S561-M565 WeakPolarHBondContact O-CG 3.4Å; S561-M565 PolarHBondContact O-N 2.85Å; L562-M565 PolarHBondContact O-N 3.38Å; M565-I567 PolarHBondContact O-N 2.94Å; M565-D568 PolarHBondContact O-N 3.47Å; M565-I569 WeakPolarHBondContact O-CB 3.2Å; M565-I569 WeakPolarHBondContact O-CD1 3.29Å; M565-I569 WeakPolarHBondContact O-CG1 3.47Å; M565-I569 PolarHBondContact O-N 2.77Å; M565-Y605 HydrophobicContact CG-CE2 3.74Å; M565-Y605 WeakPolarHBondContact CG-OH 3.41Å; M565-Y605 HydrophobicContact SD-CE2 4.02Å; M565-I609 HydrophobicContact CB-CD1 4.03Å; M565-I609 HydrophobicContact CG-CD1 4.1Å
566	V	98.8	Very high	97.5	Very high	0 Å²	0	47.7 Å²	47.7	0%	0	23%	0.232	C	C	.	.	H	α-helix	trans	-64.1	-38.9	177.6	175.1	0	0	0	0	112	A494 F497 A498 I501 L536 F540 L562 K564 I569 V570	A494-V566 HydrophobicContact CB-CG2 4.06Å; F497-V566 HydrophobicContact CD1-CB 4.49Å; F497-V566 HydrophobicContact CD1-CG1 3.85Å; F497-V566 HydrophobicContact CD1-CG2 3.8Å; F497-V566 HydrophobicContact CE1-CG1 4.07Å; A498-V566 HydrophobicContact CB-CG1 4.14Å; I501-V566 HydrophobicContact CD1-CG1 3.96Å; L536-V566 HydrophobicContact CD2-CG1 3.97Å; F540-V566 HydrophobicContact CE2-CB 4.09Å; F540-V566 HydrophobicContact CE2-CG1 3.58Å; F540-V566 HydrophobicContact CZ-CB 3.89Å; F540-V566 HydrophobicContact CZ-CG1 3.77Å; F540-V566 HydrophobicContact CZ-CG2 4.44Å; L562-V566 HydrophobicContact CD1-CG2 4.22Å; L562-V566 HydrophobicContact CG-CG2 4.4Å; L562-V566 WeakPolarHBondContact O-CB 3.36Å; L562-V566 VanDerWaalsContact O-CG2 3.26Å; L562-V566 WeakPolarHBondContact O-CG2 3.4Å; L562-V566 PolarHBondContact O-N 2.94Å; K564-V566 PolarHBondContact O-N 3.24Å; V566-I569 PolarHBondContact O-N 3.1Å; V566-V570 HydrophobicContact CG1-CG2 4.4Å; V566-V570 WeakPolarHBondContact O-CG2 3.27Å; V566-V570 PolarHBondContact O-N 2.95Å
567	I	98.6	Very high	97.3	Very high	43 Å²	43	44.4 Å²	44.4	22%	0.221	22%	0.218	C	C	.	.	H	α-helix	trans	-65	-47.1	175	-71.9	168.2	0	0	0	110.8	L536 F540 R563 K564 M565 I569 L571	L536-I567 HydrophobicContact CD1-CB 4.3Å; L536-I567 HydrophobicContact CD1-CG1 4.19Å; L536-I567 HydrophobicContact CD1-CG2 4.22Å; L536-I567 HydrophobicContact CD2-CG1 3.97Å; F540-I567 HydrophobicContact CE2-CG1 4.46Å; R563-I567 HydrophobicContact CG-CD1 3.69Å; R563-I567 HydrophobicContact CG-CG1 4.39Å; R563-I567 WeakPolarHBondContact O-CB 3.5Å; R563-I567 WeakPolarHBondContact O-CD1 3.16Å; R563-I567 WeakPolarHBondContact O-CG1 3.26Å; R563-I567 PolarHBondContact O-N 3.18Å; R563-I567 VanDerWaalsContact O-N 3.08Å; K564-I567 PolarHBondContact O-N 3.43Å; K564-I567 VanDerWaalsContact O-N 3.12Å; M565-I567 PolarHBondContact O-N 2.94Å; I567-I569 VanDerWaalsContact C-N 3.26Å; I567-I569 PolarHBondContact O-N 2.82Å; I567-L571 HydrophobicContact CG2-CD1 3.74Å; I567-L571 HydrophobicContact CG2-CG 4.3Å; I567-L571 VanDerWaalsContact O-CB 3.27Å; I567-L571 WeakPolarHBondContact O-CB 3.49Å; I567-L571 VanDerWaalsContact O-CG 3.29Å; I567-L571 WeakPolarHBondContact O-CG 3.43Å; I567-L571 PolarHBondContact O-N 2.66Å
568	D	98.1	Very high	97.2	Very high	34 Å²	34	36.5 Å²	36.5	18%	0.182	18%	0.183	C	C	.	.	H	α-helix	trans	-63	-35	-180	-58	-35.4	0	0	0	111.4	K564 M565 Y605 I609 Q613	K564-D568 WeakPolarHBondContact CE-OD2 3.21Å; K564-D568 VanDerWaalsContact CG-OD2 3.22Å; K564-D568 WeakPolarHBondContact CG-OD2 3.31Å; K564-D568 IonicContact NZ-OD1 3.52Å; K564-D568 PolarHBondContact NZ-OD1 2.75Å; K564-D568 IonicContact NZ-OD2 3.35Å; K564-D568 PolarHBondContact NZ-OD2 3.28Å; K564-D568 PolarHBondContact O-N 2.91Å; M565-D568 PolarHBondContact O-N 3.47Å; D568-Y605 PolarHBondContact OD2-OH 3.14Å; D568-I609 HydrophobicContact CB-CD1 4.17Å; D568-I609 HydrophobicContact CB-CG1 3.8Å; D568-Q613 PolarHBondContact O-NE2 3.28Å
569	I	98.7	Very high	96.8	Very high	1 Å²	1	38.8 Å²	38.8	1%	0.005	20%	0.195	C	C	.	.	H	α-helix	trans	-74.2	-52.5	178.4	-67.4	164.4	0	0	0	112.2	A495 A498 M565 V566 I567 L571 A572 I609 L612 Q613 V616	A495-I569 HydrophobicContact CB-CD1 4.45Å; A498-I569 HydrophobicContact CB-CB 3.98Å; A498-I569 HydrophobicContact CB-CG2 3.55Å; M565-I569 WeakPolarHBondContact O-CB 3.2Å; M565-I569 WeakPolarHBondContact O-CD1 3.29Å; M565-I569 WeakPolarHBondContact O-CG1 3.47Å; M565-I569 PolarHBondContact O-N 2.77Å; V566-I569 PolarHBondContact O-N 3.1Å; I567-I569 VanDerWaalsContact C-N 3.26Å; I567-I569 PolarHBondContact O-N 2.82Å; I569-L571 VanDerWaalsContact C-N 3.32Å; I569-L571 PolarHBondContact O-N 2.87Å; I569-A572 WeakPolarHBondContact O-CA 3.21Å; I569-A572 WeakPolarHBondContact O-CB 3.43Å; I569-A572 PolarHBondContact O-N 2.62Å; I569-I609 HydrophobicContact CD1-CD1 4.05Å; I569-I609 HydrophobicContact CG1-CD1 3.84Å; I569-L612 HydrophobicContact CD1-CB 3.95Å; I569-L612 HydrophobicContact CG1-CB 4.35Å; I569-Q613 HydrophobicContact CG1-CG 4.19Å; I569-V616 HydrophobicContact CG2-CB 3.77Å; I569-V616 HydrophobicContact CG2-CG1 3.99Å; I569-V616 HydrophobicContact CG2-CG2 3.68Å
570	V	98.8	Very high	96.5	Very high	1 Å²	1	40.2 Å²	40.2	1%	0.006	21%	0.209	C	C	.	.	H	α-helix	trans	-69.9	-30.3	-178.4	179.4	0	0	0	0	111.5	A498 I501 H502 H535 L536 V566 A572 T573	A498-V570 HydrophobicContact CB-CG2 3.84Å; I501-V570 HydrophobicContact CG1-CG2 4.27Å; H502-V570 HydrophobicContact CB-CG1 4.26Å; H502-V570 HydrophobicContact CB-CG2 4.28Å; H535-V570 HydrophobicContact CB-CG1 4.42Å; L536-V570 HydrophobicContact CD1-CB 4.02Å; L536-V570 HydrophobicContact CD1-CG1 4.27Å; L536-V570 HydrophobicContact CD2-CB 3.82Å; L536-V570 HydrophobicContact CD2-CG1 4.35Å; L536-V570 HydrophobicContact CD2-CG2 4Å; L536-V570 HydrophobicContact CG-CB 3.74Å; L536-V570 HydrophobicContact CG-CG1 3.81Å; L536-V570 HydrophobicContact CG-CG2 4.38Å; V566-V570 HydrophobicContact CG1-CG2 4.4Å; V566-V570 WeakPolarHBondContact O-CG2 3.27Å; V566-V570 PolarHBondContact O-N 2.95Å; V570-A572 PolarHBondContact O-N 3.12Å; V570-T573 PolarHBondContact O-N 2.89Å; V570-T573 PolarHBondContact O-OG1 3.31Å; V570-T573 VanDerWaalsContact O-OG1 3.07Å
571	L	98.4	Very high	96.4	Very high	46 Å²	46	38.7 Å²	38.7	24%	0.241	20%	0.202	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.8	-6	169.5	-68.1	-179.6	0	0	0	113.4	E532 L536 I567 I569 K577	E532-L571 HydrophobicContact CB-CD2 4.12Å; L536-L571 HydrophobicContact CD1-CD2 3.94Å; L536-L571 HydrophobicContact CD1-CG 3.74Å; I567-L571 HydrophobicContact CG2-CD1 3.74Å; I567-L571 HydrophobicContact CG2-CG 4.3Å; I567-L571 VanDerWaalsContact O-CB 3.27Å; I567-L571 WeakPolarHBondContact O-CB 3.49Å; I567-L571 VanDerWaalsContact O-CG 3.29Å; I567-L571 WeakPolarHBondContact O-CG 3.43Å; I567-L571 PolarHBondContact O-N 2.66Å; I569-L571 VanDerWaalsContact C-N 3.32Å; I569-L571 PolarHBondContact O-N 2.87Å; L571-K577 VanDerWaalsContact O-CD 3.24Å; L571-K577 WeakPolarHBondContact O-CD 3Å; L571-K577 WeakPolarHBondContact O-CE 3.44Å; L571-K577 PolarHBondContact O-NZ 2.92Å
572	A	98	Very high	96.2	Very high	3 Å²	3	37.1 Å²	37.1	3%	0.025	19%	0.19	C	C	.	.	T	Hydrogen-bonded Turn	trans	-90.5	-24.7	176.3	0	0	0	0	0	113.6	I569 V570 D574 L581 Q613	I569-A572 WeakPolarHBondContact O-CA 3.21Å; I569-A572 WeakPolarHBondContact O-CB 3.43Å; I569-A572 PolarHBondContact O-N 2.62Å; V570-A572 PolarHBondContact O-N 3.12Å; A572-D574 PolarHBondContact O-N 3.34Å; A572-L581 HydrophobicContact CB-CD1 3.98Å; A572-L581 HydrophobicContact CB-CD2 4.16Å; A572-L581 VanDerWaalsContact O-CD1 3.31Å; A572-L581 WeakPolarHBondContact O-CD1 3.24Å; A572-Q613 HydrophobicContact CB-CB 3.88Å; A572-Q613 HydrophobicContact CB-CG 3.84Å
573	T	98.2	Very high	95.8	Very high	11 Å²	11	39.4 Å²	39.4	7%	0.067	21%	0.209	C	C	.	.			trans	-68.8	-16.3	178.6	59.8	0	0	0	0	113.2	V570 M575 V616	V570-T573 PolarHBondContact O-N 2.89Å; V570-T573 PolarHBondContact O-OG1 3.31Å; V570-T573 VanDerWaalsContact O-OG1 3.07Å; T573-M575 PolarHBondContact O-N 2.89Å; T573-V616 HydrophobicContact CG2-CG1 4.22Å
574	D	97.4	Very high	95.4	Very high	10 Å²	10	38.9 Å²	38.9	5%	0.053	21%	0.212	C	C	.	.			trans	-51.2	106.3	168.2	178.6	-15.6	0	0	0	111	S529 E532 A572 S576 K577	S529-D574 VanDerWaalsContact CB-OD2 3.32Å; S529-D574 WeakPolarHBondContact CB-OD2 3.5Å; S529-D574 PolarHBondContact OG-OD2 2.74Å; E532-D574 HydrophobicContact CG-CB 3.84Å; E532-D574 WeakPolarHBondContact OE1-CA 3.35Å; E532-D574 WeakPolarHBondContact OE1-CB 3.44Å; A572-D574 PolarHBondContact O-N 3.34Å; D574-S576 VanDerWaalsContact CG-OG 3.23Å; D574-S576 PolarHBondContact O-N 3.26Å; D574-S576 VanDerWaalsContact OD1-CB 3.28Å; D574-S576 WeakPolarHBondContact OD1-CB 3.37Å; D574-S576 PolarHBondContact OD1-N 3.18Å; D574-S576 PolarHBondContact OD1-OG 3.19Å; D574-S576 PolarHBondContact OD2-OG 2.85Å; D574-K577 HydrophobicContact CB-CD 4.05Å; D574-K577 HydrophobicContact CB-CG 4.39Å; D574-K577 VanDerWaalsContact CB-NZ 3.26Å; D574-K577 WeakPolarHBondContact O-CB 3.43Å; D574-K577 PolarHBondContact O-N 2.59Å; D574-K577 VanDerWaalsContact OD2-CE 3.31Å; D574-K577 WeakPolarHBondContact OD2-CE 3.29Å; D574-K577 IonicContact OD2-NZ 3.28Å; D574-K577 PolarHBondContact OD2-NZ 2.99Å
575	M	93.1	Very high	95.2	Very high	84 Å²	84	35.5 Å²	35.5	41%	0.414	20%	0.198	S	C	.	.	G	3₁₀ helix	trans	-59.5	-19.5	-173	-74.5	-63.7	-72.8	0	0	114.3	T573 K577 H578 H617 L621 I678	T573-M575 PolarHBondContact O-N 2.89Å; M575-K577 PolarHBondContact O-N 3.34Å; M575-H578 WeakPolarHBondContact O-CB 3.37Å; M575-H578 PolarHBondContact O-N 2.75Å; M575-H617 VanDerWaalsContact SD-CE1 3.59Å; M575-L621 HydrophobicContact CE-CD1 4.12Å; M575-L621 HydrophobicContact CE-CD2 3.84Å; M575-L621 HydrophobicContact SD-CD1 3.99Å; M575-L621 HydrophobicContact SD-CD2 3.91Å; M575-L621 HydrophobicContact SD-CG 4.34Å; M575-I678 HydrophobicContact CE-CG2 3.92Å
576	S	92.5	Very high	94.9	Very high	91 Å²	91	39.1 Å²	39.1	64%	0.636	21%	0.213	S	C	*	.	G	3₁₀ helix	trans	-63.2	-19.1	171.5	71.7	0	0	0	0	113.1	D574	D574-S576 VanDerWaalsContact CG-OG 3.23Å; D574-S576 PolarHBondContact O-N 3.26Å; D574-S576 VanDerWaalsContact OD1-CB 3.28Å; D574-S576 WeakPolarHBondContact OD1-CB 3.37Å; D574-S576 PolarHBondContact OD1-N 3.18Å; D574-S576 PolarHBondContact OD1-OG 3.19Å; D574-S576 PolarHBondContact OD2-OG 2.85Å
577	K	92.2	Very high	94.5	Very high	52 Å²	52	42.9 Å²	42.9	23%	0.226	24%	0.236	C	C	.	.	G	3₁₀ helix	trans	-98.3	-8.4	-178	-58.2	173.7	-171	127.1	0	113.9	S529 L571 D574 M575 M579 N580 L581	S529-K577 PolarHBondContact OG-NZ 3.03Å; L571-K577 VanDerWaalsContact O-CD 3.24Å; L571-K577 WeakPolarHBondContact O-CD 3Å; L571-K577 WeakPolarHBondContact O-CE 3.44Å; L571-K577 PolarHBondContact O-NZ 2.92Å; D574-K577 HydrophobicContact CB-CD 4.05Å; D574-K577 HydrophobicContact CB-CG 4.39Å; D574-K577 VanDerWaalsContact CB-NZ 3.26Å; D574-K577 WeakPolarHBondContact O-CB 3.43Å; D574-K577 PolarHBondContact O-N 2.59Å; D574-K577 VanDerWaalsContact OD2-CE 3.31Å; D574-K577 WeakPolarHBondContact OD2-CE 3.29Å; D574-K577 IonicContact OD2-NZ 3.28Å; D574-K577 PolarHBondContact OD2-NZ 2.99Å; M575-K577 PolarHBondContact O-N 3.34Å; K577-M579 PolarHBondContact O-N 2.57Å; K577-M579 VanDerWaalsContact O-N 3.12Å; K577-N580 WeakPolarHBondContact O-CB 3.3Å; K577-N580 PolarHBondContact O-N 3.47Å; K577-L581 PolarHBondContact O-N 3.18Å; K577-L581 VanDerWaalsContact O-N 3.1Å
578	H	93.7	Very high	94.1	Very high	4 Å²	4	41.6 Å²	41.6	2%	0.019	23%	0.229	C	C	.	.	H	α-helix	trans	-46.3	-46.4	-178.8	171.5	104.1	0	0	0	112.5	M575 N580 L581 L582 H617 I678	M575-H578 WeakPolarHBondContact O-CB 3.37Å; M575-H578 PolarHBondContact O-N 2.75Å; H578-N580 VanDerWaalsContact C-N 3.3Å; H578-N580 PolarHBondContact O-N 2.81Å; H578-L581 PolarHBondContact O-N 3.5Å; H578-L582 WeakPolarHBondContact O-CB 3.46Å; H578-L582 PolarHBondContact O-N 2.87Å; H578-H617 AromaticContact CG-NE2 3.71Å; H578-H617 AromaticContact ND1-CD2 3.88Å; H578-H617 AromaticContact ND1-NE2 3.27Å; H578-H617 PolarHBondContact ND1-NE2 2.73Å; H578-I678 VanDerWaalsContact CE1-CG2 3.49Å; H578-I678 WeakPolarHBondContact CE1-CG2 3.41Å; H578-I678 PolarHBondContact CE1-O 2.91Å; H578-I678 VanDerWaalsContact CE1-O 3.28Å
579	M	91.4	Very high	93.9	Very high	110 Å²	110	41.3 Å²	41.3	54%	0.542	23%	0.229	S	C	.	.	H	α-helix	trans	-68.6	-25	-178	-66.5	-65.4	164.5	0	0	113.8	K577 A583 I678	K577-M579 PolarHBondContact O-N 2.57Å; K577-M579 VanDerWaalsContact O-N 3.12Å; M579-A583 WeakPolarHBondContact O-CB 3.36Å; M579-A583 PolarHBondContact O-N 3.19Å; M579-I678 HydrophobicContact CE-CD1 3.9Å
580	N	91.6	Very high	93.5	Very high	107 Å²	107	49.1 Å²	49.1	57%	0.572	27%	0.265	S	S	*	.	H	α-helix	trans	-77.6	-44.1	173.2	-58.7	-52.8	0	0	0	110.5	K577 H578 L582 A583 D584	K577-N580 WeakPolarHBondContact O-CB 3.3Å; K577-N580 PolarHBondContact O-N 3.47Å; H578-N580 VanDerWaalsContact C-N 3.3Å; H578-N580 PolarHBondContact O-N 2.81Å; N580-L582 VanDerWaalsContact C-N 3.32Å; N580-L582 PolarHBondContact O-N 3.01Å; N580-A583 PolarHBondContact O-N 2.93Å; N580-D584 PolarHBondContact O-N 3.14Å
581	L	94.2	Very high	93	Very high	12 Å²	12	53.5 Å²	53.5	6%	0.063	29%	0.292	C	S	.	.	H	α-helix	trans	-59.3	-43.3	175.9	-66.9	172.5	0	0	0	111.6	A572 K577 H578 D584 L585 Q613 N614 H617	A572-L581 HydrophobicContact CB-CD1 3.98Å; A572-L581 HydrophobicContact CB-CD2 4.16Å; A572-L581 VanDerWaalsContact O-CD1 3.31Å; A572-L581 WeakPolarHBondContact O-CD1 3.24Å; K577-L581 PolarHBondContact O-N 3.18Å; K577-L581 VanDerWaalsContact O-N 3.1Å; H578-L581 PolarHBondContact O-N 3.5Å; L581-D584 PolarHBondContact O-N 3.23Å; L581-L585 VanDerWaalsContact O-CB 3.3Å; L581-L585 WeakPolarHBondContact O-CB 3.23Å; L581-L585 PolarHBondContact O-N 3.4Å; L581-Q613 HydrophobicContact CD2-CB 4.09Å; L581-N614 PolarHBondContact O-ND2 2.98Å; L581-N614 PolarHBondContact O-OD1 2.99Å; L581-H617 HydrophobicContact CD1-CB 4.33Å
582	L	93.1	Very high	92.4	Very high	16 Å²	16	54.9 Å²	54.9	8%	0.084	30%	0.296	C	S	.	.	H	α-helix	trans	-65.2	-36.3	176.4	-175.2	58	0	0	0	112.5	H578 N580 K586 P681 L682 T685	H578-L582 WeakPolarHBondContact O-CB 3.46Å; H578-L582 PolarHBondContact O-N 2.87Å; N580-L582 VanDerWaalsContact C-N 3.32Å; N580-L582 PolarHBondContact O-N 3.01Å; L582-K586 WeakPolarHBondContact O-CB 3.46Å; L582-K586 WeakPolarHBondContact O-CG 3.27Å; L582-K586 PolarHBondContact O-N 3.03Å; L582-P681 WeakPolarHBondContact CD1-O 3.26Å; L582-P681 HydrophobicContact CD2-CB 4.14Å; L582-L682 HydrophobicContact CD1-CD1 4.33Å; L582-T685 HydrophobicContact CD1-CG2 4.37Å; L582-T685 WeakPolarHBondContact CD1-OG1 3.37Å
583	A	90.9	Very high	91.9	Very high	51 Å²	51	60.2 Å²	60.2	42%	0.421	32%	0.319	S	S	.	.	H	α-helix	trans	-69.3	-41.7	175.2	0	0	0	0	0	112.2	M579 N580 T587	M579-A583 WeakPolarHBondContact O-CB 3.36Å; M579-A583 PolarHBondContact O-N 3.19Å; N580-A583 PolarHBondContact O-N 2.93Å; A583-T587 WeakPolarHBondContact O-CB 3.31Å; A583-T587 PolarHBondContact O-N 3.03Å; A583-T587 PolarHBondContact O-OG1 3.45Å
584	D	89.7	Confident	91.4	Very high	66 Å²	66	63.2 Å²	63.2	35%	0.353	34%	0.337	S	S	.	.	H	α-helix	trans	-62.6	-43.7	172.9	-81.2	1.1	0	0	0	111	N580 L581 T587 M588 Q610	N580-D584 PolarHBondContact O-N 3.14Å; L581-D584 PolarHBondContact O-N 3.23Å; D584-T587 PolarHBondContact O-N 3.47Å; D584-M588 WeakPolarHBondContact O-CB 3.4Å; D584-M588 PolarHBondContact O-N 3.14Å; D584-Q610 PolarHBondContact OD2-NE2 3.28Å
585	L	92.9	Very high	90.9	Very high	0 Å²	0	65.2 Å²	65.2	0%	0	35%	0.35	C	S	.	.	H	α-helix	trans	-64.2	-44.5	178.2	-168.2	68.1	0	0	0	111.7	L581 M588 V589 N614 L682 T685 W686 L689	L581-L585 VanDerWaalsContact O-CB 3.3Å; L581-L585 WeakPolarHBondContact O-CB 3.23Å; L581-L585 PolarHBondContact O-N 3.4Å; L585-M588 WeakPolarHBondContact O-CB 3.49Å; L585-M588 PolarHBondContact O-N 3.48Å; L585-M588 VanDerWaalsContact O-N 3.14Å; L585-V589 WeakPolarHBondContact O-CG2 3.46Å; L585-V589 PolarHBondContact O-N 2.89Å; L585-N614 HydrophobicContact CD1-CB 3.94Å; L585-N614 HydrophobicContact CD2-CB 4.29Å; L585-L682 HydrophobicContact CD2-CD1 4.11Å; L585-T685 HydrophobicContact CB-CG2 4.15Å; L585-T685 HydrophobicContact CD2-CG2 3.74Å; L585-T685 HydrophobicContact CG-CG2 3.7Å; L585-W686 HydrophobicContact CD1-CE3 4.48Å; L585-L689 HydrophobicContact CD1-CD2 3.79Å
586	K	92.4	Very high	90.5	Very high	80 Å²	80	68 Å²	68	35%	0.348	38%	0.377	S	S	.	.	H	α-helix	trans	-61.9	-43	174.4	-75.3	-175.2	178.1	-167.9	0	111.9	L582 M588 V589 E590 T685	L582-K586 WeakPolarHBondContact O-CB 3.46Å; L582-K586 WeakPolarHBondContact O-CG 3.27Å; L582-K586 PolarHBondContact O-N 3.03Å; K586-M588 PolarHBondContact O-N 3.01Å; K586-V589 PolarHBondContact O-N 3.37Å; K586-E590 WeakPolarHBondContact O-CG 3.48Å; K586-E590 PolarHBondContact O-N 3.41Å; K586-T685 HydrophobicContact CB-CG2 4.37Å; K586-T685 WeakPolarHBondContact CE-OG1 3.29Å; K586-T685 HydrophobicContact CG-CG2 3.46Å; K586-T685 VanDerWaalsContact CG-CG2 3.46Å
587	T	90.5	Very high	90.2	Very high	79 Å²	79	68 Å²	68	49%	0.485	38%	0.378	S	S	.	.	H	α-helix	trans	-60.3	-36.8	174	-54.1	0	0	0	0	111.5	A583 D584 T591	A583-T587 WeakPolarHBondContact O-CB 3.31Å; A583-T587 PolarHBondContact O-N 3.03Å; A583-T587 PolarHBondContact O-OG1 3.45Å; D584-T587 PolarHBondContact O-N 3.47Å; T587-T591 WeakPolarHBondContact O-CB 3.44Å; T587-T591 WeakPolarHBondContact O-CG2 3.42Å; T587-T591 PolarHBondContact O-N 2.91Å; T587-T591 PolarHBondContact O-OG1 2.82Å
588	M	90.9	Very high	89.9	Confident	15 Å²	15	67.7 Å²	67.7	7%	0.074	39%	0.389	C	S	.	.	H	α-helix	trans	-70.2	-41.7	175.8	-166	179.8	-59.7	0	0	112.4	D584 L585 K586 T591 K592 L602 D607 Q610 V611 L689	D584-M588 WeakPolarHBondContact O-CB 3.4Å; D584-M588 PolarHBondContact O-N 3.14Å; L585-M588 WeakPolarHBondContact O-CB 3.49Å; L585-M588 PolarHBondContact O-N 3.48Å; L585-M588 VanDerWaalsContact O-N 3.14Å; K586-M588 PolarHBondContact O-N 3.01Å; M588-T591 CarbonylContact O-C 3.57Å; M588-T591 PolarHBondContact O-N 3.47Å; M588-T591 PolarHBondContact O-OG1 3.05Å; M588-K592 WeakPolarHBondContact O-CA 3.32Å; M588-K592 WeakPolarHBondContact O-CB 3.35Å; M588-K592 PolarHBondContact O-N 3.25Å; M588-L602 HydrophobicContact SD-CD2 4.13Å; M588-D607 HydrophobicContact CE-CB 4.29Å; M588-D607 WeakPolarHBondContact CE-O 3.49Å; M588-Q610 HydrophobicContact CE-CB 3.59Å; M588-V611 HydrophobicContact CE-CG2 3.87Å; M588-V611 HydrophobicContact SD-CG2 3.3Å; M588-V611 WeakPolarHBondContact SD-CG2 3.38Å; M588-L689 HydrophobicContact CG-CD1 4.48Å; M588-L689 HydrophobicContact SD-CD2 4.49Å
589	V	92.6	Very high	89.7	Confident	28 Å²	28	68.7 Å²	68.7	17%	0.17	40%	0.395	C	S	.	.	H	α-helix	trans	-58.3	-47.6	173.3	170.1	0	0	0	0	110.9	L585 K586 T591 K592 T685 D688 L689	L585-V589 WeakPolarHBondContact O-CG2 3.46Å; L585-V589 PolarHBondContact O-N 2.89Å; K586-V589 PolarHBondContact O-N 3.37Å; V589-T591 PolarHBondContact O-N 3.45Å; V589-K592 WeakPolarHBondContact O-CG 3.33Å; V589-K592 PolarHBondContact O-N 3.01Å; V589-T685 HydrophobicContact CG2-CG2 3.96Å; V589-D688 HydrophobicContact CG1-CB 4.01Å; V589-D688 HydrophobicContact CG2-CB 4.35Å; V589-L689 HydrophobicContact CG2-CB 3.83Å; V589-L689 HydrophobicContact CG2-CD1 4.32Å
590	E	91.3	Very high	89.6	Confident	165 Å²	165	63.7 Å²	63.7	77%	0.771	37%	0.371	S	S	*	.	H	α-helix	trans	-62	-25.8	178.1	-73	-176	-179.9	0	0	113.7	K586	K586-E590 WeakPolarHBondContact O-CG 3.48Å; K586-E590 PolarHBondContact O-N 3.41Å
591	T	88	Confident	89.5	Confident	93 Å²	93	62 Å²	62	57%	0.571	36%	0.361	S	S	*	.	H	α-helix	trans	-111	7	-177	58.5	0	0	0	0	114	T587 M588 V589 K593	T587-T591 WeakPolarHBondContact O-CB 3.44Å; T587-T591 WeakPolarHBondContact O-CG2 3.42Å; T587-T591 PolarHBondContact O-N 2.91Å; T587-T591 PolarHBondContact O-OG1 2.82Å; M588-T591 CarbonylContact O-C 3.57Å; M588-T591 PolarHBondContact O-N 3.47Å; M588-T591 PolarHBondContact O-OG1 3.05Å; V589-T591 PolarHBondContact O-N 3.45Å; T591-K593 PolarHBondContact O-N 3.29Å
592	K	86.2	Confident	89.3	Confident	75 Å²	75	62.4 Å²	62.4	33%	0.326	36%	0.363	S	S	.	.			trans	-63.3	132.8	-168.3	77.5	-175.7	-166.2	170.4	0	112.5	M588 V589 V594 L600 D688 L689	M588-K592 WeakPolarHBondContact O-CA 3.32Å; M588-K592 WeakPolarHBondContact O-CB 3.35Å; M588-K592 PolarHBondContact O-N 3.25Å; V589-K592 WeakPolarHBondContact O-CG 3.33Å; V589-K592 PolarHBondContact O-N 3.01Å; K592-V594 HydrophobicContact CG-CG2 4.32Å; K592-L600 HydrophobicContact CB-CD2 4.16Å; K592-L600 HydrophobicContact CD-CD2 4.12Å; K592-L600 HydrophobicContact CG-CD2 4.47Å; K592-D688 PolarHBondContact NZ-O 3.29Å; K592-L689 HydrophobicContact CB-CD1 4.37Å; K592-L689 HydrophobicContact CD-CD1 4.21Å; K592-L689 PolarHBondContact NZ-O 2.95Å
593	K	86.8	Confident	89	Confident	115 Å²	115	66.5 Å²	66.5	50%	0.5	39%	0.385	S	S	.	.			trans	-101.1	129.3	172.6	-60.3	173.2	-162.5	170.4	0	108.2	T591 L601 D603	T591-K593 PolarHBondContact O-N 3.29Å; K593-L601 HydrophobicContact CB-CB 4Å; K593-L601 HydrophobicContact CB-CD2 4Å; K593-L601 HydrophobicContact CD-CD2 3.66Å; K593-L601 PolarHBondContact O-N 3.11Å; K593-D603 IonicContact NZ-OD2 2.89Å; K593-D603 PolarHBondContact NZ-OD2 3.4Å
594	V	87.9	Confident	89	Confident	75 Å²	75	67.8 Å²	67.8	46%	0.455	39%	0.385	S	S	.	.	B	Isolated β-bridge	trans	-119.5	136.6	179	-170.2	0	0	0	0	108.5	K592 G598 L600	K592-V594 HydrophobicContact CG-CG2 4.32Å; V594-G598 VanDerWaalsContact CG1-O 3.31Å; V594-G598 WeakPolarHBondContact CG1-O 3.46Å; V594-L600 HydrophobicContact CG2-CD2 4.26Å
595	T	87.7	Confident	89.1	Confident	52 Å²	52	67.8 Å²	67.8	32%	0.319	38%	0.38	S	S	.	.			trans	-72.6	169.6	175.1	60.5	0	0	0	0	111.5	S597 G598 V599 L601	T595-S597 PolarHBondContact O-N 3.44Å; T595-S597 PolarHBondContact OG1-N 3.16Å; T595-S597 PolarHBondContact OG1-OG 2.75Å; T595-S597 VanDerWaalsContact OG1-OG 3.08Å; T595-G598 PolarHBondContact O-N 2.89Å; T595-G598 VanDerWaalsContact O-N 3.12Å; T595-V599 WeakPolarHBondContact CG2-O 3.37Å; T595-V599 PolarHBondContact N-O 3.41Å; T595-V599 PolarHBondContact OG1-N 3.06Å; T595-V599 VanDerWaalsContact OG1-N 3.15Å; T595-V599 PolarHBondContact OG1-O 2.74Å; T595-L601 HydrophobicContact CG2-CB 4.35Å; T595-L601 HydrophobicContact CG2-CD1 4.13Å
596	S	84.7	Confident	89.1	Confident	141 Å²	141	70.6 Å²	70.6	99%	0.986	40%	0.4	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.7	-5.7	172.8	56.2	0	0	0	0	114.6
597	S	85.7	Confident	89.1	Confident	93 Å²	93	68.7 Å²	68.7	65%	0.65	39%	0.394	S	S	*	.	T	Hydrogen-bonded Turn	trans	-105.5	7.7	174.6	59.4	0	0	0	0	113.9	T595 V599	T595-S597 PolarHBondContact O-N 3.44Å; T595-S597 PolarHBondContact OG1-N 3.16Å; T595-S597 PolarHBondContact OG1-OG 2.75Å; T595-S597 VanDerWaalsContact OG1-OG 3.08Å; S597-V599 VanDerWaalsContact C-N 3.3Å; S597-V599 PolarHBondContact O-N 3.47Å
598	G	85.9	Confident	89.4	Confident	44 Å²	44	66.9 Å²	66.9	45%	0.454	38%	0.378	S	S	.	.	S	Bend	trans	85.4	-6.7	-179	0	0	0	0	0	115.1	V594 T595	V594-G598 VanDerWaalsContact CG1-O 3.31Å; V594-G598 WeakPolarHBondContact CG1-O 3.46Å; T595-G598 PolarHBondContact O-N 2.89Å; T595-G598 VanDerWaalsContact O-N 3.12Å
599	V	89.7	Confident	89.7	Confident	25 Å²	25	66.7 Å²	66.7	15%	0.152	38%	0.377	C	S	.	.			trans	-79.3	139.4	-178.5	178.4	0	0	0	0	111.4	E484 V486 T595 S597	E484-V599 WeakPolarHBondContact O-CG1 3.31Å; V486-V599 HydrophobicContact CG2-CG1 3.38Å; T595-V599 WeakPolarHBondContact CG2-O 3.37Å; T595-V599 PolarHBondContact N-O 3.41Å; T595-V599 PolarHBondContact OG1-N 3.06Å; T595-V599 VanDerWaalsContact OG1-N 3.15Å; T595-V599 PolarHBondContact OG1-O 2.74Å; S597-V599 VanDerWaalsContact C-N 3.3Å; S597-V599 PolarHBondContact O-N 3.47Å
600	L	89.6	Confident	89.8	Confident	6 Å²	6	67.1 Å²	67.1	3%	0.031	38%	0.378	C	S	.	.	B	Isolated β-bridge	trans	-70.7	133.5	178.7	-72.3	162.3	0	0	0	112.4	A482 L483 V486 K592 V594 L689 V690	A482-L600 HydrophobicContact CB-CD1 4.24Å; A482-L600 WeakPolarHBondContact O-CB 3.34Å; A482-L600 PolarHBondContact O-N 3.46Å; L483-L600 HydrophobicContact CD2-CB 4.37Å; L483-L600 HydrophobicContact CD2-CD1 3.71Å; L483-L600 HydrophobicContact CG-CD1 4.44Å; V486-L600 VanDerWaalsContact CG2-O 3.29Å; V486-L600 WeakPolarHBondContact CG2-O 3.3Å; K592-L600 HydrophobicContact CB-CD2 4.16Å; K592-L600 HydrophobicContact CD-CD2 4.12Å; K592-L600 HydrophobicContact CG-CD2 4.47Å; V594-L600 HydrophobicContact CG2-CD2 4.26Å; L600-L689 HydrophobicContact CD1-CD1 3.97Å; L600-L689 HydrophobicContact CD1-CG 3.83Å; L600-L689 HydrophobicContact CD2-CD1 3.93Å; L600-V690 HydrophobicContact CD1-CG1 4.22Å
601	L	89.4	Confident	90.1	Very high	71 Å²	71	59.3 Å²	59.3	37%	0.372	34%	0.341	S	S	.	.			trans	-103.6	99	-177	-176.1	139.3	0	0	0	110.3	K593 T595 D603	K593-L601 HydrophobicContact CB-CB 4Å; K593-L601 HydrophobicContact CB-CD2 4Å; K593-L601 HydrophobicContact CD-CD2 3.66Å; K593-L601 PolarHBondContact O-N 3.11Å; T595-L601 HydrophobicContact CG2-CB 4.35Å; T595-L601 HydrophobicContact CG2-CD1 4.13Å; L601-D603 WeakPolarHBondContact CD2-OD1 3.47Å
602	L	90.2	Very high	90.6	Very high	20 Å²	20	54.9 Å²	54.9	11%	0.105	31%	0.314	C	S	.	.			trans	-101.9	95.5	-179.8	-53.9	-177.6	0	0	0	109.9	V486 F487 M588 N604 D607 R608 V611	V486-L602 HydrophobicContact CG1-CB 4.34Å; V486-L602 HydrophobicContact CG1-CD1 3.73Å; V486-L602 HydrophobicContact CG1-CG 4.02Å; F487-L602 HydrophobicContact CE1-CD1 4.26Å; F487-L602 HydrophobicContact CZ-CD1 4.07Å; M588-L602 HydrophobicContact SD-CD2 4.13Å; L602-N604 PolarHBondContact O-N 3.06Å; L602-D607 HydrophobicContact CB-CB 4.23Å; L602-D607 HydrophobicContact CD2-CB 4.15Å; L602-R608 HydrophobicContact CB-CG 3.61Å; L602-R608 HydrophobicContact CD1-CG 4.22Å; L602-V611 HydrophobicContact CD1-CB 4.16Å; L602-V611 HydrophobicContact CD1-CG2 3.72Å; L602-V611 HydrophobicContact CD2-CG2 4.21Å
603	D	86.5	Confident	91.2	Very high	103 Å²	103	53 Å²	53	55%	0.551	31%	0.306	S	S	*	.			trans	-69.2	-29.6	-167.6	-81.1	-49.8	0	0	0	114.1	K593 L601 D607	K593-D603 IonicContact NZ-OD2 2.89Å; K593-D603 PolarHBondContact NZ-OD2 3.4Å; L601-D603 WeakPolarHBondContact CD2-OD1 3.47Å; D603-D607 PolarHBondContact N-OD2 3.21Å
604	N	90.4	Very high	91.7	Very high	78 Å²	78	47.5 Å²	47.5	42%	0.417	28%	0.282	S	S	.	.	S	Bend	trans	-141.4	169.2	-171.1	83.3	88.9	0	0	0	113.8	L602 S606 D607 R608	L602-N604 PolarHBondContact O-N 3.06Å; N604-S606 VanDerWaalsContact C-N 3.26Å; N604-S606 PolarHBondContact O-N 2.86Å; N604-S606 WeakPolarHBondContact OD1-CB 3.42Å; N604-S606 PolarHBondContact OD1-N 2.91Å; N604-D607 PolarHBondContact N-OD2 3.12Å; N604-D607 PolarHBondContact ND2-OD1 3.19Å; N604-D607 PolarHBondContact ND2-OD2 3.21Å; N604-D607 PolarHBondContact O-N 2.86Å; N604-R608 WeakPolarHBondContact O-CD 3.43Å; N604-R608 WeakPolarHBondContact O-CG 3.34Å; N604-R608 PolarHBondContact O-N 3.22Å
605	Y	92.2	Very high	92.2	Very high	65 Å²	65	43.9 Å²	43.9	26%	0.255	26%	0.261	S	S	.	.	H	α-helix	trans	-59.7	-31.7	-175.3	179	-99	0	0	0	113.9	M565 D568 R608 I609	M565-Y605 HydrophobicContact CG-CE2 3.74Å; M565-Y605 WeakPolarHBondContact CG-OH 3.41Å; M565-Y605 HydrophobicContact SD-CE2 4.02Å; D568-Y605 PolarHBondContact OD2-OH 3.14Å; Y605-R608 PolarHBondContact O-N 2.98Å; Y605-I609 HydrophobicContact CD1-CG2 4.46Å; Y605-I609 HydrophobicContact CE1-CB 4.26Å; Y605-I609 HydrophobicContact CE1-CG2 4.08Å; Y605-I609 HydrophobicContact CE2-CB 4.48Å; Y605-I609 WeakPolarHBondContact O-CB 3.42Å; Y605-I609 WeakPolarHBondContact O-CG2 3.38Å; Y605-I609 PolarHBondContact O-N 3.08Å
606	S	91.5	Very high	92.7	Very high	59 Å²	59	41.4 Å²	41.4	41%	0.413	25%	0.245	S	C	.	.	H	α-helix	trans	-65.3	-52.6	179.7	-157.2	0	0	0	0	111.2	N604 R608 I609 Q610	N604-S606 VanDerWaalsContact C-N 3.26Å; N604-S606 PolarHBondContact O-N 2.86Å; N604-S606 WeakPolarHBondContact OD1-CB 3.42Å; N604-S606 PolarHBondContact OD1-N 2.91Å; S606-R608 VanDerWaalsContact C-N 3.25Å; S606-R608 PolarHBondContact O-N 3.36Å; S606-I609 WeakPolarHBondContact O-CG2 3.38Å; S606-I609 PolarHBondContact O-N 3Å; S606-Q610 WeakPolarHBondContact O-CB 3.42Å; S606-Q610 WeakPolarHBondContact O-CG 3.49Å; S606-Q610 PolarHBondContact O-N 2.77Å; S606-Q610 PolarHBondContact O-OE1 2.8Å
607	D	93.1	Very high	93.4	Very high	40 Å²	40	34.8 Å²	34.8	21%	0.214	20%	0.199	C	C	.	.	H	α-helix	trans	-57.9	-43.3	178.1	-29.6	-27.8	0	0	0	110.1	M588 L602 D603 N604 Q610 V611	M588-D607 HydrophobicContact CE-CB 4.29Å; M588-D607 WeakPolarHBondContact CE-O 3.49Å; L602-D607 HydrophobicContact CB-CB 4.23Å; L602-D607 HydrophobicContact CD2-CB 4.15Å; D603-D607 PolarHBondContact N-OD2 3.21Å; N604-D607 PolarHBondContact N-OD2 3.12Å; N604-D607 PolarHBondContact ND2-OD1 3.19Å; N604-D607 PolarHBondContact ND2-OD2 3.21Å; N604-D607 PolarHBondContact O-N 2.86Å; D607-Q610 PolarHBondContact O-N 3.34Å; D607-V611 WeakPolarHBondContact O-CG2 3.37Å; D607-V611 PolarHBondContact O-N 2.94Å
608	R	96.5	Very high	94	Very high	41 Å²	41	30.3 Å²	30.3	16%	0.155	17%	0.168	C	C	.	.	H	α-helix	trans	-66.9	-43.8	-177.7	-64.4	168.6	74.7	80	2	112.4	V486 F487 E491 L602 N604 Y605 S606 L612	V486-R608 PolarHBondContact O-NH1 3.29Å; V486-R608 PolarHBondContact O-NH2 2.96Å; F487-R608 HydrophobicContact CE1-CB 4.36Å; E491-R608 VanDerWaalsContact CD-NH2 3.27Å; E491-R608 IonicContact OE1-CZ 3.61Å; E491-R608 IonicContact OE1-NE 2.82Å; E491-R608 PolarHBondContact OE1-NE 2.81Å; E491-R608 IonicContact OE1-NH2 2.74Å; E491-R608 PolarHBondContact OE1-NH2 2.77Å; E491-R608 VanDerWaalsContact OE1-NH2 3.09Å; E491-R608 IonicContact OE2-CZ 2.69Å; E491-R608 IonicContact OE2-NE 3.17Å; E491-R608 IonicContact OE2-NH2 3.6Å; E491-R608 PolarHBondContact OE2-NH2 2.95Å; L602-R608 HydrophobicContact CB-CG 3.61Å; L602-R608 HydrophobicContact CD1-CG 4.22Å; N604-R608 WeakPolarHBondContact O-CD 3.43Å; N604-R608 WeakPolarHBondContact O-CG 3.34Å; N604-R608 PolarHBondContact O-N 3.22Å; Y605-R608 PolarHBondContact O-N 2.98Å; S606-R608 VanDerWaalsContact C-N 3.25Å; S606-R608 PolarHBondContact O-N 3.36Å; R608-L612 VanDerWaalsContact O-CG 3.29Å; R608-L612 WeakPolarHBondContact O-CG 3.41Å; R608-L612 PolarHBondContact O-N 3.38Å; R608-L612 VanDerWaalsContact O-N 3.16Å
609	I	97.2	Very high	94.6	Very high	12 Å²	12	28.2 Å²	28.2	6%	0.062	15%	0.146	C	C	.	.	H	α-helix	trans	-72	-35	177.7	-161.2	58.5	0	0	0	111.5	M565 D568 I569 Y605 S606 V611 L612 Q613	M565-I609 HydrophobicContact CB-CD1 4.03Å; M565-I609 HydrophobicContact CG-CD1 4.1Å; D568-I609 HydrophobicContact CB-CD1 4.17Å; D568-I609 HydrophobicContact CB-CG1 3.8Å; I569-I609 HydrophobicContact CD1-CD1 4.05Å; I569-I609 HydrophobicContact CG1-CD1 3.84Å; Y605-I609 HydrophobicContact CD1-CG2 4.46Å; Y605-I609 HydrophobicContact CE1-CB 4.26Å; Y605-I609 HydrophobicContact CE1-CG2 4.08Å; Y605-I609 HydrophobicContact CE2-CB 4.48Å; Y605-I609 WeakPolarHBondContact O-CB 3.42Å; Y605-I609 WeakPolarHBondContact O-CG2 3.38Å; Y605-I609 PolarHBondContact O-N 3.08Å; S606-I609 WeakPolarHBondContact O-CG2 3.38Å; S606-I609 PolarHBondContact O-N 3Å; I609-V611 PolarHBondContact O-N 3.42Å; I609-L612 HydrophobicContact CD1-CB 4.48Å; I609-L612 PolarHBondContact O-N 2.74Å; I609-Q613 HydrophobicContact CG1-CG 4.29Å; I609-Q613 WeakPolarHBondContact O-CB 3.46Å; I609-Q613 WeakPolarHBondContact O-CG 3.44Å; I609-Q613 PolarHBondContact O-N 2.73Å; I609-Q613 PolarHBondContact O-OE1 2.69Å
610	Q	95.4	Very high	95	Very high	37 Å²	37	28 Å²	28	17%	0.173	14%	0.144	C	C	.	.	H	α-helix	trans	-61.8	-40.4	174.2	-80.1	171.7	-36.5	0	0	112.6	D584 M588 S606 D607 N614	D584-Q610 PolarHBondContact OD2-NE2 3.28Å; M588-Q610 HydrophobicContact CE-CB 3.59Å; S606-Q610 WeakPolarHBondContact O-CB 3.42Å; S606-Q610 WeakPolarHBondContact O-CG 3.49Å; S606-Q610 PolarHBondContact O-N 2.77Å; S606-Q610 PolarHBondContact O-OE1 2.8Å; D607-Q610 PolarHBondContact O-N 3.34Å; Q610-N614 WeakPolarHBondContact O-CB 3.36Å; Q610-N614 PolarHBondContact O-N 2.8Å; Q610-N614 PolarHBondContact O-ND2 3.4Å
611	V	97.2	Very high	95.5	Very high	0 Å²	0	28.1 Å²	28.1	0%	0	14%	0.144	C	C	.	.	H	α-helix	trans	-65.9	-44.5	172.6	177.3	0	0	0	0	111.1	L483 F487 M588 L602 D607 I609 Q613 N614 M615 W686 L689	L483-V611 HydrophobicContact CD2-CG1 4.36Å; F487-V611 HydrophobicContact CE2-CG1 4.31Å; F487-V611 HydrophobicContact CZ-CB 4.07Å; F487-V611 HydrophobicContact CZ-CG1 3.76Å; M588-V611 HydrophobicContact CE-CG2 3.87Å; M588-V611 HydrophobicContact SD-CG2 3.3Å; M588-V611 WeakPolarHBondContact SD-CG2 3.38Å; L602-V611 HydrophobicContact CD1-CB 4.16Å; L602-V611 HydrophobicContact CD1-CG2 3.72Å; L602-V611 HydrophobicContact CD2-CG2 4.21Å; D607-V611 WeakPolarHBondContact O-CG2 3.37Å; D607-V611 PolarHBondContact O-N 2.94Å; I609-V611 PolarHBondContact O-N 3.42Å; V611-Q613 PolarHBondContact O-N 3.09Å; V611-N614 PolarHBondContact O-N 2.86Å; V611-M615 VanDerWaalsContact O-CB 3.23Å; V611-M615 WeakPolarHBondContact O-CB 3.36Å; V611-M615 PolarHBondContact O-N 3.11Å; V611-W686 HydrophobicContact CG1-CH2 3.99Å; V611-W686 HydrophobicContact CG1-CZ3 4.09Å; V611-L689 HydrophobicContact CG2-CD2 4.22Å
612	L	98.4	Very high	95.9	Very high	1 Å²	1	24.8 Å²	24.8	1%	0.005	13%	0.127	C	C	.	.	H	α-helix	trans	-68	-34.3	-179.1	-65.8	167	0	0	0	112.9	L478 F487 E491 A495 I569 R608 I609 V616	L478-L612 HydrophobicContact CD2-CD2 4.14Å; F487-L612 HydrophobicContact CD1-CD1 3.95Å; F487-L612 HydrophobicContact CD1-CD2 3.88Å; F487-L612 HydrophobicContact CD1-CG 4.06Å; F487-L612 HydrophobicContact CD2-CD2 4.2Å; F487-L612 HydrophobicContact CE1-CD1 3.81Å; F487-L612 HydrophobicContact CE1-CD2 3.67Å; F487-L612 HydrophobicContact CE1-CG 3.56Å; F487-L612 HydrophobicContact CE2-CD2 4Å; F487-L612 HydrophobicContact CG-CD2 4.14Å; F487-L612 HydrophobicContact CZ-CD2 3.74Å; F487-L612 HydrophobicContact CZ-CG 3.89Å; E491-L612 HydrophobicContact CB-CD1 3.93Å; E491-L612 HydrophobicContact CG-CD1 4.16Å; A495-L612 HydrophobicContact CB-CD2 4.12Å; I569-L612 HydrophobicContact CD1-CB 3.95Å; I569-L612 HydrophobicContact CG1-CB 4.35Å; R608-L612 VanDerWaalsContact O-CG 3.29Å; R608-L612 WeakPolarHBondContact O-CG 3.41Å; R608-L612 PolarHBondContact O-N 3.38Å; R608-L612 VanDerWaalsContact O-N 3.16Å; I609-L612 HydrophobicContact CD1-CB 4.48Å; I609-L612 PolarHBondContact O-N 2.74Å; L612-V616 PolarHBondContact O-N 3.03Å; L612-V616 VanDerWaalsContact O-N 3.17Å
613	Q	98.5	Very high	96.3	Very high	34 Å²	34	24.4 Å²	24.4	16%	0.159	13%	0.125	C	C	.	.	H	α-helix	trans	-62.8	-52.7	171.3	-75.6	170.9	-56.2	0	0	110.6	D568 I569 A572 L581 I609 V611 M615 V616 H617	D568-Q613 PolarHBondContact O-NE2 3.28Å; I569-Q613 HydrophobicContact CG1-CG 4.19Å; A572-Q613 HydrophobicContact CB-CB 3.88Å; A572-Q613 HydrophobicContact CB-CG 3.84Å; L581-Q613 HydrophobicContact CD2-CB 4.09Å; I609-Q613 HydrophobicContact CG1-CG 4.29Å; I609-Q613 WeakPolarHBondContact O-CB 3.46Å; I609-Q613 WeakPolarHBondContact O-CG 3.44Å; I609-Q613 PolarHBondContact O-N 2.73Å; I609-Q613 PolarHBondContact O-OE1 2.69Å; V611-Q613 PolarHBondContact O-N 3.09Å; Q613-M615 VanDerWaalsContact C-N 3.31Å; Q613-M615 PolarHBondContact O-N 3.22Å; Q613-V616 PolarHBondContact O-N 3.26Å; Q613-H617 WeakPolarHBondContact O-CB 3.22Å; Q613-H617 PolarHBondContact O-N 3.16Å
614	N	98	Very high	96.9	Very high	0 Å²	0	19.6 Å²	19.6	0%	0	10%	0.099	C	C	.	.	H	α-helix	trans	-63.9	-34.9	177.5	-81.9	-81.5	0	0	0	112.6	L581 L585 Q610 V611 H617 C618 W686	L581-N614 PolarHBondContact O-ND2 2.98Å; L581-N614 PolarHBondContact O-OD1 2.99Å; L585-N614 HydrophobicContact CD1-CB 3.94Å; L585-N614 HydrophobicContact CD2-CB 4.29Å; Q610-N614 WeakPolarHBondContact O-CB 3.36Å; Q610-N614 PolarHBondContact O-N 2.8Å; Q610-N614 PolarHBondContact O-ND2 3.4Å; V611-N614 PolarHBondContact O-N 2.86Å; N614-H617 PolarHBondContact O-N 3.02Å; N614-C618 WeakPolarHBondContact O-CB 3.24Å; N614-C618 PolarHBondContact O-N 2.91Å; N614-C618 PolarHBondContact O-SG 2.67Å; N614-W686 HydrophobicContact CB-CZ3 4.39Å
615	M	98.5	Very high	97.3	Very high	0 Å²	0	15.9 Å²	15.9	0%	0	8%	0.08	C	C	.	.	H	α-helix	trans	-62.1	-48.9	177.7	-178.1	-177.3	-76.6	0	0	111.9	T474 L477 L478 L483 F487 V611 Q613 H617 C618 A619 W686	T474-M615 HydrophobicContact CG2-SD 4.44Å; L477-M615 HydrophobicContact CB-CE 4.17Å; L477-M615 HydrophobicContact CB-CG 3.64Å; L477-M615 HydrophobicContact CB-SD 3.96Å; L477-M615 HydrophobicContact CD1-CG 3.97Å; L477-M615 HydrophobicContact CG-CG 4.47Å; L477-M615 VanDerWaalsContact O-CE 3.32Å; L477-M615 WeakPolarHBondContact O-CE 3Å; L478-M615 HydrophobicContact CB-SD 4.49Å; L478-M615 HydrophobicContact CD2-CE 4.02Å; L478-M615 HydrophobicContact CD2-SD 3.55Å; L478-M615 VanDerWaalsContact CD2-SD 3.55Å; L478-M615 HydrophobicContact CG-CE 4.4Å; L478-M615 HydrophobicContact CG-SD 3.59Å; L478-M615 VanDerWaalsContact CG-SD 3.59Å; L483-M615 HydrophobicContact CD1-CE 3.49Å; L483-M615 VanDerWaalsContact CD1-CE 3.49Å; F487-M615 HydrophobicContact CE2-CE 4.23Å; V611-M615 VanDerWaalsContact O-CB 3.23Å; V611-M615 WeakPolarHBondContact O-CB 3.36Å; V611-M615 PolarHBondContact O-N 3.11Å; Q613-M615 VanDerWaalsContact C-N 3.31Å; Q613-M615 PolarHBondContact O-N 3.22Å; M615-H617 VanDerWaalsContact C-N 3.32Å; M615-C618 PolarHBondContact O-N 3.32Å; M615-A619 WeakPolarHBondContact O-CB 3.32Å; M615-A619 PolarHBondContact O-N 2.77Å; M615-W686 HydrophobicContact CB-CH2 3.67Å; M615-W686 HydrophobicContact CB-CZ2 4.48Å; M615-W686 HydrophobicContact CB-CZ3 4Å; M615-W686 HydrophobicContact CE-CH2 3.74Å; M615-W686 HydrophobicContact CE-CZ2 4.07Å; M615-W686 HydrophobicContact CG-CH2 3.99Å; M615-W686 HydrophobicContact CG-CZ2 4.36Å
616	V	98.7	Very high	97.6	Very high	0 Å²	0	12.8 Å²	12.8	0%	0	7%	0.067	C	C	.	.	H	α-helix	trans	-69.7	-33.3	177.5	178.3	0	0	0	0	110.7	V470 T474 A495 I569 T573 L612 Q613 A619 D620	V470-V616 HydrophobicContact CG1-CG1 4.43Å; T474-V616 HydrophobicContact CG2-CG2 4.01Å; A495-V616 HydrophobicContact CB-CG2 4.27Å; I569-V616 HydrophobicContact CG2-CB 3.77Å; I569-V616 HydrophobicContact CG2-CG1 3.99Å; I569-V616 HydrophobicContact CG2-CG2 3.68Å; T573-V616 HydrophobicContact CG2-CG1 4.22Å; L612-V616 PolarHBondContact O-N 3.03Å; L612-V616 VanDerWaalsContact O-N 3.17Å; Q613-V616 PolarHBondContact O-N 3.26Å; V616-A619 WeakPolarHBondContact O-CB 3.38Å; V616-A619 PolarHBondContact O-N 3.48Å; V616-D620 WeakPolarHBondContact O-CB 3.36Å; V616-D620 PolarHBondContact O-N 3.14Å
617	H	98.4	Very high	97.9	Very high	1 Å²	1	12.7 Å²	12.7	1%	0.005	7%	0.066	C	C	.	.	H	α-helix	trans	-64.7	-36.6	172.6	-157.2	54.3	0	0	0	113.1	M575 H578 L581 Q613 N614 M615 L621	M575-H617 VanDerWaalsContact SD-CE1 3.59Å; H578-H617 AromaticContact CG-NE2 3.71Å; H578-H617 AromaticContact ND1-CD2 3.88Å; H578-H617 AromaticContact ND1-NE2 3.27Å; H578-H617 PolarHBondContact ND1-NE2 2.73Å; L581-H617 HydrophobicContact CD1-CB 4.33Å; Q613-H617 WeakPolarHBondContact O-CB 3.22Å; Q613-H617 PolarHBondContact O-N 3.16Å; N614-H617 PolarHBondContact O-N 3.02Å; M615-H617 VanDerWaalsContact C-N 3.32Å; H617-L621 VanDerWaalsContact O-CB 3.3Å; H617-L621 WeakPolarHBondContact O-CB 3.49Å; H617-L621 WeakPolarHBondContact O-CG 3.29Å; H617-L621 PolarHBondContact O-N 3.29Å
618	C	98.6	Very high	98.1	Very high	0 Å²	0	13.2 Å²	13.2	0%	0	7%	0.068	C	C	.	.	H	α-helix	trans	-69.8	-37.5	171.3	-65	0	0	0	0	111.4	L477 N614 M615 L621 S622 W683	L477-C618 HydrophobicContact CD1-CB 4.22Å; N614-C618 WeakPolarHBondContact O-CB 3.24Å; N614-C618 PolarHBondContact O-N 2.91Å; N614-C618 PolarHBondContact O-SG 2.67Å; M615-C618 PolarHBondContact O-N 3.32Å; C618-L621 CarbonylContact O-C 3.56Å; C618-L621 PolarHBondContact O-N 2.89Å; C618-S622 WeakPolarHBondContact O-CA 3.47Å; C618-S622 VanDerWaalsContact O-CB 3.3Å; C618-S622 WeakPolarHBondContact O-CB 3.28Å; C618-S622 PolarHBondContact O-N 3.05Å; C618-W683 HydrophobicContact CB-CH2 4.1Å; C618-W683 HydrophobicContact CB-CZ2 3.84Å; C618-W683 WeakPolarHBondContact O-CZ2 3.48Å
619	A	98.7	Very high	98.2	Very high	0 Å²	0	17.5 Å²	17.5	0%	0	9%	0.09	C	C	.	.	H	α-helix	trans	-66.5	-36.6	177.2	0	0	0	0	0	113.2	V470 T474 L477 M615 V616 S622	V470-A619 HydrophobicContact CG1-CB 3.94Å; T474-A619 WeakPolarHBondContact OG1-CB 3.31Å; L477-A619 HydrophobicContact CD1-CB 4.34Å; M615-A619 WeakPolarHBondContact O-CB 3.32Å; M615-A619 PolarHBondContact O-N 2.77Å; V616-A619 WeakPolarHBondContact O-CB 3.38Å; V616-A619 PolarHBondContact O-N 3.48Å; A619-S622 WeakPolarHBondContact O-CB 3.26Å; A619-S622 PolarHBondContact O-OG 3.48Å
620	D	98.7	Very high	98.3	Very high	19 Å²	19	17 Å²	17	10%	0.102	9%	0.088	C	C	.	.	H	α-helix	trans	-64.8	-57.6	169	179.1	-6.2	0	0	0	110.2	H466 V616 S622	H466-D620 IonicContact CE1-OD1 3.72Å; H466-D620 IonicContact NE2-OD1 3.87Å; V616-D620 WeakPolarHBondContact O-CB 3.36Å; V616-D620 PolarHBondContact O-N 3.14Å; D620-S622 PolarHBondContact O-N 2.9Å
621	L	98.4	Very high	98.4	Very high	9 Å²	9	15.4 Å²	15.4	5%	0.047	8%	0.08	C	C	.	.	T	Hydrogen-bonded Turn	trans	-76.4	32.5	176.6	-58.4	173.3	0	0	0	113.4	M575 H617 C618 F674 I678 L682 W683	M575-L621 HydrophobicContact CE-CD1 4.12Å; M575-L621 HydrophobicContact CE-CD2 3.84Å; M575-L621 HydrophobicContact SD-CD1 3.99Å; M575-L621 HydrophobicContact SD-CD2 3.91Å; M575-L621 HydrophobicContact SD-CG 4.34Å; H617-L621 VanDerWaalsContact O-CB 3.3Å; H617-L621 WeakPolarHBondContact O-CB 3.49Å; H617-L621 WeakPolarHBondContact O-CG 3.29Å; H617-L621 PolarHBondContact O-N 3.29Å; C618-L621 CarbonylContact O-C 3.56Å; C618-L621 PolarHBondContact O-N 2.89Å; L621-F674 HydrophobicContact CD2-CE2 4.25Å; L621-F674 HydrophobicContact CD2-CZ 3.81Å; L621-I678 HydrophobicContact CD1-CG2 4.33Å; L621-L682 HydrophobicContact CB-CD2 4.3Å; L621-L682 HydrophobicContact CD1-CD2 3.61Å; L621-W683 PolarHBondContact O-NE1 3.09Å
622	S	98.6	Very high	98.5	Very high	1 Å²	1	20.7 Å²	20.7	1%	0.007	10%	0.1	C	C	.	.	T	Hydrogen-bonded Turn	trans	-90.4	-24	-174.4	66.5	0	0	0	0	114.1	C618 A619 D620 P624 T625 K626	C618-S622 WeakPolarHBondContact O-CA 3.47Å; C618-S622 VanDerWaalsContact O-CB 3.3Å; C618-S622 WeakPolarHBondContact O-CB 3.28Å; C618-S622 PolarHBondContact O-N 3.05Å; A619-S622 WeakPolarHBondContact O-CB 3.26Å; A619-S622 PolarHBondContact O-OG 3.48Å; D620-S622 PolarHBondContact O-N 2.9Å; S622-P624 VanDerWaalsContact C-CD 3.49Å; S622-T625 WeakPolarHBondContact O-CA 3.28Å; S622-T625 WeakPolarHBondContact O-CB 3.34Å; S622-T625 PolarHBondContact O-N 3.4Å; S622-T625 PolarHBondContact O-OG1 3.08Å; S622-K626 PolarHBondContact O-N 3.38Å; S622-K626 WeakPolarHBondContact OG-CE 3.32Å; S622-K626 PolarHBondContact OG-NZ 2.8Å
623	N	98.6	Very high	98.5	Very high	13 Å²	13	23.7 Å²	23.7	7%	0.07	11%	0.114	C	C	.	.	G	3₁₀ helix	trans	-51.6	-43.8	-169.5	-49.8	-42.7	0	0	0	114.4	Y461 T625 K626 Y631 W634	Y461-N623 WeakPolarHBondContact CE2-ND2 3.22Å; Y461-N623 PolarHBondContact OH-ND2 3.34Å; N623-T625 PolarHBondContact O-N 2.92Å; N623-T625 VanDerWaalsContact O-N 3.15Å; N623-K626 WeakPolarHBondContact O-CB 3.39Å; N623-K626 PolarHBondContact O-N 2.71Å; N623-K626 VanDerWaalsContact O-N 3.11Å; N623-Y631 HydrophobicContact CB-CD2 4.16Å; N623-Y631 VanDerWaalsContact O-CB 3.29Å; N623-Y631 WeakPolarHBondContact O-CB 3.14Å; N623-Y631 WeakPolarHBondContact O-CD2 3.48Å; N623-W634 HydrophobicContact CB-CB 3.83Å; N623-W634 HydrophobicContact CB-CG 3.95Å; N623-W634 PolarHBondContact OD1-NE1 2.67Å
624	P	98.6	Very high	98.5	Very high	1 Å²	1	22.1 Å²	22.1	1%	0.006	11%	0.106	C	C	.	.	G	3₁₀ helix	trans	-68.8	-9.5	179.7	-20.9	36.7	0	0	0	114.9	S622 Y631 F674 I675 V679 L701 N704	S622-P624 VanDerWaalsContact C-CD 3.49Å; P624-Y631 HydrophobicContact CB-CD1 4.35Å; P624-Y631 HydrophobicContact CB-CD2 4.37Å; P624-Y631 HydrophobicContact CB-CE1 3.78Å; P624-Y631 HydrophobicContact CB-CE2 3.87Å; P624-Y631 HydrophobicContact CG-CD2 4.34Å; P624-Y631 HydrophobicContact CG-CE1 4.46Å; P624-Y631 HydrophobicContact CG-CE2 3.67Å; P624-F674 HydrophobicContact CG-CD1 4.28Å; P624-F674 HydrophobicContact CG-CE1 3.99Å; P624-I675 HydrophobicContact CB-CD1 4.08Å; P624-I675 HydrophobicContact CB-CG1 3.92Å; P624-I675 HydrophobicContact CG-CG1 4.44Å; P624-V679 HydrophobicContact CB-CG1 4.24Å; P624-V679 HydrophobicContact CG-CG1 4.12Å; P624-V679 HydrophobicContact CG-CG2 4.23Å; P624-L701 HydrophobicContact CB-CD1 3.58Å; P624-L701 WeakPolarHBondContact O-CD1 3.27Å; P624-N704 PolarHBondContact O-ND2 3.27Å
625	T	98.7	Very high	98.5	Very high	0 Å²	0	22.2 Å²	22.2	0%	0	11%	0.107	C	C	.	.	G	3₁₀ helix	trans	-103.4	-1.3	175.9	78	0	0	0	0	112.9	W404 S622 N623 W683 I697 T700 L701	W404-T625 VanDerWaalsContact CZ2-OG1 3.27Å; W404-T625 WeakPolarHBondContact CZ2-OG1 3.42Å; W404-T625 PolarHBondContact NE1-O 2.69Å; W404-T625 PolarHBondContact NE1-OG1 3.19Å; S622-T625 WeakPolarHBondContact O-CA 3.28Å; S622-T625 WeakPolarHBondContact O-CB 3.34Å; S622-T625 PolarHBondContact O-N 3.4Å; S622-T625 PolarHBondContact O-OG1 3.08Å; N623-T625 PolarHBondContact O-N 2.92Å; N623-T625 VanDerWaalsContact O-N 3.15Å; T625-W683 HydrophobicContact CG2-CD2 3.98Å; T625-W683 HydrophobicContact CG2-CG 3.93Å; T625-W683 HydrophobicContact CG2-CZ2 4.32Å; T625-I697 VanDerWaalsContact CB-CG2 3.41Å; T625-I697 HydrophobicContact CG2-CG2 3.9Å; T625-I697 WeakPolarHBondContact OG1-CG2 3.42Å; T625-T700 WeakPolarHBondContact O-CG2 3.39Å; T625-L701 HydrophobicContact CG2-CB 4.1Å; T625-L701 HydrophobicContact CG2-CD1 4.08Å; T625-L701 HydrophobicContact CG2-CD2 4.16Å; T625-L701 HydrophobicContact CG2-CG 4.34Å
626	K	98.6	Very high	98.5	Very high	0 Å²	0	27 Å²	27	0%	0	13%	0.132	C	C	.	.	S	Bend	trans	-80.3	156.1	172.7	-57.4	-70.4	167.8	65.5	0	109.1	W404 D469 S473 S622 N623 L628 L630 N704	W404-K626 HydrophobicContact CD2-CD 4.49Å; W404-K626 HydrophobicContact CZ2-CD 4.29Å; D469-K626 IonicContact OD1-NZ 3.67Å; D469-K626 PolarHBondContact OD1-NZ 3.12Å; D469-K626 IonicContact OD2-NZ 2.75Å; D469-K626 PolarHBondContact OD2-NZ 3.28Å; S473-K626 WeakPolarHBondContact OG-CE 3.35Å; S473-K626 PolarHBondContact OG-NZ 2.83Å; S622-K626 PolarHBondContact O-N 3.38Å; S622-K626 WeakPolarHBondContact OG-CE 3.32Å; S622-K626 PolarHBondContact OG-NZ 2.8Å; N623-K626 WeakPolarHBondContact O-CB 3.39Å; N623-K626 PolarHBondContact O-N 2.71Å; N623-K626 VanDerWaalsContact O-N 3.11Å; K626-L628 PolarHBondContact O-N 3.33Å; K626-L630 HydrophobicContact CB-CB 4.08Å; K626-L630 HydrophobicContact CB-CD1 4.49Å; K626-N704 PolarHBondContact O-ND2 3.24Å
627	P	98.5	Very high	98.5	Very high	58 Å²	58	30.1 Å²	30.1	38%	0.377	14%	0.144	S	C	.	.			trans	-49.3	138	172.5	-28.9	35.3	0	0	0	112.3	Q629 L630 Y631	P627-Q629 PolarHBondContact O-N 3.36Å; P627-L630 WeakPolarHBondContact O-CB 3.42Å; P627-L630 PolarHBondContact O-N 3.17Å; P627-Y631 PolarHBondContact O-N 3.36Å
628	L	98.2	Very high	98.4	Very high	50 Å²	50	31.2 Å²	31.2	26%	0.262	15%	0.15	S	C	.	.	H	α-helix	trans	-47.8	-34.8	-168.6	-176.7	63.7	0	0	0	115.1	K626 L630 Y631 R632 N704 W707	K626-L628 PolarHBondContact O-N 3.33Å; L628-L630 VanDerWaalsContact C-N 3.33Å; L628-L630 PolarHBondContact O-N 3.39Å; L628-Y631 PolarHBondContact O-N 3.09Å; L628-R632 HydrophobicContact CD1-CG 3.86Å; L628-R632 HydrophobicContact CG-CG 4.22Å; L628-R632 WeakPolarHBondContact O-CB 2.73Å; L628-R632 VanDerWaalsContact O-CG 3.31Å; L628-R632 WeakPolarHBondContact O-CG 3.33Å; L628-R632 PolarHBondContact O-N 3.42Å; L628-N704 WeakPolarHBondContact CA-OD1 3.46Å; L628-N704 WeakPolarHBondContact CB-OD1 3.49Å; L628-N704 WeakPolarHBondContact CD1-OD1 3.2Å; L628-W707 HydrophobicContact CD1-CB 4.38Å; L628-W707 HydrophobicContact CD1-CD2 3.83Å; L628-W707 HydrophobicContact CD1-CE3 3.74Å; L628-W707 HydrophobicContact CD1-CG 4.09Å; L628-W707 HydrophobicContact CD1-CZ3 4.39Å; L628-W707 HydrophobicContact CD2-CB 4.37Å; L628-W707 HydrophobicContact CD2-CD2 3.76Å; L628-W707 HydrophobicContact CD2-CE3 4.47Å; L628-W707 HydrophobicContact CD2-CG 3.65Å; L628-W707 HydrophobicContact CG-CD2 4.4Å
629	Q	98	Very high	98.3	Very high	131 Å²	131	31.5 Å²	31.5	61%	0.612	15%	0.151	S	C	*	.	H	α-helix	trans	-60.9	-37.6	175.9	174.7	172.9	-25.2	0	0	113.1	H407 P627 Q633	H407-Q629 PolarHBondContact NE2-NE2 3.25Å; P627-Q629 PolarHBondContact O-N 3.36Å; Q629-Q633 PolarHBondContact O-NE2 2.95Å
630	L	98.4	Very high	98.3	Very high	3 Å²	3	35.6 Å²	35.6	2%	0.016	17%	0.17	C	C	.	.	H	α-helix	trans	-78.6	-45.9	175.7	-62.3	179.6	0	0	0	110.7	G405 L406 H407 F409 K626 P627 L628 R632 Q633 W634	G405-L630 WeakPolarHBondContact O-CD1 3.34Å; L406-L630 WeakPolarHBondContact O-CD1 3.16Å; H407-L630 HydrophobicContact CB-CD2 4.5Å; F409-L630 HydrophobicContact CD2-CD2 3.65Å; F409-L630 HydrophobicContact CE2-CB 4.49Å; F409-L630 HydrophobicContact CE2-CD2 3.92Å; K626-L630 HydrophobicContact CB-CB 4.08Å; K626-L630 HydrophobicContact CB-CD1 4.49Å; P627-L630 WeakPolarHBondContact O-CB 3.42Å; P627-L630 PolarHBondContact O-N 3.17Å; L628-L630 VanDerWaalsContact C-N 3.33Å; L628-L630 PolarHBondContact O-N 3.39Å; L630-R632 VanDerWaalsContact C-N 3.34Å; L630-R632 PolarHBondContact O-N 2.91Å; L630-Q633 PolarHBondContact O-N 3.32Å; L630-Q633 VanDerWaalsContact O-N 3.15Å; L630-W634 PolarHBondContact O-N 3.04Å
631	Y	98.6	Very high	98.3	Very high	2 Å²	2	35 Å²	35	1%	0.008	17%	0.167	C	C	.	.	H	α-helix	trans	-56.6	-47.2	-180	179.6	-157.6	0	0	0	111.7	N623 P624 P627 L628 Q633 W634 T635 Q671 I675 N704 Y708	N623-Y631 HydrophobicContact CB-CD2 4.16Å; N623-Y631 VanDerWaalsContact O-CB 3.29Å; N623-Y631 WeakPolarHBondContact O-CB 3.14Å; N623-Y631 WeakPolarHBondContact O-CD2 3.48Å; P624-Y631 HydrophobicContact CB-CD1 4.35Å; P624-Y631 HydrophobicContact CB-CD2 4.37Å; P624-Y631 HydrophobicContact CB-CE1 3.78Å; P624-Y631 HydrophobicContact CB-CE2 3.87Å; P624-Y631 HydrophobicContact CG-CD2 4.34Å; P624-Y631 HydrophobicContact CG-CE1 4.46Å; P624-Y631 HydrophobicContact CG-CE2 3.67Å; P627-Y631 PolarHBondContact O-N 3.36Å; L628-Y631 PolarHBondContact O-N 3.09Å; Y631-Q633 VanDerWaalsContact C-N 3.32Å; Y631-Q633 PolarHBondContact O-N 3.44Å; Y631-W634 CarbonylContact O-C 3.57Å; Y631-W634 WeakPolarHBondContact O-CA 3.43Å; Y631-W634 WeakPolarHBondContact O-CB 3.24Å; Y631-W634 PolarHBondContact O-N 3.12Å; Y631-T635 VanDerWaalsContact CE2-OG1 3.24Å; Y631-T635 WeakPolarHBondContact CE2-OG1 3.32Å; Y631-T635 PolarHBondContact O-N 3.37Å; Y631-T635 PolarHBondContact O-OG1 3Å; Y631-Q671 PolarHBondContact OH-OE1 3.07Å; Y631-I675 HydrophobicContact CE1-CD1 4.25Å; Y631-N704 HydrophobicContact CD1-CB 3.82Å; Y631-N704 HydrophobicContact CE1-CB 3.99Å; Y631-Y708 HydrophobicContact CD1-CD2 4.26Å; Y631-Y708 AromaticContact CD1-CE2 3.72Å; Y631-Y708 HydrophobicContact CD1-CE2 3.72Å; Y631-Y708 AromaticContact CE1-CD2 3.58Å; Y631-Y708 HydrophobicContact CE1-CD2 3.58Å; Y631-Y708 AromaticContact CE1-CE2 3.32Å; Y631-Y708 HydrophobicContact CE1-CE2 3.32Å; Y631-Y708 HydrophobicContact CE2-CE2 4.44Å; Y631-Y708 HydrophobicContact CG-CE2 4.44Å; Y631-Y708 AromaticContact CZ-CE2 3.71Å
632	R	98.2	Very high	98.2	Very high	112 Å²	112	37.2 Å²	37.2	42%	0.423	18%	0.176	S	C	.	.	H	α-helix	trans	-59.2	-40.3	178.2	-73.3	-177.5	60.6	-155.2	-11	113.3	L628 L630 W634 T635 D636 W707	L628-R632 HydrophobicContact CD1-CG 3.86Å; L628-R632 HydrophobicContact CG-CG 4.22Å; L628-R632 WeakPolarHBondContact O-CB 2.73Å; L628-R632 VanDerWaalsContact O-CG 3.31Å; L628-R632 WeakPolarHBondContact O-CG 3.33Å; L628-R632 PolarHBondContact O-N 3.42Å; L630-R632 VanDerWaalsContact C-N 3.34Å; L630-R632 PolarHBondContact O-N 2.91Å; R632-W634 VanDerWaalsContact C-N 3.31Å; R632-W634 PolarHBondContact O-N 3.33Å; R632-T635 PolarHBondContact O-N 3Å; R632-D636 VanDerWaalsContact O-CG 3.27Å; R632-D636 PolarHBondContact O-N 2.91Å; R632-W707 HydrophobicContact CG-CH2 4.34Å; R632-W707 HydrophobicContact CG-CZ3 4.13Å
633	Q	98.4	Very high	98.2	Very high	63 Å²	63	39.4 Å²	39.4	29%	0.294	19%	0.186	S	C	.	.	H	α-helix	trans	-65.3	-34.2	174.9	-73.9	173.2	89.7	0	0	112.1	F409 Q629 L630 Y631 R637	F409-Q633 HydrophobicContact CD2-CB 4.14Å; F409-Q633 HydrophobicContact CD2-CG 4.5Å; F409-Q633 HydrophobicContact CE2-CB 3.47Å; F409-Q633 VanDerWaalsContact CE2-CB 3.47Å; F409-Q633 HydrophobicContact CE2-CG 4.28Å; F409-Q633 HydrophobicContact CZ-CB 3.68Å; Q629-Q633 PolarHBondContact O-NE2 2.95Å; L630-Q633 PolarHBondContact O-N 3.32Å; L630-Q633 VanDerWaalsContact O-N 3.15Å; Y631-Q633 VanDerWaalsContact C-N 3.32Å; Y631-Q633 PolarHBondContact O-N 3.44Å; Q633-R637 WeakPolarHBondContact O-CB 3.4Å; Q633-R637 WeakPolarHBondContact O-CD 3.34Å; Q633-R637 WeakPolarHBondContact O-CG 3.36Å; Q633-R637 PolarHBondContact O-N 2.87Å
634	W	98.7	Very high	98.1	Very high	2 Å²	2	43.1 Å²	43.1	1%	0.008	20%	0.199	C	C	.	.	H	α-helix	trans	-68.6	-42.1	171.5	-74.1	133.1	0	0	0	112.6	V408 F409 Y461 I465 H466 D469 N623 L630 Y631 R632 R637 I638	V408-W634 HydrophobicContact CG1-CZ2 3.94Å; F409-W634 HydrophobicContact CE1-CD2 4.27Å; F409-W634 HydrophobicContact CE1-CE3 4.2Å; F409-W634 AromaticContact CE1-CH2 3.68Å; F409-W634 HydrophobicContact CE1-CH2 3.68Å; F409-W634 AromaticContact CE1-CZ2 3.79Å; F409-W634 HydrophobicContact CE1-CZ2 3.79Å; F409-W634 AromaticContact CE1-CZ3 3.93Å; F409-W634 HydrophobicContact CE1-CZ3 3.93Å; F409-W634 HydrophobicContact CE2-CZ2 4.48Å; F409-W634 AromaticContact CZ-CD2 3.57Å; F409-W634 HydrophobicContact CZ-CD2 3.57Å; F409-W634 AromaticContact CZ-CE2 3.43Å; F409-W634 VanDerWaalsContact CZ-CE2 3.43Å; F409-W634 AromaticContact CZ-CE3 3.93Å; F409-W634 HydrophobicContact CZ-CE3 3.93Å; F409-W634 HydrophobicContact CZ-CG 4.08Å; F409-W634 AromaticContact CZ-CH2 3.92Å; F409-W634 HydrophobicContact CZ-CH2 3.92Å; F409-W634 AromaticContact CZ-CZ2 3.62Å; F409-W634 HydrophobicContact CZ-CZ2 3.62Å; F409-W634 HydrophobicContact CZ-CZ3 4.09Å; F409-W634 AromaticContact CZ-NE1 3.95Å; Y461-W634 AromaticContact CD2-CE3 3.66Å; Y461-W634 HydrophobicContact CD2-CE3 3.66Å; Y461-W634 HydrophobicContact CD2-CZ3 4.24Å; Y461-W634 HydrophobicContact CE2-CB 4.42Å; Y461-W634 HydrophobicContact CE2-CD2 4.28Å; Y461-W634 AromaticContact CE2-CE3 3.73Å; Y461-W634 HydrophobicContact CE2-CE3 3.73Å; Y461-W634 HydrophobicContact CE2-CZ3 4.44Å; I465-W634 HydrophobicContact CB-CH2 4.08Å; I465-W634 HydrophobicContact CG2-CH2 3.81Å; I465-W634 HydrophobicContact CG2-CZ2 4.35Å; H466-W634 VanDerWaalsContact CA-CH2 3.5Å; H466-W634 HydrophobicContact CB-CH2 3.9Å; H466-W634 HydrophobicContact CB-CZ3 3.95Å; D469-W634 HydrophobicContact CB-CZ2 3.8Å; D469-W634 PolarHBondContact OD2-NE1 2.99Å; N623-W634 HydrophobicContact CB-CB 3.83Å; N623-W634 HydrophobicContact CB-CG 3.95Å; N623-W634 PolarHBondContact OD1-NE1 2.67Å; L630-W634 PolarHBondContact O-N 3.04Å; Y631-W634 CarbonylContact O-C 3.57Å; Y631-W634 WeakPolarHBondContact O-CA 3.43Å; Y631-W634 WeakPolarHBondContact O-CB 3.24Å; Y631-W634 PolarHBondContact O-N 3.12Å; R632-W634 VanDerWaalsContact C-N 3.31Å; R632-W634 PolarHBondContact O-N 3.33Å; W634-R637 PolarHBondContact O-N 3.06Å; W634-I638 WeakPolarHBondContact O-CG2 3.37Å; W634-I638 PolarHBondContact O-N 3.45Å
635	T	98.2	Very high	98	Very high	1 Å²	1	43.5 Å²	43.5	1%	0.006	20%	0.201	C	C	.	.	H	α-helix	trans	-60.4	-46.7	174.4	-60.4	0	0	0	0	111.9	Y631 R632 R637 I638 M639 V667 Q671 Y708	Y631-T635 VanDerWaalsContact CE2-OG1 3.24Å; Y631-T635 WeakPolarHBondContact CE2-OG1 3.32Å; Y631-T635 PolarHBondContact O-N 3.37Å; Y631-T635 PolarHBondContact O-OG1 3Å; R632-T635 PolarHBondContact O-N 3Å; T635-R637 VanDerWaalsContact C-N 3.27Å; T635-R637 PolarHBondContact O-N 3.24Å; T635-I638 WeakPolarHBondContact O-CG2 3.15Å; T635-I638 PolarHBondContact O-N 3.4Å; T635-M639 HydrophobicContact CG2-CG 4.31Å; T635-M639 WeakPolarHBondContact O-CB 3.46Å; T635-M639 VanDerWaalsContact O-CG 3.28Å; T635-M639 WeakPolarHBondContact O-CG 3.41Å; T635-M639 PolarHBondContact O-N 3.39Å; T635-V667 HydrophobicContact CG2-CG1 3.61Å; T635-Q671 HydrophobicContact CG2-CG 3.71Å; T635-Q671 PolarHBondContact OG1-OE1 2.97Å; T635-Y708 WeakPolarHBondContact CB-OH 3.4Å; T635-Y708 HydrophobicContact CG2-CE1 4.39Å; T635-Y708 PolarHBondContact OG1-OH 3.27Å; T635-Y708 VanDerWaalsContact OG1-OH 3.13Å
636	D	97.8	Very high	98	Very high	100 Å²	100	43.5 Å²	43.5	54%	0.535	20%	0.201	S	C	.	.	H	α-helix	trans	-59.4	-40.7	178.1	-68.5	-23	0	0	0	111	R632 E640	R632-D636 VanDerWaalsContact O-CG 3.27Å; R632-D636 PolarHBondContact O-N 2.91Å; D636-E640 WeakPolarHBondContact O-CB 3.18Å; D636-E640 PolarHBondContact O-N 2.9Å
637	R	98.5	Very high	97.9	Very high	67 Å²	67	45.6 Å²	45.6	25%	0.253	21%	0.211	S	C	.	.	H	α-helix	trans	-67.6	-48.2	177.9	-75.7	171.3	177	-80.3	1.2	114	F409 A460 Y461 Q633 W634 T635 M639 E640 E641	F409-R637 VanDerWaalsContact CE1-NE 3.34Å; A460-R637 WeakPolarHBondContact O-CB 3.38Å; A460-R637 WeakPolarHBondContact O-CD 3.46Å; A460-R637 WeakPolarHBondContact O-CG 3.49Å; A460-R637 PolarHBondContact O-NH1 2.95Å; Y461-R637 HydrophobicContact CD2-CB 4.34Å; Q633-R637 WeakPolarHBondContact O-CB 3.4Å; Q633-R637 WeakPolarHBondContact O-CD 3.34Å; Q633-R637 WeakPolarHBondContact O-CG 3.36Å; Q633-R637 PolarHBondContact O-N 2.87Å; W634-R637 PolarHBondContact O-N 3.06Å; T635-R637 VanDerWaalsContact C-N 3.27Å; T635-R637 PolarHBondContact O-N 3.24Å; R637-M639 VanDerWaalsContact C-N 3.33Å; R637-E640 PolarHBondContact O-N 2.86Å; R637-E641 PolarHBondContact O-N 3.14Å
638	I	97.6	Very high	97.8	Very high	23 Å²	23	46.6 Å²	46.6	12%	0.118	21%	0.208	C	C	.	.	H	α-helix	trans	-68.2	-36.2	-179.2	-169	63.8	0	0	0	110.9	Y461 W634 T635 E641 F642	Y461-I638 HydrophobicContact CD1-CD1 3.75Å; Y461-I638 HydrophobicContact CD2-CB 3.75Å; Y461-I638 HydrophobicContact CD2-CD1 4.24Å; Y461-I638 HydrophobicContact CD2-CG1 4.47Å; Y461-I638 HydrophobicContact CE1-CD1 4.27Å; Y461-I638 HydrophobicContact CE2-CB 4.31Å; Y461-I638 HydrophobicContact CG-CB 4.02Å; Y461-I638 HydrophobicContact CG-CD1 3.74Å; Y461-I638 HydrophobicContact CG-CG1 4.43Å; W634-I638 WeakPolarHBondContact O-CG2 3.37Å; W634-I638 PolarHBondContact O-N 3.45Å; T635-I638 WeakPolarHBondContact O-CG2 3.15Å; T635-I638 PolarHBondContact O-N 3.4Å; I638-E641 PolarHBondContact O-N 2.93Å; I638-F642 HydrophobicContact CD1-CD1 4.11Å; I638-F642 HydrophobicContact CD1-CE1 3.54Å; I638-F642 HydrophobicContact CD1-CZ 3.86Å; I638-F642 HydrophobicContact CG1-CD1 4.24Å; I638-F642 HydrophobicContact CG1-CD2 4.45Å; I638-F642 HydrophobicContact CG1-CE1 3.75Å; I638-F642 HydrophobicContact CG1-CE2 3.98Å; I638-F642 HydrophobicContact CG1-CZ 3.61Å; I638-F642 WeakPolarHBondContact O-CG 3.47Å; I638-F642 PolarHBondContact O-N 3.19Å
639	M	97.1	Very high	97.8	Very high	7 Å²	7	44.2 Å²	44.2	3%	0.034	20%	0.195	C	C	.	.	H	α-helix	trans	-67.1	-40.2	173.5	-66.3	-50.7	-46.6	0	0	111.8	T635 R637 E641 F642 F643 A665 V667	T635-M639 HydrophobicContact CG2-CG 4.31Å; T635-M639 WeakPolarHBondContact O-CB 3.46Å; T635-M639 VanDerWaalsContact O-CG 3.28Å; T635-M639 WeakPolarHBondContact O-CG 3.41Å; T635-M639 PolarHBondContact O-N 3.39Å; R637-M639 VanDerWaalsContact C-N 3.33Å; M639-E641 VanDerWaalsContact C-N 3.28Å; M639-E641 PolarHBondContact O-N 3.31Å; M639-F642 HydrophobicContact CE-CD2 4.42Å; M639-F642 PolarHBondContact O-N 3.16Å; M639-F642 HydrophobicContact SD-CD2 4.24Å; M639-F643 HydrophobicContact CB-CE2 4.13Å; M639-F643 HydrophobicContact CB-CZ 4.21Å; M639-F643 HydrophobicContact CE-CD1 4.22Å; M639-F643 HydrophobicContact CE-CE1 3.35Å; M639-F643 HydrophobicContact CE-CE2 4.44Å; M639-F643 HydrophobicContact CE-CZ 3.49Å; M639-F643 VanDerWaalsContact CE-CZ 3.49Å; M639-F643 WeakPolarHBondContact O-CB 3.37Å; M639-F643 WeakPolarHBondContact O-CD1 3.5Å; M639-F643 WeakPolarHBondContact O-CD2 3.41Å; M639-F643 WeakPolarHBondContact O-CG 3.37Å; M639-F643 PolarHBondContact O-N 3.34Å; M639-A665 HydrophobicContact CE-CB 4.26Å; M639-V667 HydrophobicContact CE-CG2 4.24Å; M639-V667 HydrophobicContact CG-CG1 3.84Å; M639-V667 HydrophobicContact CG-CG2 4.04Å; M639-V667 HydrophobicContact SD-CG1 4.41Å; M639-V667 HydrophobicContact SD-CG2 4.43Å
640	E	98	Very high	97.7	Very high	86 Å²	86	42.6 Å²	42.6	40%	0.402	18%	0.184	S	C	.	.	H	α-helix	trans	-57.9	-42.5	172.6	-164.7	-165.8	160.2	0	0	111.3	A460 D636 R637 F643 R644	A460-E640 HydrophobicContact CB-CB 4.07Å; A460-E640 HydrophobicContact CB-CG 4.33Å; D636-E640 WeakPolarHBondContact O-CB 3.18Å; D636-E640 PolarHBondContact O-N 2.9Å; R637-E640 PolarHBondContact O-N 2.86Å; E640-F643 PolarHBondContact O-N 3.02Å; E640-R644 WeakPolarHBondContact O-CB 3.39Å; E640-R644 WeakPolarHBondContact O-CD 3.45Å; E640-R644 VanDerWaalsContact O-CG 3.23Å; E640-R644 WeakPolarHBondContact O-CG 3.31Å; E640-R644 PolarHBondContact O-N 3.09Å; E640-R644 IonicContact OE1-CZ 2.7Å; E640-R644 IonicContact OE1-NE 2.89Å; E640-R644 PolarHBondContact OE1-NE 3.07Å; E640-R644 IonicContact OE1-NH2 3.63Å; E640-R644 PolarHBondContact OE1-NH2 3.3Å
641	E	98.3	Very high	97.6	Very high	6 Å²	6	50.2 Å²	50.2	3%	0.028	22%	0.219	C	C	.	.	H	α-helix	trans	-67.9	-45.2	179.1	-157.9	172.3	130.2	0	0	113	V459 A460 Y461 H462 H506 G508 R637 I638 M639 F643 R644 Q645	V459-E641 VanDerWaalsContact CG1-CD 3.48Å; V459-E641 HydrophobicContact CG1-CG 4.45Å; V459-E641 WeakPolarHBondContact CG1-OE2 3.22Å; A460-E641 HydrophobicContact CB-CB 4.26Å; A460-E641 PolarHBondContact N-OE2 2.81Å; Y461-E641 WeakPolarHBondContact CA-OE2 3.28Å; Y461-E641 WeakPolarHBondContact CB-OE2 3.29Å; Y461-E641 PolarHBondContact N-OE2 3.33Å; H462-E641 IonicContact CE1-OE1 2.67Å; H462-E641 IonicContact CG-OE1 3.79Å; H462-E641 PolarHBondContact N-OE2 3.44Å; H462-E641 VanDerWaalsContact N-OE2 3.09Å; H462-E641 IonicContact ND1-OE1 3.86Å; H462-E641 PolarHBondContact ND1-OE1 2.94Å; H462-E641 IonicContact ND1-OE2 3.85Å; H506-E641 IonicContact CE1-OE1 2.66Å; H506-E641 PolarHBondContact CE1-OE1 3.29Å; H506-E641 IonicContact ND1-OE1 2.87Å; G508-E641 VanDerWaalsContact CA-OE1 3.25Å; G508-E641 WeakPolarHBondContact CA-OE1 3.24Å; R637-E641 PolarHBondContact O-N 3.14Å; I638-E641 PolarHBondContact O-N 2.93Å; M639-E641 VanDerWaalsContact C-N 3.28Å; M639-E641 PolarHBondContact O-N 3.31Å; E641-F643 VanDerWaalsContact C-N 3.29Å; E641-F643 PolarHBondContact O-N 3.35Å; E641-R644 CarbonylContact O-C 3.58Å; E641-R644 WeakPolarHBondContact O-CB 3.46Å; E641-R644 PolarHBondContact O-N 3.34Å; E641-R644 VanDerWaalsContact O-N 3.12Å; E641-Q645 PolarHBondContact O-N 3.27Å
642	F	96.9	Very high	97.5	Very high	55 Å²	55	57.3 Å²	57.3	24%	0.241	25%	0.246	C	C	.	.	H	α-helix	trans	-58.9	-40.8	172.9	-71.1	-4.4	0	0	0	111.4	I638 M639 R644 Q645 G646 M659 C660	I638-F642 HydrophobicContact CD1-CD1 4.11Å; I638-F642 HydrophobicContact CD1-CE1 3.54Å; I638-F642 HydrophobicContact CD1-CZ 3.86Å; I638-F642 HydrophobicContact CG1-CD1 4.24Å; I638-F642 HydrophobicContact CG1-CD2 4.45Å; I638-F642 HydrophobicContact CG1-CE1 3.75Å; I638-F642 HydrophobicContact CG1-CE2 3.98Å; I638-F642 HydrophobicContact CG1-CZ 3.61Å; I638-F642 WeakPolarHBondContact O-CG 3.47Å; I638-F642 PolarHBondContact O-N 3.19Å; M639-F642 HydrophobicContact CE-CD2 4.42Å; M639-F642 PolarHBondContact O-N 3.16Å; M639-F642 HydrophobicContact SD-CD2 4.24Å; F642-R644 PolarHBondContact O-N 3.3Å; F642-Q645 PolarHBondContact O-N 2.98Å; F642-G646 PolarHBondContact O-N 3.01Å; F642-M659 HydrophobicContact CD2-CB 4.18Å; F642-M659 HydrophobicContact CE2-CE 4.02Å; F642-C660 WeakPolarHBondContact O-CA 3.36Å; F642-C660 VanDerWaalsContact O-CB 3.22Å; F642-C660 WeakPolarHBondContact O-CB 3.34Å
643	F	97.5	Very high	97.4	Very high	47 Å²	47	55.3 Å²	55.3	21%	0.206	26%	0.261	C	S	.	.	H	α-helix	trans	-67.1	-34.4	175.8	-61.7	-19.5	0	0	0	112.8	M639 E640 E641 G646 D647 M659 K662 A665	M639-F643 HydrophobicContact CB-CE2 4.13Å; M639-F643 HydrophobicContact CB-CZ 4.21Å; M639-F643 HydrophobicContact CE-CD1 4.22Å; M639-F643 HydrophobicContact CE-CE1 3.35Å; M639-F643 HydrophobicContact CE-CE2 4.44Å; M639-F643 HydrophobicContact CE-CZ 3.49Å; M639-F643 VanDerWaalsContact CE-CZ 3.49Å; M639-F643 WeakPolarHBondContact O-CB 3.37Å; M639-F643 WeakPolarHBondContact O-CD1 3.5Å; M639-F643 WeakPolarHBondContact O-CD2 3.41Å; M639-F643 WeakPolarHBondContact O-CG 3.37Å; M639-F643 PolarHBondContact O-N 3.34Å; E640-F643 PolarHBondContact O-N 3.02Å; E641-F643 VanDerWaalsContact C-N 3.29Å; E641-F643 PolarHBondContact O-N 3.35Å; F643-G646 PolarHBondContact O-N 3.41Å; F643-D647 WeakPolarHBondContact O-CB 3.25Å; F643-D647 VanDerWaalsContact O-CG 3.27Å; F643-D647 PolarHBondContact O-N 3.5Å; F643-M659 WeakPolarHBondContact CE1-O 3.4Å; F643-K662 HydrophobicContact CB-CB 4.06Å; F643-K662 HydrophobicContact CB-CD 4.43Å; F643-K662 HydrophobicContact CD1-CB 3.65Å; F643-K662 HydrophobicContact CD2-CB 3.75Å; F643-K662 HydrophobicContact CE1-CB 3.96Å; F643-K662 HydrophobicContact CE2-CB 4.05Å; F643-K662 HydrophobicContact CG-CB 3.54Å; F643-K662 HydrophobicContact CZ-CB 4.14Å; F643-A665 HydrophobicContact CE1-CB 3.66Å; F643-A665 HydrophobicContact CZ-CB 3.93Å
644	R	97.4	Very high	97.2	Very high	92 Å²	92	54.6 Å²	54.6	35%	0.347	26%	0.258	S	S	.	.	H	α-helix	trans	-68.3	-35.4	171.7	-72.1	157.3	165.9	-123.3	21.2	112	D458 E640 E641 F642 R648	D458-R644 PolarHBondContact O-NH1 3.38Å; E640-R644 WeakPolarHBondContact O-CB 3.39Å; E640-R644 WeakPolarHBondContact O-CD 3.45Å; E640-R644 VanDerWaalsContact O-CG 3.23Å; E640-R644 WeakPolarHBondContact O-CG 3.31Å; E640-R644 PolarHBondContact O-N 3.09Å; E640-R644 IonicContact OE1-CZ 2.7Å; E640-R644 IonicContact OE1-NE 2.89Å; E640-R644 PolarHBondContact OE1-NE 3.07Å; E640-R644 IonicContact OE1-NH2 3.63Å; E640-R644 PolarHBondContact OE1-NH2 3.3Å; E641-R644 CarbonylContact O-C 3.58Å; E641-R644 WeakPolarHBondContact O-CB 3.46Å; E641-R644 PolarHBondContact O-N 3.34Å; E641-R644 VanDerWaalsContact O-N 3.12Å; F642-R644 PolarHBondContact O-N 3.3Å; R644-R648 VanDerWaalsContact O-CG 3.29Å; R644-R648 WeakPolarHBondContact O-CG 3.35Å; R644-R648 PolarHBondContact O-N 3.35Å
645	Q	97.5	Very high	97	Very high	9 Å²	9	63.4 Å²	63.4	4%	0.042	30%	0.299	C	S	.	.	H	α-helix	trans	-64.2	-49.2	168.7	174.1	167.6	-35.5	0	0	111	V509 F513 E641 F642 D647 R648 E649 S657	V509-Q645 VanDerWaalsContact CA-OE1 3.3Å; V509-Q645 HydrophobicContact CG1-CB 3.98Å; V509-Q645 HydrophobicContact CG1-CG 3.93Å; F513-Q645 HydrophobicContact CD2-CG 4.06Å; E641-Q645 PolarHBondContact O-N 3.27Å; F642-Q645 PolarHBondContact O-N 2.98Å; Q645-D647 VanDerWaalsContact C-N 3.26Å; Q645-D647 PolarHBondContact O-N 2.98Å; Q645-R648 CarbonylContact O-C 3.57Å; Q645-R648 WeakPolarHBondContact O-CA 3.34Å; Q645-R648 WeakPolarHBondContact O-CB 3.37Å; Q645-R648 PolarHBondContact O-N 2.92Å; Q645-E649 HydrophobicContact CG-CG 4.19Å; Q645-E649 PolarHBondContact NE2-OE1 3.48Å; Q645-E649 WeakPolarHBondContact O-CG 3.36Å; Q645-E649 PolarHBondContact O-N 3.07Å; Q645-S657 PolarHBondContact NE2-OG 3.27Å
646	G	97.1	Very high	96.8	Very high	0 Å²	0	65.7 Å²	65.7	0%	0	31%	0.311	C	S	.	.	H	α-helix	trans	-62.5	-31.9	-179.5	0	0	0	0	0	113.5	F642 F643 E649 R650	F642-G646 PolarHBondContact O-N 3.01Å; F643-G646 PolarHBondContact O-N 3.41Å; G646-E649 PolarHBondContact O-N 3.38Å; G646-R650 VanDerWaalsContact O-CB 3.31Å; G646-R650 WeakPolarHBondContact O-CB 3.45Å; G646-R650 PolarHBondContact O-N 2.83Å
647	D	97.4	Very high	96.4	Very high	43 Å²	43	62.3 Å²	62.3	23%	0.23	30%	0.295	C	S	.	.	H	α-helix	trans	-63.9	-47.9	168.5	-74.4	-9.8	0	0	0	111.8	F643 Q645 E649 R650 E651 K662	F643-D647 WeakPolarHBondContact O-CB 3.25Å; F643-D647 VanDerWaalsContact O-CG 3.27Å; F643-D647 PolarHBondContact O-N 3.5Å; Q645-D647 VanDerWaalsContact C-N 3.26Å; Q645-D647 PolarHBondContact O-N 2.98Å; D647-E649 VanDerWaalsContact C-N 3.3Å; D647-E649 PolarHBondContact O-N 2.98Å; D647-R650 PolarHBondContact O-N 3.19Å; D647-R650 IonicContact OD1-CZ 2.75Å; D647-R650 IonicContact OD1-NH1 3.48Å; D647-R650 PolarHBondContact OD1-NH1 3.33Å; D647-R650 IonicContact OD1-NH2 3.12Å; D647-E651 WeakPolarHBondContact O-CB 3.42Å; D647-E651 WeakPolarHBondContact O-CG 3.41Å; D647-E651 PolarHBondContact O-N 3.38Å; D647-K662 VanDerWaalsContact OD1-CE 3.29Å; D647-K662 WeakPolarHBondContact OD1-CE 3.38Å; D647-K662 IonicContact OD1-NZ 3.72Å; D647-K662 PolarHBondContact OD1-NZ 3.3Å; D647-K662 IonicContact OD2-NZ 3.6Å; D647-K662 PolarHBondContact OD2-NZ 2.83Å
648	R	97	Very high	95.9	Very high	80 Å²	80	63.8 Å²	63.8	30%	0.302	31%	0.313	S	S	.	.	H	α-helix	trans	-61.7	-33.2	175.2	-68.2	167.2	178.7	-172.7	2.3	112.9	P507 F513 R644 Q645 R652	P507-R648 PolarHBondContact O-NH1 3.2Å; F513-R648 HydrophobicContact CE2-CB 4.11Å; F513-R648 HydrophobicContact CZ-CB 4Å; R644-R648 VanDerWaalsContact O-CG 3.29Å; R644-R648 WeakPolarHBondContact O-CG 3.35Å; R644-R648 PolarHBondContact O-N 3.35Å; Q645-R648 CarbonylContact O-C 3.57Å; Q645-R648 WeakPolarHBondContact O-CA 3.34Å; Q645-R648 WeakPolarHBondContact O-CB 3.37Å; Q645-R648 PolarHBondContact O-N 2.92Å; R648-R652 VanDerWaalsContact O-CD 3.3Å; R648-R652 WeakPolarHBondContact O-CD 3.27Å; R648-R652 WeakPolarHBondContact O-CG 3.41Å; R648-R652 PolarHBondContact O-N 3.48Å
649	E	97.7	Very high	95.2	Very high	0 Å²	0	66.9 Å²	66.9	0%	0	33%	0.328	C	S	.	.	H	α-helix	trans	-70.6	-46.9	175.3	-70.8	170	159	0	0	111.2	F513 Q645 G646 D647 E651 R652 G653 M654 I656 S657	F513-E649 HydrophobicContact CD2-CG 3.58Å; F513-E649 HydrophobicContact CE2-CG 3.62Å; Q645-E649 HydrophobicContact CG-CG 4.19Å; Q645-E649 PolarHBondContact NE2-OE1 3.48Å; Q645-E649 WeakPolarHBondContact O-CG 3.36Å; Q645-E649 PolarHBondContact O-N 3.07Å; G646-E649 PolarHBondContact O-N 3.38Å; D647-E649 VanDerWaalsContact C-N 3.3Å; D647-E649 PolarHBondContact O-N 2.98Å; E649-E651 VanDerWaalsContact C-N 3.35Å; E649-E651 PolarHBondContact O-N 3.16Å; E649-R652 CarbonylContact O-C 3.51Å; E649-R652 PolarHBondContact O-N 2.97Å; E649-G653 PolarHBondContact O-N 3.34Å; E649-M654 HydrophobicContact CB-CB 4.23Å; E649-M654 HydrophobicContact CG-CE 4.28Å; E649-M654 PolarHBondContact O-N 2.95Å; E649-I656 HydrophobicContact CB-CG1 4.46Å; E649-I656 WeakPolarHBondContact OE2-CA 3.44Å; E649-S657 WeakPolarHBondContact OE1-CB 3.41Å; E649-S657 PolarHBondContact OE1-OG 3.25Å; E649-S657 PolarHBondContact OE2-N 2.86Å
650	R	96.1	Very high	95	Very high	96 Å²	96	66.8 Å²	66.8	36%	0.362	33%	0.328	S	S	.	.	H	α-helix	trans	-62.3	-39.8	177.5	-158.7	-176.1	-54	97.2	-3.7	111.9	G646 D647 R652 G653 I656 D661	G646-R650 VanDerWaalsContact O-CB 3.31Å; G646-R650 WeakPolarHBondContact O-CB 3.45Å; G646-R650 PolarHBondContact O-N 2.83Å; D647-R650 PolarHBondContact O-N 3.19Å; D647-R650 IonicContact OD1-CZ 2.75Å; D647-R650 IonicContact OD1-NH1 3.48Å; D647-R650 PolarHBondContact OD1-NH1 3.33Å; D647-R650 IonicContact OD1-NH2 3.12Å; R650-R652 VanDerWaalsContact C-N 3.27Å; R650-R652 PolarHBondContact O-N 3.03Å; R650-G653 PolarHBondContact O-N 3.49Å; R650-I656 HydrophobicContact CB-CD1 3.99Å; R650-I656 HydrophobicContact CB-CG1 4.34Å; R650-I656 HydrophobicContact CG-CD1 4.03Å; R650-D661 IonicContact CZ-OD1 2.9Å; R650-D661 IonicContact NH2-OD1 2.7Å; R650-D661 PolarHBondContact NH2-OD1 2.63Å
651	E	96.6	Very high	94.6	Very high	163 Å²	163	64.5 Å²	64.5	76%	0.762	32%	0.319	S	S	*	.	H	α-helix	trans	-61.5	-31.9	172.7	-77.2	178.7	174.8	0	0	113.3	D647 E649	D647-E651 WeakPolarHBondContact O-CB 3.42Å; D647-E651 WeakPolarHBondContact O-CG 3.41Å; D647-E651 PolarHBondContact O-N 3.38Å; E649-E651 VanDerWaalsContact C-N 3.35Å; E649-E651 PolarHBondContact O-N 3.16Å
652	R	95.9	Very high	94.3	Very high	151 Å²	151	68.4 Å²	68.4	57%	0.57	34%	0.335	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.2	-5.2	179.9	-71.5	170	-178.4	-110.5	1.7	113.7	R648 E649 R650 M654	R648-R652 VanDerWaalsContact O-CD 3.3Å; R648-R652 WeakPolarHBondContact O-CD 3.27Å; R648-R652 WeakPolarHBondContact O-CG 3.41Å; R648-R652 PolarHBondContact O-N 3.48Å; E649-R652 CarbonylContact O-C 3.51Å; E649-R652 PolarHBondContact O-N 2.97Å; R650-R652 VanDerWaalsContact C-N 3.27Å; R650-R652 PolarHBondContact O-N 3.03Å; R652-M654 VanDerWaalsContact C-N 3.25Å; R652-M654 HydrophobicContact CB-CG 3.89Å; R652-M654 HydrophobicContact CB-SD 3.77Å; R652-M654 HydrophobicContact CG-SD 4.44Å; R652-M654 PolarHBondContact O-N 2.76Å
653	G	95.3	Very high	93.9	Very high	71 Å²	71	72.6 Å²	72.6	73%	0.732	36%	0.355	S	S	*	.	T	Hydrogen-bonded Turn	trans	67.4	26.7	-172.9	0	0	0	0	0	113.2	E649 R650	E649-G653 PolarHBondContact O-N 3.34Å; R650-G653 PolarHBondContact O-N 3.49Å
654	M	95.1	Very high	93.4	Very high	48 Å²	48	77 Å²	77	24%	0.236	38%	0.381	C	S	.	.	P	Polyproline II helix	trans	-84.2	159.9	174.2	-66.5	167.7	56	0	0	110.3	F513 N516 T517 E649 R652	F513-M654 HydrophobicContact CD2-CE 4.14Å; F513-M654 HydrophobicContact CE2-CE 4.36Å; F513-M654 HydrophobicContact CE2-SD 4.42Å; N516-M654 HydrophobicContact CB-CE 3.75Å; T517-M654 HydrophobicContact CG2-CE 4.09Å; T517-M654 HydrophobicContact CG2-SD 3.72Å; E649-M654 HydrophobicContact CB-CB 4.23Å; E649-M654 HydrophobicContact CG-CE 4.28Å; E649-M654 PolarHBondContact O-N 2.95Å; R652-M654 VanDerWaalsContact C-N 3.25Å; R652-M654 HydrophobicContact CB-CG 3.89Å; R652-M654 HydrophobicContact CB-SD 3.77Å; R652-M654 HydrophobicContact CG-SD 4.44Å; R652-M654 PolarHBondContact O-N 2.76Å
655	E	93.3	Very high	92.7	Very high	187 Å²	187	74.2 Å²	74.2	87%	0.874	38%	0.378	S	S	*	.	P	Polyproline II helix	trans	-63.3	133.1	161.6	-172.7	168.2	-175.9	0	0	108.5
656	I	94.5	Very high	92.3	Very high	48 Å²	48	76.1 Å²	76.1	25%	0.246	39%	0.392	C	S	.	.	P	Polyproline II helix	trans	-78.7	129.5	-177.8	-57.8	172.6	0	0	0	108.3	E649 R650 C660 D661	E649-I656 HydrophobicContact CB-CG1 4.46Å; E649-I656 WeakPolarHBondContact OE2-CA 3.44Å; R650-I656 HydrophobicContact CB-CD1 3.99Å; R650-I656 HydrophobicContact CB-CG1 4.34Å; R650-I656 HydrophobicContact CG-CD1 4.03Å; I656-C660 HydrophobicContact CG2-CB 3.95Å; I656-D661 HydrophobicContact CD1-CB 4.34Å; I656-D661 HydrophobicContact CG2-CB 3.87Å
657	S	90	Very high	92.1	Very high	29 Å²	29	77.7 Å²	77.7	20%	0.203	40%	0.402	C	S	.	.	P	Polyproline II helix	trans	-60	150.3	-178.6	-71.6	0	0	0	0	111.8	Q645 E649 M659 C660	Q645-S657 PolarHBondContact NE2-OG 3.27Å; E649-S657 WeakPolarHBondContact OE1-CB 3.41Å; E649-S657 PolarHBondContact OE1-OG 3.25Å; E649-S657 PolarHBondContact OE2-N 2.86Å; S657-M659 PolarHBondContact O-N 2.87Å; S657-C660 VanDerWaalsContact O-CB 3.27Å; S657-C660 WeakPolarHBondContact O-CB 3.44Å; S657-C660 PolarHBondContact O-N 2.68Å
658	P	86.9	Confident	91.9	Very high	98 Å²	98	78.1 Å²	78.1	64%	0.636	40%	0.403	S	S	*	.	T	Hydrogen-bonded Turn	trans	-49.6	142.2	173.1	-27.9	35.7	0	0	0	112.2	C660	P658-C660 PolarHBondContact O-N 2.95Å; P658-C660 PolarHBondContact O-SG 3.16Å
659	M	84.6	Confident	91.7	Very high	88 Å²	88	79 Å²	79	43%	0.433	41%	0.409	S	S	.	.	T	Hydrogen-bonded Turn	trans	62.7	-9.4	-174.6	-52	179.7	-68.5	0	0	116.2	F642 F643 S657	F642-M659 HydrophobicContact CD2-CB 4.18Å; F642-M659 HydrophobicContact CE2-CE 4.02Å; F643-M659 WeakPolarHBondContact CE1-O 3.4Å; S657-M659 PolarHBondContact O-N 2.87Å
660	C	90.9	Very high	91.4	Very high	5 Å²	5	80.2 Å²	80.2	3%	0.034	42%	0.417	C	S	.	.	T	Hydrogen-bonded Turn	trans	-84.9	-15.3	-177	-60.5	0	0	0	0	113.9	F642 I656 S657 P658 K662	F642-C660 WeakPolarHBondContact O-CA 3.36Å; F642-C660 VanDerWaalsContact O-CB 3.22Å; F642-C660 WeakPolarHBondContact O-CB 3.34Å; I656-C660 HydrophobicContact CG2-CB 3.95Å; S657-C660 VanDerWaalsContact O-CB 3.27Å; S657-C660 WeakPolarHBondContact O-CB 3.44Å; S657-C660 PolarHBondContact O-N 2.68Å; P658-C660 PolarHBondContact O-N 2.95Å; P658-C660 PolarHBondContact O-SG 3.16Å; C660-K662 PolarHBondContact O-N 2.79Å
661	D	91.6	Very high	91.3	Very high	39 Å²	39	76.3 Å²	76.3	21%	0.209	40%	0.403	C	S	.	.			trans	-85.5	101.9	173.6	-170.9	36.4	0	0	0	112.6	R650 I656 H663 N664 A665	R650-D661 IonicContact CZ-OD1 2.9Å; R650-D661 IonicContact NH2-OD1 2.7Å; R650-D661 PolarHBondContact NH2-OD1 2.63Å; I656-D661 HydrophobicContact CD1-CB 4.34Å; I656-D661 HydrophobicContact CG2-CB 3.87Å; D661-H663 PolarHBondContact O-N 3.17Å; D661-H663 IonicContact OD1-CD2 3.14Å; D661-N664 PolarHBondContact O-N 3.1Å; D661-A665 PolarHBondContact O-N 3.36Å
662	K	90.4	Very high	91.3	Very high	87 Å²	87	69 Å²	69	38%	0.378	37%	0.369	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.2	-11.3	174.9	69.2	-163.1	179.7	-166.9	0	116.1	F643 D647 C660	F643-K662 HydrophobicContact CB-CB 4.06Å; F643-K662 HydrophobicContact CB-CD 4.43Å; F643-K662 HydrophobicContact CD1-CB 3.65Å; F643-K662 HydrophobicContact CD2-CB 3.75Å; F643-K662 HydrophobicContact CE1-CB 3.96Å; F643-K662 HydrophobicContact CE2-CB 4.05Å; F643-K662 HydrophobicContact CG-CB 3.54Å; F643-K662 HydrophobicContact CZ-CB 4.14Å; D647-K662 VanDerWaalsContact OD1-CE 3.29Å; D647-K662 WeakPolarHBondContact OD1-CE 3.38Å; D647-K662 IonicContact OD1-NZ 3.72Å; D647-K662 PolarHBondContact OD1-NZ 3.3Å; D647-K662 IonicContact OD2-NZ 3.6Å; D647-K662 PolarHBondContact OD2-NZ 2.83Å; C660-K662 PolarHBondContact O-N 2.79Å
663	H	88.8	Confident	91.1	Very high	143 Å²	143	62.8 Å²	62.8	66%	0.662	35%	0.353	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.6	-10.2	176.8	-58.5	-63.2	0	0	0	113.7	D661	D661-H663 PolarHBondContact O-N 3.17Å; D661-H663 IonicContact OD1-CD2 3.14Å
664	N	86.8	Confident	91.1	Very high	140 Å²	140	62.5 Å²	62.5	75%	0.749	33%	0.331	S	S	*	.	T	Hydrogen-bonded Turn	trans	-136.3	-1.6	-176.3	-167.4	44.4	0	0	0	113.7	D661	D661-N664 PolarHBondContact O-N 3.1Å
665	A	82.8	Confident	91.2	Very high	33 Å²	33	60.2 Å²	60.2	27%	0.273	32%	0.32	S	S	.	.			trans	-69.6	138.4	175.9	0	0	0	0	0	112.1	M639 F643 D661	M639-A665 HydrophobicContact CE-CB 4.26Å; F643-A665 HydrophobicContact CE1-CB 3.66Å; F643-A665 HydrophobicContact CZ-CB 3.93Å; D661-A665 PolarHBondContact O-N 3.36Å
666	S	89.8	Confident	91.3	Very high	50 Å²	50	54.1 Å²	54.1	35%	0.35	29%	0.293	S	S	.	.			trans	-116	93.5	167.9	46	0	0	0	0	108.5	E668 K669 S670	S666-E668 VanDerWaalsContact C-N 3.32Å; S666-E668 PolarHBondContact O-N 3.43Å; S666-K669 PolarHBondContact O-N 2.89Å; S666-S670 WeakPolarHBondContact O-CB 3.27Å; S666-S670 PolarHBondContact O-N 2.85Å; S666-S670 PolarHBondContact O-OG 3.2Å
667	V	92.2	Very high	91.1	Very high	33 Å²	33	58.7 Å²	58.7	20%	0.2	31%	0.309	C	S	.	.	H	α-helix	trans	-59.4	-45	-167.5	178.1	0	0	0	0	110.9	T635 M639 S670 Q671	T635-V667 HydrophobicContact CG2-CG1 3.61Å; M639-V667 HydrophobicContact CE-CG2 4.24Å; M639-V667 HydrophobicContact CG-CG1 3.84Å; M639-V667 HydrophobicContact CG-CG2 4.04Å; M639-V667 HydrophobicContact SD-CG1 4.41Å; M639-V667 HydrophobicContact SD-CG2 4.43Å; V667-S670 WeakPolarHBondContact O-CB 3.32Å; V667-S670 PolarHBondContact O-N 3.2Å; V667-Q671 HydrophobicContact CG1-CG 4.47Å; V667-Q671 WeakPolarHBondContact O-CG 3.44Å; V667-Q671 PolarHBondContact O-N 3.4Å
668	E	93.7	Very high	91.4	Very high	52 Å²	52	59 Å²	59	24%	0.243	31%	0.308	C	S	.	.	H	α-helix	trans	-68.4	-43.1	-174.1	-45.8	77	-169.9	0	0	110.8	S666 S670 Q671 V672 Y708 I712	S666-E668 VanDerWaalsContact C-N 3.32Å; S666-E668 PolarHBondContact O-N 3.43Å; E668-S670 VanDerWaalsContact C-N 3.3Å; E668-S670 PolarHBondContact O-N 3.23Å; E668-Q671 PolarHBondContact O-N 2.93Å; E668-V672 WeakPolarHBondContact O-CG2 3.39Å; E668-V672 PolarHBondContact O-N 2.8Å; E668-Y708 HydrophobicContact CB-CD1 4.21Å; E668-Y708 HydrophobicContact CG-CD1 4.44Å; E668-I712 HydrophobicContact CB-CB 4.44Å; E668-I712 HydrophobicContact CB-CG1 3.54Å
669	K	91.8	Very high	91.9	Very high	99 Å²	99	54.4 Å²	54.4	43%	0.43	28%	0.277	S	S	.	.	H	α-helix	trans	-64	-36.2	173	-66.3	-178	-178.2	172.4	0	112.1	S666 G673 I712	S666-K669 PolarHBondContact O-N 2.89Å; K669-G673 PolarHBondContact O-N 3.01Å; K669-I712 HydrophobicContact CD-CG2 4.38Å; K669-I712 VanDerWaalsContact CE-CG2 3.44Å; K669-I712 HydrophobicContact CG-CD1 3.77Å; K669-I712 HydrophobicContact CG-CG1 3.84Å; K669-I712 HydrophobicContact CG-CG2 3.96Å
670	S	91.2	Very high	92.5	Very high	24 Å²	24	52.4 Å²	52.4	17%	0.168	27%	0.267	C	S	.	.	H	α-helix	trans	-69.4	-40.3	177.9	-56.5	0	0	0	0	111.5	S666 V667 E668 F674	S666-S670 WeakPolarHBondContact O-CB 3.27Å; S666-S670 PolarHBondContact O-N 2.85Å; S666-S670 PolarHBondContact O-OG 3.2Å; V667-S670 WeakPolarHBondContact O-CB 3.32Å; V667-S670 PolarHBondContact O-N 3.2Å; E668-S670 VanDerWaalsContact C-N 3.3Å; E668-S670 PolarHBondContact O-N 3.23Å; S670-F674 WeakPolarHBondContact O-CB 3.49Å; S670-F674 PolarHBondContact O-N 2.91Å
671	Q	95.9	Very high	92.8	Very high	14 Å²	14	53.4 Å²	53.4	7%	0.065	27%	0.273	C	S	.	.	H	α-helix	trans	-64.9	-47.2	174	-68.8	-47	-67.7	0	0	111.9	Y631 T635 V667 E668 G673 F674 I675 Y708	Y631-Q671 PolarHBondContact OH-OE1 3.07Å; T635-Q671 HydrophobicContact CG2-CG 3.71Å; T635-Q671 PolarHBondContact OG1-OE1 2.97Å; V667-Q671 HydrophobicContact CG1-CG 4.47Å; V667-Q671 WeakPolarHBondContact O-CG 3.44Å; V667-Q671 PolarHBondContact O-N 3.4Å; E668-Q671 PolarHBondContact O-N 2.93Å; Q671-G673 PolarHBondContact O-N 3.47Å; Q671-F674 PolarHBondContact O-N 3.39Å; Q671-I675 WeakPolarHBondContact O-CG1 3.28Å; Q671-I675 PolarHBondContact O-N 3.23Å; Q671-Y708 HydrophobicContact CB-CD1 3.93Å; Q671-Y708 HydrophobicContact CB-CD2 4.25Å; Q671-Y708 HydrophobicContact CB-CE1 4.24Å; Q671-Y708 HydrophobicContact CB-CG 3.92Å; Q671-Y708 HydrophobicContact CG-CD1 4.08Å; Q671-Y708 HydrophobicContact CG-CE1 3.87Å; Q671-Y708 HydrophobicContact CG-CE2 4.45Å; Q671-Y708 HydrophobicContact CG-CG 4.42Å
672	V	96.2	Very high	93.1	Very high	9 Å²	9	51.6 Å²	51.6	6%	0.055	26%	0.264	C	S	.	.	H	α-helix	trans	-58.3	-47.6	175.8	173.7	0	0	0	0	111.3	E668 F674 I675 D676 R705 Q709 I712	E668-V672 WeakPolarHBondContact O-CG2 3.39Å; E668-V672 PolarHBondContact O-N 2.8Å; V672-F674 VanDerWaalsContact C-N 3.34Å; V672-F674 PolarHBondContact O-N 3.12Å; V672-I675 PolarHBondContact O-N 3.36Å; V672-D676 WeakPolarHBondContact O-CB 3.45Å; V672-D676 VanDerWaalsContact O-CG 3.23Å; V672-D676 PolarHBondContact O-N 3.3Å; V672-R705 VanDerWaalsContact CG1-NH2 3.27Å; V672-Q709 HydrophobicContact CG2-CB 4.01Å; V672-I712 HydrophobicContact CG2-CD1 4.16Å
673	G	91.2	Very high	93.4	Very high	22 Å²	22	47.5 Å²	47.5	23%	0.227	25%	0.246	C	C	.	.	H	α-helix	trans	-64.8	-34.6	177.4	0	0	0	0	0	113.9	K669 Q671 Y677	K669-G673 PolarHBondContact O-N 3.01Å; Q671-G673 PolarHBondContact O-N 3.47Å; G673-Y677 WeakPolarHBondContact O-CB 3.47Å; G673-Y677 WeakPolarHBondContact O-CD2 3.35Å; G673-Y677 PolarHBondContact O-N 3.11Å; G673-Y677 VanDerWaalsContact O-N 3.1Å
674	F	95.1	Very high	93.9	Very high	65 Å²	65	45 Å²	45	29%	0.285	23%	0.234	S	C	.	.	H	α-helix	trans	-66.6	-39.3	174.3	177	-123.1	0	0	0	111.8	L621 P624 S670 Q671 V672 I678 V679	L621-F674 HydrophobicContact CD2-CE2 4.25Å; L621-F674 HydrophobicContact CD2-CZ 3.81Å; P624-F674 HydrophobicContact CG-CD1 4.28Å; P624-F674 HydrophobicContact CG-CE1 3.99Å; S670-F674 WeakPolarHBondContact O-CB 3.49Å; S670-F674 PolarHBondContact O-N 2.91Å; Q671-F674 PolarHBondContact O-N 3.39Å; V672-F674 VanDerWaalsContact C-N 3.34Å; V672-F674 PolarHBondContact O-N 3.12Å; F674-I678 HydrophobicContact CD2-CB 4.01Å; F674-I678 HydrophobicContact CD2-CG1 4.19Å; F674-I678 HydrophobicContact CD2-CG2 4.31Å; F674-I678 HydrophobicContact CE2-CB 4.16Å; F674-I678 HydrophobicContact CE2-CG2 3.94Å; F674-I678 WeakPolarHBondContact O-CB 3.4Å; F674-I678 PolarHBondContact O-N 3.3Å; F674-I678 VanDerWaalsContact O-N 3.1Å; F674-V679 HydrophobicContact CD1-CG2 3.81Å; F674-V679 HydrophobicContact CD2-CG2 4.21Å; F674-V679 HydrophobicContact CE1-CG2 3.46Å; F674-V679 VanDerWaalsContact CE1-CG2 3.46Å; F674-V679 HydrophobicContact CE2-CG2 3.89Å; F674-V679 HydrophobicContact CG-CG2 4.18Å; F674-V679 HydrophobicContact CZ-CG2 3.51Å; F674-V679 PolarHBondContact O-N 2.88Å
675	I	97.4	Very high	94.3	Very high	0 Å²	0	38.6 Å²	38.6	0%	0	20%	0.201	C	C	.	.	I	π-helix	trans	-65.8	-57	173.3	-63	167.9	0	0	0	110.4	P624 Y631 Q671 V672 Y677 V679 H680 L701 R705	P624-I675 HydrophobicContact CB-CD1 4.08Å; P624-I675 HydrophobicContact CB-CG1 3.92Å; P624-I675 HydrophobicContact CG-CG1 4.44Å; Y631-I675 HydrophobicContact CE1-CD1 4.25Å; Q671-I675 WeakPolarHBondContact O-CG1 3.28Å; Q671-I675 PolarHBondContact O-N 3.23Å; V672-I675 PolarHBondContact O-N 3.36Å; I675-Y677 VanDerWaalsContact C-N 3.28Å; I675-Y677 PolarHBondContact O-N 2.7Å; I675-V679 PolarHBondContact O-N 2.9Å; I675-H680 HydrophobicContact CG2-CB 3.98Å; I675-H680 VanDerWaalsContact O-CB 3.28Å; I675-H680 WeakPolarHBondContact O-CB 3.44Å; I675-H680 PolarHBondContact O-N 3.15Å; I675-L701 HydrophobicContact CD1-CD1 4.16Å; I675-L701 HydrophobicContact CG1-CD1 4.04Å; I675-L701 HydrophobicContact CG2-CD1 3.7Å; I675-L701 HydrophobicContact CG2-CD2 4.37Å; I675-L701 HydrophobicContact CG2-CG 3.99Å; I675-R705 HydrophobicContact CB-CG 4.14Å; I675-R705 HydrophobicContact CD1-CB 3.81Å; I675-R705 HydrophobicContact CD1-CG 4.14Å; I675-R705 HydrophobicContact CG2-CB 4.01Å; I675-R705 HydrophobicContact CG2-CG 3.78Å
676	D	96	Very high	95.1	Very high	59 Å²	59	37 Å²	37	32%	0.316	19%	0.188	S	C	.	.	I	π-helix	trans	-58.3	-34.8	-173.8	-68.5	-4.9	0	0	0	113.6	V672 R705	V672-D676 WeakPolarHBondContact O-CB 3.45Å; V672-D676 VanDerWaalsContact O-CG 3.23Å; V672-D676 PolarHBondContact O-N 3.3Å; D676-R705 IonicContact OD1-CZ 3.15Å; D676-R705 IonicContact OD1-NE 2.81Å; D676-R705 PolarHBondContact OD1-NE 3.47Å; D676-R705 IonicContact OD1-NH2 2.74Å; D676-R705 PolarHBondContact OD1-NH2 3.42Å; D676-R705 VanDerWaalsContact OD1-NH2 3.17Å; D676-R705 IonicContact OD2-CZ 2.73Å; D676-R705 IonicContact OD2-NE 2.68Å; D676-R705 IonicContact OD2-NH2 3.72Å; D676-R705 PolarHBondContact OD2-NH2 3.43Å
677	Y	90.9	Very high	95.4	Very high	144 Å²	144	35.1 Å²	35.1	57%	0.565	17%	0.174	S	C	*	.	I	π-helix	trans	-106.9	-17.5	-173.1	-62.3	-57.8	0	0	0	115.9	G673 I675	G673-Y677 WeakPolarHBondContact O-CB 3.47Å; G673-Y677 WeakPolarHBondContact O-CD2 3.35Å; G673-Y677 PolarHBondContact O-N 3.11Å; G673-Y677 VanDerWaalsContact O-N 3.1Å; I675-Y677 VanDerWaalsContact C-N 3.28Å; I675-Y677 PolarHBondContact O-N 2.7Å
678	I	94.5	Very high	95.6	Very high	36 Å²	36	38 Å²	38	19%	0.185	19%	0.189	C	C	.	.	I	π-helix	trans	-128.4	-56.9	-173.8	-55.3	-66.3	0	0	0	111.4	M575 H578 M579 L621 F674 L682	M575-I678 HydrophobicContact CE-CG2 3.92Å; H578-I678 VanDerWaalsContact CE1-CG2 3.49Å; H578-I678 WeakPolarHBondContact CE1-CG2 3.41Å; H578-I678 PolarHBondContact CE1-O 2.91Å; H578-I678 VanDerWaalsContact CE1-O 3.28Å; M579-I678 HydrophobicContact CE-CD1 3.9Å; L621-I678 HydrophobicContact CD1-CG2 4.33Å; F674-I678 HydrophobicContact CD2-CB 4.01Å; F674-I678 HydrophobicContact CD2-CG1 4.19Å; F674-I678 HydrophobicContact CD2-CG2 4.31Å; F674-I678 HydrophobicContact CE2-CB 4.16Å; F674-I678 HydrophobicContact CE2-CG2 3.94Å; F674-I678 WeakPolarHBondContact O-CB 3.4Å; F674-I678 PolarHBondContact O-N 3.3Å; F674-I678 VanDerWaalsContact O-N 3.1Å; I678-L682 WeakPolarHBondContact O-CB 3.42Å
679	V	97.6	Very high	95.7	Very high	0 Å²	0	35.6 Å²	35.6	0%	0	18%	0.178	C	C	.	.	I	π-helix	trans	-80.7	-45.3	-168.2	-176.3	0	0	0	0	112	P624 F674 I675 L682 W683 L701	P624-V679 HydrophobicContact CB-CG1 4.24Å; P624-V679 HydrophobicContact CG-CG1 4.12Å; P624-V679 HydrophobicContact CG-CG2 4.23Å; F674-V679 HydrophobicContact CD1-CG2 3.81Å; F674-V679 HydrophobicContact CD2-CG2 4.21Å; F674-V679 HydrophobicContact CE1-CG2 3.46Å; F674-V679 VanDerWaalsContact CE1-CG2 3.46Å; F674-V679 HydrophobicContact CE2-CG2 3.89Å; F674-V679 HydrophobicContact CG-CG2 4.18Å; F674-V679 HydrophobicContact CZ-CG2 3.51Å; F674-V679 PolarHBondContact O-N 2.88Å; I675-V679 PolarHBondContact O-N 2.9Å; V679-L682 PolarHBondContact O-N 3.11Å; V679-W683 PolarHBondContact O-N 3.42Å; V679-L701 HydrophobicContact CG1-CD1 4.18Å; V679-L701 HydrophobicContact CG1-CD2 4.27Å
680	H	97.2	Very high	95.9	Very high	47 Å²	47	31 Å²	31	22%	0.218	16%	0.158	C	C	.	.	H	α-helix	trans	-63.4	-48.6	177.6	-171.7	-59.4	0	0	0	112.4	I675 L682 W683 E684 L701	I675-H680 HydrophobicContact CG2-CB 3.98Å; I675-H680 VanDerWaalsContact O-CB 3.28Å; I675-H680 WeakPolarHBondContact O-CB 3.44Å; I675-H680 PolarHBondContact O-N 3.15Å; H680-L682 PolarHBondContact O-N 2.7Å; H680-L682 VanDerWaalsContact O-N 3.17Å; H680-W683 PolarHBondContact O-N 2.86Å; H680-E684 IonicContact ND1-OE2 3.45Å; H680-E684 WeakPolarHBondContact O-CB 3.47Å; H680-E684 PolarHBondContact O-N 2.92Å; H680-L701 HydrophobicContact CB-CD2 4.05Å
681	P	97.5	Very high	96	Very high	25 Å²	25	35.6 Å²	35.6	16%	0.162	18%	0.176	C	C	.	.	H	α-helix	trans	-59.9	-30.2	178.6	-25.4	36.2	0	0	0	113.8	L582 T685	L582-P681 WeakPolarHBondContact CD1-O 3.26Å; L582-P681 HydrophobicContact CD2-CB 4.14Å; P681-T685 PolarHBondContact O-N 2.84Å; P681-T685 PolarHBondContact O-OG1 3.29Å
682	L	97.5	Very high	95.9	Very high	1 Å²	1	38.8 Å²	38.8	1%	0.005	20%	0.198	C	C	.	.	H	α-helix	trans	-73.8	-54	175.5	177.4	62.1	0	0	0	111.8	L582 L585 L621 I678 V679 H680 E684 T685 W686	L582-L682 HydrophobicContact CD1-CD1 4.33Å; L585-L682 HydrophobicContact CD2-CD1 4.11Å; L621-L682 HydrophobicContact CB-CD2 4.3Å; L621-L682 HydrophobicContact CD1-CD2 3.61Å; I678-L682 WeakPolarHBondContact O-CB 3.42Å; V679-L682 PolarHBondContact O-N 3.11Å; H680-L682 PolarHBondContact O-N 2.7Å; H680-L682 VanDerWaalsContact O-N 3.17Å; L682-E684 VanDerWaalsContact C-N 3.34Å; L682-E684 PolarHBondContact O-N 3.49Å; L682-T685 PolarHBondContact O-N 3.14Å; L682-W686 PolarHBondContact O-N 3.49Å
683	W	98.5	Very high	95.8	Very high	1 Å²	1	41.1 Å²	41.1	0%	0.004	21%	0.211	C	C	.	.	H	α-helix	trans	-67.6	-32.7	-178.6	-81.9	99.2	0	0	0	113.1	W404 L477 C618 L621 T625 V679 H680 W686 A687 I697 L698 L701	W404-W683 AromaticContact CH2-CH2 3.59Å; W404-W683 HydrophobicContact CH2-CH2 3.59Å; W404-W683 AromaticContact CH2-CZ2 3.95Å; W404-W683 HydrophobicContact CH2-CZ2 3.95Å; W404-W683 AromaticContact CZ2-CH2 3.64Å; W404-W683 HydrophobicContact CZ2-CH2 3.64Å; W404-W683 AromaticContact CZ2-CZ2 3.82Å; W404-W683 HydrophobicContact CZ2-CZ2 3.82Å; L477-W683 HydrophobicContact CD1-CH2 4.14Å; L477-W683 HydrophobicContact CD2-CH2 4.06Å; L477-W683 HydrophobicContact CD2-CZ3 4.11Å; C618-W683 HydrophobicContact CB-CH2 4.1Å; C618-W683 HydrophobicContact CB-CZ2 3.84Å; C618-W683 WeakPolarHBondContact O-CZ2 3.48Å; L621-W683 PolarHBondContact O-NE1 3.09Å; T625-W683 HydrophobicContact CG2-CD2 3.98Å; T625-W683 HydrophobicContact CG2-CG 3.93Å; T625-W683 HydrophobicContact CG2-CZ2 4.32Å; V679-W683 PolarHBondContact O-N 3.42Å; H680-W683 PolarHBondContact O-N 2.86Å; W683-W686 AromaticContact CE3-CD1 3.91Å; W683-W686 HydrophobicContact CE3-CG 4.43Å; W683-W686 AromaticContact CZ3-CD1 3.81Å; W683-W686 PolarHBondContact O-N 2.86Å; W683-A687 VanDerWaalsContact O-CB 3.31Å; W683-A687 WeakPolarHBondContact O-CB 3.37Å; W683-A687 PolarHBondContact O-N 2.7Å; W683-I697 HydrophobicContact CD2-CG2 4.22Å; W683-I697 HydrophobicContact CE3-CG2 3.75Å; W683-I697 HydrophobicContact CH2-CD1 4.44Å; W683-I697 HydrophobicContact CH2-CG2 4Å; W683-I697 HydrophobicContact CZ2-CG2 4.44Å; W683-I697 HydrophobicContact CZ3-CB 4.49Å; W683-I697 HydrophobicContact CZ3-CD1 4.03Å; W683-I697 HydrophobicContact CZ3-CG2 3.65Å; W683-L698 HydrophobicContact CB-CD2 3.93Å; W683-L701 HydrophobicContact CB-CD2 4.23Å
684	E	97.7	Very high	96.1	Very high	91 Å²	91	40.2 Å²	40.2	43%	0.425	20%	0.201	S	C	.	.	H	α-helix	trans	-58.3	-49.7	170.2	179.2	-176	-158.9	0	0	110.1	H680 L682 W686 A687 D688	H680-E684 IonicContact ND1-OE2 3.45Å; H680-E684 WeakPolarHBondContact O-CB 3.47Å; H680-E684 PolarHBondContact O-N 2.92Å; L682-E684 VanDerWaalsContact C-N 3.34Å; L682-E684 PolarHBondContact O-N 3.49Å; E684-W686 PolarHBondContact O-N 3.05Å; E684-A687 PolarHBondContact O-N 3.35Å; E684-D688 WeakPolarHBondContact O-CB 3.36Å; E684-D688 PolarHBondContact O-N 2.94Å
685	T	96.7	Very high	96.2	Very high	6 Å²	6	40.9 Å²	40.9	4%	0.037	21%	0.205	C	C	.	.	H	α-helix	trans	-66.9	-36.3	178.2	-49.3	0	0	0	0	112.3	L582 L585 K586 V589 P681 L682 D688 L689	L582-T685 HydrophobicContact CD1-CG2 4.37Å; L582-T685 WeakPolarHBondContact CD1-OG1 3.37Å; L585-T685 HydrophobicContact CB-CG2 4.15Å; L585-T685 HydrophobicContact CD2-CG2 3.74Å; L585-T685 HydrophobicContact CG-CG2 3.7Å; K586-T685 HydrophobicContact CB-CG2 4.37Å; K586-T685 WeakPolarHBondContact CE-OG1 3.29Å; K586-T685 HydrophobicContact CG-CG2 3.46Å; K586-T685 VanDerWaalsContact CG-CG2 3.46Å; V589-T685 HydrophobicContact CG2-CG2 3.96Å; P681-T685 PolarHBondContact O-N 2.84Å; P681-T685 PolarHBondContact O-OG1 3.29Å; L682-T685 PolarHBondContact O-N 3.14Å; T685-D688 PolarHBondContact O-N 3.34Å; T685-L689 PolarHBondContact O-N 2.85Å
686	W	97.9	Very high	96.2	Very high	0 Å²	0	47.1 Å²	47.1	0%	0	24%	0.238	C	C	.	.	H	α-helix	trans	-65	-46.8	175	-180	-94.9	0	0	0	111.3	L477 L483 L585 V611 N614 M615 L682 W683 E684 D688 L689 V690	L477-W686 HydrophobicContact CB-CZ2 4.45Å; L477-W686 HydrophobicContact CD2-CZ2 4.32Å; L483-W686 HydrophobicContact CD1-CH2 4.09Å; L483-W686 HydrophobicContact CD1-CZ2 4.06Å; L585-W686 HydrophobicContact CD1-CE3 4.48Å; V611-W686 HydrophobicContact CG1-CH2 3.99Å; V611-W686 HydrophobicContact CG1-CZ3 4.09Å; N614-W686 HydrophobicContact CB-CZ3 4.39Å; M615-W686 HydrophobicContact CB-CH2 3.67Å; M615-W686 HydrophobicContact CB-CZ2 4.48Å; M615-W686 HydrophobicContact CB-CZ3 4Å; M615-W686 HydrophobicContact CE-CH2 3.74Å; M615-W686 HydrophobicContact CE-CZ2 4.07Å; M615-W686 HydrophobicContact CG-CH2 3.99Å; M615-W686 HydrophobicContact CG-CZ2 4.36Å; L682-W686 PolarHBondContact O-N 3.49Å; W683-W686 AromaticContact CE3-CD1 3.91Å; W683-W686 HydrophobicContact CE3-CG 4.43Å; W683-W686 AromaticContact CZ3-CD1 3.81Å; W683-W686 PolarHBondContact O-N 2.86Å; E684-W686 PolarHBondContact O-N 3.05Å; W686-D688 VanDerWaalsContact C-N 3.32Å; W686-D688 PolarHBondContact O-N 3.4Å; W686-L689 WeakPolarHBondContact O-CA 3.35Å; W686-L689 WeakPolarHBondContact O-CB 3.43Å; W686-L689 PolarHBondContact O-N 3.17Å; W686-V690 HydrophobicContact CZ2-CG1 4.17Å; W686-V690 WeakPolarHBondContact O-CG2 3.41Å; W686-V690 PolarHBondContact O-N 3.49Å
687	A	97.3	Very high	96.3	Very high	9 Å²	9	45 Å²	45	7%	0.074	23%	0.227	C	C	.	.	H	α-helix	trans	-61.8	-39.6	174.6	0	0	0	0	0	111.7	W683 E684 L689 V690 H691 A694 L698	W683-A687 VanDerWaalsContact O-CB 3.31Å; W683-A687 WeakPolarHBondContact O-CB 3.37Å; W683-A687 PolarHBondContact O-N 2.7Å; E684-A687 PolarHBondContact O-N 3.35Å; A687-L689 PolarHBondContact O-N 3.1Å; A687-V690 CarbonylContact O-C 3.2Å; A687-V690 PolarHBondContact O-N 2.71Å; A687-H691 WeakPolarHBondContact O-CA 3.44Å; A687-H691 VanDerWaalsContact O-CB 3.3Å; A687-H691 WeakPolarHBondContact O-CB 3.48Å; A687-H691 PolarHBondContact O-N 3.44Å; A687-A694 HydrophobicContact CB-CB 3.97Å; A687-L698 HydrophobicContact CB-CD1 3.52Å; A687-L698 HydrophobicContact CB-CG 4.1Å
688	D	96.2	Very high	96.6	Very high	94 Å²	94	39.1 Å²	39.1	50%	0.503	21%	0.205	S	C	.	.	H	α-helix	trans	-61.5	-31.3	172.9	-117.5	1.9	0	0	0	112.3	V589 K592 E684 T685 W686	V589-D688 HydrophobicContact CG1-CB 4.01Å; V589-D688 HydrophobicContact CG2-CB 4.35Å; K592-D688 PolarHBondContact NZ-O 3.29Å; E684-D688 WeakPolarHBondContact O-CB 3.36Å; E684-D688 PolarHBondContact O-N 2.94Å; T685-D688 PolarHBondContact O-N 3.34Å; W686-D688 VanDerWaalsContact C-N 3.32Å; W686-D688 PolarHBondContact O-N 3.4Å
689	L	95	Very high	96.8	Very high	2 Å²	2	41 Å²	41	1%	0.01	22%	0.216	C	C	.	.	H	α-helix	trans	-70.2	-53.7	173.2	-177.5	61.1	0	0	0	111.1	L585 M588 V589 K592 L600 V611 T685 W686 A687	L585-L689 HydrophobicContact CD1-CD2 3.79Å; M588-L689 HydrophobicContact CG-CD1 4.48Å; M588-L689 HydrophobicContact SD-CD2 4.49Å; V589-L689 HydrophobicContact CG2-CB 3.83Å; V589-L689 HydrophobicContact CG2-CD1 4.32Å; K592-L689 HydrophobicContact CB-CD1 4.37Å; K592-L689 HydrophobicContact CD-CD1 4.21Å; K592-L689 PolarHBondContact NZ-O 2.95Å; L600-L689 HydrophobicContact CD1-CD1 3.97Å; L600-L689 HydrophobicContact CD1-CG 3.83Å; L600-L689 HydrophobicContact CD2-CD1 3.93Å; V611-L689 HydrophobicContact CG2-CD2 4.22Å; T685-L689 PolarHBondContact O-N 2.85Å; W686-L689 WeakPolarHBondContact O-CA 3.35Å; W686-L689 WeakPolarHBondContact O-CB 3.43Å; W686-L689 PolarHBondContact O-N 3.17Å; A687-L689 PolarHBondContact O-N 3.1Å
690	V	95.8	Very high	96.9	Very high	1 Å²	1	43 Å²	43	1%	0.006	23%	0.228	C	C	.	.	H	α-helix	trans	-96.7	14	-171.8	-53	0	0	0	0	115.1	T480 A482 L483 L600 W686 A687 D693 A694	T480-V690 HydrophobicContact CG2-CB 3.71Å; T480-V690 HydrophobicContact CG2-CG1 3.99Å; T480-V690 HydrophobicContact CG2-CG2 3.95Å; A482-V690 HydrophobicContact CB-CB 3.97Å; A482-V690 HydrophobicContact CB-CG1 4.41Å; L483-V690 HydrophobicContact CD1-CG1 4.19Å; L483-V690 HydrophobicContact CG-CG1 4.33Å; L600-V690 HydrophobicContact CD1-CG1 4.22Å; W686-V690 HydrophobicContact CZ2-CG1 4.17Å; W686-V690 WeakPolarHBondContact O-CG2 3.41Å; W686-V690 PolarHBondContact O-N 3.49Å; A687-V690 CarbonylContact O-C 3.2Å; A687-V690 PolarHBondContact O-N 2.71Å; V690-D693 HydrophobicContact CG2-CB 4.3Å; V690-D693 WeakPolarHBondContact O-CB 3.43Å; V690-D693 PolarHBondContact O-N 2.94Å; V690-A694 HydrophobicContact CG2-CB 3.94Å
691	H	93.4	Very high	96.9	Very high	122 Å²	122	40.8 Å²	40.8	57%	0.565	22%	0.218	S	C	*	.	T	Hydrogen-bonded Turn	trans	-49.6	128.9	-174.6	179.8	88.3	0	0	0	112.9	A687	A687-H691 WeakPolarHBondContact O-CA 3.44Å; A687-H691 VanDerWaalsContact O-CB 3.3Å; A687-H691 WeakPolarHBondContact O-CB 3.48Å; A687-H691 PolarHBondContact O-N 3.44Å
692	P	94.5	Very high	97	Very high	81 Å²	81	44.6 Å²	44.6	53%	0.526	23%	0.233	S	C	.	.	T	Hydrogen-bonded Turn	cis	-94.8	1.5	13.4	38.2	-37.2	0	0	0	115.7	A694 Q695	P692-A694 PolarHBondContact O-N 2.85Å; P692-Q695 PolarHBondContact O-N 3.27Å; P692-Q695 VanDerWaalsContact O-N 3.16Å
693	D	94.9	Very high	97	Very high	58 Å²	58	50.5 Å²	50.5	31%	0.31	27%	0.265	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.2	-12.3	-153.4	-58.5	-17.8	0	0	0	116.8	T480 P481 A482 V690	T480-D693 HydrophobicContact CG2-CB 3.67Å; T480-D693 VanDerWaalsContact CG2-OD2 3.24Å; T480-D693 WeakPolarHBondContact CG2-OD2 3.35Å; P481-D693 WeakPolarHBondContact CB-OD2 3.46Å; P481-D693 VanDerWaalsContact CD-OD2 3.23Å; P481-D693 WeakPolarHBondContact CD-OD2 3.33Å; A482-D693 WeakPolarHBondContact CB-OD2 3.44Å; A482-D693 PolarHBondContact N-OD2 3.48Å; V690-D693 HydrophobicContact CG2-CB 4.3Å; V690-D693 WeakPolarHBondContact O-CB 3.43Å; V690-D693 PolarHBondContact O-N 2.94Å
694	A	96.5	Very high	97	Very high	3 Å²	3	50.8 Å²	50.8	3%	0.025	27%	0.266	C	S	.	.	T	Hydrogen-bonded Turn	trans	-112.6	12.8	-177.7	0	0	0	0	0	113.9	A687 V690 P692 D696 I697 L698	A687-A694 HydrophobicContact CB-CB 3.97Å; V690-A694 HydrophobicContact CG2-CB 3.94Å; P692-A694 PolarHBondContact O-N 2.85Å; A694-D696 PolarHBondContact O-N 3.06Å; A694-I697 HydrophobicContact CB-CD1 4.38Å; A694-I697 WeakPolarHBondContact O-CB 3.41Å; A694-I697 PolarHBondContact O-N 3.34Å; A694-I697 VanDerWaalsContact O-N 3.16Å; A694-L698 PolarHBondContact O-N 2.7Å
695	Q	97.1	Very high	97	Very high	79 Å²	79	48.1 Å²	48.1	37%	0.369	25%	0.252	S	S	.	.	H	α-helix	trans	-59.8	-48.7	-177.3	-168.9	63.5	58.2	0	0	112.5	P692 I697 L698 D699	P692-Q695 PolarHBondContact O-N 3.27Å; P692-Q695 VanDerWaalsContact O-N 3.16Å; Q695-I697 PolarHBondContact O-N 2.94Å; Q695-L698 WeakPolarHBondContact O-CA 3.49Å; Q695-L698 WeakPolarHBondContact O-CB 3.23Å; Q695-L698 PolarHBondContact O-N 2.87Å; Q695-D699 PolarHBondContact NE2-OD1 3.49Å; Q695-D699 PolarHBondContact O-N 3.4Å
696	D	97.2	Very high	97.1	Very high	130 Å²	130	52.8 Å²	52.8	70%	0.695	27%	0.274	S	S	*	.	H	α-helix	trans	-56	-27.4	177.9	-58.2	-15.7	0	0	0	113.1	A694 T700	A694-D696 PolarHBondContact O-N 3.06Å; D696-T700 WeakPolarHBondContact O-CB 3.4Å; D696-T700 PolarHBondContact O-N 2.86Å; D696-T700 VanDerWaalsContact O-N 3.1Å; D696-T700 PolarHBondContact O-OG1 3.35Å
697	I	98.3	Very high	97.1	Very high	16 Å²	16	56.7 Å²	56.7	8%	0.082	29%	0.289	C	S	.	.	H	α-helix	trans	-77.5	-36.5	179.1	-53.8	-178.6	0	0	0	110.7	W404 T625 W683 A694 Q695 L701	W404-I697 HydrophobicContact CD2-CD1 4.16Å; W404-I697 HydrophobicContact CG-CD1 4.38Å; W404-I697 HydrophobicContact CG-CG1 4.38Å; W404-I697 HydrophobicContact CZ2-CG2 4.29Å; T625-I697 VanDerWaalsContact CB-CG2 3.41Å; T625-I697 HydrophobicContact CG2-CG2 3.9Å; T625-I697 WeakPolarHBondContact OG1-CG2 3.42Å; W683-I697 HydrophobicContact CD2-CG2 4.22Å; W683-I697 HydrophobicContact CE3-CG2 3.75Å; W683-I697 HydrophobicContact CH2-CD1 4.44Å; W683-I697 HydrophobicContact CH2-CG2 4Å; W683-I697 HydrophobicContact CZ2-CG2 4.44Å; W683-I697 HydrophobicContact CZ3-CB 4.49Å; W683-I697 HydrophobicContact CZ3-CD1 4.03Å; W683-I697 HydrophobicContact CZ3-CG2 3.65Å; A694-I697 HydrophobicContact CB-CD1 4.38Å; A694-I697 WeakPolarHBondContact O-CB 3.41Å; A694-I697 PolarHBondContact O-N 3.34Å; A694-I697 VanDerWaalsContact O-N 3.16Å; Q695-I697 PolarHBondContact O-N 2.94Å; I697-L701 WeakPolarHBondContact O-CB 3.41Å; I697-L701 PolarHBondContact O-N 2.99Å; I697-L701 VanDerWaalsContact O-N 3.15Å
698	L	98	Very high	97.1	Very high	19 Å²	19	56.7 Å²	56.7	10%	0.099	29%	0.286	C	S	.	.	H	α-helix	trans	-70.5	-45.3	170.8	-76.3	-179.6	0	0	0	112	W683 A687 A694 Q695 T700 L701 E702	W683-L698 HydrophobicContact CB-CD2 3.93Å; A687-L698 HydrophobicContact CB-CD1 3.52Å; A687-L698 HydrophobicContact CB-CG 4.1Å; A694-L698 PolarHBondContact O-N 2.7Å; Q695-L698 WeakPolarHBondContact O-CA 3.49Å; Q695-L698 WeakPolarHBondContact O-CB 3.23Å; Q695-L698 PolarHBondContact O-N 2.87Å; L698-T700 VanDerWaalsContact C-N 3.27Å; L698-T700 PolarHBondContact O-N 3.21Å; L698-L701 HydrophobicContact CD2-CD2 4.46Å; L698-L701 CarbonylContact O-C 3.58Å; L698-L701 WeakPolarHBondContact O-CA 3.32Å; L698-L701 VanDerWaalsContact O-CB 3.29Å; L698-L701 WeakPolarHBondContact O-CB 3.49Å; L698-L701 PolarHBondContact O-N 2.87Å; L698-E702 PolarHBondContact O-N 2.82Å
699	D	98.3	Very high	97.1	Very high	77 Å²	77	55 Å²	55	41%	0.412	28%	0.276	S	S	.	.	H	α-helix	trans	-59.2	-42.3	179.1	-66	12	0	0	0	110.1	Q695 L701 E702 D703	Q695-D699 PolarHBondContact NE2-OD1 3.49Å; Q695-D699 PolarHBondContact O-N 3.4Å; D699-L701 VanDerWaalsContact C-N 3.33Å; D699-L701 PolarHBondContact O-N 3.01Å; D699-E702 PolarHBondContact O-N 3.43Å; D699-D703 PolarHBondContact O-N 3.18Å
700	T	98.4	Very high	97.2	Very high	42 Å²	42	59.1 Å²	59.1	26%	0.258	31%	0.305	S	S	.	.	H	α-helix	trans	-64.1	-33.9	172.9	-56.9	0	0	0	0	112.8	T625 D696 L698 N704	T625-T700 WeakPolarHBondContact O-CG2 3.39Å; D696-T700 WeakPolarHBondContact O-CB 3.4Å; D696-T700 PolarHBondContact O-N 2.86Å; D696-T700 VanDerWaalsContact O-N 3.1Å; D696-T700 PolarHBondContact O-OG1 3.35Å; L698-T700 VanDerWaalsContact C-N 3.27Å; L698-T700 PolarHBondContact O-N 3.21Å; T700-N704 VanDerWaalsContact O-CB 3.26Å; T700-N704 WeakPolarHBondContact O-CB 3.16Å; T700-N704 VanDerWaalsContact O-CG 3.23Å; T700-N704 PolarHBondContact O-N 2.97Å; T700-N704 PolarHBondContact O-ND2 2.94Å
701	L	98.6	Very high	97.1	Very high	0 Å²	0	61.6 Å²	61.6	0%	0	32%	0.32	C	S	.	.	H	α-helix	trans	-69.4	-43.4	176.5	-178.2	58.7	0	0	0	111.7	P624 T625 I675 V679 H680 W683 I697 L698 D699 N704 R705	P624-L701 HydrophobicContact CB-CD1 3.58Å; P624-L701 WeakPolarHBondContact O-CD1 3.27Å; T625-L701 HydrophobicContact CG2-CB 4.1Å; T625-L701 HydrophobicContact CG2-CD1 4.08Å; T625-L701 HydrophobicContact CG2-CD2 4.16Å; T625-L701 HydrophobicContact CG2-CG 4.34Å; I675-L701 HydrophobicContact CD1-CD1 4.16Å; I675-L701 HydrophobicContact CG1-CD1 4.04Å; I675-L701 HydrophobicContact CG2-CD1 3.7Å; I675-L701 HydrophobicContact CG2-CD2 4.37Å; I675-L701 HydrophobicContact CG2-CG 3.99Å; V679-L701 HydrophobicContact CG1-CD1 4.18Å; V679-L701 HydrophobicContact CG1-CD2 4.27Å; H680-L701 HydrophobicContact CB-CD2 4.05Å; W683-L701 HydrophobicContact CB-CD2 4.23Å; I697-L701 WeakPolarHBondContact O-CB 3.41Å; I697-L701 PolarHBondContact O-N 2.99Å; I697-L701 VanDerWaalsContact O-N 3.15Å; L698-L701 HydrophobicContact CD2-CD2 4.46Å; L698-L701 CarbonylContact O-C 3.58Å; L698-L701 WeakPolarHBondContact O-CA 3.32Å; L698-L701 VanDerWaalsContact O-CB 3.29Å; L698-L701 WeakPolarHBondContact O-CB 3.49Å; L698-L701 PolarHBondContact O-N 2.87Å; D699-L701 VanDerWaalsContact C-N 3.33Å; D699-L701 PolarHBondContact O-N 3.01Å; L701-N704 PolarHBondContact O-N 2.86Å; L701-R705 WeakPolarHBondContact O-CB 3.32Å; L701-R705 PolarHBondContact O-N 3.37Å
702	E	98.3	Very high	97	Very high	104 Å²	104	57.5 Å²	57.5	49%	0.486	30%	0.302	S	S	.	.	H	α-helix	trans	-62.4	-47.6	175.3	-70.5	-170.3	-161.1	0	0	111.1	L698 D699 N704 R705 E706	L698-E702 PolarHBondContact O-N 2.82Å; D699-E702 PolarHBondContact O-N 3.43Å; E702-N704 PolarHBondContact O-N 3.26Å; E702-R705 WeakPolarHBondContact O-CB 3.2Å; E702-R705 PolarHBondContact O-N 3.27Å; E702-E706 PolarHBondContact O-N 2.83Å
703	D	98.5	Very high	96.6	Very high	126 Å²	126	57.6 Å²	57.6	67%	0.674	30%	0.302	S	S	*	.	H	α-helix	trans	-58.4	-45.7	175.9	-95.5	-7.8	0	0	0	112.2	D699 E706 W707	D699-D703 PolarHBondContact O-N 3.18Å; D703-E706 PolarHBondContact O-N 2.98Å; D703-W707 WeakPolarHBondContact O-CB 3.33Å; D703-W707 PolarHBondContact O-N 2.92Å
704	N	98.6	Very high	95.7	Very high	6 Å²	6	63.9 Å²	63.9	3%	0.032	33%	0.33	C	S	.	.	H	α-helix	trans	-65.1	-38.7	176.8	-81.3	-25.5	0	0	0	112.1	P624 K626 L628 Y631 T700 L701 E702 W707 Y708	P624-N704 PolarHBondContact O-ND2 3.27Å; K626-N704 PolarHBondContact O-ND2 3.24Å; L628-N704 WeakPolarHBondContact CA-OD1 3.46Å; L628-N704 WeakPolarHBondContact CB-OD1 3.49Å; L628-N704 WeakPolarHBondContact CD1-OD1 3.2Å; Y631-N704 HydrophobicContact CD1-CB 3.82Å; Y631-N704 HydrophobicContact CE1-CB 3.99Å; T700-N704 VanDerWaalsContact O-CB 3.26Å; T700-N704 WeakPolarHBondContact O-CB 3.16Å; T700-N704 VanDerWaalsContact O-CG 3.23Å; T700-N704 PolarHBondContact O-N 2.97Å; T700-N704 PolarHBondContact O-ND2 2.94Å; L701-N704 PolarHBondContact O-N 2.86Å; E702-N704 PolarHBondContact O-N 3.26Å; N704-W707 PolarHBondContact O-N 3.29Å; N704-Y708 WeakPolarHBondContact O-CD2 3.48Å; N704-Y708 PolarHBondContact O-N 3.3Å
705	R	98.2	Very high	94	Very high	36 Å²	36	67.9 Å²	67.9	14%	0.136	36%	0.358	C	S	.	.	H	α-helix	trans	-64.2	-46.2	177.4	-173.7	-92	-179.4	-138.4	-10.4	111	V672 I675 D676 L701 E702 Y708 Q709	V672-R705 VanDerWaalsContact CG1-NH2 3.27Å; I675-R705 HydrophobicContact CB-CG 4.14Å; I675-R705 HydrophobicContact CD1-CB 3.81Å; I675-R705 HydrophobicContact CD1-CG 4.14Å; I675-R705 HydrophobicContact CG2-CB 4.01Å; I675-R705 HydrophobicContact CG2-CG 3.78Å; D676-R705 IonicContact OD1-CZ 3.15Å; D676-R705 IonicContact OD1-NE 2.81Å; D676-R705 PolarHBondContact OD1-NE 3.47Å; D676-R705 IonicContact OD1-NH2 2.74Å; D676-R705 PolarHBondContact OD1-NH2 3.42Å; D676-R705 VanDerWaalsContact OD1-NH2 3.17Å; D676-R705 IonicContact OD2-CZ 2.73Å; D676-R705 IonicContact OD2-NE 2.68Å; D676-R705 IonicContact OD2-NH2 3.72Å; D676-R705 PolarHBondContact OD2-NH2 3.43Å; L701-R705 WeakPolarHBondContact O-CB 3.32Å; L701-R705 PolarHBondContact O-N 3.37Å; E702-R705 WeakPolarHBondContact O-CB 3.2Å; E702-R705 PolarHBondContact O-N 3.27Å; R705-Y708 PolarHBondContact O-N 3.22Å; R705-Q709 WeakPolarHBondContact O-CB 3.27Å; R705-Q709 PolarHBondContact O-N 3.02Å
706	E	97.9	Very high	91.8	Very high	104 Å²	104	70.1 Å²	70.1	49%	0.486	38%	0.379	S	S	.	.	H	α-helix	trans	-67.8	-34	175.4	-73.3	-54.4	106.7	0	0	112.4	E702 D703 Q709 S710	E702-E706 PolarHBondContact O-N 2.83Å; D703-E706 PolarHBondContact O-N 2.98Å; E706-Q709 PolarHBondContact O-N 3.41Å; E706-S710 WeakPolarHBondContact O-CB 3.47Å; E706-S710 PolarHBondContact O-N 3.14Å
707	W	98.2	Very high	89.1	Confident	82 Å²	82	69 Å²	69	31%	0.311	38%	0.382	S	S	.	.	H	α-helix	trans	-61	-48.1	172.4	-172.1	87.6	0	0	0	111.9	L628 R632 D703 N704 S710 T711	L628-W707 HydrophobicContact CD1-CB 4.38Å; L628-W707 HydrophobicContact CD1-CD2 3.83Å; L628-W707 HydrophobicContact CD1-CE3 3.74Å; L628-W707 HydrophobicContact CD1-CG 4.09Å; L628-W707 HydrophobicContact CD1-CZ3 4.39Å; L628-W707 HydrophobicContact CD2-CB 4.37Å; L628-W707 HydrophobicContact CD2-CD2 3.76Å; L628-W707 HydrophobicContact CD2-CE3 4.47Å; L628-W707 HydrophobicContact CD2-CG 3.65Å; L628-W707 HydrophobicContact CG-CD2 4.4Å; R632-W707 HydrophobicContact CG-CH2 4.34Å; R632-W707 HydrophobicContact CG-CZ3 4.13Å; D703-W707 WeakPolarHBondContact O-CB 3.33Å; D703-W707 PolarHBondContact O-N 2.92Å; N704-W707 PolarHBondContact O-N 3.29Å; W707-S710 PolarHBondContact O-N 2.8Å; W707-S710 PolarHBondContact O-OG 2.99Å; W707-T711 HydrophobicContact CD2-CG2 4.26Å; W707-T711 HydrophobicContact CE3-CG2 4.37Å; W707-T711 HydrophobicContact CH2-CG2 3.92Å; W707-T711 HydrophobicContact CZ2-CG2 3.8Å; W707-T711 HydrophobicContact CZ3-CG2 4.21Å; W707-T711 PolarHBondContact O-N 3.26Å; W707-T711 PolarHBondContact O-OG1 3.39Å; W707-T711 VanDerWaalsContact O-OG1 3.1Å
708	Y	97.2	Very high	86.6	Confident	8 Å²	8	74.2 Å²	74.2	3%	0.031	42%	0.416	C	S	.	.	H	α-helix	trans	-65.7	-38.5	175.1	-87.4	-74.7	0	0	0	112.2	Y631 T635 E668 Q671 N704 R705 S710 T711 I712	Y631-Y708 HydrophobicContact CD1-CD2 4.26Å; Y631-Y708 AromaticContact CD1-CE2 3.72Å; Y631-Y708 HydrophobicContact CD1-CE2 3.72Å; Y631-Y708 AromaticContact CE1-CD2 3.58Å; Y631-Y708 HydrophobicContact CE1-CD2 3.58Å; Y631-Y708 AromaticContact CE1-CE2 3.32Å; Y631-Y708 HydrophobicContact CE1-CE2 3.32Å; Y631-Y708 HydrophobicContact CE2-CE2 4.44Å; Y631-Y708 HydrophobicContact CG-CE2 4.44Å; Y631-Y708 AromaticContact CZ-CE2 3.71Å; T635-Y708 WeakPolarHBondContact CB-OH 3.4Å; T635-Y708 HydrophobicContact CG2-CE1 4.39Å; T635-Y708 PolarHBondContact OG1-OH 3.27Å; T635-Y708 VanDerWaalsContact OG1-OH 3.13Å; E668-Y708 HydrophobicContact CB-CD1 4.21Å; E668-Y708 HydrophobicContact CG-CD1 4.44Å; Q671-Y708 HydrophobicContact CB-CD1 3.93Å; Q671-Y708 HydrophobicContact CB-CD2 4.25Å; Q671-Y708 HydrophobicContact CB-CE1 4.24Å; Q671-Y708 HydrophobicContact CB-CG 3.92Å; Q671-Y708 HydrophobicContact CG-CD1 4.08Å; Q671-Y708 HydrophobicContact CG-CE1 3.87Å; Q671-Y708 HydrophobicContact CG-CE2 4.45Å; Q671-Y708 HydrophobicContact CG-CG 4.42Å; N704-Y708 WeakPolarHBondContact O-CD2 3.48Å; N704-Y708 PolarHBondContact O-N 3.3Å; R705-Y708 PolarHBondContact O-N 3.22Å; Y708-S710 VanDerWaalsContact C-N 3.28Å; Y708-S710 PolarHBondContact O-N 3.18Å; Y708-T711 WeakPolarHBondContact CA-OG1 3.47Å; Y708-T711 PolarHBondContact O-N 3.48Å; Y708-T711 PolarHBondContact O-OG1 2.99Å; Y708-T711 VanDerWaalsContact O-OG1 3.07Å; Y708-I712 PolarHBondContact O-N 3.36Å
709	Q	96.4	Very high	84.2	Confident	59 Å²	59	77.2 Å²	77.2	28%	0.276	44%	0.444	S	S	.	.	H	α-helix	trans	-60.6	-36.2	173.6	176.9	60.6	87.9	0	0	112.4	V672 R705 E706	V672-Q709 HydrophobicContact CG2-CB 4.01Å; R705-Q709 WeakPolarHBondContact O-CB 3.27Å; R705-Q709 PolarHBondContact O-N 3.02Å; E706-Q709 PolarHBondContact O-N 3.41Å
710	S	96.2	Very high	82	Confident	89 Å²	89	79.4 Å²	79.4	62%	0.622	46%	0.462	S	S	*	.	H	α-helix	trans	-74.8	-24.2	178.6	80	0	0	0	0	114.1	E706 W707 Y708	E706-S710 WeakPolarHBondContact O-CB 3.47Å; E706-S710 PolarHBondContact O-N 3.14Å; W707-S710 PolarHBondContact O-N 2.8Å; W707-S710 PolarHBondContact O-OG 2.99Å; Y708-S710 VanDerWaalsContact C-N 3.28Å; Y708-S710 PolarHBondContact O-N 3.18Å
711	T	94.4	Very high	79.8	Confident	52 Å²	52	85 Å²	85	32%	0.319	49%	0.491	S	S	.	.	H	α-helix	trans	-92.5	-9.8	-177.6	48.3	0	0	0	0	114.1	W707 Y708 P713	W707-T711 HydrophobicContact CD2-CG2 4.26Å; W707-T711 HydrophobicContact CE3-CG2 4.37Å; W707-T711 HydrophobicContact CH2-CG2 3.92Å; W707-T711 HydrophobicContact CZ2-CG2 3.8Å; W707-T711 HydrophobicContact CZ3-CG2 4.21Å; W707-T711 PolarHBondContact O-N 3.26Å; W707-T711 PolarHBondContact O-OG1 3.39Å; W707-T711 VanDerWaalsContact O-OG1 3.1Å; Y708-T711 WeakPolarHBondContact CA-OG1 3.47Å; Y708-T711 PolarHBondContact O-N 3.48Å; Y708-T711 PolarHBondContact O-OG1 2.99Å; Y708-T711 VanDerWaalsContact O-OG1 3.07Å; T711-P713 WeakPolarHBondContact O-CD 3.45Å
712	I	92	Very high	77.3	Confident	36 Å²	36	92.7 Å²	92.7	19%	0.185	53%	0.532	C	S	.	.	S	Bend	trans	-53.3	121.4	174	-73.8	165.2	0	0	0	110.5	E668 K669 V672 Y708 Q714	E668-I712 HydrophobicContact CB-CB 4.44Å; E668-I712 HydrophobicContact CB-CG1 3.54Å; K669-I712 HydrophobicContact CD-CG2 4.38Å; K669-I712 VanDerWaalsContact CE-CG2 3.44Å; K669-I712 HydrophobicContact CG-CD1 3.77Å; K669-I712 HydrophobicContact CG-CG1 3.84Å; K669-I712 HydrophobicContact CG-CG2 3.96Å; V672-I712 HydrophobicContact CG2-CD1 4.16Å; Y708-I712 PolarHBondContact O-N 3.36Å; I712-Q714 PolarHBondContact O-N 3.08Å
713	P	86.2	Confident	74.7	Confident	83 Å²	83	93.1 Å²	93.1	54%	0.539	54%	0.543	S	S	.	.	P	Polyproline II helix	trans	-58.3	129.4	176.3	-26.5	35.3	0	0	0	111.8	T711 S715	T711-P713 WeakPolarHBondContact O-CD 3.45Å; P713-S715 PolarHBondContact O-N 3.21Å
714	Q	75	Confident	72.1	Confident	190 Å²	190	96 Å²	96	89%	0.888	55%	0.553	S	S	*	*	P	Polyproline II helix	trans	-60.5	122.7	170.9	-66.3	-173.8	6.3	0	0	108.8	I712	I712-Q714 PolarHBondContact O-N 3.08Å
715	S	60.4	Low	69.4	Low	87 Å²	87	104.6 Å²	104.6	61%	0.608	59%	0.593	S	S	*	*	P	Polyproline II helix	trans	-54.4	131.2	174.5	-57.7	0	0	0	0	109.2	P713 S717	P713-S715 PolarHBondContact O-N 3.21Å; S715-S717 PolarHBondContact O-N 3.35Å; S715-S717 VanDerWaalsContact O-N 3.13Å
716	P	52.2	Low	66.3	Low	126 Å²	126	106.7 Å²	106.7	82%	0.818	63%	0.626	S	S	*	*	P	Polyproline II helix	trans	-57.6	124.1	177.4	24.1	-33.1	0	0	0	108.7
717	S	40.7	Very low	63.5	Low	108 Å²	108	113.6 Å²	113.6	76%	0.755	65%	0.647	S	S	*	*	P	Polyproline II helix	trans	-56.6	139	178.3	-50.4	0	0	0	0	109.4	S715 A719	S715-S717 PolarHBondContact O-N 3.35Å; S715-S717 VanDerWaalsContact O-N 3.13Å; S717-A719 PolarHBondContact O-N 3.05Å
718	P	44.3	Very low	60.4	Low	124 Å²	124	119.7 Å²	119.7	81%	0.805	68%	0.679	S	S	*	*	P	Polyproline II helix	trans	-56.1	130	175.1	24.6	-33.2	0	0	0	108.7
719	A	48.4	Very low	57.4	Low	82 Å²	82	122.5 Å²	122.5	68%	0.678	71%	0.711	S	S	*	*	P	Polyproline II helix	trans	-59.6	140.4	175.7	0	0	0	0	0	109.1	S717 D721	S717-A719 PolarHBondContact O-N 3.05Å; A719-D721 PolarHBondContact O-N 2.75Å
720	P	52.6	Low	54.3	Low	123 Å²	123	129.4 Å²	129.4	80%	0.799	74%	0.743	S	S	*	*	P	Polyproline II helix	trans	-61.4	131.9	175.8	26.7	-33.7	0	0	0	109.6	D722	P720-D722 PolarHBondContact O-N 2.78Å; P720-D722 VanDerWaalsContact O-N 3.13Å
721	D	51.9	Low	51.4	Low	161 Å²	161	131.4 Å²	131.4	86%	0.861	75%	0.751	S	S	*	*			trans	-64.1	111	178.1	-70	-68.3	0	0	0	110.7	A719 P723	A719-D721 PolarHBondContact O-N 2.75Å; D721-P723 WeakPolarHBondContact O-CD 3.32Å
722	D	46.4	Very low	48.5	Very low	161 Å²	161	137.5 Å²	137.5	86%	0.861	78%	0.776	S	S	*	*			trans	-68.3	119.8	166.7	-98.7	-37.5	0	0	0	109.4	P720 E724	P720-D722 PolarHBondContact O-N 2.78Å; P720-D722 VanDerWaalsContact O-N 3.13Å; D722-E724 PolarHBondContact O-N 3.49Å
723	P	43	Very low	45.8	Very low	112 Å²	112	145.3 Å²	145.3	73%	0.727	81%	0.809	S	S	*	*			trans	-98.5	93.1	-172.6	35.7	-31.3	0	0	0	112.6	D721	D721-P723 WeakPolarHBondContact O-CD 3.32Å
724	E	44	Very low	43.1	Very low	188 Å²	188	150.8 Å²	150.8	88%	0.879	83%	0.825	S	S	*	*			trans	-165.5	166.5	149.2	-118.3	164.5	-157.7	0	0	117.2	D722	D722-E724 PolarHBondContact O-N 3.49Å
725	E	41.1	Very low	40.9	Very low	185 Å²	185	150.4 Å²	150.4	86%	0.864	82%	0.823	S	S	*	*			trans	50.6	96.5	170.6	-60.1	-153.6	148.4	0	0	119.6
726	G	34.2	Very low	39.4	Very low	80 Å²	80	155 Å²	155	83%	0.825	83%	0.832	S	S	*	*			trans	-79.9	149.4	177.2	0	0	0	0	0	115.7
727	R	38.1	Very low	38.4	Very low	249 Å²	249	157 Å²	157	94%	0.94	83%	0.831	S	S	*	*			trans	-125.6	135.3	158	-81.7	-172.9	170.7	-168.9	-1.6	110.8	G729	R727-G729 PolarHBondContact O-N 2.7Å
728	Q	33.9	Very low	37.9	Very low	210 Å²	210	158.8 Å²	158.8	98%	0.981	83%	0.831	S	S	*	*			trans	-70.5	118.4	172.8	-67.8	170.7	-21.6	0	0	109.6
729	G	34.8	Very low	37.3	Very low	67 Å²	67	158.1 Å²	158.1	69%	0.691	83%	0.825	S	S	*	*			trans	-148	125.9	173.9	0	0	0	0	0	109.3	R727 T731	R727-G729 PolarHBondContact O-N 2.7Å; G729-T731 PolarHBondContact O-N 3.49Å
730	Q	31.2	Very low	36.6	Very low	204 Å²	204	161 Å²	161	95%	0.953	83%	0.828	S	S	*	*			trans	-78.1	119.1	-178.9	-68.2	173.2	-60.4	0	0	109.9
731	T	34.8	Very low	35.7	Very low	131 Å²	131	163.3 Å²	163.3	80%	0.804	83%	0.828	S	S	*	*			trans	-150.6	128.7	166.2	-44.9	0	0	0	0	107.9	G729 K733	G729-T731 PolarHBondContact O-N 3.49Å; T731-K733 PolarHBondContact O-N 2.74Å
732	E	33.6	Very low	35	Very low	181 Å²	181	163.8 Å²	163.8	85%	0.846	83%	0.825	S	S	*	*			trans	-76.4	86.3	-171.5	-64.3	179.1	150.2	0	0	111.3	F734	E732-F734 PolarHBondContact O-N 2.83Å
733	K	35.1	Very low	34.5	Very low	200 Å²	200	164.1 Å²	164.1	87%	0.87	83%	0.827	S	S	*	*			trans	-72.4	108.7	163.8	-88.5	-170.3	172.4	-175.6	0	109.2	T731 Q735	T731-K733 PolarHBondContact O-N 2.74Å; K733-Q735 PolarHBondContact O-N 2.8Å
734	F	30.5	Very low	34.1	Very low	197 Å²	197	161.4 Å²	161.4	86%	0.864	82%	0.819	S	S	*	*			trans	-64.3	112.6	161.3	-83.3	-96.2	0	0	0	109	E732	E732-F734 PolarHBondContact O-N 2.83Å
735	Q	28.7	Very low	33.8	Very low	183 Å²	183	162.2 Å²	162.2	86%	0.855	82%	0.823	S	S	*	*			trans	-99.8	112.5	173	-176	170.9	-3.3	0	0	108	K733	K733-Q735 PolarHBondContact O-N 2.8Å
736	F	28.8	Very low	33.6	Very low	184 Å²	184	158.1 Å²	158.1	81%	0.807	81%	0.814	S	S	*	*			trans	-91.1	107.1	175.8	-130.7	-82.8	0	0	0	108.7	L738	F736-L738 PolarHBondContact O-N 3.06Å
737	E	30.4	Very low	33.9	Very low	168 Å²	168	162.2 Å²	162.2	79%	0.785	82%	0.818	S	S	*	*			trans	-81.6	113.4	174.9	-170.7	163.1	-155	0	0	108.7	T739	E737-T739 PolarHBondContact O-N 2.89Å
738	L	30.3	Very low	33.8	Very low	144 Å²	144	156.6 Å²	156.6	75%	0.754	81%	0.811	S	S	*	*			trans	-81.5	92.1	172.5	-102.7	85.1	0	0	0	109.3	F736 L740	F736-L738 PolarHBondContact O-N 3.06Å; L738-L740 PolarHBondContact O-N 2.72Å
739	T	32.3	Very low	34.2	Very low	111 Å²	111	155.6 Å²	155.6	68%	0.681	81%	0.806	S	S	*	*			trans	-68.7	100.7	163.4	-35.4	0	0	0	0	108.5	E737 E741	E737-T739 PolarHBondContact O-N 2.89Å; T739-E741 HydrophobicContact CG2-CG 4.36Å; T739-E741 PolarHBondContact O-N 3.02Å
740	L	32.3	Very low	34.5	Very low	141 Å²	141	161.7 Å²	161.7	74%	0.738	81%	0.814	S	S	*	*			trans	-76.7	101	163.9	-83.5	166.4	0	0	0	108	L738 E742	L738-L740 PolarHBondContact O-N 2.72Å; L740-E742 VanDerWaalsContact C-N 3.31Å; L740-E742 PolarHBondContact O-N 2.89Å; L740-E742 VanDerWaalsContact O-N 3.11Å
741	E	33.8	Very low	34.7	Very low	173 Å²	173	159.2 Å²	159.2	81%	0.808	81%	0.807	S	S	*	*			trans	-76.4	89.6	163.3	-68	-176.4	164	0	0	107.8	T739 D743	T739-E741 HydrophobicContact CG2-CG 4.36Å; T739-E741 PolarHBondContact O-N 3.02Å; E741-D743 PolarHBondContact O-N 3.46Å
742	E	37.5	Very low	34.8	Very low	171 Å²	171	158.6 Å²	158.6	80%	0.799	81%	0.808	S	S	*	*			trans	-76.3	104	162.6	-68.1	-174	143.6	0	0	108	L740 G744	L740-E742 VanDerWaalsContact C-N 3.31Å; L740-E742 PolarHBondContact O-N 2.89Å; L740-E742 VanDerWaalsContact O-N 3.11Å; E742-G744 PolarHBondContact O-N 3.45Å
743	D	35.8	Very low	34.8	Very low	168 Å²	168	152.5 Å²	152.5	90%	0.898	79%	0.794	S	S	*	*			trans	-67.4	78.6	167.8	-87.7	-41.7	0	0	0	109.6	E741 E745	E741-D743 PolarHBondContact O-N 3.46Å; D743-E745 PolarHBondContact O-N 3.08Å
744	G	36	Very low	34.8	Very low	54 Å²	54	148.2 Å²	148.2	56%	0.557	79%	0.79	S	S	*	*			trans	-81.4	103.2	-178.5	0	0	0	0	0	112.5	E742 S746	E742-G744 PolarHBondContact O-N 3.45Å; G744-S746 PolarHBondContact O-N 3.33Å; G744-S746 PolarHBondContact O-OG 3.25Å
745	E	37.6	Very low	35	Very low	206 Å²	206	147.2 Å²	147.2	96%	0.963	79%	0.787	S	S	*	*			trans	-56.8	106.7	159.9	-69.4	-172.8	135.3	0	0	109	D743	D743-E745 PolarHBondContact O-N 3.08Å
746	S	36.8	Very low	35.4	Very low	98 Å²	98	144.1 Å²	144.1	69%	0.685	78%	0.781	S	S	*	*			trans	-129	98.8	179.4	41.9	0	0	0	0	109.8	G744	G744-S746 PolarHBondContact O-N 3.33Å; G744-S746 PolarHBondContact O-OG 3.25Å
747	D	39.5	Very low	35.8	Very low	167 Å²	167	142.5 Å²	142.5	89%	0.893	78%	0.776	S	S	*	*			trans	-58.8	138.4	172.5	-92.1	-45.6	0	0	0	111
748	T	36.1	Very low	36.1	Very low	131 Å²	131	142.7 Å²	142.7	80%	0.804	78%	0.777	S	S	*	*			trans	-109.7	62.2	-169.7	37.9	0	0	0	0	113.2
749	E	41.8	Very low	36.4	Very low	188 Å²	188	142.1 Å²	142.1	88%	0.879	77%	0.774	S	S	*	*			trans	-83	132.6	164	-70.9	-96.9	118.8	0	0	110
750	K	42.1	Very low	36.6	Very low	195 Å²	195	141.8 Å²	141.8	85%	0.848	77%	0.772	S	S	*	*			trans	-104.7	117.1	-178.7	-70	175.7	178.7	172.6	0	110.8
751	D	34.5	Very low	36.7	Very low	153 Å²	153	139.8 Å²	139.8	82%	0.818	77%	0.77	S	S	*	*			trans	-64.9	134.9	162.2	-179.6	17.6	0	0	0	110.1	G753	D751-G753 PolarHBondContact OD1-N 3.39Å
752	S	38.1	Very low	36.7	Very low	117 Å²	117	137.2 Å²	137.2	82%	0.818	77%	0.77	S	S	*	*			trans	-161.2	58.1	170.8	-76.9	0	0	0	0	111.9
753	G	33.7	Very low	36.6	Very low	54 Å²	54	134.1 Å²	134.1	56%	0.557	77%	0.767	S	S	*	*			trans	101.4	117.5	130.2	0	0	0	0	0	120.7	D751	D751-G753 PolarHBondContact OD1-N 3.39Å
754	S	33.8	Very low	36.4	Very low	110 Å²	110	133 Å²	133	77%	0.769	76%	0.761	S	S	*	*			trans	81.1	138.7	133.6	75	0	0	0	0	121.5
755	Q	34.5	Very low	36.6	Very low	175 Å²	175	136.4 Å²	136.4	82%	0.818	78%	0.776	S	S	*	*			trans	68.9	143.9	170.2	-46.1	-170.8	-95.5	0	0	114.6
756	V	36.7	Very low	36.4	Very low	118 Å²	118	135.7 Å²	135.7	72%	0.715	77%	0.77	S	S	*	*			cis	-140.9	162.8	15.3	-137.8	0	0	0	0	112.9
757	E	38.1	Very low	36.5	Very low	151 Å²	151	137.6 Å²	137.6	71%	0.706	78%	0.778	S	S	*	*			trans	-29.8	160.1	170.4	-67.2	144.6	174.4	0	0	121.8
758	E	37.4	Very low	36.1	Very low	171 Å²	171	136.6 Å²	136.6	80%	0.799	77%	0.772	S	S	*	*			trans	70.2	145.9	142.7	-78.9	170.3	-165.2	0	0	120.4
759	D	36.3	Very low	36.1	Very low	132 Å²	132	136.8 Å²	136.8	71%	0.706	78%	0.777	S	S	*	*			cis	-159.4	165.1	-9.8	-143.5	-1.9	0	0	0	115.8
760	T	35.7	Very low	35.9	Very low	105 Å²	105	132.8 Å²	132.8	64%	0.644	77%	0.765	S	S	*	*			trans	20.8	118.8	157	52.7	0	0	0	0	125.9
761	S	35.8	Very low	35.5	Very low	99 Å²	99	131.5 Å²	131.5	69%	0.692	76%	0.762	S	S	*	*				84.3	150.4	113.9	85.1	0	0	0	0	125.3
762	C	32.4	Very low	35.7	Very low	119 Å²	119	131.6 Å²	131.6	80%	0.804	76%	0.763	S	S	*	*			trans	63.2	160.1	154.3	-63.5	0	0	0	0	119.9
763	S	34.8	Very low	35.8	Very low	105 Å²	105	130.8 Å²	130.8	73%	0.734	76%	0.757	S	S	*	*			cis	-179.1	145.7	-40.9	-101.1	0	0	0	0	108.3
764	D	31.6	Very low	36	Very low	146 Å²	146	137.6 Å²	137.6	78%	0.781	78%	0.775	S	S	*	*			trans	29.2	128.7	162	-74.3	18.7	0	0	0	121.9
765	S	41.5	Very low	35.9	Very low	124 Å²	124	137.7 Å²	137.7	87%	0.867	78%	0.775	S	S	*	*			trans	-149.1	115.8	149.1	-79.1	0	0	0	0	111.7
766	K	34.1	Very low	36.1	Very low	191 Å²	191	135.8 Å²	135.8	83%	0.83	78%	0.775	S	S	*	*			trans	-96	142.8	170.1	-68.9	175.7	178.4	172.5	0	110
767	T	38.4	Very low	36.1	Very low	138 Å²	138	139 Å²	139	85%	0.847	78%	0.783	S	S	*	*			trans	-139.5	136.8	161.9	-45.6	0	0	0	0	110.4
768	L	31.5	Very low	35.9	Very low	147 Å²	147	138.9 Å²	138.9	77%	0.77	79%	0.785	S	S	*	*			trans	-80.3	157.8	174.2	-89	63.3	0	0	0	111.5
769	C	36	Very low	36.2	Very low	134 Å²	134	136.8 Å²	136.8	91%	0.905	79%	0.787	S	S	*	*			trans	-145.2	164.7	139	-120.8	0	0	0	0	109.7
770	T	36.7	Very low	36.1	Very low	105 Å²	105	137.4 Å²	137.4	64%	0.644	79%	0.789	S	S	*	*			trans	-126.7	150.4	-155.8	46.4	0	0	0	0	114.9
771	Q	34.7	Very low	36.1	Very low	167 Å²	167	139.2 Å²	139.2	78%	0.78	80%	0.795	S	S	*	*			trans	40.7	127.4	141.5	-60.8	178.8	-68.3	0	0	120.9
772	D	39	Very low	36.3	Very low	156 Å²	156	142.6 Å²	142.6	83%	0.834	80%	0.8	S	S	*	*				178.5	130.9	128.4	-82.6	-26.7	0	0	0	106.4
773	S	38.6	Very low	36.6	Very low	100 Å²	100	144.8 Å²	144.8	70%	0.699	80%	0.798	S	S	*	*			cis	85.4	95.3	36.3	-64.9	0	0	0	0	114.9
774	E	37.8	Very low	36.6	Very low	197 Å²	197	146.3 Å²	146.3	92%	0.921	80%	0.803	S	S	*	*			trans	-171.6	179.5	131	-109.7	-175.8	124.1	0	0	112.7
775	S	33.3	Very low	36.9	Very low	111 Å²	111	148.9 Å²	148.9	78%	0.776	81%	0.81	S	S	*	*			trans	-153.8	151.3	-170.8	-59.1	0	0	0	0	113.7
776	T	36.9	Very low	36.6	Very low	135 Å²	135	151.8 Å²	151.8	83%	0.828	81%	0.81	S	S	*	*			trans	-154.4	106.9	170.2	-45.7	0	0	0	0	106.8
777	E	37.1	Very low	36.7	Very low	186 Å²	186	152.3 Å²	152.3	87%	0.869	82%	0.815	S	S	*	*				81.6	152.6	72	-70.8	-158.5	158.2	0	0	115.6
778	I	34.5	Very low	36.7	Very low	148 Å²	148	149.8 Å²	149.8	76%	0.759	81%	0.808	S	S	*	*			trans	-128	150.7	-154.2	-56.2	159	0	0	0	110.5
779	P	44.4	Very low	37.1	Very low	127 Å²	127	149.6 Å²	149.6	83%	0.825	81%	0.813	S	S	*	*			trans	-112.2	153.7	150.7	-1.3	23	0	0	0	113.5
780	L	33.9	Very low	37.2	Very low	145 Å²	145	146.1 Å²	146.1	76%	0.759	80%	0.8	S	S	*	*			trans	-119.4	175	-175.6	-74.1	166.9	0	0	0	112.3
781	D	35.8	Very low	37.3	Very low	144 Å²	144	149.4 Å²	149.4	77%	0.77	81%	0.808	S	S	*	*			trans	69	117.6	154.3	-56.6	-31.5	0	0	0	121.1
782	E	40.1	Very low	37.6	Very low	169 Å²	169	150 Å²	150	79%	0.79	81%	0.811	S	S	*	*				-166	115.3	116.1	-102.5	176.4	169.6	0	0	109.4
783	Q	37.1	Very low	37.6	Very low	165 Å²	165	151.4 Å²	151.4	77%	0.771	81%	0.813	S	S	*	*				64.2	101.2	105.3	-66.9	-179.5	61	0	0	114.4
784	V	35.3	Very low	37.5	Very low	137 Å²	137	155.2 Å²	155.2	83%	0.83	82%	0.819	S	S	*	*				84.7	115.1	75	165.8	0	0	0	0	113.6
785	E	38.8	Very low	37.6	Very low	200 Å²	200	151.6 Å²	151.6	94%	0.935	82%	0.816	S	S	*	*			trans	-159.9	137.7	147.7	-117	170.1	-157.4	0	0	109.7
786	E	33.8	Very low	37.6	Very low	186 Å²	186	155.6 Å²	155.6	87%	0.869	82%	0.822	S	S	*	*			trans	-124.3	129.4	179.2	-66.2	179.4	109.8	0	0	110.1
787	E	37.6	Very low	38.1	Very low	201 Å²	201	154.9 Å²	154.9	94%	0.939	82%	0.82	S	S	*	*			trans	-166.1	163.6	147.1	-77.6	-150.4	150.7	0	0	109
788	A	38.5	Very low	38.1	Very low	85 Å²	85	155 Å²	155	70%	0.702	82%	0.821	S	S	*	*				-172.1	153.1	-70.7	0	0	0	0	0	109.4
789	V	39	Very low	38.3	Very low	143 Å²	143	151.1 Å²	151.1	87%	0.867	81%	0.81	S	S	*	*			trans	69.5	133.8	171.5	-166.5	0	0	0	0	116.4
790	G	37.6	Very low	38	Very low	62 Å²	62	150.7 Å²	150.7	64%	0.639	81%	0.809	S	S	*	*			cis	168.5	172	-7	0	0	0	0	0	113.9
791	E	39.8	Very low	38.3	Very low	174 Å²	174	149.3 Å²	149.3	81%	0.813	81%	0.807	S	S	*	*			trans	66.3	154.5	158.5	-65.1	158.8	-151.1	0	0	118.9
792	E	40	Very low	38.6	Very low	179 Å²	179	149 Å²	149	84%	0.836	80%	0.804	S	S	*	*			cis	-173.8	160.5	-31.3	-111.1	174.6	-158	0	0	106.2
793	E	39.7	Very low	38.7	Very low	185 Å²	185	147.7 Å²	147.7	86%	0.864	80%	0.802	S	S	*	*			cis	-105.4	-172.3	-7.2	-54.8	165	108.4	0	0	109.1
794	E	36.9	Very low	38.9	Very low	180 Å²	180	144.5 Å²	144.5	84%	0.841	79%	0.79	S	S	*	*			cis	80	109.1	12.1	-165.5	149.5	-69.1	0	0	121.1
795	S	38.9	Very low	39.4	Very low	122 Å²	122	147.9 Å²	147.9	85%	0.853	79%	0.788	S	S	*	*			trans	179.2	158.1	140.8	37.4	0	0	0	0	113.9
796	Q	34.8	Very low	39.6	Very low	195 Å²	195	143.1 Å²	143.1	91%	0.911	78%	0.777	S	S	*	*			trans	-130.3	169.1	-173.9	-96.2	-169.7	-3	0	0	113.6
797	P	46.1	Very low	40.5	Very low	119 Å²	119	139.7 Å²	139.7	77%	0.773	77%	0.77	S	S	*	*			trans	-105.5	154.7	-160.3	39.2	-35.9	0	0	0	118.4
798	E	37.7	Very low	41.1	Very low	189 Å²	189	137.4 Å²	137.4	88%	0.883	77%	0.765	S	S	*	*			trans	-157.2	164	161.5	-92	-142.5	93	0	0	108.8
799	A	38.8	Very low	41.7	Very low	66 Å²	66	143.7 Å²	143.7	55%	0.545	80%	0.795	S	S	.	*			cis	-175.7	177.5	-25.4	0	0	0	0	0	109.5
800	C	37.8	Very low	41.8	Very low	119 Å²	119	143.7 Å²	143.7	80%	0.804	79%	0.791	S	S	*	*			trans	68.4	162.1	159.5	-77.2	0	0	0	0	119.6
801	V	39.9	Very low	42	Very low	116 Å²	116	148 Å²	148	70%	0.703	80%	0.799	S	S	*	*			cis	-170.5	139.1	-38.4	105	0	0	0	0	112.1
802	I	42	Very low	42.1	Very low	138 Å²	138	146.6 Å²	146.6	71%	0.708	80%	0.798	S	S	*	*			trans	69.3	156.6	148.5	-71.7	172.3	0	0	0	123.3
803	D	42.6	Very low	42.3	Very low	141 Å²	141	144.6 Å²	144.6	75%	0.754	80%	0.796	S	S	*	*			trans	78.9	140.6	161.7	-84.9	0.4	0	0	0	120.6
804	D	42.2	Very low	42.4	Very low	97 Å²	97	142.1 Å²	142.1	52%	0.519	79%	0.792	S	S	.	*			cis	-167.7	161.6	-19.4	-161.5	-4	0	0	0	110.8
805	R	45.2	Very low	42.8	Very low	209 Å²	209	139.6 Å²	139.6	79%	0.789	79%	0.788	S	S	*	*			trans	62.6	149.6	156.8	-92.2	167.8	-106	-158.5	-3.3	119.6
806	S	43.5	Very low	43.1	Very low	100 Å²	100	140.9 Å²	140.9	70%	0.699	78%	0.784	S	S	*	*			cis	-147.5	160.4	2.9	-78.3	0	0	0	0	110.9
807	P	52.5	Low	43.7	Very low	113 Å²	113	136.7 Å²	136.7	73%	0.734	77%	0.774	S	S	*	*			trans	-96.8	163.1	172.9	39	-34.8	0	0	0	113.8
808	D	50	Low	43.5	Very low	153 Å²	153	138.2 Å²	138.2	82%	0.818	77%	0.774	S	S	*	*				-177.9	154.2	128.8	-103	-20.2	0	0	0	112.5
809	T	50.2	Low	44.1	Very low	217 Å²	217	133.5 Å²	133.5	100%	1.331	76%	0.764	S	S	*	*			trans	66.7	0	179.4	55.8	0	0	0	0	119.2

Retrieved 809 of 809 residues in 492.2 ms (Link to these results)

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