A0A060X7M7_ONCMY Loading...

AarF domain containing kinase 5

AlphaFold DB , UniProt , Accession A0A060X7M7, Species ONCMY (Oncorhynchus mykiss, Rainbow trout), Gene LOC110496376, Length 571 aa.

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(Predicted Aligned Error values between residue pairs)

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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	39.7	Very low	32.9	Very low	249 Å²	249	141.5 Å²	141.5	100%	1.227	75%	0.75	S	S	*	*				0	68.5	0	-68.9	-170	-69.2	0	0	110.1
2	A	32	Very low	32.9	Very low	93 Å²	93	137.7 Å²	137.7	77%	0.769	74%	0.741	S	S	*	*			trans	-146.5	45.9	-173.3	0	0	0	0	0	110.4
3	G	29.6	Very low	33	Very low	56 Å²	56	138.4 Å²	138.4	58%	0.577	74%	0.737	S	S	*	*	S	Bend	trans	-124.8	-17.4	-173.7	0	0	0	0	0	115.7
4	E	32.8	Very low	32.8	Very low	178 Å²	178	138.6 Å²	138.6	83%	0.832	74%	0.737	S	S	*	*	S	Bend	trans	-107.2	-21.1	-171.2	-68.5	-167.8	149.7	0	0	114.5	F6	E4-F6 VanDerWaalsContact C-N 3.28Å; E4-F6 PolarHBondContact O-N 3.27Å
5	T	34.6	Very low	32.8	Very low	108 Å²	108	135 Å²	135	66%	0.663	74%	0.735	S	S	*	*	H	α-helix	trans	-73.7	-17.7	175.1	40.6	0	0	0	0	113.5
6	F	32	Very low	33	Very low	168 Å²	168	135.9 Å²	135.9	74%	0.737	74%	0.737	S	S	*	*	H	α-helix	trans	-83.9	-16.7	180	-113.5	-93.7	0	0	0	114.5	E4	E4-F6 VanDerWaalsContact C-N 3.28Å; E4-F6 PolarHBondContact O-N 3.27Å
7	K	31.9	Very low	33.1	Very low	167 Å²	167	137.4 Å²	137.4	73%	0.726	74%	0.744	S	S	*	*	H	α-helix	trans	-85.1	-29.3	177.7	-86.8	-179.5	176.1	175.8	0	113.2
8	A	32.7	Very low	32.8	Very low	67 Å²	67	133.1 Å²	133.1	55%	0.554	74%	0.737	S	S	*	*	H	α-helix	trans	-70.1	-32.9	177.4	0	0	0	0	0	112.9
9	L	35	Very low	33.1	Very low	135 Å²	135	139.4 Å²	139.4	71%	0.707	75%	0.748	S	S	*	*	H	α-helix	trans	-81.5	-20.2	179.7	-94.1	123.9	0	0	0	114.5
10	R	30.9	Very low	32.8	Very low	202 Å²	202	138.6 Å²	138.6	76%	0.762	75%	0.753	S	S	*	*	H	α-helix	trans	-79	-23	173.3	-104.4	-176.8	176	-169.9	-0.2	113.6
11	L	31.1	Very low	32.7	Very low	133 Å²	133	137.4 Å²	137.4	70%	0.696	75%	0.752	S	S	*	*	H	α-helix	trans	-80.7	-27.3	178.9	-85.9	154.9	0	0	0	113.4	H13	L11-H13 VanDerWaalsContact C-N 3.34Å
12	C	33	Very low	32.4	Very low	96 Å²	96	137.1 Å²	137.1	65%	0.649	74%	0.737	S	S	*	*	H	α-helix	trans	-74.7	-22.1	173.1	-82.9	0	0	0	0	113.5
13	H	33.7	Very low	32.3	Very low	147 Å²	147	138.6 Å²	138.6	68%	0.681	74%	0.739	S	S	*	*	H	α-helix	trans	-84.9	-18.9	-175.6	-127.7	-52.2	0	0	0	114.1	L11	L11-H13 VanDerWaalsContact C-N 3.34Å
14	L	30.6	Very low	32.3	Very low	141 Å²	141	144.7 Å²	144.7	74%	0.738	75%	0.752	S	S	*	*	S	Bend	trans	-91.8	-12.4	177.6	-88.1	152.7	0	0	0	113.7
15	A	32.1	Very low	32	Very low	85 Å²	85	144.3 Å²	144.3	70%	0.702	76%	0.755	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.9	-6.9	177.9	0	0	0	0	0	114.2
16	L	36.8	Very low	31.6	Very low	149 Å²	149	147.6 Å²	147.6	78%	0.78	76%	0.763	S	S	*	*	T	Hydrogen-bonded Turn	trans	-97.3	1.5	178.1	-82.9	159.4	0	0	0	113.9
17	L	34.9	Very low	31.4	Very low	161 Å²	161	147.4 Å²	147.4	84%	0.843	77%	0.768	S	S	*	*	S	Bend	trans	-131	71.5	177.2	-77.1	166.8	0	0	0	109.7
18	G	27.8	Very low	31.1	Very low	60 Å²	60	148.2 Å²	148.2	62%	0.619	77%	0.768	S	S	*	*			trans	-166.4	100.6	176.3	0	0	0	0	0	111.9	C20	G18-C20 PolarHBondContact O-N 2.92Å
19	R	36.8	Very low	30.8	Very low	254 Å²	254	154.2 Å²	154.2	96%	0.958	78%	0.776	S	S	*	*			trans	-51.9	122.8	160.2	-79.1	177.3	172.5	176.1	-2.2	108
20	C	28.4	Very low	30.3	Very low	123 Å²	123	152 Å²	152	83%	0.831	77%	0.772	S	S	*	*			trans	-114.7	129.9	167.1	-102.7	0	0	0	0	110.6	G18	G18-C20 PolarHBondContact O-N 2.92Å
21	P	31.1	Very low	30.2	Very low	113 Å²	113	151.9 Å²	151.9	73%	0.734	78%	0.778	S	S	*	*			trans	-79.4	154.1	166.1	31.3	-24.8	0	0	0	110.4
22	R	31.5	Very low	30.1	Very low	244 Å²	244	150.3 Å²	150.3	92%	0.921	78%	0.778	S	S	*	*			trans	-58.3	151.4	172.2	-73	176.5	174	169.6	-2.3	111.2
23	P	31.8	Very low	29.8	Very low	124 Å²	124	151.6 Å²	151.6	81%	0.805	79%	0.788	S	S	*	*				-130	147.2	125.9	22.4	-4.4	0	0	0	113.3
24	Q	28.2	Very low	29.7	Very low	184 Å²	184	152.8 Å²	152.8	86%	0.86	79%	0.794	S	S	*	*			trans	-68.6	144.7	167.7	-68	164.5	-39	0	0	110
25	L	27.6	Very low	29.8	Very low	169 Å²	169	156.9 Å²	156.9	89%	0.885	80%	0.8	S	S	*	*			trans	-159	148.1	145.7	-107.9	140	0	0	0	111.8
26	Q	25.9	Very low	30.1	Very low	178 Å²	178	158.7 Å²	158.7	83%	0.832	80%	0.804	S	S	*	*			trans	-77.3	149.4	-155.6	-72.7	151.5	-37.7	0	0	114.3
27	L	27.3	Very low	30.2	Very low	163 Å²	163	163.2 Å²	163.2	85%	0.853	81%	0.811	S	S	*	*			trans	-57.7	147	157.2	-93.7	116.1	0	0	0	111.1
28	Y	25.5	Very low	30.3	Very low	185 Å²	185	165.2 Å²	165.2	73%	0.725	81%	0.813	S	S	*	*			trans	-162.9	132.3	132.3	-126.9	-108.6	0	0	0	113.8
29	R	26.1	Very low	30.8	Very low	192 Å²	192	167.8 Å²	167.8	73%	0.725	82%	0.821	S	S	*	*			trans	45.4	112.6	150.3	-75.6	-174.4	-176.4	166.4	1	120.8
30	S	26.2	Very low	30.8	Very low	89 Å²	89	162.5 Å²	162.5	62%	0.622	81%	0.811	S	S	*	*				80.3	121.3	86.3	85.2	0	0	0	0	114.3
31	F	27.6	Very low	31.3	Very low	200 Å²	200	159 Å²	159	88%	0.877	80%	0.796	S	S	*	*				-170.5	148	124.7	-109.1	-79.6	0	0	0	110.8
32	S	28.7	Very low	31.8	Very low	99 Å²	99	160.9 Å²	160.9	69%	0.692	80%	0.799	S	S	*	*			trans	-72.2	153.5	-170.9	55.7	0	0	0	0	115.5
33	S	28.2	Very low	31.9	Very low	124 Å²	124	157.1 Å²	157.1	87%	0.867	79%	0.79	S	S	*	*			trans	-152.3	135.1	135	113.3	0	0	0	0	110.7
34	Q	31	Very low	32.2	Very low	171 Å²	171	159.7 Å²	159.7	80%	0.799	78%	0.783	S	S	*	*			trans	-93.5	156	-176.2	-73.2	179.8	-21	0	0	112.5
35	R	32.3	Very low	32.6	Very low	228 Å²	228	158.8 Å²	158.8	86%	0.86	78%	0.776	S	S	*	*			trans	111.6	151.2	150.3	-63	-175	179	-172.4	0.7	116
36	P	38.3	Very low	33.3	Very low	123 Å²	123	157.7 Å²	157.7	80%	0.799	77%	0.769	S	S	*	*				-129	160.6	-54.2	33.6	-16.6	0	0	0	113.2
37	R	39.8	Very low	34.4	Very low	243 Å²	243	157 Å²	157	92%	0.917	76%	0.763	S	S	*	*			trans	-49	142.2	171.5	-91.3	169.4	160.4	160.9	-4.3	114.4
38	K	36	Very low	35.3	Very low	203 Å²	203	154.3 Å²	154.3	88%	0.883	75%	0.749	S	S	*	*				-146.1	130.1	124	-73.7	-163.6	179.2	173.6	0	112
39	S	37.6	Very low	36.4	Very low	115 Å²	115	147 Å²	147	80%	0.804	73%	0.73	S	S	*	*	S	Bend	trans	66.7	72.3	155.6	-178.1	0	0	0	0	119.8
40	L	38.4	Very low	38.1	Very low	143 Å²	143	142.3 Å²	142.3	75%	0.749	72%	0.723	S	S	*	*			trans	-141.5	31.4	159	-116.4	124.3	0	0	0	111.8
41	G	38.4	Very low	40.3	Very low	49 Å²	49	142.1 Å²	142.1	51%	0.505	72%	0.719	S	S	.	*	T	Hydrogen-bonded Turn	trans	-92.6	-8.2	-166	0	0	0	0	0	116.9
42	L	40.5	Very low	42.4	Very low	152 Å²	152	137.1 Å²	137.1	80%	0.796	71%	0.705	S	S	*	*	T	Hydrogen-bonded Turn	trans	-104.7	-32.7	-175.3	-122.5	78.1	0	0	0	114.1
43	F	35.5	Very low	44.5	Very low	166 Å²	166	136.3 Å²	136.3	73%	0.728	70%	0.696	S	S	*	*	H	α-helix	trans	-75.9	-28.9	-179.3	-102.1	-89.6	0	0	0	113.9
44	W	36.3	Very low	46.8	Very low	178 Å²	178	133.8 Å²	133.8	67%	0.674	68%	0.675	S	S	*	*	H	α-helix	trans	-74.6	-24.8	178.9	-101.9	78.5	0	0	0	113.9	L48	W44-L48 HydrophobicContact CE3-CD1 3.88Å; W44-L48 HydrophobicContact CE3-CG 4.47Å; W44-L48 HydrophobicContact CZ3-CD1 4.39Å; W44-L48 PolarHBondContact O-N 3.43Å
45	K	36.9	Very low	49	Very low	164 Å²	164	127.4 Å²	127.4	71%	0.713	66%	0.655	S	S	*	*	H	α-helix	trans	-75.5	-25.7	-179.9	-70.3	-172.3	178	-175.3	0	113.1	G49	K45-G49 PolarHBondContact O-N 3.22Å
46	M	42.1	Very low	51.2	Low	147 Å²	147	120.3 Å²	120.3	72%	0.724	64%	0.637	S	S	*	*	H	α-helix	trans	-73.7	-34.4	173.7	-93.4	179.4	69.2	0	0	112.8
47	F	49.1	Very low	53	Low	162 Å²	162	119.9 Å²	119.9	71%	0.711	62%	0.624	S	S	*	*	H	α-helix	trans	-78.4	-23.6	178.8	-87.6	-84.1	0	0	0	114.1	P51	F47-P51 WeakPolarHBondContact O-CD 3.31Å
48	L	46.6	Very low	55.1	Low	107 Å²	107	111.8 Å²	111.8	56%	0.56	59%	0.594	S	S	*	*	H	α-helix	trans	-82.1	-25.5	176.4	-84.5	157.6	0	0	0	113.7	W44	W44-L48 HydrophobicContact CE3-CD1 3.88Å; W44-L48 HydrophobicContact CE3-CG 4.47Å; W44-L48 HydrophobicContact CZ3-CD1 4.39Å; W44-L48 PolarHBondContact O-N 3.43Å
49	G	49.2	Very low	57.2	Low	32 Å²	32	105 Å²	105	33%	0.33	58%	0.575	S	S	.	*	H	α-helix	trans	-76	-36.1	-179.8	0	0	0	0	0	113.7	K45 V52 V53	K45-G49 PolarHBondContact O-N 3.22Å; G49-V52 PolarHBondContact O-N 3.37Å; G49-V53 VanDerWaalsContact O-CG2 3.31Å; G49-V53 WeakPolarHBondContact O-CG2 3.34Å; G49-V53 PolarHBondContact O-N 3.48Å
50	V	60.7	Low	59.4	Low	93 Å²	93	106.4 Å²	106.4	56%	0.564	57%	0.573	S	S	*	*	H	α-helix	trans	-62.2	-46.2	-176.7	177.4	0	0	0	0	112.7	V52 V53 V54	V50-V52 VanDerWaalsContact C-N 3.31Å; V50-V52 PolarHBondContact O-N 2.84Å; V50-V53 PolarHBondContact O-N 3.33Å; V50-V54 HydrophobicContact CG1-CG2 4.22Å; V50-V54 WeakPolarHBondContact O-CB 3.38Å; V50-V54 WeakPolarHBondContact O-CG2 3.19Å; V50-V54 PolarHBondContact O-N 2.87Å
51	P	72.3	Confident	61.5	Low	85 Å²	85	100 Å²	100	55%	0.552	54%	0.541	S	S	*	.	H	α-helix	trans	-62.9	-35.1	176.7	-22.6	33.5	0	0	0	113.4	F47 G55	F47-P51 WeakPolarHBondContact O-CD 3.31Å; P51-G55 PolarHBondContact O-N 3.14Å
52	V	71.6	Confident	63.7	Low	96 Å²	96	104 Å²	104	58%	0.582	55%	0.547	S	S	*	.	H	α-helix	trans	-72.2	-45.3	179.2	177.5	0	0	0	0	110.6	G49 V50 G55 V56	G49-V52 PolarHBondContact O-N 3.37Å; V50-V52 VanDerWaalsContact C-N 3.31Å; V50-V52 PolarHBondContact O-N 2.84Å; V52-G55 PolarHBondContact O-N 3.44Å; V52-V56 WeakPolarHBondContact O-CG2 3.44Å; V52-V56 PolarHBondContact O-N 2.97Å
53	V	74.1	Confident	65.6	Low	82 Å²	82	102 Å²	102	50%	0.497	54%	0.542	S	S	.	.	H	α-helix	trans	-62.5	-44.3	176.1	172.1	0	0	0	0	110.9	G49 V50 G55 V56 Q57	G49-V53 VanDerWaalsContact O-CG2 3.31Å; G49-V53 WeakPolarHBondContact O-CG2 3.34Å; G49-V53 PolarHBondContact O-N 3.48Å; V50-V53 PolarHBondContact O-N 3.33Å; V53-G55 VanDerWaalsContact C-N 3.32Å; V53-G55 PolarHBondContact O-N 2.85Å; V53-V56 PolarHBondContact O-N 2.92Å; V53-Q57 WeakPolarHBondContact O-CB 3.18Å; V53-Q57 WeakPolarHBondContact O-CG 3.34Å; V53-Q57 PolarHBondContact O-N 3.48Å
54	V	76.5	Confident	67.7	Low	70 Å²	70	99.5 Å²	99.5	42%	0.424	53%	0.528	S	S	.	.	H	α-helix	trans	-64.5	-38.1	175.2	172.2	0	0	0	0	111.2	V50 Y58 M69	V50-V54 HydrophobicContact CG1-CG2 4.22Å; V50-V54 WeakPolarHBondContact O-CB 3.38Å; V50-V54 WeakPolarHBondContact O-CG2 3.19Å; V50-V54 PolarHBondContact O-N 2.87Å; V54-Y58 WeakPolarHBondContact O-CB 3.11Å; V54-Y58 PolarHBondContact O-N 3.39Å; V54-M69 HydrophobicContact CG1-CE 4.23Å
55	G	77.1	Confident	69.8	Low	37 Å²	37	96 Å²	96	38%	0.381	52%	0.52	S	S	.	.	H	α-helix	trans	-64.9	-42.7	176	0	0	0	0	0	113.2	P51 V52 V53 Y58 A59	P51-G55 PolarHBondContact O-N 3.14Å; V52-G55 PolarHBondContact O-N 3.44Å; V53-G55 VanDerWaalsContact C-N 3.32Å; V53-G55 PolarHBondContact O-N 2.85Å; G55-Y58 PolarHBondContact O-N 2.87Å; G55-A59 WeakPolarHBondContact O-CB 3.38Å; G55-A59 PolarHBondContact O-N 2.86Å
56	V	77.2	Confident	72	Confident	79 Å²	79	92.5 Å²	92.5	48%	0.479	50%	0.502	S	S	.	.	H	α-helix	trans	-68	-45.8	175.5	172.2	0	0	0	0	110.9	V52 V53 Y58 A59 L60	V52-V56 WeakPolarHBondContact O-CG2 3.44Å; V52-V56 PolarHBondContact O-N 2.97Å; V53-V56 PolarHBondContact O-N 2.92Å; V56-Y58 VanDerWaalsContact C-N 3.31Å; V56-Y58 PolarHBondContact O-N 3.37Å; V56-A59 PolarHBondContact O-N 3.04Å; V56-A59 VanDerWaalsContact O-N 3.14Å; V56-L60 HydrophobicContact CG1-CD1 3.91Å; V56-L60 WeakPolarHBondContact O-CG 3.42Å; V56-L60 PolarHBondContact O-N 3.4Å
57	Q	77.7	Confident	74	Confident	114 Å²	114	87.4 Å²	87.4	53%	0.533	47%	0.474	S	S	.	.	H	α-helix	trans	-58.8	-43.1	174.2	-78.3	-174.3	-17.4	0	0	111.4	V53 A59 L60 A61 M69	V53-Q57 WeakPolarHBondContact O-CB 3.18Å; V53-Q57 WeakPolarHBondContact O-CG 3.34Å; V53-Q57 PolarHBondContact O-N 3.48Å; Q57-A59 VanDerWaalsContact C-N 3.34Å; Q57-A59 PolarHBondContact O-N 3.47Å; Q57-L60 PolarHBondContact O-N 3.02Å; Q57-A61 WeakPolarHBondContact O-CB 3.06Å; Q57-A61 PolarHBondContact O-N 2.92Å; Q57-M69 HydrophobicContact CB-CE 4.15Å
58	Y	83.7	Confident	75.6	Confident	74 Å²	74	84.6 Å²	84.6	29%	0.29	46%	0.462	S	S	.	.	H	α-helix	trans	-63.9	-37.4	176	178	-88.7	0	0	0	112.6	V54 G55 V56 L60 R66 M69 K70	V54-Y58 WeakPolarHBondContact O-CB 3.11Å; V54-Y58 PolarHBondContact O-N 3.39Å; G55-Y58 PolarHBondContact O-N 2.87Å; V56-Y58 VanDerWaalsContact C-N 3.31Å; V56-Y58 PolarHBondContact O-N 3.37Å; Y58-L60 VanDerWaalsContact C-N 3.34Å; Y58-R66 HydrophobicContact CD2-CB 4.19Å; Y58-R66 HydrophobicContact CD2-CG 4.09Å; Y58-R66 HydrophobicContact CE2-CB 3.65Å; Y58-R66 HydrophobicContact CE2-CG 3.9Å; Y58-R66 WeakPolarHBondContact O-CD 3.19Å; Y58-R66 VanDerWaalsContact O-CG 3.28Å; Y58-R66 WeakPolarHBondContact O-CG 3.28Å; Y58-R66 PolarHBondContact O-NE 3.04Å; Y58-M69 HydrophobicContact CD2-CB 4.24Å; Y58-M69 HydrophobicContact CD2-SD 3.99Å; Y58-K70 HydrophobicContact CE2-CD 4.37Å; Y58-K70 HydrophobicContact CE2-CG 4.11Å; Y58-K70 WeakPolarHBondContact OH-CE 3.49Å; Y58-K70 PolarHBondContact OH-NZ 3.02Å
59	A	79.1	Confident	77.3	Confident	59 Å²	59	82 Å²	82	49%	0.488	45%	0.447	S	S	.	.	H	α-helix	trans	-71.5	-27.5	178.6	0	0	0	0	0	113.4	G55 V56 Q57 R66	G55-A59 WeakPolarHBondContact O-CB 3.38Å; G55-A59 PolarHBondContact O-N 2.86Å; V56-A59 PolarHBondContact O-N 3.04Å; V56-A59 VanDerWaalsContact O-N 3.14Å; Q57-A59 VanDerWaalsContact C-N 3.34Å; Q57-A59 PolarHBondContact O-N 3.47Å; A59-R66 PolarHBondContact O-NH2 3.1Å
60	L	83.6	Confident	78.9	Confident	145 Å²	145	85.6 Å²	85.6	76%	0.759	45%	0.454	S	S	*	.	H	α-helix	trans	-95.1	-20.6	178.8	-64.4	175.4	0	0	0	113.3	V56 Q57 Y58	V56-L60 HydrophobicContact CG1-CD1 3.91Å; V56-L60 WeakPolarHBondContact O-CG 3.42Å; V56-L60 PolarHBondContact O-N 3.4Å; Q57-L60 PolarHBondContact O-N 3.02Å; Y58-L60 VanDerWaalsContact C-N 3.34Å
61	A	83.4	Confident	79.9	Confident	8 Å²	8	82.1 Å²	82.1	7%	0.066	43%	0.432	C	S	.	.	S	Bend	trans	-60.8	149.3	-178.8	0	0	0	0	0	113	Q57 E65 R66	Q57-A61 WeakPolarHBondContact O-CB 3.06Å; Q57-A61 PolarHBondContact O-N 2.92Å; A61-E65 HydrophobicContact CB-CB 3.8Å; A61-R66 HydrophobicContact CB-CG 3.76Å; A61-R66 VanDerWaalsContact O-CZ 3.3Å; A61-R66 PolarHBondContact O-NE 3.41Å; A61-R66 PolarHBondContact O-NH2 2.83Å; A61-R66 VanDerWaalsContact O-NH2 3.09Å
62	E	84.9	Confident	80.3	Confident	135 Å²	135	84.1 Å²	84.1	63%	0.631	44%	0.438	S	S	*	.			trans	-65.3	159.8	171.7	-71.2	-171.3	172.7	0	0	111.8	R64 E65 R66	E62-R64 PolarHBondContact O-N 3.1Å; E62-R64 VanDerWaalsContact O-N 3.11Å; E62-E65 PolarHBondContact O-N 3.09Å; E62-R66 WeakPolarHBondContact O-CG 3.34Å; E62-R66 PolarHBondContact O-N 3.12Å
63	P	79.8	Confident	80.9	Confident	108 Å²	108	84.8 Å²	84.8	70%	0.701	44%	0.441	S	S	*	.	H	α-helix	trans	-51.7	-38.4	-179.9	-28.4	35.5	0	0	0	114	R67	P63-R67 WeakPolarHBondContact O-CB 3.29Å; P63-R67 PolarHBondContact O-N 3.09Å
64	R	79.6	Confident	81.3	Confident	114 Å²	114	87.7 Å²	87.7	43%	0.43	45%	0.447	S	S	.	.	H	α-helix	trans	-67.4	-43.5	177.9	-171.5	174	-176	-174.8	2.9	112.3	E62 R67 K68	E62-R64 PolarHBondContact O-N 3.1Å; E62-R64 VanDerWaalsContact O-N 3.11Å; R64-R67 WeakPolarHBondContact O-CB 3.42Å; R64-R67 PolarHBondContact O-N 3.28Å; R64-K68 PolarHBondContact O-N 2.91Å
65	E	81.7	Confident	81.7	Confident	106 Å²	106	85.1 Å²	85.1	50%	0.495	44%	0.435	S	S	.	.	H	α-helix	trans	-68	-43.2	177.8	-69.5	-172.6	152.5	0	0	111.9	A61 E62 R67 K68 M69	A61-E65 HydrophobicContact CB-CB 3.8Å; E62-E65 PolarHBondContact O-N 3.09Å; E65-R67 PolarHBondContact O-N 2.74Å; E65-K68 PolarHBondContact O-N 2.74Å; E65-K68 VanDerWaalsContact O-N 3.1Å; E65-M69 WeakPolarHBondContact O-CG 3.44Å; E65-M69 PolarHBondContact O-N 2.97Å
66	R	82.9	Confident	82.2	Confident	90 Å²	90	87.5 Å²	87.5	34%	0.34	44%	0.442	S	S	.	.	H	α-helix	trans	-56.9	-39.2	172.4	-69.7	-174.4	-161.5	-177.3	3.5	111.8	Y58 A59 A61 E62 K70	Y58-R66 HydrophobicContact CD2-CB 4.19Å; Y58-R66 HydrophobicContact CD2-CG 4.09Å; Y58-R66 HydrophobicContact CE2-CB 3.65Å; Y58-R66 HydrophobicContact CE2-CG 3.9Å; Y58-R66 WeakPolarHBondContact O-CD 3.19Å; Y58-R66 VanDerWaalsContact O-CG 3.28Å; Y58-R66 WeakPolarHBondContact O-CG 3.28Å; Y58-R66 PolarHBondContact O-NE 3.04Å; A59-R66 PolarHBondContact O-NH2 3.1Å; A61-R66 HydrophobicContact CB-CG 3.76Å; A61-R66 VanDerWaalsContact O-CZ 3.3Å; A61-R66 PolarHBondContact O-NE 3.41Å; A61-R66 PolarHBondContact O-NH2 2.83Å; A61-R66 VanDerWaalsContact O-NH2 3.09Å; E62-R66 WeakPolarHBondContact O-CG 3.34Å; E62-R66 PolarHBondContact O-N 3.12Å; R66-K70 WeakPolarHBondContact O-CG 3.47Å; R66-K70 PolarHBondContact O-N 3.18Å
67	R	83.9	Confident	82.7	Confident	39 Å²	39	85.4 Å²	85.4	15%	0.147	44%	0.437	C	S	.	.	H	α-helix	trans	-63.9	-48.7	175	-174.6	178.8	65.9	-130.8	0.9	110.9	P63 R64 E65 M69 K70 I71 E180 D228	P63-R67 WeakPolarHBondContact O-CB 3.29Å; P63-R67 PolarHBondContact O-N 3.09Å; R64-R67 WeakPolarHBondContact O-CB 3.42Å; R64-R67 PolarHBondContact O-N 3.28Å; E65-R67 PolarHBondContact O-N 2.74Å; R67-M69 VanDerWaalsContact C-N 3.33Å; R67-M69 PolarHBondContact O-N 2.69Å; R67-K70 WeakPolarHBondContact O-CB 3.31Å; R67-K70 PolarHBondContact O-N 3.16Å; R67-I71 HydrophobicContact CG-CD1 3.79Å; R67-I71 HydrophobicContact CG-CG1 4.31Å; R67-I71 VanDerWaalsContact O-CG1 3.29Å; R67-I71 WeakPolarHBondContact O-CG1 3.47Å; R67-I71 PolarHBondContact O-N 3.11Å; R67-E180 IonicContact CZ-OE1 2.74Å; R67-E180 IonicContact NH1-OE1 2.71Å; R67-E180 PolarHBondContact NH1-OE1 2.9Å; R67-E180 VanDerWaalsContact NH2-CD 3.3Å; R67-E180 IonicContact NH2-OE1 2.63Å; R67-E180 PolarHBondContact NH2-OE1 3.46Å; R67-E180 IonicContact NH2-OE2 2.91Å; R67-E180 PolarHBondContact NH2-OE2 2.77Å; R67-E180 VanDerWaalsContact NH2-OE2 3.09Å; R67-D228 IonicContact CZ-OD2 2.88Å; R67-D228 IonicContact NE-OD2 3.12Å; R67-D228 PolarHBondContact NE-OD2 2.82Å; R67-D228 IonicContact NH2-OD2 3.46Å; R67-D228 PolarHBondContact NH2-OD2 2.69Å
68	K	81.6	Confident	83.3	Confident	104 Å²	104	80.8 Å²	80.8	45%	0.452	41%	0.414	S	S	.	.	H	α-helix	trans	-56.9	-44.3	176.7	-72.9	-178.2	177	-178.1	0	112.4	R64 E65 K70 I71 L72	R64-K68 PolarHBondContact O-N 2.91Å; E65-K68 PolarHBondContact O-N 2.74Å; E65-K68 VanDerWaalsContact O-N 3.1Å; K68-K70 PolarHBondContact O-N 3.48Å; K68-I71 PolarHBondContact O-N 3.31Å; K68-L72 PolarHBondContact O-N 3.45Å
69	M	82.6	Confident	83.7	Confident	51 Å²	51	80.9 Å²	80.9	25%	0.251	42%	0.416	S	S	.	.	H	α-helix	trans	-61.1	-45.2	176	-67.3	178.2	114.2	0	0	112.1	V54 Q57 Y58 E65 R67 I71 L72 V73	V54-M69 HydrophobicContact CG1-CE 4.23Å; Q57-M69 HydrophobicContact CB-CE 4.15Å; Y58-M69 HydrophobicContact CD2-CB 4.24Å; Y58-M69 HydrophobicContact CD2-SD 3.99Å; E65-M69 WeakPolarHBondContact O-CG 3.44Å; E65-M69 PolarHBondContact O-N 2.97Å; R67-M69 VanDerWaalsContact C-N 3.33Å; R67-M69 PolarHBondContact O-N 2.69Å; M69-I71 VanDerWaalsContact C-N 3.33Å; M69-I71 PolarHBondContact O-N 2.91Å; M69-L72 PolarHBondContact O-N 3.49Å; M69-V73 WeakPolarHBondContact O-CG2 3.37Å; M69-V73 PolarHBondContact O-N 3.06Å; M69-V73 VanDerWaalsContact O-N 3.08Å
70	K	82.1	Confident	84.3	Confident	108 Å²	108	81.6 Å²	81.6	47%	0.47	42%	0.417	S	S	.	.	H	α-helix	trans	-60.9	-41.3	174.2	-81.5	169.1	165.5	160.9	0	112.4	Y58 R66 R67 K68 L72 K74	Y58-K70 HydrophobicContact CE2-CD 4.37Å; Y58-K70 HydrophobicContact CE2-CG 4.11Å; Y58-K70 WeakPolarHBondContact OH-CE 3.49Å; Y58-K70 PolarHBondContact OH-NZ 3.02Å; R66-K70 WeakPolarHBondContact O-CG 3.47Å; R66-K70 PolarHBondContact O-N 3.18Å; R67-K70 WeakPolarHBondContact O-CB 3.31Å; R67-K70 PolarHBondContact O-N 3.16Å; K68-K70 PolarHBondContact O-N 3.48Å; K70-L72 VanDerWaalsContact C-N 3.34Å; K70-K74 WeakPolarHBondContact O-CB 3.29Å; K70-K74 WeakPolarHBondContact O-CG 3.45Å; K70-K74 PolarHBondContact O-N 3.31Å
71	I	82.3	Confident	84.8	Confident	20 Å²	20	79.1 Å²	79.1	10%	0.103	40%	0.397	C	S	.	.	H	α-helix	trans	-63.8	-42	178.6	-71.6	172.3	0	0	0	110.3	R67 K68 M69 K74 G75 D225 D228 R229	R67-I71 HydrophobicContact CG-CD1 3.79Å; R67-I71 HydrophobicContact CG-CG1 4.31Å; R67-I71 VanDerWaalsContact O-CG1 3.29Å; R67-I71 WeakPolarHBondContact O-CG1 3.47Å; R67-I71 PolarHBondContact O-N 3.11Å; K68-I71 PolarHBondContact O-N 3.31Å; M69-I71 VanDerWaalsContact C-N 3.33Å; M69-I71 PolarHBondContact O-N 2.91Å; I71-K74 PolarHBondContact O-N 3.22Å; I71-G75 WeakPolarHBondContact O-CA 3.47Å; I71-G75 PolarHBondContact O-N 2.86Å; I71-D225 HydrophobicContact CD1-CB 3.93Å; I71-D225 HydrophobicContact CG1-CB 4.43Å; I71-D228 HydrophobicContact CD1-CB 3.57Å; I71-R229 HydrophobicContact CG2-CB 3.85Å
72	L	81.5	Confident	85.2	Confident	128 Å²	128	79.1 Å²	79.1	67%	0.67	40%	0.397	S	S	*	.	H	α-helix	trans	-61.5	-50.2	176.9	-177.4	68	0	0	0	111.7	K68 M69 K70 K74 G75 V76	K68-L72 PolarHBondContact O-N 3.45Å; M69-L72 PolarHBondContact O-N 3.49Å; K70-L72 VanDerWaalsContact C-N 3.34Å; L72-K74 PolarHBondContact O-N 3.17Å; L72-G75 WeakPolarHBondContact O-CA 3.46Å; L72-G75 PolarHBondContact O-N 3.05Å; L72-V76 PolarHBondContact O-N 3.38Å; L72-V76 VanDerWaalsContact O-N 3.1Å
73	V	83.6	Confident	85.6	Confident	109 Å²	109	74.3 Å²	74.3	66%	0.661	38%	0.375	S	S	*	.	H	α-helix	trans	-60.4	-46.6	178.5	173.6	0	0	0	0	111.1	M69 G75 V76	M69-V73 WeakPolarHBondContact O-CG2 3.37Å; M69-V73 PolarHBondContact O-N 3.06Å; M69-V73 VanDerWaalsContact O-N 3.08Å; V73-G75 PolarHBondContact O-N 3.01Å; V73-V76 PolarHBondContact O-N 2.99Å
74	K	83.3	Confident	86.2	Confident	143 Å²	143	76.7 Å²	76.7	62%	0.622	37%	0.371	S	S	*	.	H	α-helix	trans	-63.9	-31.4	174.3	-71.7	-178.7	178.1	-174.8	0	112.2	K70 I71 L72 G77 R78	K70-K74 WeakPolarHBondContact O-CB 3.29Å; K70-K74 WeakPolarHBondContact O-CG 3.45Å; K70-K74 PolarHBondContact O-N 3.31Å; I71-K74 PolarHBondContact O-N 3.22Å; L72-K74 PolarHBondContact O-N 3.17Å; K74-G77 PolarHBondContact O-N 2.87Å; K74-R78 PolarHBondContact O-N 3.08Å
75	G	84.3	Confident	86.9	Confident	16 Å²	16	72.8 Å²	72.8	17%	0.165	36%	0.36	C	S	.	.	H	α-helix	trans	-61.8	-40.7	177.3	0	0	0	0	0	112.5	I71 L72 V73 G77 R78 F79	I71-G75 WeakPolarHBondContact O-CA 3.47Å; I71-G75 PolarHBondContact O-N 2.86Å; L72-G75 WeakPolarHBondContact O-CA 3.46Å; L72-G75 PolarHBondContact O-N 3.05Å; V73-G75 PolarHBondContact O-N 3.01Å; G75-G77 VanDerWaalsContact C-N 3.32Å; G75-G77 PolarHBondContact O-N 2.59Å; G75-R78 PolarHBondContact O-N 3.45Å; G75-F79 WeakPolarHBondContact O-CB 3.34Å; G75-F79 PolarHBondContact O-N 3.1Å
76	V	86.6	Confident	87.4	Confident	88 Å²	88	68 Å²	68	53%	0.533	34%	0.339	S	S	.	.	H	α-helix	trans	-59.9	-44.2	173.1	178.7	0	0	0	0	111	L72 V73 R78 F79 C80	L72-V76 PolarHBondContact O-N 3.38Å; L72-V76 VanDerWaalsContact O-N 3.1Å; V73-V76 PolarHBondContact O-N 2.99Å; V76-R78 PolarHBondContact O-N 2.87Å; V76-F79 WeakPolarHBondContact O-CB 3.4Å; V76-F79 PolarHBondContact O-N 3.47Å; V76-C80 PolarHBondContact O-N 3.41Å; V76-C80 PolarHBondContact O-SG 3.23Å; V76-C80 VanDerWaalsContact O-SG 3.39Å
77	G	89.1	Confident	87.8	Confident	35 Å²	35	66.7 Å²	66.7	36%	0.361	34%	0.338	S	S	.	.	H	α-helix	trans	-60.9	-42.9	175.3	0	0	0	0	0	112.8	K74 G75 R81	K74-G77 PolarHBondContact O-N 2.87Å; G75-G77 VanDerWaalsContact C-N 3.32Å; G75-G77 PolarHBondContact O-N 2.59Å; G77-R81 WeakPolarHBondContact O-CG 3.33Å; G77-R81 PolarHBondContact O-N 3.16Å; G77-R81 VanDerWaalsContact O-N 3.11Å
78	R	90.7	Very high	88.2	Confident	17 Å²	17	70.6 Å²	70.6	6%	0.064	35%	0.354	C	S	.	.	H	α-helix	trans	-62.5	-45.3	174.5	-68.8	-165.8	-62.2	-79.2	-3	111.8	K74 G75 V76 R81 S82 N133 D233	K74-R78 PolarHBondContact O-N 3.08Å; G75-R78 PolarHBondContact O-N 3.45Å; V76-R78 PolarHBondContact O-N 2.87Å; R78-R81 PolarHBondContact O-N 2.59Å; R78-S82 WeakPolarHBondContact O-CB 3.32Å; R78-S82 PolarHBondContact O-N 3.27Å; R78-S82 PolarHBondContact O-OG 3.02Å; R78-N133 HydrophobicContact CG-CB 4.44Å; R78-N133 WeakPolarHBondContact CG-OD1 3.3Å; R78-D233 IonicContact CZ-OD1 3.33Å; R78-D233 IonicContact NE-OD1 3.02Å; R78-D233 PolarHBondContact NE-OD1 3Å; R78-D233 IonicContact NE-OD2 3.28Å; R78-D233 IonicContact NH2-OD1 3.13Å; R78-D233 PolarHBondContact NH2-OD1 2.82Å
79	F	91.6	Very high	88.8	Confident	76 Å²	76	66.8 Å²	66.8	33%	0.333	34%	0.338	S	S	.	.	H	α-helix	trans	-54.9	-54.6	176.9	175.6	-90.7	0	0	0	111.5	G75 V76 R81 S82 I83 T236 I239	G75-F79 WeakPolarHBondContact O-CB 3.34Å; G75-F79 PolarHBondContact O-N 3.1Å; V76-F79 WeakPolarHBondContact O-CB 3.4Å; V76-F79 PolarHBondContact O-N 3.47Å; F79-R81 VanDerWaalsContact C-N 3.32Å; F79-R81 PolarHBondContact O-N 3.38Å; F79-S82 PolarHBondContact O-N 2.99Å; F79-I83 HydrophobicContact CD1-CG1 4.36Å; F79-I83 HydrophobicContact CE1-CG1 3.96Å; F79-I83 HydrophobicContact CE2-CD1 4.38Å; F79-I83 HydrophobicContact CE2-CG1 4.12Å; F79-I83 HydrophobicContact CZ-CD1 4.29Å; F79-I83 HydrophobicContact CZ-CG1 3.82Å; F79-I83 WeakPolarHBondContact O-CG1 3.39Å; F79-I83 PolarHBondContact O-N 3.21Å; F79-T236 HydrophobicContact CB-CG2 4.32Å; F79-T236 HydrophobicContact CD2-CG2 3.59Å; F79-T236 WeakPolarHBondContact CD2-OG1 3.38Å; F79-T236 HydrophobicContact CE2-CG2 4.27Å; F79-T236 HydrophobicContact CG-CG2 4.29Å; F79-I239 HydrophobicContact CE2-CD1 4.28Å
80	C	92.2	Very high	89.2	Confident	73 Å²	73	64.6 Å²	64.6	49%	0.493	33%	0.328	S	S	.	.	H	α-helix	trans	-59.9	-42.3	-179.6	-66.4	0	0	0	0	112.2	V76 I83 Y84	V76-C80 PolarHBondContact O-N 3.41Å; V76-C80 PolarHBondContact O-SG 3.23Å; V76-C80 VanDerWaalsContact O-SG 3.39Å; C80-I83 PolarHBondContact O-N 3.2Å; C80-Y84 WeakPolarHBondContact O-CB 3.49Å; C80-Y84 PolarHBondContact O-N 3.05Å
81	R	93.3	Very high	89.7	Confident	93 Å²	93	63.2 Å²	63.2	35%	0.351	33%	0.328	S	S	.	.	H	α-helix	trans	-63.7	-44.3	176.3	-72.2	-172.1	-58.2	-177.1	8.1	112.3	G77 R78 F79 Y84 V85 Q132 N133	G77-R81 WeakPolarHBondContact O-CG 3.33Å; G77-R81 PolarHBondContact O-N 3.16Å; G77-R81 VanDerWaalsContact O-N 3.11Å; R78-R81 PolarHBondContact O-N 2.59Å; F79-R81 VanDerWaalsContact C-N 3.32Å; F79-R81 PolarHBondContact O-N 3.38Å; R81-Y84 PolarHBondContact O-N 3.23Å; R81-V85 WeakPolarHBondContact O-CG2 2.94Å; R81-V85 PolarHBondContact O-N 3.38Å; R81-Q132 PolarHBondContact NH1-O 3.4Å; R81-Q132 PolarHBondContact NH2-O 3.1Å; R81-N133 PolarHBondContact NE-OD1 3.03Å; R81-N133 PolarHBondContact NH2-OD1 2.93Å
82	S	92.6	Very high	90.2	Very high	8 Å²	8	63.4 Å²	63.4	6%	0.056	33%	0.33	C	S	.	.	H	α-helix	trans	-62.2	-43.4	178.1	-69.8	0	0	0	0	112.3	R78 F79 G86 N133 Y137	R78-S82 WeakPolarHBondContact O-CB 3.32Å; R78-S82 PolarHBondContact O-N 3.27Å; R78-S82 PolarHBondContact O-OG 3.02Å; F79-S82 PolarHBondContact O-N 2.99Å; S82-G86 PolarHBondContact O-N 2.52Å; S82-N133 PolarHBondContact OG-ND2 3.32Å; S82-Y137 WeakPolarHBondContact OG-CE1 3.49Å; S82-Y137 PolarHBondContact OG-OH 3.4Å; S82-Y137 VanDerWaalsContact OG-OH 3.1Å
83	I	91.8	Very high	90.6	Very high	34 Å²	34	59.2 Å²	59.2	17%	0.174	31%	0.305	C	S	.	.	H	α-helix	trans	-64.5	-44.8	175.7	-64.7	-61.4	0	0	0	110.8	F79 C80 G86 L87 I239 L240	F79-I83 HydrophobicContact CD1-CG1 4.36Å; F79-I83 HydrophobicContact CE1-CG1 3.96Å; F79-I83 HydrophobicContact CE2-CD1 4.38Å; F79-I83 HydrophobicContact CE2-CG1 4.12Å; F79-I83 HydrophobicContact CZ-CD1 4.29Å; F79-I83 HydrophobicContact CZ-CG1 3.82Å; F79-I83 WeakPolarHBondContact O-CG1 3.39Å; F79-I83 PolarHBondContact O-N 3.21Å; C80-I83 PolarHBondContact O-N 3.2Å; I83-G86 PolarHBondContact O-N 2.99Å; I83-L87 HydrophobicContact CG2-CD1 3.68Å; I83-L87 HydrophobicContact CG2-CG 4.19Å; I83-L87 VanDerWaalsContact O-CB 3.3Å; I83-L87 WeakPolarHBondContact O-CB 3.45Å; I83-L87 VanDerWaalsContact O-CG 3.29Å; I83-L87 WeakPolarHBondContact O-CG 3.46Å; I83-L87 PolarHBondContact O-N 3.32Å; I83-I239 HydrophobicContact CD1-CG2 4.47Å; I83-L240 HydrophobicContact CD1-CB 4.03Å; I83-L240 HydrophobicContact CD1-CD1 4.11Å
84	Y	93.7	Very high	90.9	Very high	159 Å²	159	59.7 Å²	59.7	62%	0.624	30%	0.295	S	S	*	.	H	α-helix	trans	-58.2	-52	176.9	173.2	-96.5	0	0	0	112.3	C80 R81 G86 L87 Y88	C80-Y84 WeakPolarHBondContact O-CB 3.49Å; C80-Y84 PolarHBondContact O-N 3.05Å; R81-Y84 PolarHBondContact O-N 3.23Å; Y84-G86 PolarHBondContact O-N 3.2Å; Y84-L87 PolarHBondContact O-N 3.47Å; Y84-Y88 VanDerWaalsContact O-CB 3.31Å; Y84-Y88 WeakPolarHBondContact O-CB 2.92Å; Y84-Y88 PolarHBondContact O-N 2.82Å
85	V	93.4	Very high	91.3	Very high	31 Å²	31	59 Å²	59	19%	0.188	29%	0.289	C	S	.	.	H	α-helix	trans	-60.1	-47.8	179.4	170.4	0	0	0	0	110.5	R81 L87 Y88 I89 G125	R81-V85 WeakPolarHBondContact O-CG2 2.94Å; R81-V85 PolarHBondContact O-N 3.38Å; V85-L87 PolarHBondContact O-N 3.01Å; V85-Y88 PolarHBondContact O-N 3.42Å; V85-I89 HydrophobicContact CG1-CD1 3.81Å; V85-I89 VanDerWaalsContact O-CG1 3.28Å; V85-I89 WeakPolarHBondContact O-CG1 3.2Å; V85-I89 PolarHBondContact O-N 2.91Å; V85-G125 WeakPolarHBondContact CG1-O 3.44Å
86	G	91.6	Very high	91.5	Very high	6 Å²	6	58.4 Å²	58.4	6%	0.062	28%	0.282	C	S	.	.	H	α-helix	trans	-65.8	-37.7	-178.8	0	0	0	0	0	113.6	S82 I83 Y84 S90	S82-G86 PolarHBondContact O-N 2.52Å; I83-G86 PolarHBondContact O-N 2.99Å; Y84-G86 PolarHBondContact O-N 3.2Å; G86-S90 VanDerWaalsContact O-CB 3.31Å; G86-S90 WeakPolarHBondContact O-CB 3.19Å; G86-S90 PolarHBondContact O-N 3.36Å; G86-S90 PolarHBondContact O-OG 2.88Å
87	L	91.5	Very high	91.4	Very high	62 Å²	62	56.2 Å²	56.2	33%	0.325	27%	0.271	S	S	.	.	H	α-helix	trans	-68.1	-43.3	173.7	-75.3	175.6	0	0	0	111.9	I83 Y84 V85 I89 S90 V91 V243 M247	I83-L87 HydrophobicContact CG2-CD1 3.68Å; I83-L87 HydrophobicContact CG2-CG 4.19Å; I83-L87 VanDerWaalsContact O-CB 3.3Å; I83-L87 WeakPolarHBondContact O-CB 3.45Å; I83-L87 VanDerWaalsContact O-CG 3.29Å; I83-L87 WeakPolarHBondContact O-CG 3.46Å; I83-L87 PolarHBondContact O-N 3.32Å; Y84-L87 PolarHBondContact O-N 3.47Å; V85-L87 PolarHBondContact O-N 3.01Å; L87-I89 PolarHBondContact O-N 3.36Å; L87-S90 PolarHBondContact O-N 3.33Å; L87-V91 WeakPolarHBondContact O-CB 3.46Å; L87-V91 WeakPolarHBondContact O-CG2 3.46Å; L87-V91 PolarHBondContact O-N 2.93Å; L87-V243 HydrophobicContact CD2-CG1 3.79Å; L87-M247 HydrophobicContact CD2-SD 4.06Å
88	Y	93.8	Very high	91.2	Very high	121 Å²	121	58.3 Å²	58.3	48%	0.475	27%	0.273	S	S	.	.	H	α-helix	trans	-56.5	-50.3	176.1	175.4	-95.4	0	0	0	111.1	Y84 V85 S90 V91 D92	Y84-Y88 VanDerWaalsContact O-CB 3.31Å; Y84-Y88 WeakPolarHBondContact O-CB 2.92Å; Y84-Y88 PolarHBondContact O-N 2.82Å; V85-Y88 PolarHBondContact O-N 3.42Å; Y88-S90 VanDerWaalsContact C-N 3.33Å; Y88-S90 PolarHBondContact O-N 3.37Å; Y88-V91 PolarHBondContact O-N 3.08Å; Y88-D92 WeakPolarHBondContact O-CB 3.31Å; Y88-D92 PolarHBondContact O-N 3.22Å
89	I	92.7	Very high	91.2	Very high	25 Å²	25	60.5 Å²	60.5	13%	0.128	29%	0.289	C	S	.	.	H	α-helix	trans	-58.1	-48	175.4	-68	171.4	0	0	0	110.1	V85 L87 V91 D92 Y93 A122 M126	V85-I89 HydrophobicContact CG1-CD1 3.81Å; V85-I89 VanDerWaalsContact O-CG1 3.28Å; V85-I89 WeakPolarHBondContact O-CG1 3.2Å; V85-I89 PolarHBondContact O-N 2.91Å; L87-I89 PolarHBondContact O-N 3.36Å; I89-V91 VanDerWaalsContact C-N 3.34Å; I89-V91 PolarHBondContact O-N 3.39Å; I89-D92 PolarHBondContact O-N 3.26Å; I89-Y93 HydrophobicContact CG2-CD2 3.72Å; I89-Y93 HydrophobicContact CG2-CE2 3.69Å; I89-Y93 WeakPolarHBondContact O-CD2 3.44Å; I89-Y93 PolarHBondContact O-N 3.01Å; I89-A122 WeakPolarHBondContact CD1-O 3.41Å; I89-A122 HydrophobicContact CG1-CB 4.27Å; I89-A122 HydrophobicContact CG2-CB 3.67Å; I89-M126 HydrophobicContact CD1-CB 4.48Å
90	S	90.7	Very high	91	Very high	4 Å²	4	62.8 Å²	62.8	3%	0.028	30%	0.302	C	S	.	.	H	α-helix	trans	-62.3	-40	-177.4	-61.6	0	0	0	0	112.9	G86 L87 Y88 W94 I244 H248	G86-S90 VanDerWaalsContact O-CB 3.31Å; G86-S90 WeakPolarHBondContact O-CB 3.19Å; G86-S90 PolarHBondContact O-N 3.36Å; G86-S90 PolarHBondContact O-OG 2.88Å; L87-S90 PolarHBondContact O-N 3.33Å; Y88-S90 VanDerWaalsContact C-N 3.33Å; Y88-S90 PolarHBondContact O-N 3.37Å; S90-W94 WeakPolarHBondContact O-CB 3.48Å; S90-W94 PolarHBondContact O-N 2.99Å; S90-I244 WeakPolarHBondContact OG-CG1 3.2Å; S90-H248 PolarHBondContact O-CE1 2.96Å; S90-H248 PolarHBondContact O-NE2 3.23Å
91	V	92.6	Very high	90.8	Very high	79 Å²	79	60 Å²	60	48%	0.479	28%	0.282	S	S	.	.	H	α-helix	trans	-68.2	-40.4	175.9	171.6	0	0	0	0	110.7	L87 Y88 I89 W94 W95 M247	L87-V91 WeakPolarHBondContact O-CB 3.46Å; L87-V91 WeakPolarHBondContact O-CG2 3.46Å; L87-V91 PolarHBondContact O-N 2.93Å; Y88-V91 PolarHBondContact O-N 3.08Å; I89-V91 VanDerWaalsContact C-N 3.34Å; I89-V91 PolarHBondContact O-N 3.39Å; V91-W94 PolarHBondContact O-N 3.44Å; V91-W95 WeakPolarHBondContact O-CB 3.34Å; V91-W95 PolarHBondContact O-N 3.24Å; V91-M247 HydrophobicContact CG2-CE 4.01Å
92	D	93	Very high	90.5	Very high	25 Å²	25	65.4 Å²	65.4	13%	0.134	30%	0.302	C	S	.	.	H	α-helix	trans	-62.7	-42.5	177.1	-171	35.6	0	0	0	112	Y88 I89 W95 T96 R121	Y88-D92 WeakPolarHBondContact O-CB 3.31Å; Y88-D92 PolarHBondContact O-N 3.22Å; I89-D92 PolarHBondContact O-N 3.26Å; D92-W95 PolarHBondContact O-N 3.3Å; D92-T96 VanDerWaalsContact O-CB 3.28Å; D92-T96 WeakPolarHBondContact O-CB 3.45Å; D92-T96 PolarHBondContact O-N 3.39Å; D92-T96 PolarHBondContact O-OG1 3.37Å; D92-R121 VanDerWaalsContact CG-NH2 3.33Å; D92-R121 IonicContact OD1-CZ 2.7Å; D92-R121 IonicContact OD1-NE 3.58Å; D92-R121 IonicContact OD1-NH2 3.6Å; D92-R121 PolarHBondContact OD1-NH2 3.42Å; D92-R121 IonicContact OD2-CZ 3.34Å; D92-R121 IonicContact OD2-NE 3.19Å; D92-R121 PolarHBondContact OD2-NE 3.17Å; D92-R121 IonicContact OD2-NH2 3.09Å; D92-R121 PolarHBondContact OD2-NH2 2.75Å
93	Y	90.1	Very high	89.9	Confident	40 Å²	40	69 Å²	69	16%	0.157	34%	0.341	C	S	.	.	H	α-helix	trans	-61.2	-46.6	172	-90.3	-83	0	0	0	112	I89 W95 T96 S97 M115 H119 A122 Y155	I89-Y93 HydrophobicContact CG2-CD2 3.72Å; I89-Y93 HydrophobicContact CG2-CE2 3.69Å; I89-Y93 WeakPolarHBondContact O-CD2 3.44Å; I89-Y93 PolarHBondContact O-N 3.01Å; Y93-W95 VanDerWaalsContact C-N 3.34Å; Y93-W95 PolarHBondContact O-N 3.47Å; Y93-T96 PolarHBondContact O-N 3.36Å; Y93-S97 WeakPolarHBondContact O-CB 3.39Å; Y93-S97 PolarHBondContact O-N 3.41Å; Y93-S97 PolarHBondContact O-OG 3.2Å; Y93-M115 HydrophobicContact CD1-CE 3.95Å; Y93-M115 HydrophobicContact CE1-CE 3.75Å; Y93-H119 AromaticContact CE1-CE1 3.77Å; Y93-H119 AromaticContact CE1-ND1 3.58Å; Y93-H119 AromaticContact CZ-ND1 3.57Å; Y93-H119 PolarHBondContact OH-ND1 3.48Å; Y93-A122 HydrophobicContact CE2-CB 3.55Å; Y93-Y155 WeakPolarHBondContact OH-CE2 3.26Å; Y93-Y155 PolarHBondContact OH-OH 3.38Å
94	W	89.5	Confident	89.6	Confident	118 Å²	118	71 Å²	71	45%	0.447	35%	0.352	S	S	.	.	H	α-helix	trans	-61.9	-45	-179.5	-178.2	87.4	0	0	0	110.9	S90 V91 S97 N98 V99	S90-W94 WeakPolarHBondContact O-CB 3.48Å; S90-W94 PolarHBondContact O-N 2.99Å; V91-W94 PolarHBondContact O-N 3.44Å; W94-S97 PolarHBondContact O-OG 3.17Å; W94-N98 VanDerWaalsContact O-CB 3.26Å; W94-N98 WeakPolarHBondContact O-CB 3.46Å; W94-N98 PolarHBondContact O-N 3.37Å; W94-N98 PolarHBondContact O-ND2 3.38Å; W94-V99 HydrophobicContact CZ3-CG2 4.31Å
95	W	91.7	Very high	88.9	Confident	129 Å²	129	68.2 Å²	68.2	49%	0.489	35%	0.348	S	S	.	.	H	α-helix	trans	-65.4	-47.1	178.4	-174.2	-93.7	0	0	0	112.1	V91 D92 Y93 S97 V99 M100	V91-W95 WeakPolarHBondContact O-CB 3.34Å; V91-W95 PolarHBondContact O-N 3.24Å; D92-W95 PolarHBondContact O-N 3.3Å; Y93-W95 VanDerWaalsContact C-N 3.34Å; Y93-W95 PolarHBondContact O-N 3.47Å; W95-S97 PolarHBondContact O-N 3.02Å; W95-V99 HydrophobicContact CD2-CB 4.04Å; W95-V99 HydrophobicContact CD2-CG1 4.35Å; W95-V99 HydrophobicContact CD2-CG2 4.03Å; W95-V99 HydrophobicContact CE3-CB 4.31Å; W95-V99 HydrophobicContact CE3-CG2 3.81Å; W95-V99 HydrophobicContact CG-CB 4.42Å; W95-V99 HydrophobicContact CH2-CG1 4.1Å; W95-V99 HydrophobicContact CZ2-CB 4.43Å; W95-V99 HydrophobicContact CZ2-CG1 3.84Å; W95-V99 HydrophobicContact CZ3-CG1 4.47Å; W95-V99 HydrophobicContact CZ3-CG2 4.08Å; W95-V99 WeakPolarHBondContact O-CA 3.29Å; W95-V99 VanDerWaalsContact O-CB 3.25Å; W95-V99 WeakPolarHBondContact O-CB 3.48Å; W95-V99 PolarHBondContact O-N 2.79Å; W95-M100 PolarHBondContact O-N 3.12Å
96	T	89.6	Confident	88.1	Confident	3 Å²	3	74.4 Å²	74.4	2%	0.018	37%	0.372	C	S	.	.	I	π-helix	trans	-60.7	-49	179.7	-59.6	0	0	0	0	110.6	D92 Y93 M100 L101 M115 C118 R121	D92-T96 VanDerWaalsContact O-CB 3.28Å; D92-T96 WeakPolarHBondContact O-CB 3.45Å; D92-T96 PolarHBondContact O-N 3.39Å; D92-T96 PolarHBondContact O-OG1 3.37Å; Y93-T96 PolarHBondContact O-N 3.36Å; T96-M100 PolarHBondContact O-N 2.84Å; T96-L101 HydrophobicContact CG2-CD1 3.76Å; T96-L101 HydrophobicContact CG2-CG 4.08Å; T96-L101 WeakPolarHBondContact O-CB 3.44Å; T96-L101 WeakPolarHBondContact O-CG 3.44Å; T96-L101 PolarHBondContact O-N 3.21Å; T96-M115 HydrophobicContact CG2-SD 4.14Å; T96-C118 HydrophobicContact CG2-CB 3.95Å; T96-R121 PolarHBondContact OG1-NH2 2.99Å
97	S	84.6	Confident	87.3	Confident	43 Å²	43	78.5 Å²	78.5	30%	0.301	40%	0.399	S	S	.	.	I	π-helix	trans	-73.3	-40.5	-176.7	57.5	0	0	0	0	114.3	Y93 W94 W95	Y93-S97 WeakPolarHBondContact O-CB 3.39Å; Y93-S97 PolarHBondContact O-N 3.41Å; Y93-S97 PolarHBondContact O-OG 3.2Å; W94-S97 PolarHBondContact O-OG 3.17Å; W95-S97 PolarHBondContact O-N 3.02Å
98	N	85.6	Confident	86.8	Confident	78 Å²	78	76.7 Å²	76.7	42%	0.417	39%	0.392	S	S	.	.	I	π-helix	trans	-97	-19.3	-172.8	-64.8	-82.4	0	0	0	114.3	W94 R102	W94-N98 VanDerWaalsContact O-CB 3.26Å; W94-N98 WeakPolarHBondContact O-CB 3.46Å; W94-N98 PolarHBondContact O-N 3.37Å; W94-N98 PolarHBondContact O-ND2 3.38Å; N98-R102 WeakPolarHBondContact O-CB 3.49Å; N98-R102 WeakPolarHBondContact O-CD 3.45Å
99	V	89.1	Confident	86.3	Confident	63 Å²	63	76.2 Å²	76.2	38%	0.382	40%	0.404	S	S	.	.	I	π-helix	trans	-115.5	-60.3	-177.2	-174.2	0	0	0	0	111.1	W94 W95	W94-V99 HydrophobicContact CZ3-CG2 4.31Å; W95-V99 HydrophobicContact CD2-CB 4.04Å; W95-V99 HydrophobicContact CD2-CG1 4.35Å; W95-V99 HydrophobicContact CD2-CG2 4.03Å; W95-V99 HydrophobicContact CE3-CB 4.31Å; W95-V99 HydrophobicContact CE3-CG2 3.81Å; W95-V99 HydrophobicContact CG-CB 4.42Å; W95-V99 HydrophobicContact CH2-CG1 4.1Å; W95-V99 HydrophobicContact CZ2-CB 4.43Å; W95-V99 HydrophobicContact CZ2-CG1 3.84Å; W95-V99 HydrophobicContact CZ3-CG1 4.47Å; W95-V99 HydrophobicContact CZ3-CG2 4.08Å; W95-V99 WeakPolarHBondContact O-CA 3.29Å; W95-V99 VanDerWaalsContact O-CB 3.25Å; W95-V99 WeakPolarHBondContact O-CB 3.48Å; W95-V99 PolarHBondContact O-N 2.79Å
100	M	88.3	Confident	85.8	Confident	125 Å²	125	78.8 Å²	78.8	62%	0.616	42%	0.424	S	S	*	.	I	π-helix	trans	-70.6	-41.8	-173.2	-64.7	-169.5	81.7	0	0	113	W95 T96	W95-M100 PolarHBondContact O-N 3.12Å; T96-M100 PolarHBondContact O-N 2.84Å
101	L	88.1	Confident	85.5	Confident	15 Å²	15	80.1 Å²	80.1	8%	0.079	43%	0.429	C	S	.	.	T	Hydrogen-bonded Turn	trans	-99.9	16	-176.9	-56.8	-179.6	0	0	0	112.9	T96 G103 L104 F111 M115	T96-L101 HydrophobicContact CG2-CD1 3.76Å; T96-L101 HydrophobicContact CG2-CG 4.08Å; T96-L101 WeakPolarHBondContact O-CB 3.44Å; T96-L101 WeakPolarHBondContact O-CG 3.44Å; T96-L101 PolarHBondContact O-N 3.21Å; L101-G103 PolarHBondContact O-N 3.2Å; L101-L104 HydrophobicContact CB-CD1 4.4Å; L101-L104 HydrophobicContact CD2-CD1 3.86Å; L101-L104 PolarHBondContact O-N 2.71Å; L101-F111 HydrophobicContact CB-CD2 3.7Å; L101-F111 HydrophobicContact CB-CE2 3.81Å; L101-F111 HydrophobicContact CD1-CD2 3.87Å; L101-F111 HydrophobicContact CD1-CE2 3.95Å; L101-F111 HydrophobicContact CD1-CG 4.26Å; L101-F111 HydrophobicContact CD1-CZ 4.43Å; L101-F111 HydrophobicContact CG-CD2 4.33Å; L101-M115 HydrophobicContact CD1-CG 3.74Å; L101-M115 HydrophobicContact CD1-SD 3.93Å
102	R	86.6	Confident	84.9	Confident	205 Å²	205	79.5 Å²	79.5	77%	0.774	43%	0.426	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.9	128.4	-176.1	-168	-179.9	179.5	171.1	-1.3	110.8	N98 L104	N98-R102 WeakPolarHBondContact O-CB 3.49Å; N98-R102 WeakPolarHBondContact O-CD 3.45Å; R102-L104 PolarHBondContact O-N 3.41Å
103	G	81.1	Confident	84.6	Confident	84 Å²	84	80.9 Å²	80.9	87%	0.866	44%	0.44	S	S	*	.	T	Hydrogen-bonded Turn	trans	80.2	0.1	177.1	0	0	0	0	0	114.6	L101	L101-G103 PolarHBondContact O-N 3.2Å
104	L	83.6	Confident	84.5	Confident	77 Å²	77	79.8 Å²	79.8	40%	0.403	44%	0.441	S	S	.	.			trans	-80.6	142.3	167.9	-65.4	176.5	0	0	0	110.1	L101 R102 F111	L101-L104 HydrophobicContact CB-CD1 4.4Å; L101-L104 HydrophobicContact CD2-CD1 3.86Å; L101-L104 PolarHBondContact O-N 2.71Å; R102-L104 PolarHBondContact O-N 3.41Å; L104-F111 HydrophobicContact CB-CB 4.29Å; L104-F111 HydrophobicContact CB-CD2 4.2Å
105	D	80.8	Confident	84.3	Confident	100 Å²	100	75.5 Å²	75.5	54%	0.535	43%	0.427	S	S	.	.			trans	-64.9	137.3	169.5	177.4	33.9	0	0	0	110	S107 S108 F111	D105-S107 VanDerWaalsContact CG-OG 3.27Å; D105-S107 PolarHBondContact O-N 3.04Å; D105-S107 PolarHBondContact OD1-OG 2.96Å; D105-S107 WeakPolarHBondContact OD2-CB 3.39Å; D105-S107 PolarHBondContact OD2-OG 3.11Å; D105-S108 VanDerWaalsContact O-CB 3.24Å; D105-S108 WeakPolarHBondContact O-CB 3.39Å; D105-S108 PolarHBondContact O-N 3.06Å; D105-S108 PolarHBondContact O-OG 2.84Å; D105-F111 VanDerWaalsContact O-CB 3.23Å; D105-F111 WeakPolarHBondContact O-CB 3.34Å
106	K	76.7	Confident	84.1	Confident	160 Å²	160	71.2 Å²	71.2	70%	0.696	42%	0.417	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65	-28.5	-176.1	-69.1	-176.6	179	178.3	0	112.3	S108 F111	K106-S108 VanDerWaalsContact C-N 3.31Å; K106-F111 HydrophobicContact CB-CD1 4.31Å; K106-F111 HydrophobicContact CB-CE1 4.17Å; K106-F111 HydrophobicContact CG-CE1 4.14Å; K106-F111 HydrophobicContact CG-CE2 4.29Å; K106-F111 HydrophobicContact CG-CZ 3.98Å; K106-F111 VanDerWaalsContact O-CD1 3.24Å; K106-F111 WeakPolarHBondContact O-CD1 3.08Å
107	S	73.7	Confident	84.2	Confident	92 Å²	92	76.3 Å²	76.3	64%	0.643	44%	0.443	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.3	-8.4	173.3	18.4	0	0	0	0	113.8	D105	D105-S107 VanDerWaalsContact CG-OG 3.27Å; D105-S107 PolarHBondContact O-N 3.04Å; D105-S107 PolarHBondContact OD1-OG 2.96Å; D105-S107 WeakPolarHBondContact OD2-CB 3.39Å; D105-S107 PolarHBondContact OD2-OG 3.11Å
108	S	81.3	Confident	84.6	Confident	25 Å²	25	74.3 Å²	74.3	18%	0.175	43%	0.429	C	S	.	.	S	Bend	trans	-67.7	138.7	-178.5	70.9	0	0	0	0	111.1	D105 K106 S110 F111 V112	D105-S108 VanDerWaalsContact O-CB 3.24Å; D105-S108 WeakPolarHBondContact O-CB 3.39Å; D105-S108 PolarHBondContact O-N 3.06Å; D105-S108 PolarHBondContact O-OG 2.84Å; K106-S108 VanDerWaalsContact C-N 3.31Å; S108-S110 PolarHBondContact O-N 2.91Å; S108-S110 VanDerWaalsContact O-N 3.13Å; S108-F111 WeakPolarHBondContact O-CB 3.5Å; S108-F111 PolarHBondContact O-N 3.27Å; S108-F111 VanDerWaalsContact OG-CB 3.28Å; S108-F111 WeakPolarHBondContact OG-CB 3.29Å; S108-F111 PolarHBondContact OG-N 2.87Å; S108-V112 PolarHBondContact O-N 3.3Å; S108-V112 VanDerWaalsContact O-N 3.09Å
109	P	82.4	Confident	84.8	Confident	110 Å²	110	72.3 Å²	72.3	71%	0.714	42%	0.417	S	S	*	.	H	α-helix	trans	-54.4	-35.3	178	-28.3	35	0	0	0	113.2	V112 A113	P109-V112 PolarHBondContact O-N 2.65Å; P109-A113 WeakPolarHBondContact O-CB 3.28Å; P109-A113 PolarHBondContact O-N 3.15Å
110	S	83	Confident	85	Confident	79 Å²	79	72.2 Å²	72.2	55%	0.552	41%	0.413	S	S	*	.	H	α-helix	trans	-65.8	-39	176.9	-55.4	0	0	0	0	112.8	S108 G114	S108-S110 PolarHBondContact O-N 2.91Å; S108-S110 VanDerWaalsContact O-N 3.13Å; S110-G114 PolarHBondContact O-N 3.33Å
111	F	83.8	Confident	85.3	Confident	32 Å²	32	70.5 Å²	70.5	14%	0.14	40%	0.399	C	S	.	.	H	α-helix	trans	-65.7	-47.6	174.9	-177.2	-84.2	0	0	0	110.9	L101 L104 D105 K106 S108 A113 G114 M115	L101-F111 HydrophobicContact CB-CD2 3.7Å; L101-F111 HydrophobicContact CB-CE2 3.81Å; L101-F111 HydrophobicContact CD1-CD2 3.87Å; L101-F111 HydrophobicContact CD1-CE2 3.95Å; L101-F111 HydrophobicContact CD1-CG 4.26Å; L101-F111 HydrophobicContact CD1-CZ 4.43Å; L101-F111 HydrophobicContact CG-CD2 4.33Å; L104-F111 HydrophobicContact CB-CB 4.29Å; L104-F111 HydrophobicContact CB-CD2 4.2Å; D105-F111 VanDerWaalsContact O-CB 3.23Å; D105-F111 WeakPolarHBondContact O-CB 3.34Å; K106-F111 HydrophobicContact CB-CD1 4.31Å; K106-F111 HydrophobicContact CB-CE1 4.17Å; K106-F111 HydrophobicContact CG-CE1 4.14Å; K106-F111 HydrophobicContact CG-CE2 4.29Å; K106-F111 HydrophobicContact CG-CZ 3.98Å; K106-F111 VanDerWaalsContact O-CD1 3.24Å; K106-F111 WeakPolarHBondContact O-CD1 3.08Å; S108-F111 WeakPolarHBondContact O-CB 3.5Å; S108-F111 PolarHBondContact O-N 3.27Å; S108-F111 VanDerWaalsContact OG-CB 3.28Å; S108-F111 WeakPolarHBondContact OG-CB 3.29Å; S108-F111 PolarHBondContact OG-N 2.87Å; F111-A113 VanDerWaalsContact C-N 3.34Å; F111-A113 PolarHBondContact O-N 2.63Å; F111-G114 PolarHBondContact O-N 3.06Å; F111-M115 HydrophobicContact CD1-CG 4.04Å; F111-M115 HydrophobicContact CE1-CG 3.57Å; F111-M115 HydrophobicContact CZ-CG 3.91Å; F111-M115 HydrophobicContact CZ-SD 4.45Å; F111-M115 PolarHBondContact O-N 3.34Å
112	V	81.3	Confident	85.6	Confident	66 Å²	66	69.8 Å²	69.8	40%	0.4	40%	0.396	S	S	.	.	H	α-helix	trans	-59.9	-44.9	178.8	177.1	0	0	0	0	110.9	S108 P109 M115 S116	S108-V112 PolarHBondContact O-N 3.3Å; S108-V112 VanDerWaalsContact O-N 3.09Å; P109-V112 PolarHBondContact O-N 2.65Å; V112-M115 PolarHBondContact O-N 3.04Å; V112-S116 WeakPolarHBondContact O-CB 3.4Å; V112-S116 PolarHBondContact O-N 3.39Å
113	A	85.3	Confident	85.8	Confident	54 Å²	54	60 Å²	60	45%	0.446	36%	0.359	S	S	.	.	H	α-helix	trans	-63.1	-42.7	177.1	0	0	0	0	0	112.6	P109 F111 S116 L117	P109-A113 WeakPolarHBondContact O-CB 3.28Å; P109-A113 PolarHBondContact O-N 3.15Å; F111-A113 VanDerWaalsContact C-N 3.34Å; F111-A113 PolarHBondContact O-N 2.63Å; A113-S116 PolarHBondContact O-N 3.09Å; A113-L117 PolarHBondContact O-N 3.36Å; A113-L117 VanDerWaalsContact O-N 3.15Å
114	G	87.7	Confident	86.4	Confident	17 Å²	17	59.7 Å²	59.7	18%	0.175	34%	0.337	C	S	.	.	H	α-helix	trans	-63.4	-40.9	176.5	0	0	0	0	0	113	S110 F111 L117 C118	S110-G114 PolarHBondContact O-N 3.33Å; F111-G114 PolarHBondContact O-N 3.06Å; G114-L117 PolarHBondContact O-N 2.92Å; G114-C118 PolarHBondContact O-N 3.08Å
115	M	87.3	Confident	86.9	Confident	28 Å²	28	56.6 Å²	56.6	14%	0.138	32%	0.324	C	S	.	.	H	α-helix	trans	-67.6	-41.9	175.3	-77.6	-55.2	-52.4	0	0	112.4	Y93 T96 L101 F111 V112 L117 C118 H119	Y93-M115 HydrophobicContact CD1-CE 3.95Å; Y93-M115 HydrophobicContact CE1-CE 3.75Å; T96-M115 HydrophobicContact CG2-SD 4.14Å; L101-M115 HydrophobicContact CD1-CG 3.74Å; L101-M115 HydrophobicContact CD1-SD 3.93Å; F111-M115 HydrophobicContact CD1-CG 4.04Å; F111-M115 HydrophobicContact CE1-CG 3.57Å; F111-M115 HydrophobicContact CZ-CG 3.91Å; F111-M115 HydrophobicContact CZ-SD 4.45Å; F111-M115 PolarHBondContact O-N 3.34Å; V112-M115 PolarHBondContact O-N 3.04Å; M115-L117 VanDerWaalsContact C-N 3.31Å; M115-L117 PolarHBondContact O-N 2.93Å; M115-C118 CarbonylContact O-C 3.45Å; M115-C118 WeakPolarHBondContact O-CA 3.23Å; M115-C118 WeakPolarHBondContact O-CB 3.49Å; M115-C118 PolarHBondContact O-N 3.22Å; M115-H119 PolarHBondContact O-CD2 3.37Å; M115-H119 VanDerWaalsContact O-CD2 3.31Å; M115-H119 VanDerWaalsContact O-CG 3.27Å; M115-H119 PolarHBondContact O-N 3.19Å
116	S	87.5	Confident	87.4	Confident	40 Å²	40	54.3 Å²	54.3	28%	0.28	31%	0.311	S	S	.	.	H	α-helix	trans	-55.2	-44.6	174.9	172.5	0	0	0	0	111.7	V112 A113 C118 H119 Q120 E154	V112-S116 WeakPolarHBondContact O-CB 3.4Å; V112-S116 PolarHBondContact O-N 3.39Å; A113-S116 PolarHBondContact O-N 3.09Å; S116-C118 VanDerWaalsContact C-N 3.32Å; S116-C118 PolarHBondContact O-N 2.71Å; S116-H119 WeakPolarHBondContact O-CB 3.49Å; S116-H119 PolarHBondContact O-N 3.06Å; S116-Q120 PolarHBondContact O-N 3.19Å; S116-E154 WeakPolarHBondContact CB-OE1 3.29Å; S116-E154 PolarHBondContact OG-OE1 3.3Å
117	L	90.8	Very high	88.1	Confident	110 Å²	110	47.4 Å²	47.4	58%	0.576	28%	0.282	S	S	*	.	H	α-helix	trans	-63.1	-36.6	175.2	-69.9	174.3	0	0	0	113	A113 G114 M115 R121	A113-L117 PolarHBondContact O-N 3.36Å; A113-L117 VanDerWaalsContact O-N 3.15Å; G114-L117 PolarHBondContact O-N 2.92Å; M115-L117 VanDerWaalsContact C-N 3.31Å; M115-L117 PolarHBondContact O-N 2.93Å; L117-R121 WeakPolarHBondContact O-CG 3.49Å; L117-R121 PolarHBondContact O-N 3.05Å; L117-R121 VanDerWaalsContact O-N 3.16Å; L117-R121 PolarHBondContact O-NH1 3.07Å
118	C	92.1	Very high	88.9	Confident	0 Å²	0	48.5 Å²	48.5	0%	0	28%	0.277	C	S	.	.	H	α-helix	trans	-68.8	-41.8	174.5	-176	0	0	0	0	111.5	T96 G114 M115 S116 Q120 R121 A122	T96-C118 HydrophobicContact CG2-CB 3.95Å; G114-C118 PolarHBondContact O-N 3.08Å; M115-C118 CarbonylContact O-C 3.45Å; M115-C118 WeakPolarHBondContact O-CA 3.23Å; M115-C118 WeakPolarHBondContact O-CB 3.49Å; M115-C118 PolarHBondContact O-N 3.22Å; S116-C118 VanDerWaalsContact C-N 3.32Å; S116-C118 PolarHBondContact O-N 2.71Å; C118-Q120 VanDerWaalsContact C-N 3.31Å; C118-Q120 PolarHBondContact O-N 3.32Å; C118-R121 PolarHBondContact O-N 3.3Å; C118-A122 WeakPolarHBondContact O-CB 3.43Å; C118-A122 PolarHBondContact O-N 3.08Å
119	H	90.8	Very high	89.3	Confident	37 Å²	37	47.8 Å²	47.8	17%	0.171	27%	0.273	C	S	.	.	H	α-helix	trans	-56.8	-44.5	173.2	-63.3	-36.2	0	0	0	111.6	Y93 M115 S116 A122 A123 P152 E154 Y155	Y93-H119 AromaticContact CE1-CE1 3.77Å; Y93-H119 AromaticContact CE1-ND1 3.58Å; Y93-H119 AromaticContact CZ-ND1 3.57Å; Y93-H119 PolarHBondContact OH-ND1 3.48Å; M115-H119 PolarHBondContact O-CD2 3.37Å; M115-H119 VanDerWaalsContact O-CD2 3.31Å; M115-H119 VanDerWaalsContact O-CG 3.27Å; M115-H119 PolarHBondContact O-N 3.19Å; S116-H119 WeakPolarHBondContact O-CB 3.49Å; S116-H119 PolarHBondContact O-N 3.06Å; H119-A122 PolarHBondContact O-N 3.23Å; H119-A123 WeakPolarHBondContact O-CB 3.5Å; H119-A123 PolarHBondContact O-N 2.94Å; H119-P152 HydrophobicContact CB-CB 4.13Å; H119-E154 HydrophobicContact CB-CB 4.01Å; H119-E154 HydrophobicContact CB-CG 4.11Å; H119-E154 IonicContact CD2-OE2 2.94Å; H119-Y155 HydrophobicContact CB-CD2 4.36Å; H119-Y155 HydrophobicContact CB-CE2 4.13Å
120	Q	93.5	Very high	89.6	Confident	61 Å²	61	42.8 Å²	42.8	29%	0.285	24%	0.242	S	C	.	.	H	α-helix	trans	-61.3	-51.7	177.5	-171.8	62.3	58	0	0	112.3	S116 C118 A122 A123 D124 E154 T158	S116-Q120 PolarHBondContact O-N 3.19Å; C118-Q120 VanDerWaalsContact C-N 3.31Å; C118-Q120 PolarHBondContact O-N 3.32Å; Q120-A122 VanDerWaalsContact C-N 3.27Å; Q120-A122 PolarHBondContact O-N 2.92Å; Q120-A123 PolarHBondContact O-N 2.91Å; Q120-D124 PolarHBondContact NE2-OD1 2.93Å; Q120-D124 PolarHBondContact O-N 2.82Å; Q120-E154 HydrophobicContact CB-CB 4.23Å; Q120-E154 HydrophobicContact CB-CG 4.1Å; Q120-T158 PolarHBondContact NE2-OG1 3.44Å
121	R	95.1	Very high	89.8	Confident	88 Å²	88	42 Å²	42	33%	0.332	23%	0.233	S	C	.	.	H	α-helix	trans	-58.9	-40.6	178.4	-70	-169.9	-56.9	-90.1	10.7	112.2	D92 T96 L117 C118 D124 G125	D92-R121 VanDerWaalsContact CG-NH2 3.33Å; D92-R121 IonicContact OD1-CZ 2.7Å; D92-R121 IonicContact OD1-NE 3.58Å; D92-R121 IonicContact OD1-NH2 3.6Å; D92-R121 PolarHBondContact OD1-NH2 3.42Å; D92-R121 IonicContact OD2-CZ 3.34Å; D92-R121 IonicContact OD2-NE 3.19Å; D92-R121 PolarHBondContact OD2-NE 3.17Å; D92-R121 IonicContact OD2-NH2 3.09Å; D92-R121 PolarHBondContact OD2-NH2 2.75Å; T96-R121 PolarHBondContact OG1-NH2 2.99Å; L117-R121 WeakPolarHBondContact O-CG 3.49Å; L117-R121 PolarHBondContact O-N 3.05Å; L117-R121 VanDerWaalsContact O-N 3.16Å; L117-R121 PolarHBondContact O-NH1 3.07Å; C118-R121 PolarHBondContact O-N 3.3Å; R121-D124 PolarHBondContact O-N 2.96Å; R121-G125 PolarHBondContact O-N 2.8Å
122	A	92.8	Very high	89.9	Confident	1 Å²	1	44.8 Å²	44.8	1%	0.008	25%	0.247	C	C	.	.	H	α-helix	trans	-66.8	-41.8	178	0	0	0	0	0	112.5	I89 Y93 C118 H119 Q120 G125 M126 Y155	I89-A122 WeakPolarHBondContact CD1-O 3.41Å; I89-A122 HydrophobicContact CG1-CB 4.27Å; I89-A122 HydrophobicContact CG2-CB 3.67Å; Y93-A122 HydrophobicContact CE2-CB 3.55Å; C118-A122 WeakPolarHBondContact O-CB 3.43Å; C118-A122 PolarHBondContact O-N 3.08Å; H119-A122 PolarHBondContact O-N 3.23Å; Q120-A122 VanDerWaalsContact C-N 3.27Å; Q120-A122 PolarHBondContact O-N 2.92Å; A122-G125 PolarHBondContact O-N 3.1Å; A122-M126 WeakPolarHBondContact O-CB 3.33Å; A122-M126 PolarHBondContact O-N 3.14Å; A122-Y155 HydrophobicContact CB-CE1 4.28Å; A122-Y155 WeakPolarHBondContact CB-OH 3.25Å
123	A	92.3	Very high	90.2	Very high	0 Å²	0	42.1 Å²	42.1	0%	0	23%	0.23	C	C	.	.	H	α-helix	trans	-62.1	-43.3	175.4	0	0	0	0	0	111.8	H119 Q120 M126 V127 Y155 T158	H119-A123 WeakPolarHBondContact O-CB 3.5Å; H119-A123 PolarHBondContact O-N 2.94Å; Q120-A123 PolarHBondContact O-N 2.91Å; A123-M126 PolarHBondContact O-N 2.88Å; A123-V127 PolarHBondContact O-N 2.96Å; A123-Y155 HydrophobicContact CB-CD1 3.61Å; A123-Y155 HydrophobicContact CB-CE1 4.03Å; A123-Y155 HydrophobicContact CB-CG 3.96Å; A123-T158 HydrophobicContact CB-CG2 3.98Å
124	D	93.6	Very high	90	Very high	76 Å²	76	39.9 Å²	39.9	41%	0.406	21%	0.212	S	C	.	.	H	α-helix	trans	-62.5	-47.4	178.1	-63.6	-22.9	0	0	0	110.9	Q120 R121 M126 V127 E128 T158	Q120-D124 PolarHBondContact NE2-OD1 2.93Å; Q120-D124 PolarHBondContact O-N 2.82Å; R121-D124 PolarHBondContact O-N 2.96Å; D124-M126 VanDerWaalsContact C-N 3.3Å; D124-M126 PolarHBondContact O-N 3.43Å; D124-V127 PolarHBondContact O-N 3.49Å; D124-E128 PolarHBondContact O-N 3.35Å; D124-T158 VanDerWaalsContact OD1-CG2 3.29Å; D124-T158 WeakPolarHBondContact OD1-CG2 3.24Å; D124-T158 PolarHBondContact OD1-OG1 2.83Å
125	G	92.8	Very high	89.7	Confident	13 Å²	13	39.1 Å²	39.1	13%	0.134	21%	0.205	C	C	.	.	H	α-helix	trans	-61.8	-36.2	175.9	0	0	0	0	0	113	V85 R121 A122 G129	V85-G125 WeakPolarHBondContact CG1-O 3.44Å; R121-G125 PolarHBondContact O-N 2.8Å; A122-G125 PolarHBondContact O-N 3.1Å; G125-G129 PolarHBondContact O-N 3.2Å
126	M	91.6	Very high	89.4	Confident	52 Å²	52	37.8 Å²	37.8	26%	0.256	20%	0.198	S	C	.	.	H	α-helix	trans	-67.8	-42.6	176.2	-172.4	162.2	73.7	0	0	112.1	I89 A122 A123 D124 G129 A130 L144 Y155 L159	I89-M126 HydrophobicContact CD1-CB 4.48Å; A122-M126 WeakPolarHBondContact O-CB 3.33Å; A122-M126 PolarHBondContact O-N 3.14Å; A123-M126 PolarHBondContact O-N 2.88Å; D124-M126 VanDerWaalsContact C-N 3.3Å; D124-M126 PolarHBondContact O-N 3.43Å; M126-G129 PolarHBondContact O-N 3.18Å; M126-A130 VanDerWaalsContact O-CB 3.26Å; M126-A130 WeakPolarHBondContact O-CB 3.42Å; M126-A130 PolarHBondContact O-N 3.3Å; M126-L144 HydrophobicContact CE-CD1 3.98Å; M126-L144 HydrophobicContact SD-CD1 4.17Å; M126-Y155 HydrophobicContact CE-CD1 3.6Å; M126-Y155 HydrophobicContact CE-CE1 3.86Å; M126-L159 HydrophobicContact CE-CD1 3.41Å; M126-L159 VanDerWaalsContact CE-CD1 3.41Å; M126-L159 HydrophobicContact CE-CD2 3.43Å; M126-L159 VanDerWaalsContact CE-CD2 3.43Å; M126-L159 HydrophobicContact CE-CG 3.84Å; M126-L159 HydrophobicContact CG-CD2 4.41Å
127	V	90.8	Very high	89.4	Confident	15 Å²	15	36.7 Å²	36.7	9%	0.091	19%	0.188	C	C	.	.	H	α-helix	trans	-65.1	-44	175.2	165.9	0	0	0	0	111.2	A123 D124 G129 A130 V131 T158 L159 L162	A123-V127 PolarHBondContact O-N 2.96Å; D124-V127 PolarHBondContact O-N 3.49Å; V127-G129 PolarHBondContact O-N 2.97Å; V127-A130 PolarHBondContact O-N 2.76Å; V127-V131 HydrophobicContact CG1-CG2 4.2Å; V127-V131 WeakPolarHBondContact O-CB 3.44Å; V127-V131 VanDerWaalsContact O-CG2 3.26Å; V127-V131 WeakPolarHBondContact O-CG2 3.49Å; V127-V131 PolarHBondContact O-N 2.92Å; V127-T158 HydrophobicContact CB-CG2 4.23Å; V127-T158 HydrophobicContact CG2-CG2 3.7Å; V127-L159 HydrophobicContact CG2-CD2 3.69Å; V127-L159 HydrophobicContact CG2-CG 4.33Å; V127-L162 HydrophobicContact CG1-CD2 4.13Å; V127-L162 HydrophobicContact CG2-CD1 4.25Å; V127-L162 HydrophobicContact CG2-CG 4.2Å
128	E	90.3	Very high	89.1	Confident	114 Å²	114	32 Å²	32	53%	0.533	16%	0.164	S	C	.	.	H	α-helix	trans	-58.6	-50.1	176.5	-174	-178.5	-178.9	0	0	110.9	D124 A130 V131 Q132	D124-E128 PolarHBondContact O-N 3.35Å; E128-A130 VanDerWaalsContact C-N 3.32Å; E128-A130 PolarHBondContact O-N 3.29Å; E128-V131 PolarHBondContact O-N 3.32Å; E128-Q132 HydrophobicContact CG-CG 4.41Å; E128-Q132 WeakPolarHBondContact O-CB 3.4Å; E128-Q132 VanDerWaalsContact O-CG 3.29Å; E128-Q132 WeakPolarHBondContact O-CG 3.47Å; E128-Q132 PolarHBondContact O-N 3.11Å; E128-Q132 PolarHBondContact OE1-NE2 2.8Å
129	G	90.8	Very high	88.6	Confident	10 Å²	10	33 Å²	33	10%	0.103	17%	0.168	C	C	.	.	H	α-helix	trans	-58.9	-42.3	176.6	0	0	0	0	0	112.8	G125 M126 V127 N133	G125-G129 PolarHBondContact O-N 3.2Å; M126-G129 PolarHBondContact O-N 3.18Å; V127-G129 PolarHBondContact O-N 2.97Å; G129-N133 WeakPolarHBondContact O-CB 3.5Å; G129-N133 PolarHBondContact O-N 2.87Å
130	A	89.5	Confident	88.2	Confident	6 Å²	6	32 Å²	32	5%	0.05	16%	0.164	C	C	.	.	H	α-helix	trans	-65.9	-44.4	178.9	0	0	0	0	0	112.5	M126 V127 E128 N133 G134 V138 L162	M126-A130 VanDerWaalsContact O-CB 3.26Å; M126-A130 WeakPolarHBondContact O-CB 3.42Å; M126-A130 PolarHBondContact O-N 3.3Å; V127-A130 PolarHBondContact O-N 2.76Å; E128-A130 VanDerWaalsContact C-N 3.32Å; E128-A130 PolarHBondContact O-N 3.29Å; A130-N133 PolarHBondContact O-N 2.9Å; A130-G134 WeakPolarHBondContact O-CA 3.29Å; A130-G134 PolarHBondContact O-N 3.35Å; A130-V138 WeakPolarHBondContact O-CG2 3.41Å; A130-L162 HydrophobicContact CB-CD1 4.05Å; A130-L162 HydrophobicContact CB-CD2 4.22Å
131	V	86.4	Confident	87.7	Confident	62 Å²	62	29.3 Å²	29.3	38%	0.376	15%	0.152	S	C	.	.	H	α-helix	trans	-65.4	-43.5	177.3	171.9	0	0	0	0	111	V127 E128 N133 G134 L162 K165	V127-V131 HydrophobicContact CG1-CG2 4.2Å; V127-V131 WeakPolarHBondContact O-CB 3.44Å; V127-V131 VanDerWaalsContact O-CG2 3.26Å; V127-V131 WeakPolarHBondContact O-CG2 3.49Å; V127-V131 PolarHBondContact O-N 2.92Å; E128-V131 PolarHBondContact O-N 3.32Å; V131-N133 VanDerWaalsContact C-N 3.34Å; V131-N133 PolarHBondContact O-N 3.27Å; V131-G134 PolarHBondContact O-N 3.44Å; V131-L162 HydrophobicContact CG2-CD2 3.65Å; V131-K165 HydrophobicContact CG2-CD 4.13Å
132	Q	86.5	Confident	87	Confident	90 Å²	90	26.2 Å²	26.2	42%	0.421	14%	0.142	S	C	.	.	H	α-helix	trans	-66.6	-32.4	179.6	-74.4	-172.4	20.7	0	0	113.5	R81 E128	R81-Q132 PolarHBondContact NH1-O 3.4Å; R81-Q132 PolarHBondContact NH2-O 3.1Å; E128-Q132 HydrophobicContact CG-CG 4.41Å; E128-Q132 WeakPolarHBondContact O-CB 3.4Å; E128-Q132 VanDerWaalsContact O-CG 3.29Å; E128-Q132 WeakPolarHBondContact O-CG 3.47Å; E128-Q132 PolarHBondContact O-N 3.11Å; E128-Q132 PolarHBondContact OE1-NE2 2.8Å
133	N	86.4	Confident	86.2	Confident	10 Å²	10	26.4 Å²	26.4	5%	0.053	14%	0.144	C	C	.	.	H	α-helix	trans	-86.2	-28.7	176	-75.6	-14.8	0	0	0	112.7	R78 R81 S82 G129 A130 V131 Y137 R229	R78-N133 HydrophobicContact CG-CB 4.44Å; R78-N133 WeakPolarHBondContact CG-OD1 3.3Å; R81-N133 PolarHBondContact NE-OD1 3.03Å; R81-N133 PolarHBondContact NH2-OD1 2.93Å; S82-N133 PolarHBondContact OG-ND2 3.32Å; G129-N133 WeakPolarHBondContact O-CB 3.5Å; G129-N133 PolarHBondContact O-N 2.87Å; A130-N133 PolarHBondContact O-N 2.9Å; V131-N133 VanDerWaalsContact C-N 3.34Å; V131-N133 PolarHBondContact O-N 3.27Å; N133-Y137 HydrophobicContact CB-CD1 4.35Å; N133-Y137 HydrophobicContact CB-CD2 3.39Å; N133-Y137 HydrophobicContact CB-CE2 3.77Å; N133-Y137 HydrophobicContact CB-CG 3.71Å; N133-Y137 WeakPolarHBondContact ND2-CE1 3.32Å; N133-R229 PolarHBondContact O-NH2 2.8Å
134	G	81.7	Confident	85.5	Confident	7 Å²	7	27.9 Å²	27.9	7%	0.072	15%	0.151	C	C	.	.			trans	64.1	-173	-179.7	0	0	0	0	0	113.9	A130 V131 I136 Y137 R229	A130-G134 WeakPolarHBondContact O-CA 3.29Å; A130-G134 PolarHBondContact O-N 3.35Å; V131-G134 PolarHBondContact O-N 3.44Å; G134-I136 PolarHBondContact O-N 3.26Å; G134-Y137 PolarHBondContact O-N 2.89Å; G134-R229 PolarHBondContact O-NH2 3.24Å
135	G	80.3	Confident	84.4	Confident	1 Å²	1	24.7 Å²	24.7	1%	0.01	14%	0.135	C	C	.	.	T	Hydrogen-bonded Turn	trans	54	-119.1	170	0	0	0	0	0	113.3	Y137 V138 K139	G135-Y137 PolarHBondContact O-N 3.47Å; G135-V138 WeakPolarHBondContact O-CB 3.41Å; G135-V138 PolarHBondContact O-N 2.75Å; G135-K139 PolarHBondContact O-N 3.32Å
136	I	81.5	Confident	83	Confident	0 Å²	0	24.9 Å²	24.9	0%	0	14%	0.135	C	C	.	.	H	α-helix	trans	-53.9	-38.1	-177.6	-67	168.5	0	0	0	113	G134 V138 K139 L140 L226 R229 F230 D233 I234 L264	G134-I136 PolarHBondContact O-N 3.26Å; I136-V138 PolarHBondContact O-N 2.88Å; I136-K139 PolarHBondContact O-N 3.13Å; I136-L140 HydrophobicContact CG2-CD1 3.69Å; I136-L140 HydrophobicContact CG2-CG 4.11Å; I136-L140 WeakPolarHBondContact O-CB 3.47Å; I136-L140 VanDerWaalsContact O-CG 3.25Å; I136-L140 WeakPolarHBondContact O-CG 3.45Å; I136-L140 PolarHBondContact O-N 2.84Å; I136-L226 HydrophobicContact CG1-CD2 4.38Å; I136-R229 HydrophobicContact CD1-CG 4.42Å; I136-F230 HydrophobicContact CD1-CB 3.81Å; I136-F230 HydrophobicContact CD1-CD2 3.55Å; I136-F230 HydrophobicContact CD1-CG 4.08Å; I136-F230 HydrophobicContact CG1-CD2 4.27Å; I136-D233 HydrophobicContact CD1-CB 4.22Å; I136-I234 HydrophobicContact CG2-CD1 4.25Å; I136-L264 HydrophobicContact CB-CD2 4.21Å; I136-L264 HydrophobicContact CG1-CD2 4.08Å; I136-L264 HydrophobicContact CG2-CD2 3.55Å
137	Y	87.3	Confident	81.7	Confident	18 Å²	18	23.2 Å²	23.2	7%	0.071	13%	0.127	C	C	.	.	H	α-helix	trans	-68.5	-37.4	-179.5	-66.2	-97.4	0	0	0	112.3	S82 N133 G134 G135 G141 D233 L237	S82-Y137 WeakPolarHBondContact OG-CE1 3.49Å; S82-Y137 PolarHBondContact OG-OH 3.4Å; S82-Y137 VanDerWaalsContact OG-OH 3.1Å; N133-Y137 HydrophobicContact CB-CD1 4.35Å; N133-Y137 HydrophobicContact CB-CD2 3.39Å; N133-Y137 HydrophobicContact CB-CE2 3.77Å; N133-Y137 HydrophobicContact CB-CG 3.71Å; N133-Y137 WeakPolarHBondContact ND2-CE1 3.32Å; G134-Y137 PolarHBondContact O-N 2.89Å; G135-Y137 PolarHBondContact O-N 3.47Å; Y137-G141 PolarHBondContact O-N 2.99Å; Y137-D233 HydrophobicContact CE2-CB 3.9Å; Y137-L237 HydrophobicContact CD1-CD2 4.26Å; Y137-L237 HydrophobicContact CE1-CD1 4.29Å; Y137-L237 HydrophobicContact CE1-CD2 3.75Å; Y137-L237 HydrophobicContact CE1-CG 4.07Å
138	V	84.3	Confident	80.4	Confident	11 Å²	11	24.8 Å²	24.8	7%	0.067	14%	0.135	C	C	.	.	H	α-helix	trans	-64.1	-46.9	173.1	175.5	0	0	0	0	109.3	A130 G135 I136 L140 G141 Q142 L162	A130-V138 WeakPolarHBondContact O-CG2 3.41Å; G135-V138 WeakPolarHBondContact O-CB 3.41Å; G135-V138 PolarHBondContact O-N 2.75Å; I136-V138 PolarHBondContact O-N 2.88Å; V138-L140 PolarHBondContact O-N 3.12Å; V138-G141 PolarHBondContact O-N 3.17Å; V138-G141 VanDerWaalsContact O-N 3.16Å; V138-Q142 WeakPolarHBondContact O-CG 3.35Å; V138-Q142 PolarHBondContact O-N 2.9Å; V138-L162 HydrophobicContact CG1-CB 4.17Å; V138-L162 HydrophobicContact CG1-CD2 4.42Å; V138-L162 HydrophobicContact CG2-CD2 4.46Å
139	K	81.5	Confident	78.8	Confident	22 Å²	22	21.8 Å²	21.8	10%	0.096	12%	0.12	C	C	.	.	H	α-helix	trans	-65.1	-37.2	-179.9	-169.6	72.3	-149.7	-153	0	112.8	G135 I136 Q142 G143 S202 L203 L264 E267	G135-K139 PolarHBondContact O-N 3.32Å; I136-K139 PolarHBondContact O-N 3.13Å; K139-Q142 WeakPolarHBondContact O-CB 3.48Å; K139-Q142 PolarHBondContact O-N 3.22Å; K139-G143 PolarHBondContact O-N 3.42Å; K139-S202 VanDerWaalsContact CD-OG 3.25Å; K139-S202 WeakPolarHBondContact CD-OG 3.41Å; K139-L203 HydrophobicContact CB-CD2 4.17Å; K139-L203 HydrophobicContact CD-CD1 4.15Å; K139-L203 HydrophobicContact CD-CG 4.16Å; K139-L203 HydrophobicContact CG-CD1 4.16Å; K139-L203 HydrophobicContact CG-CD2 4.3Å; K139-L203 HydrophobicContact CG-CG 4.26Å; K139-L264 HydrophobicContact CB-CD1 4.07Å; K139-L264 HydrophobicContact CG-CD1 3.45Å; K139-L264 VanDerWaalsContact CG-CD1 3.45Å; K139-E267 WeakPolarHBondContact CD-OE2 3.4Å; K139-E267 VanDerWaalsContact CE-CD 3.43Å; K139-E267 WeakPolarHBondContact CE-OE1 3.38Å; K139-E267 WeakPolarHBondContact CE-OE2 3.42Å; K139-E267 IonicContact NZ-OE1 3.65Å; K139-E267 PolarHBondContact NZ-OE1 2.97Å; K139-E267 IonicContact NZ-OE2 2.77Å; K139-E267 PolarHBondContact NZ-OE2 3.08Å
140	L	83.3	Confident	77.4	Confident	15 Å²	15	21.4 Å²	21.4	8%	0.079	12%	0.116	C	C	.	.	H	α-helix	trans	-66.5	-39.3	173	-73.2	171.3	0	0	0	111.6	I136 V138 G143 L144 I234 L237 L257 L260 L264	I136-L140 HydrophobicContact CG2-CD1 3.69Å; I136-L140 HydrophobicContact CG2-CG 4.11Å; I136-L140 WeakPolarHBondContact O-CB 3.47Å; I136-L140 VanDerWaalsContact O-CG 3.25Å; I136-L140 WeakPolarHBondContact O-CG 3.45Å; I136-L140 PolarHBondContact O-N 2.84Å; V138-L140 PolarHBondContact O-N 3.12Å; L140-G143 CarbonylContact O-C 3.58Å; L140-G143 PolarHBondContact O-N 3.08Å; L140-L144 WeakPolarHBondContact O-CG 3.46Å; L140-L144 PolarHBondContact O-N 3.13Å; L140-I234 HydrophobicContact CD1-CD1 4.37Å; L140-L237 HydrophobicContact CD1-CD1 3.13Å; L140-L257 HydrophobicContact CD2-CD1 4.45Å; L140-L260 HydrophobicContact CD2-CB 3.71Å; L140-L260 HydrophobicContact CD2-CD1 4.04Å; L140-L260 HydrophobicContact CD2-CG 4.41Å; L140-L264 HydrophobicContact CD2-CD2 4.4Å; L140-L264 HydrophobicContact CG-CD2 4.38Å
141	G	83.9	Confident	76.6	Confident	4 Å²	4	22.2 Å²	22.2	4%	0.041	12%	0.119	C	C	.	.	H	α-helix	trans	-60.8	-44.1	171.3	0	0	0	0	0	112.7	Y137 V138 G143 L144 C145	Y137-G141 PolarHBondContact O-N 2.99Å; V138-G141 PolarHBondContact O-N 3.17Å; V138-G141 VanDerWaalsContact O-N 3.16Å; G141-G143 VanDerWaalsContact C-N 3.33Å; G141-G143 PolarHBondContact O-N 2.84Å; G141-L144 WeakPolarHBondContact O-CB 3.31Å; G141-L144 PolarHBondContact O-N 3.3Å; G141-L144 VanDerWaalsContact O-N 3.15Å; G141-C145 PolarHBondContact O-N 3.13Å; G141-C145 VanDerWaalsContact O-N 3.07Å; G141-C145 PolarHBondContact O-SG 2.9Å
142	Q	79.1	Confident	76.2	Confident	23 Å²	23	20.8 Å²	20.8	11%	0.107	11%	0.111	C	C	.	.	H	α-helix	trans	-60.4	-42.2	171.8	-67	173.6	-11.2	0	0	111.4	V138 K139 L144 C145 A146 L162 E163 S202	V138-Q142 WeakPolarHBondContact O-CG 3.35Å; V138-Q142 PolarHBondContact O-N 2.9Å; K139-Q142 WeakPolarHBondContact O-CB 3.48Å; K139-Q142 PolarHBondContact O-N 3.22Å; Q142-L144 VanDerWaalsContact C-N 3.29Å; Q142-L144 PolarHBondContact O-N 3.06Å; Q142-C145 WeakPolarHBondContact O-CB 3.16Å; Q142-C145 PolarHBondContact O-N 3.3Å; Q142-C145 VanDerWaalsContact O-N 3.17Å; Q142-A146 PolarHBondContact O-N 2.96Å; Q142-L162 HydrophobicContact CG-CB 4.2Å; Q142-L162 PolarHBondContact NE2-O 3.5Å; Q142-E163 HydrophobicContact CG-CG 4.11Å; Q142-S202 PolarHBondContact OE1-OG 2.98Å
143	G	76	Confident	75.9	Confident	5 Å²	5	19.9 Å²	19.9	5%	0.052	11%	0.113	C	C	.	.	H	α-helix	trans	-62.2	-34.8	174.2	0	0	0	0	0	112.9	K139 L140 G141 A146 F147	K139-G143 PolarHBondContact O-N 3.42Å; L140-G143 CarbonylContact O-C 3.58Å; L140-G143 PolarHBondContact O-N 3.08Å; G141-G143 VanDerWaalsContact C-N 3.33Å; G141-G143 PolarHBondContact O-N 2.84Å; G143-A146 WeakPolarHBondContact O-CB 3.41Å; G143-A146 PolarHBondContact O-N 3.34Å; G143-F147 WeakPolarHBondContact O-CD2 3.45Å
144	L	77.9	Confident	76	Confident	31 Å²	31	20.6 Å²	20.6	16%	0.162	12%	0.117	C	C	.	.	H	α-helix	trans	-68.6	-33.8	173.7	-72.8	173	0	0	0	112.4	M126 L140 G141 Q142 A146 F147 L151 L159 V256 L260	M126-L144 HydrophobicContact CE-CD1 3.98Å; M126-L144 HydrophobicContact SD-CD1 4.17Å; L140-L144 WeakPolarHBondContact O-CG 3.46Å; L140-L144 PolarHBondContact O-N 3.13Å; G141-L144 WeakPolarHBondContact O-CB 3.31Å; G141-L144 PolarHBondContact O-N 3.3Å; G141-L144 VanDerWaalsContact O-N 3.15Å; Q142-L144 VanDerWaalsContact C-N 3.29Å; Q142-L144 PolarHBondContact O-N 3.06Å; L144-A146 PolarHBondContact O-N 3.44Å; L144-F147 CarbonylContact O-C 3.47Å; L144-F147 WeakPolarHBondContact O-CA 3.3Å; L144-F147 WeakPolarHBondContact O-CB 3.49Å; L144-F147 PolarHBondContact O-N 3.24Å; L144-L151 HydrophobicContact CB-CD1 4.02Å; L144-L151 VanDerWaalsContact O-CD1 3.3Å; L144-L151 WeakPolarHBondContact O-CD1 3.41Å; L144-L159 HydrophobicContact CB-CD1 4.21Å; L144-V256 HydrophobicContact CD2-CG1 4.11Å; L144-L260 HydrophobicContact CD2-CD1 4Å; L144-L260 HydrophobicContact CG-CD1 4.19Å
145	C	70.9	Confident	76.2	Confident	9 Å²	9	21.7 Å²	21.7	6%	0.061	12%	0.119	C	C	.	.	H	α-helix	trans	-58.9	-31.9	172.3	-65.4	0	0	0	0	112.6	G141 Q142 F147 N148 L159 E163	G141-C145 PolarHBondContact O-N 3.13Å; G141-C145 VanDerWaalsContact O-N 3.07Å; G141-C145 PolarHBondContact O-SG 2.9Å; Q142-C145 WeakPolarHBondContact O-CB 3.16Å; Q142-C145 PolarHBondContact O-N 3.3Å; Q142-C145 VanDerWaalsContact O-N 3.17Å; C145-F147 PolarHBondContact O-N 3.26Å; C145-N148 VanDerWaalsContact O-CB 3.32Å; C145-N148 WeakPolarHBondContact O-CB 3.4Å; C145-N148 PolarHBondContact O-N 2.99Å; C145-L159 VanDerWaalsContact SG-C 3.57Å; C145-L159 WeakPolarHBondContact SG-CB 3.3Å; C145-E163 WeakPolarHBondContact CB-OE1 3.44Å
146	A	62.7	Low	76.2	Confident	17 Å²	17	22.7 Å²	22.7	14%	0.14	12%	0.124	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.3	-21.6	175.1	0	0	0	0	0	113.2	Q142 G143 L144 N148 R474	Q142-A146 PolarHBondContact O-N 2.96Å; G143-A146 WeakPolarHBondContact O-CB 3.41Å; G143-A146 PolarHBondContact O-N 3.34Å; L144-A146 PolarHBondContact O-N 3.44Å; A146-N148 VanDerWaalsContact C-N 3.28Å; A146-N148 PolarHBondContact O-N 3.43Å; A146-R474 HydrophobicContact CB-CG 3.89Å
147	F	65.7	Low	76.3	Confident	17 Å²	17	29.9 Å²	29.9	8%	0.075	16%	0.156	C	C	.	.	T	Hydrogen-bonded Turn	trans	-94	34	172.7	-62.8	-76.3	0	0	0	111.6	G143 L144 C145 H149 L150 L151 V256 L260 L470	G143-F147 WeakPolarHBondContact O-CD2 3.45Å; L144-F147 CarbonylContact O-C 3.47Å; L144-F147 WeakPolarHBondContact O-CA 3.3Å; L144-F147 WeakPolarHBondContact O-CB 3.49Å; L144-F147 PolarHBondContact O-N 3.24Å; C145-F147 PolarHBondContact O-N 3.26Å; F147-H149 PolarHBondContact O-N 3.42Å; F147-L150 HydrophobicContact CB-CB 4.1Å; F147-L150 HydrophobicContact CB-CD1 3.82Å; F147-L150 HydrophobicContact CB-CG 3.78Å; F147-L150 HydrophobicContact CD1-CD1 3.37Å; F147-L150 HydrophobicContact CD1-CG 4.04Å; F147-L150 HydrophobicContact CE1-CD1 4.22Å; F147-L150 HydrophobicContact CG-CD1 3.9Å; F147-L150 HydrophobicContact CG-CG 4.36Å; F147-L150 WeakPolarHBondContact O-CA 3.36Å; F147-L150 WeakPolarHBondContact O-CB 3.42Å; F147-L150 PolarHBondContact O-N 3.48Å; F147-L151 PolarHBondContact O-N 2.86Å; F147-V256 HydrophobicContact CD2-CG1 4.17Å; F147-V256 HydrophobicContact CE2-CG1 3.91Å; F147-V256 HydrophobicContact CZ-CG1 4.28Å; F147-L260 HydrophobicContact CE2-CD2 3.94Å; F147-L260 HydrophobicContact CE2-CG 4.24Å; F147-L470 HydrophobicContact CE1-CB 4.43Å; F147-L470 HydrophobicContact CE1-CD1 4.26Å; F147-L470 HydrophobicContact CE1-CD2 4.15Å
148	N	63	Low	76.4	Confident	49 Å²	49	30 Å²	30	26%	0.262	16%	0.158	S	C	.	.	T	Hydrogen-bonded Turn	trans	-52.6	-25	-180	59	1.7	0	0	0	115.5	C145 A146 L150 V156 N477	C145-N148 VanDerWaalsContact O-CB 3.32Å; C145-N148 WeakPolarHBondContact O-CB 3.4Å; C145-N148 PolarHBondContact O-N 2.99Å; A146-N148 VanDerWaalsContact C-N 3.28Å; A146-N148 PolarHBondContact O-N 3.43Å; N148-L150 VanDerWaalsContact C-N 3.35Å; N148-V156 HydrophobicContact CB-CG1 3.74Å; N148-V156 HydrophobicContact CB-CG2 3.97Å; N148-V156 WeakPolarHBondContact O-CG2 3.45Å; N148-N477 PolarHBondContact ND2-ND2 3.06Å; N148-N477 VanDerWaalsContact ND2-ND2 3.2Å
149	H	56.2	Low	76.5	Confident	50 Å²	50	29.4 Å²	29.4	23%	0.231	16%	0.155	C	C	.	.	T	Hydrogen-bonded Turn	trans	-85.4	-8.6	176.9	55	-77.3	0	0	0	112.9	F147	F147-H149 PolarHBondContact O-N 3.42Å
150	L	61.1	Low	76.5	Confident	2 Å²	2	32.9 Å²	32.9	1%	0.01	17%	0.171	C	C	.	.	T	Hydrogen-bonded Turn	trans	-102.9	-16.3	178	-48	-163.7	0	0	0	113.3	F147 N148 W255 F455 M459 L462	F147-L150 HydrophobicContact CB-CB 4.1Å; F147-L150 HydrophobicContact CB-CD1 3.82Å; F147-L150 HydrophobicContact CB-CG 3.78Å; F147-L150 HydrophobicContact CD1-CD1 3.37Å; F147-L150 HydrophobicContact CD1-CG 4.04Å; F147-L150 HydrophobicContact CE1-CD1 4.22Å; F147-L150 HydrophobicContact CG-CD1 3.9Å; F147-L150 HydrophobicContact CG-CG 4.36Å; F147-L150 WeakPolarHBondContact O-CA 3.36Å; F147-L150 WeakPolarHBondContact O-CB 3.42Å; F147-L150 PolarHBondContact O-N 3.48Å; N148-L150 VanDerWaalsContact C-N 3.35Å; L150-W255 HydrophobicContact CD1-CH2 4.23Å; L150-F455 WeakPolarHBondContact O-CE2 3.32Å; L150-M459 HydrophobicContact CB-CE 4.12Å; L150-M459 HydrophobicContact CD2-CE 3.58Å; L150-M459 HydrophobicContact CG-CE 4.39Å; L150-L462 HydrophobicContact CD1-CD1 4.38Å; L150-L462 HydrophobicContact CD2-CD1 2.94Å; L150-L462 HydrophobicContact CD2-CD2 4.15Å; L150-L462 HydrophobicContact CD2-CG 4.14Å; L150-L462 HydrophobicContact CG-CD1 4.27Å
151	L	73.3	Confident	76.5	Confident	23 Å²	23	35.4 Å²	35.4	12%	0.12	19%	0.187	C	C	.	.	S	Bend	trans	-110.6	142.6	-170.9	-63.7	178.6	0	0	0	109.6	L144 F147 V156 L159 F253	L144-L151 HydrophobicContact CB-CD1 4.02Å; L144-L151 VanDerWaalsContact O-CD1 3.3Å; L144-L151 WeakPolarHBondContact O-CD1 3.41Å; F147-L151 PolarHBondContact O-N 2.86Å; L151-V156 HydrophobicContact CB-CG2 4.02Å; L151-L159 HydrophobicContact CD1-CD1 4.36Å; L151-F253 HydrophobicContact CD2-CE1 3.98Å; L151-F253 HydrophobicContact CD2-CZ 4.28Å
152	P	78.6	Confident	76.3	Confident	32 Å²	32	35.2 Å²	35.2	21%	0.208	19%	0.185	C	C	.	.			trans	-51.4	145.3	169.6	-24.3	31.4	0	0	0	111.1	H119 E154 Y155 V156	H119-P152 HydrophobicContact CB-CB 4.13Å; P152-E154 VanDerWaalsContact CB-OE2 3.23Å; P152-E154 WeakPolarHBondContact CB-OE2 3.49Å; P152-E154 PolarHBondContact O-N 3.47Å; P152-Y155 HydrophobicContact CB-CD2 4.03Å; P152-Y155 HydrophobicContact CG-CD2 3.9Å; P152-Y155 HydrophobicContact CG-CE2 4.2Å; P152-Y155 WeakPolarHBondContact O-CB 3.17Å; P152-Y155 PolarHBondContact O-N 3.15Å; P152-V156 PolarHBondContact O-N 3.09Å
153	P	79.6	Confident	75.9	Confident	71 Å²	71	38.2 Å²	38.2	46%	0.461	20%	0.199	S	C	.	.	H	α-helix	trans	-57.3	-28	-173.7	22.9	-33.7	0	0	0	113.3	V156 K157	P153-V156 PolarHBondContact O-N 3.11Å; P153-K157 WeakPolarHBondContact O-CB 3.41Å; P153-K157 PolarHBondContact O-N 3.2Å
154	E	88.3	Confident	75.2	Confident	26 Å²	26	44.9 Å²	44.9	12%	0.121	23%	0.234	C	C	.	.	H	α-helix	trans	-61.1	-45.2	175.1	-59.4	78.9	-171.2	0	0	111.6	S116 H119 Q120 P152 T158	S116-E154 WeakPolarHBondContact CB-OE1 3.29Å; S116-E154 PolarHBondContact OG-OE1 3.3Å; H119-E154 HydrophobicContact CB-CB 4.01Å; H119-E154 HydrophobicContact CB-CG 4.11Å; H119-E154 IonicContact CD2-OE2 2.94Å; Q120-E154 HydrophobicContact CB-CB 4.23Å; Q120-E154 HydrophobicContact CB-CG 4.1Å; P152-E154 VanDerWaalsContact CB-OE2 3.23Å; P152-E154 WeakPolarHBondContact CB-OE2 3.49Å; P152-E154 PolarHBondContact O-N 3.47Å; E154-T158 VanDerWaalsContact O-CB 3.28Å; E154-T158 WeakPolarHBondContact O-CB 3.44Å; E154-T158 PolarHBondContact O-N 2.84Å; E154-T158 PolarHBondContact O-OG1 3.12Å; E154-T158 VanDerWaalsContact O-OG1 3.09Å
155	Y	86.3	Confident	74.3	Confident	30 Å²	30	48.1 Å²	48.1	12%	0.118	25%	0.246	C	C	.	.	H	α-helix	trans	-63.3	-46.9	175.7	-78.5	-82.2	0	0	0	111.6	Y93 H119 A122 A123 M126 P152 K157 T158 L159	Y93-Y155 WeakPolarHBondContact OH-CE2 3.26Å; Y93-Y155 PolarHBondContact OH-OH 3.38Å; H119-Y155 HydrophobicContact CB-CD2 4.36Å; H119-Y155 HydrophobicContact CB-CE2 4.13Å; A122-Y155 HydrophobicContact CB-CE1 4.28Å; A122-Y155 WeakPolarHBondContact CB-OH 3.25Å; A123-Y155 HydrophobicContact CB-CD1 3.61Å; A123-Y155 HydrophobicContact CB-CE1 4.03Å; A123-Y155 HydrophobicContact CB-CG 3.96Å; M126-Y155 HydrophobicContact CE-CD1 3.6Å; M126-Y155 HydrophobicContact CE-CE1 3.86Å; P152-Y155 HydrophobicContact CB-CD2 4.03Å; P152-Y155 HydrophobicContact CG-CD2 3.9Å; P152-Y155 HydrophobicContact CG-CE2 4.2Å; P152-Y155 WeakPolarHBondContact O-CB 3.17Å; P152-Y155 PolarHBondContact O-N 3.15Å; Y155-K157 PolarHBondContact O-N 2.8Å; Y155-T158 PolarHBondContact O-N 2.85Å; Y155-L159 HydrophobicContact CD1-CD1 4.43Å; Y155-L159 WeakPolarHBondContact O-CB 3.19Å; Y155-L159 WeakPolarHBondContact O-CD1 3.16Å; Y155-L159 WeakPolarHBondContact O-CG 3.37Å; Y155-L159 PolarHBondContact O-N 3.17Å
156	V	80.1	Confident	73.6	Confident	21 Å²	21	50.7 Å²	50.7	13%	0.127	27%	0.268	C	S	.	.	H	α-helix	trans	-59.1	-50.1	-178.6	-177.8	0	0	0	0	110.4	N148 L151 P152 P153 Q160	N148-V156 HydrophobicContact CB-CG1 3.74Å; N148-V156 HydrophobicContact CB-CG2 3.97Å; N148-V156 WeakPolarHBondContact O-CG2 3.45Å; L151-V156 HydrophobicContact CB-CG2 4.02Å; P152-V156 PolarHBondContact O-N 3.09Å; P153-V156 PolarHBondContact O-N 3.11Å; V156-Q160 VanDerWaalsContact O-CG 3.28Å; V156-Q160 WeakPolarHBondContact O-CG 3.31Å; V156-Q160 PolarHBondContact O-N 3.14Å
157	K	83.6	Confident	73.3	Confident	152 Å²	152	53.5 Å²	53.5	66%	0.661	28%	0.281	S	S	*	.	H	α-helix	trans	-64.9	-41.8	-178.4	-175.1	179.1	178	-174.1	0	112.3	P153 Y155	P153-K157 WeakPolarHBondContact O-CB 3.41Å; P153-K157 PolarHBondContact O-N 3.2Å; Y155-K157 PolarHBondContact O-N 2.8Å
158	T	89.1	Confident	72.9	Confident	19 Å²	19	57.7 Å²	57.7	12%	0.117	30%	0.304	C	S	.	.	H	α-helix	trans	-74.1	-41	-177.5	-66.3	0	0	0	0	111.9	Q120 A123 D124 V127 E154 Y155 Q160 V161	Q120-T158 PolarHBondContact NE2-OG1 3.44Å; A123-T158 HydrophobicContact CB-CG2 3.98Å; D124-T158 VanDerWaalsContact OD1-CG2 3.29Å; D124-T158 WeakPolarHBondContact OD1-CG2 3.24Å; D124-T158 PolarHBondContact OD1-OG1 2.83Å; V127-T158 HydrophobicContact CB-CG2 4.23Å; V127-T158 HydrophobicContact CG2-CG2 3.7Å; E154-T158 VanDerWaalsContact O-CB 3.28Å; E154-T158 WeakPolarHBondContact O-CB 3.44Å; E154-T158 PolarHBondContact O-N 2.84Å; E154-T158 PolarHBondContact O-OG1 3.12Å; E154-T158 VanDerWaalsContact O-OG1 3.09Å; Y155-T158 PolarHBondContact O-N 2.85Å; T158-Q160 VanDerWaalsContact C-N 3.27Å; T158-Q160 PolarHBondContact O-N 2.83Å; T158-V161 PolarHBondContact O-N 3.43Å
159	L	86.5	Confident	73	Confident	0 Å²	0	57.8 Å²	57.8	0%	0	30%	0.301	C	S	.	.	H	α-helix	trans	-69.5	-22.1	-178.8	-68.8	163.6	0	0	0	113.5	M126 V127 L144 C145 L151 Y155 V161 L162	M126-L159 HydrophobicContact CE-CD1 3.41Å; M126-L159 VanDerWaalsContact CE-CD1 3.41Å; M126-L159 HydrophobicContact CE-CD2 3.43Å; M126-L159 VanDerWaalsContact CE-CD2 3.43Å; M126-L159 HydrophobicContact CE-CG 3.84Å; M126-L159 HydrophobicContact CG-CD2 4.41Å; V127-L159 HydrophobicContact CG2-CD2 3.69Å; V127-L159 HydrophobicContact CG2-CG 4.33Å; L144-L159 HydrophobicContact CB-CD1 4.21Å; C145-L159 VanDerWaalsContact SG-C 3.57Å; C145-L159 WeakPolarHBondContact SG-CB 3.3Å; L151-L159 HydrophobicContact CD1-CD1 4.36Å; Y155-L159 HydrophobicContact CD1-CD1 4.43Å; Y155-L159 WeakPolarHBondContact O-CB 3.19Å; Y155-L159 WeakPolarHBondContact O-CD1 3.16Å; Y155-L159 WeakPolarHBondContact O-CG 3.37Å; Y155-L159 PolarHBondContact O-N 3.17Å; L159-V161 PolarHBondContact O-N 3.42Å; L159-V161 VanDerWaalsContact O-N 3.09Å; L159-L162 HydrophobicContact CD2-CD1 3.72Å; L159-L162 WeakPolarHBondContact O-CB 3.4Å; L159-L162 WeakPolarHBondContact O-CG 3.49Å; L159-L162 PolarHBondContact O-N 3.22Å
160	Q	81.1	Confident	73.3	Confident	95 Å²	95	65.2 Å²	65.2	44%	0.444	33%	0.327	S	S	.	.	T	Hydrogen-bonded Turn	trans	-52.1	-31	173.5	-82.1	167.5	-8.5	0	0	112.9	V156 T158 L162 E163	V156-Q160 VanDerWaalsContact O-CG 3.28Å; V156-Q160 WeakPolarHBondContact O-CG 3.31Å; V156-Q160 PolarHBondContact O-N 3.14Å; T158-Q160 VanDerWaalsContact C-N 3.27Å; T158-Q160 PolarHBondContact O-N 2.83Å; Q160-L162 PolarHBondContact O-N 3.47Å; Q160-E163 WeakPolarHBondContact O-CB 3.38Å; Q160-E163 PolarHBondContact O-N 3.02Å
161	V	83.1	Confident	73.3	Confident	68 Å²	68	67.9 Å²	67.9	41%	0.412	34%	0.344	S	S	.	.	H	α-helix	trans	-58.6	-23	175.7	177.2	0	0	0	0	112.6	T158 L159 E163 K165	T158-V161 PolarHBondContact O-N 3.43Å; L159-V161 PolarHBondContact O-N 3.42Å; L159-V161 VanDerWaalsContact O-N 3.09Å; V161-E163 VanDerWaalsContact C-N 3.34Å; V161-K165 HydrophobicContact CG1-CD 4.3Å; V161-K165 WeakPolarHBondContact O-CG 3.25Å
162	L	79.4	Confident	73.2	Confident	0 Å²	0	75.4 Å²	75.4	0%	0	38%	0.376	C	S	.	.	H	α-helix	trans	-75.2	-21.3	176.5	-60.7	178.6	0	0	0	112.8	V127 A130 V131 V138 Q142 L159 Q160	V127-L162 HydrophobicContact CG1-CD2 4.13Å; V127-L162 HydrophobicContact CG2-CD1 4.25Å; V127-L162 HydrophobicContact CG2-CG 4.2Å; A130-L162 HydrophobicContact CB-CD1 4.05Å; A130-L162 HydrophobicContact CB-CD2 4.22Å; V131-L162 HydrophobicContact CG2-CD2 3.65Å; V138-L162 HydrophobicContact CG1-CB 4.17Å; V138-L162 HydrophobicContact CG1-CD2 4.42Å; V138-L162 HydrophobicContact CG2-CD2 4.46Å; Q142-L162 HydrophobicContact CG-CB 4.2Å; Q142-L162 PolarHBondContact NE2-O 3.5Å; L159-L162 HydrophobicContact CD2-CD1 3.72Å; L159-L162 WeakPolarHBondContact O-CB 3.4Å; L159-L162 WeakPolarHBondContact O-CG 3.49Å; L159-L162 PolarHBondContact O-N 3.22Å; Q160-L162 PolarHBondContact O-N 3.47Å
163	E	71.3	Confident	73.3	Confident	85 Å²	85	76.8 Å²	76.8	40%	0.397	38%	0.38	S	S	.	.	H	α-helix	trans	-72.9	-37.5	178.2	-66.1	178.7	178.6	0	0	111.7	Q142 C145 Q160 V161	Q142-E163 HydrophobicContact CG-CG 4.11Å; C145-E163 WeakPolarHBondContact CB-OE1 3.44Å; Q160-E163 WeakPolarHBondContact O-CB 3.38Å; Q160-E163 PolarHBondContact O-N 3.02Å; V161-E163 VanDerWaalsContact C-N 3.34Å
164	D	61.3	Low	73.8	Confident	146 Å²	146	73.5 Å²	73.5	78%	0.781	36%	0.358	S	S	*	.	H	α-helix	trans	-85.1	-12.5	-174.7	-69	-31.7	0	0	0	114.6	A166	D164-A166 PolarHBondContact O-N 2.9Å; D164-A166 VanDerWaalsContact O-N 3.11Å
165	K	58.4	Low	73.9	Confident	98 Å²	98	74.7 Å²	74.7	43%	0.426	37%	0.366	S	S	.	.			trans	-84.6	89	-175.7	-78.3	-179.3	179	175.6	0	111.9	V131 V161	V131-K165 HydrophobicContact CG2-CD 4.13Å; V161-K165 HydrophobicContact CG1-CD 4.3Å; V161-K165 WeakPolarHBondContact O-CG 3.25Å
166	A	56.8	Low	74.1	Confident	63 Å²	63	75.1 Å²	75.1	52%	0.521	38%	0.375	S	S	.	.			trans	-73.2	126.9	163	0	0	0	0	0	110.4	D164 A200	D164-A166 PolarHBondContact O-N 2.9Å; D164-A166 VanDerWaalsContact O-N 3.11Å; A166-A200 HydrophobicContact CB-CB 4.16Å; A166-A200 WeakPolarHBondContact CB-O 3.23Å
167	L	56.7	Low	74.6	Confident	77 Å²	77	74.1 Å²	74.1	40%	0.403	37%	0.369	S	S	.	.			trans	-91.8	108	171.2	-72.6	168.3	0	0	0	108.5	R169 Y223	L167-R169 PolarHBondContact O-N 2.82Å; L167-Y223 PolarHBondContact O-OH 2.81Å
168	N	57.8	Low	75.1	Confident	104 Å²	104	66.9 Å²	66.9	56%	0.556	34%	0.338	S	S	*	.			trans	-76.9	121.9	170.3	-157.9	-5.1	0	0	0	109.2	E196	N168-E196 PolarHBondContact ND2-OE1 2.77Å
169	R	64.3	Low	75.3	Confident	52 Å²	52	69.7 Å²	69.7	20%	0.196	35%	0.351	C	S	.	.			trans	-115	163.6	-176.8	-67.9	-157.1	-175.8	-175.9	7.3	111.6	L167 E173 Y223 D225	L167-R169 PolarHBondContact O-N 2.82Å; R169-E173 IonicContact NH1-OE2 3.6Å; R169-Y223 HydrophobicContact CB-CD1 4.25Å; R169-Y223 HydrophobicContact CB-CE1 3.99Å; R169-Y223 HydrophobicContact CG-CD1 4.06Å; R169-Y223 HydrophobicContact CG-CE1 3.79Å; R169-D225 IonicContact CZ-OD1 2.64Å; R169-D225 IonicContact NH1-OD1 3.1Å; R169-D225 PolarHBondContact NH1-OD1 3.29Å; R169-D225 IonicContact NH1-OD2 2.84Å; R169-D225 IonicContact NH2-OD1 3.92Å; R169-D225 IonicContact NH2-OD2 2.85Å
170	R	63	Low	75.5	Confident	206 Å²	206	72 Å²	72	78%	0.777	36%	0.362	S	S	*	.			trans	-75.1	142.5	-170.3	-69.5	-177.3	-100.6	-172.1	-9.8	112.6	K172 E173	R170-K172 VanDerWaalsContact C-N 3.29Å; R170-K172 PolarHBondContact O-N 2.86Å; R170-K172 VanDerWaalsContact O-N 3.14Å; R170-E173 PolarHBondContact O-N 3.41Å
171	C	60.7	Low	76.1	Confident	57 Å²	57	69.9 Å²	69.9	39%	0.385	35%	0.354	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.2	-30.5	-176.1	-46.3	0	0	0	0	115.5	E173 V174 Y195	C171-E173 PolarHBondContact O-N 3.32Å; C171-E173 VanDerWaalsContact O-N 3.08Å; C171-V174 WeakPolarHBondContact O-CB 3.38Å; C171-V174 PolarHBondContact O-N 2.87Å; C171-Y195 HydrophobicContact CB-CD1 4.12Å
172	K	70.4	Confident	76.7	Confident	181 Å²	181	68.8 Å²	68.8	79%	0.787	34%	0.343	S	S	*	.	H	α-helix	trans	-63.6	-16.2	-177.3	-68.6	-171.4	176.6	-174.2	0	114.3	R170 V174	R170-K172 VanDerWaalsContact C-N 3.29Å; R170-K172 PolarHBondContact O-N 2.86Å; R170-K172 VanDerWaalsContact O-N 3.14Å; K172-V174 VanDerWaalsContact C-N 3.34Å
173	E	82.6	Confident	77.5	Confident	62 Å²	62	75.5 Å²	75.5	29%	0.29	38%	0.38	S	S	.	.	H	α-helix	trans	-73.7	-28	176	-65.8	-177.3	-179.4	0	0	112	R169 R170 C171 L177 I224	R169-E173 IonicContact NH1-OE2 3.6Å; R170-E173 PolarHBondContact O-N 3.41Å; C171-E173 PolarHBondContact O-N 3.32Å; C171-E173 VanDerWaalsContact O-N 3.08Å; E173-L177 PolarHBondContact O-N 3.49Å; E173-I224 HydrophobicContact CB-CG2 4.07Å; E173-I224 HydrophobicContact CG-CG2 4.11Å
174	V	89.5	Confident	78.6	Confident	1 Å²	1	73.1 Å²	73.1	1%	0.006	37%	0.371	C	S	.	.	H	α-helix	trans	-68.8	-51.6	-178	-178.3	0	0	0	0	111	C171 K172 A176 L177 F178 P186 F193 V221	C171-V174 WeakPolarHBondContact O-CB 3.38Å; C171-V174 PolarHBondContact O-N 2.87Å; K172-V174 VanDerWaalsContact C-N 3.34Å; V174-A176 VanDerWaalsContact C-N 3.29Å; V174-A176 PolarHBondContact O-N 3.45Å; V174-L177 WeakPolarHBondContact O-CB 3.5Å; V174-L177 PolarHBondContact O-N 2.8Å; V174-F178 HydrophobicContact CG1-CD2 3.8Å; V174-F178 HydrophobicContact CG1-CE2 3.82Å; V174-F178 WeakPolarHBondContact O-CD2 3.45Å; V174-F178 PolarHBondContact O-N 3.04Å; V174-P186 HydrophobicContact CG1-CG 3.91Å; V174-F193 HydrophobicContact CG1-CE1 4.12Å; V174-F193 HydrophobicContact CG1-CZ 4.09Å; V174-V221 HydrophobicContact CG1-CG1 4.46Å
175	D	91.1	Very high	80.2	Confident	52 Å²	52	67.4 Å²	67.4	28%	0.278	34%	0.341	S	S	.	.	H	α-helix	trans	-59.1	-42.4	-178.7	-62.5	-27.3	0	0	0	112	L177 F178 I179 P186 Y195	D175-L177 VanDerWaalsContact C-N 3.28Å; D175-L177 PolarHBondContact O-N 3.21Å; D175-F178 PolarHBondContact O-N 3.07Å; D175-I179 WeakPolarHBondContact O-CB 3.34Å; D175-I179 VanDerWaalsContact O-CG1 3.31Å; D175-I179 WeakPolarHBondContact O-CG1 3.44Å; D175-I179 PolarHBondContact O-N 3.45Å; D175-P186 VanDerWaalsContact OD1-CD 3.28Å; D175-P186 WeakPolarHBondContact OD1-CD 3.31Å; D175-Y195 VanDerWaalsContact OD1-CE1 3.23Å; D175-Y195 WeakPolarHBondContact OD1-CE1 3.42Å; D175-Y195 PolarHBondContact OD1-OH 3.28Å
176	A	89.2	Confident	81.9	Confident	38 Å²	38	62.8 Å²	62.8	31%	0.314	32%	0.321	S	S	.	.	H	α-helix	trans	-62.3	-37.4	178.1	0	0	0	0	0	111.9	V174 E180 I224	V174-A176 VanDerWaalsContact C-N 3.29Å; V174-A176 PolarHBondContact O-N 3.45Å; A176-E180 VanDerWaalsContact O-CG 3.29Å; A176-E180 WeakPolarHBondContact O-CG 3.5Å; A176-E180 PolarHBondContact O-N 3.21Å; A176-E180 VanDerWaalsContact O-N 3.16Å; A176-I224 HydrophobicContact CB-CD1 3.69Å
177	L	91.3	Very high	83.6	Confident	1 Å²	1	64.3 Å²	64.3	1%	0.005	32%	0.32	C	S	.	.	H	α-helix	trans	-69.1	-44.6	177.7	-171.5	154.8	0	0	0	111.1	E173 V174 D175 E180 D181 V221 Q222 I224 R303 V304	E173-L177 PolarHBondContact O-N 3.49Å; V174-L177 WeakPolarHBondContact O-CB 3.5Å; V174-L177 PolarHBondContact O-N 2.8Å; D175-L177 VanDerWaalsContact C-N 3.28Å; D175-L177 PolarHBondContact O-N 3.21Å; L177-E180 PolarHBondContact O-N 3.32Å; L177-D181 PolarHBondContact O-N 2.92Å; L177-V221 HydrophobicContact CD1-CG1 3.87Å; L177-V221 HydrophobicContact CD2-CG1 4.1Å; L177-V221 HydrophobicContact CG-CG1 4.46Å; L177-Q222 WeakPolarHBondContact CD1-O 3.32Å; L177-I224 HydrophobicContact CB-CD1 4Å; L177-I224 HydrophobicContact CB-CG1 4.32Å; L177-I224 HydrophobicContact CD1-CB 4.38Å; L177-R303 HydrophobicContact CD1-CB 4.15Å; L177-R303 HydrophobicContact CD2-CB 4.04Å; L177-R303 HydrophobicContact CG-CB 4.35Å; L177-V304 HydrophobicContact CD2-CG2 3.2Å
178	F	94	Very high	85.4	Confident	0 Å²	0	67.6 Å²	67.6	0%	0	33%	0.331	C	S	.	.	H	α-helix	trans	-63.1	-41	177.2	-90.3	-100.2	0	0	0	112.7	V174 D175 E180 D181 F182 N183 T184 P186 M189 F190 F193 V219 V221 V304	V174-F178 HydrophobicContact CG1-CD2 3.8Å; V174-F178 HydrophobicContact CG1-CE2 3.82Å; V174-F178 WeakPolarHBondContact O-CD2 3.45Å; V174-F178 PolarHBondContact O-N 3.04Å; D175-F178 PolarHBondContact O-N 3.07Å; F178-E180 VanDerWaalsContact C-N 3.29Å; F178-E180 PolarHBondContact O-N 3.19Å; F178-D181 PolarHBondContact O-N 3.23Å; F178-F182 AromaticContact CD1-CD2 3.71Å; F178-F182 HydrophobicContact CD1-CD2 3.71Å; F178-F182 HydrophobicContact CD1-CE2 4.08Å; F178-F182 HydrophobicContact CE1-CD2 4.12Å; F178-F182 HydrophobicContact CE1-CE2 4.04Å; F178-F182 HydrophobicContact CG-CD2 4.31Å; F178-F182 WeakPolarHBondContact O-CA 3.42Å; F178-F182 WeakPolarHBondContact O-CB 3.42Å; F178-F182 PolarHBondContact O-N 3.45Å; F178-N183 PolarHBondContact O-N 2.7Å; F178-T184 CarbonylContact C-O 3.06Å; F178-T184 WeakPolarHBondContact CB-O 3.31Å; F178-P186 HydrophobicContact CB-CG 4.17Å; F178-P186 HydrophobicContact CD1-CG 4.12Å; F178-P186 HydrophobicContact CD2-CG 3.75Å; F178-P186 HydrophobicContact CE1-CG 4.49Å; F178-P186 HydrophobicContact CE2-CG 4.11Å; F178-P186 HydrophobicContact CG-CG 3.73Å; F178-P186 HydrophobicContact CZ-CG 4.47Å; F178-M189 HydrophobicContact CD1-SD 4.04Å; F178-M189 HydrophobicContact CE1-SD 3.72Å; F178-F190 AromaticContact CE1-CE2 3.69Å; F178-F190 HydrophobicContact CE1-CE2 3.69Å; F178-F190 HydrophobicContact CE1-CZ 4.46Å; F178-F190 AromaticContact CZ-CE2 3.99Å; F178-F190 HydrophobicContact CZ-CE2 3.99Å; F178-F193 HydrophobicContact CZ-CE2 4.46Å; F178-V219 HydrophobicContact CZ-CG1 3.93Å; F178-V221 HydrophobicContact CE2-CG1 4.44Å; F178-V221 HydrophobicContact CE2-CG2 3.83Å; F178-V221 HydrophobicContact CZ-CG2 4.42Å; F178-V304 HydrophobicContact CD2-CG2 4.38Å; F178-V304 HydrophobicContact CE1-CG1 4.3Å; F178-V304 HydrophobicContact CE2-CG1 4.25Å; F178-V304 HydrophobicContact CE2-CG2 3.93Å; F178-V304 HydrophobicContact CZ-CG1 3.68Å; F178-V304 HydrophobicContact CZ-CG2 4.08Å
179	I	92.9	Very high	87.1	Confident	77 Å²	77	64.1 Å²	64.1	40%	0.395	31%	0.312	S	S	.	.	H	α-helix	trans	-61	-40.4	174	-72.6	-71	0	0	0	111	D175 N183 T184 T185	D175-I179 WeakPolarHBondContact O-CB 3.34Å; D175-I179 VanDerWaalsContact O-CG1 3.31Å; D175-I179 WeakPolarHBondContact O-CG1 3.44Å; D175-I179 PolarHBondContact O-N 3.45Å; I179-N183 WeakPolarHBondContact O-CA 3.28Å; I179-N183 PolarHBondContact O-N 3.13Å; I179-T184 WeakPolarHBondContact CA-O 3.38Å; I179-T184 PolarHBondContact N-O 3.47Å; I179-T184 VanDerWaalsContact N-O 3.16Å; I179-T185 HydrophobicContact CD1-CG2 3.75Å; I179-T185 HydrophobicContact CG1-CG2 3.93Å
180	E	91.4	Very high	88.7	Confident	49 Å²	49	61.7 Å²	61.7	23%	0.229	30%	0.303	C	S	.	.	H	α-helix	trans	-72.3	-34.2	179.7	-72.8	174	-163.8	0	0	114.1	R67 A176 L177 F178 R303	R67-E180 IonicContact CZ-OE1 2.74Å; R67-E180 IonicContact NH1-OE1 2.71Å; R67-E180 PolarHBondContact NH1-OE1 2.9Å; R67-E180 VanDerWaalsContact NH2-CD 3.3Å; R67-E180 IonicContact NH2-OE1 2.63Å; R67-E180 PolarHBondContact NH2-OE1 3.46Å; R67-E180 IonicContact NH2-OE2 2.91Å; R67-E180 PolarHBondContact NH2-OE2 2.77Å; R67-E180 VanDerWaalsContact NH2-OE2 3.09Å; A176-E180 VanDerWaalsContact O-CG 3.29Å; A176-E180 WeakPolarHBondContact O-CG 3.5Å; A176-E180 PolarHBondContact O-N 3.21Å; A176-E180 VanDerWaalsContact O-N 3.16Å; L177-E180 PolarHBondContact O-N 3.32Å; F178-E180 VanDerWaalsContact C-N 3.29Å; F178-E180 PolarHBondContact O-N 3.19Å; E180-R303 IonicContact OE2-CZ 3.86Å; E180-R303 IonicContact OE2-NH1 3.89Å; E180-R303 PolarHBondContact OE2-NH1 3.1Å; E180-R303 IonicContact OE2-NH2 2.78Å; E180-R303 PolarHBondContact OE2-NH2 3.43Å; E180-R303 VanDerWaalsContact OE2-NH2 3.1Å
181	D	93.5	Very high	90.4	Very high	50 Å²	50	58 Å²	58	27%	0.267	29%	0.293	S	S	.	.	H	α-helix	trans	-92	-32.7	-176.3	-86.4	5.7	0	0	0	113.7	L177 F178 S301 R303	L177-D181 PolarHBondContact O-N 2.92Å; F178-D181 PolarHBondContact O-N 3.23Å; D181-S301 WeakPolarHBondContact OD2-CB 3.37Å; D181-S301 PolarHBondContact OD2-OG 3.39Å; D181-R303 IonicContact OD1-CZ 2.8Å; D181-R303 IonicContact OD1-NE 2.83Å; D181-R303 PolarHBondContact OD1-NE 2.89Å; D181-R303 IonicContact OD1-NH2 3.46Å; D181-R303 PolarHBondContact OD1-NH2 2.8Å; D181-R303 VanDerWaalsContact OD2-CB 3.32Å; D181-R303 WeakPolarHBondContact OD2-CB 3.13Å; D181-R303 IonicContact OD2-NE 3.1Å; D181-R303 PolarHBondContact OD2-NE 3.37Å
182	F	95.3	Very high	92.1	Very high	45 Å²	45	59.9 Å²	59.9	20%	0.197	29%	0.294	C	S	.	.	H	α-helix	trans	-126.4	-1.9	-171.6	-56.2	-75	0	0	0	113.7	F178 T184 M189 V304	F178-F182 AromaticContact CD1-CD2 3.71Å; F178-F182 HydrophobicContact CD1-CD2 3.71Å; F178-F182 HydrophobicContact CD1-CE2 4.08Å; F178-F182 HydrophobicContact CE1-CD2 4.12Å; F178-F182 HydrophobicContact CE1-CE2 4.04Å; F178-F182 HydrophobicContact CG-CD2 4.31Å; F178-F182 WeakPolarHBondContact O-CA 3.42Å; F178-F182 WeakPolarHBondContact O-CB 3.42Å; F178-F182 PolarHBondContact O-N 3.45Å; F182-T184 HydrophobicContact CB-CG2 3.95Å; F182-T184 PolarHBondContact O-N 3.19Å; F182-T184 VanDerWaalsContact O-N 3.12Å; F182-M189 HydrophobicContact CB-CE 3.48Å; F182-M189 VanDerWaalsContact CB-CE 3.48Å; F182-M189 HydrophobicContact CD1-CE 3.63Å; F182-M189 HydrophobicContact CD2-CE 3.92Å; F182-M189 HydrophobicContact CD2-SD 4.37Å; F182-M189 HydrophobicContact CE1-CE 4.27Å; F182-M189 HydrophobicContact CG-CE 3.41Å; F182-M189 VanDerWaalsContact CG-CE 3.41Å; F182-M189 HydrophobicContact CG-SD 4.41Å; F182-V304 HydrophobicContact CE2-CB 3.75Å; F182-V304 HydrophobicContact CE2-CG1 4.15Å; F182-V304 HydrophobicContact CE2-CG2 3.75Å; F182-V304 HydrophobicContact CZ-CB 3.99Å; F182-V304 HydrophobicContact CZ-CG1 4.39Å; F182-V304 HydrophobicContact CZ-CG2 4.45Å
183	N	95.3	Very high	93.4	Very high	142 Å²	142	52.2 Å²	52.2	76%	0.759	26%	0.261	S	S	*	.	S	Bend	trans	55.5	26.7	-176.2	-160.6	43.5	0	0	0	113.7	F178 I179	F178-N183 PolarHBondContact O-N 2.7Å; I179-N183 WeakPolarHBondContact O-CA 3.28Å; I179-N183 PolarHBondContact O-N 3.13Å
184	T	94.8	Very high	93.9	Very high	35 Å²	35	52.3 Å²	52.3	22%	0.215	26%	0.261	C	S	.	.	S	Bend	trans	-148.7	170.6	178.1	-167.4	0	0	0	0	109.9	F178 I179 F182 K188 M189	F178-T184 CarbonylContact C-O 3.06Å; F178-T184 WeakPolarHBondContact CB-O 3.31Å; I179-T184 WeakPolarHBondContact CA-O 3.38Å; I179-T184 PolarHBondContact N-O 3.47Å; I179-T184 VanDerWaalsContact N-O 3.16Å; F182-T184 HydrophobicContact CB-CG2 3.95Å; F182-T184 PolarHBondContact O-N 3.19Å; F182-T184 VanDerWaalsContact O-N 3.12Å; T184-K188 WeakPolarHBondContact OG1-CB 3.34Å; T184-M189 HydrophobicContact CG2-CB 4.08Å; T184-M189 HydrophobicContact CG2-CE 3.72Å
185	T	94.8	Very high	94	Very high	26 Å²	26	55.4 Å²	55.4	16%	0.16	27%	0.273	C	S	.	.			trans	-102.4	158.8	178.2	51.1	0	0	0	0	111.5	I179 D187 K188 M189	I179-T185 HydrophobicContact CD1-CG2 3.75Å; I179-T185 HydrophobicContact CG1-CG2 3.93Å; T185-D187 VanDerWaalsContact C-N 3.3Å; T185-D187 WeakPolarHBondContact CB-OD1 3.49Å; T185-D187 PolarHBondContact O-N 3.39Å; T185-D187 PolarHBondContact OG1-OD1 2.98Å; T185-K188 PolarHBondContact O-N 3.47Å; T185-K188 VanDerWaalsContact O-N 3.1Å; T185-M189 PolarHBondContact O-N 2.95Å
186	P	94.6	Very high	93.9	Very high	0 Å²	0	58.8 Å²	58.8	0%	0	29%	0.288	C	S	.	.	H	α-helix	trans	-56.9	-39.5	-179.7	-22.9	32	0	0	0	113.6	V174 D175 F178 K188 M189 F190 F193 Y195	V174-P186 HydrophobicContact CG1-CG 3.91Å; D175-P186 VanDerWaalsContact OD1-CD 3.28Å; D175-P186 WeakPolarHBondContact OD1-CD 3.31Å; F178-P186 HydrophobicContact CB-CG 4.17Å; F178-P186 HydrophobicContact CD1-CG 4.12Å; F178-P186 HydrophobicContact CD2-CG 3.75Å; F178-P186 HydrophobicContact CE1-CG 4.49Å; F178-P186 HydrophobicContact CE2-CG 4.11Å; F178-P186 HydrophobicContact CG-CG 3.73Å; F178-P186 HydrophobicContact CZ-CG 4.47Å; P186-K188 PolarHBondContact O-N 3.04Å; P186-M189 PolarHBondContact O-N 3.44Å; P186-F190 HydrophobicContact CB-CD2 4.43Å; P186-F190 WeakPolarHBondContact O-CB 3.33Å; P186-F190 WeakPolarHBondContact O-CD2 3.43Å; P186-F190 PolarHBondContact O-N 2.92Å; P186-F193 HydrophobicContact CB-CB 4.12Å; P186-F193 HydrophobicContact CB-CD1 3.75Å; P186-F193 HydrophobicContact CB-CD2 3.79Å; P186-F193 HydrophobicContact CB-CE1 4.07Å; P186-F193 HydrophobicContact CB-CE2 4.11Å; P186-F193 HydrophobicContact CB-CG 3.6Å; P186-F193 HydrophobicContact CB-CZ 4.24Å; P186-F193 HydrophobicContact CG-CD1 4.5Å; P186-F193 HydrophobicContact CG-CE1 4.43Å; P186-Y195 HydrophobicContact CG-CE1 4.48Å
187	D	92.8	Very high	93.9	Very high	95 Å²	95	57.9 Å²	57.9	51%	0.508	28%	0.279	S	S	.	.	H	α-helix	trans	-63.3	-23.8	178.1	62.4	-58.4	0	0	0	113.9	T185	T185-D187 VanDerWaalsContact C-N 3.3Å; T185-D187 WeakPolarHBondContact CB-OD1 3.49Å; T185-D187 PolarHBondContact O-N 3.39Å; T185-D187 PolarHBondContact OG1-OD1 2.98Å
188	K	93.7	Very high	93.8	Very high	146 Å²	146	61.9 Å²	61.9	64%	0.635	30%	0.299	S	S	*	.	H	α-helix	trans	-93.1	-33.9	175	-69	-177.9	-178.9	179.5	0	112.5	T184 T185 P186	T184-K188 WeakPolarHBondContact OG1-CB 3.34Å; T185-K188 PolarHBondContact O-N 3.47Å; T185-K188 VanDerWaalsContact O-N 3.1Å; P186-K188 PolarHBondContact O-N 3.04Å
189	M	95	Very high	93.3	Very high	31 Å²	31	64.3 Å²	64.3	15%	0.153	32%	0.319	C	S	.	.	H	α-helix	trans	-73.2	-40.8	-179.7	179.4	170.8	-84.1	0	0	111.7	F178 F182 T184 T185 P186 Q212 Q299	F178-M189 HydrophobicContact CD1-SD 4.04Å; F178-M189 HydrophobicContact CE1-SD 3.72Å; F182-M189 HydrophobicContact CB-CE 3.48Å; F182-M189 VanDerWaalsContact CB-CE 3.48Å; F182-M189 HydrophobicContact CD1-CE 3.63Å; F182-M189 HydrophobicContact CD2-CE 3.92Å; F182-M189 HydrophobicContact CD2-SD 4.37Å; F182-M189 HydrophobicContact CE1-CE 4.27Å; F182-M189 HydrophobicContact CG-CE 3.41Å; F182-M189 VanDerWaalsContact CG-CE 3.41Å; F182-M189 HydrophobicContact CG-SD 4.41Å; T184-M189 HydrophobicContact CG2-CB 4.08Å; T184-M189 HydrophobicContact CG2-CE 3.72Å; T185-M189 PolarHBondContact O-N 2.95Å; P186-M189 PolarHBondContact O-N 3.44Å; M189-Q212 PolarHBondContact O-NE2 3.49Å; M189-Q299 HydrophobicContact CG-CG 3.86Å; M189-Q299 HydrophobicContact SD-CB 4.01Å; M189-Q299 HydrophobicContact SD-CG 3.76Å
190	F	97.4	Very high	92.6	Very high	2 Å²	2	62.1 Å²	62.1	1%	0.009	31%	0.313	C	S	.	.	S	Bend	trans	-106.8	152.9	-178.3	-61.4	-79.7	0	0	0	111	F178 P186 K192 F193 A209 E210 L211 V217 V219 Q299 T306	F178-F190 AromaticContact CE1-CE2 3.69Å; F178-F190 HydrophobicContact CE1-CE2 3.69Å; F178-F190 HydrophobicContact CE1-CZ 4.46Å; F178-F190 AromaticContact CZ-CE2 3.99Å; F178-F190 HydrophobicContact CZ-CE2 3.99Å; P186-F190 HydrophobicContact CB-CD2 4.43Å; P186-F190 WeakPolarHBondContact O-CB 3.33Å; P186-F190 WeakPolarHBondContact O-CD2 3.43Å; P186-F190 PolarHBondContact O-N 2.92Å; F190-K192 VanDerWaalsContact C-N 3.31Å; F190-F193 HydrophobicContact CB-CB 4.38Å; F190-F193 AromaticContact CD2-CD2 3.59Å; F190-F193 HydrophobicContact CD2-CD2 3.59Å; F190-F193 HydrophobicContact CD2-CE2 4.23Å; F190-F193 HydrophobicContact CD2-CG 4.47Å; F190-F193 AromaticContact CE2-CD2 3.95Å; F190-F193 HydrophobicContact CE2-CD2 3.95Å; F190-F193 HydrophobicContact CE2-CE2 4.13Å; F190-F193 HydrophobicContact CG-CD2 4.2Å; F190-A209 HydrophobicContact CB-CB 4.36Å; F190-A209 HydrophobicContact CD1-CB 3.92Å; F190-A209 HydrophobicContact CE1-CB 4.37Å; F190-A209 HydrophobicContact CG-CB 4.02Å; F190-E210 WeakPolarHBondContact CB-O 3.42Å; F190-L211 HydrophobicContact CD1-CD2 3.93Å; F190-L211 HydrophobicContact CE1-CD2 3.83Å; F190-V217 HydrophobicContact CD1-CG2 4.25Å; F190-V217 HydrophobicContact CE1-CG2 4Å; F190-V219 HydrophobicContact CE1-CG2 3.93Å; F190-V219 HydrophobicContact CE2-CG1 4.49Å; F190-V219 HydrophobicContact CE2-CG2 4.24Å; F190-V219 HydrophobicContact CZ-CG1 4.24Å; F190-V219 HydrophobicContact CZ-CG2 3.66Å; F190-Q299 HydrophobicContact CE1-CB 4.22Å; F190-Q299 HydrophobicContact CE1-CG 4.02Å; F190-Q299 HydrophobicContact CZ-CB 3.99Å; F190-Q299 HydrophobicContact CZ-CG 4.09Å; F190-T306 HydrophobicContact CE1-CG2 4.12Å; F190-T306 HydrophobicContact CZ-CG2 4.4Å
191	K	97.3	Very high	91.8	Very high	128 Å²	128	62.4 Å²	62.4	56%	0.557	32%	0.323	S	S	*	.	S	Bend	trans	-65.8	-39.6	172	-178.8	-178.4	178.7	-175.3	0	111.1	E210 L211	K191-E210 HydrophobicContact CB-CB 4.44Å; K191-E210 PolarHBondContact N-O 3.28Å; K191-L211 VanDerWaalsContact CB-O 3.3Å; K191-L211 WeakPolarHBondContact CB-O 3.16Å
192	K	97.3	Very high	90.8	Very high	96 Å²	96	60.7 Å²	60.7	42%	0.417	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.2	135	175.9	-175	-176	169.5	-152.6	0	108.4	F190 E194 A209 E210	F190-K192 VanDerWaalsContact C-N 3.31Å; K192-E194 WeakPolarHBondContact CE-OE1 3.43Å; K192-E194 IonicContact NZ-OE1 3.96Å; K192-E194 PolarHBondContact NZ-OE1 2.84Å; K192-A209 CarbonylContact O-C 3.55Å; K192-A209 WeakPolarHBondContact O-CA 3.35Å; K192-A209 VanDerWaalsContact O-CB 3.29Å; K192-A209 WeakPolarHBondContact O-CB 3.43Å; K192-E210 HydrophobicContact CB-CB 4.15Å; K192-E210 HydrophobicContact CB-CG 4.37Å; K192-E210 PolarHBondContact N-O 3.44Å; K192-E210 PolarHBondContact O-N 3.31Å
193	F	96.6	Very high	90.1	Very high	21 Å²	21	59.1 Å²	59.1	9%	0.092	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.8	121.4	175.8	-170.6	-88.9	0	0	0	109.9	V174 F178 P186 F190 Y195 H207 A209 V219	V174-F193 HydrophobicContact CG1-CE1 4.12Å; V174-F193 HydrophobicContact CG1-CZ 4.09Å; F178-F193 HydrophobicContact CZ-CE2 4.46Å; P186-F193 HydrophobicContact CB-CB 4.12Å; P186-F193 HydrophobicContact CB-CD1 3.75Å; P186-F193 HydrophobicContact CB-CD2 3.79Å; P186-F193 HydrophobicContact CB-CE1 4.07Å; P186-F193 HydrophobicContact CB-CE2 4.11Å; P186-F193 HydrophobicContact CB-CG 3.6Å; P186-F193 HydrophobicContact CB-CZ 4.24Å; P186-F193 HydrophobicContact CG-CD1 4.5Å; P186-F193 HydrophobicContact CG-CE1 4.43Å; F190-F193 HydrophobicContact CB-CB 4.38Å; F190-F193 AromaticContact CD2-CD2 3.59Å; F190-F193 HydrophobicContact CD2-CD2 3.59Å; F190-F193 HydrophobicContact CD2-CE2 4.23Å; F190-F193 HydrophobicContact CD2-CG 4.47Å; F190-F193 AromaticContact CE2-CD2 3.95Å; F190-F193 HydrophobicContact CE2-CD2 3.95Å; F190-F193 HydrophobicContact CE2-CE2 4.13Å; F190-F193 HydrophobicContact CG-CD2 4.2Å; F193-Y195 HydrophobicContact CD1-CD1 4.28Å; F193-Y195 HydrophobicContact CD1-CD2 4.06Å; F193-Y195 HydrophobicContact CD1-CE1 4.33Å; F193-Y195 HydrophobicContact CD1-CE2 4.09Å; F193-Y195 HydrophobicContact CD1-CG 4.17Å; F193-Y195 HydrophobicContact CE1-CD1 4.2Å; F193-Y195 HydrophobicContact CE1-CE1 4.37Å; F193-Y195 HydrophobicContact CE1-CG 4.4Å; F193-Y195 PolarHBondContact O-N 3.34Å; F193-H207 HydrophobicContact CE1-CB 4.05Å; F193-H207 AromaticContact CE1-CG 3.89Å; F193-H207 AromaticContact CE1-ND1 3.98Å; F193-H207 HydrophobicContact CE2-CB 4Å; F193-H207 HydrophobicContact CZ-CB 3.54Å; F193-H207 AromaticContact CZ-CD2 3.97Å; F193-H207 AromaticContact CZ-CG 3.6Å; F193-A209 HydrophobicContact CD2-CB 3.67Å; F193-A209 HydrophobicContact CE2-CB 4.32Å; F193-A209 HydrophobicContact CG-CB 4.43Å; F193-V219 HydrophobicContact CE2-CB 3.97Å; F193-V219 HydrophobicContact CE2-CG1 4.02Å; F193-V219 HydrophobicContact CE2-CG2 4.1Å
194	E	94.3	Very high	89.7	Confident	63 Å²	63	52.5 Å²	52.5	29%	0.294	27%	0.274	S	S	.	.			trans	-88.7	104.8	178.7	-61.7	-176.5	-175	0	0	109.7	K192 E196 H207 K208	K192-E194 WeakPolarHBondContact CE-OE1 3.43Å; K192-E194 IonicContact NZ-OE1 3.96Å; K192-E194 PolarHBondContact NZ-OE1 2.84Å; E194-E196 PolarHBondContact O-N 3.47Å; E194-H207 WeakPolarHBondContact O-CB 3.48Å; E194-H207 PolarHBondContact O-ND1 3.42Å; E194-K208 HydrophobicContact CB-CB 4.42Å; E194-K208 VanDerWaalsContact CB-O 3.32Å; E194-K208 WeakPolarHBondContact CB-O 3.28Å; E194-K208 HydrophobicContact CG-CB 4.47Å; E194-K208 PolarHBondContact N-O 2.88Å
195	Y	90.9	Very high	89.4	Confident	66 Å²	66	51.1 Å²	51.1	26%	0.259	27%	0.265	S	S	.	.			trans	-67.9	-21	-178.3	-81.5	-85.8	0	0	0	114.1	C171 D175 P186 F193 P197 H207	C171-Y195 HydrophobicContact CB-CD1 4.12Å; D175-Y195 VanDerWaalsContact OD1-CE1 3.23Å; D175-Y195 WeakPolarHBondContact OD1-CE1 3.42Å; D175-Y195 PolarHBondContact OD1-OH 3.28Å; P186-Y195 HydrophobicContact CG-CE1 4.48Å; F193-Y195 HydrophobicContact CD1-CD1 4.28Å; F193-Y195 HydrophobicContact CD1-CD2 4.06Å; F193-Y195 HydrophobicContact CD1-CE1 4.33Å; F193-Y195 HydrophobicContact CD1-CE2 4.09Å; F193-Y195 HydrophobicContact CD1-CG 4.17Å; F193-Y195 HydrophobicContact CE1-CD1 4.2Å; F193-Y195 HydrophobicContact CE1-CE1 4.37Å; F193-Y195 HydrophobicContact CE1-CG 4.4Å; F193-Y195 PolarHBondContact O-N 3.34Å; Y195-P197 WeakPolarHBondContact O-CD 3.38Å; Y195-H207 PolarHBondContact O-CE1 3.31Å; Y195-H207 PolarHBondContact O-ND1 3.02Å
196	E	89.4	Confident	89.3	Confident	123 Å²	123	51.6 Å²	51.6	58%	0.575	27%	0.268	S	S	*	.	S	Bend	trans	-77.3	121.7	169.5	-169.6	63.1	-150.7	0	0	108.4	N168 E194	N168-E196 PolarHBondContact ND2-OE1 2.77Å; E194-E196 PolarHBondContact O-N 3.47Å
197	P	89.9	Confident	89.3	Confident	19 Å²	19	51.6 Å²	51.6	12%	0.123	27%	0.268	C	S	.	.			trans	-69.9	136.6	-178.8	28.4	-33.8	0	0	0	111.1	Y195 A199 Q205 V206	Y195-P197 WeakPolarHBondContact O-CD 3.38Å; P197-A199 VanDerWaalsContact C-N 3.29Å; P197-Q205 HydrophobicContact CB-CB 4.08Å; P197-V206 CarbonylContact C-O 3.45Å; P197-V206 VanDerWaalsContact CA-O 3.25Å; P197-V206 WeakPolarHBondContact CA-O 3.23Å; P197-V206 WeakPolarHBondContact CB-O 3.35Å
198	I	88.6	Confident	89.4	Confident	86 Å²	86	49.9 Å²	49.9	44%	0.441	26%	0.256	S	S	.	.	S	Bend	trans	-75.2	-23.9	172.5	59.9	169.1	0	0	0	112	V206 K208 F309	I198-V206 HydrophobicContact CD1-CG1 4.03Å; I198-V206 HydrophobicContact CG1-CB 4.21Å; I198-V206 HydrophobicContact CG1-CG1 4.03Å; I198-V206 VanDerWaalsContact CG1-O 3.3Å; I198-V206 WeakPolarHBondContact CG1-O 3.31Å; I198-V206 PolarHBondContact N-O 2.79Å; I198-K208 HydrophobicContact CG2-CB 4.03Å; I198-F309 HydrophobicContact CD1-CD2 4.44Å; I198-F309 HydrophobicContact CD1-CE2 3.71Å
199	A	82.9	Confident	89.6	Confident	51 Å²	51	43 Å²	43	42%	0.421	23%	0.226	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.4	146.3	175.8	0	0	0	0	0	109.8	P197 V206	P197-A199 VanDerWaalsContact C-N 3.29Å; A199-V206 HydrophobicContact CB-CB 4.27Å; A199-V206 HydrophobicContact CB-CG2 4.48Å; A199-V206 PolarHBondContact N-O 3.02Å; A199-V206 PolarHBondContact O-N 3Å
200	A	79.3	Confident	89.7	Confident	31 Å²	31	44.1 Å²	44.1	26%	0.256	23%	0.231	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	135.9	172.9	0	0	0	0	0	109.3	A166	A166-A200 HydrophobicContact CB-CB 4.16Å; A166-A200 WeakPolarHBondContact CB-O 3.23Å
201	A	74.1	Confident	89.7	Confident	54 Å²	54	44.6 Å²	44.6	45%	0.446	23%	0.234	S	C	.	.			trans	-121.5	-173.2	178.9	0	0	0	0	0	110.2	A204 Y223	A201-A204 WeakPolarHBondContact CA-O 3.37Å; A201-A204 PolarHBondContact N-O 2.9Å; A201-Y223 WeakPolarHBondContact O-CE2 3.44Å; A201-Y223 PolarHBondContact O-OH 2.91Å
202	S	71.9	Confident	89.6	Confident	15 Å²	15	44.3 Å²	44.3	11%	0.105	23%	0.234	C	C	.	.	S	Bend	trans	-69.9	-32.5	-176.5	49.8	0	0	0	0	113.9	K139 Q142	K139-S202 VanDerWaalsContact CD-OG 3.25Å; K139-S202 WeakPolarHBondContact CD-OG 3.41Å; Q142-S202 PolarHBondContact OE1-OG 2.98Å
203	L	80.4	Confident	89.5	Confident	11 Å²	11	45.4 Å²	45.4	6%	0.058	25%	0.245	C	C	.	.	S	Bend	trans	-109.5	-20.7	-178.4	-59.7	178.7	0	0	0	114.7	K139 Q222 Y223 L226 L264 E267 L268	K139-L203 HydrophobicContact CB-CD2 4.17Å; K139-L203 HydrophobicContact CD-CD1 4.15Å; K139-L203 HydrophobicContact CD-CG 4.16Å; K139-L203 HydrophobicContact CG-CD1 4.16Å; K139-L203 HydrophobicContact CG-CD2 4.3Å; K139-L203 HydrophobicContact CG-CG 4.26Å; L203-Q222 WeakPolarHBondContact O-CA 3.25Å; L203-Y223 VanDerWaalsContact C-CD2 3.49Å; L203-Y223 WeakPolarHBondContact O-CD2 3.39Å; L203-Y223 PolarHBondContact O-N 2.71Å; L203-L226 HydrophobicContact CB-CD1 4.03Å; L203-L226 HydrophobicContact CD2-CD1 3.78Å; L203-L226 HydrophobicContact CD2-CD2 4.41Å; L203-L226 WeakPolarHBondContact O-CD1 3.46Å; L203-L264 HydrophobicContact CD1-CD1 3.83Å; L203-L264 HydrophobicContact CD2-CD1 4.27Å; L203-E267 HydrophobicContact CD1-CB 3.88Å; L203-E267 VanDerWaalsContact CD1-OE2 3.31Å; L203-E267 WeakPolarHBondContact CD1-OE2 3.23Å; L203-L268 HydrophobicContact CD1-CD2 4.17Å; L203-L268 HydrophobicContact CD2-CD2 4.32Å
204	A	87.5	Confident	89.4	Confident	3 Å²	3	45.8 Å²	45.8	3%	0.025	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.2	165.4	-169.9	0	0	0	0	0	112.1	A201 K220 V221 F270	A201-A204 WeakPolarHBondContact CA-O 3.37Å; A201-A204 PolarHBondContact N-O 2.9Å; A204-K220 HydrophobicContact CB-CG 3.92Å; A204-V221 CarbonylContact C-O 3.55Å; A204-V221 WeakPolarHBondContact CA-O 3.46Å; A204-V221 VanDerWaalsContact CB-O 3.24Å; A204-V221 WeakPolarHBondContact CB-O 3.3Å; A204-F270 HydrophobicContact CB-CE2 4.24Å; A204-F270 HydrophobicContact CB-CZ 3.7Å
205	Q	88.9	Confident	89.6	Confident	6 Å²	6	44.6 Å²	44.6	3%	0.028	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	145.6	173.2	54.9	-173	49.1	0	0	109.3	P197 H207 K220 V221 Y223	P197-Q205 HydrophobicContact CB-CB 4.08Å; Q205-H207 WeakPolarHBondContact CG-NE2 3.34Å; Q205-H207 PolarHBondContact NE2-CE1 2.94Å; Q205-H207 PolarHBondContact NE2-NE2 2.95Å; Q205-K220 CarbonylContact O-C 3.58Å; Q205-K220 WeakPolarHBondContact O-CA 3.48Å; Q205-V221 HydrophobicContact CG-CB 4.35Å; Q205-V221 PolarHBondContact N-O 2.91Å; Q205-V221 PolarHBondContact O-N 2.78Å; Q205-Y223 HydrophobicContact CB-CE1 4.38Å; Q205-Y223 HydrophobicContact CG-CE1 4.37Å
206	V	92.1	Very high	89.9	Confident	36 Å²	36	44.2 Å²	44.2	22%	0.218	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	127.2	-178.7	-174	0	0	0	0	108.5	P197 I198 A199 A218 V219 K220	P197-V206 CarbonylContact C-O 3.45Å; P197-V206 VanDerWaalsContact CA-O 3.25Å; P197-V206 WeakPolarHBondContact CA-O 3.23Å; P197-V206 WeakPolarHBondContact CB-O 3.35Å; I198-V206 HydrophobicContact CD1-CG1 4.03Å; I198-V206 HydrophobicContact CG1-CB 4.21Å; I198-V206 HydrophobicContact CG1-CG1 4.03Å; I198-V206 VanDerWaalsContact CG1-O 3.3Å; I198-V206 WeakPolarHBondContact CG1-O 3.31Å; I198-V206 PolarHBondContact N-O 2.79Å; A199-V206 HydrophobicContact CB-CB 4.27Å; A199-V206 HydrophobicContact CB-CG2 4.48Å; A199-V206 PolarHBondContact N-O 3.02Å; A199-V206 PolarHBondContact O-N 3Å; V206-A218 HydrophobicContact CG1-CB 4.03Å; V206-V219 WeakPolarHBondContact CA-O 3.25Å; V206-K220 HydrophobicContact CG2-CB 4.23Å; V206-K220 HydrophobicContact CG2-CG 4.12Å
207	H	94.2	Very high	90.3	Very high	0 Å²	0	38.4 Å²	38.4	0%	0	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	149.4	177.8	-64.8	-87.9	0	0	0	110.3	F193 E194 Y195 Q205 A218 V219	F193-H207 HydrophobicContact CE1-CB 4.05Å; F193-H207 AromaticContact CE1-CG 3.89Å; F193-H207 AromaticContact CE1-ND1 3.98Å; F193-H207 HydrophobicContact CE2-CB 4Å; F193-H207 HydrophobicContact CZ-CB 3.54Å; F193-H207 AromaticContact CZ-CD2 3.97Å; F193-H207 AromaticContact CZ-CG 3.6Å; E194-H207 WeakPolarHBondContact O-CB 3.48Å; E194-H207 PolarHBondContact O-ND1 3.42Å; Y195-H207 PolarHBondContact O-CE1 3.31Å; Y195-H207 PolarHBondContact O-ND1 3.02Å; Q205-H207 WeakPolarHBondContact CG-NE2 3.34Å; Q205-H207 PolarHBondContact NE2-CE1 2.94Å; Q205-H207 PolarHBondContact NE2-NE2 2.95Å; H207-A218 WeakPolarHBondContact O-CA 3.43Å; H207-V219 HydrophobicContact CB-CB 4.48Å; H207-V219 PolarHBondContact N-O 3.08Å; H207-V219 PolarHBondContact O-N 2.84Å
208	K	96.2	Very high	90.7	Very high	59 Å²	59	38.4 Å²	38.4	26%	0.257	23%	0.232	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.9	135.3	167.7	-171	175.1	-177.6	176.9	0	109	E194 I198 F309	E194-K208 HydrophobicContact CB-CB 4.42Å; E194-K208 VanDerWaalsContact CB-O 3.32Å; E194-K208 WeakPolarHBondContact CB-O 3.28Å; E194-K208 HydrophobicContact CG-CB 4.47Å; E194-K208 PolarHBondContact N-O 2.88Å; I198-K208 HydrophobicContact CG2-CB 4.03Å; K208-F309 HydrophobicContact CD-CE2 4.34Å; K208-F309 HydrophobicContact CD-CZ 4.3Å; K208-F309 HydrophobicContact CG-CD2 4.37Å; K208-F309 HydrophobicContact CG-CE2 4.37Å
209	A	97.5	Very high	91.1	Very high	2 Å²	2	34.3 Å²	34.3	2%	0.017	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.5	171.2	175.7	0	0	0	0	0	111.2	F190 K192 F193 V217 V219	F190-A209 HydrophobicContact CB-CB 4.36Å; F190-A209 HydrophobicContact CD1-CB 3.92Å; F190-A209 HydrophobicContact CE1-CB 4.37Å; F190-A209 HydrophobicContact CG-CB 4.02Å; K192-A209 CarbonylContact O-C 3.55Å; K192-A209 WeakPolarHBondContact O-CA 3.35Å; K192-A209 VanDerWaalsContact O-CB 3.29Å; K192-A209 WeakPolarHBondContact O-CB 3.43Å; F193-A209 HydrophobicContact CD2-CB 3.67Å; F193-A209 HydrophobicContact CE2-CB 4.32Å; F193-A209 HydrophobicContact CG-CB 4.43Å; A209-V217 HydrophobicContact CB-CG2 3.91Å; A209-V217 PolarHBondContact N-O 3.38Å; A209-V217 PolarHBondContact O-N 2.78Å; A209-V219 HydrophobicContact CB-CG2 3.74Å
210	E	98	Very high	91.6	Very high	54 Å²	54	33.7 Å²	33.7	25%	0.252	20%	0.199	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-127	130.7	174	-66.8	174	-160.1	0	0	108.9	F190 K191 K192 T215	F190-E210 WeakPolarHBondContact CB-O 3.42Å; K191-E210 HydrophobicContact CB-CB 4.44Å; K191-E210 PolarHBondContact N-O 3.28Å; K192-E210 HydrophobicContact CB-CB 4.15Å; K192-E210 HydrophobicContact CB-CG 4.37Å; K192-E210 PolarHBondContact N-O 3.44Å; K192-E210 PolarHBondContact O-N 3.31Å; E210-T215 WeakPolarHBondContact CA-O 3.36Å
211	L	97	Very high	92.3	Very high	13 Å²	13	32.2 Å²	32.2	7%	0.068	19%	0.187	C	C	.	.			trans	-67.6	169.1	171.1	-65.5	178.4	0	0	0	110.9	F190 K191 D213 G214 T215 V217 Y296 Q299	F190-L211 HydrophobicContact CD1-CD2 3.93Å; F190-L211 HydrophobicContact CE1-CD2 3.83Å; K191-L211 VanDerWaalsContact CB-O 3.3Å; K191-L211 WeakPolarHBondContact CB-O 3.16Å; L211-D213 VanDerWaalsContact CB-OD1 3.31Å; L211-D213 WeakPolarHBondContact CB-OD1 3.35Å; L211-D213 PolarHBondContact O-N 2.83Å; L211-G214 WeakPolarHBondContact O-CA 3.47Å; L211-G214 PolarHBondContact O-N 3.07Å; L211-T215 PolarHBondContact N-O 3.14Å; L211-V217 HydrophobicContact CD1-CG1 3.83Å; L211-V217 HydrophobicContact CD2-CG1 4.39Å; L211-V217 HydrophobicContact CD2-CG2 4.34Å; L211-V217 HydrophobicContact CG-CG1 3.76Å; L211-V217 HydrophobicContact CG-CG2 4.24Å; L211-Y296 HydrophobicContact CD1-CD1 3.44Å; L211-Y296 VanDerWaalsContact CD1-CD1 3.44Å; L211-Y296 HydrophobicContact CD1-CD2 4.44Å; L211-Y296 HydrophobicContact CD1-CE1 3.47Å; L211-Y296 VanDerWaalsContact CD1-CE1 3.47Å; L211-Y296 HydrophobicContact CD1-CE2 4.47Å; L211-Y296 HydrophobicContact CD1-CG 3.96Å; L211-Q299 HydrophobicContact CD2-CG 4.21Å
212	Q	94.3	Very high	93.1	Very high	122 Å²	122	29.9 Å²	29.9	57%	0.57	17%	0.166	S	C	*	.	T	Hydrogen-bonded Turn	trans	-60.1	-30.5	-178.8	-61.3	-61	-18.3	0	0	113	M189 G214	M189-Q212 PolarHBondContact O-NE2 3.49Å; Q212-G214 PolarHBondContact O-N 2.91Å
213	D	95.1	Very high	93.8	Very high	118 Å²	118	29.3 Å²	29.3	63%	0.631	16%	0.162	S	C	*	.	T	Hydrogen-bonded Turn	trans	-78.4	-2.4	174.9	65.7	1.7	0	0	0	113.9	L211 T215	L211-D213 VanDerWaalsContact CB-OD1 3.31Å; L211-D213 WeakPolarHBondContact CB-OD1 3.35Å; L211-D213 PolarHBondContact O-N 2.83Å; D213-T215 WeakPolarHBondContact OD1-CB 3.31Å; D213-T215 PolarHBondContact OD1-N 2.81Å; D213-T215 PolarHBondContact OD1-OG1 3.03Å; D213-T215 PolarHBondContact OD2-OG1 3.37Å; D213-T215 VanDerWaalsContact OD2-OG1 3.13Å
214	G	95.6	Very high	94	Very high	29 Å²	29	29.3 Å²	29.3	30%	0.299	16%	0.162	S	C	.	.			trans	88	1.7	-177.2	0	0	0	0	0	114.7	L211 Q212	L211-G214 WeakPolarHBondContact O-CA 3.47Å; L211-G214 PolarHBondContact O-N 3.07Å; Q212-G214 PolarHBondContact O-N 2.91Å
215	T	96.9	Very high	93.5	Very high	39 Å²	39	30.4 Å²	30.4	24%	0.239	17%	0.168	C	C	.	.			trans	-66.5	125.8	178.2	-58.7	0	0	0	0	110.7	E210 L211 D213 Y296	E210-T215 WeakPolarHBondContact CA-O 3.36Å; L211-T215 PolarHBondContact N-O 3.14Å; D213-T215 WeakPolarHBondContact OD1-CB 3.31Å; D213-T215 PolarHBondContact OD1-N 2.81Å; D213-T215 PolarHBondContact OD1-OG1 3.03Å; D213-T215 PolarHBondContact OD2-OG1 3.37Å; D213-T215 VanDerWaalsContact OD2-OG1 3.13Å; T215-Y296 WeakPolarHBondContact CG2-OH 3.47Å
216	P	97.9	Very high	93	Very high	58 Å²	58	30.1 Å²	30.1	38%	0.377	17%	0.166	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.4	132.9	178.9	31.1	-34.9	0	0	0	111.2	F309	P216-F309 HydrophobicContact CB-CB 4.04Å; P216-F309 WeakPolarHBondContact O-CB 2.88Å; P216-F309 PolarHBondContact O-N 2.96Å; P216-F309 VanDerWaalsContact O-N 3.08Å
217	V	98.1	Very high	92.3	Very high	0 Å²	0	33.3 Å²	33.3	0%	0	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	149.9	-177.9	-64.5	0	0	0	0	112.1	F190 A209 L211 V219 Y296 T306 A307	F190-V217 HydrophobicContact CD1-CG2 4.25Å; F190-V217 HydrophobicContact CE1-CG2 4Å; A209-V217 HydrophobicContact CB-CG2 3.91Å; A209-V217 PolarHBondContact N-O 3.38Å; A209-V217 PolarHBondContact O-N 2.78Å; L211-V217 HydrophobicContact CD1-CG1 3.83Å; L211-V217 HydrophobicContact CD2-CG1 4.39Å; L211-V217 HydrophobicContact CD2-CG2 4.34Å; L211-V217 HydrophobicContact CG-CG1 3.76Å; L211-V217 HydrophobicContact CG-CG2 4.24Å; V217-V219 HydrophobicContact CG2-CG2 4.03Å; V217-Y296 HydrophobicContact CG1-CD2 3.77Å; V217-Y296 HydrophobicContact CG1-CE2 3.58Å; V217-T306 HydrophobicContact CB-CG2 3.87Å; V217-T306 HydrophobicContact CG1-CG2 4.17Å; V217-T306 HydrophobicContact CG2-CG2 3.9Å; V217-A307 CarbonylContact C-O 3.34Å; V217-A307 VanDerWaalsContact CA-O 3.28Å; V217-A307 WeakPolarHBondContact CA-O 3.29Å; V217-A307 WeakPolarHBondContact CB-O 3.45Å
218	A	97.4	Very high	91.6	Very high	20 Å²	20	35.9 Å²	35.9	17%	0.165	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.4	125.5	166.3	0	0	0	0	0	108.8	V206 H207 A307 F309	V206-A218 HydrophobicContact CG1-CB 4.03Å; H207-A218 WeakPolarHBondContact O-CA 3.43Å; A218-A307 PolarHBondContact N-O 3Å; A218-A307 PolarHBondContact O-N 2.9Å; A218-F309 HydrophobicContact CB-CD2 4.21Å
219	V	96.9	Very high	91	Very high	0 Å²	0	33.7 Å²	33.7	0%	0	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	102.9	-177.9	-171.6	0	0	0	0	108.9	F178 F190 F193 V206 H207 A209 V217 V221 V304 L305 T306	F178-V219 HydrophobicContact CZ-CG1 3.93Å; F190-V219 HydrophobicContact CE1-CG2 3.93Å; F190-V219 HydrophobicContact CE2-CG1 4.49Å; F190-V219 HydrophobicContact CE2-CG2 4.24Å; F190-V219 HydrophobicContact CZ-CG1 4.24Å; F190-V219 HydrophobicContact CZ-CG2 3.66Å; F193-V219 HydrophobicContact CE2-CB 3.97Å; F193-V219 HydrophobicContact CE2-CG1 4.02Å; F193-V219 HydrophobicContact CE2-CG2 4.1Å; V206-V219 WeakPolarHBondContact CA-O 3.25Å; H207-V219 HydrophobicContact CB-CB 4.48Å; H207-V219 PolarHBondContact N-O 3.08Å; H207-V219 PolarHBondContact O-N 2.84Å; A209-V219 HydrophobicContact CB-CG2 3.74Å; V217-V219 HydrophobicContact CG2-CG2 4.03Å; V219-V221 HydrophobicContact CG1-CG2 3.93Å; V219-V304 HydrophobicContact CG1-CG1 3.66Å; V219-L305 CarbonylContact C-O 3.59Å; V219-L305 WeakPolarHBondContact CA-O 3.47Å; V219-T306 HydrophobicContact CG2-CG2 4.21Å
220	K	94.8	Very high	90.4	Very high	37 Å²	37	34.6 Å²	34.6	16%	0.161	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.7	118.7	177.4	-173.3	-172.6	-170	-175.1	0	108.7	A204 Q205 V206 F270 E273 V304 L305	A204-K220 HydrophobicContact CB-CG 3.92Å; Q205-K220 CarbonylContact O-C 3.58Å; Q205-K220 WeakPolarHBondContact O-CA 3.48Å; V206-K220 HydrophobicContact CG2-CB 4.23Å; V206-K220 HydrophobicContact CG2-CG 4.12Å; K220-F270 HydrophobicContact CB-CE2 4.26Å; K220-F270 HydrophobicContact CD-CE1 4.03Å; K220-F270 HydrophobicContact CD-CE2 3.96Å; K220-F270 HydrophobicContact CD-CZ 3.58Å; K220-F270 HydrophobicContact CG-CE2 3.72Å; K220-F270 HydrophobicContact CG-CZ 3.68Å; K220-F270 WeakPolarHBondContact O-CE2 3.38Å; K220-E273 IonicContact NZ-OE1 3.17Å; K220-E273 PolarHBondContact NZ-OE1 3.25Å; K220-E273 IonicContact NZ-OE2 3.64Å; K220-E273 PolarHBondContact NZ-OE2 3.07Å; K220-V304 CarbonylContact O-C 3.42Å; K220-V304 WeakPolarHBondContact O-CA 3.01Å; K220-L305 HydrophobicContact CB-CB 4.19Å; K220-L305 HydrophobicContact CD-CD2 4.36Å; K220-L305 PolarHBondContact N-O 3.06Å; K220-L305 PolarHBondContact O-N 3.25Å
221	V	93.4	Very high	89.7	Confident	1 Å²	1	37.6 Å²	37.6	1%	0.006	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120	123.3	-173.9	-175.8	0	0	0	0	109.2	V174 L177 F178 A204 Q205 V219 V304	V174-V221 HydrophobicContact CG1-CG1 4.46Å; L177-V221 HydrophobicContact CD1-CG1 3.87Å; L177-V221 HydrophobicContact CD2-CG1 4.1Å; L177-V221 HydrophobicContact CG-CG1 4.46Å; F178-V221 HydrophobicContact CE2-CG1 4.44Å; F178-V221 HydrophobicContact CE2-CG2 3.83Å; F178-V221 HydrophobicContact CZ-CG2 4.42Å; A204-V221 CarbonylContact C-O 3.55Å; A204-V221 WeakPolarHBondContact CA-O 3.46Å; A204-V221 VanDerWaalsContact CB-O 3.24Å; A204-V221 WeakPolarHBondContact CB-O 3.3Å; Q205-V221 HydrophobicContact CG-CB 4.35Å; Q205-V221 PolarHBondContact N-O 2.91Å; Q205-V221 PolarHBondContact O-N 2.78Å; V219-V221 HydrophobicContact CG1-CG2 3.93Å; V221-V304 HydrophobicContact CG1-CG2 4.48Å
222	Q	91.3	Very high	89.2	Confident	4 Å²	4	39.1 Å²	39.1	2%	0.019	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.5	152.2	176.3	-65.7	-177.9	10.3	0	0	111.9	L177 L203 I224 L268 F270 K302 R303	L177-Q222 WeakPolarHBondContact CD1-O 3.32Å; L203-Q222 WeakPolarHBondContact O-CA 3.25Å; Q222-I224 PolarHBondContact O-N 2.74Å; Q222-L268 VanDerWaalsContact NE2-C 3.27Å; Q222-L268 PolarHBondContact NE2-O 3.18Å; Q222-F270 HydrophobicContact CB-CE2 4.46Å; Q222-F270 HydrophobicContact CG-CD2 3.93Å; Q222-F270 HydrophobicContact CG-CE1 4.08Å; Q222-F270 HydrophobicContact CG-CE2 3.35Å; Q222-F270 HydrophobicContact CG-CZ 3.43Å; Q222-F270 VanDerWaalsContact CG-CZ 3.43Å; Q222-K302 PolarHBondContact NE2-O 3.39Å; Q222-R303 HydrophobicContact CB-CB 4.32Å; Q222-R303 HydrophobicContact CG-CB 4.42Å; Q222-R303 PolarHBondContact N-O 2.6Å
223	Y	86.9	Confident	89	Confident	4 Å²	4	33.4 Å²	33.4	2%	0.016	19%	0.192	C	C	.	.			trans	-67.6	127.3	167.5	-56.2	-59.8	0	0	0	110.4	L167 R169 A201 L203 Q205 D225 L226	L167-Y223 PolarHBondContact O-OH 2.81Å; R169-Y223 HydrophobicContact CB-CD1 4.25Å; R169-Y223 HydrophobicContact CB-CE1 3.99Å; R169-Y223 HydrophobicContact CG-CD1 4.06Å; R169-Y223 HydrophobicContact CG-CE1 3.79Å; A201-Y223 WeakPolarHBondContact O-CE2 3.44Å; A201-Y223 PolarHBondContact O-OH 2.91Å; L203-Y223 VanDerWaalsContact C-CD2 3.49Å; L203-Y223 WeakPolarHBondContact O-CD2 3.39Å; L203-Y223 PolarHBondContact O-N 2.71Å; Q205-Y223 HydrophobicContact CB-CE1 4.38Å; Q205-Y223 HydrophobicContact CG-CE1 4.37Å; Y223-D225 PolarHBondContact O-N 2.89Å; Y223-L226 HydrophobicContact CD2-CD1 3.78Å; Y223-L226 HydrophobicContact CG-CD1 4.29Å; Y223-L226 WeakPolarHBondContact O-CB 3.38Å; Y223-L226 PolarHBondContact O-N 2.95Å; Y223-L226 VanDerWaalsContact O-N 3.09Å
224	I	83.5	Confident	88.7	Confident	11 Å²	11	27.9 Å²	27.9	6%	0.056	16%	0.162	C	C	.	.	H	α-helix	trans	-60	-25	-168.3	-161.5	166.3	0	0	0	114.5	E173 A176 L177 Q222	E173-I224 HydrophobicContact CB-CG2 4.07Å; E173-I224 HydrophobicContact CG-CG2 4.11Å; A176-I224 HydrophobicContact CB-CD1 3.69Å; L177-I224 HydrophobicContact CB-CD1 4Å; L177-I224 HydrophobicContact CB-CG1 4.32Å; L177-I224 HydrophobicContact CD1-CB 4.38Å; Q222-I224 PolarHBondContact O-N 2.74Å
225	D	78.3	Confident	88.3	Confident	26 Å²	26	33.4 Å²	33.4	14%	0.139	17%	0.174	C	C	.	.	H	α-helix	trans	-87	-14.7	-178.2	72.8	-47.6	0	0	0	114.3	I71 R169 Y223 R229	I71-D225 HydrophobicContact CD1-CB 3.93Å; I71-D225 HydrophobicContact CG1-CB 4.43Å; R169-D225 IonicContact CZ-OD1 2.64Å; R169-D225 IonicContact NH1-OD1 3.1Å; R169-D225 PolarHBondContact NH1-OD1 3.29Å; R169-D225 IonicContact NH1-OD2 2.84Å; R169-D225 IonicContact NH2-OD1 3.92Å; R169-D225 IonicContact NH2-OD2 2.85Å; Y223-D225 PolarHBondContact O-N 2.89Å; D225-R229 WeakPolarHBondContact O-CD 3.48Å; D225-R229 WeakPolarHBondContact O-CG 3.34Å; D225-R229 PolarHBondContact O-N 3.44Å; D225-R229 IonicContact OD2-CZ 3.26Å; D225-R229 IonicContact OD2-NH1 3.17Å; D225-R229 PolarHBondContact OD2-NH1 2.79Å
226	L	78.3	Confident	88	Confident	0 Å²	0	32.1 Å²	32.1	0%	0	17%	0.166	C	C	.	.	H	α-helix	trans	-67.6	-46.5	-170.3	-76.1	173.7	0	0	0	113.2	I136 L203 Y223 R229 F230 L268	I136-L226 HydrophobicContact CG1-CD2 4.38Å; L203-L226 HydrophobicContact CB-CD1 4.03Å; L203-L226 HydrophobicContact CD2-CD1 3.78Å; L203-L226 HydrophobicContact CD2-CD2 4.41Å; L203-L226 WeakPolarHBondContact O-CD1 3.46Å; Y223-L226 HydrophobicContact CD2-CD1 3.78Å; Y223-L226 HydrophobicContact CG-CD1 4.29Å; Y223-L226 WeakPolarHBondContact O-CB 3.38Å; Y223-L226 PolarHBondContact O-N 2.95Å; Y223-L226 VanDerWaalsContact O-N 3.09Å; L226-R229 WeakPolarHBondContact O-CG 3.26Å; L226-R229 PolarHBondContact O-N 2.84Å; L226-F230 PolarHBondContact O-N 3.46Å; L226-F230 VanDerWaalsContact O-N 3.08Å; L226-L268 HydrophobicContact CB-CD2 4.38Å
227	R	76.7	Confident	87.5	Confident	103 Å²	103	30.6 Å²	30.6	39%	0.389	16%	0.155	S	C	.	.	H	α-helix	trans	-67.9	-42.1	180	-167.1	173.9	-173.4	146.2	6.3	111.3	R229 F230 K302	R227-R229 PolarHBondContact O-N 2.85Å; R227-F230 PolarHBondContact O-N 2.63Å; R227-K302 VanDerWaalsContact NH1-CB 3.28Å
228	D	79.1	Confident	87.1	Confident	54 Å²	54	32.6 Å²	32.6	29%	0.289	16%	0.164	S	C	.	.	H	α-helix	trans	-60.7	-27.5	179.1	-77.1	-20.4	0	0	0	112.5	R67 I71	R67-D228 IonicContact CZ-OD2 2.88Å; R67-D228 IonicContact NE-OD2 3.12Å; R67-D228 PolarHBondContact NE-OD2 2.82Å; R67-D228 IonicContact NH2-OD2 3.46Å; R67-D228 PolarHBondContact NH2-OD2 2.69Å; I71-D228 HydrophobicContact CD1-CB 3.57Å
229	R	83.4	Confident	86.7	Confident	13 Å²	13	34.5 Å²	34.5	5%	0.049	17%	0.171	C	C	.	.	H	α-helix	trans	-103.3	-4.3	179.8	75.1	-166.1	-133.9	-170.6	5	114.7	I71 N133 G134 I136 D225 L226 R227 G232 D233	I71-R229 HydrophobicContact CG2-CB 3.85Å; N133-R229 PolarHBondContact O-NH2 2.8Å; G134-R229 PolarHBondContact O-NH2 3.24Å; I136-R229 HydrophobicContact CD1-CG 4.42Å; D225-R229 WeakPolarHBondContact O-CD 3.48Å; D225-R229 WeakPolarHBondContact O-CG 3.34Å; D225-R229 PolarHBondContact O-N 3.44Å; D225-R229 IonicContact OD2-CZ 3.26Å; D225-R229 IonicContact OD2-NH1 3.17Å; D225-R229 PolarHBondContact OD2-NH1 2.79Å; L226-R229 WeakPolarHBondContact O-CG 3.26Å; L226-R229 PolarHBondContact O-N 2.84Å; R227-R229 PolarHBondContact O-N 2.85Å; R229-G232 PolarHBondContact O-N 3.16Å; R229-D233 WeakPolarHBondContact CG-OD2 3.44Å; R229-D233 IonicContact CZ-OD2 2.87Å; R229-D233 IonicContact NE-OD2 2.79Å; R229-D233 PolarHBondContact NE-OD2 2.9Å; R229-D233 IonicContact NH2-OD2 3.75Å; R229-D233 WeakPolarHBondContact O-CB 3.15Å; R229-D233 PolarHBondContact O-N 3.36Å
230	F	84.6	Confident	86.3	Confident	20 Å²	20	35.3 Å²	35.3	9%	0.088	18%	0.175	C	C	.	.	H	α-helix	trans	-58.5	-55.5	-170.3	175.6	-93.9	0	0	0	113.4	I136 L226 R227 G232 D233 I234 K261 L264 A265 L268	I136-F230 HydrophobicContact CD1-CB 3.81Å; I136-F230 HydrophobicContact CD1-CD2 3.55Å; I136-F230 HydrophobicContact CD1-CG 4.08Å; I136-F230 HydrophobicContact CG1-CD2 4.27Å; L226-F230 PolarHBondContact O-N 3.46Å; L226-F230 VanDerWaalsContact O-N 3.08Å; R227-F230 PolarHBondContact O-N 2.63Å; F230-G232 VanDerWaalsContact C-N 3.29Å; F230-G232 PolarHBondContact O-N 2.84Å; F230-D233 PolarHBondContact O-N 2.89Å; F230-I234 HydrophobicContact CD1-CG1 4.44Å; F230-I234 HydrophobicContact CD2-CG1 4.23Å; F230-I234 HydrophobicContact CE1-CG1 4.19Å; F230-I234 HydrophobicContact CE2-CD1 4.31Å; F230-I234 HydrophobicContact CE2-CG1 3.95Å; F230-I234 HydrophobicContact CG-CG1 4.47Å; F230-I234 HydrophobicContact CZ-CD1 4.46Å; F230-I234 HydrophobicContact CZ-CG1 3.94Å; F230-I234 WeakPolarHBondContact O-CB 3.28Å; F230-I234 VanDerWaalsContact O-CG1 3.29Å; F230-I234 WeakPolarHBondContact O-CG1 3.26Å; F230-I234 PolarHBondContact O-N 3.13Å; F230-K261 HydrophobicContact CZ-CG 4.34Å; F230-L264 HydrophobicContact CD2-CD2 4.18Å; F230-L264 HydrophobicContact CD2-CG 4.36Å; F230-L264 HydrophobicContact CE2-CB 4.12Å; F230-L264 HydrophobicContact CE2-CD2 3.63Å; F230-L264 HydrophobicContact CE2-CG 3.67Å; F230-A265 HydrophobicContact CZ-CB 4.18Å; F230-L268 HydrophobicContact CB-CD1 4.32Å; F230-L268 HydrophobicContact CD2-CD1 3.32Å; F230-L268 HydrophobicContact CE2-CD1 3.78Å; F230-L268 HydrophobicContact CG-CD1 3.94Å
231	D	84.6	Confident	85.9	Confident	117 Å²	117	35 Å²	35	63%	0.626	18%	0.175	S	C	*	.	H	α-helix	trans	-63.7	-37.4	-176.9	-64.5	-48.6	0	0	0	112	R235	D231-R235 WeakPolarHBondContact O-CB 3.44Å; D231-R235 PolarHBondContact O-N 3Å
232	G	86.6	Confident	85.6	Confident	45 Å²	45	38 Å²	38	46%	0.464	19%	0.191	S	C	.	.	H	α-helix	trans	-68.4	-45.5	178.3	0	0	0	0	0	113.2	R229 F230 R235 T236	R229-G232 PolarHBondContact O-N 3.16Å; F230-G232 VanDerWaalsContact C-N 3.29Å; F230-G232 PolarHBondContact O-N 2.84Å; G232-R235 PolarHBondContact O-N 3.22Å; G232-T236 PolarHBondContact O-N 3.45Å; G232-T236 PolarHBondContact O-OG1 2.81Å
233	D	89	Confident	85.4	Confident	3 Å²	3	40.5 Å²	40.5	2%	0.016	21%	0.206	C	C	.	.	H	α-helix	trans	-66.4	-40.4	177.9	-72.3	-3.3	0	0	0	110.1	R78 I136 Y137 R229 F230 T236 L237	R78-D233 IonicContact CZ-OD1 3.33Å; R78-D233 IonicContact NE-OD1 3.02Å; R78-D233 PolarHBondContact NE-OD1 3Å; R78-D233 IonicContact NE-OD2 3.28Å; R78-D233 IonicContact NH2-OD1 3.13Å; R78-D233 PolarHBondContact NH2-OD1 2.82Å; I136-D233 HydrophobicContact CD1-CB 4.22Å; Y137-D233 HydrophobicContact CE2-CB 3.9Å; R229-D233 WeakPolarHBondContact CG-OD2 3.44Å; R229-D233 IonicContact CZ-OD2 2.87Å; R229-D233 IonicContact NE-OD2 2.79Å; R229-D233 PolarHBondContact NE-OD2 2.9Å; R229-D233 IonicContact NH2-OD2 3.75Å; R229-D233 WeakPolarHBondContact O-CB 3.15Å; R229-D233 PolarHBondContact O-N 3.36Å; F230-D233 PolarHBondContact O-N 2.89Å; D233-T236 WeakPolarHBondContact O-CB 3.4Å; D233-T236 PolarHBondContact O-N 3.02Å; D233-L237 WeakPolarHBondContact O-CG 3.46Å; D233-L237 PolarHBondContact O-N 2.96Å
234	I	88.7	Confident	85.3	Confident	1 Å²	1	41.3 Å²	41.3	1%	0.005	21%	0.211	C	C	.	.	H	α-helix	trans	-65.6	-43.9	174.8	-68.2	-66.6	0	0	0	111.7	I136 L140 F230 T236 L237 E238 K261	I136-I234 HydrophobicContact CG2-CD1 4.25Å; L140-I234 HydrophobicContact CD1-CD1 4.37Å; F230-I234 HydrophobicContact CD1-CG1 4.44Å; F230-I234 HydrophobicContact CD2-CG1 4.23Å; F230-I234 HydrophobicContact CE1-CG1 4.19Å; F230-I234 HydrophobicContact CE2-CD1 4.31Å; F230-I234 HydrophobicContact CE2-CG1 3.95Å; F230-I234 HydrophobicContact CG-CG1 4.47Å; F230-I234 HydrophobicContact CZ-CD1 4.46Å; F230-I234 HydrophobicContact CZ-CG1 3.94Å; F230-I234 WeakPolarHBondContact O-CB 3.28Å; F230-I234 VanDerWaalsContact O-CG1 3.29Å; F230-I234 WeakPolarHBondContact O-CG1 3.26Å; F230-I234 PolarHBondContact O-N 3.13Å; I234-T236 VanDerWaalsContact C-N 3.25Å; I234-T236 PolarHBondContact O-N 3.46Å; I234-L237 WeakPolarHBondContact O-CB 3.43Å; I234-L237 PolarHBondContact O-N 3.41Å; I234-L237 VanDerWaalsContact O-N 3.08Å; I234-E238 HydrophobicContact CG2-CG 4.39Å; I234-E238 WeakPolarHBondContact O-CG 3.43Å; I234-E238 PolarHBondContact O-N 3.27Å; I234-K261 HydrophobicContact CD1-CG 4.47Å; I234-K261 HydrophobicContact CG2-CD 3.69Å; I234-K261 HydrophobicContact CG2-CG 4.07Å
235	R	88.5	Confident	85.3	Confident	146 Å²	146	46.2 Å²	46.2	55%	0.551	23%	0.231	S	C	*	.	H	α-helix	trans	-60.7	-38	177.6	-177.1	57.3	174.5	-175.5	0.3	111.9	D231 G232 L237 E238 I239	D231-R235 WeakPolarHBondContact O-CB 3.44Å; D231-R235 PolarHBondContact O-N 3Å; G232-R235 PolarHBondContact O-N 3.22Å; R235-L237 VanDerWaalsContact C-N 3.31Å; R235-L237 PolarHBondContact O-N 2.86Å; R235-E238 IonicContact NH1-OE2 3.09Å; R235-E238 PolarHBondContact NH1-OE2 3.17Å; R235-E238 PolarHBondContact O-N 3.38Å; R235-I239 HydrophobicContact CG-CD1 4.11Å; R235-I239 VanDerWaalsContact O-CG1 3.31Å; R235-I239 WeakPolarHBondContact O-CG1 3.29Å; R235-I239 PolarHBondContact O-N 3.43Å
236	T	89.6	Confident	85.6	Confident	12 Å²	12	53.6 Å²	53.6	7%	0.074	26%	0.263	C	S	.	.	H	α-helix	trans	-57.2	-46.3	173.6	-60.3	0	0	0	0	111.1	F79 G232 D233 I234 I239 L240	F79-T236 HydrophobicContact CB-CG2 4.32Å; F79-T236 HydrophobicContact CD2-CG2 3.59Å; F79-T236 WeakPolarHBondContact CD2-OG1 3.38Å; F79-T236 HydrophobicContact CE2-CG2 4.27Å; F79-T236 HydrophobicContact CG-CG2 4.29Å; G232-T236 PolarHBondContact O-N 3.45Å; G232-T236 PolarHBondContact O-OG1 2.81Å; D233-T236 WeakPolarHBondContact O-CB 3.4Å; D233-T236 PolarHBondContact O-N 3.02Å; I234-T236 VanDerWaalsContact C-N 3.25Å; I234-T236 PolarHBondContact O-N 3.46Å; T236-I239 PolarHBondContact O-N 3.39Å; T236-L240 WeakPolarHBondContact O-CB 3.5Å; T236-L240 PolarHBondContact O-N 3.48Å
237	L	88.6	Confident	85.7	Confident	26 Å²	26	56.2 Å²	56.2	14%	0.136	28%	0.276	C	S	.	.	H	α-helix	trans	-69.1	-38.1	179.6	-68.7	170.2	0	0	0	112.6	Y137 L140 D233 I234 R235 L240 L241 L257	Y137-L237 HydrophobicContact CD1-CD2 4.26Å; Y137-L237 HydrophobicContact CE1-CD1 4.29Å; Y137-L237 HydrophobicContact CE1-CD2 3.75Å; Y137-L237 HydrophobicContact CE1-CG 4.07Å; L140-L237 HydrophobicContact CD1-CD1 3.13Å; D233-L237 WeakPolarHBondContact O-CG 3.46Å; D233-L237 PolarHBondContact O-N 2.96Å; I234-L237 WeakPolarHBondContact O-CB 3.43Å; I234-L237 PolarHBondContact O-N 3.41Å; I234-L237 VanDerWaalsContact O-N 3.08Å; R235-L237 VanDerWaalsContact C-N 3.31Å; R235-L237 PolarHBondContact O-N 2.86Å; L237-L240 PolarHBondContact O-N 2.95Å; L237-L241 WeakPolarHBondContact O-CG 3.45Å; L237-L241 PolarHBondContact O-N 2.94Å; L237-L257 HydrophobicContact CB-CD1 4.33Å; L237-L257 HydrophobicContact CB-CD2 3.94Å; L237-L257 HydrophobicContact CD1-CD1 4.34Å
238	E	89.1	Confident	85.9	Confident	41 Å²	41	52.8 Å²	52.8	19%	0.192	26%	0.264	C	S	.	.	H	α-helix	trans	-58.4	-47.8	172.9	-71.4	174.2	176.6	0	0	111	I234 R235 L241 D242 L257 K261	I234-E238 HydrophobicContact CG2-CG 4.39Å; I234-E238 WeakPolarHBondContact O-CG 3.43Å; I234-E238 PolarHBondContact O-N 3.27Å; R235-E238 IonicContact NH1-OE2 3.09Å; R235-E238 PolarHBondContact NH1-OE2 3.17Å; R235-E238 PolarHBondContact O-N 3.38Å; E238-L241 PolarHBondContact O-N 3.38Å; E238-D242 PolarHBondContact O-N 2.88Å; E238-L257 HydrophobicContact CG-CD2 4.04Å; E238-K261 IonicContact OE1-NZ 2.87Å; E238-K261 PolarHBondContact OE1-NZ 3.18Å
239	I	89.9	Confident	85.9	Confident	60 Å²	60	55.4 Å²	55.4	31%	0.308	28%	0.284	S	S	.	.	H	α-helix	trans	-61.8	-45.4	176.9	-68.1	165.2	0	0	0	110.7	F79 I83 R235 T236 L241 D242 V243	F79-I239 HydrophobicContact CE2-CD1 4.28Å; I83-I239 HydrophobicContact CD1-CG2 4.47Å; R235-I239 HydrophobicContact CG-CD1 4.11Å; R235-I239 VanDerWaalsContact O-CG1 3.31Å; R235-I239 WeakPolarHBondContact O-CG1 3.29Å; R235-I239 PolarHBondContact O-N 3.43Å; T236-I239 PolarHBondContact O-N 3.39Å; I239-L241 VanDerWaalsContact C-N 3.34Å; I239-L241 PolarHBondContact O-N 3.27Å; I239-D242 PolarHBondContact O-N 3.49Å; I239-V243 WeakPolarHBondContact O-CG2 3.33Å; I239-V243 PolarHBondContact O-N 2.87Å
240	L	88.6	Confident	85.2	Confident	17 Å²	17	60.4 Å²	60.4	9%	0.089	32%	0.321	C	S	.	.	H	α-helix	trans	-58.5	-47.2	178.6	175.5	61.9	0	0	0	111.1	I83 T236 L237 D242 V243 I244	I83-L240 HydrophobicContact CD1-CB 4.03Å; I83-L240 HydrophobicContact CD1-CD1 4.11Å; T236-L240 WeakPolarHBondContact O-CB 3.5Å; T236-L240 PolarHBondContact O-N 3.48Å; L237-L240 PolarHBondContact O-N 2.95Å; L240-D242 VanDerWaalsContact C-N 3.28Å; L240-D242 PolarHBondContact O-N 2.91Å; L240-V243 PolarHBondContact O-N 2.96Å; L240-I244 HydrophobicContact CD1-CD1 4.01Å; L240-I244 HydrophobicContact CD1-CG1 4.18Å; L240-I244 HydrophobicContact CD2-CD1 4.45Å; L240-I244 HydrophobicContact CG-CD1 3.86Å; L240-I244 HydrophobicContact CG-CG1 4.4Å; L240-I244 VanDerWaalsContact O-CG1 3.28Å; L240-I244 WeakPolarHBondContact O-CG1 3.49Å; L240-I244 PolarHBondContact O-N 3.48Å
241	L	86.3	Confident	84.5	Confident	32 Å²	32	63.2 Å²	63.2	17%	0.168	33%	0.333	C	S	.	.	H	α-helix	trans	-63.6	-33.1	178.3	-71.6	-175.1	0	0	0	112.9	L237 E238 I239 I244 K245 F251 L257	L237-L241 WeakPolarHBondContact O-CG 3.45Å; L237-L241 PolarHBondContact O-N 2.94Å; E238-L241 PolarHBondContact O-N 3.38Å; I239-L241 VanDerWaalsContact C-N 3.34Å; I239-L241 PolarHBondContact O-N 3.27Å; L241-I244 HydrophobicContact CD2-CD1 4.41Å; L241-I244 PolarHBondContact O-N 3.46Å; L241-K245 WeakPolarHBondContact O-CB 3.32Å; L241-K245 PolarHBondContact O-N 3.03Å; L241-F251 HydrophobicContact CD2-CE1 4.03Å; L241-L257 HydrophobicContact CD1-CB 3.58Å; L241-L257 HydrophobicContact CD1-CD2 3.41Å; L241-L257 VanDerWaalsContact CD1-CD2 3.41Å; L241-L257 HydrophobicContact CD1-CG 4.07Å; L241-L257 HydrophobicContact CG-CD2 4.29Å
242	D	86.1	Confident	83.6	Confident	64 Å²	64	59.5 Å²	59.5	34%	0.342	32%	0.323	S	S	.	.	H	α-helix	trans	-65.8	-40.3	174.7	-77.7	-28.8	0	0	0	111.6	E238 I239 L240 F246 R254	E238-D242 PolarHBondContact O-N 2.88Å; I239-D242 PolarHBondContact O-N 3.49Å; L240-D242 VanDerWaalsContact C-N 3.28Å; L240-D242 PolarHBondContact O-N 2.91Å; D242-F246 PolarHBondContact O-N 3.35Å; D242-R254 IonicContact OD1-CZ 3.48Å; D242-R254 IonicContact OD1-NE 3.23Å; D242-R254 IonicContact OD1-NH1 3.82Å; D242-R254 PolarHBondContact OD1-NH1 3.45Å; D242-R254 IonicContact OD1-NH2 2.59Å; D242-R254 PolarHBondContact OD1-NH2 3.02Å; D242-R254 VanDerWaalsContact OD1-NH2 3.15Å; D242-R254 IonicContact OD2-CZ 2.69Å; D242-R254 IonicContact OD2-NH1 3.2Å; D242-R254 IonicContact OD2-NH2 3.1Å; D242-R254 PolarHBondContact OD2-NH2 3.44Å
243	V	86.5	Confident	82.9	Confident	56 Å²	56	59.7 Å²	59.7	34%	0.339	31%	0.311	S	S	.	.	H	α-helix	trans	-65.7	-44.1	173.2	175.4	0	0	0	0	111.4	L87 I239 L240 K245 F246 M247	L87-V243 HydrophobicContact CD2-CG1 3.79Å; I239-V243 WeakPolarHBondContact O-CG2 3.33Å; I239-V243 PolarHBondContact O-N 2.87Å; L240-V243 PolarHBondContact O-N 2.96Å; V243-K245 VanDerWaalsContact C-N 3.35Å; V243-K245 PolarHBondContact O-N 3.18Å; V243-F246 WeakPolarHBondContact O-CB 3.31Å; V243-F246 PolarHBondContact O-N 2.98Å; V243-M247 PolarHBondContact O-N 3.37Å
244	I	85.3	Confident	82.3	Confident	20 Å²	20	65.9 Å²	65.9	10%	0.103	33%	0.334	C	S	.	.	H	α-helix	trans	-62	-43.7	178.3	-66.5	175.5	0	0	0	110.6	S90 L240 L241 F246 M247 H248 F251	S90-I244 WeakPolarHBondContact OG-CG1 3.2Å; L240-I244 HydrophobicContact CD1-CD1 4.01Å; L240-I244 HydrophobicContact CD1-CG1 4.18Å; L240-I244 HydrophobicContact CD2-CD1 4.45Å; L240-I244 HydrophobicContact CG-CD1 3.86Å; L240-I244 HydrophobicContact CG-CG1 4.4Å; L240-I244 VanDerWaalsContact O-CG1 3.28Å; L240-I244 WeakPolarHBondContact O-CG1 3.49Å; L240-I244 PolarHBondContact O-N 3.48Å; L241-I244 HydrophobicContact CD2-CD1 4.41Å; L241-I244 PolarHBondContact O-N 3.46Å; I244-F246 PolarHBondContact O-N 3.38Å; I244-M247 PolarHBondContact O-N 2.83Å; I244-M247 VanDerWaalsContact O-N 3.1Å; I244-H248 PolarHBondContact O-N 3.24Å; I244-F251 HydrophobicContact CG2-CD1 3.63Å; I244-F251 HydrophobicContact CG2-CE1 3.93Å; I244-F251 HydrophobicContact CG2-CG 4.15Å
245	K	84.6	Confident	81.7	Confident	114 Å²	114	68 Å²	68	50%	0.496	34%	0.342	S	S	.	.	H	α-helix	trans	-59.7	-36.7	177.7	-178.3	-178.1	176.1	-173.5	0	112	L241 V243 H248 P249	L241-K245 WeakPolarHBondContact O-CB 3.32Å; L241-K245 PolarHBondContact O-N 3.03Å; V243-K245 VanDerWaalsContact C-N 3.35Å; V243-K245 PolarHBondContact O-N 3.18Å; K245-H248 CarbonylContact O-C 3.46Å; K245-P249 WeakPolarHBondContact O-CA 3.29Å
246	F	83.3	Confident	81.1	Confident	182 Å²	182	61.2 Å²	61.2	80%	0.798	32%	0.317	S	S	*	.	H	α-helix	trans	-64.5	-41.8	175.3	176.8	-97.1	0	0	0	111.8	D242 V243 I244	D242-F246 PolarHBondContact O-N 3.35Å; V243-F246 WeakPolarHBondContact O-CB 3.31Å; V243-F246 PolarHBondContact O-N 2.98Å; I244-F246 PolarHBondContact O-N 3.38Å
247	M	81.3	Confident	80.7	Confident	55 Å²	55	61.6 Å²	61.6	27%	0.271	32%	0.318	S	S	.	.	H	α-helix	trans	-74.8	-33.4	177.5	-69	-177.1	58.1	0	0	113.6	L87 V91 V243 I244	L87-M247 HydrophobicContact CD2-SD 4.06Å; V91-M247 HydrophobicContact CG2-CE 4.01Å; V243-M247 PolarHBondContact O-N 3.37Å; I244-M247 PolarHBondContact O-N 2.83Å; I244-M247 VanDerWaalsContact O-N 3.1Å
248	H	81.4	Confident	80.3	Confident	31 Å²	31	67.9 Å²	67.9	14%	0.144	35%	0.345	C	S	.	.			trans	-130	80.4	-174.1	-62.4	-74.9	0	0	0	110.1	S90 I244 K245 S250 F251	S90-H248 PolarHBondContact O-CE1 2.96Å; S90-H248 PolarHBondContact O-NE2 3.23Å; I244-H248 PolarHBondContact O-N 3.24Å; K245-H248 CarbonylContact O-C 3.46Å; H248-S250 PolarHBondContact O-N 2.82Å; H248-S250 VanDerWaalsContact O-N 3.13Å; H248-F251 HydrophobicContact CB-CB 3.9Å; H248-F251 WeakPolarHBondContact O-CB 3.49Å; H248-F251 PolarHBondContact O-N 3.12Å
249	P	77.1	Confident	79.7	Confident	108 Å²	108	68.2 Å²	68.2	70%	0.701	35%	0.347	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.4	-24.9	-173.9	-26.7	35.9	0	0	0	115	K245 F251	K245-P249 WeakPolarHBondContact O-CA 3.29Å; P249-F251 PolarHBondContact O-N 3.39Å
250	S	69.8	Low	79.2	Confident	119 Å²	119	66 Å²	66	83%	0.832	34%	0.336	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.7	-11.1	174.4	52.1	0	0	0	0	113.5	H248 G252	H248-S250 PolarHBondContact O-N 2.82Å; H248-S250 VanDerWaalsContact O-N 3.13Å; S250-G252 PolarHBondContact O-N 2.88Å
251	F	70	Confident	79.1	Confident	78 Å²	78	68.5 Å²	68.5	34%	0.342	35%	0.346	S	S	.	.			trans	-78	106.4	-177.3	-169.3	-105.1	0	0	0	111.6	L241 I244 H248 P249 F253	L241-F251 HydrophobicContact CD2-CE1 4.03Å; I244-F251 HydrophobicContact CG2-CD1 3.63Å; I244-F251 HydrophobicContact CG2-CE1 3.93Å; I244-F251 HydrophobicContact CG2-CG 4.15Å; H248-F251 HydrophobicContact CB-CB 3.9Å; H248-F251 WeakPolarHBondContact O-CB 3.49Å; H248-F251 PolarHBondContact O-N 3.12Å; P249-F251 PolarHBondContact O-N 3.39Å; F251-F253 HydrophobicContact CD1-CB 4.33Å; F251-F253 HydrophobicContact CD1-CD2 4.27Å; F251-F253 AromaticContact CD2-CD2 3.64Å; F251-F253 HydrophobicContact CD2-CD2 3.64Å; F251-F253 HydrophobicContact CD2-CE2 4.03Å; F251-F253 HydrophobicContact CE1-CB 3.65Å; F251-F253 AromaticContact CE1-CD2 3.89Å; F251-F253 HydrophobicContact CE1-CD2 3.89Å; F251-F253 HydrophobicContact CE1-CG 4.09Å; F251-F253 HydrophobicContact CE2-CB 4.45Å; F251-F253 AromaticContact CE2-CD2 3.18Å; F251-F253 HydrophobicContact CE2-CD2 3.18Å; F251-F253 AromaticContact CE2-CE2 3.56Å; F251-F253 HydrophobicContact CE2-CE2 3.56Å; F251-F253 AromaticContact CE2-CG 4Å; F251-F253 HydrophobicContact CE2-CG 4Å; F251-F253 HydrophobicContact CG-CD2 4.16Å; F251-F253 HydrophobicContact CZ-CB 3.71Å; F251-F253 AromaticContact CZ-CD2 3.32Å; F251-F253 HydrophobicContact CZ-CD2 3.32Å; F251-F253 HydrophobicContact CZ-CE2 4.1Å; F251-F253 AromaticContact CZ-CG 3.65Å; F251-F253 HydrophobicContact CZ-CG 3.65Å
252	G	65.4	Low	78.9	Confident	40 Å²	40	68.7 Å²	68.7	41%	0.412	36%	0.356	S	S	.	.			trans	-106.6	38.9	-171.1	0	0	0	0	0	116	S250 W255	S250-G252 PolarHBondContact O-N 2.88Å; G252-W255 PolarHBondContact O-NE1 3.47Å
253	F	71.8	Confident	78.6	Confident	49 Å²	49	66.6 Å²	66.6	22%	0.215	35%	0.346	C	S	.	.			trans	-95.6	0	-173.2	-78.6	-98.3	0	0	0	116	L151 F251 W255 V256 L257	L151-F253 HydrophobicContact CD2-CE1 3.98Å; L151-F253 HydrophobicContact CD2-CZ 4.28Å; F251-F253 HydrophobicContact CD1-CB 4.33Å; F251-F253 HydrophobicContact CD1-CD2 4.27Å; F251-F253 AromaticContact CD2-CD2 3.64Å; F251-F253 HydrophobicContact CD2-CD2 3.64Å; F251-F253 HydrophobicContact CD2-CE2 4.03Å; F251-F253 HydrophobicContact CE1-CB 3.65Å; F251-F253 AromaticContact CE1-CD2 3.89Å; F251-F253 HydrophobicContact CE1-CD2 3.89Å; F251-F253 HydrophobicContact CE1-CG 4.09Å; F251-F253 HydrophobicContact CE2-CB 4.45Å; F251-F253 AromaticContact CE2-CD2 3.18Å; F251-F253 HydrophobicContact CE2-CD2 3.18Å; F251-F253 AromaticContact CE2-CE2 3.56Å; F251-F253 HydrophobicContact CE2-CE2 3.56Å; F251-F253 AromaticContact CE2-CG 4Å; F251-F253 HydrophobicContact CE2-CG 4Å; F251-F253 HydrophobicContact CG-CD2 4.16Å; F251-F253 HydrophobicContact CZ-CB 3.71Å; F251-F253 AromaticContact CZ-CD2 3.32Å; F251-F253 HydrophobicContact CZ-CD2 3.32Å; F251-F253 HydrophobicContact CZ-CE2 4.1Å; F251-F253 AromaticContact CZ-CG 3.65Å; F251-F253 HydrophobicContact CZ-CG 3.65Å; F253-W255 PolarHBondContact O-N 2.93Å; F253-W255 VanDerWaalsContact O-N 3.17Å; F253-V256 HydrophobicContact CD1-CB 4.32Å; F253-V256 HydrophobicContact CD1-CG2 3.83Å; F253-V256 WeakPolarHBondContact O-CB 3.23Å; F253-V256 PolarHBondContact O-N 3.47Å; F253-L257 PolarHBondContact O-N 2.66Å
254	R	76	Confident	78.5	Confident	133 Å²	133	64.1 Å²	64.1	50%	0.502	33%	0.33	S	S	.	.	H	α-helix	trans	-56.9	-35.8	-178.8	-171.1	177.9	-168.9	144.6	19	113.1	D242 V256 L257 K258	D242-R254 IonicContact OD1-CZ 3.48Å; D242-R254 IonicContact OD1-NE 3.23Å; D242-R254 IonicContact OD1-NH1 3.82Å; D242-R254 PolarHBondContact OD1-NH1 3.45Å; D242-R254 IonicContact OD1-NH2 2.59Å; D242-R254 PolarHBondContact OD1-NH2 3.02Å; D242-R254 VanDerWaalsContact OD1-NH2 3.15Å; D242-R254 IonicContact OD2-CZ 2.69Å; D242-R254 IonicContact OD2-NH1 3.2Å; D242-R254 IonicContact OD2-NH2 3.1Å; D242-R254 PolarHBondContact OD2-NH2 3.44Å; R254-V256 VanDerWaalsContact C-N 3.31Å; R254-L257 PolarHBondContact O-N 2.64Å; R254-K258 PolarHBondContact O-N 3.22Å; R254-K258 VanDerWaalsContact O-N 3.14Å
255	W	76.5	Confident	78.5	Confident	46 Å²	46	65.3 Å²	65.3	17%	0.174	34%	0.343	C	S	.	.	H	α-helix	trans	-66.8	-34.1	177.3	68.1	-93.1	0	0	0	111.9	L150 G252 F253 K258 D259 L470	L150-W255 HydrophobicContact CD1-CH2 4.23Å; G252-W255 PolarHBondContact O-NE1 3.47Å; F253-W255 PolarHBondContact O-N 2.93Å; F253-W255 VanDerWaalsContact O-N 3.17Å; W255-K258 WeakPolarHBondContact O-CB 3.21Å; W255-K258 PolarHBondContact O-N 3.19Å; W255-D259 PolarHBondContact O-N 3.17Å; W255-L470 HydrophobicContact CH2-CD1 4.31Å; W255-L470 HydrophobicContact CZ3-CD1 3.75Å
256	V	76.3	Confident	78.6	Confident	3 Å²	3	62.5 Å²	62.5	2%	0.018	33%	0.332	C	S	.	.	H	α-helix	trans	-64	-44.1	176.7	-177.3	0	0	0	0	110.2	L144 F147 F253 R254 K258 D259 L260	L144-V256 HydrophobicContact CD2-CG1 4.11Å; F147-V256 HydrophobicContact CD2-CG1 4.17Å; F147-V256 HydrophobicContact CE2-CG1 3.91Å; F147-V256 HydrophobicContact CZ-CG1 4.28Å; F253-V256 HydrophobicContact CD1-CB 4.32Å; F253-V256 HydrophobicContact CD1-CG2 3.83Å; F253-V256 WeakPolarHBondContact O-CB 3.23Å; F253-V256 PolarHBondContact O-N 3.47Å; R254-V256 VanDerWaalsContact C-N 3.31Å; V256-K258 VanDerWaalsContact C-N 3.31Å; V256-K258 PolarHBondContact O-N 2.73Å; V256-D259 PolarHBondContact O-N 2.86Å; V256-L260 HydrophobicContact CG1-CD1 3.97Å; V256-L260 HydrophobicContact CG1-CG 4.27Å; V256-L260 WeakPolarHBondContact O-CB 3.06Å; V256-L260 VanDerWaalsContact O-CG 3.31Å; V256-L260 WeakPolarHBondContact O-CG 3.46Å; V256-L260 PolarHBondContact O-N 3.45Å
257	L	80.1	Confident	78.7	Confident	19 Å²	19	54.7 Å²	54.7	10%	0.099	30%	0.298	C	S	.	.	H	α-helix	trans	-62.9	-39.1	175.4	-178.3	66.1	0	0	0	111.8	L140 L237 E238 L241 F253 R254 D259 L260 K261	L140-L257 HydrophobicContact CD2-CD1 4.45Å; L237-L257 HydrophobicContact CB-CD1 4.33Å; L237-L257 HydrophobicContact CB-CD2 3.94Å; L237-L257 HydrophobicContact CD1-CD1 4.34Å; E238-L257 HydrophobicContact CG-CD2 4.04Å; L241-L257 HydrophobicContact CD1-CB 3.58Å; L241-L257 HydrophobicContact CD1-CD2 3.41Å; L241-L257 VanDerWaalsContact CD1-CD2 3.41Å; L241-L257 HydrophobicContact CD1-CG 4.07Å; L241-L257 HydrophobicContact CG-CD2 4.29Å; F253-L257 PolarHBondContact O-N 2.66Å; R254-L257 PolarHBondContact O-N 2.64Å; L257-D259 VanDerWaalsContact C-N 3.34Å; L257-L260 PolarHBondContact O-N 3.19Å; L257-K261 VanDerWaalsContact O-CB 3.26Å; L257-K261 WeakPolarHBondContact O-CB 3.41Å; L257-K261 PolarHBondContact O-N 2.88Å
258	K	81.4	Confident	79.1	Confident	159 Å²	159	52.5 Å²	52.5	69%	0.691	29%	0.287	S	S	*	.	H	α-helix	trans	-61.4	-45	176.9	-173.7	-176.7	176.6	-174.8	0	111.2	R254 W255 V256 K261 G262	R254-K258 PolarHBondContact O-N 3.22Å; R254-K258 VanDerWaalsContact O-N 3.14Å; W255-K258 WeakPolarHBondContact O-CB 3.21Å; W255-K258 PolarHBondContact O-N 3.19Å; V256-K258 VanDerWaalsContact C-N 3.31Å; V256-K258 PolarHBondContact O-N 2.73Å; K258-K261 PolarHBondContact O-N 2.86Å; K258-G262 PolarHBondContact O-N 3.38Å
259	D	77.1	Confident	79.6	Confident	47 Å²	47	52.9 Å²	52.9	25%	0.251	29%	0.29	S	S	.	.	H	α-helix	trans	-66.7	-46.8	179	-66.9	-6.7	0	0	0	110.2	W255 V256 L257 K261 G262 T263 R467	W255-D259 PolarHBondContact O-N 3.17Å; V256-D259 PolarHBondContact O-N 2.86Å; L257-D259 VanDerWaalsContact C-N 3.34Å; D259-K261 VanDerWaalsContact C-N 3.32Å; D259-K261 PolarHBondContact O-N 2.82Å; D259-G262 PolarHBondContact O-N 3.47Å; D259-G262 VanDerWaalsContact O-N 3.13Å; D259-T263 PolarHBondContact O-N 2.86Å; D259-T263 PolarHBondContact O-OG1 2.96Å; D259-R467 IonicContact OD1-NH1 3.04Å; D259-R467 IonicContact OD2-CZ 3.99Å; D259-R467 IonicContact OD2-NH1 2.87Å; D259-R467 PolarHBondContact OD2-NH1 3.13Å
260	L	79.4	Confident	80.5	Confident	13 Å²	13	47.9 Å²	47.9	7%	0.068	26%	0.257	C	S	.	.	H	α-helix	trans	-60.2	-36.8	175.4	-74.6	176.6	0	0	0	113.3	L140 L144 F147 V256 L257 G262 T263 L264	L140-L260 HydrophobicContact CD2-CB 3.71Å; L140-L260 HydrophobicContact CD2-CD1 4.04Å; L140-L260 HydrophobicContact CD2-CG 4.41Å; L144-L260 HydrophobicContact CD2-CD1 4Å; L144-L260 HydrophobicContact CG-CD1 4.19Å; F147-L260 HydrophobicContact CE2-CD2 3.94Å; F147-L260 HydrophobicContact CE2-CG 4.24Å; V256-L260 HydrophobicContact CG1-CD1 3.97Å; V256-L260 HydrophobicContact CG1-CG 4.27Å; V256-L260 WeakPolarHBondContact O-CB 3.06Å; V256-L260 VanDerWaalsContact O-CG 3.31Å; V256-L260 WeakPolarHBondContact O-CG 3.46Å; V256-L260 PolarHBondContact O-N 3.45Å; L257-L260 PolarHBondContact O-N 3.19Å; L260-G262 VanDerWaalsContact C-N 3.34Å; L260-T263 PolarHBondContact O-N 2.84Å; L260-L264 VanDerWaalsContact O-CB 3.25Å; L260-L264 WeakPolarHBondContact O-CB 3.31Å; L260-L264 PolarHBondContact O-N 3.42Å
261	K	84.5	Confident	81.8	Confident	71 Å²	71	44.5 Å²	44.5	31%	0.309	23%	0.229	S	C	.	.	H	α-helix	trans	-61.9	-43.2	175.2	178.2	-175.3	-174.7	169	0	111.1	F230 I234 E238 L257 K258 D259 L264 A265	F230-K261 HydrophobicContact CZ-CG 4.34Å; I234-K261 HydrophobicContact CD1-CG 4.47Å; I234-K261 HydrophobicContact CG2-CD 3.69Å; I234-K261 HydrophobicContact CG2-CG 4.07Å; E238-K261 IonicContact OE1-NZ 2.87Å; E238-K261 PolarHBondContact OE1-NZ 3.18Å; L257-K261 VanDerWaalsContact O-CB 3.26Å; L257-K261 WeakPolarHBondContact O-CB 3.41Å; L257-K261 PolarHBondContact O-N 2.88Å; K258-K261 PolarHBondContact O-N 2.86Å; D259-K261 VanDerWaalsContact C-N 3.32Å; D259-K261 PolarHBondContact O-N 2.82Å; K261-L264 PolarHBondContact O-N 2.83Å; K261-A265 WeakPolarHBondContact O-CB 3.16Å; K261-A265 PolarHBondContact O-N 3.47Å
262	G	82.4	Confident	83	Confident	35 Å²	35	43.1 Å²	43.1	36%	0.361	23%	0.225	S	C	.	.	H	α-helix	trans	-62.3	-50.4	176.5	0	0	0	0	0	111.6	K258 D259 L260 L264 A265 Q266	K258-G262 PolarHBondContact O-N 3.38Å; D259-G262 PolarHBondContact O-N 3.47Å; D259-G262 VanDerWaalsContact O-N 3.13Å; L260-G262 VanDerWaalsContact C-N 3.34Å; G262-L264 VanDerWaalsContact C-N 3.35Å; G262-L264 PolarHBondContact O-N 3.1Å; G262-A265 PolarHBondContact O-N 3.47Å; G262-Q266 WeakPolarHBondContact O-CG 3.45Å; G262-Q266 PolarHBondContact O-N 3.27Å; G262-Q266 VanDerWaalsContact O-N 3.12Å
263	T	81.1	Confident	84.5	Confident	21 Å²	21	41.3 Å²	41.3	13%	0.129	21%	0.206	C	C	.	.	H	α-helix	trans	-54.7	-48	174.4	-63.5	0	0	0	0	112	D259 L260 A265 Q266 E267 L377	D259-T263 PolarHBondContact O-N 2.86Å; D259-T263 PolarHBondContact O-OG1 2.96Å; L260-T263 PolarHBondContact O-N 2.84Å; T263-A265 VanDerWaalsContact C-N 3.34Å; T263-A265 PolarHBondContact O-N 3.43Å; T263-Q266 WeakPolarHBondContact O-CB 3.46Å; T263-Q266 PolarHBondContact O-N 3.43Å; T263-E267 PolarHBondContact O-N 3.11Å; T263-E267 VanDerWaalsContact O-N 3.09Å; T263-L377 HydrophobicContact CG2-CD1 3.33Å; T263-L377 HydrophobicContact CG2-CD2 3.58Å; T263-L377 HydrophobicContact CG2-CG 4.05Å
264	L	83.3	Confident	85.7	Confident	3 Å²	3	39 Å²	39	2%	0.016	20%	0.195	C	C	.	.	H	α-helix	trans	-68.1	-34.3	-177.9	-172.1	60	0	0	0	112.8	I136 K139 L140 L203 F230 L260 K261 G262 Q266 E267 L268	I136-L264 HydrophobicContact CB-CD2 4.21Å; I136-L264 HydrophobicContact CG1-CD2 4.08Å; I136-L264 HydrophobicContact CG2-CD2 3.55Å; K139-L264 HydrophobicContact CB-CD1 4.07Å; K139-L264 HydrophobicContact CG-CD1 3.45Å; K139-L264 VanDerWaalsContact CG-CD1 3.45Å; L140-L264 HydrophobicContact CD2-CD2 4.4Å; L140-L264 HydrophobicContact CG-CD2 4.38Å; L203-L264 HydrophobicContact CD1-CD1 3.83Å; L203-L264 HydrophobicContact CD2-CD1 4.27Å; F230-L264 HydrophobicContact CD2-CD2 4.18Å; F230-L264 HydrophobicContact CD2-CG 4.36Å; F230-L264 HydrophobicContact CE2-CB 4.12Å; F230-L264 HydrophobicContact CE2-CD2 3.63Å; F230-L264 HydrophobicContact CE2-CG 3.67Å; L260-L264 VanDerWaalsContact O-CB 3.25Å; L260-L264 WeakPolarHBondContact O-CB 3.31Å; L260-L264 PolarHBondContact O-N 3.42Å; K261-L264 PolarHBondContact O-N 2.83Å; G262-L264 VanDerWaalsContact C-N 3.35Å; G262-L264 PolarHBondContact O-N 3.1Å; L264-Q266 VanDerWaalsContact C-N 3.32Å; L264-E267 PolarHBondContact O-N 3.08Å; L264-L268 WeakPolarHBondContact O-CG 3.48Å; L264-L268 PolarHBondContact O-N 3.38Å; L264-L268 VanDerWaalsContact O-N 3.15Å
265	A	85.9	Confident	86.7	Confident	46 Å²	46	39.4 Å²	39.4	38%	0.38	20%	0.197	S	C	.	.	H	α-helix	trans	-64.5	-38.1	174	0	0	0	0	0	111.7	F230 K261 G262 T263 L268	F230-A265 HydrophobicContact CZ-CB 4.18Å; K261-A265 WeakPolarHBondContact O-CB 3.16Å; K261-A265 PolarHBondContact O-N 3.47Å; G262-A265 PolarHBondContact O-N 3.47Å; T263-A265 VanDerWaalsContact C-N 3.34Å; T263-A265 PolarHBondContact O-N 3.43Å; A265-L268 PolarHBondContact O-N 2.67Å
266	Q	87.1	Confident	87.7	Confident	54 Å²	54	38 Å²	38	25%	0.252	19%	0.193	S	C	.	.	H	α-helix	trans	-64.1	-43.5	174	-65.6	175.3	22.5	0	0	111.6	G262 T263 L264 L268 D269	G262-Q266 WeakPolarHBondContact O-CG 3.45Å; G262-Q266 PolarHBondContact O-N 3.27Å; G262-Q266 VanDerWaalsContact O-N 3.12Å; T263-Q266 WeakPolarHBondContact O-CB 3.46Å; T263-Q266 PolarHBondContact O-N 3.43Å; L264-Q266 VanDerWaalsContact C-N 3.32Å; Q266-L268 PolarHBondContact O-N 3.23Å; Q266-D269 PolarHBondContact O-N 3.15Å; Q266-D269 VanDerWaalsContact O-N 3.11Å
267	E	85.8	Confident	88.7	Confident	18 Å²	18	38.2 Å²	38.2	8%	0.084	20%	0.195	C	C	.	.	H	α-helix	trans	-67.4	-21.9	178.9	-71	-169.2	-162.7	0	0	114.2	K139 L203 T263 L264 D269	K139-E267 WeakPolarHBondContact CD-OE2 3.4Å; K139-E267 VanDerWaalsContact CE-CD 3.43Å; K139-E267 WeakPolarHBondContact CE-OE1 3.38Å; K139-E267 WeakPolarHBondContact CE-OE2 3.42Å; K139-E267 IonicContact NZ-OE1 3.65Å; K139-E267 PolarHBondContact NZ-OE1 2.97Å; K139-E267 IonicContact NZ-OE2 2.77Å; K139-E267 PolarHBondContact NZ-OE2 3.08Å; L203-E267 HydrophobicContact CD1-CB 3.88Å; L203-E267 VanDerWaalsContact CD1-OE2 3.31Å; L203-E267 WeakPolarHBondContact CD1-OE2 3.23Å; T263-E267 PolarHBondContact O-N 3.11Å; T263-E267 VanDerWaalsContact O-N 3.09Å; L264-E267 PolarHBondContact O-N 3.08Å; E267-D269 VanDerWaalsContact C-N 3.32Å
268	L	88.1	Confident	89.5	Confident	10 Å²	10	41.4 Å²	41.4	5%	0.052	21%	0.209	C	C	.	.	T	Hydrogen-bonded Turn	trans	-86.8	-0.4	175.1	-71.7	174.7	0	0	0	113.2	L203 Q222 L226 F230 L264 A265 Q266	L203-L268 HydrophobicContact CD1-CD2 4.17Å; L203-L268 HydrophobicContact CD2-CD2 4.32Å; Q222-L268 VanDerWaalsContact NE2-C 3.27Å; Q222-L268 PolarHBondContact NE2-O 3.18Å; L226-L268 HydrophobicContact CB-CD2 4.38Å; F230-L268 HydrophobicContact CB-CD1 4.32Å; F230-L268 HydrophobicContact CD2-CD1 3.32Å; F230-L268 HydrophobicContact CE2-CD1 3.78Å; F230-L268 HydrophobicContact CG-CD1 3.94Å; L264-L268 WeakPolarHBondContact O-CG 3.48Å; L264-L268 PolarHBondContact O-N 3.38Å; L264-L268 VanDerWaalsContact O-N 3.15Å; A265-L268 PolarHBondContact O-N 2.67Å; Q266-L268 PolarHBondContact O-N 3.23Å
269	D	92.9	Very high	90.3	Very high	38 Å²	38	38.7 Å²	38.7	20%	0.203	19%	0.194	C	C	.	.			trans	-112.3	95.9	175.1	-162.1	-30.6	0	0	0	110.6	Q266 E267 E271 N272 E273	Q266-D269 PolarHBondContact O-N 3.15Å; Q266-D269 VanDerWaalsContact O-N 3.11Å; E267-D269 VanDerWaalsContact C-N 3.32Å; D269-E271 VanDerWaalsContact C-N 3.27Å; D269-E271 PolarHBondContact O-N 3Å; D269-E271 WeakPolarHBondContact OD1-CB 3.36Å; D269-E271 PolarHBondContact OD1-N 3.32Å; D269-N272 HydrophobicContact CB-CB 4Å; D269-N272 VanDerWaalsContact O-CB 3.3Å; D269-N272 WeakPolarHBondContact O-CB 3.5Å; D269-N272 PolarHBondContact O-N 3.41Å; D269-N272 VanDerWaalsContact O-N 3.08Å; D269-N272 PolarHBondContact OD1-N 3.08Å; D269-E273 PolarHBondContact O-N 2.93Å; D269-E273 VanDerWaalsContact O-N 3.12Å
270	F	95.8	Very high	91.3	Very high	3 Å²	3	36.5 Å²	36.5	1%	0.013	18%	0.182	C	C	.	.	H	α-helix	trans	-71.7	-17.7	-178.4	-79.5	-1.7	0	0	0	114.5	A204 K220 Q222 N272 E273 A274 S301 K302 L305	A204-F270 HydrophobicContact CB-CE2 4.24Å; A204-F270 HydrophobicContact CB-CZ 3.7Å; K220-F270 HydrophobicContact CB-CE2 4.26Å; K220-F270 HydrophobicContact CD-CE1 4.03Å; K220-F270 HydrophobicContact CD-CE2 3.96Å; K220-F270 HydrophobicContact CD-CZ 3.58Å; K220-F270 HydrophobicContact CG-CE2 3.72Å; K220-F270 HydrophobicContact CG-CZ 3.68Å; K220-F270 WeakPolarHBondContact O-CE2 3.38Å; Q222-F270 HydrophobicContact CB-CE2 4.46Å; Q222-F270 HydrophobicContact CG-CD2 3.93Å; Q222-F270 HydrophobicContact CG-CE1 4.08Å; Q222-F270 HydrophobicContact CG-CE2 3.35Å; Q222-F270 HydrophobicContact CG-CZ 3.43Å; Q222-F270 VanDerWaalsContact CG-CZ 3.43Å; F270-N272 VanDerWaalsContact C-N 3.33Å; F270-E273 WeakPolarHBondContact CD1-OE2 3.46Å; F270-E273 WeakPolarHBondContact CE1-OE2 2.98Å; F270-A274 WeakPolarHBondContact O-CB 3.39Å; F270-A274 PolarHBondContact O-N 3.35Å; F270-S301 WeakPolarHBondContact CB-O 3.32Å; F270-K302 PolarHBondContact N-O 3.19Å; F270-K302 VanDerWaalsContact N-O 3.13Å; F270-L305 HydrophobicContact CB-CB 3.98Å; F270-L305 HydrophobicContact CD2-CB 3.83Å; F270-L305 HydrophobicContact CG-CB 4Å
271	E	96.4	Very high	92.1	Very high	49 Å²	49	37.8 Å²	37.8	23%	0.229	20%	0.195	C	C	.	.	H	α-helix	trans	-70.7	-36.2	168.3	-64.4	172	-176.5	0	0	110.4	D269 A274 R275 W297 K302	D269-E271 VanDerWaalsContact C-N 3.27Å; D269-E271 PolarHBondContact O-N 3Å; D269-E271 WeakPolarHBondContact OD1-CB 3.36Å; D269-E271 PolarHBondContact OD1-N 3.32Å; E271-A274 PolarHBondContact O-N 3.2Å; E271-R275 WeakPolarHBondContact O-CG 3.12Å; E271-R275 PolarHBondContact O-N 3.1Å; E271-R275 IonicContact OE2-NH2 2.69Å; E271-W297 HydrophobicContact CB-CZ3 4.23Å; E271-W297 HydrophobicContact CG-CZ3 4.35Å; E271-K302 VanDerWaalsContact CD-CG 3.44Å; E271-K302 HydrophobicContact CG-CG 4.03Å; E271-K302 WeakPolarHBondContact OE1-CG 3.41Å; E271-K302 PolarHBondContact OE1-N 3.36Å; E271-K302 WeakPolarHBondContact OE2-CE 3.22Å
272	N	95.8	Very high	92.7	Very high	48 Å²	48	39.6 Å²	39.6	26%	0.257	21%	0.205	S	C	.	.	H	α-helix	trans	-66.1	-44.4	174	-174.3	69	0	0	0	111.1	D269 F270 A274 R275 N276	D269-N272 HydrophobicContact CB-CB 4Å; D269-N272 VanDerWaalsContact O-CB 3.3Å; D269-N272 WeakPolarHBondContact O-CB 3.5Å; D269-N272 PolarHBondContact O-N 3.41Å; D269-N272 VanDerWaalsContact O-N 3.08Å; D269-N272 PolarHBondContact OD1-N 3.08Å; F270-N272 VanDerWaalsContact C-N 3.33Å; N272-A274 VanDerWaalsContact C-N 3.34Å; N272-A274 PolarHBondContact O-N 3.1Å; N272-R275 PolarHBondContact O-N 2.87Å; N272-N276 PolarHBondContact ND2-ND2 3.27Å; N272-N276 WeakPolarHBondContact O-CB 3.22Å; N272-N276 PolarHBondContact O-N 3.33Å; N272-N276 PolarHBondContact O-ND2 3.18Å
273	E	96	Very high	93.3	Very high	3 Å²	3	40 Å²	40	1%	0.014	20%	0.197	C	C	.	.	H	α-helix	trans	-57.3	-44.4	173.7	179.4	167.6	176.7	0	0	112.1	K220 D269 F270 N276 S277 L305 H375	K220-E273 IonicContact NZ-OE1 3.17Å; K220-E273 PolarHBondContact NZ-OE1 3.25Å; K220-E273 IonicContact NZ-OE2 3.64Å; K220-E273 PolarHBondContact NZ-OE2 3.07Å; D269-E273 PolarHBondContact O-N 2.93Å; D269-E273 VanDerWaalsContact O-N 3.12Å; F270-E273 WeakPolarHBondContact CD1-OE2 3.46Å; F270-E273 WeakPolarHBondContact CE1-OE2 2.98Å; E273-N276 WeakPolarHBondContact O-CB 3.13Å; E273-N276 PolarHBondContact O-N 2.79Å; E273-S277 PolarHBondContact O-N 3.3Å; E273-L305 HydrophobicContact CB-CD2 4.38Å; E273-L305 HydrophobicContact CG-CD2 3.73Å; E273-H375 HydrophobicContact CG-CB 4.05Å; E273-H375 PolarHBondContact OE1-N 3.06Å
274	A	97.6	Very high	94	Very high	0 Å²	0	39.1 Å²	39.1	0%	0	19%	0.192	C	C	.	.	H	α-helix	trans	-61	-44.4	175	0	0	0	0	0	113.5	F270 E271 N272 N276 S277 E278 V295 W297 T300 L305	F270-A274 WeakPolarHBondContact O-CB 3.39Å; F270-A274 PolarHBondContact O-N 3.35Å; E271-A274 PolarHBondContact O-N 3.2Å; N272-A274 VanDerWaalsContact C-N 3.34Å; N272-A274 PolarHBondContact O-N 3.1Å; A274-N276 VanDerWaalsContact C-N 3.3Å; A274-N276 PolarHBondContact O-N 2.98Å; A274-S277 PolarHBondContact O-N 3.17Å; A274-S277 PolarHBondContact O-OG 3.07Å; A274-E278 PolarHBondContact O-N 3.4Å; A274-E278 VanDerWaalsContact O-N 3.14Å; A274-V295 HydrophobicContact CB-CB 4.49Å; A274-V295 HydrophobicContact CB-CG1 3.78Å; A274-V295 HydrophobicContact CB-CG2 4Å; A274-W297 HydrophobicContact CB-CH2 3.29Å; A274-W297 HydrophobicContact CB-CZ2 3.6Å; A274-W297 HydrophobicContact CB-CZ3 3.9Å; A274-T300 HydrophobicContact CB-CG2 4.37Å; A274-L305 HydrophobicContact CB-CD1 3.74Å
275	R	97.8	Very high	94.6	Very high	141 Å²	141	44.7 Å²	44.7	53%	0.532	22%	0.216	S	C	.	.	H	α-helix	trans	-65.3	-36.7	176.1	-68.8	178.5	-162.4	140.3	10.3	111.7	E271 N272 R279 W297	E271-R275 WeakPolarHBondContact O-CG 3.12Å; E271-R275 PolarHBondContact O-N 3.1Å; E271-R275 IonicContact OE2-NH2 2.69Å; N272-R275 PolarHBondContact O-N 2.87Å; R275-R279 WeakPolarHBondContact O-CB 3.41Å; R275-R279 PolarHBondContact O-N 3.46Å; R275-W297 HydrophobicContact CG-CH2 3.74Å; R275-W297 HydrophobicContact CG-CZ2 4.01Å
276	N	97.3	Very high	94.9	Very high	17 Å²	17	46.2 Å²	46.2	9%	0.091	22%	0.215	C	C	.	.	H	α-helix	trans	-64.6	-40.8	176.3	-70	-20.5	0	0	0	111.6	N272 E273 A274 C280 F348 H375 Y378	N272-N276 PolarHBondContact ND2-ND2 3.27Å; N272-N276 WeakPolarHBondContact O-CB 3.22Å; N272-N276 PolarHBondContact O-N 3.33Å; N272-N276 PolarHBondContact O-ND2 3.18Å; E273-N276 WeakPolarHBondContact O-CB 3.13Å; E273-N276 PolarHBondContact O-N 2.79Å; A274-N276 VanDerWaalsContact C-N 3.3Å; A274-N276 PolarHBondContact O-N 2.98Å; N276-C280 VanDerWaalsContact O-CB 3.23Å; N276-C280 WeakPolarHBondContact O-CB 3.42Å; N276-C280 PolarHBondContact O-N 3.09Å; N276-F348 HydrophobicContact CB-CZ 4Å; N276-H375 HydrophobicContact CB-CB 4.04Å; N276-H375 WeakPolarHBondContact CB-O 3.22Å; N276-H375 PolarHBondContact ND2-O 2.79Å; N276-Y378 HydrophobicContact CB-CD2 3.84Å; N276-Y378 HydrophobicContact CB-CE2 4.15Å; N276-Y378 HydrophobicContact CB-CG 4.41Å
277	S	97.1	Very high	95.3	Very high	8 Å²	8	45 Å²	45	6%	0.056	21%	0.209	C	C	.	.	H	α-helix	trans	-65.1	-47	178.5	72.5	0	0	0	0	111.4	E273 A274 R279 C280 A281 V292 V295 H375	E273-S277 PolarHBondContact O-N 3.3Å; A274-S277 PolarHBondContact O-N 3.17Å; A274-S277 PolarHBondContact O-OG 3.07Å; S277-R279 PolarHBondContact O-N 2.76Å; S277-C280 WeakPolarHBondContact O-CB 3.32Å; S277-C280 PolarHBondContact O-N 3.11Å; S277-A281 WeakPolarHBondContact O-CB 3.32Å; S277-A281 PolarHBondContact O-N 3.47Å; S277-V292 WeakPolarHBondContact O-CG1 3.28Å; S277-V295 VanDerWaalsContact OG-CG2 3.23Å; S277-V295 WeakPolarHBondContact OG-CG2 3.25Å; S277-H375 WeakPolarHBondContact CB-CD2 3.32Å
278	E	97.8	Very high	95.8	Very high	85 Å²	85	52.1 Å²	52.1	40%	0.397	24%	0.239	S	C	.	.	H	α-helix	trans	-61.3	-43.1	177.1	-70.2	-177.5	150.4	0	0	112.1	A274 A281 E282 V295 W297	A274-E278 PolarHBondContact O-N 3.4Å; A274-E278 VanDerWaalsContact O-N 3.14Å; E278-A281 WeakPolarHBondContact O-CB 3.3Å; E278-A281 PolarHBondContact O-N 3.15Å; E278-E282 PolarHBondContact O-N 3.48Å; E278-V295 HydrophobicContact CG-CG2 4.31Å; E278-W297 PolarHBondContact OE1-NE1 3.46Å; E278-W297 PolarHBondContact OE2-NE1 3.3Å
279	R	97.5	Very high	96.2	Very high	103 Å²	103	53.3 Å²	53.3	39%	0.389	24%	0.244	S	C	.	.	H	α-helix	trans	-62.1	-44.3	174.5	179.7	175.9	174.5	178.8	-1.9	111.8	R275 S277 A281 E282 E283 F348	R275-R279 WeakPolarHBondContact O-CB 3.41Å; R275-R279 PolarHBondContact O-N 3.46Å; S277-R279 PolarHBondContact O-N 2.76Å; R279-A281 VanDerWaalsContact C-N 3.31Å; R279-A281 PolarHBondContact O-N 2.89Å; R279-E282 PolarHBondContact O-N 2.93Å; R279-E283 HydrophobicContact CG-CG 4.37Å; R279-E283 IonicContact CZ-OE1 3.91Å; R279-E283 IonicContact NE-OE1 3.07Å; R279-E283 PolarHBondContact NE-OE1 2.87Å; R279-E283 IonicContact NH2-OE1 3.78Å; R279-E283 PolarHBondContact NH2-OE1 3.05Å; R279-E283 WeakPolarHBondContact O-CG 3.22Å; R279-E283 PolarHBondContact O-N 2.97Å; R279-F348 HydrophobicContact CB-CE1 4.01Å; R279-F348 HydrophobicContact CB-CZ 4.47Å; R279-F348 HydrophobicContact CG-CD1 3.97Å; R279-F348 HydrophobicContact CG-CE1 3.81Å; R279-F348 HydrophobicContact CG-CZ 4.36Å
280	C	97.2	Very high	96.4	Very high	0 Å²	0	52.4 Å²	52.4	0%	0	24%	0.24	C	C	.	.	H	α-helix	trans	-59.6	-43.9	176.7	-176.5	0	0	0	0	111.1	N276 S277 E282 E283 L284 Q342 F348 Y378	N276-C280 VanDerWaalsContact O-CB 3.23Å; N276-C280 WeakPolarHBondContact O-CB 3.42Å; N276-C280 PolarHBondContact O-N 3.09Å; S277-C280 WeakPolarHBondContact O-CB 3.32Å; S277-C280 PolarHBondContact O-N 3.11Å; C280-E282 VanDerWaalsContact C-N 3.33Å; C280-E282 PolarHBondContact O-N 2.81Å; C280-E283 PolarHBondContact O-N 3.27Å; C280-L284 VanDerWaalsContact O-CB 3.31Å; C280-L284 WeakPolarHBondContact O-CB 3.39Å; C280-L284 WeakPolarHBondContact O-CG 3.35Å; C280-L284 PolarHBondContact O-N 2.78Å; C280-L284 VanDerWaalsContact SG-CD1 3.56Å; C280-Q342 PolarHBondContact SG-NE2 2.94Å; C280-F348 HydrophobicContact CB-CE1 4.5Å; C280-Y378 HydrophobicContact CB-CE1 4.48Å; C280-Y378 WeakPolarHBondContact CB-OH 3.3Å; C280-Y378 PolarHBondContact SG-OH 3.21Å
281	A	96.9	Very high	96.5	Very high	40 Å²	40	53.7 Å²	53.7	33%	0.331	25%	0.248	S	C	.	.	H	α-helix	trans	-58.8	-44.8	176.6	0	0	0	0	0	111.6	S277 E278 R279 K285 V292	S277-A281 WeakPolarHBondContact O-CB 3.32Å; S277-A281 PolarHBondContact O-N 3.47Å; E278-A281 WeakPolarHBondContact O-CB 3.3Å; E278-A281 PolarHBondContact O-N 3.15Å; R279-A281 VanDerWaalsContact C-N 3.31Å; R279-A281 PolarHBondContact O-N 2.89Å; A281-K285 WeakPolarHBondContact O-CA 3.32Å; A281-K285 WeakPolarHBondContact O-CB 3.19Å; A281-K285 PolarHBondContact O-N 3.28Å; A281-V292 HydrophobicContact CB-CB 3.81Å; A281-V292 HydrophobicContact CB-CG1 4.24Å; A281-V292 HydrophobicContact CB-CG2 4.21Å
282	E	96.9	Very high	96.5	Very high	110 Å²	110	52.3 Å²	52.3	51%	0.514	24%	0.243	S	C	.	.	H	α-helix	trans	-68	-44.7	179.8	-179.9	56.6	-157.6	0	0	112.4	E278 R279 C280 L284 K285	E278-E282 PolarHBondContact O-N 3.48Å; R279-E282 PolarHBondContact O-N 2.93Å; C280-E282 VanDerWaalsContact C-N 3.33Å; C280-E282 PolarHBondContact O-N 2.81Å; E282-L284 VanDerWaalsContact C-N 3.34Å; E282-L284 PolarHBondContact O-N 3.18Å; E282-K285 WeakPolarHBondContact O-CB 3.16Å; E282-K285 VanDerWaalsContact O-CD 3.32Å; E282-K285 WeakPolarHBondContact O-CD 3.47Å; E282-K285 WeakPolarHBondContact O-CG 3.22Å; E282-K285 PolarHBondContact O-N 3.46Å; E282-K285 WeakPolarHBondContact OE1-CE 3.33Å; E282-K285 IonicContact OE1-NZ 3.83Å; E282-K285 PolarHBondContact OE1-NZ 3.48Å; E282-K285 IonicContact OE2-NZ 3.15Å
283	E	94.8	Very high	96.6	Very high	43 Å²	43	50.6 Å²	50.6	20%	0.201	24%	0.235	C	C	.	.	H	α-helix	trans	-66.6	-35.8	178.9	-72.6	-174.9	-175.9	0	0	112	R279 C280 H286 T346 F348	R279-E283 HydrophobicContact CG-CG 4.37Å; R279-E283 IonicContact CZ-OE1 3.91Å; R279-E283 IonicContact NE-OE1 3.07Å; R279-E283 PolarHBondContact NE-OE1 2.87Å; R279-E283 IonicContact NH2-OE1 3.78Å; R279-E283 PolarHBondContact NH2-OE1 3.05Å; R279-E283 WeakPolarHBondContact O-CG 3.22Å; R279-E283 PolarHBondContact O-N 2.97Å; C280-E283 PolarHBondContact O-N 3.27Å; E283-H286 PolarHBondContact O-CE1 3.47Å; E283-H286 VanDerWaalsContact O-CE1 3.25Å; E283-H286 PolarHBondContact O-ND1 3.41Å; E283-T346 HydrophobicContact CB-CG2 4.14Å; E283-T346 WeakPolarHBondContact OE2-CB 3.48Å; E283-T346 PolarHBondContact OE2-OG1 2.91Å; E283-F348 WeakPolarHBondContact OE2-CB 3.26Å
284	L	96.2	Very high	96.7	Very high	3 Å²	3	56.6 Å²	56.6	2%	0.016	26%	0.261	C	S	.	.	H	α-helix	trans	-94.2	3.6	-178.7	-61.6	179.5	0	0	0	114.4	C280 E282 H286 F287 V290 T338 E341 Q342 L372	C280-L284 VanDerWaalsContact O-CB 3.31Å; C280-L284 WeakPolarHBondContact O-CB 3.39Å; C280-L284 WeakPolarHBondContact O-CG 3.35Å; C280-L284 PolarHBondContact O-N 2.78Å; C280-L284 VanDerWaalsContact SG-CD1 3.56Å; E282-L284 VanDerWaalsContact C-N 3.34Å; E282-L284 PolarHBondContact O-N 3.18Å; L284-H286 PolarHBondContact O-N 2.96Å; L284-F287 HydrophobicContact CD2-CD2 4.14Å; L284-F287 HydrophobicContact CD2-CE2 4.41Å; L284-F287 PolarHBondContact O-N 2.85Å; L284-V290 HydrophobicContact CB-CG1 4.46Å; L284-V290 HydrophobicContact CD1-CG1 4.08Å; L284-T338 HydrophobicContact CD1-CG2 3.76Å; L284-E341 HydrophobicContact CD2-CG 4.4Å; L284-Q342 HydrophobicContact CD2-CG 4.3Å; L284-L372 HydrophobicContact CD1-CD1 4.18Å
285	K	95.3	Very high	96.7	Very high	120 Å²	120	57 Å²	57	52%	0.522	26%	0.263	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.7	-20.8	-176.5	74.1	-174.7	175.8	-176.9	0	115.7	A281 E282 K288	A281-K285 WeakPolarHBondContact O-CA 3.32Å; A281-K285 WeakPolarHBondContact O-CB 3.19Å; A281-K285 PolarHBondContact O-N 3.28Å; E282-K285 WeakPolarHBondContact O-CB 3.16Å; E282-K285 VanDerWaalsContact O-CD 3.32Å; E282-K285 WeakPolarHBondContact O-CD 3.47Å; E282-K285 WeakPolarHBondContact O-CG 3.22Å; E282-K285 PolarHBondContact O-N 3.46Å; E282-K285 WeakPolarHBondContact OE1-CE 3.33Å; E282-K285 IonicContact OE1-NZ 3.83Å; E282-K285 PolarHBondContact OE1-NZ 3.48Å; E282-K285 IonicContact OE2-NZ 3.15Å; K285-K288 PolarHBondContact O-NZ 2.66Å
286	H	93.5	Very high	96.8	Very high	77 Å²	77	52 Å²	52	36%	0.356	24%	0.244	S	C	.	.	T	Hydrogen-bonded Turn	trans	-78.4	-24	178.4	65.3	-85.2	0	0	0	112.1	E283 L284 K288 E341	E283-H286 PolarHBondContact O-CE1 3.47Å; E283-H286 VanDerWaalsContact O-CE1 3.25Å; E283-H286 PolarHBondContact O-ND1 3.41Å; L284-H286 PolarHBondContact O-N 2.96Å; H286-K288 PolarHBondContact O-N 2.83Å; H286-E341 IonicContact CE1-OE1 2.71Å; H286-E341 IonicContact NE2-OE1 3.08Å; H286-E341 PolarHBondContact NE2-OE1 3.02Å
287	F	95.9	Very high	96.8	Very high	28 Å²	28	55.4 Å²	55.4	12%	0.123	26%	0.256	C	S	.	.			trans	-84.9	93.7	167.8	-67.1	-30.5	0	0	0	110.5	L284 F289 V290 E341	L284-F287 HydrophobicContact CD2-CD2 4.14Å; L284-F287 HydrophobicContact CD2-CE2 4.41Å; L284-F287 PolarHBondContact O-N 2.85Å; F287-F289 HydrophobicContact CB-CD1 4.23Å; F287-F289 HydrophobicContact CB-CE1 3.78Å; F287-F289 HydrophobicContact CB-CE2 4.15Å; F287-F289 HydrophobicContact CB-CZ 3.73Å; F287-F289 AromaticContact CD1-CE1 3.69Å; F287-F289 HydrophobicContact CD1-CE1 3.69Å; F287-F289 AromaticContact CD1-CZ 3.77Å; F287-F289 HydrophobicContact CD1-CZ 3.77Å; F287-F289 AromaticContact CD2-CZ 3.99Å; F287-F289 HydrophobicContact CD2-CZ 3.99Å; F287-F289 HydrophobicContact CE1-CE1 4.47Å; F287-F289 HydrophobicContact CE1-CZ 4.38Å; F287-F289 AromaticContact CG-CE1 3.81Å; F287-F289 HydrophobicContact CG-CE1 3.81Å; F287-F289 HydrophobicContact CG-CE2 4.31Å; F287-F289 AromaticContact CG-CZ 3.57Å; F287-F289 HydrophobicContact CG-CZ 3.57Å; F287-F289 PolarHBondContact O-N 3.36Å; F287-V290 HydrophobicContact CB-CB 4.32Å; F287-V290 HydrophobicContact CB-CG2 3.87Å; F287-V290 HydrophobicContact CD2-CG2 4.5Å; F287-V290 PolarHBondContact O-N 2.98Å; F287-E341 HydrophobicContact CE2-CB 3.6Å; F287-E341 HydrophobicContact CE2-CG 3.81Å; F287-E341 HydrophobicContact CZ-CB 4.01Å; F287-E341 HydrophobicContact CZ-CG 4.06Å
288	K	95.3	Very high	96.7	Very high	168 Å²	168	61.7 Å²	61.7	73%	0.73	29%	0.289	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.1	-9.9	178.7	-56.9	-53.2	-177.3	-167.7	0	114.8	K285 H286	K285-K288 PolarHBondContact O-NZ 2.66Å; H286-K288 PolarHBondContact O-N 2.83Å
289	F	96.6	Very high	96.7	Very high	35 Å²	35	59.3 Å²	59.3	15%	0.154	28%	0.278	C	S	.	.	T	Hydrogen-bonded Turn	trans	-94.6	2.7	175.3	62	-99.7	0	0	0	113.1	F287 K334 T338 E369 L370	F287-F289 HydrophobicContact CB-CD1 4.23Å; F287-F289 HydrophobicContact CB-CE1 3.78Å; F287-F289 HydrophobicContact CB-CE2 4.15Å; F287-F289 HydrophobicContact CB-CZ 3.73Å; F287-F289 AromaticContact CD1-CE1 3.69Å; F287-F289 HydrophobicContact CD1-CE1 3.69Å; F287-F289 AromaticContact CD1-CZ 3.77Å; F287-F289 HydrophobicContact CD1-CZ 3.77Å; F287-F289 AromaticContact CD2-CZ 3.99Å; F287-F289 HydrophobicContact CD2-CZ 3.99Å; F287-F289 HydrophobicContact CE1-CE1 4.47Å; F287-F289 HydrophobicContact CE1-CZ 4.38Å; F287-F289 AromaticContact CG-CE1 3.81Å; F287-F289 HydrophobicContact CG-CE1 3.81Å; F287-F289 HydrophobicContact CG-CE2 4.31Å; F287-F289 AromaticContact CG-CZ 3.57Å; F287-F289 HydrophobicContact CG-CZ 3.57Å; F287-F289 PolarHBondContact O-N 3.36Å; F289-K334 HydrophobicContact CB-CD 3.85Å; F289-K334 HydrophobicContact CB-CG 4.48Å; F289-K334 HydrophobicContact CD1-CD 4.32Å; F289-K334 HydrophobicContact CD1-CG 4.13Å; F289-K334 HydrophobicContact CD2-CB 3.58Å; F289-K334 HydrophobicContact CD2-CD 3.73Å; F289-K334 HydrophobicContact CD2-CG 3.52Å; F289-K334 HydrophobicContact CE1-CG 4.25Å; F289-K334 HydrophobicContact CE2-CB 3.49Å; F289-K334 VanDerWaalsContact CE2-CB 3.49Å; F289-K334 HydrophobicContact CE2-CD 4.38Å; F289-K334 HydrophobicContact CE2-CG 3.66Å; F289-K334 HydrophobicContact CG-CB 4.35Å; F289-K334 HydrophobicContact CG-CD 3.7Å; F289-K334 HydrophobicContact CG-CG 3.78Å; F289-K334 HydrophobicContact CZ-CB 4.2Å; F289-K334 HydrophobicContact CZ-CG 4.04Å; F289-T338 WeakPolarHBondContact CE2-OG1 3.36Å; F289-E369 CarbonylContact O-C 3.57Å; F289-E369 WeakPolarHBondContact O-CA 3.33Å; F289-L370 PolarHBondContact O-N 3.16Å
290	V	97.4	Very high	96.7	Very high	20 Å²	20	55 Å²	55	12%	0.121	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	130.1	175.7	-179.8	0	0	0	0	109	L284 F287 T338 L370 L372	L284-V290 HydrophobicContact CB-CG1 4.46Å; L284-V290 HydrophobicContact CD1-CG1 4.08Å; F287-V290 HydrophobicContact CB-CB 4.32Å; F287-V290 HydrophobicContact CB-CG2 3.87Å; F287-V290 HydrophobicContact CD2-CG2 4.5Å; F287-V290 PolarHBondContact O-N 2.98Å; V290-T338 HydrophobicContact CG2-CG2 4.09Å; V290-T338 VanDerWaalsContact CG2-OG1 3.25Å; V290-T338 WeakPolarHBondContact CG2-OG1 3.4Å; V290-L370 CarbonylContact C-O 3.59Å; V290-L370 WeakPolarHBondContact CA-O 3.49Å; V290-L372 HydrophobicContact CG1-CD1 3.93Å; V290-L372 HydrophobicContact CG1-CG 4.18Å
291	V	97.1	Very high	96.6	Very high	29 Å²	29	55.6 Å²	55.6	18%	0.176	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	133.9	174.6	176	0	0	0	0	108.4	E369 L370 V371 L372	V291-E369 HydrophobicContact CG2-CG 3.79Å; V291-E369 WeakPolarHBondContact CG2-OE2 3.34Å; V291-L370 PolarHBondContact N-O 3.02Å; V291-V371 HydrophobicContact CB-CG2 4.32Å; V291-V371 HydrophobicContact CG1-CG1 4.41Å; V291-V371 VanDerWaalsContact O-CA 3.31Å; V291-V371 WeakPolarHBondContact O-CA 3.26Å; V291-L372 PolarHBondContact O-N 2.85Å
292	V	97.6	Very high	96.5	Very high	21 Å²	21	57.6 Å²	57.6	13%	0.127	27%	0.268	C	S	.	.			trans	-118.2	124.5	169.8	177.4	0	0	0	0	106.4	S277 A281 K294 L372 H375	S277-V292 WeakPolarHBondContact O-CG1 3.28Å; A281-V292 HydrophobicContact CB-CB 3.81Å; A281-V292 HydrophobicContact CB-CG1 4.24Å; A281-V292 HydrophobicContact CB-CG2 4.21Å; V292-K294 PolarHBondContact O-N 3.02Å; V292-L372 HydrophobicContact CG2-CB 4.42Å; V292-H375 WeakPolarHBondContact CG1-NE2 3.46Å
293	P	97.3	Very high	96.4	Very high	12 Å²	12	53.3 Å²	53.3	8%	0.078	25%	0.247	C	C	.	.	P	Polyproline II helix	trans	-54.9	135.8	-178.8	-27.1	34.5	0	0	0	112.4	A307 E308 V371 L372 L373	P293-A307 HydrophobicContact CB-CB 4.1Å; P293-E308 HydrophobicContact CB-CB 4.1Å; P293-V371 HydrophobicContact CG-CG1 4.12Å; P293-L372 WeakPolarHBondContact CD-O 3.4Å; P293-L373 HydrophobicContact CG-CD2 3.88Å
294	K	97.9	Very high	96.4	Very high	129 Å²	129	51.2 Å²	51.2	56%	0.561	24%	0.238	S	C	*	.	P	Polyproline II helix	trans	-64.2	135.6	174.7	-177.9	-177.2	174.5	-170.8	0	110.8	V292 A307 E308	V292-K294 PolarHBondContact O-N 3.02Å; K294-A307 CarbonylContact O-C 3.55Å; K294-A307 VanDerWaalsContact O-CA 3.23Å; K294-A307 WeakPolarHBondContact O-CA 3.46Å; K294-E308 HydrophobicContact CB-CB 4.3Å; K294-E308 PolarHBondContact N-OE2 3.31Å; K294-E308 PolarHBondContact O-N 3.07Å
295	V	98.4	Very high	96.5	Very high	7 Å²	7	51.7 Å²	51.7	4%	0.042	24%	0.24	C	C	.	.	B	Isolated β-bridge	trans	-84.6	142.9	174.1	177.9	0	0	0	0	110.9	A274 S277 E278 W297 L305	A274-V295 HydrophobicContact CB-CB 4.49Å; A274-V295 HydrophobicContact CB-CG1 3.78Å; A274-V295 HydrophobicContact CB-CG2 4Å; S277-V295 VanDerWaalsContact OG-CG2 3.23Å; S277-V295 WeakPolarHBondContact OG-CG2 3.25Å; E278-V295 HydrophobicContact CG-CG2 4.31Å; V295-W297 HydrophobicContact CG1-CD2 4.14Å; V295-W297 HydrophobicContact CG1-CG 4.3Å; V295-W297 HydrophobicContact CG1-CZ2 4.41Å; V295-L305 HydrophobicContact CG1-CD1 4.23Å
296	Y	98.1	Very high	96.6	Very high	38 Å²	38	46 Å²	46	15%	0.149	22%	0.215	C	C	.	.			trans	-110.4	96.3	171.7	-62.6	-89.4	0	0	0	109.8	L211 T215 V217 D298 Q299 T300 T306 E308	L211-Y296 HydrophobicContact CD1-CD1 3.44Å; L211-Y296 VanDerWaalsContact CD1-CD1 3.44Å; L211-Y296 HydrophobicContact CD1-CD2 4.44Å; L211-Y296 HydrophobicContact CD1-CE1 3.47Å; L211-Y296 VanDerWaalsContact CD1-CE1 3.47Å; L211-Y296 HydrophobicContact CD1-CE2 4.47Å; L211-Y296 HydrophobicContact CD1-CG 3.96Å; T215-Y296 WeakPolarHBondContact CG2-OH 3.47Å; V217-Y296 HydrophobicContact CG1-CD2 3.77Å; V217-Y296 HydrophobicContact CG1-CE2 3.58Å; Y296-D298 VanDerWaalsContact C-N 3.34Å; Y296-D298 PolarHBondContact O-N 3.43Å; Y296-Q299 CarbonylContact O-C 3.57Å; Y296-Q299 PolarHBondContact O-N 2.84Å; Y296-T300 WeakPolarHBondContact O-CB 3.37Å; Y296-T300 PolarHBondContact O-N 3.18Å; Y296-T300 PolarHBondContact O-OG1 2.91Å; Y296-T306 HydrophobicContact CD2-CG2 4.24Å; Y296-T306 HydrophobicContact CG-CG2 4.45Å; Y296-T306 PolarHBondContact N-O 2.91Å; Y296-E308 HydrophobicContact CE2-CB 4.27Å
297	W	97.6	Very high	96.9	Very high	88 Å²	88	43.1 Å²	43.1	33%	0.333	21%	0.205	S	C	.	.	G	3₁₀ helix	trans	-65	-33.3	-172.4	-75.8	102.9	0	0	0	114	E271 A274 R275 E278 V295 Q299 T300	E271-W297 HydrophobicContact CB-CZ3 4.23Å; E271-W297 HydrophobicContact CG-CZ3 4.35Å; A274-W297 HydrophobicContact CB-CH2 3.29Å; A274-W297 HydrophobicContact CB-CZ2 3.6Å; A274-W297 HydrophobicContact CB-CZ3 3.9Å; R275-W297 HydrophobicContact CG-CH2 3.74Å; R275-W297 HydrophobicContact CG-CZ2 4.01Å; E278-W297 PolarHBondContact OE1-NE1 3.46Å; E278-W297 PolarHBondContact OE2-NE1 3.3Å; V295-W297 HydrophobicContact CG1-CD2 4.14Å; V295-W297 HydrophobicContact CG1-CG 4.3Å; V295-W297 HydrophobicContact CG1-CZ2 4.41Å; W297-Q299 PolarHBondContact O-N 3.26Å; W297-T300 HydrophobicContact CE3-CG2 4.15Å; W297-T300 HydrophobicContact CZ3-CG2 4.17Å; W297-T300 PolarHBondContact O-N 2.66Å
298	D	96.1	Very high	97	Very high	139 Å²	139	45.2 Å²	45.2	74%	0.743	22%	0.215	S	C	*	.	G	3₁₀ helix	trans	-64.3	-23.2	179.3	-65	-17.9	0	0	0	112.9	Y296	Y296-D298 VanDerWaalsContact C-N 3.34Å; Y296-D298 PolarHBondContact O-N 3.43Å
299	Q	96.7	Very high	97	Very high	36 Å²	36	39.4 Å²	39.4	17%	0.168	19%	0.19	C	C	.	.	G	3₁₀ helix	trans	-112.9	21	175.9	-60.7	76.8	34.5	0	0	111.7	M189 F190 L211 Y296 W297 T306	M189-Q299 HydrophobicContact CG-CG 3.86Å; M189-Q299 HydrophobicContact SD-CB 4.01Å; M189-Q299 HydrophobicContact SD-CG 3.76Å; F190-Q299 HydrophobicContact CE1-CB 4.22Å; F190-Q299 HydrophobicContact CE1-CG 4.02Å; F190-Q299 HydrophobicContact CZ-CB 3.99Å; F190-Q299 HydrophobicContact CZ-CG 4.09Å; L211-Q299 HydrophobicContact CD2-CG 4.21Å; Y296-Q299 CarbonylContact O-C 3.57Å; Y296-Q299 PolarHBondContact O-N 2.84Å; W297-Q299 PolarHBondContact O-N 3.26Å; Q299-T306 HydrophobicContact CB-CG2 4.05Å; Q299-T306 WeakPolarHBondContact CB-OG1 3.27Å; Q299-T306 WeakPolarHBondContact O-CB 3.46Å; Q299-T306 PolarHBondContact O-OG1 2.95Å
300	T	97.6	Very high	96.9	Very high	13 Å²	13	38.3 Å²	38.3	8%	0.08	19%	0.186	C	C	.	.			trans	-118	137.8	178.7	-64.8	0	0	0	0	110.2	A274 Y296 W297 V304 L305 T306	A274-T300 HydrophobicContact CB-CG2 4.37Å; Y296-T300 WeakPolarHBondContact O-CB 3.37Å; Y296-T300 PolarHBondContact O-N 3.18Å; Y296-T300 PolarHBondContact O-OG1 2.91Å; W297-T300 HydrophobicContact CE3-CG2 4.15Å; W297-T300 HydrophobicContact CZ3-CG2 4.17Å; W297-T300 PolarHBondContact O-N 2.66Å; T300-V304 CarbonylContact C-O 3.52Å; T300-V304 VanDerWaalsContact CA-O 3.29Å; T300-V304 WeakPolarHBondContact CA-O 3.49Å; T300-V304 WeakPolarHBondContact CG2-O 3.48Å; T300-L305 HydrophobicContact CG2-CD1 4.02Å; T300-T306 PolarHBondContact OG1-N 2.89Å; T300-T306 VanDerWaalsContact OG1-N 3.17Å
301	S	96.5	Very high	96.7	Very high	11 Å²	11	44 Å²	44	8%	0.077	21%	0.212	C	C	.	.			trans	-138.7	-177.6	175.5	74.4	0	0	0	0	108.7	D181 F270 R303 V304	D181-S301 WeakPolarHBondContact OD2-CB 3.37Å; D181-S301 PolarHBondContact OD2-OG 3.39Å; F270-S301 WeakPolarHBondContact CB-O 3.32Å; S301-R303 PolarHBondContact O-N 3.34Å; S301-R303 VanDerWaalsContact O-N 3.12Å; S301-R303 PolarHBondContact OG-N 3.32Å; S301-R303 VanDerWaalsContact OG-N 3.11Å; S301-V304 PolarHBondContact N-O 3.19Å; S301-V304 PolarHBondContact OG-N 3.46Å
302	K	94.2	Very high	96.5	Very high	82 Å²	82	44.5 Å²	44.5	36%	0.357	22%	0.223	S	C	.	.	S	Bend	trans	-61	-19.7	172.3	-59.1	-164.6	176	-164	0	114.9	Q222 R227 F270 E271	Q222-K302 PolarHBondContact NE2-O 3.39Å; R227-K302 VanDerWaalsContact NH1-CB 3.28Å; F270-K302 PolarHBondContact N-O 3.19Å; F270-K302 VanDerWaalsContact N-O 3.13Å; E271-K302 VanDerWaalsContact CD-CG 3.44Å; E271-K302 HydrophobicContact CG-CG 4.03Å; E271-K302 WeakPolarHBondContact OE1-CG 3.41Å; E271-K302 PolarHBondContact OE1-N 3.36Å; E271-K302 WeakPolarHBondContact OE2-CE 3.22Å
303	R	94.1	Very high	96.3	Very high	20 Å²	20	44 Å²	44	8%	0.075	22%	0.22	C	C	.	.	S	Bend	trans	-119.7	-7.5	-176.8	-52.7	-178.9	-80.1	178.7	-6.9	114.1	L177 E180 D181 Q222 S301	L177-R303 HydrophobicContact CD1-CB 4.15Å; L177-R303 HydrophobicContact CD2-CB 4.04Å; L177-R303 HydrophobicContact CG-CB 4.35Å; E180-R303 IonicContact OE2-CZ 3.86Å; E180-R303 IonicContact OE2-NH1 3.89Å; E180-R303 PolarHBondContact OE2-NH1 3.1Å; E180-R303 IonicContact OE2-NH2 2.78Å; E180-R303 PolarHBondContact OE2-NH2 3.43Å; E180-R303 VanDerWaalsContact OE2-NH2 3.1Å; D181-R303 IonicContact OD1-CZ 2.8Å; D181-R303 IonicContact OD1-NE 2.83Å; D181-R303 PolarHBondContact OD1-NE 2.89Å; D181-R303 IonicContact OD1-NH2 3.46Å; D181-R303 PolarHBondContact OD1-NH2 2.8Å; D181-R303 VanDerWaalsContact OD2-CB 3.32Å; D181-R303 WeakPolarHBondContact OD2-CB 3.13Å; D181-R303 IonicContact OD2-NE 3.1Å; D181-R303 PolarHBondContact OD2-NE 3.37Å; Q222-R303 HydrophobicContact CB-CB 4.32Å; Q222-R303 HydrophobicContact CG-CB 4.42Å; Q222-R303 PolarHBondContact N-O 2.6Å; S301-R303 PolarHBondContact O-N 3.34Å; S301-R303 VanDerWaalsContact O-N 3.12Å; S301-R303 PolarHBondContact OG-N 3.32Å; S301-R303 VanDerWaalsContact OG-N 3.11Å
304	V	96.2	Very high	96.1	Very high	0 Å²	0	49 Å²	49	0%	0	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	126	175.4	-178.5	0	0	0	0	109.2	L177 F178 F182 V219 K220 V221 T300 S301	L177-V304 HydrophobicContact CD2-CG2 3.2Å; F178-V304 HydrophobicContact CD2-CG2 4.38Å; F178-V304 HydrophobicContact CE1-CG1 4.3Å; F178-V304 HydrophobicContact CE2-CG1 4.25Å; F178-V304 HydrophobicContact CE2-CG2 3.93Å; F178-V304 HydrophobicContact CZ-CG1 3.68Å; F178-V304 HydrophobicContact CZ-CG2 4.08Å; F182-V304 HydrophobicContact CE2-CB 3.75Å; F182-V304 HydrophobicContact CE2-CG1 4.15Å; F182-V304 HydrophobicContact CE2-CG2 3.75Å; F182-V304 HydrophobicContact CZ-CB 3.99Å; F182-V304 HydrophobicContact CZ-CG1 4.39Å; F182-V304 HydrophobicContact CZ-CG2 4.45Å; V219-V304 HydrophobicContact CG1-CG1 3.66Å; K220-V304 CarbonylContact O-C 3.42Å; K220-V304 WeakPolarHBondContact O-CA 3.01Å; V221-V304 HydrophobicContact CG1-CG2 4.48Å; T300-V304 CarbonylContact C-O 3.52Å; T300-V304 VanDerWaalsContact CA-O 3.29Å; T300-V304 WeakPolarHBondContact CA-O 3.49Å; T300-V304 WeakPolarHBondContact CG2-O 3.48Å; S301-V304 PolarHBondContact N-O 3.19Å; S301-V304 PolarHBondContact OG-N 3.46Å
305	L	97.5	Very high	95.9	Very high	13 Å²	13	42.8 Å²	42.8	7%	0.068	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	120.6	172.1	173.3	61.9	0	0	0	108.8	V219 K220 F270 E273 A274 V295 T300	V219-L305 CarbonylContact C-O 3.59Å; V219-L305 WeakPolarHBondContact CA-O 3.47Å; K220-L305 HydrophobicContact CB-CB 4.19Å; K220-L305 HydrophobicContact CD-CD2 4.36Å; K220-L305 PolarHBondContact N-O 3.06Å; K220-L305 PolarHBondContact O-N 3.25Å; F270-L305 HydrophobicContact CB-CB 3.98Å; F270-L305 HydrophobicContact CD2-CB 3.83Å; F270-L305 HydrophobicContact CG-CB 4Å; E273-L305 HydrophobicContact CB-CD2 4.38Å; E273-L305 HydrophobicContact CG-CD2 3.73Å; A274-L305 HydrophobicContact CB-CD1 3.74Å; V295-L305 HydrophobicContact CG1-CD1 4.23Å; T300-L305 HydrophobicContact CG2-CD1 4.02Å
306	T	98	Very high	95.5	Very high	0 Å²	0	45.8 Å²	45.8	0%	0	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	120.3	175	-60.1	0	0	0	0	109.4	F190 V217 V219 Y296 Q299 T300	F190-T306 HydrophobicContact CE1-CG2 4.12Å; F190-T306 HydrophobicContact CZ-CG2 4.4Å; V217-T306 HydrophobicContact CB-CG2 3.87Å; V217-T306 HydrophobicContact CG1-CG2 4.17Å; V217-T306 HydrophobicContact CG2-CG2 3.9Å; V219-T306 HydrophobicContact CG2-CG2 4.21Å; Y296-T306 HydrophobicContact CD2-CG2 4.24Å; Y296-T306 HydrophobicContact CG-CG2 4.45Å; Y296-T306 PolarHBondContact N-O 2.91Å; Q299-T306 HydrophobicContact CB-CG2 4.05Å; Q299-T306 WeakPolarHBondContact CB-OG1 3.27Å; Q299-T306 WeakPolarHBondContact O-CB 3.46Å; Q299-T306 PolarHBondContact O-OG1 2.95Å; T300-T306 PolarHBondContact OG1-N 2.89Å; T300-T306 VanDerWaalsContact OG1-N 3.17Å
307	A	98.1	Very high	95.2	Very high	17 Å²	17	47.3 Å²	47.3	14%	0.14	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.7	162.5	-179.5	0	0	0	0	0	111.6	V217 A218 P293 K294 F309	V217-A307 CarbonylContact C-O 3.34Å; V217-A307 VanDerWaalsContact CA-O 3.28Å; V217-A307 WeakPolarHBondContact CA-O 3.29Å; V217-A307 WeakPolarHBondContact CB-O 3.45Å; A218-A307 PolarHBondContact N-O 3Å; A218-A307 PolarHBondContact O-N 2.9Å; P293-A307 HydrophobicContact CB-CB 4.1Å; K294-A307 CarbonylContact O-C 3.55Å; K294-A307 VanDerWaalsContact O-CA 3.23Å; K294-A307 WeakPolarHBondContact O-CA 3.46Å; A307-F309 PolarHBondContact O-N 3.27Å
308	E	97.9	Very high	95	Very high	72 Å²	72	45.1 Å²	45.1	34%	0.336	24%	0.235	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-53.5	131.5	176.6	-179.2	-175.5	176.3	0	0	111.4	P293 K294 Y296 C310	P293-E308 HydrophobicContact CB-CB 4.1Å; K294-E308 HydrophobicContact CB-CB 4.3Å; K294-E308 PolarHBondContact N-OE2 3.31Å; K294-E308 PolarHBondContact O-N 3.07Å; Y296-E308 HydrophobicContact CE2-CB 4.27Å; E308-C310 PolarHBondContact O-N 3.28Å
309	F	97	Very high	94.8	Very high	45 Å²	45	44.3 Å²	44.3	20%	0.197	23%	0.227	C	C	.	.			trans	-74.4	114.9	175.2	-175.9	-99.9	0	0	0	110	I198 K208 P216 A218 A307 E311	I198-F309 HydrophobicContact CD1-CD2 4.44Å; I198-F309 HydrophobicContact CD1-CE2 3.71Å; K208-F309 HydrophobicContact CD-CE2 4.34Å; K208-F309 HydrophobicContact CD-CZ 4.3Å; K208-F309 HydrophobicContact CG-CD2 4.37Å; K208-F309 HydrophobicContact CG-CE2 4.37Å; P216-F309 HydrophobicContact CB-CB 4.04Å; P216-F309 WeakPolarHBondContact O-CB 2.88Å; P216-F309 PolarHBondContact O-N 2.96Å; P216-F309 VanDerWaalsContact O-N 3.08Å; A218-F309 HydrophobicContact CB-CD2 4.21Å; A307-F309 PolarHBondContact O-N 3.27Å; F309-E311 HydrophobicContact CD1-CG 4.3Å; F309-E311 HydrophobicContact CE1-CG 3.76Å
310	C	94.8	Very high	94.7	Very high	12 Å²	12	44.2 Å²	44.2	8%	0.081	23%	0.226	C	C	.	.			trans	-105.7	129.4	178.6	-71.8	0	0	0	0	111.6	E308 V371 L373	E308-C310 PolarHBondContact O-N 3.28Å; C310-V371 HydrophobicContact CB-CG1 3.75Å; C310-L373 HydrophobicContact CB-CD2 4.49Å
311	E	92.3	Very high	94.6	Very high	140 Å²	140	43.6 Å²	43.6	65%	0.654	22%	0.222	S	C	*	.			trans	-88.2	147.8	171.7	-63	-173.5	160.5	0	0	111.6	F309 R361	F309-E311 HydrophobicContact CD1-CG 4.3Å; F309-E311 HydrophobicContact CE1-CG 3.76Å; E311-R361 VanDerWaalsContact O-CD 3.27Å; E311-R361 WeakPolarHBondContact O-CD 3.41Å
312	G	93.2	Very high	94.4	Very high	40 Å²	40	48 Å²	48	41%	0.412	24%	0.24	S	C	.	.			trans	164.8	173.5	177.6	0	0	0	0	0	111.8
313	C	93.6	Very high	94.5	Very high	10 Å²	10	53.2 Å²	53.2	7%	0.068	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	150	173.3	68.2	0	0	0	0	110.7	E320 I321 L359 V360	C313-E320 HydrophobicContact CB-CB 3.85Å; C313-E320 HydrophobicContact CB-CG 3.22Å; C313-I321 VanDerWaalsContact SG-CG1 3.58Å; C313-L359 CarbonylContact O-C 3.56Å; C313-L359 VanDerWaalsContact O-CA 3.26Å; C313-L359 WeakPolarHBondContact O-CA 3.27Å; C313-V360 PolarHBondContact N-O 2.82Å; C313-V360 PolarHBondContact O-N 3.22Å; C313-V360 PolarHBondContact SG-O 3.38Å
314	K	92.9	Very high	94.4	Very high	116 Å²	116	54.6 Å²	54.6	50%	0.504	27%	0.265	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.6	143.4	175.7	-63.6	-179.6	179.1	178.5	0	110.3	N316 N317 L359	K314-N316 VanDerWaalsContact CB-OD1 3.23Å; K314-N316 WeakPolarHBondContact CB-OD1 3.41Å; K314-N316 PolarHBondContact O-N 3.34Å; K314-N316 VanDerWaalsContact O-N 3.08Å; K314-N317 WeakPolarHBondContact O-CB 3.28Å; K314-N317 PolarHBondContact O-N 3.17Å; K314-L359 HydrophobicContact CG-CD2 4.33Å
315	I	93	Very high	94.3	Very high	0 Å²	0	57.1 Å²	57.1	0%	0	29%	0.291	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60.4	-22.9	-177.7	-167.4	160.3	0	0	0	114.2	N317 I321 T331 L335 P355 V358 V360 L370 I482 L486	I315-N317 VanDerWaalsContact C-N 3.33Å; I315-I321 WeakPolarHBondContact O-CD1 3.27Å; I315-T331 HydrophobicContact CD1-CG2 4.06Å; I315-T331 HydrophobicContact CG1-CG2 4.06Å; I315-L335 HydrophobicContact CD1-CB 4.35Å; I315-L335 HydrophobicContact CD1-CD1 3.55Å; I315-L335 HydrophobicContact CD1-CD2 3.79Å; I315-L335 HydrophobicContact CD1-CG 4.1Å; I315-P355 HydrophobicContact CG2-CB 3.97Å; I315-V358 HydrophobicContact CB-CB 4.25Å; I315-V358 HydrophobicContact CB-CG1 4.19Å; I315-V358 HydrophobicContact CD1-CG1 3.84Å; I315-V358 HydrophobicContact CG2-CB 3.99Å; I315-V358 HydrophobicContact CG2-CG1 4.41Å; I315-V358 PolarHBondContact N-O 3.31Å; I315-V360 HydrophobicContact CB-CG2 3.9Å; I315-V360 HydrophobicContact CD1-CG2 4.3Å; I315-V360 HydrophobicContact CG1-CG2 3.86Å; I315-L370 HydrophobicContact CD1-CD2 4.37Å; I315-I482 HydrophobicContact CD1-CG2 3.8Å; I315-I482 HydrophobicContact CG1-CG2 3.79Å; I315-I482 HydrophobicContact CG2-CD1 4.23Å; I315-I482 HydrophobicContact CG2-CG1 4.37Å; I315-I482 HydrophobicContact CG2-CG2 4Å; I315-L486 HydrophobicContact CG1-CD1 4.39Å; I315-L486 WeakPolarHBondContact O-CD2 3.34Å
316	N	89.2	Confident	94.3	Very high	70 Å²	70	57 Å²	57	37%	0.374	29%	0.29	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.1	2	175.4	65	-11.2	0	0	0	114.1	K314 L318 P355 T485	K314-N316 VanDerWaalsContact CB-OD1 3.23Å; K314-N316 WeakPolarHBondContact CB-OD1 3.41Å; K314-N316 PolarHBondContact O-N 3.34Å; K314-N316 VanDerWaalsContact O-N 3.08Å; N316-L318 VanDerWaalsContact O-CD1 3.26Å; N316-L318 WeakPolarHBondContact O-CD1 3.31Å; N316-L318 PolarHBondContact O-N 3.06Å; N316-P355 HydrophobicContact CB-CB 3.99Å; N316-T485 HydrophobicContact CB-CG2 3.99Å
317	N	91.9	Very high	94.1	Very high	70 Å²	70	60 Å²	60	37%	0.374	31%	0.311	S	S	.	.			trans	-94	81.5	177.1	-169.2	-16.2	0	0	0	111.1	K314 I315 E319 E320 I321	K314-N317 WeakPolarHBondContact O-CB 3.28Å; K314-N317 PolarHBondContact O-N 3.17Å; I315-N317 VanDerWaalsContact C-N 3.33Å; N317-E319 VanDerWaalsContact C-N 3.31Å; N317-E319 PolarHBondContact O-N 3.25Å; N317-E320 HydrophobicContact CB-CB 4.12Å; N317-E320 VanDerWaalsContact CG-CB 3.42Å; N317-E320 PolarHBondContact O-N 3.46Å; N317-E320 WeakPolarHBondContact OD1-CB 3.49Å; N317-E320 PolarHBondContact OD1-N 3.39Å; N317-I321 WeakPolarHBondContact O-CG1 3.41Å; N317-I321 PolarHBondContact O-N 2.88Å; N317-I321 VanDerWaalsContact O-N 3.15Å
318	L	93.3	Very high	94	Very high	41 Å²	41	60.6 Å²	60.6	22%	0.215	31%	0.312	C	S	.	.	H	α-helix	trans	-59	-41.2	-175	-74.9	70.7	0	0	0	112.9	N316 E320 I321 K322 L328 T485 L486	N316-L318 VanDerWaalsContact O-CD1 3.26Å; N316-L318 WeakPolarHBondContact O-CD1 3.31Å; N316-L318 PolarHBondContact O-N 3.06Å; L318-E320 VanDerWaalsContact C-N 3.33Å; L318-I321 PolarHBondContact O-N 3.35Å; L318-K322 WeakPolarHBondContact O-CG 3.26Å; L318-K322 PolarHBondContact O-N 2.94Å; L318-L328 HydrophobicContact CD2-CD1 4.2Å; L318-L328 HydrophobicContact CG-CD1 4.33Å; L318-T485 HydrophobicContact CD1-CG2 3.86Å; L318-T485 WeakPolarHBondContact CD1-O 3.45Å; L318-T485 WeakPolarHBondContact CD2-O 3.32Å; L318-L486 HydrophobicContact CD1-CD2 4.42Å; L318-L486 HydrophobicContact CG-CD2 4.33Å
319	E	93.7	Very high	93.8	Very high	123 Å²	123	65.3 Å²	65.3	58%	0.575	33%	0.327	S	S	*	.	H	α-helix	trans	-67.7	-38.4	-175.8	-63.1	-52.9	116.7	0	0	111	N317 K322 R323	N317-E319 VanDerWaalsContact C-N 3.31Å; N317-E319 PolarHBondContact O-N 3.25Å; E319-K322 PolarHBondContact O-N 3.35Å; E319-K322 IonicContact OE1-NZ 3.82Å; E319-K322 PolarHBondContact OE1-NZ 3.44Å; E319-R323 VanDerWaalsContact O-CB 3.31Å; E319-R323 WeakPolarHBondContact O-CB 3.41Å; E319-R323 PolarHBondContact O-N 3.28Å
320	E	94	Very high	93.7	Very high	33 Å²	33	65 Å²	65	15%	0.154	33%	0.327	C	S	.	.	H	α-helix	trans	-67.7	-42.5	175.6	-170.7	54.9	-141.2	0	0	112.6	C313 N317 L318 K322 R323 Q324	C313-E320 HydrophobicContact CB-CB 3.85Å; C313-E320 HydrophobicContact CB-CG 3.22Å; N317-E320 HydrophobicContact CB-CB 4.12Å; N317-E320 VanDerWaalsContact CG-CB 3.42Å; N317-E320 PolarHBondContact O-N 3.46Å; N317-E320 WeakPolarHBondContact OD1-CB 3.49Å; N317-E320 PolarHBondContact OD1-N 3.39Å; L318-E320 VanDerWaalsContact C-N 3.33Å; E320-K322 VanDerWaalsContact C-N 3.31Å; E320-K322 PolarHBondContact O-N 2.81Å; E320-R323 WeakPolarHBondContact O-CB 3.4Å; E320-R323 PolarHBondContact O-N 3.22Å; E320-R323 IonicContact OE1-CZ 3.29Å; E320-R323 IonicContact OE1-NE 2.73Å; E320-R323 PolarHBondContact OE1-NE 3.22Å; E320-R323 VanDerWaalsContact OE1-NE 3.09Å; E320-R323 IonicContact OE1-NH2 3.5Å; E320-R323 PolarHBondContact OE1-NH2 2.85Å; E320-R323 IonicContact OE2-CZ 3.71Å; E320-R323 IonicContact OE2-NE 3.71Å; E320-R323 PolarHBondContact OE2-NE 3.05Å; E320-R323 VanDerWaalsContact OE2-NE 3.08Å; E320-R323 IonicContact OE2-NH1 2.85Å; E320-R323 PolarHBondContact OE2-NH1 3.09Å; E320-R323 IonicContact OE2-NH2 3.84Å; E320-R323 PolarHBondContact OE2-NH2 2.9Å; E320-Q324 WeakPolarHBondContact O-CG 3.27Å; E320-Q324 PolarHBondContact O-N 2.82Å; E320-Q324 PolarHBondContact OE1-NE2 2.99Å
321	I	94.4	Very high	93.8	Very high	0 Å²	0	64.4 Å²	64.4	0%	0	32%	0.323	C	S	.	.	H	α-helix	trans	-60.2	-44.9	177.1	-63.8	167.3	0	0	0	110	C313 I315 N317 L318 Q324 L326 L328 V360 L486	C313-I321 VanDerWaalsContact SG-CG1 3.58Å; I315-I321 WeakPolarHBondContact O-CD1 3.27Å; N317-I321 WeakPolarHBondContact O-CG1 3.41Å; N317-I321 PolarHBondContact O-N 2.88Å; N317-I321 VanDerWaalsContact O-N 3.15Å; L318-I321 PolarHBondContact O-N 3.35Å; I321-Q324 PolarHBondContact O-N 3.28Å; I321-L326 HydrophobicContact CG2-CB 3.71Å; I321-L326 WeakPolarHBondContact O-CB 3.45Å; I321-L326 PolarHBondContact O-N 2.81Å; I321-L328 HydrophobicContact CB-CD2 3.92Å; I321-L328 HydrophobicContact CD1-CD2 4.33Å; I321-L328 HydrophobicContact CG2-CD2 3.67Å; I321-V360 HydrophobicContact CD1-CB 4.45Å; I321-V360 HydrophobicContact CD1-CG2 4.22Å; I321-V360 HydrophobicContact CG1-CB 4.3Å; I321-V360 HydrophobicContact CG1-CG1 4.3Å; I321-L486 HydrophobicContact CD1-CD2 4.18Å
322	K	94.1	Very high	93.9	Very high	105 Å²	105	57.8 Å²	57.8	46%	0.457	29%	0.292	S	S	.	.	H	α-helix	trans	-63.8	-41.8	175.1	-70.3	172.4	-168.5	163.4	0	112	L318 E319 E320 Q324 G325	L318-K322 WeakPolarHBondContact O-CG 3.26Å; L318-K322 PolarHBondContact O-N 2.94Å; E319-K322 PolarHBondContact O-N 3.35Å; E319-K322 IonicContact OE1-NZ 3.82Å; E319-K322 PolarHBondContact OE1-NZ 3.44Å; E320-K322 VanDerWaalsContact C-N 3.31Å; E320-K322 PolarHBondContact O-N 2.81Å; K322-Q324 VanDerWaalsContact C-N 3.26Å; K322-Q324 PolarHBondContact O-N 3.37Å; K322-G325 WeakPolarHBondContact O-CA 3.4Å; K322-G325 PolarHBondContact O-N 2.97Å
323	R	95.1	Very high	94	Very high	190 Å²	190	57.6 Å²	57.6	72%	0.717	28%	0.282	S	S	*	.	H	α-helix	trans	-60.7	-35.4	178.2	-170.6	178.5	74.4	179.1	11.2	112.2	E319 E320 G325	E319-R323 VanDerWaalsContact O-CB 3.31Å; E319-R323 WeakPolarHBondContact O-CB 3.41Å; E319-R323 PolarHBondContact O-N 3.28Å; E320-R323 WeakPolarHBondContact O-CB 3.4Å; E320-R323 PolarHBondContact O-N 3.22Å; E320-R323 IonicContact OE1-CZ 3.29Å; E320-R323 IonicContact OE1-NE 2.73Å; E320-R323 PolarHBondContact OE1-NE 3.22Å; E320-R323 VanDerWaalsContact OE1-NE 3.09Å; E320-R323 IonicContact OE1-NH2 3.5Å; E320-R323 PolarHBondContact OE1-NH2 2.85Å; E320-R323 IonicContact OE2-CZ 3.71Å; E320-R323 IonicContact OE2-NE 3.71Å; E320-R323 PolarHBondContact OE2-NE 3.05Å; E320-R323 VanDerWaalsContact OE2-NE 3.08Å; E320-R323 IonicContact OE2-NH1 2.85Å; E320-R323 PolarHBondContact OE2-NH1 3.09Å; E320-R323 IonicContact OE2-NH2 3.84Å; E320-R323 PolarHBondContact OE2-NH2 2.9Å; R323-G325 PolarHBondContact O-N 2.96Å
324	Q	93.3	Very high	94.2	Very high	49 Å²	49	57.7 Å²	57.7	23%	0.229	28%	0.281	C	S	.	.	T	Hydrogen-bonded Turn	trans	-74.2	-0.9	172.6	-66.4	-179.3	36.3	0	0	113.6	E320 I321 K322 L326 R362	E320-Q324 WeakPolarHBondContact O-CG 3.27Å; E320-Q324 PolarHBondContact O-N 2.82Å; E320-Q324 PolarHBondContact OE1-NE2 2.99Å; I321-Q324 PolarHBondContact O-N 3.28Å; K322-Q324 VanDerWaalsContact C-N 3.26Å; K322-Q324 PolarHBondContact O-N 3.37Å; Q324-L326 VanDerWaalsContact C-N 3.3Å; Q324-L326 HydrophobicContact CB-CD1 4.02Å; Q324-L326 HydrophobicContact CB-CG 3.95Å; Q324-R362 PolarHBondContact O-NE 3.03Å; Q324-R362 PolarHBondContact O-NH2 3.09Å
325	G	93.8	Very high	94.4	Very high	54 Å²	54	52.2 Å²	52.2	56%	0.557	26%	0.257	S	S	*	.	T	Hydrogen-bonded Turn	trans	70	25.1	-177.5	0	0	0	0	0	113.3	K322 R323	K322-G325 WeakPolarHBondContact O-CA 3.4Å; K322-G325 PolarHBondContact O-N 2.97Å; R323-G325 PolarHBondContact O-N 2.96Å
326	L	96	Very high	94.5	Very high	10 Å²	10	52.3 Å²	52.3	5%	0.052	26%	0.258	C	S	.	.			trans	-95	147.2	-178.3	-59	176.6	0	0	0	110.9	I321 Q324 V360 R362	I321-L326 HydrophobicContact CG2-CB 3.71Å; I321-L326 WeakPolarHBondContact O-CB 3.45Å; I321-L326 PolarHBondContact O-N 2.81Å; Q324-L326 VanDerWaalsContact C-N 3.3Å; Q324-L326 HydrophobicContact CB-CD1 4.02Å; Q324-L326 HydrophobicContact CB-CG 3.95Å; L326-V360 HydrophobicContact CD1-CG1 3.9Å; L326-R362 HydrophobicContact CD2-CB 4.21Å; L326-R362 HydrophobicContact CD2-CG 4.34Å
327	S	95.3	Very high	94.8	Very high	62 Å²	62	54.3 Å²	54.3	43%	0.434	26%	0.26	S	S	.	.			trans	-83.1	126.3	179.7	170.6	0	0	0	0	111.2	R329 D330 T331	S327-R329 PolarHBondContact O-N 2.77Å; S327-R329 PolarHBondContact OG-N 3.39Å; S327-D330 PolarHBondContact O-N 2.96Å; S327-D330 PolarHBondContact OG-N 3.44Å; S327-T331 PolarHBondContact O-N 3.19Å; S327-T331 PolarHBondContact O-OG1 3.29Å
328	L	94.8	Very high	95	Very high	31 Å²	31	51 Å²	51	16%	0.162	24%	0.242	C	C	.	.	H	α-helix	trans	-60.8	-35.8	172.6	-57.1	-174.1	0	0	0	111.3	L318 I321 T331 A332 L486	L318-L328 HydrophobicContact CD2-CD1 4.2Å; L318-L328 HydrophobicContact CG-CD1 4.33Å; I321-L328 HydrophobicContact CB-CD2 3.92Å; I321-L328 HydrophobicContact CD1-CD2 4.33Å; I321-L328 HydrophobicContact CG2-CD2 3.67Å; L328-T331 PolarHBondContact O-N 2.9Å; L328-A332 WeakPolarHBondContact O-CB 3.48Å; L328-A332 PolarHBondContact O-N 3.43Å; L328-L486 HydrophobicContact CD2-CD2 4.12Å
329	R	94.4	Very high	95.1	Very high	171 Å²	171	49.1 Å²	49.1	65%	0.645	23%	0.232	S	C	*	.	H	α-helix	trans	-66.6	-44.3	177.1	-173.4	179.1	178	-175.1	0.7	112	S327 T331 A332 D333 P489 V490	S327-R329 PolarHBondContact O-N 2.77Å; S327-R329 PolarHBondContact OG-N 3.39Å; R329-T331 VanDerWaalsContact C-N 3.35Å; R329-A332 PolarHBondContact O-N 2.89Å; R329-D333 WeakPolarHBondContact O-CB 3.44Å; R329-D333 PolarHBondContact O-N 3.33Å; R329-P489 HydrophobicContact CB-CB 3.97Å; R329-P489 HydrophobicContact CB-CG 4.46Å; R329-P489 HydrophobicContact CG-CB 4.26Å; R329-V490 HydrophobicContact CG-CG2 3.76Å; R329-V490 WeakPolarHBondContact O-CG2 3.45Å
330	D	95.6	Very high	95.2	Very high	38 Å²	38	43.2 Å²	43.2	20%	0.203	21%	0.205	C	C	.	.	H	α-helix	trans	-62.9	-43.8	176.6	-178.2	63.1	0	0	0	110.8	S327 D333 K334 A368	S327-D330 PolarHBondContact O-N 2.96Å; S327-D330 PolarHBondContact OG-N 3.44Å; D330-D333 PolarHBondContact O-N 2.73Å; D330-K334 WeakPolarHBondContact O-CB 3.23Å; D330-K334 VanDerWaalsContact O-CG 3.28Å; D330-K334 WeakPolarHBondContact O-CG 3.25Å; D330-K334 PolarHBondContact O-N 3.5Å; D330-K334 VanDerWaalsContact OD1-CE 3.27Å; D330-K334 WeakPolarHBondContact OD1-CE 3.47Å; D330-K334 IonicContact OD1-NZ 3.93Å; D330-K334 PolarHBondContact OD1-NZ 2.9Å; D330-K334 WeakPolarHBondContact OD2-CE 3.43Å; D330-K334 IonicContact OD2-NZ 2.8Å; D330-K334 PolarHBondContact OD2-NZ 2.86Å; D330-A368 WeakPolarHBondContact OD2-CB 3.33Å; D330-A368 PolarHBondContact OD2-N 3.45Å; D330-A368 VanDerWaalsContact OD2-N 3.14Å
331	T	96.1	Very high	95.2	Very high	0 Å²	0	42 Å²	42	0%	0	20%	0.199	C	C	.	.	H	α-helix	trans	-59.5	-49.2	176.6	-53.8	0	0	0	0	111.4	I315 S327 L328 R329 L335 V360 A368 L370 L486	I315-T331 HydrophobicContact CD1-CG2 4.06Å; I315-T331 HydrophobicContact CG1-CG2 4.06Å; S327-T331 PolarHBondContact O-N 3.19Å; S327-T331 PolarHBondContact O-OG1 3.29Å; L328-T331 PolarHBondContact O-N 2.9Å; R329-T331 VanDerWaalsContact C-N 3.35Å; T331-L335 WeakPolarHBondContact O-CB 3.48Å; T331-L335 PolarHBondContact O-N 3.09Å; T331-V360 HydrophobicContact CG2-CG1 4.14Å; T331-V360 HydrophobicContact CG2-CG2 3.67Å; T331-A368 WeakPolarHBondContact OG1-CB 3.12Å; T331-L370 HydrophobicContact CG2-CD2 4.04Å; T331-L486 HydrophobicContact CG2-CD1 4.43Å
332	A	95.1	Very high	95.3	Very high	0 Å²	0	42 Å²	42	0%	0	20%	0.199	C	C	.	.	H	α-helix	trans	-65.1	-42.8	178.9	0	0	0	0	0	112.8	L328 R329 L335 I336 L486 P489 V490	L328-A332 WeakPolarHBondContact O-CB 3.48Å; L328-A332 PolarHBondContact O-N 3.43Å; R329-A332 PolarHBondContact O-N 2.89Å; A332-L335 WeakPolarHBondContact O-CB 3.34Å; A332-L335 PolarHBondContact O-N 3.03Å; A332-I336 WeakPolarHBondContact O-CD1 3.22Å; A332-I336 VanDerWaalsContact O-CG1 3.25Å; A332-I336 WeakPolarHBondContact O-CG1 3.44Å; A332-I336 PolarHBondContact O-N 2.92Å; A332-L486 HydrophobicContact CB-CD1 3.84Å; A332-P489 HydrophobicContact CB-CG 3.85Å; A332-V490 HydrophobicContact CB-CB 4.34Å; A332-V490 HydrophobicContact CB-CG2 3.83Å
333	D	95.4	Very high	95.3	Very high	37 Å²	37	37 Å²	37	20%	0.198	18%	0.177	C	C	.	.	H	α-helix	trans	-62.7	-45.8	179	-179.1	72.4	0	0	0	110.9	R329 D330 L335 I336 R337 V490	R329-D333 WeakPolarHBondContact O-CB 3.44Å; R329-D333 PolarHBondContact O-N 3.33Å; D330-D333 PolarHBondContact O-N 2.73Å; D333-L335 VanDerWaalsContact C-N 3.35Å; D333-L335 PolarHBondContact O-N 3.36Å; D333-I336 PolarHBondContact O-N 2.98Å; D333-R337 WeakPolarHBondContact O-CB 3.44Å; D333-R337 VanDerWaalsContact O-CG 3.24Å; D333-R337 WeakPolarHBondContact O-CG 3.46Å; D333-R337 PolarHBondContact O-N 3.19Å; D333-R337 IonicContact OD1-NE 3.82Å; D333-R337 PolarHBondContact OD1-NE 3.07Å; D333-R337 WeakPolarHBondContact OD2-CD 3.32Å; D333-R337 IonicContact OD2-CZ 3.77Å; D333-R337 IonicContact OD2-NE 2.91Å; D333-R337 PolarHBondContact OD2-NE 2.96Å; D333-R337 IonicContact OD2-NH2 3.35Å; D333-V490 HydrophobicContact CB-CG1 4.49Å; D333-V490 HydrophobicContact CB-CG2 4.03Å
334	K	96.7	Very high	95.3	Very high	12 Å²	12	28 Å²	28	5%	0.052	14%	0.143	C	C	.	.	H	α-helix	trans	-59.7	-44.2	175.1	-76.1	171.5	173	169.2	0	111.8	F289 D330 R337 T338 A368 L370	F289-K334 HydrophobicContact CB-CD 3.85Å; F289-K334 HydrophobicContact CB-CG 4.48Å; F289-K334 HydrophobicContact CD1-CD 4.32Å; F289-K334 HydrophobicContact CD1-CG 4.13Å; F289-K334 HydrophobicContact CD2-CB 3.58Å; F289-K334 HydrophobicContact CD2-CD 3.73Å; F289-K334 HydrophobicContact CD2-CG 3.52Å; F289-K334 HydrophobicContact CE1-CG 4.25Å; F289-K334 HydrophobicContact CE2-CB 3.49Å; F289-K334 VanDerWaalsContact CE2-CB 3.49Å; F289-K334 HydrophobicContact CE2-CD 4.38Å; F289-K334 HydrophobicContact CE2-CG 3.66Å; F289-K334 HydrophobicContact CG-CB 4.35Å; F289-K334 HydrophobicContact CG-CD 3.7Å; F289-K334 HydrophobicContact CG-CG 3.78Å; F289-K334 HydrophobicContact CZ-CB 4.2Å; F289-K334 HydrophobicContact CZ-CG 4.04Å; D330-K334 WeakPolarHBondContact O-CB 3.23Å; D330-K334 VanDerWaalsContact O-CG 3.28Å; D330-K334 WeakPolarHBondContact O-CG 3.25Å; D330-K334 PolarHBondContact O-N 3.5Å; D330-K334 VanDerWaalsContact OD1-CE 3.27Å; D330-K334 WeakPolarHBondContact OD1-CE 3.47Å; D330-K334 IonicContact OD1-NZ 3.93Å; D330-K334 PolarHBondContact OD1-NZ 2.9Å; D330-K334 WeakPolarHBondContact OD2-CE 3.43Å; D330-K334 IonicContact OD2-NZ 2.8Å; D330-K334 PolarHBondContact OD2-NZ 2.86Å; K334-R337 PolarHBondContact O-N 3.2Å; K334-T338 WeakPolarHBondContact O-CB 3.37Å; K334-T338 PolarHBondContact O-N 2.8Å; K334-T338 PolarHBondContact O-OG1 3.42Å; K334-A368 WeakPolarHBondContact CD-O 3.23Å; K334-A368 WeakPolarHBondContact CE-O 3.14Å; K334-A368 PolarHBondContact NZ-O 3.45Å; K334-L370 HydrophobicContact CB-CD1 3.81Å; K334-L370 HydrophobicContact CB-CG 4.33Å
335	L	96.5	Very high	95.2	Very high	1 Å²	1	28 Å²	28	1%	0.005	14%	0.142	C	C	.	.	H	α-helix	trans	-59.8	-50.8	178	-172.4	77.9	0	0	0	111.4	I315 T331 A332 D333 R337 T338 F339 V358 L370 I482	I315-L335 HydrophobicContact CD1-CB 4.35Å; I315-L335 HydrophobicContact CD1-CD1 3.55Å; I315-L335 HydrophobicContact CD1-CD2 3.79Å; I315-L335 HydrophobicContact CD1-CG 4.1Å; T331-L335 WeakPolarHBondContact O-CB 3.48Å; T331-L335 PolarHBondContact O-N 3.09Å; A332-L335 WeakPolarHBondContact O-CB 3.34Å; A332-L335 PolarHBondContact O-N 3.03Å; D333-L335 VanDerWaalsContact C-N 3.35Å; D333-L335 PolarHBondContact O-N 3.36Å; L335-R337 VanDerWaalsContact C-N 3.33Å; L335-R337 PolarHBondContact O-N 3.41Å; L335-T338 PolarHBondContact O-N 3.04Å; L335-F339 HydrophobicContact CD1-CD2 4.1Å; L335-F339 HydrophobicContact CD1-CE2 3.51Å; L335-F339 HydrophobicContact CG-CD2 4.09Å; L335-F339 HydrophobicContact CG-CE2 3.99Å; L335-F339 VanDerWaalsContact O-CD2 3.24Å; L335-F339 WeakPolarHBondContact O-CD2 3.35Å; L335-F339 PolarHBondContact O-N 3.34Å; L335-V358 HydrophobicContact CD1-CG1 4.11Å; L335-L370 HydrophobicContact CB-CD1 4.18Å; L335-L370 HydrophobicContact CD1-CD1 4.26Å; L335-I482 HydrophobicContact CD2-CB 3.8Å; L335-I482 HydrophobicContact CD2-CD1 4.01Å; L335-I482 HydrophobicContact CD2-CG2 3.42Å; L335-I482 VanDerWaalsContact CD2-CG2 3.42Å
336	I	95.4	Very high	95.2	Very high	1 Å²	1	26.3 Å²	26.3	1%	0.005	12%	0.121	C	C	.	.	H	α-helix	trans	-62.8	-42.8	-178.9	-64.9	160.2	0	0	0	110	A332 D333 A340 V479 V490 R492 V495 M496	A332-I336 WeakPolarHBondContact O-CD1 3.22Å; A332-I336 VanDerWaalsContact O-CG1 3.25Å; A332-I336 WeakPolarHBondContact O-CG1 3.44Å; A332-I336 PolarHBondContact O-N 2.92Å; D333-I336 PolarHBondContact O-N 2.98Å; I336-A340 WeakPolarHBondContact O-CB 3.23Å; I336-A340 PolarHBondContact O-N 2.91Å; I336-V479 HydrophobicContact CG1-CG1 3.81Å; I336-V490 HydrophobicContact CD1-CB 3.92Å; I336-V490 HydrophobicContact CD1-CG1 3.67Å; I336-R492 HydrophobicContact CD1-CB 3.79Å; I336-R492 HydrophobicContact CG1-CB 4.37Å; I336-R492 HydrophobicContact CG2-CB 4.45Å; I336-V495 HydrophobicContact CB-CG1 4.29Å; I336-V495 HydrophobicContact CG2-CB 4.03Å; I336-V495 HydrophobicContact CG2-CG1 3.62Å; I336-M496 HydrophobicContact CG2-CG 3.73Å
337	R	95.9	Very high	95	Very high	112 Å²	112	25.9 Å²	25.9	42%	0.423	12%	0.118	S	C	.	.	H	α-helix	trans	-61.8	-45.1	177.1	-75.5	172	176.5	-125.8	1.1	112.5	D333 K334 L335 F339 A340 E341 V495	D333-R337 WeakPolarHBondContact O-CB 3.44Å; D333-R337 VanDerWaalsContact O-CG 3.24Å; D333-R337 WeakPolarHBondContact O-CG 3.46Å; D333-R337 PolarHBondContact O-N 3.19Å; D333-R337 IonicContact OD1-NE 3.82Å; D333-R337 PolarHBondContact OD1-NE 3.07Å; D333-R337 WeakPolarHBondContact OD2-CD 3.32Å; D333-R337 IonicContact OD2-CZ 3.77Å; D333-R337 IonicContact OD2-NE 2.91Å; D333-R337 PolarHBondContact OD2-NE 2.96Å; D333-R337 IonicContact OD2-NH2 3.35Å; K334-R337 PolarHBondContact O-N 3.2Å; L335-R337 VanDerWaalsContact C-N 3.33Å; L335-R337 PolarHBondContact O-N 3.41Å; R337-F339 PolarHBondContact O-N 2.97Å; R337-A340 PolarHBondContact O-N 3.21Å; R337-E341 WeakPolarHBondContact O-CB 3.46Å; R337-E341 PolarHBondContact O-N 2.96Å; R337-V495 HydrophobicContact CG-CG1 4.09Å
338	T	96.4	Very high	95	Very high	0 Å²	0	23.4 Å²	23.4	0%	0	10%	0.1	C	C	.	.	H	α-helix	trans	-56.3	-52	178.6	-64.7	0	0	0	0	111.6	L284 F289 V290 K334 L335 E341 Q342 L372	L284-T338 HydrophobicContact CD1-CG2 3.76Å; F289-T338 WeakPolarHBondContact CE2-OG1 3.36Å; V290-T338 HydrophobicContact CG2-CG2 4.09Å; V290-T338 VanDerWaalsContact CG2-OG1 3.25Å; V290-T338 WeakPolarHBondContact CG2-OG1 3.4Å; K334-T338 WeakPolarHBondContact O-CB 3.37Å; K334-T338 PolarHBondContact O-N 2.8Å; K334-T338 PolarHBondContact O-OG1 3.42Å; L335-T338 PolarHBondContact O-N 3.04Å; T338-E341 PolarHBondContact O-N 2.79Å; T338-Q342 PolarHBondContact O-N 3.47Å; T338-L372 HydrophobicContact CG2-CD1 4.26Å
339	F	95.8	Very high	94.9	Very high	2 Å²	2	22 Å²	22	1%	0.009	9%	0.092	C	C	.	.	H	α-helix	trans	-76.2	-30.1	-178.2	-67	-61.5	0	0	0	113	L335 R337 E341 Q342 I343 H350 P353 L372 N475 V479	L335-F339 HydrophobicContact CD1-CD2 4.1Å; L335-F339 HydrophobicContact CD1-CE2 3.51Å; L335-F339 HydrophobicContact CG-CD2 4.09Å; L335-F339 HydrophobicContact CG-CE2 3.99Å; L335-F339 VanDerWaalsContact O-CD2 3.24Å; L335-F339 WeakPolarHBondContact O-CD2 3.35Å; L335-F339 PolarHBondContact O-N 3.34Å; R337-F339 PolarHBondContact O-N 2.97Å; F339-E341 VanDerWaalsContact C-N 3.34Å; F339-Q342 VanDerWaalsContact CD1-OE1 3.23Å; F339-Q342 PolarHBondContact O-N 3.06Å; F339-I343 VanDerWaalsContact O-CG1 3.28Å; F339-I343 WeakPolarHBondContact O-CG1 3.28Å; F339-I343 PolarHBondContact O-N 2.95Å; F339-H350 HydrophobicContact CE1-CB 4.05Å; F339-H350 AromaticContact CE1-CD2 3.96Å; F339-P353 HydrophobicContact CD1-CB 4.36Å; F339-P353 HydrophobicContact CD1-CG 4.48Å; F339-P353 HydrophobicContact CD2-CB 4.45Å; F339-P353 HydrophobicContact CE1-CB 3.54Å; F339-P353 HydrophobicContact CE1-CG 4.12Å; F339-P353 HydrophobicContact CE2-CB 3.61Å; F339-P353 HydrophobicContact CE2-CG 4.17Å; F339-P353 HydrophobicContact CZ-CB 3.12Å; F339-P353 HydrophobicContact CZ-CG 3.97Å; F339-L372 HydrophobicContact CZ-CD2 4.27Å; F339-N475 VanDerWaalsContact CD1-ND2 3.26Å; F339-N475 WeakPolarHBondContact CD1-ND2 3.48Å; F339-V479 HydrophobicContact CB-CG2 3.92Å; F339-V479 HydrophobicContact CD2-CG2 3.46Å; F339-V479 VanDerWaalsContact CD2-CG2 3.46Å; F339-V479 HydrophobicContact CE2-CG2 4.26Å; F339-V479 HydrophobicContact CG-CG2 3.85Å
340	A	95	Very high	94.8	Very high	0 Å²	0	14 Å²	14	0%	0	6%	0.062	C	C	.	.	H	α-helix	trans	-63.2	-39.8	171.2	0	0	0	0	0	111.7	I336 R337 I343 F344 M496	I336-A340 WeakPolarHBondContact O-CB 3.23Å; I336-A340 PolarHBondContact O-N 2.91Å; R337-A340 PolarHBondContact O-N 3.21Å; A340-I343 PolarHBondContact O-N 3.29Å; A340-F344 HydrophobicContact CB-CD2 3.93Å; A340-F344 HydrophobicContact CB-CE2 4.04Å; A340-F344 WeakPolarHBondContact O-CB 3.48Å; A340-F344 WeakPolarHBondContact O-CD2 3.41Å; A340-F344 PolarHBondContact O-N 3.22Å; A340-M496 HydrophobicContact CB-CG 4.29Å
341	E	95	Very high	94.2	Very high	6 Å²	6	12.2 Å²	12.2	3%	0.028	5%	0.053	C	C	.	.	H	α-helix	trans	-61.2	-44.5	175.1	-168.8	77.3	-169.3	0	0	111.2	L284 H286 F287 R337 T338 F339 Y345 T346 R506	L284-E341 HydrophobicContact CD2-CG 4.4Å; H286-E341 IonicContact CE1-OE1 2.71Å; H286-E341 IonicContact NE2-OE1 3.08Å; H286-E341 PolarHBondContact NE2-OE1 3.02Å; F287-E341 HydrophobicContact CE2-CB 3.6Å; F287-E341 HydrophobicContact CE2-CG 3.81Å; F287-E341 HydrophobicContact CZ-CB 4.01Å; F287-E341 HydrophobicContact CZ-CG 4.06Å; R337-E341 WeakPolarHBondContact O-CB 3.46Å; R337-E341 PolarHBondContact O-N 2.96Å; T338-E341 PolarHBondContact O-N 2.79Å; F339-E341 VanDerWaalsContact C-N 3.34Å; E341-Y345 HydrophobicContact CG-CD1 4.36Å; E341-Y345 WeakPolarHBondContact O-CA 3.28Å; E341-Y345 WeakPolarHBondContact O-CB 3.29Å; E341-Y345 PolarHBondContact O-N 3.46Å; E341-Y345 WeakPolarHBondContact OE1-CD1 3.35Å; E341-T346 HydrophobicContact CG-CG2 4.42Å; E341-T346 PolarHBondContact O-N 3.33Å; E341-T346 VanDerWaalsContact O-N 3.09Å; E341-R506 IonicContact OE1-NH1 3.54Å; E341-R506 PolarHBondContact OE1-NH1 2.85Å; E341-R506 IonicContact OE2-NH1 3.49Å
342	Q	95.5	Very high	93.4	Very high	0 Å²	0	13.1 Å²	13.1	0%	0	6%	0.058	C	C	.	.	I	π-helix	trans	-61.8	-44.2	175.9	-74.2	-175.8	-30	0	0	112.6	C280 L284 T338 F339 G347 F348	C280-Q342 PolarHBondContact SG-NE2 2.94Å; L284-Q342 HydrophobicContact CD2-CG 4.3Å; T338-Q342 PolarHBondContact O-N 3.47Å; F339-Q342 VanDerWaalsContact CD1-OE1 3.23Å; F339-Q342 PolarHBondContact O-N 3.06Å; Q342-G347 VanDerWaalsContact O-CA 3.23Å; Q342-G347 WeakPolarHBondContact O-CA 3.35Å; Q342-G347 PolarHBondContact O-N 3.32Å; Q342-F348 WeakPolarHBondContact CB-O 3.49Å; Q342-F348 WeakPolarHBondContact CG-O 3.37Å
343	I	94.6	Very high	92.7	Very high	1 Å²	1	13.1 Å²	13.1	1%	0.005	6%	0.058	C	C	.	.	I	π-helix	trans	-68.9	-48.6	-179.1	-67.9	166.5	0	0	0	111.6	F339 A340 I349 L389 V472 N475 I476 M496	F339-I343 VanDerWaalsContact O-CG1 3.28Å; F339-I343 WeakPolarHBondContact O-CG1 3.28Å; F339-I343 PolarHBondContact O-N 2.95Å; A340-I343 PolarHBondContact O-N 3.29Å; I343-I349 HydrophobicContact CG1-CD1 4.27Å; I343-I349 HydrophobicContact CG1-CG2 4.11Å; I343-L389 HydrophobicContact CG2-CD2 3.66Å; I343-V472 HydrophobicContact CD1-CG1 4.38Å; I343-V472 HydrophobicContact CG2-CG1 4.19Å; I343-N475 WeakPolarHBondContact CD1-OD1 3.46Å; I343-I476 HydrophobicContact CD1-CG1 4.14Å; I343-M496 HydrophobicContact CD1-CE 4.1Å
344	F	94.1	Very high	92.1	Very high	0 Å²	0	15.1 Å²	15.1	0%	0	7%	0.066	C	C	.	.	I	π-helix	trans	-96.9	-27	-166.3	-62.2	-57.6	0	0	0	114.3	A340 L389 C390 W393 M496 A500 C503	A340-F344 HydrophobicContact CB-CD2 3.93Å; A340-F344 HydrophobicContact CB-CE2 4.04Å; A340-F344 WeakPolarHBondContact O-CB 3.48Å; A340-F344 WeakPolarHBondContact O-CD2 3.41Å; A340-F344 PolarHBondContact O-N 3.22Å; F344-L389 HydrophobicContact CD1-CG 4.44Å; F344-L389 HydrophobicContact CE1-CD2 4.27Å; F344-L389 HydrophobicContact CE1-CG 4.04Å; F344-C390 VanDerWaalsContact CB-SG 3.6Å; F344-C390 VanDerWaalsContact CD1-SG 3.56Å; F344-W393 HydrophobicContact CE1-CB 4.26Å; F344-W393 HydrophobicContact CE1-CD2 4.29Å; F344-W393 HydrophobicContact CE1-CE3 4.08Å; F344-W393 HydrophobicContact CE1-CG 4.36Å; F344-W393 HydrophobicContact CZ-CB 4.39Å; F344-W393 AromaticContact CZ-CD2 3.75Å; F344-W393 HydrophobicContact CZ-CD2 3.75Å; F344-W393 AromaticContact CZ-CE3 3.74Å; F344-W393 HydrophobicContact CZ-CE3 3.74Å; F344-W393 HydrophobicContact CZ-CG 4.02Å; F344-W393 HydrophobicContact CZ-CZ3 4.32Å; F344-M496 HydrophobicContact CE2-CB 3.96Å; F344-M496 HydrophobicContact CE2-CE 3.85Å; F344-M496 HydrophobicContact CE2-CG 4.49Å; F344-M496 WeakPolarHBondContact CE2-O 3.45Å; F344-M496 HydrophobicContact CZ-CB 4.38Å; F344-M496 HydrophobicContact CZ-CE 3.98Å; F344-A500 HydrophobicContact CD1-CB 3.81Å; F344-A500 HydrophobicContact CD2-CB 4Å; F344-A500 HydrophobicContact CE1-CB 3.89Å; F344-A500 HydrophobicContact CE2-CB 4.11Å; F344-A500 HydrophobicContact CG-CB 3.88Å; F344-A500 HydrophobicContact CZ-CB 4.05Å; F344-C503 HydrophobicContact CB-CB 3.81Å
345	Y	91.8	Very high	91.4	Very high	50 Å²	50	15.3 Å²	15.3	20%	0.196	7%	0.068	C	C	.	.	I	π-helix	trans	-106.9	-69.5	-178.4	-176.4	-124.3	0	0	0	112.1	E341 G347 R386 R506 L507 E510	E341-Y345 HydrophobicContact CG-CD1 4.36Å; E341-Y345 WeakPolarHBondContact O-CA 3.28Å; E341-Y345 WeakPolarHBondContact O-CB 3.29Å; E341-Y345 PolarHBondContact O-N 3.46Å; E341-Y345 WeakPolarHBondContact OE1-CD1 3.35Å; Y345-G347 PolarHBondContact O-N 3.27Å; Y345-R386 PolarHBondContact O-NE 3.18Å; Y345-R386 PolarHBondContact O-NH2 3.32Å; Y345-R506 HydrophobicContact CD2-CB 4.14Å; Y345-R506 HydrophobicContact CE2-CB 3.71Å; Y345-L507 HydrophobicContact CD2-CD2 4.17Å; Y345-L507 HydrophobicContact CD2-CG 4.23Å; Y345-L507 HydrophobicContact CE2-CD2 4.36Å; Y345-E510 PolarHBondContact OH-OE1 3.02Å; Y345-E510 PolarHBondContact OH-OE2 3.46Å
346	T	93	Very high	90.8	Very high	19 Å²	19	16.4 Å²	16.4	12%	0.117	8%	0.08	C	C	.	.	I	π-helix	trans	-71.9	-34.7	-169.4	83.6	0	0	0	0	111.7	E283 E341 F348	E283-T346 HydrophobicContact CB-CG2 4.14Å; E283-T346 WeakPolarHBondContact OE2-CB 3.48Å; E283-T346 PolarHBondContact OE2-OG1 2.91Å; E341-T346 HydrophobicContact CG-CG2 4.42Å; E341-T346 PolarHBondContact O-N 3.33Å; E341-T346 VanDerWaalsContact O-N 3.09Å; T346-F348 PolarHBondContact O-N 2.95Å; T346-F348 PolarHBondContact OG1-N 3.06Å; T346-F348 VanDerWaalsContact OG1-N 3.17Å
347	G	93.3	Very high	90.5	Very high	0 Å²	0	18 Å²	18	0%	0	9%	0.088	C	C	.	.			trans	75.7	1.7	-175.5	0	0	0	0	0	114.5	Q342 Y345 Y380 L381	Q342-G347 VanDerWaalsContact O-CA 3.23Å; Q342-G347 WeakPolarHBondContact O-CA 3.35Å; Q342-G347 PolarHBondContact O-N 3.32Å; Y345-G347 PolarHBondContact O-N 3.27Å; G347-Y380 CarbonylContact O-C 3.51Å; G347-Y380 VanDerWaalsContact O-CA 3.29Å; G347-Y380 WeakPolarHBondContact O-CA 3.47Å; G347-Y380 WeakPolarHBondContact O-CD2 3.5Å; G347-L381 PolarHBondContact O-N 3.39Å
348	F	95.5	Very high	90.4	Very high	10 Å²	10	12.7 Å²	12.7	4%	0.044	7%	0.068	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.8	92.3	176.4	-173.3	-124.2	0	0	0	108.5	N276 R279 C280 E283 Q342 T346 Y378	N276-F348 HydrophobicContact CB-CZ 4Å; R279-F348 HydrophobicContact CB-CE1 4.01Å; R279-F348 HydrophobicContact CB-CZ 4.47Å; R279-F348 HydrophobicContact CG-CD1 3.97Å; R279-F348 HydrophobicContact CG-CE1 3.81Å; R279-F348 HydrophobicContact CG-CZ 4.36Å; C280-F348 HydrophobicContact CB-CE1 4.5Å; E283-F348 WeakPolarHBondContact OE2-CB 3.26Å; Q342-F348 WeakPolarHBondContact CB-O 3.49Å; Q342-F348 WeakPolarHBondContact CG-O 3.37Å; T346-F348 PolarHBondContact O-N 2.95Å; T346-F348 PolarHBondContact OG1-N 3.06Å; T346-F348 VanDerWaalsContact OG1-N 3.17Å; F348-Y378 AromaticContact CD1-CD1 3.46Å; F348-Y378 HydrophobicContact CD1-CD1 3.46Å; F348-Y378 VanDerWaalsContact CD1-CD1 3.46Å; F348-Y378 AromaticContact CD1-CE1 3.51Å; F348-Y378 HydrophobicContact CD1-CE1 3.51Å; F348-Y378 HydrophobicContact CD1-CG 4.47Å; F348-Y378 AromaticContact CD2-CD1 3.78Å; F348-Y378 HydrophobicContact CD2-CD1 3.78Å; F348-Y378 HydrophobicContact CD2-CG 4.38Å; F348-Y378 AromaticContact CE1-CD1 3.21Å; F348-Y378 HydrophobicContact CE1-CD1 3.21Å; F348-Y378 AromaticContact CE1-CE1 3.32Å; F348-Y378 HydrophobicContact CE1-CE1 3.32Å; F348-Y378 AromaticContact CE1-CG 3.86Å; F348-Y378 HydrophobicContact CE1-CG 3.86Å; F348-Y378 AromaticContact CE2-CD1 3.56Å; F348-Y378 HydrophobicContact CE2-CD1 3.56Å; F348-Y378 HydrophobicContact CE2-CE1 4.49Å; F348-Y378 AromaticContact CE2-CG 3.76Å; F348-Y378 HydrophobicContact CE2-CG 3.76Å; F348-Y378 AromaticContact CG-CD1 3.73Å; F348-Y378 HydrophobicContact CG-CD1 3.73Å; F348-Y378 HydrophobicContact CG-CE1 4.18Å; F348-Y378 AromaticContact CZ-CD1 3.26Å; F348-Y378 HydrophobicContact CZ-CD1 3.26Å; F348-Y378 HydrophobicContact CZ-CD2 4.22Å; F348-Y378 AromaticContact CZ-CE1 3.86Å; F348-Y378 HydrophobicContact CZ-CE1 3.86Å; F348-Y378 AromaticContact CZ-CG 3.45Å; F348-Y378 HydrophobicContact CZ-CG 3.45Å; F348-Y378 VanDerWaalsContact CZ-CG 3.45Å
349	I	92.3	Very high	90.3	Very high	2 Å²	2	13.6 Å²	13.6	1%	0.01	7%	0.073	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	116.9	-161.5	-54.3	-177.6	0	0	0	108.9	I343 A351 Y378 E379 L381 V472 N475	I343-I349 HydrophobicContact CG1-CD1 4.27Å; I343-I349 HydrophobicContact CG1-CG2 4.11Å; I349-A351 PolarHBondContact O-N 3.4Å; I349-Y378 VanDerWaalsContact O-CA 3.31Å; I349-Y378 WeakPolarHBondContact O-CA 3.38Å; I349-E379 PolarHBondContact N-O 2.97Å; I349-E379 PolarHBondContact O-N 3.17Å; I349-L381 HydrophobicContact CD1-CB 3.71Å; I349-L381 HydrophobicContact CD1-CD2 4.07Å; I349-V472 HydrophobicContact CD1-CG2 3.49Å; I349-V472 VanDerWaalsContact CD1-CG2 3.49Å; I349-N475 HydrophobicContact CG2-CB 4.4Å
350	H	92.1	Very high	90.4	Very high	3 Å²	3	13.5 Å²	13.5	1%	0.014	7%	0.072	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.8	112.3	168.2	-176.8	5.7	0	0	0	108.9	F339 D352 D374 L377 Y378 N475	F339-H350 HydrophobicContact CE1-CB 4.05Å; F339-H350 AromaticContact CE1-CD2 3.96Å; H350-D352 PolarHBondContact CE1-O 2.89Å; H350-D352 PolarHBondContact ND1-N 3.35Å; H350-D352 PolarHBondContact O-N 3.31Å; H350-D374 PolarHBondContact CE1-O 3.04Å; H350-D374 PolarHBondContact NE2-O 3.32Å; H350-D374 VanDerWaalsContact NE2-O 3.1Å; H350-L377 PolarHBondContact ND1-O 2.98Å; H350-Y378 HydrophobicContact CB-CD1 4.34Å; H350-Y378 HydrophobicContact CB-CE1 3.74Å; H350-Y378 HydrophobicContact CB-CE2 4.12Å; H350-Y378 AromaticContact CG-CZ 3.95Å; H350-N475 PolarHBondContact O-ND2 3.31Å
351	A	81.8	Confident	90.4	Very high	0 Å²	0	16.6 Å²	16.6	0%	0	8%	0.084	C	C	.	.	S	Bend	trans	-81.2	-15.9	-171	0	0	0	0	0	114.4	I349 L377 L471 R474	I349-A351 PolarHBondContact O-N 3.4Å; A351-L377 HydrophobicContact CB-CB 4.37Å; A351-L377 HydrophobicContact CB-CD2 3.68Å; A351-L377 HydrophobicContact CB-CG 3.66Å; A351-L377 PolarHBondContact N-O 3.42Å; A351-L471 HydrophobicContact CB-CB 3.64Å; A351-L471 HydrophobicContact CB-CD1 3.37Å; A351-L471 HydrophobicContact CB-CD2 4.12Å; A351-L471 HydrophobicContact CB-CG 3.9Å; A351-R474 WeakPolarHBondContact O-CD 3.43Å; A351-R474 VanDerWaalsContact O-CG 3.23Å; A351-R474 WeakPolarHBondContact O-CG 3.33Å
352	D	79.4	Confident	90.5	Very high	20 Å²	20	22 Å²	22	11%	0.107	11%	0.105	C	C	.	.			trans	-137.3	63	-171.6	-162	34.2	0	0	0	113.3	H350 H354 L377 R474	H350-D352 PolarHBondContact CE1-O 2.89Å; H350-D352 PolarHBondContact ND1-N 3.35Å; H350-D352 PolarHBondContact O-N 3.31Å; D352-H354 PolarHBondContact O-N 3Å; D352-L377 HydrophobicContact CB-CD2 4.45Å; D352-R474 VanDerWaalsContact CG-CZ 3.49Å; D352-R474 IonicContact OD1-CZ 2.75Å; D352-R474 VanDerWaalsContact OD1-CZ 3.28Å; D352-R474 IonicContact OD1-NE 2.63Å; D352-R474 PolarHBondContact OD1-NE 3.37Å; D352-R474 VanDerWaalsContact OD1-NE 3.1Å; D352-R474 IonicContact OD1-NH2 3.43Å; D352-R474 PolarHBondContact OD1-NH2 3.46Å; D352-R474 IonicContact OD2-CZ 2.81Å; D352-R474 IonicContact OD2-NH2 2.7Å; D352-R474 PolarHBondContact OD2-NH2 2.95Å
353	P	81.9	Confident	90.4	Very high	0 Å²	0	22.3 Å²	22.3	0%	0	11%	0.107	C	C	.	.			trans	-78.1	51	180	36.3	-38.3	0	0	0	111.7	F339 T478 V479 I482	F339-P353 HydrophobicContact CD1-CB 4.36Å; F339-P353 HydrophobicContact CD1-CG 4.48Å; F339-P353 HydrophobicContact CD2-CB 4.45Å; F339-P353 HydrophobicContact CE1-CB 3.54Å; F339-P353 HydrophobicContact CE1-CG 4.12Å; F339-P353 HydrophobicContact CE2-CB 3.61Å; F339-P353 HydrophobicContact CE2-CG 4.17Å; F339-P353 HydrophobicContact CZ-CB 3.12Å; F339-P353 HydrophobicContact CZ-CG 3.97Å; P353-T478 HydrophobicContact CG-CG2 3.86Å; P353-T478 WeakPolarHBondContact O-CG2 3.42Å; P353-V479 HydrophobicContact CG-CG2 4.43Å; P353-I482 WeakPolarHBondContact O-CD1 3.43Å
354	H	81.9	Confident	90.2	Very high	78 Å²	78	28.2 Å²	28.2	36%	0.361	15%	0.146	S	C	.	.			trans	-52.6	144.2	-176.3	-175.3	-96.3	0	0	0	110.5	D352 G356 N357	D352-H354 PolarHBondContact O-N 3Å; H354-G356 PolarHBondContact ND1-N 3.4Å; H354-G356 VanDerWaalsContact ND1-N 3.18Å; H354-G356 PolarHBondContact O-N 3.35Å; H354-N357 WeakPolarHBondContact O-CB 3.5Å; H354-N357 PolarHBondContact O-N 2.94Å
355	P	82.3	Confident	90.2	Very high	17 Å²	17	32.6 Å²	32.6	11%	0.11	17%	0.169	C	C	.	.	G	3₁₀ helix	trans	-55.4	-24.5	-177.9	-21.8	26.7	0	0	0	114.7	I315 N316 N357 I482	I315-P355 HydrophobicContact CG2-CB 3.97Å; N316-P355 HydrophobicContact CB-CB 3.99Å; P355-N357 VanDerWaalsContact C-N 3.3Å; P355-I482 HydrophobicContact CB-CG1 4.3Å; P355-I482 HydrophobicContact CG-CD1 4.22Å; P355-I482 HydrophobicContact CG-CG1 3.76Å
356	G	82.9	Confident	90.2	Very high	24 Å²	24	37.5 Å²	37.5	25%	0.247	19%	0.192	C	C	.	.	G	3₁₀ helix	trans	-70.7	-20.5	174	0	0	0	0	0	114.9	H354	H354-G356 PolarHBondContact ND1-N 3.4Å; H354-G356 VanDerWaalsContact ND1-N 3.18Å; H354-G356 PolarHBondContact O-N 3.35Å
357	N	88.9	Confident	90.3	Very high	34 Å²	34	42 Å²	42	18%	0.182	21%	0.21	C	C	.	.	G	3₁₀ helix	trans	-101.7	1.8	-174.6	-65.4	-16	0	0	0	112.9	H354 P355 L373 D374	H354-N357 WeakPolarHBondContact O-CB 3.5Å; H354-N357 PolarHBondContact O-N 2.94Å; P355-N357 VanDerWaalsContact C-N 3.3Å; N357-L373 PolarHBondContact O-N 3.39Å; N357-D374 HydrophobicContact CB-CB 3.7Å; N357-D374 WeakPolarHBondContact ND2-CB 3.44Å; N357-D374 PolarHBondContact ND2-OD2 3.4Å
358	V	93.9	Very high	90.4	Very high	0 Å²	0	42 Å²	42	0%	0	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	114.5	177.5	-174.4	0	0	0	0	109.1	I315 L335 V371 L372	I315-V358 HydrophobicContact CB-CB 4.25Å; I315-V358 HydrophobicContact CB-CG1 4.19Å; I315-V358 HydrophobicContact CD1-CG1 3.84Å; I315-V358 HydrophobicContact CG2-CB 3.99Å; I315-V358 HydrophobicContact CG2-CG1 4.41Å; I315-V358 PolarHBondContact N-O 3.31Å; L335-V358 HydrophobicContact CD1-CG1 4.11Å; V358-V371 WeakPolarHBondContact CA-O 3.46Å; V358-L372 HydrophobicContact CG1-CD2 4.2Å; V358-L372 HydrophobicContact CG2-CD2 4.04Å
359	L	95.8	Very high	90.5	Very high	19 Å²	19	42.3 Å²	42.3	10%	0.099	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.1	153.7	171.1	-51	178.8	0	0	0	110.8	C313 K314 L370 V371 L373	C313-L359 CarbonylContact O-C 3.56Å; C313-L359 VanDerWaalsContact O-CA 3.26Å; C313-L359 WeakPolarHBondContact O-CA 3.27Å; K314-L359 HydrophobicContact CG-CD2 4.33Å; L359-L370 WeakPolarHBondContact O-CA 3.45Å; L359-V371 HydrophobicContact CB-CB 4.1Å; L359-V371 HydrophobicContact CB-CG2 4.47Å; L359-V371 PolarHBondContact N-O 3.07Å; L359-V371 PolarHBondContact O-N 3.48Å; L359-L373 HydrophobicContact CD1-CD1 3.86Å; L359-L373 HydrophobicContact CD1-CD2 4.27Å; L359-L373 HydrophobicContact CD1-CG 4.39Å; L359-L373 HydrophobicContact CD2-CD1 4.21Å; L359-L373 HydrophobicContact CG-CD1 3.76Å; L359-L373 HydrophobicContact CG-CG 4.26Å
360	V	97.3	Very high	90.8	Very high	0 Å²	0	42.2 Å²	42.2	0%	0	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	128	173.7	-175.4	0	0	0	0	107.6	C313 I315 I321 L326 T331 A368 E369 L370	C313-V360 PolarHBondContact N-O 2.82Å; C313-V360 PolarHBondContact O-N 3.22Å; C313-V360 PolarHBondContact SG-O 3.38Å; I315-V360 HydrophobicContact CB-CG2 3.9Å; I315-V360 HydrophobicContact CD1-CG2 4.3Å; I315-V360 HydrophobicContact CG1-CG2 3.86Å; I321-V360 HydrophobicContact CD1-CB 4.45Å; I321-V360 HydrophobicContact CD1-CG2 4.22Å; I321-V360 HydrophobicContact CG1-CB 4.3Å; I321-V360 HydrophobicContact CG1-CG1 4.3Å; L326-V360 HydrophobicContact CD1-CG1 3.9Å; T331-V360 HydrophobicContact CG2-CG1 4.14Å; T331-V360 HydrophobicContact CG2-CG2 3.67Å; V360-A368 HydrophobicContact CG1-CB 4.15Å; V360-E369 WeakPolarHBondContact CA-O 3.34Å; V360-L370 HydrophobicContact CG2-CD2 4.04Å
361	R	95.9	Very high	91	Very high	65 Å²	65	42 Å²	42	25%	0.245	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.4	169.4	172.4	71.4	-175.6	-173.7	-171.4	-0.9	110.7	E311 G363 E369 V371	E311-R361 VanDerWaalsContact O-CD 3.27Å; E311-R361 WeakPolarHBondContact O-CD 3.41Å; R361-G363 PolarHBondContact O-N 2.91Å; R361-E369 HydrophobicContact CG-CB 4.17Å; R361-E369 IonicContact CZ-OE2 3.74Å; R361-E369 PolarHBondContact N-O 3.27Å; R361-E369 IonicContact NE-OE2 2.75Å; R361-E369 PolarHBondContact NE-OE2 3.32Å; R361-E369 IonicContact NH2-OE2 3.72Å; R361-E369 PolarHBondContact NH2-OE2 3.37Å; R361-E369 PolarHBondContact O-N 2.93Å; R361-V371 HydrophobicContact CG-CG2 4.37Å
362	R	95.7	Very high	91.7	Very high	121 Å²	121	42.1 Å²	42.1	46%	0.457	21%	0.21	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.8	114.6	173.9	-180	175.5	-85.8	-115.5	-2.8	109.6	Q324 L326	Q324-R362 PolarHBondContact O-NE 3.03Å; Q324-R362 PolarHBondContact O-NH2 3.09Å; L326-R362 HydrophobicContact CD2-CB 4.21Å; L326-R362 HydrophobicContact CD2-CG 4.34Å
363	G	93.4	Very high	92.4	Very high	6 Å²	6	44.3 Å²	44.3	6%	0.062	22%	0.222	C	C	.	.			trans	-74.5	172.7	176.1	0	0	0	0	0	113.2	R361 D365 K366 K367	R361-G363 PolarHBondContact O-N 2.91Å; G363-D365 PolarHBondContact O-N 2.84Å; G363-K366 WeakPolarHBondContact O-CA 3.26Å; G363-K366 PolarHBondContact O-N 3.34Å; G363-K367 PolarHBondContact N-O 2.91Å
364	P	91.4	Very high	92.7	Very high	124 Å²	124	45.9 Å²	45.9	81%	0.805	23%	0.23	S	C	*	.	T	Hydrogen-bonded Turn	trans	-59.6	-28.6	179.4	-23.6	33.8	0	0	0	113.7	K366 E369	P364-K366 PolarHBondContact O-N 3.26Å; P364-E369 WeakPolarHBondContact CD-OE1 3.24Å
365	D	92.9	Very high	93.3	Very high	92 Å²	92	42.3 Å²	42.3	49%	0.492	21%	0.213	S	C	.	.	T	Hydrogen-bonded Turn	trans	-81.3	7.2	176.8	71.9	-16.2	0	0	0	113.5	G363 K367	G363-D365 PolarHBondContact O-N 2.84Å; D365-K367 PolarHBondContact O-N 3.4Å; D365-K367 WeakPolarHBondContact OD1-CB 3.45Å; D365-K367 PolarHBondContact OD1-N 3.48Å; D365-K367 WeakPolarHBondContact OD2-CD 3.42Å
366	K	92.3	Very high	93.6	Very high	154 Å²	154	41.5 Å²	41.5	67%	0.67	21%	0.208	S	C	*	.	S	Bend	trans	63.4	14	-174.3	-54.4	177.6	-178.7	177.9	0	114	G363 P364	G363-K366 WeakPolarHBondContact O-CA 3.26Å; G363-K366 PolarHBondContact O-N 3.34Å; P364-K366 PolarHBondContact O-N 3.26Å
367	K	95.3	Very high	93.8	Very high	114 Å²	114	40.5 Å²	40.5	50%	0.496	20%	0.197	S	C	.	.	S	Bend	trans	-104.7	179.1	174.8	-56.9	-174.3	-177.9	173.8	0	111	G363 D365 E369	G363-K367 PolarHBondContact N-O 2.91Å; D365-K367 PolarHBondContact O-N 3.4Å; D365-K367 WeakPolarHBondContact OD1-CB 3.45Å; D365-K367 PolarHBondContact OD1-N 3.48Å; D365-K367 WeakPolarHBondContact OD2-CD 3.42Å; K367-E369 PolarHBondContact O-N 3.5Å
368	A	96.2	Very high	93.9	Very high	0 Å²	0	39.3 Å²	39.3	0%	0	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.6	130.5	-179.7	0	0	0	0	0	110.8	D330 T331 K334 V360	D330-A368 WeakPolarHBondContact OD2-CB 3.33Å; D330-A368 PolarHBondContact OD2-N 3.45Å; D330-A368 VanDerWaalsContact OD2-N 3.14Å; T331-A368 WeakPolarHBondContact OG1-CB 3.12Å; K334-A368 WeakPolarHBondContact CD-O 3.23Å; K334-A368 WeakPolarHBondContact CE-O 3.14Å; K334-A368 PolarHBondContact NZ-O 3.45Å; V360-A368 HydrophobicContact CG1-CB 4.15Å
369	E	97.3	Very high	93.7	Very high	15 Å²	15	42.2 Å²	42.2	7%	0.07	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	132.7	169.8	-171.6	176	-94.8	0	0	108.2	F289 V291 V360 R361 P364 K367	F289-E369 CarbonylContact O-C 3.57Å; F289-E369 WeakPolarHBondContact O-CA 3.33Å; V291-E369 HydrophobicContact CG2-CG 3.79Å; V291-E369 WeakPolarHBondContact CG2-OE2 3.34Å; V360-E369 WeakPolarHBondContact CA-O 3.34Å; R361-E369 HydrophobicContact CG-CB 4.17Å; R361-E369 IonicContact CZ-OE2 3.74Å; R361-E369 PolarHBondContact N-O 3.27Å; R361-E369 IonicContact NE-OE2 2.75Å; R361-E369 PolarHBondContact NE-OE2 3.32Å; R361-E369 IonicContact NH2-OE2 3.72Å; R361-E369 PolarHBondContact NH2-OE2 3.37Å; R361-E369 PolarHBondContact O-N 2.93Å; P364-E369 WeakPolarHBondContact CD-OE1 3.24Å; K367-E369 PolarHBondContact O-N 3.5Å
370	L	97.8	Very high	93.5	Very high	0 Å²	0	46.7 Å²	46.7	0%	0	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	125.7	-179	-57.3	-178.3	0	0	0	109.2	F289 V290 V291 I315 T331 K334 L335 L359 V360	F289-L370 PolarHBondContact O-N 3.16Å; V290-L370 CarbonylContact C-O 3.59Å; V290-L370 WeakPolarHBondContact CA-O 3.49Å; V291-L370 PolarHBondContact N-O 3.02Å; I315-L370 HydrophobicContact CD1-CD2 4.37Å; T331-L370 HydrophobicContact CG2-CD2 4.04Å; K334-L370 HydrophobicContact CB-CD1 3.81Å; K334-L370 HydrophobicContact CB-CG 4.33Å; L335-L370 HydrophobicContact CB-CD1 4.18Å; L335-L370 HydrophobicContact CD1-CD1 4.26Å; L359-L370 WeakPolarHBondContact O-CA 3.45Å; V360-L370 HydrophobicContact CG2-CD2 4.04Å
371	V	97.3	Very high	93.3	Very high	0 Å²	0	46.7 Å²	46.7	0%	0	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	120.1	171.8	-168.8	0	0	0	0	108.8	V291 P293 C310 V358 L359 R361 L373	V291-V371 HydrophobicContact CB-CG2 4.32Å; V291-V371 HydrophobicContact CG1-CG1 4.41Å; V291-V371 VanDerWaalsContact O-CA 3.31Å; V291-V371 WeakPolarHBondContact O-CA 3.26Å; P293-V371 HydrophobicContact CG-CG1 4.12Å; C310-V371 HydrophobicContact CB-CG1 3.75Å; V358-V371 WeakPolarHBondContact CA-O 3.46Å; L359-V371 HydrophobicContact CB-CB 4.1Å; L359-V371 HydrophobicContact CB-CG2 4.47Å; L359-V371 PolarHBondContact N-O 3.07Å; L359-V371 PolarHBondContact O-N 3.48Å; R361-V371 HydrophobicContact CG-CG2 4.37Å; V371-L373 HydrophobicContact CG1-CD2 3.9Å
372	L	96.8	Very high	93.2	Very high	2 Å²	2	45.6 Å²	45.6	1%	0.01	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.1	122.7	176.6	-51.9	-178.6	0	0	0	108.7	L284 V290 V291 V292 P293 T338 F339 V358 H375	L284-L372 HydrophobicContact CD1-CD1 4.18Å; V290-L372 HydrophobicContact CG1-CD1 3.93Å; V290-L372 HydrophobicContact CG1-CG 4.18Å; V291-L372 PolarHBondContact O-N 2.85Å; V292-L372 HydrophobicContact CG2-CB 4.42Å; P293-L372 WeakPolarHBondContact CD-O 3.4Å; T338-L372 HydrophobicContact CG2-CD1 4.26Å; F339-L372 HydrophobicContact CZ-CD2 4.27Å; V358-L372 HydrophobicContact CG1-CD2 4.2Å; V358-L372 HydrophobicContact CG2-CD2 4.04Å; L372-H375 PolarHBondContact O-NE2 2.96Å
373	L	92.3	Very high	93	Very high	66 Å²	66	43.3 Å²	43.3	35%	0.346	22%	0.217	S	C	.	.			trans	-103.9	-42.5	-171.4	-61.8	180	0	0	0	114.3	P293 C310 N357 L359 V371	P293-L373 HydrophobicContact CG-CD2 3.88Å; C310-L373 HydrophobicContact CB-CD2 4.49Å; N357-L373 PolarHBondContact O-N 3.39Å; L359-L373 HydrophobicContact CD1-CD1 3.86Å; L359-L373 HydrophobicContact CD1-CD2 4.27Å; L359-L373 HydrophobicContact CD1-CG 4.39Å; L359-L373 HydrophobicContact CD2-CD1 4.21Å; L359-L373 HydrophobicContact CG-CD1 3.76Å; L359-L373 HydrophobicContact CG-CG 4.26Å; V371-L373 HydrophobicContact CG1-CD2 3.9Å
374	D	90	Very high	92.9	Very high	32 Å²	32	49.2 Å²	49.2	17%	0.171	25%	0.246	C	C	.	.			trans	-100.3	124.9	-172.9	-170.8	-22.1	0	0	0	109.9	H350 N357 G376	H350-D374 PolarHBondContact CE1-O 3.04Å; H350-D374 PolarHBondContact NE2-O 3.32Å; H350-D374 VanDerWaalsContact NE2-O 3.1Å; N357-D374 HydrophobicContact CB-CB 3.7Å; N357-D374 WeakPolarHBondContact ND2-CB 3.44Å; N357-D374 PolarHBondContact ND2-OD2 3.4Å; D374-G376 PolarHBondContact OD1-N 3.09Å
375	H	93.7	Very high	93.1	Very high	3 Å²	3	44.7 Å²	44.7	1%	0.014	22%	0.215	C	C	.	.			trans	-124.7	21.3	179.7	-63	-87.3	0	0	0	113	E273 N276 S277 V292 L372 L377 Y378	E273-H375 HydrophobicContact CG-CB 4.05Å; E273-H375 PolarHBondContact OE1-N 3.06Å; N276-H375 HydrophobicContact CB-CB 4.04Å; N276-H375 WeakPolarHBondContact CB-O 3.22Å; N276-H375 PolarHBondContact ND2-O 2.79Å; S277-H375 WeakPolarHBondContact CB-CD2 3.32Å; V292-H375 WeakPolarHBondContact CG1-NE2 3.46Å; L372-H375 PolarHBondContact O-NE2 2.96Å; H375-L377 VanDerWaalsContact C-N 3.3Å; H375-L377 PolarHBondContact O-N 3.49Å; H375-Y378 HydrophobicContact CB-CD2 4.47Å; H375-Y378 HydrophobicContact CB-CE2 3.76Å; H375-Y378 PolarHBondContact CE1-OH 2.89Å; H375-Y378 AromaticContact ND1-CE2 3.5Å; H375-Y378 AromaticContact ND1-CZ 3.57Å; H375-Y378 PolarHBondContact ND1-OH 3.45Å; H375-Y378 WeakPolarHBondContact O-CD2 3.46Å
376	G	88.1	Confident	93.1	Very high	1 Å²	1	41 Å²	41	1%	0.01	19%	0.194	C	C	.	.	S	Bend	trans	-69.7	-23.7	-174.1	0	0	0	0	0	114.3	D374	D374-G376 PolarHBondContact OD1-N 3.09Å
377	L	87.5	Confident	93.1	Very high	3 Å²	3	34.4 Å²	34.4	2%	0.016	17%	0.167	C	C	.	.			trans	-130.2	106.3	-176.7	-168.4	60.4	0	0	0	113.1	T263 H350 A351 D352 H375 L471	T263-L377 HydrophobicContact CG2-CD1 3.33Å; T263-L377 HydrophobicContact CG2-CD2 3.58Å; T263-L377 HydrophobicContact CG2-CG 4.05Å; H350-L377 PolarHBondContact ND1-O 2.98Å; A351-L377 HydrophobicContact CB-CB 4.37Å; A351-L377 HydrophobicContact CB-CD2 3.68Å; A351-L377 HydrophobicContact CB-CG 3.66Å; A351-L377 PolarHBondContact N-O 3.42Å; D352-L377 HydrophobicContact CB-CD2 4.45Å; H375-L377 VanDerWaalsContact C-N 3.3Å; H375-L377 PolarHBondContact O-N 3.49Å; L377-L471 HydrophobicContact CD1-CD1 4.23Å; L377-L471 HydrophobicContact CD2-CD1 4.23Å; L377-L471 HydrophobicContact CG-CD1 4.14Å
378	Y	91.4	Very high	93.1	Very high	9 Å²	9	29.3 Å²	29.3	4%	0.035	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	145.9	174.9	-85	-101	0	0	0	111	N276 C280 F348 I349 H350 H375	N276-Y378 HydrophobicContact CB-CD2 3.84Å; N276-Y378 HydrophobicContact CB-CE2 4.15Å; N276-Y378 HydrophobicContact CB-CG 4.41Å; C280-Y378 HydrophobicContact CB-CE1 4.48Å; C280-Y378 WeakPolarHBondContact CB-OH 3.3Å; C280-Y378 PolarHBondContact SG-OH 3.21Å; F348-Y378 AromaticContact CD1-CD1 3.46Å; F348-Y378 HydrophobicContact CD1-CD1 3.46Å; F348-Y378 VanDerWaalsContact CD1-CD1 3.46Å; F348-Y378 AromaticContact CD1-CE1 3.51Å; F348-Y378 HydrophobicContact CD1-CE1 3.51Å; F348-Y378 HydrophobicContact CD1-CG 4.47Å; F348-Y378 AromaticContact CD2-CD1 3.78Å; F348-Y378 HydrophobicContact CD2-CD1 3.78Å; F348-Y378 HydrophobicContact CD2-CG 4.38Å; F348-Y378 AromaticContact CE1-CD1 3.21Å; F348-Y378 HydrophobicContact CE1-CD1 3.21Å; F348-Y378 AromaticContact CE1-CE1 3.32Å; F348-Y378 HydrophobicContact CE1-CE1 3.32Å; F348-Y378 AromaticContact CE1-CG 3.86Å; F348-Y378 HydrophobicContact CE1-CG 3.86Å; F348-Y378 AromaticContact CE2-CD1 3.56Å; F348-Y378 HydrophobicContact CE2-CD1 3.56Å; F348-Y378 HydrophobicContact CE2-CE1 4.49Å; F348-Y378 AromaticContact CE2-CG 3.76Å; F348-Y378 HydrophobicContact CE2-CG 3.76Å; F348-Y378 AromaticContact CG-CD1 3.73Å; F348-Y378 HydrophobicContact CG-CD1 3.73Å; F348-Y378 HydrophobicContact CG-CE1 4.18Å; F348-Y378 AromaticContact CZ-CD1 3.26Å; F348-Y378 HydrophobicContact CZ-CD1 3.26Å; F348-Y378 HydrophobicContact CZ-CD2 4.22Å; F348-Y378 AromaticContact CZ-CE1 3.86Å; F348-Y378 HydrophobicContact CZ-CE1 3.86Å; F348-Y378 AromaticContact CZ-CG 3.45Å; F348-Y378 HydrophobicContact CZ-CG 3.45Å; F348-Y378 VanDerWaalsContact CZ-CG 3.45Å; I349-Y378 VanDerWaalsContact O-CA 3.31Å; I349-Y378 WeakPolarHBondContact O-CA 3.38Å; H350-Y378 HydrophobicContact CB-CD1 4.34Å; H350-Y378 HydrophobicContact CB-CE1 3.74Å; H350-Y378 HydrophobicContact CB-CE2 4.12Å; H350-Y378 AromaticContact CG-CZ 3.95Å; H375-Y378 HydrophobicContact CB-CD2 4.47Å; H375-Y378 HydrophobicContact CB-CE2 3.76Å; H375-Y378 PolarHBondContact CE1-OH 2.89Å; H375-Y378 AromaticContact ND1-CE2 3.5Å; H375-Y378 AromaticContact ND1-CZ 3.57Å; H375-Y378 PolarHBondContact ND1-OH 3.45Å; H375-Y378 WeakPolarHBondContact O-CD2 3.46Å
379	E	89.3	Confident	93	Very high	60 Å²	60	29.3 Å²	29.3	28%	0.28	15%	0.146	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	156.1	170.3	-81.7	-64.4	164.3	0	0	111.3	I349 P468 L471	I349-E379 PolarHBondContact N-O 2.97Å; I349-E379 PolarHBondContact O-N 3.17Å; E379-P468 HydrophobicContact CB-CB 4.43Å; E379-L471 HydrophobicContact CB-CD1 3.99Å; E379-L471 HydrophobicContact CG-CB 4.47Å; E379-L471 HydrophobicContact CG-CD1 3.16Å; E379-L471 HydrophobicContact CG-CG 4.06Å
380	Y	92.3	Very high	92.8	Very high	113 Å²	113	28.7 Å²	28.7	44%	0.443	14%	0.143	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	120.2	178.3	-168.4	-101.7	0	0	0	111.5	G347 R386 P468	G347-Y380 CarbonylContact O-C 3.51Å; G347-Y380 VanDerWaalsContact O-CA 3.29Å; G347-Y380 WeakPolarHBondContact O-CA 3.47Å; G347-Y380 WeakPolarHBondContact O-CD2 3.5Å; Y380-R386 PolarHBondContact OH-NH1 2.94Å; Y380-P468 WeakPolarHBondContact O-CG 3.17Å
381	L	93.1	Very high	92.5	Very high	0 Å²	0	31 Å²	31	0%	0	15%	0.153	C	C	.	.			trans	-93.9	125.3	171.7	-170.8	62.6	0	0	0	109.5	G347 I349 D385 R386 L389 P468 M469 V472	G347-L381 PolarHBondContact O-N 3.39Å; I349-L381 HydrophobicContact CD1-CB 3.71Å; I349-L381 HydrophobicContact CD1-CD2 4.07Å; L381-D385 HydrophobicContact CD1-CB 3.57Å; L381-D385 HydrophobicContact CG-CB 3.98Å; L381-R386 HydrophobicContact CB-CG 3.95Å; L381-R386 HydrophobicContact CD2-CG 3.69Å; L381-R386 HydrophobicContact CG-CG 3.69Å; L381-R386 WeakPolarHBondContact O-CD 3.09Å; L381-R386 PolarHBondContact O-NH1 3.39Å; L381-L389 HydrophobicContact CD2-CD2 3.83Å; L381-P468 HydrophobicContact CD1-CB 4.1Å; L381-M469 HydrophobicContact CD1-SD 4.21Å; L381-M469 HydrophobicContact CD2-SD 4.26Å; L381-V472 HydrophobicContact CD2-CG2 4.42Å
382	S	93.6	Very high	92.4	Very high	42 Å²	42	31 Å²	31	29%	0.294	15%	0.153	S	C	.	.			trans	-60.9	151.6	-177.4	82.2	0	0	0	0	111.9	I384 D385 R386	S382-I384 PolarHBondContact O-N 2.84Å; S382-D385 PolarHBondContact O-N 3.3Å; S382-D385 PolarHBondContact OG-N 3.42Å; S382-D385 PolarHBondContact OG-OD2 3.26Å; S382-R386 VanDerWaalsContact O-CG 3.31Å; S382-R386 WeakPolarHBondContact O-CG 3.25Å; S382-R386 PolarHBondContact O-N 3.4Å
383	E	91.8	Very high	92.2	Very high	73 Å²	73	30.9 Å²	30.9	34%	0.341	15%	0.152	S	C	.	.	H	α-helix	trans	-57.1	-37.4	178.3	-172.2	-167.6	133	0	0	111.9	R386 V387 R511	E383-R386 PolarHBondContact O-N 2.96Å; E383-V387 HydrophobicContact CG-CG2 4.29Å; E383-V387 WeakPolarHBondContact O-CB 3.47Å; E383-V387 VanDerWaalsContact O-CG2 3.27Å; E383-V387 WeakPolarHBondContact O-CG2 3.24Å; E383-V387 PolarHBondContact O-N 2.79Å; E383-R511 IonicContact OE1-CZ 2.83Å; E383-R511 IonicContact OE1-NE 3.39Å; E383-R511 PolarHBondContact OE1-NE 2.83Å; E383-R511 VanDerWaalsContact OE1-NE 3.12Å; E383-R511 IonicContact OE1-NH2 3.6Å; E383-R511 PolarHBondContact OE1-NH2 3.39Å
384	I	91.7	Very high	92.1	Very high	130 Å²	130	30.4 Å²	30.4	67%	0.667	15%	0.146	S	C	*	.	H	α-helix	trans	-61.5	-49.6	179.4	-62.4	173.5	0	0	0	110	S382 V387 A388	S382-I384 PolarHBondContact O-N 2.84Å; I384-V387 PolarHBondContact O-N 2.85Å; I384-A388 PolarHBondContact O-N 3.33Å
385	D	94.2	Very high	92.1	Very high	30 Å²	30	28.9 Å²	28.9	16%	0.16	14%	0.138	C	C	.	.	H	α-helix	trans	-66.6	-40.3	179	-60.1	-40.2	0	0	0	111.1	L381 S382 V387 A388 L389 L411 P466	L381-D385 HydrophobicContact CD1-CB 3.57Å; L381-D385 HydrophobicContact CG-CB 3.98Å; S382-D385 PolarHBondContact O-N 3.3Å; S382-D385 PolarHBondContact OG-N 3.42Å; S382-D385 PolarHBondContact OG-OD2 3.26Å; D385-V387 PolarHBondContact O-N 3.39Å; D385-A388 PolarHBondContact O-N 3.22Å; D385-L389 VanDerWaalsContact O-CB 3.29Å; D385-L389 WeakPolarHBondContact O-CB 3.46Å; D385-L389 PolarHBondContact O-N 3.07Å; D385-L411 HydrophobicContact CB-CD2 3.82Å; D385-P466 HydrophobicContact CB-CG 4.46Å
386	R	93.6	Very high	91.9	Very high	13 Å²	13	28.7 Å²	28.7	5%	0.049	14%	0.137	C	C	.	.	H	α-helix	trans	-59.1	-46.8	175.1	-71.3	-171.7	-37.1	-110.4	10.4	111.9	Y345 Y380 L381 S382 E383 A388 L389 C390	Y345-R386 PolarHBondContact O-NE 3.18Å; Y345-R386 PolarHBondContact O-NH2 3.32Å; Y380-R386 PolarHBondContact OH-NH1 2.94Å; L381-R386 HydrophobicContact CB-CG 3.95Å; L381-R386 HydrophobicContact CD2-CG 3.69Å; L381-R386 HydrophobicContact CG-CG 3.69Å; L381-R386 WeakPolarHBondContact O-CD 3.09Å; L381-R386 PolarHBondContact O-NH1 3.39Å; S382-R386 VanDerWaalsContact O-CG 3.31Å; S382-R386 WeakPolarHBondContact O-CG 3.25Å; S382-R386 PolarHBondContact O-N 3.4Å; E383-R386 PolarHBondContact O-N 2.96Å; R386-A388 VanDerWaalsContact C-N 3.31Å; R386-A388 PolarHBondContact O-N 2.87Å; R386-L389 PolarHBondContact O-N 3.37Å; R386-C390 PolarHBondContact O-N 3.28Å; R386-C390 PolarHBondContact O-SG 2.93Å
387	V	92.1	Very high	91.7	Very high	17 Å²	17	29 Å²	29	10%	0.103	14%	0.139	C	C	.	.	H	α-helix	trans	-63.1	-40.8	178.7	169.8	0	0	0	0	110.8	E383 I384 D385 K391 L507	E383-V387 HydrophobicContact CG-CG2 4.29Å; E383-V387 WeakPolarHBondContact O-CB 3.47Å; E383-V387 VanDerWaalsContact O-CG2 3.27Å; E383-V387 WeakPolarHBondContact O-CG2 3.24Å; E383-V387 PolarHBondContact O-N 2.79Å; I384-V387 PolarHBondContact O-N 2.85Å; D385-V387 PolarHBondContact O-N 3.39Å; V387-K391 HydrophobicContact CG1-CD 4.24Å; V387-K391 VanDerWaalsContact O-CG 3.27Å; V387-K391 WeakPolarHBondContact O-CG 3.45Å; V387-K391 PolarHBondContact O-N 2.91Å; V387-L507 HydrophobicContact CG2-CD1 4.11Å
388	A	94.6	Very high	91.6	Very high	6 Å²	6	30 Å²	30	5%	0.05	14%	0.144	C	C	.	.	H	α-helix	trans	-63.4	-44.5	174.6	0	0	0	0	0	111.4	I384 D385 R386 K391 L392 L411	I384-A388 PolarHBondContact O-N 3.33Å; D385-A388 PolarHBondContact O-N 3.22Å; R386-A388 VanDerWaalsContact C-N 3.31Å; R386-A388 PolarHBondContact O-N 2.87Å; A388-K391 PolarHBondContact O-N 3.41Å; A388-L392 WeakPolarHBondContact O-CB 3.42Å; A388-L392 PolarHBondContact O-N 3.48Å; A388-L411 HydrophobicContact CB-CD1 4.39Å; A388-L411 HydrophobicContact CB-CD2 4.03Å; A388-L411 HydrophobicContact CB-CG 3.82Å
389	L	94.9	Very high	91.2	Very high	0 Å²	0	31 Å²	31	0%	0	15%	0.148	C	C	.	.	H	α-helix	trans	-63.2	-44.5	178.5	-176.9	61.1	0	0	0	112.3	I343 F344 L381 D385 R386 K391 L392 W393 L411 L423 M469 V472	I343-L389 HydrophobicContact CG2-CD2 3.66Å; F344-L389 HydrophobicContact CD1-CG 4.44Å; F344-L389 HydrophobicContact CE1-CD2 4.27Å; F344-L389 HydrophobicContact CE1-CG 4.04Å; L381-L389 HydrophobicContact CD2-CD2 3.83Å; D385-L389 VanDerWaalsContact O-CB 3.29Å; D385-L389 WeakPolarHBondContact O-CB 3.46Å; D385-L389 PolarHBondContact O-N 3.07Å; R386-L389 PolarHBondContact O-N 3.37Å; L389-K391 VanDerWaalsContact C-N 3.3Å; L389-K391 PolarHBondContact O-N 3.39Å; L389-L392 PolarHBondContact O-N 2.98Å; L389-W393 WeakPolarHBondContact O-CB 3.41Å; L389-W393 PolarHBondContact O-N 3.36Å; L389-L411 HydrophobicContact CB-CD1 4.36Å; L389-L411 HydrophobicContact CD1-CD1 4.38Å; L389-L423 HydrophobicContact CD1-CD1 4.18Å; L389-L423 HydrophobicContact CD1-CD2 3.84Å; L389-M469 HydrophobicContact CD1-CE 3.93Å; L389-M469 HydrophobicContact CD2-CE 4.29Å; L389-M469 HydrophobicContact CD2-SD 4.12Å; L389-V472 HydrophobicContact CD2-CG1 4.39Å
390	C	93	Very high	91.1	Very high	2 Å²	2	31.3 Å²	31.3	1%	0.014	15%	0.151	C	C	.	.	H	α-helix	trans	-58.5	-44.5	176.6	-70.2	0	0	0	0	111.7	F344 R386 R394 A500 W504	F344-C390 VanDerWaalsContact CB-SG 3.6Å; F344-C390 VanDerWaalsContact CD1-SG 3.56Å; R386-C390 PolarHBondContact O-N 3.28Å; R386-C390 PolarHBondContact O-SG 2.93Å; C390-R394 WeakPolarHBondContact O-CB 3.25Å; C390-R394 PolarHBondContact O-N 3.05Å; C390-R394 VanDerWaalsContact O-N 3.07Å; C390-A500 HydrophobicContact CB-CB 4.15Å; C390-W504 HydrophobicContact CB-CB 4.02Å
391	K	92.3	Very high	91	Very high	48 Å²	48	29.3 Å²	29.3	21%	0.209	15%	0.148	C	C	.	.	H	α-helix	trans	-70.9	-40.3	-179.8	-67.9	176.5	179.3	-176.4	0	111.8	V387 A388 L389 R394 S395 Y407 W504	V387-K391 HydrophobicContact CG1-CD 4.24Å; V387-K391 VanDerWaalsContact O-CG 3.27Å; V387-K391 WeakPolarHBondContact O-CG 3.45Å; V387-K391 PolarHBondContact O-N 2.91Å; A388-K391 PolarHBondContact O-N 3.41Å; L389-K391 VanDerWaalsContact C-N 3.3Å; L389-K391 PolarHBondContact O-N 3.39Å; K391-R394 PolarHBondContact O-N 3.13Å; K391-S395 WeakPolarHBondContact O-CB 3.31Å; K391-S395 PolarHBondContact O-N 2.95Å; K391-S395 PolarHBondContact O-OG 3.46Å; K391-Y407 HydrophobicContact CB-CD1 3.92Å; K391-Y407 HydrophobicContact CB-CD2 3.51Å; K391-Y407 HydrophobicContact CB-CE1 4.02Å; K391-Y407 HydrophobicContact CB-CE2 3.6Å; K391-Y407 HydrophobicContact CB-CG 3.69Å; K391-Y407 HydrophobicContact CD-CD1 3.89Å; K391-Y407 HydrophobicContact CD-CE1 3.35Å; K391-Y407 HydrophobicContact CD-CE2 4.11Å; K391-Y407 HydrophobicContact CD-CG 4.48Å; K391-Y407 VanDerWaalsContact CD-CZ 3.48Å; K391-Y407 HydrophobicContact CG-CE1 4.35Å; K391-Y407 HydrophobicContact CG-CE2 4.37Å; K391-W504 HydrophobicContact CD-CZ2 4.39Å; K391-W504 VanDerWaalsContact CE-NE1 3.3Å; K391-W504 HydrophobicContact CG-CD2 4.45Å; K391-W504 HydrophobicContact CG-CZ2 4.47Å
392	L	94.6	Very high	91	Very high	0 Å²	0	32.7 Å²	32.7	0%	0	18%	0.176	C	C	.	.	H	α-helix	trans	-59.6	-49.3	173.9	177.7	58.8	0	0	0	110.7	A388 L389 R394 S395 I396 M404 L411 F419 L423	A388-L392 WeakPolarHBondContact O-CB 3.42Å; A388-L392 PolarHBondContact O-N 3.48Å; L389-L392 PolarHBondContact O-N 2.98Å; L392-R394 VanDerWaalsContact C-N 3.34Å; L392-R394 PolarHBondContact O-N 2.9Å; L392-S395 WeakPolarHBondContact O-CB 3.36Å; L392-S395 PolarHBondContact O-N 3.34Å; L392-I396 HydrophobicContact CD1-CD1 4.02Å; L392-I396 HydrophobicContact CD1-CG1 4.1Å; L392-I396 HydrophobicContact CG-CD1 3.83Å; L392-I396 HydrophobicContact CG-CG1 4.38Å; L392-I396 VanDerWaalsContact O-CG1 3.27Å; L392-I396 WeakPolarHBondContact O-CG1 3.26Å; L392-I396 PolarHBondContact O-N 3.02Å; L392-M404 HydrophobicContact CD1-CB 4.2Å; L392-M404 HydrophobicContact CD1-CG 4.34Å; L392-L411 HydrophobicContact CD2-CD1 3.96Å; L392-F419 HydrophobicContact CD2-CD1 3.78Å; L392-F419 HydrophobicContact CD2-CE1 3.39Å; L392-F419 HydrophobicContact CD2-CZ 4.42Å; L392-L423 HydrophobicContact CD2-CD2 4.28Å
393	W	92.4	Very high	91	Very high	0 Å²	0	31.3 Å²	31.3	0%	0	17%	0.167	C	C	.	.	H	α-helix	trans	-59.8	-44.2	179.7	-157.1	-71.2	0	0	0	112.2	F344 L389 S395 I396 V397 L423 L424 I476 Y493 M496 A500	F344-W393 HydrophobicContact CE1-CB 4.26Å; F344-W393 HydrophobicContact CE1-CD2 4.29Å; F344-W393 HydrophobicContact CE1-CE3 4.08Å; F344-W393 HydrophobicContact CE1-CG 4.36Å; F344-W393 HydrophobicContact CZ-CB 4.39Å; F344-W393 AromaticContact CZ-CD2 3.75Å; F344-W393 HydrophobicContact CZ-CD2 3.75Å; F344-W393 AromaticContact CZ-CE3 3.74Å; F344-W393 HydrophobicContact CZ-CE3 3.74Å; F344-W393 HydrophobicContact CZ-CG 4.02Å; F344-W393 HydrophobicContact CZ-CZ3 4.32Å; L389-W393 WeakPolarHBondContact O-CB 3.41Å; L389-W393 PolarHBondContact O-N 3.36Å; W393-S395 VanDerWaalsContact C-N 3.35Å; W393-S395 PolarHBondContact O-N 2.94Å; W393-I396 PolarHBondContact O-N 3.35Å; W393-V397 PolarHBondContact O-N 3.34Å; W393-L423 HydrophobicContact CE3-CD1 4.26Å; W393-L423 HydrophobicContact CE3-CD2 3.59Å; W393-L423 HydrophobicContact CE3-CG 3.8Å; W393-L423 HydrophobicContact CH2-CG 4.22Å; W393-L423 HydrophobicContact CZ3-CD1 3.68Å; W393-L423 HydrophobicContact CZ3-CD2 3.76Å; W393-L423 HydrophobicContact CZ3-CG 3.39Å; W393-L424 HydrophobicContact CH2-CD2 4.45Å; W393-L424 HydrophobicContact CZ2-CD2 4.04Å; W393-I476 HydrophobicContact CH2-CD1 3.82Å; W393-I476 HydrophobicContact CH2-CG1 4.43Å; W393-I476 HydrophobicContact CH2-CG2 4.48Å; W393-I476 HydrophobicContact CZ3-CD1 3.62Å; W393-Y493 PolarHBondContact NE1-O 2.71Å; W393-M496 HydrophobicContact CH2-CE 3.73Å; W393-M496 HydrophobicContact CH2-SD 3.9Å; W393-M496 HydrophobicContact CZ2-CB 3.87Å; W393-M496 HydrophobicContact CZ2-CE 3.92Å; W393-M496 HydrophobicContact CZ2-CG 4.39Å; W393-M496 HydrophobicContact CZ2-SD 3.65Å; W393-M496 HydrophobicContact CZ3-CE 4.21Å; W393-A500 HydrophobicContact CB-CB 4.33Å
394	R	89.2	Confident	91.1	Very high	56 Å²	56	27.9 Å²	27.9	21%	0.211	15%	0.151	C	C	.	.	H	α-helix	trans	-57	-47.8	172.2	175.6	-173.3	168.9	-83.2	-3.9	111.3	C390 K391 L392 I396 V397 L398 V501 F533	C390-R394 WeakPolarHBondContact O-CB 3.25Å; C390-R394 PolarHBondContact O-N 3.05Å; C390-R394 VanDerWaalsContact O-N 3.07Å; K391-R394 PolarHBondContact O-N 3.13Å; L392-R394 VanDerWaalsContact C-N 3.34Å; L392-R394 PolarHBondContact O-N 2.9Å; R394-I396 VanDerWaalsContact C-N 3.34Å; R394-I396 PolarHBondContact O-N 2.86Å; R394-V397 PolarHBondContact O-N 3.2Å; R394-L398 HydrophobicContact CG-CD1 3.94Å; R394-L398 WeakPolarHBondContact O-CG 3.21Å; R394-L398 PolarHBondContact O-N 2.7Å; R394-V501 HydrophobicContact CB-CG2 3.98Å; R394-V501 HydrophobicContact CG-CG2 3.84Å; R394-F533 HydrophobicContact CG-CD2 3.82Å; R394-F533 HydrophobicContact CG-CE2 3.81Å
395	S	90.8	Very high	91.3	Very high	0 Å²	0	27 Å²	27	0%	0	14%	0.142	C	C	.	.	H	α-helix	trans	-65.5	-35.8	-178.8	-67.4	0	0	0	0	112.8	K391 L392 W393 L398 R399 D400 A403	K391-S395 WeakPolarHBondContact O-CB 3.31Å; K391-S395 PolarHBondContact O-N 2.95Å; K391-S395 PolarHBondContact O-OG 3.46Å; L392-S395 WeakPolarHBondContact O-CB 3.36Å; L392-S395 PolarHBondContact O-N 3.34Å; W393-S395 VanDerWaalsContact C-N 3.35Å; W393-S395 PolarHBondContact O-N 2.94Å; S395-L398 CarbonylContact O-C 3.56Å; S395-L398 PolarHBondContact O-N 2.97Å; S395-R399 PolarHBondContact O-N 3.12Å; S395-D400 PolarHBondContact O-N 2.94Å; S395-A403 WeakPolarHBondContact OG-CB 3.24Å
396	I	89.5	Confident	91.4	Very high	0 Å²	0	33.4 Å²	33.4	0%	0	17%	0.165	C	C	.	.	H	α-helix	trans	-62.9	-44.2	175.3	-68.7	165.1	0	0	0	111.2	L392 W393 R394 R399 M404 L423 L424 I428	L392-I396 HydrophobicContact CD1-CD1 4.02Å; L392-I396 HydrophobicContact CD1-CG1 4.1Å; L392-I396 HydrophobicContact CG-CD1 3.83Å; L392-I396 HydrophobicContact CG-CG1 4.38Å; L392-I396 VanDerWaalsContact O-CG1 3.27Å; L392-I396 WeakPolarHBondContact O-CG1 3.26Å; L392-I396 PolarHBondContact O-N 3.02Å; W393-I396 PolarHBondContact O-N 3.35Å; R394-I396 VanDerWaalsContact C-N 3.34Å; R394-I396 PolarHBondContact O-N 2.86Å; I396-R399 WeakPolarHBondContact O-CD 3.4Å; I396-R399 PolarHBondContact O-N 3.35Å; I396-R399 PolarHBondContact O-NH1 2.8Å; I396-M404 HydrophobicContact CG1-CE 4.03Å; I396-M404 HydrophobicContact CG1-CG 4.02Å; I396-M404 HydrophobicContact CG1-SD 4.14Å; I396-L423 HydrophobicContact CD1-CD2 3.99Å; I396-L424 HydrophobicContact CG2-CD1 3.21Å; I396-L424 HydrophobicContact CG2-CD2 3.91Å; I396-L424 HydrophobicContact CG2-CG 3.75Å; I396-I428 HydrophobicContact CG2-CD1 4.1Å
397	V	84.6	Confident	91.5	Very high	7 Å²	7	34.6 Å²	34.6	4%	0.042	17%	0.169	C	C	.	.	H	α-helix	trans	-71.7	-34.6	179.8	172.7	0	0	0	0	111.9	W393 R394 R399 L435 A497 F533 L537	W393-V397 PolarHBondContact O-N 3.34Å; R394-V397 PolarHBondContact O-N 3.2Å; V397-R399 VanDerWaalsContact C-N 3.31Å; V397-L435 HydrophobicContact CG2-CD1 4.42Å; V397-A497 HydrophobicContact CB-CB 4.14Å; V397-A497 HydrophobicContact CG1-CB 4.33Å; V397-A497 HydrophobicContact CG2-CB 3.72Å; V397-F533 HydrophobicContact CG1-CZ 4.46Å; V397-L537 HydrophobicContact CG1-CD1 3.77Å
398	L	83.9	Confident	91.7	Very high	23 Å²	23	33.8 Å²	33.8	12%	0.12	16%	0.164	C	C	.	.	T	Hydrogen-bonded Turn	trans	-84.6	1.2	175.7	-64.7	179.2	0	0	0	114	R394 S395 D400 F533 A536 L537	R394-L398 HydrophobicContact CG-CD1 3.94Å; R394-L398 WeakPolarHBondContact O-CG 3.21Å; R394-L398 PolarHBondContact O-N 2.7Å; S395-L398 CarbonylContact O-C 3.56Å; S395-L398 PolarHBondContact O-N 2.97Å; L398-D400 PolarHBondContact O-N 3.29Å; L398-F533 HydrophobicContact CD1-CD2 4.01Å; L398-F533 HydrophobicContact CD1-CE2 4.11Å; L398-F533 HydrophobicContact CD2-CD2 4.36Å; L398-F533 HydrophobicContact CD2-CE2 4.05Å; L398-F533 HydrophobicContact CG-CD2 4.32Å; L398-F533 HydrophobicContact CG-CE2 3.94Å; L398-A536 HydrophobicContact CD2-CB 4.27Å; L398-L537 HydrophobicContact CD2-CD1 4.48Å
399	R	84.1	Confident	91.7	Very high	32 Å²	32	37.1 Å²	37.1	12%	0.121	18%	0.181	C	C	.	.	T	Hydrogen-bonded Turn	trans	53.9	35.6	-177	-54.2	-58	-168.4	-158.1	10.6	114.1	S395 I396 V397 D401 N429 M430 E432 L433	S395-R399 PolarHBondContact O-N 3.12Å; I396-R399 WeakPolarHBondContact O-CD 3.4Å; I396-R399 PolarHBondContact O-N 3.35Å; I396-R399 PolarHBondContact O-NH1 2.8Å; V397-R399 VanDerWaalsContact C-N 3.31Å; R399-D401 PolarHBondContact O-N 3.45Å; R399-N429 PolarHBondContact NE-O 3.35Å; R399-N429 VanDerWaalsContact NE-O 3.12Å; R399-N429 PolarHBondContact NH2-O 3.08Å; R399-M430 HydrophobicContact CB-SD 4.46Å; R399-E432 PolarHBondContact NE-O 3.18Å; R399-E432 VanDerWaalsContact NE-O 3.07Å; R399-E432 PolarHBondContact NH2-O 3.41Å; R399-L433 HydrophobicContact CG-CG 4.29Å
400	D	87.5	Confident	91.7	Very high	66 Å²	66	40.3 Å²	40.3	35%	0.353	20%	0.203	S	C	.	.			trans	-87	87.4	177.2	-177	-16.2	0	0	0	110.1	S395 L398 A402 A403 M404	S395-D400 PolarHBondContact O-N 2.94Å; L398-D400 PolarHBondContact O-N 3.29Å; D400-A402 PolarHBondContact O-N 3.01Å; D400-A403 HydrophobicContact CB-CB 4.01Å; D400-A403 PolarHBondContact O-N 3.27Å; D400-A403 VanDerWaalsContact OD1-CB 3.31Å; D400-A403 WeakPolarHBondContact OD1-CB 3.37Å; D400-A403 PolarHBondContact OD1-N 2.91Å; D400-A403 VanDerWaalsContact OD2-CB 3.22Å; D400-A403 WeakPolarHBondContact OD2-CB 3.38Å; D400-M404 VanDerWaalsContact O-CG 3.28Å; D400-M404 WeakPolarHBondContact O-CG 3.44Å; D400-M404 PolarHBondContact O-N 3.21Å
401	D	89.8	Confident	91.8	Very high	71 Å²	71	40.3 Å²	40.3	38%	0.38	20%	0.204	S	C	.	.	H	α-helix	trans	-55	-45.8	-175.9	-176.7	74.1	0	0	0	113.1	R399 A403 M404 K405 Y416 M430	R399-D401 PolarHBondContact O-N 3.45Å; D401-A403 VanDerWaalsContact C-N 3.34Å; D401-A403 PolarHBondContact O-N 2.74Å; D401-M404 WeakPolarHBondContact O-CB 3.27Å; D401-M404 PolarHBondContact O-N 2.88Å; D401-K405 PolarHBondContact O-N 3.29Å; D401-Y416 VanDerWaalsContact OD1-CE2 3.22Å; D401-Y416 WeakPolarHBondContact OD1-CE2 3.4Å; D401-Y416 VanDerWaalsContact OD1-CZ 3.28Å; D401-Y416 PolarHBondContact OD1-OH 3.43Å; D401-Y416 PolarHBondContact OD2-OH 3.45Å; D401-M430 HydrophobicContact CB-CE 4.28Å; D401-M430 WeakPolarHBondContact OD1-CE 3.35Å
402	A	93.2	Very high	91.9	Very high	71 Å²	71	40 Å²	40	59%	0.587	21%	0.214	S	C	*	.	H	α-helix	trans	-63	-42.2	-180	0	0	0	0	0	111.6	D400 R406	D400-A402 PolarHBondContact O-N 3.01Å; A402-R406 WeakPolarHBondContact O-CB 3.26Å; A402-R406 PolarHBondContact O-N 3.33Å; A402-R406 VanDerWaalsContact O-N 3.07Å
403	A	92.9	Very high	91.8	Very high	13 Å²	13	40.1 Å²	40.1	11%	0.107	21%	0.214	C	C	.	.	H	α-helix	trans	-71.9	-36.1	176.5	0	0	0	0	0	112.6	S395 D400 D401 R406 Y407	S395-A403 WeakPolarHBondContact OG-CB 3.24Å; D400-A403 HydrophobicContact CB-CB 4.01Å; D400-A403 PolarHBondContact O-N 3.27Å; D400-A403 VanDerWaalsContact OD1-CB 3.31Å; D400-A403 WeakPolarHBondContact OD1-CB 3.37Å; D400-A403 PolarHBondContact OD1-N 2.91Å; D400-A403 VanDerWaalsContact OD2-CB 3.22Å; D400-A403 WeakPolarHBondContact OD2-CB 3.38Å; D401-A403 VanDerWaalsContact C-N 3.34Å; D401-A403 PolarHBondContact O-N 2.74Å; A403-R406 PolarHBondContact O-N 3.26Å; A403-Y407 HydrophobicContact CB-CD2 4.14Å; A403-Y407 HydrophobicContact CB-CE2 3.92Å; A403-Y407 WeakPolarHBondContact O-CD2 3.38Å; A403-Y407 PolarHBondContact O-N 3.36Å
404	M	94.5	Very high	91.8	Very high	0 Å²	0	48.6 Å²	48.6	0%	0	25%	0.251	C	S	.	.	H	α-helix	trans	-56.8	-51.5	172.9	-73.6	172	55	0	0	110.5	L392 I396 D400 D401 R406 Y407 S408 Y416 I428 M430	L392-M404 HydrophobicContact CD1-CB 4.2Å; L392-M404 HydrophobicContact CD1-CG 4.34Å; I396-M404 HydrophobicContact CG1-CE 4.03Å; I396-M404 HydrophobicContact CG1-CG 4.02Å; I396-M404 HydrophobicContact CG1-SD 4.14Å; D400-M404 VanDerWaalsContact O-CG 3.28Å; D400-M404 WeakPolarHBondContact O-CG 3.44Å; D400-M404 PolarHBondContact O-N 3.21Å; D401-M404 WeakPolarHBondContact O-CB 3.27Å; D401-M404 PolarHBondContact O-N 2.88Å; M404-R406 VanDerWaalsContact C-N 3.32Å; M404-R406 PolarHBondContact O-N 3.13Å; M404-Y407 PolarHBondContact O-N 3.3Å; M404-S408 WeakPolarHBondContact O-CB 3.31Å; M404-S408 PolarHBondContact O-N 2.87Å; M404-Y416 HydrophobicContact CB-CD2 3.82Å; M404-Y416 HydrophobicContact CB-CE2 4.24Å; M404-Y416 HydrophobicContact CE-CD2 4.09Å; M404-Y416 HydrophobicContact CE-CE2 4.28Å; M404-I428 HydrophobicContact CE-CD1 4.29Å; M404-M430 HydrophobicContact CE-CE 3.58Å; M404-M430 HydrophobicContact SD-CE 3.67Å; M404-M430 HydrophobicContact SD-SD 4.33Å
405	K	95.8	Very high	91.9	Very high	111 Å²	111	48.7 Å²	48.7	48%	0.483	26%	0.256	S	S	.	.	H	α-helix	trans	-58.1	-43.8	176.5	-174.3	173.6	-176.8	173.7	0	112.3	D401 N409 Y416	D401-K405 PolarHBondContact O-N 3.29Å; K405-N409 WeakPolarHBondContact O-CB 3.35Å; K405-N409 PolarHBondContact O-N 2.88Å; K405-N409 VanDerWaalsContact O-N 3.13Å; K405-N409 PolarHBondContact O-ND2 3.46Å; K405-Y416 HydrophobicContact CB-CD1 3.91Å; K405-Y416 HydrophobicContact CB-CD2 4.44Å; K405-Y416 HydrophobicContact CB-CE1 4.1Å; K405-Y416 HydrophobicContact CB-CG 4.09Å; K405-Y416 HydrophobicContact CD-CD1 4.45Å; K405-Y416 HydrophobicContact CD-CE1 4.21Å; K405-Y416 HydrophobicContact CG-CD1 3.94Å; K405-Y416 HydrophobicContact CG-CE1 4.17Å
406	R	96.4	Very high	92	Very high	166 Å²	166	50.8 Å²	50.8	63%	0.626	26%	0.264	S	S	*	.	H	α-helix	trans	-62	-49.7	179.7	-177.5	-179.7	178.8	178.1	2	112.5	A402 A403 M404 N409 S410	A402-R406 WeakPolarHBondContact O-CB 3.26Å; A402-R406 PolarHBondContact O-N 3.33Å; A402-R406 VanDerWaalsContact O-N 3.07Å; A403-R406 PolarHBondContact O-N 3.26Å; M404-R406 VanDerWaalsContact C-N 3.32Å; M404-R406 PolarHBondContact O-N 3.13Å; R406-N409 PolarHBondContact O-N 2.84Å; R406-S410 PolarHBondContact O-N 3.02Å; R406-S410 VanDerWaalsContact O-N 3.17Å; R406-S410 PolarHBondContact O-OG 3.21Å
407	Y	95.6	Very high	92.1	Very high	38 Å²	38	53.6 Å²	53.6	15%	0.149	28%	0.277	C	S	.	.	H	α-helix	trans	-81.9	-26.7	-173.2	-62.2	-52.9	0	0	0	112.9	K391 A403 M404 S410 L411	K391-Y407 HydrophobicContact CB-CD1 3.92Å; K391-Y407 HydrophobicContact CB-CD2 3.51Å; K391-Y407 HydrophobicContact CB-CE1 4.02Å; K391-Y407 HydrophobicContact CB-CE2 3.6Å; K391-Y407 HydrophobicContact CB-CG 3.69Å; K391-Y407 HydrophobicContact CD-CD1 3.89Å; K391-Y407 HydrophobicContact CD-CE1 3.35Å; K391-Y407 HydrophobicContact CD-CE2 4.11Å; K391-Y407 HydrophobicContact CD-CG 4.48Å; K391-Y407 VanDerWaalsContact CD-CZ 3.48Å; K391-Y407 HydrophobicContact CG-CE1 4.35Å; K391-Y407 HydrophobicContact CG-CE2 4.37Å; A403-Y407 HydrophobicContact CB-CD2 4.14Å; A403-Y407 HydrophobicContact CB-CE2 3.92Å; A403-Y407 WeakPolarHBondContact O-CD2 3.38Å; A403-Y407 PolarHBondContact O-N 3.36Å; M404-Y407 PolarHBondContact O-N 3.3Å; Y407-S410 WeakPolarHBondContact O-CB 3.23Å; Y407-S410 PolarHBondContact O-N 2.9Å; Y407-L411 PolarHBondContact O-N 2.89Å
408	S	96.4	Very high	92.3	Very high	0 Å²	0	53.9 Å²	53.9	0%	0	28%	0.278	C	S	.	.	H	α-helix	trans	-60	-45.8	165	-178.5	0	0	0	0	111.4	M404 S410 L411 G412 V413 Y416 F419	M404-S408 WeakPolarHBondContact O-CB 3.31Å; M404-S408 PolarHBondContact O-N 2.87Å; S408-S410 VanDerWaalsContact C-N 3.28Å; S408-S410 PolarHBondContact O-N 3.08Å; S408-L411 CarbonylContact O-C 3.17Å; S408-L411 WeakPolarHBondContact O-CA 3.24Å; S408-L411 WeakPolarHBondContact O-CB 3.39Å; S408-L411 PolarHBondContact O-N 2.92Å; S408-G412 PolarHBondContact O-N 3.2Å; S408-V413 CarbonylContact C-O 3.55Å; S408-V413 PolarHBondContact O-N 2.93Å; S408-V413 PolarHBondContact OG-O 3.4Å; S408-Y416 VanDerWaalsContact OG-CA 3.3Å; S408-Y416 WeakPolarHBondContact OG-CA 3.47Å; S408-Y416 WeakPolarHBondContact OG-CB 3.23Å; S408-F419 WeakPolarHBondContact OG-CD1 3.43Å
409	N	95.4	Very high	92.6	Very high	75 Å²	75	52.8 Å²	52.8	40%	0.401	27%	0.272	S	S	.	.	H	α-helix	trans	-63.1	-33	175.9	-79.4	-37.1	0	0	0	112.8	K405 R406 L411 G412 V413 K414	K405-N409 WeakPolarHBondContact O-CB 3.35Å; K405-N409 PolarHBondContact O-N 2.88Å; K405-N409 VanDerWaalsContact O-N 3.13Å; K405-N409 PolarHBondContact O-ND2 3.46Å; R406-N409 PolarHBondContact O-N 2.84Å; N409-L411 PolarHBondContact O-N 2.94Å; N409-G412 PolarHBondContact O-N 3.22Å; N409-V413 PolarHBondContact N-O 3.29Å; N409-V413 PolarHBondContact OD1-O 3.11Å; N409-K414 WeakPolarHBondContact OD1-CA 3.24Å
410	S	94.7	Very high	93	Very high	67 Å²	67	51.2 Å²	51.2	47%	0.469	27%	0.266	S	S	.	.	H	α-helix	trans	-64.2	-25.6	173	-59.7	0	0	0	0	113	R406 Y407 S408 G412	R406-S410 PolarHBondContact O-N 3.02Å; R406-S410 VanDerWaalsContact O-N 3.17Å; R406-S410 PolarHBondContact O-OG 3.21Å; Y407-S410 WeakPolarHBondContact O-CB 3.23Å; Y407-S410 PolarHBondContact O-N 2.9Å; S408-S410 VanDerWaalsContact C-N 3.28Å; S408-S410 PolarHBondContact O-N 3.08Å; S410-G412 VanDerWaalsContact C-N 3.28Å
411	L	94.4	Very high	93	Very high	3 Å²	3	48.2 Å²	48.2	2%	0.016	25%	0.25	C	C	.	.	T	Hydrogen-bonded Turn	trans	-89.8	14.6	170.5	-68.8	166.5	0	0	0	112.2	D385 A388 L389 L392 Y407 S408 N409 V413 F419 P466	D385-L411 HydrophobicContact CB-CD2 3.82Å; A388-L411 HydrophobicContact CB-CD1 4.39Å; A388-L411 HydrophobicContact CB-CD2 4.03Å; A388-L411 HydrophobicContact CB-CG 3.82Å; L389-L411 HydrophobicContact CB-CD1 4.36Å; L389-L411 HydrophobicContact CD1-CD1 4.38Å; L392-L411 HydrophobicContact CD2-CD1 3.96Å; Y407-L411 PolarHBondContact O-N 2.89Å; S408-L411 CarbonylContact O-C 3.17Å; S408-L411 WeakPolarHBondContact O-CA 3.24Å; S408-L411 WeakPolarHBondContact O-CB 3.39Å; S408-L411 PolarHBondContact O-N 2.92Å; N409-L411 PolarHBondContact O-N 2.94Å; L411-V413 PolarHBondContact O-N 2.82Å; L411-F419 HydrophobicContact CB-CE1 4.33Å; L411-F419 HydrophobicContact CD1-CE1 3.76Å; L411-F419 HydrophobicContact CD1-CZ 4Å; L411-P466 HydrophobicContact CD2-CG 4.22Å; L411-P466 WeakPolarHBondContact O-CD 3.35Å
412	G	93.9	Very high	92.9	Very high	42 Å²	42	45.6 Å²	45.6	43%	0.433	24%	0.236	S	C	.	.	T	Hydrogen-bonded Turn	trans	76.3	3.3	178.1	0	0	0	0	0	115.2	S408 N409 S410 S464	S408-G412 PolarHBondContact O-N 3.2Å; N409-G412 PolarHBondContact O-N 3.22Å; S410-G412 VanDerWaalsContact C-N 3.28Å; G412-S464 WeakPolarHBondContact O-CB 3.41Å
413	V	94	Very high	92.6	Very high	1 Å²	1	42.2 Å²	42.2	1%	0.006	21%	0.208	C	C	.	.			trans	-104.9	117	-174.8	-174.7	0	0	0	0	111.5	S408 N409 L411 F419 V461 M465	S408-V413 CarbonylContact C-O 3.55Å; S408-V413 PolarHBondContact O-N 2.93Å; S408-V413 PolarHBondContact OG-O 3.4Å; N409-V413 PolarHBondContact N-O 3.29Å; N409-V413 PolarHBondContact OD1-O 3.11Å; L411-V413 PolarHBondContact O-N 2.82Å; V413-F419 HydrophobicContact CB-CB 4.47Å; V413-F419 HydrophobicContact CB-CD1 4.1Å; V413-F419 HydrophobicContact CB-CG 4.17Å; V413-F419 HydrophobicContact CG1-CB 3.71Å; V413-F419 HydrophobicContact CG1-CD1 4.25Å; V413-F419 HydrophobicContact CG1-CD2 4.4Å; V413-F419 HydrophobicContact CG1-CG 3.88Å; V413-F419 HydrophobicContact CG2-CD1 4.33Å; V413-F419 HydrophobicContact CG2-CD2 4.25Å; V413-F419 HydrophobicContact CG2-CE1 4.38Å; V413-F419 HydrophobicContact CG2-CE2 4.32Å; V413-F419 HydrophobicContact CG2-CG 4.26Å; V413-F419 HydrophobicContact CG2-CZ 4.39Å; V413-V461 HydrophobicContact CG1-CB 4.21Å; V413-V461 HydrophobicContact CG1-CG1 3.85Å; V413-V461 HydrophobicContact CG1-CG2 3.86Å; V413-V461 HydrophobicContact CG2-CG1 4.47Å; V413-M465 HydrophobicContact CG2-CB 3.58Å
414	K	91.8	Very high	92.4	Very high	178 Å²	178	41.6 Å²	41.6	77%	0.774	20%	0.202	S	C	*	.	S	Bend	trans	-77.5	-42.4	179.4	-67.1	-177.7	179.6	178.7	0	113.1	N409 Y416	N409-K414 WeakPolarHBondContact OD1-CA 3.24Å; K414-Y416 VanDerWaalsContact C-N 3.25Å; K414-Y416 PolarHBondContact O-N 3.09Å
415	D	91.9	Very high	91.9	Very high	58 Å²	58	42.9 Å²	42.9	31%	0.31	21%	0.208	S	C	.	.			trans	-80.6	78.2	177.8	-163.9	-28.3	0	0	0	109.7	F417 I418 F419 V461	D415-F417 PolarHBondContact O-N 3.29Å; D415-I418 PolarHBondContact OD1-N 2.68Å; D415-I418 VanDerWaalsContact OD2-CD1 3.26Å; D415-I418 WeakPolarHBondContact OD2-CD1 3.43Å; D415-F419 VanDerWaalsContact O-CB 3.25Å; D415-F419 WeakPolarHBondContact O-CB 3.46Å; D415-F419 PolarHBondContact O-N 2.94Å; D415-F419 VanDerWaalsContact O-N 3.12Å; D415-V461 HydrophobicContact CB-CG2 3.93Å
416	Y	92.8	Very high	91.4	Very high	44 Å²	44	38.1 Å²	38.1	17%	0.173	19%	0.188	C	C	.	.	H	α-helix	trans	-67.1	-25.3	-175	72.2	-83.1	0	0	0	112.7	D401 M404 K405 S408 K414 S420 M430	D401-Y416 VanDerWaalsContact OD1-CE2 3.22Å; D401-Y416 WeakPolarHBondContact OD1-CE2 3.4Å; D401-Y416 VanDerWaalsContact OD1-CZ 3.28Å; D401-Y416 PolarHBondContact OD1-OH 3.43Å; D401-Y416 PolarHBondContact OD2-OH 3.45Å; M404-Y416 HydrophobicContact CB-CD2 3.82Å; M404-Y416 HydrophobicContact CB-CE2 4.24Å; M404-Y416 HydrophobicContact CE-CD2 4.09Å; M404-Y416 HydrophobicContact CE-CE2 4.28Å; K405-Y416 HydrophobicContact CB-CD1 3.91Å; K405-Y416 HydrophobicContact CB-CD2 4.44Å; K405-Y416 HydrophobicContact CB-CE1 4.1Å; K405-Y416 HydrophobicContact CB-CG 4.09Å; K405-Y416 HydrophobicContact CD-CD1 4.45Å; K405-Y416 HydrophobicContact CD-CE1 4.21Å; K405-Y416 HydrophobicContact CG-CD1 3.94Å; K405-Y416 HydrophobicContact CG-CE1 4.17Å; S408-Y416 VanDerWaalsContact OG-CA 3.3Å; S408-Y416 WeakPolarHBondContact OG-CA 3.47Å; S408-Y416 WeakPolarHBondContact OG-CB 3.23Å; K414-Y416 VanDerWaalsContact C-N 3.25Å; K414-Y416 PolarHBondContact O-N 3.09Å; Y416-S420 WeakPolarHBondContact O-CB 3.45Å; Y416-S420 PolarHBondContact O-N 3.29Å; Y416-S420 PolarHBondContact O-OG 3.15Å; Y416-M430 HydrophobicContact CE2-CE 4.5Å
417	F	90.6	Very high	90.8	Very high	60 Å²	60	31.1 Å²	31.1	26%	0.263	16%	0.164	S	C	.	.	H	α-helix	trans	-74	-55.3	-177.3	-162.8	-93.1	0	0	0	110.1	D415 F419 S420 E421 I428 M430	D415-F417 PolarHBondContact O-N 3.29Å; F417-F419 VanDerWaalsContact C-N 3.25Å; F417-F419 PolarHBondContact O-N 3.45Å; F417-S420 PolarHBondContact O-N 3.41Å; F417-S420 VanDerWaalsContact O-N 3.09Å; F417-E421 HydrophobicContact CD1-CG 4.23Å; F417-E421 VanDerWaalsContact CE1-CD 3.44Å; F417-E421 HydrophobicContact CE1-CG 4.1Å; F417-E421 WeakPolarHBondContact CE1-OE1 3.44Å; F417-E421 WeakPolarHBondContact O-CG 3.34Å; F417-E421 PolarHBondContact O-N 2.88Å; F417-I428 HydrophobicContact CE2-CB 4.22Å; F417-I428 HydrophobicContact CE2-CG2 4.12Å; F417-I428 HydrophobicContact CZ-CB 4.15Å; F417-I428 HydrophobicContact CZ-CG2 4.47Å; F417-I428 VanDerWaalsContact CZ-O 3.28Å; F417-I428 WeakPolarHBondContact CZ-O 3.41Å; F417-M430 HydrophobicContact CD2-CE 4.27Å; F417-M430 HydrophobicContact CE2-CE 4.16Å; F417-M430 HydrophobicContact CE2-CG 4.45Å
418	I	88.6	Confident	90.1	Very high	12 Å²	12	29.8 Å²	29.8	6%	0.062	16%	0.159	C	C	.	.	H	α-helix	trans	-57.1	-43.7	174.5	-66.8	-176.4	0	0	0	110.2	D415 S420 E421 M422 H454 N457 I458 V461	D415-I418 PolarHBondContact OD1-N 2.68Å; D415-I418 VanDerWaalsContact OD2-CD1 3.26Å; D415-I418 WeakPolarHBondContact OD2-CD1 3.43Å; I418-S420 VanDerWaalsContact C-N 3.33Å; I418-S420 PolarHBondContact O-N 3.04Å; I418-E421 PolarHBondContact O-N 3.4Å; I418-M422 HydrophobicContact CG2-CG 4.25Å; I418-M422 HydrophobicContact CG2-SD 3.72Å; I418-M422 WeakPolarHBondContact O-CB 3.28Å; I418-M422 WeakPolarHBondContact O-CG 3.3Å; I418-M422 PolarHBondContact O-N 3.36Å; I418-H454 HydrophobicContact CD1-CB 4.25Å; I418-N457 HydrophobicContact CD1-CB 3.6Å; I418-I458 HydrophobicContact CG2-CG1 3.88Å; I418-V461 HydrophobicContact CB-CG2 4.41Å; I418-V461 HydrophobicContact CG2-CG2 4.15Å
419	F	91.6	Very high	89.3	Confident	0 Å²	0	32.8 Å²	32.8	0%	0	18%	0.175	C	C	.	.	H	α-helix	trans	-60	-42.2	178.1	-175.9	-132.2	0	0	0	113.3	L392 S408 L411 V413 D415 F417 M422 L423 V461 M465 M469 F473	L392-F419 HydrophobicContact CD2-CD1 3.78Å; L392-F419 HydrophobicContact CD2-CE1 3.39Å; L392-F419 HydrophobicContact CD2-CZ 4.42Å; S408-F419 WeakPolarHBondContact OG-CD1 3.43Å; L411-F419 HydrophobicContact CB-CE1 4.33Å; L411-F419 HydrophobicContact CD1-CE1 3.76Å; L411-F419 HydrophobicContact CD1-CZ 4Å; V413-F419 HydrophobicContact CB-CB 4.47Å; V413-F419 HydrophobicContact CB-CD1 4.1Å; V413-F419 HydrophobicContact CB-CG 4.17Å; V413-F419 HydrophobicContact CG1-CB 3.71Å; V413-F419 HydrophobicContact CG1-CD1 4.25Å; V413-F419 HydrophobicContact CG1-CD2 4.4Å; V413-F419 HydrophobicContact CG1-CG 3.88Å; V413-F419 HydrophobicContact CG2-CD1 4.33Å; V413-F419 HydrophobicContact CG2-CD2 4.25Å; V413-F419 HydrophobicContact CG2-CE1 4.38Å; V413-F419 HydrophobicContact CG2-CE2 4.32Å; V413-F419 HydrophobicContact CG2-CG 4.26Å; V413-F419 HydrophobicContact CG2-CZ 4.39Å; D415-F419 VanDerWaalsContact O-CB 3.25Å; D415-F419 WeakPolarHBondContact O-CB 3.46Å; D415-F419 PolarHBondContact O-N 2.94Å; D415-F419 VanDerWaalsContact O-N 3.12Å; F417-F419 VanDerWaalsContact C-N 3.25Å; F417-F419 PolarHBondContact O-N 3.45Å; F419-M422 PolarHBondContact O-N 2.57Å; F419-L423 VanDerWaalsContact O-CB 3.31Å; F419-L423 WeakPolarHBondContact O-CB 3.31Å; F419-L423 PolarHBondContact O-N 3.29Å; F419-V461 HydrophobicContact CB-CG1 4.05Å; F419-V461 HydrophobicContact CD2-CG1 3.75Å; F419-V461 HydrophobicContact CG-CG1 4.27Å; F419-M465 HydrophobicContact CE2-SD 4.02Å; F419-M469 HydrophobicContact CE2-CE 4.45Å; F419-M469 HydrophobicContact CZ-CE 4.11Å; F419-F473 AromaticContact CD2-CZ 3.95Å; F419-F473 HydrophobicContact CD2-CZ 3.95Å; F419-F473 HydrophobicContact CE2-CE1 4.44Å; F419-F473 HydrophobicContact CE2-CE2 4.42Å; F419-F473 AromaticContact CE2-CZ 3.64Å; F419-F473 HydrophobicContact CE2-CZ 3.64Å
420	S	91.4	Very high	88.4	Confident	0 Å²	0	32.2 Å²	32.2	0%	0	17%	0.171	C	C	.	.	H	α-helix	trans	-70.2	-38.3	179.1	-59.5	0	0	0	0	111.5	Y416 F417 I418 L423 L424	Y416-S420 WeakPolarHBondContact O-CB 3.45Å; Y416-S420 PolarHBondContact O-N 3.29Å; Y416-S420 PolarHBondContact O-OG 3.15Å; F417-S420 PolarHBondContact O-N 3.41Å; F417-S420 VanDerWaalsContact O-N 3.09Å; I418-S420 VanDerWaalsContact C-N 3.33Å; I418-S420 PolarHBondContact O-N 3.04Å; S420-L423 PolarHBondContact O-N 3.01Å; S420-L424 WeakPolarHBondContact O-CG 3.49Å; S420-L424 PolarHBondContact O-N 3.25Å
421	E	88.3	Confident	86.9	Confident	2 Å²	2	36.9 Å²	36.9	1%	0.009	18%	0.178	C	C	.	.	H	α-helix	trans	-65.3	-39	174.1	-68.3	-168.6	141.8	0	0	112.1	F417 I418 Q425 R426 P427 I428 Y446	F417-E421 HydrophobicContact CD1-CG 4.23Å; F417-E421 VanDerWaalsContact CE1-CD 3.44Å; F417-E421 HydrophobicContact CE1-CG 4.1Å; F417-E421 WeakPolarHBondContact CE1-OE1 3.44Å; F417-E421 WeakPolarHBondContact O-CG 3.34Å; F417-E421 PolarHBondContact O-N 2.88Å; I418-E421 PolarHBondContact O-N 3.4Å; E421-Q425 VanDerWaalsContact O-CA 3.24Å; E421-Q425 WeakPolarHBondContact O-CA 3.26Å; E421-Q425 PolarHBondContact O-N 3.44Å; E421-R426 WeakPolarHBondContact CA-O 3.39Å; E421-R426 PolarHBondContact O-N 2.91Å; E421-P427 WeakPolarHBondContact OE1-CA 3.06Å; E421-I428 HydrophobicContact CG-CB 4.21Å; E421-I428 HydrophobicContact CG-CD1 4.08Å; E421-I428 HydrophobicContact CG-CG1 4.04Å; E421-I428 PolarHBondContact OE1-N 2.97Å; E421-I428 VanDerWaalsContact OE1-N 3.13Å; E421-Y446 WeakPolarHBondContact OE1-CE1 3.08Å; E421-Y446 PolarHBondContact OE1-OH 2.82Å; E421-Y446 VanDerWaalsContact OE1-OH 3.1Å; E421-Y446 PolarHBondContact OE2-OH 3.18Å; E421-Y446 VanDerWaalsContact OE2-OH 3.12Å
422	M	85.9	Confident	85.5	Confident	16 Å²	16	39.6 Å²	39.6	8%	0.079	19%	0.191	C	C	.	.	H	α-helix	trans	-63.6	-41.9	172.3	-71	169.1	64.2	0	0	111.8	I418 F419 Q425 I458 V461 L462 F473	I418-M422 HydrophobicContact CG2-CG 4.25Å; I418-M422 HydrophobicContact CG2-SD 3.72Å; I418-M422 WeakPolarHBondContact O-CB 3.28Å; I418-M422 WeakPolarHBondContact O-CG 3.3Å; I418-M422 PolarHBondContact O-N 3.36Å; F419-M422 PolarHBondContact O-N 2.57Å; M422-Q425 VanDerWaalsContact O-CG 3.27Å; M422-Q425 WeakPolarHBondContact O-CG 3.22Å; M422-Q425 PolarHBondContact O-N 2.96Å; M422-I458 HydrophobicContact CE-CG2 4.06Å; M422-I458 HydrophobicContact SD-CG2 4.02Å; M422-V461 HydrophobicContact CE-CG1 4.23Å; M422-V461 HydrophobicContact SD-CB 4.37Å; M422-V461 HydrophobicContact SD-CG1 3.82Å; M422-L462 HydrophobicContact CE-CD1 4.29Å; M422-L462 HydrophobicContact CE-CD2 3.45Å; M422-L462 VanDerWaalsContact CE-CD2 3.45Å; M422-L462 HydrophobicContact CE-CG 3.74Å; M422-F473 HydrophobicContact CB-CE1 4.15Å; M422-F473 HydrophobicContact CB-CZ 4.07Å; M422-F473 HydrophobicContact CE-CE2 3.93Å; M422-F473 HydrophobicContact CE-CZ 4.12Å
423	L	88.9	Confident	83.7	Confident	0 Å²	0	38.8 Å²	38.8	0%	0	18%	0.176	C	C	.	.	H	α-helix	trans	-67.4	-42.8	179.7	-170.1	68	0	0	0	112.5	L389 L392 W393 I396 F419 S420 Q425 M469 F473 I476	L389-L423 HydrophobicContact CD1-CD1 4.18Å; L389-L423 HydrophobicContact CD1-CD2 3.84Å; L392-L423 HydrophobicContact CD2-CD2 4.28Å; W393-L423 HydrophobicContact CE3-CD1 4.26Å; W393-L423 HydrophobicContact CE3-CD2 3.59Å; W393-L423 HydrophobicContact CE3-CG 3.8Å; W393-L423 HydrophobicContact CH2-CG 4.22Å; W393-L423 HydrophobicContact CZ3-CD1 3.68Å; W393-L423 HydrophobicContact CZ3-CD2 3.76Å; W393-L423 HydrophobicContact CZ3-CG 3.39Å; I396-L423 HydrophobicContact CD1-CD2 3.99Å; F419-L423 VanDerWaalsContact O-CB 3.31Å; F419-L423 WeakPolarHBondContact O-CB 3.31Å; F419-L423 PolarHBondContact O-N 3.29Å; S420-L423 PolarHBondContact O-N 3.01Å; L423-Q425 VanDerWaalsContact C-N 3.32Å; L423-M469 HydrophobicContact CD1-CE 4.1Å; L423-F473 HydrophobicContact CB-CE1 3.95Å; L423-F473 HydrophobicContact CD1-CD1 4.15Å; L423-F473 HydrophobicContact CD1-CE1 3.71Å; L423-F473 HydrophobicContact CG-CE1 4.47Å; L423-I476 HydrophobicContact CD1-CD1 3.73Å
424	L	87.4	Confident	81.9	Confident	0 Å²	0	41 Å²	41	0%	0	20%	0.199	C	C	.	.	H	α-helix	trans	-79.2	-15.1	173.6	-60.4	-172.8	0	0	0	112.7	W393 I396 S420 R426 I428 L435 R492 Y493	W393-L424 HydrophobicContact CH2-CD2 4.45Å; W393-L424 HydrophobicContact CZ2-CD2 4.04Å; I396-L424 HydrophobicContact CG2-CD1 3.21Å; I396-L424 HydrophobicContact CG2-CD2 3.91Å; I396-L424 HydrophobicContact CG2-CG 3.75Å; S420-L424 WeakPolarHBondContact O-CG 3.49Å; S420-L424 PolarHBondContact O-N 3.25Å; L424-R426 HydrophobicContact CB-CG 3.66Å; L424-R426 HydrophobicContact CD1-CG 4.31Å; L424-R426 PolarHBondContact O-N 2.99Å; L424-I428 HydrophobicContact CD1-CD1 3.95Å; L424-I428 HydrophobicContact CD1-CG1 3.76Å; L424-L435 HydrophobicContact CD1-CD1 4.44Å; L424-R492 PolarHBondContact O-NH2 2.89Å; L424-Y493 HydrophobicContact CB-CE1 4.08Å; L424-Y493 HydrophobicContact CD2-CD1 3.84Å; L424-Y493 HydrophobicContact CD2-CE1 4.22Å; L424-Y493 WeakPolarHBondContact O-CE1 3.26Å
425	Q	84.8	Confident	80.5	Confident	27 Å²	27	33.2 Å²	33.2	13%	0.126	17%	0.166	C	C	.	.	T	Hydrogen-bonded Turn	trans	52.7	38.5	-172.6	-58.2	174.2	6.9	0	0	112.4	E421 M422 L423 F473 N477 R480	E421-Q425 VanDerWaalsContact O-CA 3.24Å; E421-Q425 WeakPolarHBondContact O-CA 3.26Å; E421-Q425 PolarHBondContact O-N 3.44Å; M422-Q425 VanDerWaalsContact O-CG 3.27Å; M422-Q425 WeakPolarHBondContact O-CG 3.22Å; M422-Q425 PolarHBondContact O-N 2.96Å; L423-Q425 VanDerWaalsContact C-N 3.32Å; Q425-F473 PolarHBondContact NE2-O 3.43Å; Q425-N477 VanDerWaalsContact NE2-CB 3.28Å; Q425-N477 VanDerWaalsContact NE2-N 3.14Å; Q425-N477 VanDerWaalsContact OE1-CA 3.32Å; Q425-N477 PolarHBondContact OE1-OD1 3.2Å; Q425-N477 VanDerWaalsContact OE1-OD1 3.13Å; Q425-R480 VanDerWaalsContact OE1-CD 3.31Å
426	R	84.6	Confident	79.1	Confident	12 Å²	12	33.1 Å²	33.1	5%	0.045	17%	0.17	C	C	.	.	S	Bend	trans	-160.8	159.3	178.8	68.4	171.1	-74.9	157.3	2.5	110.5	E421 L424 L435 S436 L439 E443 Y493	E421-R426 WeakPolarHBondContact CA-O 3.39Å; E421-R426 PolarHBondContact O-N 2.91Å; L424-R426 HydrophobicContact CB-CG 3.66Å; L424-R426 HydrophobicContact CD1-CG 4.31Å; L424-R426 PolarHBondContact O-N 2.99Å; R426-L435 VanDerWaalsContact CZ-CD2 3.48Å; R426-S436 PolarHBondContact NH1-O 3.35Å; R426-S436 PolarHBondContact NH1-OG 3.21Å; R426-L439 HydrophobicContact CB-CD2 3.51Å; R426-E443 IonicContact CZ-OE1 2.72Å; R426-E443 IonicContact NE-OE1 3Å; R426-E443 IonicContact NH2-OE1 3.03Å; R426-E443 PolarHBondContact NH2-OE1 2.92Å; R426-Y493 VanDerWaalsContact CD-CZ 3.5Å; R426-Y493 WeakPolarHBondContact CD-OH 3.45Å; R426-Y493 HydrophobicContact CG-CE1 4.32Å
427	P	83.3	Confident	78	Confident	19 Å²	19	32.7 Å²	32.7	12%	0.123	17%	0.171	C	C	.	.			trans	-63.1	150.2	170.9	24	-31.4	0	0	0	111.8	E421 E443 Y446	E421-P427 WeakPolarHBondContact OE1-CA 3.06Å; P427-E443 HydrophobicContact CG-CB 3.71Å; P427-E443 HydrophobicContact CG-CG 3.58Å; P427-Y446 HydrophobicContact CB-CD1 3.64Å; P427-Y446 HydrophobicContact CB-CE1 3.68Å; P427-Y446 HydrophobicContact CB-CG 4.49Å; P427-Y446 HydrophobicContact CG-CD1 4.17Å
428	I	81.9	Confident	77	Confident	9 Å²	9	34.8 Å²	34.8	5%	0.046	18%	0.183	C	C	.	.			trans	-106.5	107.3	173.8	-70.5	168.9	0	0	0	109.1	I396 M404 F417 E421 L424 M430	I396-I428 HydrophobicContact CG2-CD1 4.1Å; M404-I428 HydrophobicContact CE-CD1 4.29Å; F417-I428 HydrophobicContact CE2-CB 4.22Å; F417-I428 HydrophobicContact CE2-CG2 4.12Å; F417-I428 HydrophobicContact CZ-CB 4.15Å; F417-I428 HydrophobicContact CZ-CG2 4.47Å; F417-I428 VanDerWaalsContact CZ-O 3.28Å; F417-I428 WeakPolarHBondContact CZ-O 3.41Å; E421-I428 HydrophobicContact CG-CB 4.21Å; E421-I428 HydrophobicContact CG-CD1 4.08Å; E421-I428 HydrophobicContact CG-CG1 4.04Å; E421-I428 PolarHBondContact OE1-N 2.97Å; E421-I428 VanDerWaalsContact OE1-N 3.13Å; L424-I428 HydrophobicContact CD1-CD1 3.95Å; L424-I428 HydrophobicContact CD1-CG1 3.76Å; I428-M430 HydrophobicContact CG2-CE 4.27Å; I428-M430 HydrophobicContact CG2-CG 4.38Å; I428-M430 HydrophobicContact CG2-SD 3.9Å
429	N	79	Confident	76.2	Confident	64 Å²	64	36.3 Å²	36.3	34%	0.342	19%	0.191	S	C	.	.			trans	-88.9	111.5	165.3	-170	-13.8	0	0	0	109.1	R399 R431 E432	R399-N429 PolarHBondContact NE-O 3.35Å; R399-N429 VanDerWaalsContact NE-O 3.12Å; R399-N429 PolarHBondContact NH2-O 3.08Å; N429-R431 PolarHBondContact O-N 3.28Å; N429-R431 VanDerWaalsContact OD1-CB 3.31Å; N429-R431 WeakPolarHBondContact OD1-CB 3.45Å; N429-R431 PolarHBondContact OD1-N 3.37Å; N429-E432 HydrophobicContact CB-CB 4.27Å; N429-E432 VanDerWaalsContact ND2-CD 3.34Å; N429-E432 PolarHBondContact ND2-OE1 2.96Å; N429-E432 PolarHBondContact O-N 3.36Å
430	M	75.9	Confident	75.5	Confident	62 Å²	62	38.8 Å²	38.8	31%	0.305	21%	0.209	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.9	-17.2	177.1	-67.8	-63.1	-161	0	0	112.9	R399 D401 M404 Y416 F417 I428	R399-M430 HydrophobicContact CB-SD 4.46Å; D401-M430 HydrophobicContact CB-CE 4.28Å; D401-M430 WeakPolarHBondContact OD1-CE 3.35Å; M404-M430 HydrophobicContact CE-CE 3.58Å; M404-M430 HydrophobicContact SD-CE 3.67Å; M404-M430 HydrophobicContact SD-SD 4.33Å; Y416-M430 HydrophobicContact CE2-CE 4.5Å; F417-M430 HydrophobicContact CD2-CE 4.27Å; F417-M430 HydrophobicContact CE2-CE 4.16Å; F417-M430 HydrophobicContact CE2-CG 4.45Å; I428-M430 HydrophobicContact CG2-CE 4.27Å; I428-M430 HydrophobicContact CG2-CG 4.38Å; I428-M430 HydrophobicContact CG2-SD 3.9Å
431	R	64.9	Low	74.7	Confident	166 Å²	166	49.4 Å²	49.4	63%	0.626	25%	0.249	S	C	*	.	T	Hydrogen-bonded Turn	trans	-86.6	-17.4	178.9	-55.6	179.8	-178.2	176.6	0.5	112.6	N429 M544 E565 Y569	N429-R431 PolarHBondContact O-N 3.28Å; N429-R431 VanDerWaalsContact OD1-CB 3.31Å; N429-R431 WeakPolarHBondContact OD1-CB 3.45Å; N429-R431 PolarHBondContact OD1-N 3.37Å; R431-M544 WeakPolarHBondContact O-CE 3.39Å; R431-E565 IonicContact NH1-OE2 2.79Å; R431-E565 PolarHBondContact NH1-OE2 2.97Å; R431-Y569 VanDerWaalsContact O-CE2 3.31Å; R431-Y569 WeakPolarHBondContact O-CE2 3.47Å
432	E	63.6	Low	74.2	Confident	60 Å²	60	55.7 Å²	55.7	28%	0.28	28%	0.278	S	S	.	.			trans	-123.1	127.8	-176.3	-71.8	168.7	-158	0	0	111.9	R399 N429 Y569	R399-E432 PolarHBondContact NE-O 3.18Å; R399-E432 VanDerWaalsContact NE-O 3.07Å; R399-E432 PolarHBondContact NH2-O 3.41Å; N429-E432 HydrophobicContact CB-CB 4.27Å; N429-E432 VanDerWaalsContact ND2-CD 3.34Å; N429-E432 PolarHBondContact ND2-OE1 2.96Å; N429-E432 PolarHBondContact O-N 3.36Å; E432-Y569 HydrophobicContact CG-CD2 4Å; E432-Y569 HydrophobicContact CG-CE2 4.25Å
433	L	56.2	Low	73.9	Confident	25 Å²	25	56.5 Å²	56.5	13%	0.131	28%	0.281	C	S	.	.			trans	-82.4	-18	173.5	-88.5	105.7	0	0	0	113.2	R399 L435 L537 E540 M544	R399-L433 HydrophobicContact CG-CG 4.29Å; L433-L435 PolarHBondContact O-N 3Å; L433-L537 HydrophobicContact CD2-CD1 4.43Å; L433-E540 HydrophobicContact CD1-CB 3.89Å; L433-E540 HydrophobicContact CD2-CB 3.64Å; L433-E540 HydrophobicContact CD2-CG 4.4Å; L433-E540 HydrophobicContact CG-CB 4.45Å; L433-M544 HydrophobicContact CB-CE 4.43Å; L433-M544 HydrophobicContact CB-SD 3.47Å; L433-M544 WeakPolarHBondContact CB-SD 3.49Å; L433-M544 HydrophobicContact CD1-CE 3.78Å; L433-M544 HydrophobicContact CD1-CG 3.86Å; L433-M544 HydrophobicContact CD1-SD 3.22Å; L433-M544 WeakPolarHBondContact CD1-SD 3.36Å; L433-M544 HydrophobicContact CG-SD 3.91Å; L433-M544 PolarHBondContact N-SD 2.87Å
434	G	57.6	Low	73.2	Confident	47 Å²	47	59.1 Å²	59.1	49%	0.485	30%	0.298	S	S	.	.			trans	-66.1	107.4	-174.9	0	0	0	0	0	112
435	L	60.6	Low	72.6	Confident	14 Å²	14	61.7 Å²	61.7	7%	0.073	31%	0.314	C	S	.	.			trans	-99.9	85.4	171	-60	178.1	0	0	0	110.3	V397 L424 R426 L433 Y493	V397-L435 HydrophobicContact CG2-CD1 4.42Å; L424-L435 HydrophobicContact CD1-CD1 4.44Å; R426-L435 VanDerWaalsContact CZ-CD2 3.48Å; L433-L435 PolarHBondContact O-N 3Å; L435-Y493 HydrophobicContact CB-CD2 3.41Å; L435-Y493 VanDerWaalsContact CB-CD2 3.41Å; L435-Y493 HydrophobicContact CB-CE2 3.91Å; L435-Y493 HydrophobicContact CB-CG 3.9Å; L435-Y493 VanDerWaalsContact CD1-CB 3.48Å; L435-Y493 HydrophobicContact CD1-CD1 4.1Å; L435-Y493 HydrophobicContact CD1-CD2 4.06Å; L435-Y493 HydrophobicContact CD1-CG 3.63Å; L435-Y493 HydrophobicContact CG-CD2 4.34Å; L435-Y493 HydrophobicContact CG-CG 4.39Å
436	S	63.7	Low	72.5	Confident	56 Å²	56	65 Å²	65	39%	0.392	33%	0.326	S	S	.	.			trans	-51.2	143.4	168.8	59.3	0	0	0	0	111.8	R426 I438 Y493	R426-S436 PolarHBondContact NH1-O 3.35Å; R426-S436 PolarHBondContact NH1-OG 3.21Å; S436-I438 VanDerWaalsContact C-N 3.27Å; S436-I438 PolarHBondContact O-N 2.92Å; S436-I438 PolarHBondContact OG-O 2.84Å; S436-Y493 WeakPolarHBondContact O-CE2 3.28Å
437	N	68.4	Low	72.2	Confident	36 Å²	36	66.2 Å²	66.2	19%	0.193	33%	0.332	C	S	.	.	S	Bend	trans	-77	-17.9	179.5	-64.5	-31.3	0	0	0	113.6	A488 V490 D491	N437-A488 HydrophobicContact CB-CB 3.66Å; N437-A488 PolarHBondContact ND2-O 3.24Å; N437-V490 VanDerWaalsContact CG-O 3.26Å; N437-V490 PolarHBondContact ND2-O 3.24Å; N437-V490 PolarHBondContact OD1-O 3.03Å; N437-D491 PolarHBondContact ND2-N 3.01Å; N437-D491 VanDerWaalsContact OD1-CA 3.23Å; N437-D491 WeakPolarHBondContact OD1-CA 3.33Å
438	I	70.5	Confident	71.7	Confident	104 Å²	104	71.9 Å²	71.9	53%	0.533	35%	0.351	S	S	.	.	S	Bend	trans	-117.2	131.5	178.7	-57.8	176.4	0	0	0	107.2	S436 A488	S436-I438 VanDerWaalsContact C-N 3.27Å; S436-I438 PolarHBondContact O-N 2.92Å; S436-I438 PolarHBondContact OG-O 2.84Å; I438-A488 HydrophobicContact CD1-CB 3.92Å; I438-A488 HydrophobicContact CG1-CB 3.61Å
439	L	70.8	Confident	71.3	Confident	43 Å²	43	75 Å²	75	23%	0.225	37%	0.368	C	S	.	.			trans	-68.9	136.9	175.6	-70.6	168.7	0	0	0	110.3	R426 E443	R426-L439 HydrophobicContact CB-CD2 3.51Å; L439-E443 WeakPolarHBondContact CA-OE2 3.24Å; L439-E443 HydrophobicContact CB-CB 4.43Å; L439-E443 HydrophobicContact CD2-CB 3.91Å
440	S	78.7	Confident	71.2	Confident	52 Å²	52	72.6 Å²	72.6	36%	0.364	36%	0.355	S	S	.	.			trans	-68.3	165.2	168.1	88.5	0	0	0	0	110.8	E442 E443 T444	S440-E442 PolarHBondContact O-N 3.44Å; S440-E442 PolarHBondContact OG-N 3.48Å; S440-E443 PolarHBondContact N-OE2 3.29Å; S440-E443 PolarHBondContact O-N 3.39Å; S440-E443 WeakPolarHBondContact OG-CG 3.32Å; S440-E443 PolarHBondContact OG-N 3.07Å; S440-E443 VanDerWaalsContact OG-N 3.08Å; S440-T444 WeakPolarHBondContact O-CB 3.35Å; S440-T444 PolarHBondContact O-N 3.43Å; S440-T444 PolarHBondContact O-OG1 2.81Å
441	R	73.5	Confident	70.9	Confident	224 Å²	224	71.4 Å²	71.4	85%	0.845	36%	0.355	S	S	*	.	H	α-helix	trans	-61.7	-37.1	175.2	-174.8	177.7	177.7	-177.9	-1.1	111.3	T445	R441-T445 PolarHBondContact O-N 3.43Å; R441-T445 PolarHBondContact O-OG1 3.06Å
442	E	77.8	Confident	71	Confident	133 Å²	133	67.1 Å²	67.1	62%	0.621	35%	0.347	S	S	*	.	H	α-helix	trans	-66.3	-49.4	177.7	-66.9	169.7	-166	0	0	110.5	S440 T444 T445 Y446	S440-E442 PolarHBondContact O-N 3.44Å; S440-E442 PolarHBondContact OG-N 3.48Å; E442-T444 VanDerWaalsContact C-N 3.3Å; E442-T444 PolarHBondContact O-N 3.22Å; E442-T445 WeakPolarHBondContact O-CB 3.38Å; E442-T445 PolarHBondContact O-N 2.92Å; E442-Y446 PolarHBondContact O-N 3.33Å
443	E	79.5	Confident	71.4	Confident	33 Å²	33	70 Å²	70	15%	0.154	36%	0.364	C	S	.	.	H	α-helix	trans	-60.8	-39.6	176.5	-66.2	179.5	121.9	0	0	111.9	R426 P427 L439 S440 T445 Y446 M447	R426-E443 IonicContact CZ-OE1 2.72Å; R426-E443 IonicContact NE-OE1 3Å; R426-E443 IonicContact NH2-OE1 3.03Å; R426-E443 PolarHBondContact NH2-OE1 2.92Å; P427-E443 HydrophobicContact CG-CB 3.71Å; P427-E443 HydrophobicContact CG-CG 3.58Å; L439-E443 WeakPolarHBondContact CA-OE2 3.24Å; L439-E443 HydrophobicContact CB-CB 4.43Å; L439-E443 HydrophobicContact CD2-CB 3.91Å; S440-E443 PolarHBondContact N-OE2 3.29Å; S440-E443 PolarHBondContact O-N 3.39Å; S440-E443 WeakPolarHBondContact OG-CG 3.32Å; S440-E443 PolarHBondContact OG-N 3.07Å; S440-E443 VanDerWaalsContact OG-N 3.08Å; E443-T445 VanDerWaalsContact C-N 3.28Å; E443-T445 PolarHBondContact O-N 3.27Å; E443-Y446 PolarHBondContact O-N 2.8Å; E443-M447 VanDerWaalsContact O-CG 3.26Å; E443-M447 WeakPolarHBondContact O-CG 3.46Å; E443-M447 PolarHBondContact O-N 3.38Å
444	T	75.2	Confident	72.3	Confident	55 Å²	55	72.9 Å²	72.9	34%	0.337	38%	0.377	S	S	.	.	H	α-helix	trans	-63.8	-36.5	176.5	-57.1	0	0	0	0	111.6	S440 E442 R448	S440-T444 WeakPolarHBondContact O-CB 3.35Å; S440-T444 PolarHBondContact O-N 3.43Å; S440-T444 PolarHBondContact O-OG1 2.81Å; E442-T444 VanDerWaalsContact C-N 3.3Å; E442-T444 PolarHBondContact O-N 3.22Å; T444-R448 PolarHBondContact O-N 3.2Å
445	T	74.5	Confident	73	Confident	55 Å²	55	74 Å²	74	34%	0.337	37%	0.368	S	S	.	.	H	α-helix	trans	-71.4	-47.4	178.5	-55.1	0	0	0	0	109.9	R441 E442 E443 M447 R448 D449	R441-T445 PolarHBondContact O-N 3.43Å; R441-T445 PolarHBondContact O-OG1 3.06Å; E442-T445 WeakPolarHBondContact O-CB 3.38Å; E442-T445 PolarHBondContact O-N 2.92Å; E443-T445 VanDerWaalsContact C-N 3.28Å; E443-T445 PolarHBondContact O-N 3.27Å; T445-M447 VanDerWaalsContact C-N 3.34Å; T445-M447 PolarHBondContact O-N 2.95Å; T445-R448 WeakPolarHBondContact O-CB 3.35Å; T445-R448 PolarHBondContact O-N 2.97Å; T445-R448 VanDerWaalsContact O-N 3.08Å; T445-D449 VanDerWaalsContact O-CG 3.31Å; T445-D449 PolarHBondContact O-N 3.38Å
446	Y	82.6	Confident	73.6	Confident	96 Å²	96	79.3 Å²	79.3	38%	0.376	40%	0.397	S	S	.	.	H	α-helix	trans	-53.7	-48.4	173.1	171.9	-89.8	0	0	0	112.1	E421 P427 E442 E443 R448 D449 M450	E421-Y446 WeakPolarHBondContact OE1-CE1 3.08Å; E421-Y446 PolarHBondContact OE1-OH 2.82Å; E421-Y446 VanDerWaalsContact OE1-OH 3.1Å; E421-Y446 PolarHBondContact OE2-OH 3.18Å; E421-Y446 VanDerWaalsContact OE2-OH 3.12Å; P427-Y446 HydrophobicContact CB-CD1 3.64Å; P427-Y446 HydrophobicContact CB-CE1 3.68Å; P427-Y446 HydrophobicContact CB-CG 4.49Å; P427-Y446 HydrophobicContact CG-CD1 4.17Å; E442-Y446 PolarHBondContact O-N 3.33Å; E443-Y446 PolarHBondContact O-N 2.8Å; Y446-R448 VanDerWaalsContact C-N 3.26Å; Y446-R448 PolarHBondContact O-N 3.19Å; Y446-D449 PolarHBondContact O-N 2.85Å; Y446-M450 HydrophobicContact CE1-CB 4.27Å; Y446-M450 VanDerWaalsContact O-CB 3.23Å; Y446-M450 WeakPolarHBondContact O-CB 3.27Å; Y446-M450 PolarHBondContact O-N 3.45Å
447	M	78.7	Confident	74.4	Confident	37 Å²	37	80 Å²	80	18%	0.182	40%	0.397	C	S	.	.	H	α-helix	trans	-62.8	-35.2	-179.7	-70.9	-64.2	-65.1	0	0	112.2	E443 T445 M450 A451	E443-M447 VanDerWaalsContact O-CG 3.26Å; E443-M447 WeakPolarHBondContact O-CG 3.46Å; E443-M447 PolarHBondContact O-N 3.38Å; T445-M447 VanDerWaalsContact C-N 3.34Å; T445-M447 PolarHBondContact O-N 2.95Å; M447-M450 HydrophobicContact CE-CE 3.79Å; M447-M450 HydrophobicContact SD-CE 4.04Å; M447-A451 WeakPolarHBondContact O-CB 3.15Å; M447-A451 PolarHBondContact O-N 2.89Å
448	R	72.1	Confident	75	Confident	138 Å²	138	78.6 Å²	78.6	52%	0.521	39%	0.389	S	S	.	.	H	α-helix	trans	-68.1	-46.2	175.2	-173.9	-176.4	-67.5	126.3	-0.4	110.8	T444 T445 Y446 M450 A451 V452	T444-R448 PolarHBondContact O-N 3.2Å; T445-R448 WeakPolarHBondContact O-CB 3.35Å; T445-R448 PolarHBondContact O-N 2.97Å; T445-R448 VanDerWaalsContact O-N 3.08Å; Y446-R448 VanDerWaalsContact C-N 3.26Å; Y446-R448 PolarHBondContact O-N 3.19Å; R448-M450 VanDerWaalsContact C-N 3.33Å; R448-A451 PolarHBondContact O-N 2.85Å; R448-V452 WeakPolarHBondContact O-CG2 3.48Å; R448-V452 PolarHBondContact O-N 2.91Å; R448-V452 VanDerWaalsContact O-N 3.11Å
449	D	73.1	Confident	75.4	Confident	76 Å²	76	74.6 Å²	74.6	41%	0.406	37%	0.368	S	S	.	.	H	α-helix	trans	-66	-38.8	179.5	-65.5	-14.7	0	0	0	111	T445 Y446 A451 V452 N453	T445-D449 VanDerWaalsContact O-CG 3.31Å; T445-D449 PolarHBondContact O-N 3.38Å; Y446-D449 PolarHBondContact O-N 2.85Å; D449-A451 PolarHBondContact O-N 3.39Å; D449-V452 PolarHBondContact O-N 3.38Å; D449-N453 VanDerWaalsContact O-CB 3.24Å; D449-N453 WeakPolarHBondContact O-CB 3.21Å; D449-N453 VanDerWaalsContact O-CG 3.31Å; D449-N453 PolarHBondContact O-N 3.46Å; D449-N453 PolarHBondContact O-ND2 3.3Å; D449-N453 VanDerWaalsContact O-ND2 3.14Å
450	M	77.1	Confident	76	Confident	12 Å²	12	76.8 Å²	76.8	6%	0.059	38%	0.383	C	S	.	.	H	α-helix	trans	-60.5	-45.2	174	-175.9	-83.4	-75.5	0	0	110.9	Y446 M447 R448 V452 H454 I458	Y446-M450 HydrophobicContact CE1-CB 4.27Å; Y446-M450 VanDerWaalsContact O-CB 3.23Å; Y446-M450 WeakPolarHBondContact O-CB 3.27Å; Y446-M450 PolarHBondContact O-N 3.45Å; M447-M450 HydrophobicContact CE-CE 3.79Å; M447-M450 HydrophobicContact SD-CE 4.04Å; R448-M450 VanDerWaalsContact C-N 3.33Å; M450-V452 VanDerWaalsContact C-N 3.33Å; M450-V452 PolarHBondContact O-N 2.97Å; M450-H454 WeakPolarHBondContact O-CA 3.43Å; M450-H454 VanDerWaalsContact O-CB 3.31Å; M450-H454 WeakPolarHBondContact O-CB 3.27Å; M450-H454 PolarHBondContact O-N 3.01Å; M450-I458 HydrophobicContact SD-CD1 3.63Å; M450-I458 HydrophobicContact SD-CG1 4.15Å
451	A	69.9	Low	76.4	Confident	37 Å²	37	74.4 Å²	74.4	31%	0.306	37%	0.366	S	S	.	.	H	α-helix	trans	-62.5	-37.3	177.5	0	0	0	0	0	113.3	M447 R448 D449	M447-A451 WeakPolarHBondContact O-CB 3.15Å; M447-A451 PolarHBondContact O-N 2.89Å; R448-A451 PolarHBondContact O-N 2.85Å; D449-A451 PolarHBondContact O-N 3.39Å
452	V	66.9	Low	76.9	Confident	77 Å²	77	64 Å²	64	47%	0.467	33%	0.327	S	S	.	.	H	α-helix	trans	-77.9	-48.6	179.8	174.7	0	0	0	0	111.4	R448 D449 M450	R448-V452 WeakPolarHBondContact O-CG2 3.48Å; R448-V452 PolarHBondContact O-N 2.91Å; R448-V452 VanDerWaalsContact O-N 3.11Å; D449-V452 PolarHBondContact O-N 3.38Å; M450-V452 VanDerWaalsContact C-N 3.33Å; M450-V452 PolarHBondContact O-N 2.97Å
453	N	72.9	Confident	77.1	Confident	120 Å²	120	63.4 Å²	63.4	64%	0.642	32%	0.323	S	S	*	.	H	α-helix	trans	-83.3	-24.5	-170.5	-63.2	-36.4	0	0	0	113.3	D449	D449-N453 VanDerWaalsContact O-CB 3.24Å; D449-N453 WeakPolarHBondContact O-CB 3.21Å; D449-N453 VanDerWaalsContact O-CG 3.31Å; D449-N453 PolarHBondContact O-N 3.46Å; D449-N453 PolarHBondContact O-ND2 3.3Å; D449-N453 VanDerWaalsContact O-ND2 3.14Å
454	H	74.8	Confident	77.5	Confident	85 Å²	85	64.6 Å²	64.6	39%	0.394	34%	0.335	S	S	.	.	T	Hydrogen-bonded Turn	trans	-113.1	22.4	-179.7	-61.9	-80.5	0	0	0	113.3	I418 M450 D456 N457 I458	I418-H454 HydrophobicContact CD1-CB 4.25Å; M450-H454 WeakPolarHBondContact O-CA 3.43Å; M450-H454 VanDerWaalsContact O-CB 3.31Å; M450-H454 WeakPolarHBondContact O-CB 3.27Å; M450-H454 PolarHBondContact O-N 3.01Å; H454-D456 VanDerWaalsContact C-N 3.29Å; H454-D456 PolarHBondContact O-N 3Å; H454-N457 HydrophobicContact CB-CB 4.48Å; H454-N457 PolarHBondContact O-N 3.34Å; H454-I458 WeakPolarHBondContact O-CG1 3.49Å; H454-I458 PolarHBondContact O-N 3.14Å
455	F	71.4	Confident	78.2	Confident	70 Å²	70	62.4 Å²	62.4	31%	0.307	32%	0.321	S	S	.	.	H	α-helix	trans	-50	-46.4	-178.6	-173.2	-96.3	0	0	0	113.2	L150 N457 I458 M459	L150-F455 WeakPolarHBondContact O-CE2 3.32Å; F455-N457 VanDerWaalsContact C-N 3.35Å; F455-N457 PolarHBondContact O-N 2.7Å; F455-I458 PolarHBondContact O-N 2.85Å; F455-M459 HydrophobicContact CD1-CG 3.98Å; F455-M459 HydrophobicContact CD2-CE 4.2Å; F455-M459 HydrophobicContact CE1-CE 4.11Å; F455-M459 HydrophobicContact CE1-CG 3.61Å; F455-M459 HydrophobicContact CE1-SD 4.11Å; F455-M459 HydrophobicContact CE2-CE 3.61Å; F455-M459 HydrophobicContact CZ-CE 3.56Å; F455-M459 HydrophobicContact CZ-CG 4.02Å; F455-M459 HydrophobicContact CZ-SD 3.92Å; F455-M459 WeakPolarHBondContact O-CG 3.48Å; F455-M459 PolarHBondContact O-N 3.4Å
456	D	74.3	Confident	78.9	Confident	126 Å²	126	61 Å²	61	67%	0.674	31%	0.313	S	S	*	.	H	α-helix	trans	-63.2	-39.7	-179.5	-72	-32	0	0	0	112.2	H454 M459 V460	H454-D456 VanDerWaalsContact C-N 3.29Å; H454-D456 PolarHBondContact O-N 3Å; D456-M459 WeakPolarHBondContact O-CB 3.28Å; D456-M459 PolarHBondContact O-N 2.75Å; D456-V460 WeakPolarHBondContact O-CG2 3.45Å; D456-V460 PolarHBondContact O-N 2.63Å
457	N	79.9	Confident	78.9	Confident	72 Å²	72	62.1 Å²	62.1	39%	0.385	32%	0.316	S	S	.	.	H	α-helix	trans	-68.5	-41.9	177.2	-65.7	-13.3	0	0	0	111.2	I418 H454 F455 M459 V460 V461	I418-N457 HydrophobicContact CD1-CB 3.6Å; H454-N457 HydrophobicContact CB-CB 4.48Å; H454-N457 PolarHBondContact O-N 3.34Å; F455-N457 VanDerWaalsContact C-N 3.35Å; F455-N457 PolarHBondContact O-N 2.7Å; N457-M459 VanDerWaalsContact C-N 3.29Å; N457-M459 PolarHBondContact O-N 3.45Å; N457-V460 WeakPolarHBondContact O-CB 3.2Å; N457-V460 PolarHBondContact O-N 3.09Å; N457-V460 VanDerWaalsContact O-N 3.09Å; N457-V461 WeakPolarHBondContact O-CG2 3.34Å; N457-V461 PolarHBondContact O-N 2.83Å
458	I	80.7	Confident	79.3	Confident	5 Å²	5	61.5 Å²	61.5	3%	0.026	32%	0.315	C	S	.	.	H	α-helix	trans	-57.4	-45.8	173.6	-65.5	167	0	0	0	109.6	I418 M422 M450 H454 F455 V460 V461 L462	I418-I458 HydrophobicContact CG2-CG1 3.88Å; M422-I458 HydrophobicContact CE-CG2 4.06Å; M422-I458 HydrophobicContact SD-CG2 4.02Å; M450-I458 HydrophobicContact SD-CD1 3.63Å; M450-I458 HydrophobicContact SD-CG1 4.15Å; H454-I458 WeakPolarHBondContact O-CG1 3.49Å; H454-I458 PolarHBondContact O-N 3.14Å; F455-I458 PolarHBondContact O-N 2.85Å; I458-V460 VanDerWaalsContact C-N 3.3Å; I458-V460 PolarHBondContact O-N 2.95Å; I458-V461 WeakPolarHBondContact O-CB 3.44Å; I458-V461 PolarHBondContact O-N 3.3Å; I458-L462 HydrophobicContact CG2-CD1 3.67Å; I458-L462 HydrophobicContact CG2-CG 4.41Å; I458-L462 VanDerWaalsContact O-CD1 3.23Å; I458-L462 WeakPolarHBondContact O-CD1 3.37Å; I458-L462 VanDerWaalsContact O-CG 3.25Å; I458-L462 WeakPolarHBondContact O-CG 3.44Å; I458-L462 PolarHBondContact O-N 2.88Å
459	M	78.8	Confident	80.1	Confident	21 Å²	21	55 Å²	55	10%	0.103	29%	0.29	C	S	.	.	H	α-helix	trans	-60.1	-38.2	175.8	-69.8	-54.8	110.9	0	0	112.7	L150 F455 D456 N457 L462 K463	L150-M459 HydrophobicContact CB-CE 4.12Å; L150-M459 HydrophobicContact CD2-CE 3.58Å; L150-M459 HydrophobicContact CG-CE 4.39Å; F455-M459 HydrophobicContact CD1-CG 3.98Å; F455-M459 HydrophobicContact CD2-CE 4.2Å; F455-M459 HydrophobicContact CE1-CE 4.11Å; F455-M459 HydrophobicContact CE1-CG 3.61Å; F455-M459 HydrophobicContact CE1-SD 4.11Å; F455-M459 HydrophobicContact CE2-CE 3.61Å; F455-M459 HydrophobicContact CZ-CE 3.56Å; F455-M459 HydrophobicContact CZ-CG 4.02Å; F455-M459 HydrophobicContact CZ-SD 3.92Å; F455-M459 WeakPolarHBondContact O-CG 3.48Å; F455-M459 PolarHBondContact O-N 3.4Å; D456-M459 WeakPolarHBondContact O-CB 3.28Å; D456-M459 PolarHBondContact O-N 2.75Å; N457-M459 VanDerWaalsContact C-N 3.29Å; N457-M459 PolarHBondContact O-N 3.45Å; M459-L462 HydrophobicContact CE-CD1 3.77Å; M459-L462 HydrophobicContact SD-CD1 4.38Å; M459-K463 WeakPolarHBondContact O-CB 3.4Å; M459-K463 WeakPolarHBondContact O-CD 3.47Å; M459-K463 WeakPolarHBondContact O-CG 3.25Å; M459-K463 PolarHBondContact O-N 3.46Å; M459-K463 VanDerWaalsContact O-N 3.07Å
460	V	84.3	Confident	80.6	Confident	88 Å²	88	51.9 Å²	51.9	53%	0.533	27%	0.274	S	S	.	.	H	α-helix	trans	-65.2	-45.3	175.1	171.2	0	0	0	0	110.9	D456 N457 I458 L462 K463 S464	D456-V460 WeakPolarHBondContact O-CG2 3.45Å; D456-V460 PolarHBondContact O-N 2.63Å; N457-V460 WeakPolarHBondContact O-CB 3.2Å; N457-V460 PolarHBondContact O-N 3.09Å; N457-V460 VanDerWaalsContact O-N 3.09Å; I458-V460 VanDerWaalsContact C-N 3.3Å; I458-V460 PolarHBondContact O-N 2.95Å; V460-L462 PolarHBondContact O-N 3.38Å; V460-K463 PolarHBondContact O-N 2.94Å; V460-S464 WeakPolarHBondContact O-CB 3.24Å; V460-S464 PolarHBondContact O-N 2.84Å; V460-S464 VanDerWaalsContact O-N 3.08Å; V460-S464 PolarHBondContact O-OG 3.2Å
461	V	87	Confident	80.9	Confident	3 Å²	3	52.1 Å²	52.1	2%	0.018	28%	0.275	C	S	.	.	H	α-helix	trans	-55.3	-51.5	176.2	164.8	0	0	0	0	110.8	V413 D415 I418 F419 M422 N457 I458 K463 S464 M465	V413-V461 HydrophobicContact CG1-CB 4.21Å; V413-V461 HydrophobicContact CG1-CG1 3.85Å; V413-V461 HydrophobicContact CG1-CG2 3.86Å; V413-V461 HydrophobicContact CG2-CG1 4.47Å; D415-V461 HydrophobicContact CB-CG2 3.93Å; I418-V461 HydrophobicContact CB-CG2 4.41Å; I418-V461 HydrophobicContact CG2-CG2 4.15Å; F419-V461 HydrophobicContact CB-CG1 4.05Å; F419-V461 HydrophobicContact CD2-CG1 3.75Å; F419-V461 HydrophobicContact CG-CG1 4.27Å; M422-V461 HydrophobicContact CE-CG1 4.23Å; M422-V461 HydrophobicContact SD-CB 4.37Å; M422-V461 HydrophobicContact SD-CG1 3.82Å; N457-V461 WeakPolarHBondContact O-CG2 3.34Å; N457-V461 PolarHBondContact O-N 2.83Å; I458-V461 WeakPolarHBondContact O-CB 3.44Å; I458-V461 PolarHBondContact O-N 3.3Å; V461-K463 VanDerWaalsContact C-N 3.34Å; V461-K463 PolarHBondContact O-N 2.93Å; V461-S464 PolarHBondContact O-N 3.12Å; V461-S464 VanDerWaalsContact O-N 3.11Å; V461-M465 PolarHBondContact O-N 2.76Å; V461-M465 VanDerWaalsContact O-N 3.15Å
462	L	83.3	Confident	81.8	Confident	5 Å²	5	50.4 Å²	50.4	3%	0.026	26%	0.261	C	S	.	.	H	α-helix	trans	-66.6	-33.6	-176.8	-66.1	155.4	0	0	0	113.7	L150 M422 I458 M459 V460 S464 M465 L470 F473	L150-L462 HydrophobicContact CD1-CD1 4.38Å; L150-L462 HydrophobicContact CD2-CD1 2.94Å; L150-L462 HydrophobicContact CD2-CD2 4.15Å; L150-L462 HydrophobicContact CD2-CG 4.14Å; L150-L462 HydrophobicContact CG-CD1 4.27Å; M422-L462 HydrophobicContact CE-CD1 4.29Å; M422-L462 HydrophobicContact CE-CD2 3.45Å; M422-L462 VanDerWaalsContact CE-CD2 3.45Å; M422-L462 HydrophobicContact CE-CG 3.74Å; I458-L462 HydrophobicContact CG2-CD1 3.67Å; I458-L462 HydrophobicContact CG2-CG 4.41Å; I458-L462 VanDerWaalsContact O-CD1 3.23Å; I458-L462 WeakPolarHBondContact O-CD1 3.37Å; I458-L462 VanDerWaalsContact O-CG 3.25Å; I458-L462 WeakPolarHBondContact O-CG 3.44Å; I458-L462 PolarHBondContact O-N 2.88Å; M459-L462 HydrophobicContact CE-CD1 3.77Å; M459-L462 HydrophobicContact SD-CD1 4.38Å; V460-L462 PolarHBondContact O-N 3.38Å; L462-S464 VanDerWaalsContact C-N 3.3Å; L462-M465 HydrophobicContact CB-CE 4.49Å; L462-M465 HydrophobicContact CD2-CE 3.64Å; L462-M465 HydrophobicContact CD2-SD 4.42Å; L462-L470 HydrophobicContact CD2-CD2 3.73Å; L462-F473 HydrophobicContact CD2-CD2 4.44Å; L462-F473 HydrophobicContact CD2-CE2 4.13Å
463	K	82.9	Confident	82.7	Confident	121 Å²	121	47 Å²	47	53%	0.526	24%	0.24	S	C	.	.	H	α-helix	trans	-72.2	-26.8	175.4	-75.5	172	-175.5	172	0	112.3	M459 V460 V461	M459-K463 WeakPolarHBondContact O-CB 3.4Å; M459-K463 WeakPolarHBondContact O-CD 3.47Å; M459-K463 WeakPolarHBondContact O-CG 3.25Å; M459-K463 PolarHBondContact O-N 3.46Å; M459-K463 VanDerWaalsContact O-N 3.07Å; V460-K463 PolarHBondContact O-N 2.94Å; V461-K463 VanDerWaalsContact C-N 3.34Å; V461-K463 PolarHBondContact O-N 2.93Å
464	S	88.1	Confident	83.2	Confident	58 Å²	58	42.4 Å²	42.4	41%	0.406	21%	0.214	S	C	.	.	H	α-helix	trans	-89.5	-28.9	-172.5	-54.5	0	0	0	0	113.4	G412 V460 V461 L462	G412-S464 WeakPolarHBondContact O-CB 3.41Å; V460-S464 WeakPolarHBondContact O-CB 3.24Å; V460-S464 PolarHBondContact O-N 2.84Å; V460-S464 VanDerWaalsContact O-N 3.08Å; V460-S464 PolarHBondContact O-OG 3.2Å; V461-S464 PolarHBondContact O-N 3.12Å; V461-S464 VanDerWaalsContact O-N 3.11Å; L462-S464 VanDerWaalsContact C-N 3.3Å
465	M	88.6	Confident	84	Confident	9 Å²	9	38.4 Å²	38.4	4%	0.044	20%	0.195	C	C	.	.	S	Bend	trans	-75.6	161.4	-178.3	69.9	-176.5	-168.3	0	0	113.6	V413 F419 V461 L462 R467 M469 L470 F473	V413-M465 HydrophobicContact CG2-CB 3.58Å; F419-M465 HydrophobicContact CE2-SD 4.02Å; V461-M465 PolarHBondContact O-N 2.76Å; V461-M465 VanDerWaalsContact O-N 3.15Å; L462-M465 HydrophobicContact CB-CE 4.49Å; L462-M465 HydrophobicContact CD2-CE 3.64Å; L462-M465 HydrophobicContact CD2-SD 4.42Å; M465-R467 PolarHBondContact O-N 3.29Å; M465-M469 HydrophobicContact CE-CB 3.91Å; M465-M469 HydrophobicContact CG-CB 4.12Å; M465-M469 HydrophobicContact SD-CB 3.7Å; M465-L470 HydrophobicContact CE-CB 4.35Å; M465-L470 HydrophobicContact CE-CD2 3.25Å; M465-L470 HydrophobicContact CE-CG 3.54Å; M465-F473 HydrophobicContact CE-CD2 3.93Å; M465-F473 HydrophobicContact CE-CE2 3.57Å; M465-F473 HydrophobicContact SD-CD2 4.38Å; M465-F473 HydrophobicContact SD-CE2 3.49Å; M465-F473 WeakPolarHBondContact SD-CE2 3.38Å; M465-F473 HydrophobicContact SD-CZ 4.14Å
466	P	89.7	Confident	84.8	Confident	26 Å²	26	35.1 Å²	35.1	17%	0.169	18%	0.181	C	C	.	.			trans	-54.4	135.7	171.2	-25.6	31.6	0	0	0	111.8	D385 L411 P468 M469	D385-P466 HydrophobicContact CB-CG 4.46Å; L411-P466 HydrophobicContact CD2-CG 4.22Å; L411-P466 WeakPolarHBondContact O-CD 3.35Å; P466-P468 VanDerWaalsContact C-CD 3.43Å; P466-P468 VanDerWaalsContact C-N 3.34Å; P466-M469 HydrophobicContact CB-CG 4.23Å; P466-M469 HydrophobicContact CG-CG 4.43Å; P466-M469 VanDerWaalsContact O-CB 3.22Å; P466-M469 WeakPolarHBondContact O-CB 3.45Å; P466-M469 PolarHBondContact O-N 2.63Å
467	R	82.6	Confident	85.4	Confident	118 Å²	118	30.6 Å²	30.6	45%	0.445	16%	0.156	S	C	.	.	T	Hydrogen-bonded Turn	trans	-51	-43.1	-179.4	-69.6	-76.7	173.1	179.7	-11.3	114	D259 M465 M469 L470	D259-R467 IonicContact OD1-NH1 3.04Å; D259-R467 IonicContact OD2-CZ 3.99Å; D259-R467 IonicContact OD2-NH1 2.87Å; D259-R467 PolarHBondContact OD2-NH1 3.13Å; M465-R467 PolarHBondContact O-N 3.29Å; R467-M469 PolarHBondContact O-N 2.97Å; R467-M469 VanDerWaalsContact O-N 3.08Å; R467-L470 PolarHBondContact O-N 3.47Å
468	P	87.5	Confident	85.7	Confident	25 Å²	25	28 Å²	28	16%	0.162	14%	0.143	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.8	-22.1	179.1	-25.4	36.1	0	0	0	114.1	E379 Y380 L381 P466 L470 L471 V472	E379-P468 HydrophobicContact CB-CB 4.43Å; Y380-P468 WeakPolarHBondContact O-CG 3.17Å; L381-P468 HydrophobicContact CD1-CB 4.1Å; P466-P468 VanDerWaalsContact C-CD 3.43Å; P466-P468 VanDerWaalsContact C-N 3.34Å; P468-L470 PolarHBondContact O-N 3.45Å; P468-L471 PolarHBondContact O-N 2.95Å; P468-L471 VanDerWaalsContact O-N 3.08Å; P468-V472 PolarHBondContact O-N 3.27Å
469	M	88.8	Confident	86.2	Confident	0 Å²	0	27.9 Å²	27.9	0%	0	14%	0.143	C	C	.	.	H	α-helix	trans	-62.6	-25.8	178.7	-71.1	-62	-55.9	0	0	113.4	L381 L389 F419 L423 M465 P466 R467 L471 V472 F473	L381-M469 HydrophobicContact CD1-SD 4.21Å; L381-M469 HydrophobicContact CD2-SD 4.26Å; L389-M469 HydrophobicContact CD1-CE 3.93Å; L389-M469 HydrophobicContact CD2-CE 4.29Å; L389-M469 HydrophobicContact CD2-SD 4.12Å; F419-M469 HydrophobicContact CE2-CE 4.45Å; F419-M469 HydrophobicContact CZ-CE 4.11Å; L423-M469 HydrophobicContact CD1-CE 4.1Å; M465-M469 HydrophobicContact CE-CB 3.91Å; M465-M469 HydrophobicContact CG-CB 4.12Å; M465-M469 HydrophobicContact SD-CB 3.7Å; P466-M469 HydrophobicContact CB-CG 4.23Å; P466-M469 HydrophobicContact CG-CG 4.43Å; P466-M469 VanDerWaalsContact O-CB 3.22Å; P466-M469 WeakPolarHBondContact O-CB 3.45Å; P466-M469 PolarHBondContact O-N 2.63Å; R467-M469 PolarHBondContact O-N 2.97Å; R467-M469 VanDerWaalsContact O-N 3.08Å; M469-L471 VanDerWaalsContact C-N 3.25Å; M469-L471 PolarHBondContact O-N 3.16Å; M469-V472 HydrophobicContact CE-CB 4.18Å; M469-V472 HydrophobicContact CE-CG1 4.09Å; M469-V472 WeakPolarHBondContact O-CB 3.38Å; M469-V472 PolarHBondContact O-N 3.15Å; M469-V472 HydrophobicContact SD-CB 4.27Å; M469-V472 HydrophobicContact SD-CG2 4.03Å; M469-F473 WeakPolarHBondContact O-CD2 3.36Å; M469-F473 PolarHBondContact O-N 2.98Å
470	L	82.7	Confident	86.6	Confident	11 Å²	11	29.5 Å²	29.5	6%	0.058	15%	0.148	C	C	.	.	H	α-helix	trans	-59.5	-40.9	174	-68.4	169.3	0	0	0	111.1	F147 W255 L462 M465 R467 P468 F473 R474	F147-L470 HydrophobicContact CE1-CB 4.43Å; F147-L470 HydrophobicContact CE1-CD1 4.26Å; F147-L470 HydrophobicContact CE1-CD2 4.15Å; W255-L470 HydrophobicContact CH2-CD1 4.31Å; W255-L470 HydrophobicContact CZ3-CD1 3.75Å; L462-L470 HydrophobicContact CD2-CD2 3.73Å; M465-L470 HydrophobicContact CE-CB 4.35Å; M465-L470 HydrophobicContact CE-CD2 3.25Å; M465-L470 HydrophobicContact CE-CG 3.54Å; R467-L470 PolarHBondContact O-N 3.47Å; P468-L470 PolarHBondContact O-N 3.45Å; L470-F473 PolarHBondContact O-N 3.18Å; L470-R474 PolarHBondContact O-N 2.93Å
471	L	82.9	Confident	86.7	Confident	18 Å²	18	28 Å²	28	9%	0.094	14%	0.141	C	C	.	.	H	α-helix	trans	-78.9	-25.9	177.8	-64.4	-160.1	0	0	0	112.6	A351 L377 E379 P468 M469 R474 N475	A351-L471 HydrophobicContact CB-CB 3.64Å; A351-L471 HydrophobicContact CB-CD1 3.37Å; A351-L471 HydrophobicContact CB-CD2 4.12Å; A351-L471 HydrophobicContact CB-CG 3.9Å; L377-L471 HydrophobicContact CD1-CD1 4.23Å; L377-L471 HydrophobicContact CD2-CD1 4.23Å; L377-L471 HydrophobicContact CG-CD1 4.14Å; E379-L471 HydrophobicContact CB-CD1 3.99Å; E379-L471 HydrophobicContact CG-CB 4.47Å; E379-L471 HydrophobicContact CG-CD1 3.16Å; E379-L471 HydrophobicContact CG-CG 4.06Å; P468-L471 PolarHBondContact O-N 2.95Å; P468-L471 VanDerWaalsContact O-N 3.08Å; M469-L471 VanDerWaalsContact C-N 3.25Å; M469-L471 PolarHBondContact O-N 3.16Å; L471-R474 PolarHBondContact O-N 3.36Å; L471-N475 PolarHBondContact O-N 3.4Å
472	V	89.3	Confident	86.8	Confident	0 Å²	0	27.8 Å²	27.8	0%	0	14%	0.14	C	C	.	.	H	α-helix	trans	-60.9	-45.8	167.6	179.2	0	0	0	0	110.5	I343 I349 L381 L389 P468 M469 R474 N475 I476	I343-V472 HydrophobicContact CD1-CG1 4.38Å; I343-V472 HydrophobicContact CG2-CG1 4.19Å; I349-V472 HydrophobicContact CD1-CG2 3.49Å; I349-V472 VanDerWaalsContact CD1-CG2 3.49Å; L381-V472 HydrophobicContact CD2-CG2 4.42Å; L389-V472 HydrophobicContact CD2-CG1 4.39Å; P468-V472 PolarHBondContact O-N 3.27Å; M469-V472 HydrophobicContact CE-CB 4.18Å; M469-V472 HydrophobicContact CE-CG1 4.09Å; M469-V472 WeakPolarHBondContact O-CB 3.38Å; M469-V472 PolarHBondContact O-N 3.15Å; M469-V472 HydrophobicContact SD-CB 4.27Å; M469-V472 HydrophobicContact SD-CG2 4.03Å; V472-R474 VanDerWaalsContact C-N 3.31Å; V472-R474 PolarHBondContact O-N 3.38Å; V472-N475 PolarHBondContact O-N 3.09Å; V472-I476 HydrophobicContact CG1-CD1 3.66Å; V472-I476 HydrophobicContact CG1-CG1 4.32Å; V472-I476 VanDerWaalsContact O-CG1 3.27Å; V472-I476 WeakPolarHBondContact O-CG1 3.49Å; V472-I476 PolarHBondContact O-N 2.7Å
473	F	86.2	Confident	87.1	Confident	6 Å²	6	27.7 Å²	27.7	3%	0.026	14%	0.139	C	C	.	.	H	α-helix	trans	-61	-41.4	175.5	-70.4	-46.3	0	0	0	112.3	F419 M422 L423 Q425 L462 M465 M469 L470 I476 N477	F419-F473 AromaticContact CD2-CZ 3.95Å; F419-F473 HydrophobicContact CD2-CZ 3.95Å; F419-F473 HydrophobicContact CE2-CE1 4.44Å; F419-F473 HydrophobicContact CE2-CE2 4.42Å; F419-F473 AromaticContact CE2-CZ 3.64Å; F419-F473 HydrophobicContact CE2-CZ 3.64Å; M422-F473 HydrophobicContact CB-CE1 4.15Å; M422-F473 HydrophobicContact CB-CZ 4.07Å; M422-F473 HydrophobicContact CE-CE2 3.93Å; M422-F473 HydrophobicContact CE-CZ 4.12Å; L423-F473 HydrophobicContact CB-CE1 3.95Å; L423-F473 HydrophobicContact CD1-CD1 4.15Å; L423-F473 HydrophobicContact CD1-CE1 3.71Å; L423-F473 HydrophobicContact CG-CE1 4.47Å; Q425-F473 PolarHBondContact NE2-O 3.43Å; L462-F473 HydrophobicContact CD2-CD2 4.44Å; L462-F473 HydrophobicContact CD2-CE2 4.13Å; M465-F473 HydrophobicContact CE-CD2 3.93Å; M465-F473 HydrophobicContact CE-CE2 3.57Å; M465-F473 HydrophobicContact SD-CD2 4.38Å; M465-F473 HydrophobicContact SD-CE2 3.49Å; M465-F473 WeakPolarHBondContact SD-CE2 3.38Å; M465-F473 HydrophobicContact SD-CZ 4.14Å; M469-F473 WeakPolarHBondContact O-CD2 3.36Å; M469-F473 PolarHBondContact O-N 2.98Å; L470-F473 PolarHBondContact O-N 3.18Å; F473-I476 PolarHBondContact O-N 3.34Å; F473-N477 WeakPolarHBondContact O-CB 3.26Å; F473-N477 PolarHBondContact O-N 3.29Å
474	R	83.8	Confident	87.3	Confident	24 Å²	24	25 Å²	25	9%	0.091	13%	0.13	C	C	.	.	H	α-helix	trans	-59	-51	174.9	-172.5	-177.7	179.3	162.4	0.3	111	A146 A351 D352 L470 L471 V472 I476 N477 T478	A146-R474 HydrophobicContact CB-CG 3.89Å; A351-R474 WeakPolarHBondContact O-CD 3.43Å; A351-R474 VanDerWaalsContact O-CG 3.23Å; A351-R474 WeakPolarHBondContact O-CG 3.33Å; D352-R474 VanDerWaalsContact CG-CZ 3.49Å; D352-R474 IonicContact OD1-CZ 2.75Å; D352-R474 VanDerWaalsContact OD1-CZ 3.28Å; D352-R474 IonicContact OD1-NE 2.63Å; D352-R474 PolarHBondContact OD1-NE 3.37Å; D352-R474 VanDerWaalsContact OD1-NE 3.1Å; D352-R474 IonicContact OD1-NH2 3.43Å; D352-R474 PolarHBondContact OD1-NH2 3.46Å; D352-R474 IonicContact OD2-CZ 2.81Å; D352-R474 IonicContact OD2-NH2 2.7Å; D352-R474 PolarHBondContact OD2-NH2 2.95Å; L470-R474 PolarHBondContact O-N 2.93Å; L471-R474 PolarHBondContact O-N 3.36Å; V472-R474 VanDerWaalsContact C-N 3.31Å; V472-R474 PolarHBondContact O-N 3.38Å; R474-I476 PolarHBondContact O-N 3.08Å; R474-N477 PolarHBondContact O-N 3.42Å; R474-T478 PolarHBondContact O-N 3.01Å; R474-T478 PolarHBondContact O-OG1 2.92Å; R474-T478 VanDerWaalsContact O-OG1 3.07Å
475	N	90.3	Very high	87.2	Confident	1 Å²	1	25.1 Å²	25.1	1%	0.005	13%	0.128	C	C	.	.	H	α-helix	trans	-56.5	-51.4	177.2	179.1	-74.4	0	0	0	111.5	F339 I343 I349 H350 L471 V472 N477 T478 V479	F339-N475 VanDerWaalsContact CD1-ND2 3.26Å; F339-N475 WeakPolarHBondContact CD1-ND2 3.48Å; I343-N475 WeakPolarHBondContact CD1-OD1 3.46Å; I349-N475 HydrophobicContact CG2-CB 4.4Å; H350-N475 PolarHBondContact O-ND2 3.31Å; L471-N475 PolarHBondContact O-N 3.4Å; V472-N475 PolarHBondContact O-N 3.09Å; N475-N477 VanDerWaalsContact C-N 3.27Å; N475-N477 PolarHBondContact O-N 3.14Å; N475-T478 PolarHBondContact O-N 3.21Å; N475-T478 VanDerWaalsContact O-N 3.13Å; N475-V479 WeakPolarHBondContact O-CG2 3.44Å; N475-V479 PolarHBondContact O-N 3.2Å
476	I	89.6	Confident	87.2	Confident	1 Å²	1	24.9 Å²	24.9	1%	0.005	13%	0.127	C	C	.	.	H	α-helix	trans	-58.4	-41	179.6	-68	166.7	0	0	0	111	I343 W393 L423 V472 F473 R474 R480 M496	I343-I476 HydrophobicContact CD1-CG1 4.14Å; W393-I476 HydrophobicContact CH2-CD1 3.82Å; W393-I476 HydrophobicContact CH2-CG1 4.43Å; W393-I476 HydrophobicContact CH2-CG2 4.48Å; W393-I476 HydrophobicContact CZ3-CD1 3.62Å; L423-I476 HydrophobicContact CD1-CD1 3.73Å; V472-I476 HydrophobicContact CG1-CD1 3.66Å; V472-I476 HydrophobicContact CG1-CG1 4.32Å; V472-I476 VanDerWaalsContact O-CG1 3.27Å; V472-I476 WeakPolarHBondContact O-CG1 3.49Å; V472-I476 PolarHBondContact O-N 2.7Å; F473-I476 PolarHBondContact O-N 3.34Å; R474-I476 PolarHBondContact O-N 3.08Å; I476-R480 VanDerWaalsContact O-CB 3.24Å; I476-R480 WeakPolarHBondContact O-CB 3.23Å; I476-R480 PolarHBondContact O-N 2.73Å; I476-M496 HydrophobicContact CG1-CE 4.14Å
477	N	85.7	Confident	87	Confident	30 Å²	30	26.3 Å²	26.3	16%	0.16	15%	0.147	C	C	.	.	H	α-helix	trans	-63.7	-44.7	177.8	-173.9	52	0	0	0	111.6	N148 Q425 F473 R474 N475 R480 S481	N148-N477 PolarHBondContact ND2-ND2 3.06Å; N148-N477 VanDerWaalsContact ND2-ND2 3.2Å; Q425-N477 VanDerWaalsContact NE2-CB 3.28Å; Q425-N477 VanDerWaalsContact NE2-N 3.14Å; Q425-N477 VanDerWaalsContact OE1-CA 3.32Å; Q425-N477 PolarHBondContact OE1-OD1 3.2Å; Q425-N477 VanDerWaalsContact OE1-OD1 3.13Å; F473-N477 WeakPolarHBondContact O-CB 3.26Å; F473-N477 PolarHBondContact O-N 3.29Å; R474-N477 PolarHBondContact O-N 3.42Å; N475-N477 VanDerWaalsContact C-N 3.27Å; N475-N477 PolarHBondContact O-N 3.14Å; N477-R480 PolarHBondContact O-N 3.5Å; N477-R480 PolarHBondContact OD1-NH2 2.75Å; N477-S481 WeakPolarHBondContact O-CB 3.43Å; N477-S481 PolarHBondContact O-N 3.27Å
478	T	86.3	Confident	87	Confident	17 Å²	17	21.1 Å²	21.1	10%	0.104	13%	0.129	C	C	.	.	H	α-helix	trans	-66.4	-44.3	179.8	-55	0	0	0	0	111.4	P353 R474 N475 R480 S481 I482	P353-T478 HydrophobicContact CG-CG2 3.86Å; P353-T478 WeakPolarHBondContact O-CG2 3.42Å; R474-T478 PolarHBondContact O-N 3.01Å; R474-T478 PolarHBondContact O-OG1 2.92Å; R474-T478 VanDerWaalsContact O-OG1 3.07Å; N475-T478 PolarHBondContact O-N 3.21Å; N475-T478 VanDerWaalsContact O-N 3.13Å; T478-R480 VanDerWaalsContact C-N 3.35Å; T478-R480 PolarHBondContact O-N 2.88Å; T478-S481 PolarHBondContact O-N 3.08Å; T478-I482 HydrophobicContact CG2-CD1 4.11Å; T478-I482 WeakPolarHBondContact O-CG1 3.24Å; T478-I482 PolarHBondContact O-N 3.19Å
479	V	90.9	Very high	86.8	Confident	4 Å²	4	22 Å²	22	2%	0.024	14%	0.135	C	C	.	.	H	α-helix	trans	-61	-43.5	174.5	173.7	0	0	0	0	111.1	I336 F339 P353 N475 I482 N483	I336-V479 HydrophobicContact CG1-CG1 3.81Å; F339-V479 HydrophobicContact CB-CG2 3.92Å; F339-V479 HydrophobicContact CD2-CG2 3.46Å; F339-V479 VanDerWaalsContact CD2-CG2 3.46Å; F339-V479 HydrophobicContact CE2-CG2 4.26Å; F339-V479 HydrophobicContact CG-CG2 3.85Å; P353-V479 HydrophobicContact CG-CG2 4.43Å; N475-V479 WeakPolarHBondContact O-CG2 3.44Å; N475-V479 PolarHBondContact O-N 3.2Å; V479-I482 PolarHBondContact O-N 3.13Å; V479-N483 WeakPolarHBondContact O-CB 3.5Å; V479-N483 PolarHBondContact O-N 3.36Å
480	R	88.7	Confident	86.7	Confident	55 Å²	55	22.4 Å²	22.4	21%	0.208	14%	0.137	C	C	.	.	H	α-helix	trans	-59.2	-48.4	174.3	-179.6	-173.1	69.4	97.1	1	110.9	Q425 I476 N477 T478 I482 N483 I484	Q425-R480 VanDerWaalsContact OE1-CD 3.31Å; I476-R480 VanDerWaalsContact O-CB 3.24Å; I476-R480 WeakPolarHBondContact O-CB 3.23Å; I476-R480 PolarHBondContact O-N 2.73Å; N477-R480 PolarHBondContact O-N 3.5Å; N477-R480 PolarHBondContact OD1-NH2 2.75Å; T478-R480 VanDerWaalsContact C-N 3.35Å; T478-R480 PolarHBondContact O-N 2.88Å; R480-I482 PolarHBondContact O-N 2.99Å; R480-N483 PolarHBondContact O-N 3.44Å; R480-I484 HydrophobicContact CG-CD1 3.88Å; R480-I484 HydrophobicContact CG-CG1 4.49Å; R480-I484 WeakPolarHBondContact O-CG1 3.44Å; R480-I484 PolarHBondContact O-N 3.32Å
481	S	86.3	Confident	86.8	Confident	55 Å²	55	24.5 Å²	24.5	39%	0.385	15%	0.148	S	C	.	.	H	α-helix	trans	-59	-46.7	-179.5	-169.5	0	0	0	0	111.2	N477 T478 I484 T485	N477-S481 WeakPolarHBondContact O-CB 3.43Å; N477-S481 PolarHBondContact O-N 3.27Å; T478-S481 PolarHBondContact O-N 3.08Å; S481-I484 PolarHBondContact O-N 2.94Å; S481-T485 PolarHBondContact O-N 2.58Å; S481-T485 PolarHBondContact O-OG1 3.33Å
482	I	88.7	Confident	87.2	Confident	0 Å²	0	23.7 Å²	23.7	0%	0	14%	0.144	C	C	.	.	H	α-helix	trans	-62.3	-45.6	177.2	-65.8	162.8	0	0	0	111	I315 L335 P353 P355 T478 V479 R480 I484 T485 L486	I315-I482 HydrophobicContact CD1-CG2 3.8Å; I315-I482 HydrophobicContact CG1-CG2 3.79Å; I315-I482 HydrophobicContact CG2-CD1 4.23Å; I315-I482 HydrophobicContact CG2-CG1 4.37Å; I315-I482 HydrophobicContact CG2-CG2 4Å; L335-I482 HydrophobicContact CD2-CB 3.8Å; L335-I482 HydrophobicContact CD2-CD1 4.01Å; L335-I482 HydrophobicContact CD2-CG2 3.42Å; L335-I482 VanDerWaalsContact CD2-CG2 3.42Å; P353-I482 WeakPolarHBondContact O-CD1 3.43Å; P355-I482 HydrophobicContact CB-CG1 4.3Å; P355-I482 HydrophobicContact CG-CD1 4.22Å; P355-I482 HydrophobicContact CG-CG1 3.76Å; T478-I482 HydrophobicContact CG2-CD1 4.11Å; T478-I482 WeakPolarHBondContact O-CG1 3.24Å; T478-I482 PolarHBondContact O-N 3.19Å; V479-I482 PolarHBondContact O-N 3.13Å; R480-I482 PolarHBondContact O-N 2.99Å; I482-I484 VanDerWaalsContact C-N 3.29Å; I482-I484 PolarHBondContact O-N 2.81Å; I482-T485 PolarHBondContact O-N 3.48Å; I482-T485 VanDerWaalsContact O-N 3.16Å; I482-L486 HydrophobicContact CG2-CD1 4.04Å; I482-L486 HydrophobicContact CG2-CG 4.39Å; I482-L486 WeakPolarHBondContact O-CG 3.25Å; I482-L486 PolarHBondContact O-N 3.48Å
483	N	90.4	Very high	87.1	Confident	2 Å²	2	23.9 Å²	23.9	1%	0.011	15%	0.145	C	C	.	.	H	α-helix	trans	-59.3	-41.1	177.7	-171.3	47	0	0	0	111.5	V479 R480 L486 A488 V490	V479-N483 WeakPolarHBondContact O-CB 3.5Å; V479-N483 PolarHBondContact O-N 3.36Å; R480-N483 PolarHBondContact O-N 3.44Å; N483-L486 PolarHBondContact O-N 2.8Å; N483-A488 WeakPolarHBondContact O-CA 3.47Å; N483-A488 PolarHBondContact O-N 2.95Å; N483-V490 PolarHBondContact ND2-O 2.95Å
484	I	86.6	Confident	86.9	Confident	66 Å²	66	24.8 Å²	24.8	34%	0.338	15%	0.152	S	C	.	.	H	α-helix	trans	-63.2	-46.5	174.8	-69.6	169	0	0	0	110.7	R480 S481 I482 L486 G487	R480-I484 HydrophobicContact CG-CD1 3.88Å; R480-I484 HydrophobicContact CG-CG1 4.49Å; R480-I484 WeakPolarHBondContact O-CG1 3.44Å; R480-I484 PolarHBondContact O-N 3.32Å; S481-I484 PolarHBondContact O-N 2.94Å; I482-I484 VanDerWaalsContact C-N 3.29Å; I482-I484 PolarHBondContact O-N 2.81Å; I484-L486 PolarHBondContact O-N 3.26Å; I484-G487 PolarHBondContact O-N 2.88Å
485	T	86.4	Confident	87.2	Confident	60 Å²	60	24.7 Å²	24.7	37%	0.368	15%	0.154	S	C	.	.	H	α-helix	trans	-57	-38.6	176.9	-55	0	0	0	0	111.4	N316 L318 S481 I482 G487	N316-T485 HydrophobicContact CB-CG2 3.99Å; L318-T485 HydrophobicContact CD1-CG2 3.86Å; L318-T485 WeakPolarHBondContact CD1-O 3.45Å; L318-T485 WeakPolarHBondContact CD2-O 3.32Å; S481-T485 PolarHBondContact O-N 2.58Å; S481-T485 PolarHBondContact O-OG1 3.33Å; I482-T485 PolarHBondContact O-N 3.48Å; I482-T485 VanDerWaalsContact O-N 3.16Å; T485-G487 PolarHBondContact O-N 3.34Å; T485-G487 VanDerWaalsContact O-N 3.15Å
486	L	87.5	Confident	87.3	Confident	3 Å²	3	24.9 Å²	24.9	2%	0.016	16%	0.155	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72.4	3.3	176.2	-66.8	175.2	0	0	0	114.6	I315 L318 I321 L328 T331 A332 I482 N483 I484 P489	I315-L486 HydrophobicContact CG1-CD1 4.39Å; I315-L486 WeakPolarHBondContact O-CD2 3.34Å; L318-L486 HydrophobicContact CD1-CD2 4.42Å; L318-L486 HydrophobicContact CG-CD2 4.33Å; I321-L486 HydrophobicContact CD1-CD2 4.18Å; L328-L486 HydrophobicContact CD2-CD2 4.12Å; T331-L486 HydrophobicContact CG2-CD1 4.43Å; A332-L486 HydrophobicContact CB-CD1 3.84Å; I482-L486 HydrophobicContact CG2-CD1 4.04Å; I482-L486 HydrophobicContact CG2-CG 4.39Å; I482-L486 WeakPolarHBondContact O-CG 3.25Å; I482-L486 PolarHBondContact O-N 3.48Å; N483-L486 PolarHBondContact O-N 2.8Å; I484-L486 PolarHBondContact O-N 3.26Å; L486-P489 HydrophobicContact CB-CG 4.47Å
487	G	84.9	Confident	87.2	Confident	56 Å²	56	24.9 Å²	24.9	58%	0.577	16%	0.155	S	C	*	.	T	Hydrogen-bonded Turn	trans	88.6	19.3	-178	0	0	0	0	0	114.2	I484 T485 P489	I484-G487 PolarHBondContact O-N 2.88Å; T485-G487 PolarHBondContact O-N 3.34Å; T485-G487 VanDerWaalsContact O-N 3.15Å; G487-P489 VanDerWaalsContact C-CD 3.43Å
488	A	83.4	Confident	87.2	Confident	10 Å²	10	27 Å²	27	8%	0.083	16%	0.162	C	C	.	.	S	Bend	trans	52.5	43.3	179.1	0	0	0	0	0	115.7	N437 I438 N483 V490	N437-A488 HydrophobicContact CB-CB 3.66Å; N437-A488 PolarHBondContact ND2-O 3.24Å; I438-A488 HydrophobicContact CD1-CB 3.92Å; I438-A488 HydrophobicContact CG1-CB 3.61Å; N483-A488 WeakPolarHBondContact O-CA 3.47Å; N483-A488 PolarHBondContact O-N 2.95Å; A488-V490 PolarHBondContact O-N 3.38Å
489	P	82.9	Confident	87.5	Confident	43 Å²	43	26.7 Å²	26.7	28%	0.279	16%	0.161	S	C	.	.			trans	-74.2	-8.6	-169.4	32.7	-38.2	0	0	0	114.4	R329 A332 L486 G487	R329-P489 HydrophobicContact CB-CB 3.97Å; R329-P489 HydrophobicContact CB-CG 4.46Å; R329-P489 HydrophobicContact CG-CB 4.26Å; A332-P489 HydrophobicContact CB-CG 3.85Å; L486-P489 HydrophobicContact CB-CG 4.47Å; G487-P489 VanDerWaalsContact C-CD 3.43Å
490	V	86.2	Confident	87.5	Confident	9 Å²	9	26.5 Å²	26.5	6%	0.055	16%	0.16	C	C	.	.	S	Bend	trans	-129.2	131.9	-174.8	178.3	0	0	0	0	110.8	R329 A332 D333 I336 N437 N483 A488 R492 V495	R329-V490 HydrophobicContact CG-CG2 3.76Å; R329-V490 WeakPolarHBondContact O-CG2 3.45Å; A332-V490 HydrophobicContact CB-CB 4.34Å; A332-V490 HydrophobicContact CB-CG2 3.83Å; D333-V490 HydrophobicContact CB-CG1 4.49Å; D333-V490 HydrophobicContact CB-CG2 4.03Å; I336-V490 HydrophobicContact CD1-CB 3.92Å; I336-V490 HydrophobicContact CD1-CG1 3.67Å; N437-V490 VanDerWaalsContact CG-O 3.26Å; N437-V490 PolarHBondContact ND2-O 3.24Å; N437-V490 PolarHBondContact OD1-O 3.03Å; N483-V490 PolarHBondContact ND2-O 2.95Å; A488-V490 PolarHBondContact O-N 3.38Å; V490-R492 VanDerWaalsContact C-N 3.35Å; V490-R492 PolarHBondContact O-N 3.35Å; V490-V495 HydrophobicContact CG1-CG2 3.71Å
491	D	86.3	Confident	87.4	Confident	54 Å²	54	24 Å²	24	29%	0.289	15%	0.151	S	C	.	.			trans	-67.2	90.6	167.9	-173.8	-18.3	0	0	0	111.2	N437 Y493 C494 V495	N437-D491 PolarHBondContact ND2-N 3.01Å; N437-D491 VanDerWaalsContact OD1-CA 3.23Å; N437-D491 WeakPolarHBondContact OD1-CA 3.33Å; D491-Y493 PolarHBondContact O-N 3.43Å; D491-Y493 WeakPolarHBondContact OD1-CB 3.42Å; D491-Y493 PolarHBondContact OD1-N 3.5Å; D491-C494 HydrophobicContact CB-CB 4.23Å; D491-C494 PolarHBondContact OD1-N 2.89Å; D491-C494 WeakPolarHBondContact OD2-CB 3.22Å; D491-C494 PolarHBondContact OD2-SG 3.26Å; D491-V495 WeakPolarHBondContact O-CB 3.5Å; D491-V495 VanDerWaalsContact O-CG2 3.26Å; D491-V495 WeakPolarHBondContact O-CG2 3.28Å; D491-V495 PolarHBondContact O-N 3.34Å
492	R	89.7	Confident	87.3	Confident	2 Å²	2	24.9 Å²	24.9	1%	0.008	15%	0.149	C	C	.	.	H	α-helix	trans	-62.5	-33.9	-178.2	75.4	176.9	179.3	101.9	-4.8	111.9	I336 L424 V490 M496	I336-R492 HydrophobicContact CD1-CB 3.79Å; I336-R492 HydrophobicContact CG1-CB 4.37Å; I336-R492 HydrophobicContact CG2-CB 4.45Å; L424-R492 PolarHBondContact O-NH2 2.89Å; V490-R492 VanDerWaalsContact C-N 3.35Å; V490-R492 PolarHBondContact O-N 3.35Å; R492-M496 WeakPolarHBondContact O-CB 3.42Å; R492-M496 WeakPolarHBondContact O-CG 3.48Å; R492-M496 PolarHBondContact O-N 2.95Å
493	Y	87.4	Confident	87.1	Confident	3 Å²	3	24.9 Å²	24.9	1%	0.012	15%	0.149	C	C	.	.	H	α-helix	trans	-69.5	-47.7	-174.2	-53.8	-75.7	0	0	0	110.1	W393 L424 R426 L435 S436 D491 A497	W393-Y493 PolarHBondContact NE1-O 2.71Å; L424-Y493 HydrophobicContact CB-CE1 4.08Å; L424-Y493 HydrophobicContact CD2-CD1 3.84Å; L424-Y493 HydrophobicContact CD2-CE1 4.22Å; L424-Y493 WeakPolarHBondContact O-CE1 3.26Å; R426-Y493 VanDerWaalsContact CD-CZ 3.5Å; R426-Y493 WeakPolarHBondContact CD-OH 3.45Å; R426-Y493 HydrophobicContact CG-CE1 4.32Å; L435-Y493 HydrophobicContact CB-CD2 3.41Å; L435-Y493 VanDerWaalsContact CB-CD2 3.41Å; L435-Y493 HydrophobicContact CB-CE2 3.91Å; L435-Y493 HydrophobicContact CB-CG 3.9Å; L435-Y493 VanDerWaalsContact CD1-CB 3.48Å; L435-Y493 HydrophobicContact CD1-CD1 4.1Å; L435-Y493 HydrophobicContact CD1-CD2 4.06Å; L435-Y493 HydrophobicContact CD1-CG 3.63Å; L435-Y493 HydrophobicContact CG-CD2 4.34Å; L435-Y493 HydrophobicContact CG-CG 4.39Å; S436-Y493 WeakPolarHBondContact O-CE2 3.28Å; D491-Y493 PolarHBondContact O-N 3.43Å; D491-Y493 WeakPolarHBondContact OD1-CB 3.42Å; D491-Y493 PolarHBondContact OD1-N 3.5Å; Y493-A497 VanDerWaalsContact O-CB 3.26Å; Y493-A497 WeakPolarHBondContact O-CB 3.26Å; Y493-A497 PolarHBondContact O-N 3.19Å
494	C	83.6	Confident	86.8	Confident	25 Å²	25	26.7 Å²	26.7	17%	0.169	16%	0.156	C	C	.	.	H	α-helix	trans	-65.4	-42.8	175.4	-75.3	0	0	0	0	111.9	D491 A497 K498	D491-C494 HydrophobicContact CB-CB 4.23Å; D491-C494 PolarHBondContact OD1-N 2.89Å; D491-C494 WeakPolarHBondContact OD2-CB 3.22Å; D491-C494 PolarHBondContact OD2-SG 3.26Å; C494-A497 PolarHBondContact O-N 3.37Å; C494-K498 WeakPolarHBondContact O-CB 3.46Å; C494-K498 VanDerWaalsContact O-CG 3.28Å; C494-K498 WeakPolarHBondContact O-CG 3.36Å; C494-K498 PolarHBondContact O-N 2.98Å
495	V	88.7	Confident	86.4	Confident	22 Å²	22	23.7 Å²	23.7	13%	0.133	14%	0.141	C	C	.	.	H	α-helix	trans	-62.9	-47.7	177.8	173	0	0	0	0	110.8	I336 R337 V490 D491 A497 K498 S499	I336-V495 HydrophobicContact CB-CG1 4.29Å; I336-V495 HydrophobicContact CG2-CB 4.03Å; I336-V495 HydrophobicContact CG2-CG1 3.62Å; R337-V495 HydrophobicContact CG-CG1 4.09Å; V490-V495 HydrophobicContact CG1-CG2 3.71Å; D491-V495 WeakPolarHBondContact O-CB 3.5Å; D491-V495 VanDerWaalsContact O-CG2 3.26Å; D491-V495 WeakPolarHBondContact O-CG2 3.28Å; D491-V495 PolarHBondContact O-N 3.34Å; V495-A497 VanDerWaalsContact C-N 3.34Å; V495-A497 PolarHBondContact O-N 2.59Å; V495-K498 PolarHBondContact O-N 3.21Å; V495-S499 PolarHBondContact O-N 3.33Å; V495-S499 PolarHBondContact O-OG 3.39Å
496	M	91.8	Very high	86.1	Confident	6 Å²	6	25 Å²	25	3%	0.03	14%	0.139	C	C	.	.	H	α-helix	trans	-63.1	-38.6	177	-71.3	-174.1	78.6	0	0	112.2	I336 A340 I343 F344 W393 I476 R492 S499 A500	I336-M496 HydrophobicContact CG2-CG 3.73Å; A340-M496 HydrophobicContact CB-CG 4.29Å; I343-M496 HydrophobicContact CD1-CE 4.1Å; F344-M496 HydrophobicContact CE2-CB 3.96Å; F344-M496 HydrophobicContact CE2-CE 3.85Å; F344-M496 HydrophobicContact CE2-CG 4.49Å; F344-M496 WeakPolarHBondContact CE2-O 3.45Å; F344-M496 HydrophobicContact CZ-CB 4.38Å; F344-M496 HydrophobicContact CZ-CE 3.98Å; W393-M496 HydrophobicContact CH2-CE 3.73Å; W393-M496 HydrophobicContact CH2-SD 3.9Å; W393-M496 HydrophobicContact CZ2-CB 3.87Å; W393-M496 HydrophobicContact CZ2-CE 3.92Å; W393-M496 HydrophobicContact CZ2-CG 4.39Å; W393-M496 HydrophobicContact CZ2-SD 3.65Å; W393-M496 HydrophobicContact CZ3-CE 4.21Å; I476-M496 HydrophobicContact CG1-CE 4.14Å; R492-M496 WeakPolarHBondContact O-CB 3.42Å; R492-M496 WeakPolarHBondContact O-CG 3.48Å; R492-M496 PolarHBondContact O-N 2.95Å; M496-S499 PolarHBondContact O-N 2.93Å; M496-A500 WeakPolarHBondContact O-CB 3.46Å; M496-A500 PolarHBondContact O-N 3.44Å
497	A	88.1	Confident	85.8	Confident	0 Å²	0	25.3 Å²	25.3	0%	0	14%	0.141	C	C	.	.	H	α-helix	trans	-66	-42.2	175.8	0	0	0	0	0	112.3	V397 Y493 C494 V495 S499 A500 V501 F533	V397-A497 HydrophobicContact CB-CB 4.14Å; V397-A497 HydrophobicContact CG1-CB 4.33Å; V397-A497 HydrophobicContact CG2-CB 3.72Å; Y493-A497 VanDerWaalsContact O-CB 3.26Å; Y493-A497 WeakPolarHBondContact O-CB 3.26Å; Y493-A497 PolarHBondContact O-N 3.19Å; C494-A497 PolarHBondContact O-N 3.37Å; V495-A497 VanDerWaalsContact C-N 3.34Å; V495-A497 PolarHBondContact O-N 2.59Å; A497-S499 VanDerWaalsContact C-N 3.35Å; A497-A500 WeakPolarHBondContact O-CB 3.5Å; A497-A500 PolarHBondContact O-N 2.99Å; A497-V501 WeakPolarHBondContact O-CG2 3.43Å; A497-V501 PolarHBondContact O-N 3Å; A497-F533 HydrophobicContact CB-CE1 4.35Å; A497-F533 HydrophobicContact CB-CZ 3.75Å
498	K	86.9	Confident	85.3	Confident	74 Å²	74	25.6 Å²	25.6	32%	0.322	13%	0.127	S	C	.	.	H	α-helix	trans	-59.8	-46.9	173.5	-74.7	178.4	-178.2	-169.3	0	110.9	C494 V495 V501 Q502 F533	C494-K498 WeakPolarHBondContact O-CB 3.46Å; C494-K498 VanDerWaalsContact O-CG 3.28Å; C494-K498 WeakPolarHBondContact O-CG 3.36Å; C494-K498 PolarHBondContact O-N 2.98Å; V495-K498 PolarHBondContact O-N 3.21Å; K498-V501 PolarHBondContact O-N 2.96Å; K498-Q502 WeakPolarHBondContact O-CB 3.23Å; K498-Q502 VanDerWaalsContact O-CG 3.26Å; K498-Q502 WeakPolarHBondContact O-CG 3.4Å; K498-Q502 PolarHBondContact O-N 3Å; K498-F533 HydrophobicContact CG-CD1 4.43Å; K498-F533 HydrophobicContact CG-CE1 3.88Å
499	S	91	Very high	84.7	Confident	11 Å²	11	26.1 Å²	26.1	8%	0.077	13%	0.131	C	C	.	.	H	α-helix	trans	-58.1	-49.7	173.9	-63.8	0	0	0	0	110.8	V495 M496 A497 V501 Q502 C503	V495-S499 PolarHBondContact O-N 3.33Å; V495-S499 PolarHBondContact O-OG 3.39Å; M496-S499 PolarHBondContact O-N 2.93Å; A497-S499 VanDerWaalsContact C-N 3.35Å; S499-V501 VanDerWaalsContact C-N 3.32Å; S499-V501 PolarHBondContact O-N 3.34Å; S499-Q502 PolarHBondContact O-N 3.06Å; S499-C503 VanDerWaalsContact O-CB 3.24Å; S499-C503 WeakPolarHBondContact O-CB 3.35Å; S499-C503 PolarHBondContact O-N 3.18Å; S499-C503 PolarHBondContact O-SG 3.49Å
500	A	90.9	Very high	84.2	Confident	0 Å²	0	29.2 Å²	29.2	0%	0	14%	0.142	C	C	.	.	H	α-helix	trans	-54.2	-44.7	178.7	0	0	0	0	0	113.1	F344 C390 W393 M496 A497 W504	F344-A500 HydrophobicContact CD1-CB 3.81Å; F344-A500 HydrophobicContact CD2-CB 4Å; F344-A500 HydrophobicContact CE1-CB 3.89Å; F344-A500 HydrophobicContact CE2-CB 4.11Å; F344-A500 HydrophobicContact CG-CB 3.88Å; F344-A500 HydrophobicContact CZ-CB 4.05Å; C390-A500 HydrophobicContact CB-CB 4.15Å; W393-A500 HydrophobicContact CB-CB 4.33Å; M496-A500 WeakPolarHBondContact O-CB 3.46Å; M496-A500 PolarHBondContact O-N 3.44Å; A497-A500 WeakPolarHBondContact O-CB 3.5Å; A497-A500 PolarHBondContact O-N 2.99Å; A500-W504 VanDerWaalsContact O-CB 3.26Å; A500-W504 WeakPolarHBondContact O-CB 3.44Å; A500-W504 PolarHBondContact O-N 3Å
501	V	87	Confident	83.3	Confident	3 Å²	3	34.8 Å²	34.8	2%	0.018	16%	0.162	C	C	.	.	H	α-helix	trans	-68.1	-45.4	178	175.3	0	0	0	0	111.8	R394 A497 K498 S499 W504 G505 F533	R394-V501 HydrophobicContact CB-CG2 3.98Å; R394-V501 HydrophobicContact CG-CG2 3.84Å; A497-V501 WeakPolarHBondContact O-CG2 3.43Å; A497-V501 PolarHBondContact O-N 3Å; K498-V501 PolarHBondContact O-N 2.96Å; S499-V501 VanDerWaalsContact C-N 3.32Å; S499-V501 PolarHBondContact O-N 3.34Å; V501-W504 PolarHBondContact O-N 3.3Å; V501-G505 PolarHBondContact O-N 3.37Å; V501-F533 HydrophobicContact CB-CB 4.42Å; V501-F533 HydrophobicContact CB-CD1 4.32Å; V501-F533 HydrophobicContact CB-CG 4.25Å; V501-F533 HydrophobicContact CG1-CB 3.82Å; V501-F533 HydrophobicContact CG1-CG 4.2Å; V501-F533 HydrophobicContact CG2-CB 4.18Å; V501-F533 HydrophobicContact CG2-CD1 4.01Å; V501-F533 HydrophobicContact CG2-CD2 3.77Å; V501-F533 HydrophobicContact CG2-CE1 4.35Å; V501-F533 HydrophobicContact CG2-CE2 4.13Å; V501-F533 HydrophobicContact CG2-CG 3.7Å; V501-F533 HydrophobicContact CG2-CZ 4.41Å
502	Q	84.9	Confident	81.8	Confident	73 Å²	73	38.6 Å²	38.6	34%	0.341	19%	0.19	S	C	.	.	H	α-helix	trans	-61.6	-46.1	177.7	-71.9	174.8	3.3	0	0	111.4	K498 S499 G505 R506	K498-Q502 WeakPolarHBondContact O-CB 3.23Å; K498-Q502 VanDerWaalsContact O-CG 3.26Å; K498-Q502 WeakPolarHBondContact O-CG 3.4Å; K498-Q502 PolarHBondContact O-N 3Å; S499-Q502 PolarHBondContact O-N 3.06Å; Q502-G505 PolarHBondContact O-N 3.3Å; Q502-R506 WeakPolarHBondContact O-CG 3.28Å; Q502-R506 PolarHBondContact O-N 2.82Å
503	C	83.6	Confident	80.3	Confident	1 Å²	1	41 Å²	41	1%	0.007	22%	0.216	C	C	.	.	H	α-helix	trans	-63	-43.9	178.9	-63.4	0	0	0	0	111	F344 S499 G505 R506 L507	F344-C503 HydrophobicContact CB-CB 3.81Å; S499-C503 VanDerWaalsContact O-CB 3.24Å; S499-C503 WeakPolarHBondContact O-CB 3.35Å; S499-C503 PolarHBondContact O-N 3.18Å; S499-C503 PolarHBondContact O-SG 3.49Å; C503-G505 VanDerWaalsContact C-N 3.32Å; C503-G505 PolarHBondContact O-N 3.05Å; C503-R506 WeakPolarHBondContact O-CB 3.35Å; C503-R506 PolarHBondContact O-N 3.29Å; C503-R506 VanDerWaalsContact O-N 3.17Å; C503-L507 WeakPolarHBondContact O-CG 3.18Å; C503-L507 PolarHBondContact O-N 3.1Å
504	W	84	Confident	78.7	Confident	40 Å²	40	48 Å²	48	15%	0.152	26%	0.258	C	S	.	.	H	α-helix	trans	-60.9	-40.3	174.4	177.2	51.5	0	0	0	112.6	C390 K391 A500 V501 L507 Q508	C390-W504 HydrophobicContact CB-CB 4.02Å; K391-W504 HydrophobicContact CD-CZ2 4.39Å; K391-W504 VanDerWaalsContact CE-NE1 3.3Å; K391-W504 HydrophobicContact CG-CD2 4.45Å; K391-W504 HydrophobicContact CG-CZ2 4.47Å; A500-W504 VanDerWaalsContact O-CB 3.26Å; A500-W504 WeakPolarHBondContact O-CB 3.44Å; A500-W504 PolarHBondContact O-N 3Å; V501-W504 PolarHBondContact O-N 3.3Å; W504-L507 PolarHBondContact O-N 3.21Å; W504-Q508 VanDerWaalsContact NE1-NE2 3.16Å; W504-Q508 PolarHBondContact O-N 3.13Å; W504-Q508 VanDerWaalsContact O-N 3.09Å
505	G	79.3	Confident	77.1	Confident	3 Å²	3	52.1 Å²	52.1	3%	0.031	28%	0.278	C	S	.	.	H	α-helix	trans	-60.4	-42.6	172.9	0	0	0	0	0	112.7	V501 Q502 C503 Q508 A509	V501-G505 PolarHBondContact O-N 3.37Å; Q502-G505 PolarHBondContact O-N 3.3Å; C503-G505 VanDerWaalsContact C-N 3.32Å; C503-G505 PolarHBondContact O-N 3.05Å; G505-Q508 PolarHBondContact O-N 3.28Å; G505-A509 WeakPolarHBondContact O-CB 3.33Å; G505-A509 PolarHBondContact O-N 3.15Å
506	R	80.4	Confident	75.5	Confident	86 Å²	86	56 Å²	56	33%	0.325	30%	0.304	S	S	.	.	H	α-helix	trans	-64.4	-47	175.4	-67.4	178.6	-170.2	170.7	6.3	112.3	E341 Y345 Q502 C503 Q508 A509 E510	E341-R506 IonicContact OE1-NH1 3.54Å; E341-R506 PolarHBondContact OE1-NH1 2.85Å; E341-R506 IonicContact OE2-NH1 3.49Å; Y345-R506 HydrophobicContact CD2-CB 4.14Å; Y345-R506 HydrophobicContact CE2-CB 3.71Å; Q502-R506 WeakPolarHBondContact O-CG 3.28Å; Q502-R506 PolarHBondContact O-N 2.82Å; C503-R506 WeakPolarHBondContact O-CB 3.35Å; C503-R506 PolarHBondContact O-N 3.29Å; C503-R506 VanDerWaalsContact O-N 3.17Å; R506-Q508 VanDerWaalsContact C-N 3.29Å; R506-Q508 PolarHBondContact O-N 3.27Å; R506-A509 CarbonylContact O-C 3.58Å; R506-A509 WeakPolarHBondContact O-CA 3.47Å; R506-A509 WeakPolarHBondContact O-CB 3.35Å; R506-A509 PolarHBondContact O-N 2.93Å; R506-E510 WeakPolarHBondContact O-CG 3.2Å; R506-E510 PolarHBondContact O-N 3.33Å
507	L	80.3	Confident	73.7	Confident	10 Å²	10	66.6 Å²	66.6	5%	0.052	34%	0.344	C	S	.	.	H	α-helix	trans	-58.1	-41.1	177.9	-70.8	171.5	0	0	0	111.7	Y345 V387 C503 W504 A509 E510 R511	Y345-L507 HydrophobicContact CD2-CD2 4.17Å; Y345-L507 HydrophobicContact CD2-CG 4.23Å; Y345-L507 HydrophobicContact CE2-CD2 4.36Å; V387-L507 HydrophobicContact CG2-CD1 4.11Å; C503-L507 WeakPolarHBondContact O-CG 3.18Å; C503-L507 PolarHBondContact O-N 3.1Å; W504-L507 PolarHBondContact O-N 3.21Å; L507-A509 VanDerWaalsContact C-N 3.35Å; L507-E510 PolarHBondContact O-N 3.28Å; L507-R511 PolarHBondContact O-N 3.37Å
508	Q	75.5	Confident	72.6	Confident	62 Å²	62	72 Å²	72	29%	0.29	37%	0.367	S	S	.	.	H	α-helix	trans	-65.1	-38.4	173	-75.4	-171.3	41.3	0	0	113.1	W504 G505 R506 E510	W504-Q508 VanDerWaalsContact NE1-NE2 3.16Å; W504-Q508 PolarHBondContact O-N 3.13Å; W504-Q508 VanDerWaalsContact O-N 3.09Å; G505-Q508 PolarHBondContact O-N 3.28Å; R506-Q508 VanDerWaalsContact C-N 3.29Å; R506-Q508 PolarHBondContact O-N 3.27Å; Q508-E510 VanDerWaalsContact C-N 3.25Å; Q508-E510 PolarHBondContact O-N 2.81Å
509	A	70.9	Confident	71.4	Confident	21 Å²	21	78.1 Å²	78.1	17%	0.174	39%	0.388	C	S	.	.	H	α-helix	trans	-67.2	-27	178.1	0	0	0	0	0	112.2	G505 R506 L507 R522	G505-A509 WeakPolarHBondContact O-CB 3.33Å; G505-A509 PolarHBondContact O-N 3.15Å; R506-A509 CarbonylContact O-C 3.58Å; R506-A509 WeakPolarHBondContact O-CA 3.47Å; R506-A509 WeakPolarHBondContact O-CB 3.35Å; R506-A509 PolarHBondContact O-N 2.93Å; L507-A509 VanDerWaalsContact C-N 3.35Å; A509-R522 HydrophobicContact CB-CB 3.9Å; A509-R522 VanDerWaalsContact O-CD 3.26Å; A509-R522 WeakPolarHBondContact O-CD 3.26Å; A509-R522 VanDerWaalsContact O-CZ 3.28Å; A509-R522 PolarHBondContact O-NE 3.36Å; A509-R522 PolarHBondContact O-NH1 2.81Å
510	E	71.8	Confident	70.3	Confident	109 Å²	109	83 Å²	83	51%	0.509	42%	0.417	S	S	.	.	H	α-helix	trans	-89.3	-17.5	-177.4	-72.3	170.2	-175.6	0	0	113.9	Y345 R506 L507 Q508	Y345-E510 PolarHBondContact OH-OE1 3.02Å; Y345-E510 PolarHBondContact OH-OE2 3.46Å; R506-E510 WeakPolarHBondContact O-CG 3.2Å; R506-E510 PolarHBondContact O-N 3.33Å; L507-E510 PolarHBondContact O-N 3.28Å; Q508-E510 VanDerWaalsContact C-N 3.25Å; Q508-E510 PolarHBondContact O-N 2.81Å
511	R	67.1	Low	69.3	Low	126 Å²	126	88.3 Å²	88.3	48%	0.475	45%	0.445	S	S	.	.	S	Bend	trans	-54.5	130.1	176.5	-80.2	-179.2	-179.6	-173.8	-1.9	111.1	E383 L507 G513	E383-R511 IonicContact OE1-CZ 2.83Å; E383-R511 IonicContact OE1-NE 3.39Å; E383-R511 PolarHBondContact OE1-NE 2.83Å; E383-R511 VanDerWaalsContact OE1-NE 3.12Å; E383-R511 IonicContact OE1-NH2 3.6Å; E383-R511 PolarHBondContact OE1-NH2 3.39Å; L507-R511 PolarHBondContact O-N 3.37Å; R511-G513 VanDerWaalsContact C-N 3.33Å; R511-G513 PolarHBondContact O-N 3.35Å
512	P	55.8	Low	68.3	Low	134 Å²	134	91.7 Å²	91.7	87%	0.87	46%	0.457	S	S	*	.			trans	-68	93	178.7	25.4	-30.8	0	0	0	109.3
513	G	56.8	Low	67.5	Low	53 Å²	53	96.3 Å²	96.3	55%	0.546	47%	0.472	S	S	.	.			trans	-84.3	158.5	163.7	0	0	0	0	0	110.6	R511 L515	R511-G513 VanDerWaalsContact C-N 3.33Å; R511-G513 PolarHBondContact O-N 3.35Å; G513-L515 PolarHBondContact O-N 2.88Å
514	V	53.9	Low	67.1	Low	148 Å²	148	99.9 Å²	99.9	90%	0.897	49%	0.493	S	S	*	.	S	Bend	trans	-56.8	-14.1	-175.8	-174.3	0	0	0	0	114
515	L	51	Low	66.4	Low	112 Å²	112	105.4 Å²	105.4	59%	0.586	51%	0.514	S	S	*	.			trans	-127.3	96.4	-174.4	-78.9	152.4	0	0	0	112.5	G513 R517	G513-L515 PolarHBondContact O-N 2.88Å; L515-R517 PolarHBondContact O-N 2.91Å
516	P	54.7	Low	65.9	Low	105 Å²	105	106 Å²	106	68%	0.682	52%	0.519	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.9	-14.5	176.5	22.4	-31	0	0	0	114.2	F518	P516-F518 VanDerWaalsContact C-N 3.32Å; P516-F518 PolarHBondContact O-N 3.43Å
517	R	54.4	Low	65.6	Low	228 Å²	228	104.9 Å²	104.9	86%	0.86	52%	0.522	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.8	-15	-173.3	-89.1	-177.7	170.7	169.6	-2.5	116.2	L515	L515-R517 PolarHBondContact O-N 2.91Å
518	F	63.6	Low	65.4	Low	112 Å²	112	111.9 Å²	111.9	49%	0.491	55%	0.548	S	S	.	.			trans	-108.1	45.7	-174.1	-70.6	-70.1	0	0	0	113.9	P516 V520 L521 R522	P516-F518 VanDerWaalsContact C-N 3.32Å; P516-F518 PolarHBondContact O-N 3.43Å; F518-V520 VanDerWaalsContact C-N 3.29Å; F518-V520 PolarHBondContact O-N 3.42Å; F518-L521 HydrophobicContact CB-CB 3.91Å; F518-L521 HydrophobicContact CD1-CB 4.21Å; F518-L521 HydrophobicContact CD1-CD1 3.38Å; F518-L521 HydrophobicContact CD1-CG 4.41Å; F518-L521 HydrophobicContact CE1-CD1 3.79Å; F518-L521 HydrophobicContact CG-CB 4.45Å; F518-L521 HydrophobicContact CG-CD1 4.24Å; F518-L521 PolarHBondContact O-N 2.85Å; F518-R522 WeakPolarHBondContact O-CG 3.31Å; F518-R522 PolarHBondContact O-N 2.81Å; F518-R522 VanDerWaalsContact O-N 3.07Å
519	R	62.5	Low	65.3	Low	204 Å²	204	110.8 Å²	110.8	77%	0.77	54%	0.543	S	S	*	.	H	α-helix	trans	-59.3	-39.3	176.2	-162.4	177.3	-173.9	-178.3	2	112.3	R522 W523	R519-R522 PolarHBondContact O-N 2.93Å; R519-W523 PolarHBondContact O-N 3.35Å
520	V	68.5	Low	65.4	Low	112 Å²	112	110.6 Å²	110.6	68%	0.679	54%	0.54	S	S	*	.	H	α-helix	trans	-64.7	-46	176.7	-180	0	0	0	0	111.3	F518 R522 W523 V524	F518-V520 VanDerWaalsContact C-N 3.29Å; F518-V520 PolarHBondContact O-N 3.42Å; V520-R522 VanDerWaalsContact C-N 3.32Å; V520-R522 PolarHBondContact O-N 3.34Å; V520-W523 PolarHBondContact O-N 2.87Å; V520-V524 HydrophobicContact CG1-CG2 4.31Å; V520-V524 VanDerWaalsContact O-CG2 3.3Å; V520-V524 WeakPolarHBondContact O-CG2 3.45Å; V520-V524 PolarHBondContact O-N 3.07Å
521	L	69.8	Low	65.7	Low	112 Å²	112	109.2 Å²	109.2	59%	0.586	54%	0.535	S	S	*	.	H	α-helix	trans	-64.1	-36.5	179.9	-118.7	134.6	0	0	0	112.2	F518 R525	F518-L521 HydrophobicContact CB-CB 3.91Å; F518-L521 HydrophobicContact CD1-CB 4.21Å; F518-L521 HydrophobicContact CD1-CD1 3.38Å; F518-L521 HydrophobicContact CD1-CG 4.41Å; F518-L521 HydrophobicContact CE1-CD1 3.79Å; F518-L521 HydrophobicContact CG-CB 4.45Å; F518-L521 HydrophobicContact CG-CD1 4.24Å; F518-L521 PolarHBondContact O-N 2.85Å; L521-R525 WeakPolarHBondContact O-CB 3.32Å; L521-R525 PolarHBondContact O-N 3.05Å
522	R	65.8	Low	66.1	Low	74 Å²	74	108.6 Å²	108.6	28%	0.279	54%	0.536	S	S	.	.	H	α-helix	trans	-66.9	-41.7	172.9	-71.5	-174.5	-71	173.5	-8.7	112.3	A509 F518 R519 V520 R525 A526	A509-R522 HydrophobicContact CB-CB 3.9Å; A509-R522 VanDerWaalsContact O-CD 3.26Å; A509-R522 WeakPolarHBondContact O-CD 3.26Å; A509-R522 VanDerWaalsContact O-CZ 3.28Å; A509-R522 PolarHBondContact O-NE 3.36Å; A509-R522 PolarHBondContact O-NH1 2.81Å; F518-R522 WeakPolarHBondContact O-CG 3.31Å; F518-R522 PolarHBondContact O-N 2.81Å; F518-R522 VanDerWaalsContact O-N 3.07Å; R519-R522 PolarHBondContact O-N 2.93Å; V520-R522 VanDerWaalsContact C-N 3.32Å; V520-R522 PolarHBondContact O-N 3.34Å; R522-R525 PolarHBondContact O-N 3.15Å; R522-A526 PolarHBondContact O-N 3.36Å
523	W	68.3	Low	67	Low	170 Å²	170	102.3 Å²	102.3	64%	0.644	50%	0.495	S	S	*	.	H	α-helix	trans	-63.9	-45.3	174	-179.3	85.4	0	0	0	111.9	R519 V520 R525 A526 T527	R519-W523 PolarHBondContact O-N 3.35Å; V520-W523 PolarHBondContact O-N 2.87Å; W523-R525 VanDerWaalsContact C-N 3.28Å; W523-R525 PolarHBondContact O-N 3.4Å; W523-A526 PolarHBondContact O-N 2.88Å; W523-T527 WeakPolarHBondContact O-CB 3.34Å; W523-T527 PolarHBondContact O-N 3.07Å; W523-T527 PolarHBondContact O-OG1 2.9Å
524	V	74.2	Confident	67.9	Low	76 Å²	76	102.2 Å²	102.2	46%	0.461	48%	0.481	S	S	.	.	H	α-helix	trans	-57.2	-43.1	174.6	170.1	0	0	0	0	110.7	V520 T527 W528	V520-V524 HydrophobicContact CG1-CG2 4.31Å; V520-V524 VanDerWaalsContact O-CG2 3.3Å; V520-V524 WeakPolarHBondContact O-CG2 3.45Å; V520-V524 PolarHBondContact O-N 3.07Å; V524-T527 PolarHBondContact O-N 3.26Å; V524-W528 VanDerWaalsContact O-CB 3.25Å; V524-W528 WeakPolarHBondContact O-CB 3.43Å; V524-W528 PolarHBondContact O-N 3.29Å
525	R	70.8	Confident	69.1	Low	156 Å²	156	98.5 Å²	98.5	59%	0.589	46%	0.461	S	S	*	.	H	α-helix	trans	-64.3	-43.6	176.8	-171	177.1	-177.2	166.7	1.8	112.8	L521 R522 W523 W528 E529	L521-R525 WeakPolarHBondContact O-CB 3.32Å; L521-R525 PolarHBondContact O-N 3.05Å; R522-R525 PolarHBondContact O-N 3.15Å; W523-R525 VanDerWaalsContact C-N 3.28Å; W523-R525 PolarHBondContact O-N 3.4Å; R525-W528 WeakPolarHBondContact O-CB 3.47Å; R525-W528 PolarHBondContact O-N 3.48Å; R525-E529 PolarHBondContact O-N 2.85Å
526	A	68.6	Low	70.2	Confident	17 Å²	17	94.5 Å²	94.5	14%	0.14	44%	0.444	C	S	.	.	H	α-helix	trans	-63.4	-43.6	176.5	0	0	0	0	0	111.7	R522 W523 W528 E529 S530	R522-A526 PolarHBondContact O-N 3.36Å; W523-A526 PolarHBondContact O-N 2.88Å; A526-W528 VanDerWaalsContact C-N 3.31Å; A526-W528 PolarHBondContact O-N 3.17Å; A526-E529 PolarHBondContact O-N 3.5Å; A526-S530 PolarHBondContact O-N 2.9Å; A526-S530 VanDerWaalsContact O-N 3.08Å
527	T	72.4	Confident	71	Confident	62 Å²	62	90 Å²	90	38%	0.38	41%	0.414	S	S	.	.	H	α-helix	trans	-63.2	-38.6	174.7	-57.5	0	0	0	0	111.4	W523 V524 S530 L531	W523-T527 WeakPolarHBondContact O-CB 3.34Å; W523-T527 PolarHBondContact O-N 3.07Å; W523-T527 PolarHBondContact O-OG1 2.9Å; V524-T527 PolarHBondContact O-N 3.26Å; T527-S530 PolarHBondContact O-N 3.36Å; T527-L531 WeakPolarHBondContact O-CB 3.43Å; T527-L531 PolarHBondContact O-N 3.41Å
528	W	77.3	Confident	72	Confident	157 Å²	157	87 Å²	87	60%	0.595	40%	0.403	S	S	*	.	H	α-helix	trans	-64.3	-43.3	175.6	-179.3	-106.7	0	0	0	112.7	V524 R525 A526 S530 L531 K532	V524-W528 VanDerWaalsContact O-CB 3.25Å; V524-W528 WeakPolarHBondContact O-CB 3.43Å; V524-W528 PolarHBondContact O-N 3.29Å; R525-W528 WeakPolarHBondContact O-CB 3.47Å; R525-W528 PolarHBondContact O-N 3.48Å; A526-W528 VanDerWaalsContact C-N 3.31Å; A526-W528 PolarHBondContact O-N 3.17Å; W528-S530 VanDerWaalsContact C-N 3.33Å; W528-S530 PolarHBondContact O-N 3.07Å; W528-L531 HydrophobicContact CE3-CD2 3.97Å; W528-L531 HydrophobicContact CZ3-CD2 3.86Å; W528-L531 PolarHBondContact O-N 3.12Å; W528-K532 WeakPolarHBondContact O-CB 3.34Å; W528-K532 PolarHBondContact O-N 2.89Å
529	E	72.9	Confident	72.5	Confident	39 Å²	39	84.7 Å²	84.7	18%	0.182	40%	0.4	C	S	.	.	H	α-helix	trans	-64.2	-38.7	175.4	-70.8	-63.2	159.8	0	0	111.9	R525 A526 K532 F533	R525-E529 PolarHBondContact O-N 2.85Å; A526-E529 PolarHBondContact O-N 3.5Å; E529-K532 PolarHBondContact O-N 3.07Å; E529-F533 WeakPolarHBondContact O-CB 3.27Å; E529-F533 PolarHBondContact O-N 3.06Å
530	S	72.8	Confident	72.9	Confident	16 Å²	16	78.1 Å²	78.1	11%	0.112	38%	0.378	C	S	.	.	H	α-helix	trans	-63.1	-44.3	172.8	-169.8	0	0	0	0	111.5	A526 T527 W528 F533 E534	A526-S530 PolarHBondContact O-N 2.9Å; A526-S530 VanDerWaalsContact O-N 3.08Å; T527-S530 PolarHBondContact O-N 3.36Å; W528-S530 VanDerWaalsContact C-N 3.33Å; W528-S530 PolarHBondContact O-N 3.07Å; S530-F533 PolarHBondContact O-N 3.08Å; S530-E534 WeakPolarHBondContact O-CG 3.36Å; S530-E534 PolarHBondContact O-N 2.72Å
531	L	77.7	Confident	73	Confident	80 Å²	80	77.2 Å²	77.2	42%	0.419	37%	0.368	S	S	.	.	H	α-helix	trans	-63.1	-44.8	176.8	-175.6	70.5	0	0	0	111.1	T527 W528 F533 E534 C535	T527-L531 WeakPolarHBondContact O-CB 3.43Å; T527-L531 PolarHBondContact O-N 3.41Å; W528-L531 HydrophobicContact CE3-CD2 3.97Å; W528-L531 HydrophobicContact CZ3-CD2 3.86Å; W528-L531 PolarHBondContact O-N 3.12Å; L531-F533 VanDerWaalsContact C-N 3.3Å; L531-F533 PolarHBondContact O-N 2.99Å; L531-E534 PolarHBondContact O-N 2.9Å; L531-E534 VanDerWaalsContact O-N 3.15Å; L531-C535 WeakPolarHBondContact O-CB 3.38Å; L531-C535 PolarHBondContact O-N 3.46Å; L531-C535 PolarHBondContact O-SG 3.4Å; L531-C535 VanDerWaalsContact O-SG 3.36Å
532	K	77.4	Confident	73.2	Confident	113 Å²	113	74.7 Å²	74.7	49%	0.491	36%	0.363	S	S	.	.	H	α-helix	trans	-59	-42.7	176.4	-177.5	179	179.9	-178.4	0	111.3	W528 E529 C535 A536	W528-K532 WeakPolarHBondContact O-CB 3.34Å; W528-K532 PolarHBondContact O-N 2.89Å; E529-K532 PolarHBondContact O-N 3.07Å; K532-C535 PolarHBondContact O-N 3.32Å; K532-A536 VanDerWaalsContact O-CB 3.27Å; K532-A536 WeakPolarHBondContact O-CB 3.21Å; K532-A536 PolarHBondContact O-N 2.77Å
533	F	74.5	Confident	73.6	Confident	3 Å²	3	76.1 Å²	76.1	1%	0.013	37%	0.374	C	S	.	.	H	α-helix	trans	-63.7	-44.6	174.4	175	-104.3	0	0	0	112	R394 V397 L398 A497 K498 V501 E529 S530 L531 A536 L537	R394-F533 HydrophobicContact CG-CD2 3.82Å; R394-F533 HydrophobicContact CG-CE2 3.81Å; V397-F533 HydrophobicContact CG1-CZ 4.46Å; L398-F533 HydrophobicContact CD1-CD2 4.01Å; L398-F533 HydrophobicContact CD1-CE2 4.11Å; L398-F533 HydrophobicContact CD2-CD2 4.36Å; L398-F533 HydrophobicContact CD2-CE2 4.05Å; L398-F533 HydrophobicContact CG-CD2 4.32Å; L398-F533 HydrophobicContact CG-CE2 3.94Å; A497-F533 HydrophobicContact CB-CE1 4.35Å; A497-F533 HydrophobicContact CB-CZ 3.75Å; K498-F533 HydrophobicContact CG-CD1 4.43Å; K498-F533 HydrophobicContact CG-CE1 3.88Å; V501-F533 HydrophobicContact CB-CB 4.42Å; V501-F533 HydrophobicContact CB-CD1 4.32Å; V501-F533 HydrophobicContact CB-CG 4.25Å; V501-F533 HydrophobicContact CG1-CB 3.82Å; V501-F533 HydrophobicContact CG1-CG 4.2Å; V501-F533 HydrophobicContact CG2-CB 4.18Å; V501-F533 HydrophobicContact CG2-CD1 4.01Å; V501-F533 HydrophobicContact CG2-CD2 3.77Å; V501-F533 HydrophobicContact CG2-CE1 4.35Å; V501-F533 HydrophobicContact CG2-CE2 4.13Å; V501-F533 HydrophobicContact CG2-CG 3.7Å; V501-F533 HydrophobicContact CG2-CZ 4.41Å; E529-F533 WeakPolarHBondContact O-CB 3.27Å; E529-F533 PolarHBondContact O-N 3.06Å; S530-F533 PolarHBondContact O-N 3.08Å; L531-F533 VanDerWaalsContact C-N 3.3Å; L531-F533 PolarHBondContact O-N 2.99Å; F533-A536 PolarHBondContact O-N 2.86Å; F533-L537 HydrophobicContact CE1-CD2 4.37Å; F533-L537 HydrophobicContact CZ-CD2 4.47Å; F533-L537 VanDerWaalsContact O-CB 3.32Å; F533-L537 WeakPolarHBondContact O-CB 3.26Å; F533-L537 PolarHBondContact O-N 2.79Å
534	E	74.7	Confident	73.4	Confident	50 Å²	50	68.7 Å²	68.7	23%	0.234	35%	0.347	C	S	.	.	H	α-helix	trans	-63.1	-42.1	176.4	-73.2	-162.8	172.1	0	0	112.5	S530 L531 L537 R538	S530-E534 WeakPolarHBondContact O-CG 3.36Å; S530-E534 PolarHBondContact O-N 2.72Å; L531-E534 PolarHBondContact O-N 2.9Å; L531-E534 VanDerWaalsContact O-N 3.15Å; E534-L537 PolarHBondContact O-N 3.34Å; E534-R538 WeakPolarHBondContact O-CB 3.32Å; E534-R538 VanDerWaalsContact O-CG 3.26Å; E534-R538 WeakPolarHBondContact O-CG 3.39Å; E534-R538 PolarHBondContact O-N 2.83Å; E534-R538 IonicContact OE2-NH2 3.45Å
535	C	78.3	Confident	73.2	Confident	71 Å²	71	68.1 Å²	68.1	48%	0.48	35%	0.346	S	S	.	.	H	α-helix	trans	-61.9	-47.2	174.8	-73.1	0	0	0	0	111.2	L531 K532 R538 S539	L531-C535 WeakPolarHBondContact O-CB 3.38Å; L531-C535 PolarHBondContact O-N 3.46Å; L531-C535 PolarHBondContact O-SG 3.4Å; L531-C535 VanDerWaalsContact O-SG 3.36Å; K532-C535 PolarHBondContact O-N 3.32Å; C535-R538 PolarHBondContact O-N 3.4Å; C535-S539 WeakPolarHBondContact O-CB 3.36Å; C535-S539 PolarHBondContact O-N 3.38Å; C535-S539 PolarHBondContact O-OG 2.8Å
536	A	75.6	Confident	73.5	Confident	28 Å²	28	66.6 Å²	66.6	23%	0.231	35%	0.349	C	S	.	.	H	α-helix	trans	-61.4	-45.5	177.4	0	0	0	0	0	111.7	L398 K532 F533 R538 S539 E540	L398-A536 HydrophobicContact CD2-CB 4.27Å; K532-A536 VanDerWaalsContact O-CB 3.27Å; K532-A536 WeakPolarHBondContact O-CB 3.21Å; K532-A536 PolarHBondContact O-N 2.77Å; F533-A536 PolarHBondContact O-N 2.86Å; A536-R538 PolarHBondContact O-N 3.16Å; A536-S539 WeakPolarHBondContact CA-OG 3.37Å; A536-S539 PolarHBondContact O-N 2.93Å; A536-S539 PolarHBondContact O-OG 3.4Å; A536-E540 WeakPolarHBondContact O-CB 3.22Å; A536-E540 VanDerWaalsContact O-CG 3.29Å; A536-E540 WeakPolarHBondContact O-CG 3.28Å; A536-E540 PolarHBondContact O-N 3.46Å
537	L	72	Confident	73.7	Confident	11 Å²	11	68.2 Å²	68.2	6%	0.058	36%	0.357	C	S	.	.	H	α-helix	trans	-62.3	-44.6	177.6	-174.4	66.9	0	0	0	111.3	V397 L398 L433 F533 E534 M541	V397-L537 HydrophobicContact CG1-CD1 3.77Å; L398-L537 HydrophobicContact CD2-CD1 4.48Å; L433-L537 HydrophobicContact CD2-CD1 4.43Å; F533-L537 HydrophobicContact CE1-CD2 4.37Å; F533-L537 HydrophobicContact CZ-CD2 4.47Å; F533-L537 VanDerWaalsContact O-CB 3.32Å; F533-L537 WeakPolarHBondContact O-CB 3.26Å; F533-L537 PolarHBondContact O-N 2.79Å; E534-L537 PolarHBondContact O-N 3.34Å; L537-M541 HydrophobicContact CG-CE 4.32Å; L537-M541 WeakPolarHBondContact O-CB 2.82Å; L537-M541 VanDerWaalsContact O-CG 3.28Å; L537-M541 WeakPolarHBondContact O-CG 3.29Å; L537-M541 PolarHBondContact O-N 3.03Å
538	R	75.4	Confident	73.6	Confident	164 Å²	164	69.7 Å²	69.7	62%	0.619	36%	0.356	S	S	*	.	H	α-helix	trans	-66.2	-39.7	177	-73.4	179.6	-170.9	-171.5	8.2	112.3	E534 C535 A536 M541 A542	E534-R538 WeakPolarHBondContact O-CB 3.32Å; E534-R538 VanDerWaalsContact O-CG 3.26Å; E534-R538 WeakPolarHBondContact O-CG 3.39Å; E534-R538 PolarHBondContact O-N 2.83Å; E534-R538 IonicContact OE2-NH2 3.45Å; C535-R538 PolarHBondContact O-N 3.4Å; A536-R538 PolarHBondContact O-N 3.16Å; R538-M541 HydrophobicContact CG-CE 4.17Å; R538-A542 WeakPolarHBondContact O-CB 3.46Å; R538-A542 PolarHBondContact O-N 3.34Å
539	S	73.4	Confident	73.4	Confident	64 Å²	64	65.6 Å²	65.6	45%	0.448	35%	0.351	S	S	.	.	H	α-helix	trans	-66.1	-42	178	61.9	0	0	0	0	111.3	C535 A536 A542 M543	C535-S539 WeakPolarHBondContact O-CB 3.36Å; C535-S539 PolarHBondContact O-N 3.38Å; C535-S539 PolarHBondContact O-OG 2.8Å; A536-S539 WeakPolarHBondContact CA-OG 3.37Å; A536-S539 PolarHBondContact O-N 2.93Å; A536-S539 PolarHBondContact O-OG 3.4Å; S539-A542 PolarHBondContact O-N 3.4Å; S539-M543 VanDerWaalsContact O-CB 3.22Å; S539-M543 WeakPolarHBondContact O-CB 3.42Å; S539-M543 PolarHBondContact O-N 2.93Å
540	E	71.3	Confident	73.7	Confident	65 Å²	65	68 Å²	68	30%	0.304	37%	0.365	S	S	.	.	H	α-helix	trans	-63.6	-47.9	175.7	-73.7	-60.8	152.8	0	0	111.6	L433 A536 A542 M543 M544	L433-E540 HydrophobicContact CD1-CB 3.89Å; L433-E540 HydrophobicContact CD2-CB 3.64Å; L433-E540 HydrophobicContact CD2-CG 4.4Å; L433-E540 HydrophobicContact CG-CB 4.45Å; A536-E540 WeakPolarHBondContact O-CB 3.22Å; A536-E540 VanDerWaalsContact O-CG 3.29Å; A536-E540 WeakPolarHBondContact O-CG 3.28Å; A536-E540 PolarHBondContact O-N 3.46Å; E540-A542 VanDerWaalsContact C-N 3.33Å; E540-A542 PolarHBondContact O-N 3Å; E540-M543 PolarHBondContact O-N 2.87Å; E540-M543 WeakPolarHBondContact OE2-CE 3.31Å; E540-M544 WeakPolarHBondContact O-CB 3.48Å; E540-M544 WeakPolarHBondContact O-CG 3.17Å; E540-M544 PolarHBondContact O-N 3.32Å
541	M	70.1	Confident	73.7	Confident	94 Å²	94	69 Å²	69	46%	0.463	37%	0.369	S	S	.	.	H	α-helix	trans	-60.5	-41.9	175.6	-71.5	-173.5	-52.7	0	0	112.4	L537 R538 S545	L537-M541 HydrophobicContact CG-CE 4.32Å; L537-M541 WeakPolarHBondContact O-CB 2.82Å; L537-M541 VanDerWaalsContact O-CG 3.28Å; L537-M541 WeakPolarHBondContact O-CG 3.29Å; L537-M541 PolarHBondContact O-N 3.03Å; R538-M541 HydrophobicContact CG-CE 4.17Å; M541-S545 WeakPolarHBondContact O-CB 3.42Å; M541-S545 PolarHBondContact O-N 3.42Å
542	A	73.6	Confident	73.5	Confident	58 Å²	58	68 Å²	68	48%	0.479	37%	0.368	S	S	.	.	H	α-helix	trans	-68	-44.3	178.8	0	0	0	0	0	111.6	R538 S539 E540 M544 S545 L546	R538-A542 WeakPolarHBondContact O-CB 3.46Å; R538-A542 PolarHBondContact O-N 3.34Å; S539-A542 PolarHBondContact O-N 3.4Å; E540-A542 VanDerWaalsContact C-N 3.33Å; E540-A542 PolarHBondContact O-N 3Å; A542-M544 VanDerWaalsContact C-N 3.35Å; A542-M544 PolarHBondContact O-N 3.32Å; A542-S545 PolarHBondContact O-N 2.8Å; A542-L546 WeakPolarHBondContact O-CB 3.22Å; A542-L546 PolarHBondContact O-N 3.09Å
543	M	73.6	Confident	73.5	Confident	104 Å²	104	67 Å²	67	51%	0.512	37%	0.368	S	S	.	.	H	α-helix	trans	-57	-51.2	175.3	-176.5	172.8	67.3	0	0	109.4	S539 E540 S545 L546 T547	S539-M543 VanDerWaalsContact O-CB 3.22Å; S539-M543 WeakPolarHBondContact O-CB 3.42Å; S539-M543 PolarHBondContact O-N 2.93Å; E540-M543 PolarHBondContact O-N 2.87Å; E540-M543 WeakPolarHBondContact OE2-CE 3.31Å; M543-S545 PolarHBondContact O-N 3.39Å; M543-L546 CarbonylContact O-C 3.55Å; M543-L546 WeakPolarHBondContact O-CA 3.47Å; M543-L546 WeakPolarHBondContact O-CB 3.31Å; M543-L546 PolarHBondContact O-N 2.74Å; M543-L546 VanDerWaalsContact O-N 3.09Å; M543-T547 PolarHBondContact O-N 2.88Å; M543-T547 PolarHBondContact O-OG1 3.26Å
544	M	65.8	Low	73.7	Confident	15 Å²	15	68.9 Å²	68.9	7%	0.074	38%	0.378	C	S	.	.	H	α-helix	trans	-61.2	-39.5	177.2	-75	-162.5	129.7	0	0	114.6	R431 L433 E540 A542 L546 T547 R548 Y569	R431-M544 WeakPolarHBondContact O-CE 3.39Å; L433-M544 HydrophobicContact CB-CE 4.43Å; L433-M544 HydrophobicContact CB-SD 3.47Å; L433-M544 WeakPolarHBondContact CB-SD 3.49Å; L433-M544 HydrophobicContact CD1-CE 3.78Å; L433-M544 HydrophobicContact CD1-CG 3.86Å; L433-M544 HydrophobicContact CD1-SD 3.22Å; L433-M544 WeakPolarHBondContact CD1-SD 3.36Å; L433-M544 HydrophobicContact CG-SD 3.91Å; L433-M544 PolarHBondContact N-SD 2.87Å; E540-M544 WeakPolarHBondContact O-CB 3.48Å; E540-M544 WeakPolarHBondContact O-CG 3.17Å; E540-M544 PolarHBondContact O-N 3.32Å; A542-M544 VanDerWaalsContact C-N 3.35Å; A542-M544 PolarHBondContact O-N 3.32Å; M544-L546 VanDerWaalsContact C-N 3.27Å; M544-T547 PolarHBondContact O-N 3.49Å; M544-R548 WeakPolarHBondContact O-CB 3.39Å; M544-R548 PolarHBondContact O-N 2.94Å; M544-Y569 HydrophobicContact CE-CE2 4.15Å
545	S	68.8	Low	73.8	Confident	63 Å²	63	68 Å²	68	44%	0.441	38%	0.377	S	S	.	.	H	α-helix	trans	-62.3	-41.8	174.9	-172.7	0	0	0	0	110.2	M541 A542 M543 R548 S549	M541-S545 WeakPolarHBondContact O-CB 3.42Å; M541-S545 PolarHBondContact O-N 3.42Å; A542-S545 PolarHBondContact O-N 2.8Å; M543-S545 PolarHBondContact O-N 3.39Å; S545-R548 PolarHBondContact O-N 3.47Å; S545-S549 WeakPolarHBondContact O-CB 3.47Å; S545-S549 PolarHBondContact O-N 3.26Å; S545-S549 PolarHBondContact O-OG 3.3Å; S545-S549 VanDerWaalsContact O-OG 3.05Å
546	L	76.3	Confident	73.9	Confident	124 Å²	124	73.7 Å²	73.7	65%	0.649	39%	0.39	S	S	*	.	H	α-helix	trans	-67.3	-42.1	177.5	-167.5	127.3	0	0	0	111.3	A542 M543 M544 S549 L550	A542-L546 WeakPolarHBondContact O-CB 3.22Å; A542-L546 PolarHBondContact O-N 3.09Å; M543-L546 CarbonylContact O-C 3.55Å; M543-L546 WeakPolarHBondContact O-CA 3.47Å; M543-L546 WeakPolarHBondContact O-CB 3.31Å; M543-L546 PolarHBondContact O-N 2.74Å; M543-L546 VanDerWaalsContact O-N 3.09Å; M544-L546 VanDerWaalsContact C-N 3.27Å; L546-S549 PolarHBondContact O-N 3.1Å; L546-L550 WeakPolarHBondContact O-CB 3.23Å; L546-L550 PolarHBondContact O-N 3.37Å
547	T	73.1	Confident	74.4	Confident	51 Å²	51	78.3 Å²	78.3	31%	0.313	41%	0.405	S	S	.	.	H	α-helix	trans	-62.6	-43.3	174.7	-26.9	0	0	0	0	111.1	M543 M544 L550 L551	M543-T547 PolarHBondContact O-N 2.88Å; M543-T547 PolarHBondContact O-OG1 3.26Å; M544-T547 PolarHBondContact O-N 3.49Å; T547-L550 PolarHBondContact O-N 2.88Å; T547-L551 HydrophobicContact CG2-CD1 4.3Å; T547-L551 VanDerWaalsContact O-CB 3.32Å; T547-L551 WeakPolarHBondContact O-CB 3.32Å; T547-L551 VanDerWaalsContact O-CG 3.23Å; T547-L551 WeakPolarHBondContact O-CG 3.21Å; T547-L551 PolarHBondContact O-N 3.23Å
548	R	70.6	Confident	74.6	Confident	93 Å²	93	85 Å²	85	35%	0.351	44%	0.441	S	S	.	.	H	α-helix	trans	-62.7	-50.2	175.3	-83.6	-173.5	-86.1	175.1	-9.6	111.5	M544 S545 L550 L551 S552 Y569 L570	M544-R548 WeakPolarHBondContact O-CB 3.39Å; M544-R548 PolarHBondContact O-N 2.94Å; S545-R548 PolarHBondContact O-N 3.47Å; R548-L550 VanDerWaalsContact C-N 3.3Å; R548-L550 PolarHBondContact O-N 3.42Å; R548-L551 PolarHBondContact O-N 3.19Å; R548-S552 WeakPolarHBondContact O-CB 3.41Å; R548-S552 PolarHBondContact O-N 3.46Å; R548-S552 PolarHBondContact O-OG 2.83Å; R548-Y569 WeakPolarHBondContact CD-O 3.11Å; R548-Y569 HydrophobicContact CG-CD1 4.23Å; R548-Y569 HydrophobicContact CG-CE1 3.8Å; R548-L570 HydrophobicContact CB-CD2 4.16Å; R548-L570 HydrophobicContact CG-CD2 4.14Å; R548-L570 WeakPolarHBondContact O-CD2 3.16Å
549	S	73.8	Confident	74.5	Confident	72 Å²	72	83 Å²	83	50%	0.503	44%	0.442	S	S	.	.	H	α-helix	trans	-59.8	-40.2	177.2	-64.1	0	0	0	0	112.4	S545 L546 L553	S545-S549 WeakPolarHBondContact O-CB 3.47Å; S545-S549 PolarHBondContact O-N 3.26Å; S545-S549 PolarHBondContact O-OG 3.3Å; S545-S549 VanDerWaalsContact O-OG 3.05Å; L546-S549 PolarHBondContact O-N 3.1Å; S549-L553 WeakPolarHBondContact O-CB 3.39Å; S549-L553 PolarHBondContact O-N 3.15Å
550	L	78.5	Confident	74.5	Confident	90 Å²	90	83.6 Å²	83.6	47%	0.471	44%	0.439	S	S	.	.	H	α-helix	trans	-65.1	-46.5	176.2	-178.1	67.2	0	0	0	111.4	L546 T547 R548 L553 L554	L546-L550 WeakPolarHBondContact O-CB 3.23Å; L546-L550 PolarHBondContact O-N 3.37Å; T547-L550 PolarHBondContact O-N 2.88Å; R548-L550 VanDerWaalsContact C-N 3.3Å; R548-L550 PolarHBondContact O-N 3.42Å; L550-L553 PolarHBondContact O-N 2.86Å; L550-L554 HydrophobicContact CD1-CD1 4.16Å; L550-L554 HydrophobicContact CD1-CG 4.32Å; L550-L554 HydrophobicContact CD2-CD1 4.46Å; L550-L554 HydrophobicContact CG-CD1 3.84Å; L550-L554 HydrophobicContact CG-CG 4.39Å; L550-L554 WeakPolarHBondContact O-CB 3.39Å; L550-L554 VanDerWaalsContact O-CG 3.23Å; L550-L554 WeakPolarHBondContact O-CG 3.23Å; L550-L554 PolarHBondContact O-N 3.43Å
551	L	73.8	Confident	74.1	Confident	37 Å²	37	85.7 Å²	85.7	19%	0.194	46%	0.461	C	S	.	.	H	α-helix	trans	-64.7	-40.9	177.7	-74.9	169.2	0	0	0	111.9	T547 R548 L553 S555 V566 Y569 L570	T547-L551 HydrophobicContact CG2-CD1 4.3Å; T547-L551 VanDerWaalsContact O-CB 3.32Å; T547-L551 WeakPolarHBondContact O-CB 3.32Å; T547-L551 VanDerWaalsContact O-CG 3.23Å; T547-L551 WeakPolarHBondContact O-CG 3.21Å; T547-L551 PolarHBondContact O-N 3.23Å; R548-L551 PolarHBondContact O-N 3.19Å; L551-L553 VanDerWaalsContact C-N 3.32Å; L551-L553 PolarHBondContact O-N 3.44Å; L551-S555 VanDerWaalsContact O-CB 3.31Å; L551-S555 WeakPolarHBondContact O-CB 3.34Å; L551-S555 PolarHBondContact O-N 2.83Å; L551-V566 HydrophobicContact CD1-CG1 4.33Å; L551-V566 HydrophobicContact CD2-CG1 4.41Å; L551-Y569 HydrophobicContact CD1-CD1 3.83Å; L551-Y569 HydrophobicContact CD1-CE1 3.77Å; L551-L570 HydrophobicContact CB-CD1 4.34Å; L551-L570 HydrophobicContact CB-CD2 3.79Å; L551-L570 HydrophobicContact CB-CG 4.44Å
552	S	71.9	Confident	73.5	Confident	57 Å²	57	83.1 Å²	83.1	40%	0.399	45%	0.449	S	S	.	.	H	α-helix	trans	-62	-40.2	172.9	-61.4	0	0	0	0	111.9	R548 Y556 L570	R548-S552 WeakPolarHBondContact O-CB 3.41Å; R548-S552 PolarHBondContact O-N 3.46Å; R548-S552 PolarHBondContact O-OG 2.83Å; S552-Y556 WeakPolarHBondContact O-CB 3.44Å; S552-Y556 PolarHBondContact O-N 2.88Å; S552-L570 WeakPolarHBondContact OG-CD2 3.48Å
553	L	79.1	Confident	72.9	Confident	93 Å²	93	86.1 Å²	86.1	49%	0.487	46%	0.457	S	S	.	.	H	α-helix	trans	-71.2	-43.4	179.4	-170.2	138	0	0	0	111.6	S549 L550 L551 S555 Y556 F557	S549-L553 WeakPolarHBondContact O-CB 3.39Å; S549-L553 PolarHBondContact O-N 3.15Å; L550-L553 PolarHBondContact O-N 2.86Å; L551-L553 VanDerWaalsContact C-N 3.32Å; L551-L553 PolarHBondContact O-N 3.44Å; L553-S555 VanDerWaalsContact C-N 3.29Å; L553-S555 PolarHBondContact O-N 3.25Å; L553-Y556 WeakPolarHBondContact O-CB 3.38Å; L553-Y556 PolarHBondContact O-N 3.05Å; L553-F557 HydrophobicContact CD1-CE2 4.39Å; L553-F557 HydrophobicContact CD2-CD2 3.68Å; L553-F557 HydrophobicContact CD2-CE2 3.64Å; L553-F557 HydrophobicContact CG-CD2 3.95Å; L553-F557 HydrophobicContact CG-CE2 3.74Å; L553-F557 WeakPolarHBondContact O-CD2 3.21Å; L553-F557 PolarHBondContact O-N 2.92Å
554	L	78.8	Confident	71.7	Confident	42 Å²	42	89.4 Å²	89.4	22%	0.22	47%	0.471	C	S	.	.	H	α-helix	trans	-62.8	-36.5	174.6	-71.1	169.5	0	0	0	112.1	L550 N558 L559 I560	L550-L554 HydrophobicContact CD1-CD1 4.16Å; L550-L554 HydrophobicContact CD1-CG 4.32Å; L550-L554 HydrophobicContact CD2-CD1 4.46Å; L550-L554 HydrophobicContact CG-CD1 3.84Å; L550-L554 HydrophobicContact CG-CG 4.39Å; L550-L554 WeakPolarHBondContact O-CB 3.39Å; L550-L554 VanDerWaalsContact O-CG 3.23Å; L550-L554 WeakPolarHBondContact O-CG 3.23Å; L550-L554 PolarHBondContact O-N 3.43Å; L554-N558 PolarHBondContact O-N 3.04Å; L554-L559 HydrophobicContact CD2-CD1 3.81Å; L554-L559 PolarHBondContact O-N 2.93Å; L554-L559 HydrophobicContact CD2-CB 4.25Å; L554-I560 HydrophobicContact CB-CD1 3.9Å; L554-I560 HydrophobicContact CB-CG1 4.21Å; L554-I560 HydrophobicContact CD1-CD1 3.7Å; L554-I560 HydrophobicContact CG-CD1 4.32Å
555	S	75.8	Confident	70.8	Confident	33 Å²	33	95.2 Å²	95.2	23%	0.231	50%	0.498	C	S	.	.	H	α-helix	trans	-67.9	-42.9	171.4	175.1	0	0	0	0	112.4	L551 L553 F557 N558 L562	L551-S555 VanDerWaalsContact O-CB 3.31Å; L551-S555 WeakPolarHBondContact O-CB 3.34Å; L551-S555 PolarHBondContact O-N 2.83Å; L553-S555 VanDerWaalsContact C-N 3.29Å; L553-S555 PolarHBondContact O-N 3.25Å; S555-F557 PolarHBondContact O-N 2.82Å; S555-N558 PolarHBondContact O-N 3.24Å; S555-L562 WeakPolarHBondContact OG-CD1 3.31Å; S555-L562 VanDerWaalsContact CB-CD1 3.45Å
556	Y	79.9	Confident	69.9	Low	189 Å²	189	94.4 Å²	94.4	74%	0.741	49%	0.49	S	S	*	.	H	α-helix	trans	-59.3	-36.6	176.9	-179.4	-97.3	0	0	0	112.3	S552 L553 N558	S552-Y556 WeakPolarHBondContact O-CB 3.44Å; S552-Y556 PolarHBondContact O-N 2.88Å; L553-Y556 WeakPolarHBondContact O-CB 3.38Å; L553-Y556 PolarHBondContact O-N 3.05Å; Y556-N558 VanDerWaalsContact C-N 3.28Å; Y556-N558 PolarHBondContact O-N 3.37Å
557	F	85.9	Confident	68.7	Low	126 Å²	126	95.1 Å²	95.1	55%	0.553	49%	0.485	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.7	8.2	175.3	-72.4	-67.7	0	0	0	114.3	L553 S555 L559	L553-F557 HydrophobicContact CD1-CE2 4.39Å; L553-F557 HydrophobicContact CD2-CD2 3.68Å; L553-F557 HydrophobicContact CD2-CE2 3.64Å; L553-F557 HydrophobicContact CG-CD2 3.95Å; L553-F557 HydrophobicContact CG-CE2 3.74Å; L553-F557 WeakPolarHBondContact O-CD2 3.21Å; L553-F557 PolarHBondContact O-N 2.92Å; S555-F557 PolarHBondContact O-N 2.82Å; F557-L559 HydrophobicContact CB-CD1 3.91Å; F557-L559 HydrophobicContact CB-CG 4.01Å; F557-L559 PolarHBondContact O-N 2.93Å; F557-L559 VanDerWaalsContact O-N 3.09Å
558	N	76.9	Confident	67.5	Low	150 Å²	150	98.2 Å²	98.2	80%	0.802	50%	0.496	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.5	24.6	-176.6	-78.7	-19.8	0	0	0	114.3	L554 S555 Y556 I560	L554-N558 PolarHBondContact O-N 3.04Å; S555-N558 PolarHBondContact O-N 3.24Å; Y556-N558 VanDerWaalsContact C-N 3.28Å; Y556-N558 PolarHBondContact O-N 3.37Å; N558-I560 VanDerWaalsContact C-N 3.31Å
559	L	73.9	Confident	66.2	Low	124 Å²	124	95.7 Å²	95.7	65%	0.649	49%	0.487	S	S	*	.	S	Bend	trans	-79.4	-18.3	179	-68.3	168.5	0	0	0	112.1	L554 F557	L554-L559 HydrophobicContact CD2-CD1 3.81Å; L554-L559 PolarHBondContact O-N 2.93Å; L554-L559 HydrophobicContact CD2-CB 4.25Å; F557-L559 HydrophobicContact CB-CD1 3.91Å; F557-L559 HydrophobicContact CB-CG 4.01Å; F557-L559 PolarHBondContact O-N 2.93Å; F557-L559 VanDerWaalsContact O-N 3.09Å
560	I	73.4	Confident	64.7	Low	76 Å²	76	94.1 Å²	94.1	39%	0.39	47%	0.473	S	S	.	.	S	Bend	trans	-141.3	132.4	178.8	-55	179.8	0	0	0	108.7	L554 N558	L554-I560 HydrophobicContact CB-CD1 3.9Å; L554-I560 HydrophobicContact CB-CG1 4.21Å; L554-I560 HydrophobicContact CD1-CD1 3.7Å; L554-I560 HydrophobicContact CG-CD1 4.32Å; N558-I560 VanDerWaalsContact C-N 3.31Å
561	S	61.7	Low	63.2	Low	109 Å²	109	99.5 Å²	99.5	76%	0.762	49%	0.492	S	S	*	.			trans	-78.7	116.8	164.3	57	0	0	0	0	108.9	D563	S561-D563 PolarHBondContact O-N 3.43Å
562	L	58.8	Low	62.7	Low	39 Å²	39	102.7 Å²	102.7	20%	0.204	51%	0.507	C	S	.	.			trans	-71.3	111.4	174.9	-65.2	170.6	0	0	0	108.8	S555 V566 Y567 L570	S555-L562 WeakPolarHBondContact OG-CD1 3.31Å; S555-L562 VanDerWaalsContact CB-CD1 3.45Å; L562-V566 HydrophobicContact CD2-CG1 3.38Å; L562-V566 HydrophobicContact CD2-CB 3.88Å; L562-V566 HydrophobicContact CB-CB 4.45Å; L562-Y567 HydrophobicContact CB-CD2 4.44Å; L562-Y567 HydrophobicContact CD1-CD2 4.09Å; L562-L570 HydrophobicContact CD1-CD1 3.46Å; L562-L570 VanDerWaalsContact CD1-CD1 3.46Å; L562-L570 HydrophobicContact CD2-CD1 3.58Å; L562-L570 HydrophobicContact CG-CD1 4.19Å
563	D	60.4	Low	62.2	Low	121 Å²	121	105.1 Å²	105.1	65%	0.647	51%	0.513	S	S	*	.			trans	-61.2	160.1	164.7	-102.1	-20.3	0	0	0	110.3	S561 E565 V566 Y567	S561-D563 PolarHBondContact O-N 3.43Å; D563-E565 PolarHBondContact O-N 3.48Å; D563-E565 VanDerWaalsContact O-N 3.1Å; D563-V566 HydrophobicContact CB-CG2 4.33Å; D563-V566 PolarHBondContact O-N 2.89Å; D563-Y567 PolarHBondContact O-N 3.2Å
564	E	49	Very low	61.2	Low	173 Å²	173	105.7 Å²	105.7	81%	0.808	52%	0.515	S	S	*	.	H	α-helix	trans	-54.3	-33.3	-179.6	-151.7	169.3	-160.2	0	0	112	Q568	E564-Q568 PolarHBondContact O-N 3.09Å; E564-Q568 VanDerWaalsContact O-N 3.15Å
565	E	46.1	Very low	60.2	Low	137 Å²	137	109.5 Å²	109.5	64%	0.64	53%	0.532	S	S	*	.	H	α-helix	trans	-67.5	-38.4	173.2	-69.1	-166.1	-169.7	0	0	113.9	R431 D563 Y569	R431-E565 IonicContact NH1-OE2 2.79Å; R431-E565 PolarHBondContact NH1-OE2 2.97Å; D563-E565 PolarHBondContact O-N 3.48Å; D563-E565 VanDerWaalsContact O-N 3.1Å; E565-Y569 PolarHBondContact O-N 2.98Å
566	V	50.3	Low	59.2	Low	47 Å²	47	114.3 Å²	114.3	29%	0.285	55%	0.551	S	S	.	*	H	α-helix	trans	-79.5	-29.8	-180	-165	0	0	0	0	110.5	L551 L562 D563 Y569 L570	L551-V566 HydrophobicContact CD1-CG1 4.33Å; L551-V566 HydrophobicContact CD2-CG1 4.41Å; L562-V566 HydrophobicContact CD2-CG1 3.38Å; L562-V566 HydrophobicContact CD2-CB 3.88Å; L562-V566 HydrophobicContact CB-CB 4.45Å; D563-V566 HydrophobicContact CB-CG2 4.33Å; D563-V566 PolarHBondContact O-N 2.89Å; V566-Y569 PolarHBondContact O-N 3.32Å; V566-L570 WeakPolarHBondContact O-CG 3.37Å; V566-L570 PolarHBondContact O-N 3.02Å
567	Y	50.2	Low	57.8	Low	139 Å²	139	109.3 Å²	109.3	55%	0.545	54%	0.538	S	S	.	.	H	α-helix	trans	-67.1	-36.7	173.3	-159.5	-91.2	0	0	0	112.1	L562 D563 L570 K571	L562-Y567 HydrophobicContact CB-CD2 4.44Å; L562-Y567 HydrophobicContact CD1-CD2 4.09Å; D563-Y567 PolarHBondContact O-N 3.2Å; Y567-L570 PolarHBondContact O-N 3.41Å; Y567-K571 PolarHBondContact O-N 2.98Å
568	Q	48.2	Very low	55.8	Low	115 Å²	115	108.1 Å²	108.1	54%	0.537	54%	0.537	S	S	.	.	H	α-helix	trans	-66	-41.6	170.9	-80.1	-148.3	-20.7	0	0	112.7	E564 L570 K571	E564-Q568 PolarHBondContact O-N 3.09Å; E564-Q568 VanDerWaalsContact O-N 3.15Å; Q568-L570 PolarHBondContact O-N 3.19Å; Q568-K571 PolarHBondContact O-N 3.44Å
569	Y	43.6	Very low	54.2	Low	41 Å²	41	104.8 Å²	104.8	16%	0.161	52%	0.517	C	S	.	.	H	α-helix	trans	-62.1	-22.5	177.1	-178.5	-100.5	0	0	0	114.1	R431 E432 M544 R548 L551 E565 V566	R431-Y569 VanDerWaalsContact O-CE2 3.31Å; R431-Y569 WeakPolarHBondContact O-CE2 3.47Å; E432-Y569 HydrophobicContact CG-CD2 4Å; E432-Y569 HydrophobicContact CG-CE2 4.25Å; M544-Y569 HydrophobicContact CE-CE2 4.15Å; R548-Y569 WeakPolarHBondContact CD-O 3.11Å; R548-Y569 HydrophobicContact CG-CD1 4.23Å; R548-Y569 HydrophobicContact CG-CE1 3.8Å; L551-Y569 HydrophobicContact CD1-CD1 3.83Å; L551-Y569 HydrophobicContact CD1-CE1 3.77Å; E565-Y569 PolarHBondContact O-N 2.98Å; V566-Y569 PolarHBondContact O-N 3.32Å
570	L	43	Very low	52.6	Low	38 Å²	38	103.3 Å²	103.3	20%	0.199	51%	0.505	C	S	.	.	H	α-helix	trans	-91.5	-15.6	180	-75.2	176.3	0	0	0	114.5	R548 L551 S552 L562 V566 Y567 Q568	R548-L570 HydrophobicContact CB-CD2 4.16Å; R548-L570 HydrophobicContact CG-CD2 4.14Å; R548-L570 WeakPolarHBondContact O-CD2 3.16Å; L551-L570 HydrophobicContact CB-CD1 4.34Å; L551-L570 HydrophobicContact CB-CD2 3.79Å; L551-L570 HydrophobicContact CB-CG 4.44Å; S552-L570 WeakPolarHBondContact OG-CD2 3.48Å; L562-L570 HydrophobicContact CD1-CD1 3.46Å; L562-L570 VanDerWaalsContact CD1-CD1 3.46Å; L562-L570 HydrophobicContact CD2-CD1 3.58Å; L562-L570 HydrophobicContact CG-CD1 4.19Å; V566-L570 WeakPolarHBondContact O-CG 3.37Å; V566-L570 PolarHBondContact O-N 3.02Å; Y567-L570 PolarHBondContact O-N 3.41Å; Q568-L570 PolarHBondContact O-N 3.19Å
571	K	46.2	Very low	50.7	Low	204 Å²	204	105.7 Å²	105.7	89%	0.887	52%	0.516	S	S	*	.			trans	-78.2	0	172.6	-100.6	-178.7	176	174.8	0	111.3	Y567 Q568	Y567-K571 PolarHBondContact O-N 2.98Å; Q568-K571 PolarHBondContact O-N 3.44Å

Retrieved 571 of 571 residues in 497.8 ms (Link to these results)

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