A0A087XYD1_POEFO Loading...

Mucolipin TRP cation channel 1

AlphaFold DB , UniProt , Accession A0A087XYD1, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 566 aa.

Structure Viewer

Loading PAE data...

(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	30.8	Very low	26.7	Very low	250 Å²	250	139.5 Å²	139.5	100%	1.232	84%	0.842	S	S	*	*				0	110.5	0	-70	174.6	169.7	0	0	106.5
2	A	29.5	Very low	26.5	Very low	106 Å²	106	134.5 Å²	134.5	88%	0.876	82%	0.817	S	S	*	*			cis	-140.4	143	7.9	0	0	0	0	0	108.8
3	S	25.4	Very low	26.8	Very low	124 Å²	124	132.1 Å²	132.1	87%	0.867	81%	0.806	S	S	*	*			trans	-85	142.6	173.9	62.4	0	0	0	0	111
4	S	25.8	Very low	26.9	Very low	116 Å²	116	126.9 Å²	126.9	81%	0.811	78%	0.783	S	S	*	*			trans	-156.9	103.8	160.3	167.8	0	0	0	0	105
5	G	24.4	Very low	27	Very low	60 Å²	60	129.3 Å²	129.3	62%	0.619	78%	0.782	S	S	*	*				99.8	71.4	60	0	0	0	0	0	107.6	T7	G5-T7 PolarHBondContact O-N 3.1Å
6	Y	22.7	Very low	27.1	Very low	239 Å²	239	131.9 Å²	131.9	94%	0.937	78%	0.779	S	S	*	*			trans	-75.6	100.7	171	-86.4	-85	0	0	0	108.4
7	T	24.9	Very low	27.2	Very low	123 Å²	123	132.6 Å²	132.6	76%	0.755	77%	0.773	S	S	*	*			trans	-97.6	109.4	166.6	29.8	0	0	0	0	108.9	G5 V9	G5-T7 PolarHBondContact O-N 3.1Å; T7-V9 PolarHBondContact O-N 2.98Å
8	C	25.9	Very low	27.2	Very low	134 Å²	134	135 Å²	135	91%	0.905	77%	0.773	S	S	*	*			trans	-66.7	118.9	160	-71.9	0	0	0	0	108.4
9	V	26.3	Very low	27.2	Very low	128 Å²	128	136.3 Å²	136.3	78%	0.776	78%	0.776	S	S	*	*			trans	-106	129	165.4	178.1	0	0	0	0	107.5	T7	T7-V9 PolarHBondContact O-N 2.98Å
10	P	34.1	Very low	27.2	Very low	101 Å²	101	137.4 Å²	137.4	66%	0.656	78%	0.778	S	S	*	*			trans	-85.7	168.9	176	35.6	-31.9	0	0	0	111.7
11	D	24.2	Very low	27.4	Very low	154 Å²	154	134.9 Å²	134.9	82%	0.824	77%	0.77	S	S	*	*			trans	82.2	128.1	171.4	-60.9	-31	0	0	0	116.8
12	S	24.3	Very low	27.1	Very low	79 Å²	79	128.4 Å²	128.4	55%	0.552	75%	0.749	S	S	*	*				-155.8	148.3	58.3	164.8	0	0	0	0	113.8	A14	S12-A14 PolarHBondContact O-N 3.26Å; S12-A14 VanDerWaalsContact O-N 3.1Å; S12-A14 VanDerWaalsContact OG-CB 3.23Å; S12-A14 WeakPolarHBondContact OG-CB 3.24Å; S12-A14 PolarHBondContact OG-N 3.13Å
13	P	30.9	Very low	27.1	Very low	103 Å²	103	132.1 Å²	132.1	67%	0.669	75%	0.745	S	S	*	*	T	Hydrogen-bonded Turn	trans	-64.4	-7.5	170.6	3.3	5.2	0	0	0	114.2	E15	P13-E15 PolarHBondContact O-N 3.5Å
14	A	27.8	Very low	27.2	Very low	59 Å²	59	130.6 Å²	130.6	49%	0.488	74%	0.735	S	S	.	*	H	α-helix	trans	-72.9	-24.9	-176.7	0	0	0	0	0	114	S12 Q17 K18	S12-A14 PolarHBondContact O-N 3.26Å; S12-A14 VanDerWaalsContact O-N 3.1Å; S12-A14 VanDerWaalsContact OG-CB 3.23Å; S12-A14 WeakPolarHBondContact OG-CB 3.24Å; S12-A14 PolarHBondContact OG-N 3.13Å; A14-Q17 PolarHBondContact O-N 3.01Å; A14-K18 PolarHBondContact O-N 2.83Å
15	E	27.6	Very low	27.2	Very low	163 Å²	163	127.7 Å²	127.7	76%	0.762	72%	0.723	S	S	*	*	H	α-helix	trans	-80	-30.9	-177.8	-123.5	-179.2	176.6	0	0	112.9	P13 Q17 K18	P13-E15 PolarHBondContact O-N 3.5Å; E15-Q17 VanDerWaalsContact C-N 3.28Å; E15-Q17 PolarHBondContact O-N 2.99Å; E15-K18 PolarHBondContact O-N 3.18Å
16	K	29.2	Very low	27.8	Very low	171 Å²	171	133.8 Å²	133.8	74%	0.743	73%	0.729	S	S	*	*	H	α-helix	trans	-71.8	-22.4	172.1	-79.2	-176.3	176.4	176.9	0	112.9
17	Q	28	Very low	27.9	Very low	144 Å²	144	125.1 Å²	125.1	67%	0.673	71%	0.712	S	S	*	*	H	α-helix	trans	-83.9	-20.4	179.1	-132.8	165.6	-0.7	0	0	113.1	A14 E15	A14-Q17 PolarHBondContact O-N 3.01Å; E15-Q17 VanDerWaalsContact C-N 3.28Å; E15-Q17 PolarHBondContact O-N 2.99Å
18	K	27.2	Very low	28	Very low	176 Å²	176	124.6 Å²	124.6	77%	0.765	71%	0.713	S	S	*	*	H	α-helix	trans	-79.9	-19.1	175.7	-121.3	177.3	-178.3	179	0	114.2	A14 E15	A14-K18 PolarHBondContact O-N 2.83Å; E15-K18 PolarHBondContact O-N 3.18Å
19	L	27.8	Very low	28	Very low	159 Å²	159	127 Å²	127	83%	0.832	71%	0.711	S	S	*	*	S	Bend	trans	-90.4	-8.6	175.6	-80.9	159.9	0	0	0	113.7
20	L	27.1	Very low	28	Very low	158 Å²	158	128 Å²	128	83%	0.827	71%	0.712	S	S	*	*	S	Bend	trans	-108.3	0.5	178.6	-75.1	167.4	0	0	0	113.8
21	S	32.1	Very low	27.6	Very low	86 Å²	86	129.9 Å²	129.9	60%	0.601	72%	0.722	S	S	*	*			trans	-130.4	104.5	171.1	80.7	0	0	0	0	111.6
22	S	24.8	Very low	27.8	Very low	113 Å²	113	130.5 Å²	130.5	79%	0.79	72%	0.724	S	S	*	*			trans	-154.5	88.3	158.5	-172.2	0	0	0	0	106.9
23	K	29.1	Very low	27.8	Very low	184 Å²	184	130.4 Å²	130.4	80%	0.8	74%	0.735	S	S	*	*				48.7	67.5	89.4	-95.6	-168.2	176	-172.1	0	113.5
24	S	26.9	Very low	27.3	Very low	93 Å²	93	132.1 Å²	132.1	65%	0.65	75%	0.748	S	S	*	*			trans	-122.8	48.5	130.8	62.6	0	0	0	0	109.7
25	G	25.9	Very low	27.3	Very low	54 Å²	54	133.2 Å²	133.2	56%	0.557	76%	0.757	S	S	*	*	S	Bend	trans	-97	121	156.4	0	0	0	0	0	106.6	G27	G25-G27 PolarHBondContact O-N 2.91Å
26	Y	37.1	Very low	27.3	Very low	189 Å²	189	130.7 Å²	130.7	74%	0.741	76%	0.758	S	S	*	*			trans	-53.1	109.6	171.6	-77.3	-91.1	0	0	0	108.7
27	G	24.8	Very low	27.1	Very low	56 Å²	56	130.9 Å²	130.9	58%	0.577	77%	0.766	S	S	*	*			trans	-149.2	109.5	-174	0	0	0	0	0	109.9	G25	G25-G27 PolarHBondContact O-N 2.91Å
28	S	27.2	Very low	27.3	Very low	112 Å²	112	128.7 Å²	128.7	78%	0.783	77%	0.773	S	S	*	*	P	Polyproline II helix	trans	-46.8	142.3	179.7	-150.8	0	0	0	0	113.9
29	Q	26	Very low	27.2	Very low	184 Å²	184	128.1 Å²	128.1	86%	0.86	78%	0.778	S	S	*	*	P	Polyproline II helix	trans	-89.4	126.5	160.1	-106.3	175.4	-17.7	0	0	108.3	V31	Q29-V31 PolarHBondContact O-N 2.81Å
30	D	25.1	Very low	27.4	Very low	151 Å²	151	125 Å²	125	81%	0.807	77%	0.769	S	S	*	*	P	Polyproline II helix	trans	-67.8	123.5	174.1	-69.6	-45.9	0	0	0	110.7
31	V	27.1	Very low	27.6	Very low	140 Å²	140	126 Å²	126	85%	0.848	77%	0.77	S	S	*	*			trans	-112.6	111.6	160.3	177.9	0	0	0	0	107.3	Q29	Q29-V31 PolarHBondContact O-N 2.81Å
32	L	27.8	Very low	27.5	Very low	167 Å²	167	130.8 Å²	130.8	87%	0.874	78%	0.78	S	S	*	*			trans	-73.3	127.9	172.9	-97.2	107.2	0	0	0	111.2
33	G	23.5	Very low	27.8	Very low	77 Å²	77	135.3 Å²	135.3	79%	0.794	78%	0.78	S	S	*	*			trans	100.7	107.5	134.5	0	0	0	0	0	118.6
34	C	22.3	Very low	28	Very low	138 Å²	138	130.3 Å²	130.3	93%	0.932	78%	0.78	S	S	*	*				-161.9	142.9	117.1	-152.5	0	0	0	0	110.8
35	A	25.9	Very low	28.5	Very low	83 Å²	83	132.8 Å²	132.8	69%	0.686	78%	0.781	S	S	*	*			trans	-87.9	147.5	-171	0	0	0	0	0	113.6
36	S	27.7	Very low	29.4	Very low	110 Å²	110	133.6 Å²	133.6	77%	0.769	78%	0.777	S	S	*	*			trans	41.4	121	147.2	62.9	0	0	0	0	120.3
37	L	25.3	Very low	29.9	Very low	174 Å²	174	131.9 Å²	131.9	91%	0.911	78%	0.776	S	S	*	*				-153.6	112.1	121.7	-102	154.4	0	0	0	108
38	A	33.4	Very low	31.3	Very low	99 Å²	99	134.9 Å²	134.9	82%	0.818	78%	0.779	S	S	*	*			trans	-69.3	128.2	169.5	0	0	0	0	0	108.3
39	D	24.8	Very low	32.7	Very low	163 Å²	163	134.5 Å²	134.5	87%	0.872	76%	0.764	S	S	*	*			trans	-131.6	118.1	150.7	-151.6	1.7	0	0	0	108.7
40	S	32.5	Very low	34.7	Very low	94 Å²	94	130.3 Å²	130.3	66%	0.657	75%	0.748	S	S	*	*			trans	-100.4	111.5	-176.1	49.6	0	0	0	0	107.9
41	Q	31.3	Very low	37.1	Very low	179 Å²	179	129.1 Å²	129.1	84%	0.836	74%	0.737	S	S	*	*			trans	157.6	109.5	144.1	-89.7	166	14.6	0	0	109.5
42	F	28.2	Very low	39.5	Very low	187 Å²	187	128 Å²	128	82%	0.82	72%	0.723	S	S	*	*				177.7	127	124.2	-116.3	-101.3	0	0	0	112
43	R	31.6	Very low	42.1	Very low	208 Å²	208	122.1 Å²	122.1	79%	0.785	69%	0.691	S	S	*	*			trans	68.3	102.7	152.7	-109.5	171	179.6	171.4	-1.5	119.4	Q45 P46	R43-Q45 PolarHBondContact O-N 3.45Å; R43-Q45 VanDerWaalsContact O-N 3.1Å; R43-P46 VanDerWaalsContact O-CD 3.24Å; R43-P46 WeakPolarHBondContact O-CD 3.39Å
44	G	34.6	Very low	44.8	Very low	78 Å²	78	122.7 Å²	122.7	80%	0.804	67%	0.673	S	S	*	*	S	Bend	trans	-79.4	79.2	175.4	0	0	0	0	0	114.5
45	Q	36.6	Very low	47.7	Very low	145 Å²	145	118.1 Å²	118.1	68%	0.678	65%	0.645	S	S	*	*	S	Bend	trans	-130.5	-17.1	159.2	-92.9	178.4	-42.7	0	0	115.5	R43	R43-Q45 PolarHBondContact O-N 3.45Å; R43-Q45 VanDerWaalsContact O-N 3.1Å
46	P	44.4	Very low	50.4	Low	71 Å²	71	114.4 Å²	114.4	46%	0.461	61%	0.614	S	S	.	*	H	α-helix	trans	-81.8	-18	-177.7	30	-31.3	0	0	0	114.6	R43 E49 D50	R43-P46 VanDerWaalsContact O-CD 3.24Å; R43-P46 WeakPolarHBondContact O-CD 3.39Å; P46-E49 PolarHBondContact O-N 3.16Å; P46-D50 PolarHBondContact O-N 3.34Å; P46-D50 VanDerWaalsContact O-N 3.13Å
47	Q	48.4	Very low	53.1	Low	153 Å²	153	111 Å²	111	72%	0.715	58%	0.584	S	S	*	*	H	α-helix	trans	-71.1	-43.3	-174.4	-106.7	177.3	-25.6	0	0	113.7	E49 E51	Q47-E49 VanDerWaalsContact C-N 3.31Å; Q47-E51 WeakPolarHBondContact O-CG 3.47Å; Q47-E51 PolarHBondContact O-N 3.34Å
48	D	53.9	Low	55.8	Low	120 Å²	120	105.8 Å²	105.8	64%	0.642	55%	0.552	S	S	*	*	H	α-helix	trans	-71	-29.8	177.4	-70.9	-30.5	0	0	0	111.6	E52	D48-E52 PolarHBondContact O-N 3.34Å
49	E	56.1	Low	58.3	Low	103 Å²	103	105.8 Å²	105.8	48%	0.481	53%	0.534	S	S	.	.	H	α-helix	trans	-73.5	-41.4	-178.6	-67.9	-176	158.3	0	0	112.6	P46 Q47 E51 E53	P46-E49 PolarHBondContact O-N 3.16Å; Q47-E49 VanDerWaalsContact C-N 3.31Å; E49-E51 VanDerWaalsContact C-N 3.34Å; E49-E53 PolarHBondContact O-N 3.16Å
50	D	67.3	Low	61.1	Low	96 Å²	96	98 Å²	98	51%	0.513	49%	0.493	S	S	.	.	H	α-helix	trans	-66.9	-35.8	173.6	-74.5	-27.1	0	0	0	111.3	P46 E53 E54	P46-D50 PolarHBondContact O-N 3.34Å; P46-D50 VanDerWaalsContact O-N 3.13Å; D50-E53 PolarHBondContact O-N 2.71Å; D50-E54 WeakPolarHBondContact O-CB 3.47Å; D50-E54 WeakPolarHBondContact O-CG 3.08Å; D50-E54 PolarHBondContact O-N 3.49Å
51	E	75.6	Confident	63.5	Low	126 Å²	126	95.2 Å²	95.2	59%	0.589	47%	0.468	S	S	*	.	H	α-helix	trans	-66.8	-41.1	178.2	-81.5	-171.1	-178.7	0	0	113.1	Q47 E49 A55	Q47-E51 WeakPolarHBondContact O-CG 3.47Å; Q47-E51 PolarHBondContact O-N 3.34Å; E49-E51 VanDerWaalsContact C-N 3.34Å; E51-A55 VanDerWaalsContact O-CB 3.24Å; E51-A55 WeakPolarHBondContact O-CB 3.24Å; E51-A55 PolarHBondContact O-N 2.7Å
52	E	78.6	Confident	66.1	Low	116 Å²	116	89.5 Å²	89.5	54%	0.542	44%	0.44	S	S	.	.	H	α-helix	trans	-62.8	-42.5	174.9	-77.3	-175.6	158.6	0	0	112.1	D48 A55 L56 K338	D48-E52 PolarHBondContact O-N 3.34Å; E52-A55 PolarHBondContact O-N 2.78Å; E52-L56 PolarHBondContact O-N 2.78Å; E52-K338 WeakPolarHBondContact OE2-CE 3.25Å; E52-K338 IonicContact OE2-NZ 3.78Å; E52-K338 PolarHBondContact OE2-NZ 3.1Å
53	E	81.4	Confident	68.8	Low	44 Å²	44	83.1 Å²	83.1	21%	0.206	41%	0.411	C	S	.	.	H	α-helix	trans	-67.2	-45.1	179.4	-172.5	170.2	-177.5	0	0	111.4	E49 D50 A55 L56 R57 F334 F538	E49-E53 PolarHBondContact O-N 3.16Å; D50-E53 PolarHBondContact O-N 2.71Å; E53-A55 VanDerWaalsContact C-N 3.32Å; E53-A55 PolarHBondContact O-N 3.19Å; E53-L56 PolarHBondContact O-N 2.8Å; E53-R57 VanDerWaalsContact CD-NH2 3.32Å; E53-R57 WeakPolarHBondContact O-CG 3.28Å; E53-R57 PolarHBondContact O-N 2.81Å; E53-R57 IonicContact OE1-CZ 3.14Å; E53-R57 IonicContact OE1-NE 3.56Å; E53-R57 IonicContact OE1-NH2 2.81Å; E53-R57 PolarHBondContact OE1-NH2 2.97Å; E53-F334 HydrophobicContact CB-CZ 3.93Å; E53-F334 HydrophobicContact CG-CE1 4.29Å; E53-F334 HydrophobicContact CG-CZ 3.89Å; E53-F538 HydrophobicContact CG-CE2 4.11Å; E53-F538 HydrophobicContact CG-CZ 3.98Å; E53-F538 VanDerWaalsContact OE1-CE2 3.28Å; E53-F538 WeakPolarHBondContact OE1-CE2 3.46Å
54	E	81.3	Confident	71.2	Confident	89 Å²	89	76.3 Å²	76.3	42%	0.416	39%	0.388	S	S	.	.	H	α-helix	trans	-61.1	-40.2	173.1	-78.3	-162.9	176.5	0	0	112.4	D50 R57 R58	D50-E54 WeakPolarHBondContact O-CB 3.47Å; D50-E54 WeakPolarHBondContact O-CG 3.08Å; D50-E54 PolarHBondContact O-N 3.49Å; E54-R57 PolarHBondContact O-N 3.46Å; E54-R58 WeakPolarHBondContact O-CB 3.34Å; E54-R58 WeakPolarHBondContact O-CG 3.48Å; E54-R58 PolarHBondContact O-N 2.91Å; E54-R58 IonicContact OE2-CZ 2.81Å; E54-R58 IonicContact OE2-NH1 3.39Å; E54-R58 IonicContact OE2-NH2 2.8Å; E54-R58 PolarHBondContact OE2-NH2 3.38Å
55	A	82	Confident	73.4	Confident	42 Å²	42	73.8 Å²	73.8	35%	0.347	36%	0.355	S	S	.	.	H	α-helix	trans	-63.3	-43.1	177.3	0	0	0	0	0	111.6	E51 E52 E53 R58 K59	E51-A55 VanDerWaalsContact O-CB 3.24Å; E51-A55 WeakPolarHBondContact O-CB 3.24Å; E51-A55 PolarHBondContact O-N 2.7Å; E52-A55 PolarHBondContact O-N 2.78Å; E53-A55 VanDerWaalsContact C-N 3.32Å; E53-A55 PolarHBondContact O-N 3.19Å; A55-R58 PolarHBondContact O-N 3Å; A55-K59 WeakPolarHBondContact O-CG 3.45Å; A55-K59 PolarHBondContact O-N 3.45Å
56	L	84	Confident	75.4	Confident	6 Å²	6	68.6 Å²	68.6	3%	0.031	34%	0.335	C	S	.	.	H	α-helix	trans	-64.4	-44.5	175.7	-176.2	62.3	0	0	0	111.4	E52 E53 R58 K59 L60 E330 F334	E52-L56 PolarHBondContact O-N 2.78Å; E53-L56 PolarHBondContact O-N 2.8Å; L56-R58 VanDerWaalsContact C-N 3.34Å; L56-R58 PolarHBondContact O-N 3.14Å; L56-K59 WeakPolarHBondContact O-CB 3.15Å; L56-K59 PolarHBondContact O-N 2.92Å; L56-L60 HydrophobicContact CD1-CD1 4.48Å; L56-L60 HydrophobicContact CD1-CG 4.48Å; L56-L60 HydrophobicContact CG-CD1 4.05Å; L56-L60 VanDerWaalsContact O-CG 3.32Å; L56-L60 WeakPolarHBondContact O-CG 3.43Å; L56-L60 PolarHBondContact O-N 3.19Å; L56-E330 HydrophobicContact CD1-CG 4.17Å; L56-F334 HydrophobicContact CD2-CB 3.7Å; L56-F334 HydrophobicContact CD2-CD1 3.53Å; L56-F334 HydrophobicContact CD2-CD2 3.9Å; L56-F334 HydrophobicContact CD2-CE1 4.11Å; L56-F334 HydrophobicContact CD2-CE2 4.42Å; L56-F334 HydrophobicContact CD2-CG 3.42Å; L56-F334 VanDerWaalsContact CD2-CG 3.42Å
57	R	83.6	Confident	77	Confident	38 Å²	38	66.9 Å²	66.9	14%	0.143	32%	0.324	C	S	.	.	H	α-helix	trans	-58.9	-42.9	175	-71.6	175.6	-174.7	164.7	-2.7	112	E53 E54 L60 K61 F538 Q541 C542	E53-R57 VanDerWaalsContact CD-NH2 3.32Å; E53-R57 WeakPolarHBondContact O-CG 3.28Å; E53-R57 PolarHBondContact O-N 2.81Å; E53-R57 IonicContact OE1-CZ 3.14Å; E53-R57 IonicContact OE1-NE 3.56Å; E53-R57 IonicContact OE1-NH2 2.81Å; E53-R57 PolarHBondContact OE1-NH2 2.97Å; E54-R57 PolarHBondContact O-N 3.46Å; R57-L60 PolarHBondContact O-N 3.36Å; R57-K61 VanDerWaalsContact O-CB 3.3Å; R57-K61 WeakPolarHBondContact O-CB 3.41Å; R57-K61 PolarHBondContact O-N 2.7Å; R57-F538 HydrophobicContact CG-CD1 3.93Å; R57-F538 HydrophobicContact CG-CE1 3.44Å; R57-F538 VanDerWaalsContact CG-CE1 3.44Å; R57-F538 HydrophobicContact CG-CE2 4.23Å; R57-F538 HydrophobicContact CG-CG 4.49Å; R57-F538 HydrophobicContact CG-CZ 3.62Å; R57-Q541 VanDerWaalsContact CZ-OE1 3.31Å; R57-C542 HydrophobicContact CB-CB 4.1Å
58	R	83.1	Confident	78.3	Confident	64 Å²	64	63 Å²	63	24%	0.242	31%	0.313	C	S	.	.	H	α-helix	trans	-62.8	-42.2	174.9	-74	176.7	-173.7	132	18.2	112.1	E54 A55 L56 Y62 D544 F551	E54-R58 WeakPolarHBondContact O-CB 3.34Å; E54-R58 WeakPolarHBondContact O-CG 3.48Å; E54-R58 PolarHBondContact O-N 2.91Å; E54-R58 IonicContact OE2-CZ 2.81Å; E54-R58 IonicContact OE2-NH1 3.39Å; E54-R58 IonicContact OE2-NH2 2.8Å; E54-R58 PolarHBondContact OE2-NH2 3.38Å; A55-R58 PolarHBondContact O-N 3Å; L56-R58 VanDerWaalsContact C-N 3.34Å; L56-R58 PolarHBondContact O-N 3.14Å; R58-Y62 VanDerWaalsContact O-CB 3.3Å; R58-Y62 WeakPolarHBondContact O-CB 3.42Å; R58-Y62 PolarHBondContact O-N 3.33Å; R58-D544 IonicContact CZ-OD2 3.61Å; R58-D544 IonicContact NE-OD2 3.86Å; R58-D544 PolarHBondContact NE-OD2 3.39Å; R58-D544 IonicContact NH2-OD2 2.64Å; R58-D544 PolarHBondContact NH2-OD2 3.46Å; R58-D544 VanDerWaalsContact NH2-OD2 3.14Å; R58-F551 HydrophobicContact CB-CE1 4.21Å; R58-F551 HydrophobicContact CG-CE1 4.39Å
59	K	84	Confident	79.5	Confident	100 Å²	100	60.3 Å²	60.3	44%	0.435	30%	0.298	S	S	.	.	H	α-helix	trans	-60.9	-46.3	175.2	-74.1	178.6	-173.9	178.2	0	111.5	A55 L56 Y62 F63 L327 E330	A55-K59 WeakPolarHBondContact O-CG 3.45Å; A55-K59 PolarHBondContact O-N 3.45Å; L56-K59 WeakPolarHBondContact O-CB 3.15Å; L56-K59 PolarHBondContact O-N 2.92Å; K59-Y62 PolarHBondContact O-N 3.39Å; K59-F63 PolarHBondContact O-N 2.95Å; K59-L327 HydrophobicContact CB-CD1 4.25Å; K59-E330 IonicContact NZ-OE1 3.68Å; K59-E330 PolarHBondContact NZ-OE1 2.95Å; K59-E330 IonicContact NZ-OE2 3.77Å
60	L	84.8	Confident	80.7	Confident	0 Å²	0	57.8 Å²	57.8	0%	0	29%	0.286	C	S	.	.	H	α-helix	trans	-64.3	-48.7	178.5	-69.6	166.7	0	0	0	111.7	L56 R57 Y62 F63 F64 L327 Y331 F351 F538 I539	L56-L60 HydrophobicContact CD1-CD1 4.48Å; L56-L60 HydrophobicContact CD1-CG 4.48Å; L56-L60 HydrophobicContact CG-CD1 4.05Å; L56-L60 VanDerWaalsContact O-CG 3.32Å; L56-L60 WeakPolarHBondContact O-CG 3.43Å; L56-L60 PolarHBondContact O-N 3.19Å; R57-L60 PolarHBondContact O-N 3.36Å; L60-Y62 VanDerWaalsContact C-N 3.3Å; L60-Y62 PolarHBondContact O-N 3.47Å; L60-F63 WeakPolarHBondContact O-CB 3.37Å; L60-F63 PolarHBondContact O-N 3.35Å; L60-F64 WeakPolarHBondContact O-CD2 3.32Å; L60-F64 PolarHBondContact O-N 3.44Å; L60-F64 VanDerWaalsContact O-N 3.12Å; L60-L327 HydrophobicContact CD2-CD1 4.37Å; L60-L327 HydrophobicContact CD2-CD2 4Å; L60-L327 HydrophobicContact CD2-CG 4.04Å; L60-Y331 HydrophobicContact CD1-CD2 3.79Å; L60-Y331 HydrophobicContact CD1-CE2 4.08Å; L60-Y331 HydrophobicContact CD2-CD2 4.31Å; L60-F351 HydrophobicContact CD2-CE1 3.52Å; L60-F351 HydrophobicContact CD2-CZ 3.75Å; L60-F538 HydrophobicContact CD1-CD1 3.84Å; L60-F538 HydrophobicContact CD1-CE1 3.7Å; L60-I539 HydrophobicContact CB-CD1 4.17Å; L60-I539 HydrophobicContact CB-CG1 3.92Å
61	K	83.5	Confident	81.3	Confident	35 Å²	35	58.2 Å²	58.2	15%	0.152	28%	0.281	C	S	.	.	H	α-helix	trans	-56.8	-46	176	-167.8	169.1	-175.7	179.9	0	111	R57 F63 F64 M65 I539 C542 D544 F551	R57-K61 VanDerWaalsContact O-CB 3.3Å; R57-K61 WeakPolarHBondContact O-CB 3.41Å; R57-K61 PolarHBondContact O-N 2.7Å; K61-F63 VanDerWaalsContact C-N 3.31Å; K61-F63 PolarHBondContact O-N 2.94Å; K61-F64 PolarHBondContact O-N 2.96Å; K61-M65 WeakPolarHBondContact O-CG 3.35Å; K61-M65 PolarHBondContact O-N 3.06Å; K61-M65 VanDerWaalsContact O-N 3.16Å; K61-I539 HydrophobicContact CB-CG2 3.91Å; K61-I539 HydrophobicContact CG-CG2 4.06Å; K61-C542 HydrophobicContact CD-CB 4.1Å; K61-C542 PolarHBondContact NZ-O 2.92Å; K61-D544 PolarHBondContact NZ-O 3.18Å; K61-F551 HydrophobicContact CD-CZ 4.25Å
62	Y	83.9	Confident	81.4	Confident	59 Å²	59	58.5 Å²	58.5	23%	0.231	28%	0.282	C	S	.	.	H	α-helix	trans	-62.3	-36.2	175	-177.1	-98.4	0	0	0	112.4	R58 K59 L60 K70 K74	R58-Y62 VanDerWaalsContact O-CB 3.3Å; R58-Y62 WeakPolarHBondContact O-CB 3.42Å; R58-Y62 PolarHBondContact O-N 3.33Å; K59-Y62 PolarHBondContact O-N 3.39Å; L60-Y62 VanDerWaalsContact C-N 3.3Å; L60-Y62 PolarHBondContact O-N 3.47Å; Y62-K70 HydrophobicContact CD2-CG 4.28Å; Y62-K70 HydrophobicContact CE2-CB 4.12Å; Y62-K70 HydrophobicContact CE2-CG 3.78Å; Y62-K70 WeakPolarHBondContact O-CE 3.19Å; Y62-K70 PolarHBondContact O-NZ 3.26Å; Y62-K74 HydrophobicContact CE2-CD 3.79Å; Y62-K74 HydrophobicContact CE2-CG 4.01Å
63	F	85.3	Confident	81.3	Confident	52 Å²	52	53 Å²	53	23%	0.228	26%	0.257	C	S	.	.	H	α-helix	trans	-64.9	-45.7	179.2	-178.4	-98.5	0	0	0	112.6	K59 L60 K61 K70 L327 F351	K59-F63 PolarHBondContact O-N 2.95Å; L60-F63 WeakPolarHBondContact O-CB 3.37Å; L60-F63 PolarHBondContact O-N 3.35Å; K61-F63 VanDerWaalsContact C-N 3.31Å; K61-F63 PolarHBondContact O-N 2.94Å; F63-K70 PolarHBondContact O-NZ 3.25Å; F63-L327 HydrophobicContact CB-CD2 3.59Å; F63-L327 HydrophobicContact CD1-CD2 4.18Å; F63-L327 HydrophobicContact CD2-CD2 3.9Å; F63-L327 HydrophobicContact CG-CD2 3.63Å; F63-F351 HydrophobicContact CE1-CD1 4.3Å
64	F	83.3	Confident	81	Confident	65 Å²	65	54.3 Å²	54.3	29%	0.285	26%	0.262	S	S	.	.	H	α-helix	trans	-82	-11.6	-177.2	-70	-72.2	0	0	0	114.9	L60 K61 E350 F351 L535 I539	L60-F64 WeakPolarHBondContact O-CD2 3.32Å; L60-F64 PolarHBondContact O-N 3.44Å; L60-F64 VanDerWaalsContact O-N 3.12Å; K61-F64 PolarHBondContact O-N 2.96Å; F64-E350 HydrophobicContact CE1-CG 4.02Å; F64-E350 HydrophobicContact CZ-CG 4.44Å; F64-F351 HydrophobicContact CE2-CE1 4.14Å; F64-F351 HydrophobicContact CE2-CZ 4.46Å; F64-F351 HydrophobicContact CZ-CD1 4.18Å; F64-F351 HydrophobicContact CZ-CE1 4.2Å; F64-F351 HydrophobicContact CZ-CG 4.47Å; F64-F351 HydrophobicContact CZ-CZ 4.5Å; F64-L535 HydrophobicContact CE2-CD2 4.05Å; F64-L535 HydrophobicContact CZ-CD2 3.94Å; F64-I539 HydrophobicContact CD2-CD1 3.67Å; F64-I539 HydrophobicContact CE2-CD1 3.98Å
65	M	80.1	Confident	80.5	Confident	26 Å²	26	52 Å²	52	13%	0.128	26%	0.262	C	S	.	.	S	Bend	trans	-60.2	149.5	175.3	-86.7	171.3	138.5	0	0	114.3	K61 D69 K70 P546	K61-M65 WeakPolarHBondContact O-CG 3.35Å; K61-M65 PolarHBondContact O-N 3.06Å; K61-M65 VanDerWaalsContact O-N 3.16Å; M65-D69 HydrophobicContact CB-CB 4.27Å; M65-D69 HydrophobicContact CE-CB 4.21Å; M65-D69 HydrophobicContact CG-CB 4.31Å; M65-K70 HydrophobicContact CB-CG 4.04Å; M65-K70 VanDerWaalsContact O-CE 3.26Å; M65-K70 WeakPolarHBondContact O-CE 3.2Å; M65-K70 PolarHBondContact O-NZ 3Å; M65-P546 HydrophobicContact CE-CB 3.6Å; M65-P546 HydrophobicContact CE-CG 3.47Å; M65-P546 VanDerWaalsContact CE-CG 3.47Å
66	S	78.6	Confident	80.2	Confident	35 Å²	35	57.4 Å²	57.4	25%	0.245	27%	0.273	C	S	.	.			trans	-64.2	155.7	173.1	83.3	0	0	0	0	111.3	C68 D69 K70	S66-C68 VanDerWaalsContact C-N 3.25Å; S66-C68 PolarHBondContact O-N 2.95Å; S66-D69 WeakPolarHBondContact CB-OD2 3.41Å; S66-D69 PolarHBondContact O-N 2.89Å; S66-D69 PolarHBondContact OG-N 3.38Å; S66-D69 PolarHBondContact OG-OD2 3.49Å; S66-K70 WeakPolarHBondContact O-CG 3.35Å; S66-K70 PolarHBondContact O-N 3.31Å
67	P	78.1	Confident	79.8	Confident	36 Å²	36	63.2 Å²	63.2	23%	0.234	30%	0.298	C	S	.	.	H	α-helix	trans	-59.8	-33.2	177.5	-25.2	36.1	0	0	0	113.9	K70 Y71 F408	P67-K70 PolarHBondContact O-N 3.37Å; P67-Y71 PolarHBondContact O-N 2.8Å; P67-Y71 VanDerWaalsContact O-N 3.07Å; P67-F408 HydrophobicContact CG-CE1 4.05Å; P67-F408 HydrophobicContact CG-CE2 4.26Å; P67-F408 HydrophobicContact CG-CZ 3.51Å
68	C	76.4	Confident	79.7	Confident	70 Å²	70	64.3 Å²	64.3	47%	0.473	31%	0.31	S	S	.	.	H	α-helix	trans	-67.5	-42.9	176.3	-61.1	0	0	0	0	110.9	S66 K70 Y71 H72	S66-C68 VanDerWaalsContact C-N 3.25Å; S66-C68 PolarHBondContact O-N 2.95Å; C68-K70 VanDerWaalsContact C-N 3.34Å; C68-K70 PolarHBondContact O-N 3.46Å; C68-Y71 WeakPolarHBondContact O-CB 3.4Å; C68-Y71 PolarHBondContact O-N 3.45Å; C68-H72 PolarHBondContact O-CD2 2.7Å; C68-H72 PolarHBondContact O-N 3.1Å
69	D	77.6	Confident	79.7	Confident	64 Å²	64	68.6 Å²	68.6	34%	0.342	33%	0.331	S	S	.	.	H	α-helix	trans	-67.1	-37.7	177.1	-56.8	-36.8	0	0	0	111.6	M65 S66 Y71 H72 A73	M65-D69 HydrophobicContact CB-CB 4.27Å; M65-D69 HydrophobicContact CE-CB 4.21Å; M65-D69 HydrophobicContact CG-CB 4.31Å; S66-D69 WeakPolarHBondContact CB-OD2 3.41Å; S66-D69 PolarHBondContact O-N 2.89Å; S66-D69 PolarHBondContact OG-N 3.38Å; S66-D69 PolarHBondContact OG-OD2 3.49Å; D69-Y71 VanDerWaalsContact C-N 3.28Å; D69-Y71 PolarHBondContact O-N 2.79Å; D69-H72 PolarHBondContact O-N 3.08Å; D69-A73 WeakPolarHBondContact O-CB 3.41Å; D69-A73 PolarHBondContact O-N 2.95Å
70	K	82	Confident	79.8	Confident	51 Å²	51	66.1 Å²	66.1	22%	0.222	32%	0.32	C	S	.	.	H	α-helix	trans	-60.9	-37	173.1	-75.7	170.9	171.3	149.6	0	112.4	Y62 F63 M65 S66 P67 C68 K74	Y62-K70 HydrophobicContact CD2-CG 4.28Å; Y62-K70 HydrophobicContact CE2-CB 4.12Å; Y62-K70 HydrophobicContact CE2-CG 3.78Å; Y62-K70 WeakPolarHBondContact O-CE 3.19Å; Y62-K70 PolarHBondContact O-NZ 3.26Å; F63-K70 PolarHBondContact O-NZ 3.25Å; M65-K70 HydrophobicContact CB-CG 4.04Å; M65-K70 VanDerWaalsContact O-CE 3.26Å; M65-K70 WeakPolarHBondContact O-CE 3.2Å; M65-K70 PolarHBondContact O-NZ 3Å; S66-K70 WeakPolarHBondContact O-CG 3.35Å; S66-K70 PolarHBondContact O-N 3.31Å; P67-K70 PolarHBondContact O-N 3.37Å; C68-K70 VanDerWaalsContact C-N 3.34Å; C68-K70 PolarHBondContact O-N 3.46Å; K70-K74 PolarHBondContact O-N 3.11Å; K70-K74 VanDerWaalsContact O-N 3.1Å
71	Y	80.2	Confident	79.8	Confident	105 Å²	105	68.3 Å²	68.3	41%	0.412	33%	0.332	S	S	.	.	H	α-helix	trans	-66.7	-46.6	174.3	177.2	-108.4	0	0	0	111.1	P67 C68 D69 A73 G75 R76	P67-Y71 PolarHBondContact O-N 2.8Å; P67-Y71 VanDerWaalsContact O-N 3.07Å; C68-Y71 WeakPolarHBondContact O-CB 3.4Å; C68-Y71 PolarHBondContact O-N 3.45Å; D69-Y71 VanDerWaalsContact C-N 3.28Å; D69-Y71 PolarHBondContact O-N 2.79Å; Y71-A73 VanDerWaalsContact C-N 3.29Å; Y71-A73 PolarHBondContact O-N 3.48Å; Y71-G75 WeakPolarHBondContact O-CA 3.3Å; Y71-G75 PolarHBondContact O-N 3.37Å; Y71-R76 WeakPolarHBondContact CD2-O 3.5Å
72	H	76.7	Confident	80	Confident	131 Å²	131	68.5 Å²	68.5	61%	0.606	34%	0.344	S	S	*	.	H	α-helix	trans	-61.5	-36.4	175.4	-81.6	-72.9	0	0	0	112.8	C68 D69	C68-H72 PolarHBondContact O-CD2 2.7Å; C68-H72 PolarHBondContact O-N 3.1Å; D69-H72 PolarHBondContact O-N 3.08Å
73	A	76.6	Confident	80.3	Confident	2 Å²	2	67.1 Å²	67.1	2%	0.017	34%	0.34	C	S	.	.	H	α-helix	trans	-72.9	-47.7	-178.6	0	0	0	0	0	114.4	D69 Y71 P546 F551 R552	D69-A73 WeakPolarHBondContact O-CB 3.41Å; D69-A73 PolarHBondContact O-N 2.95Å; Y71-A73 VanDerWaalsContact C-N 3.29Å; Y71-A73 PolarHBondContact O-N 3.48Å; A73-P546 WeakPolarHBondContact CA-O 3.43Å; A73-P546 HydrophobicContact CB-CB 4.38Å; A73-P546 WeakPolarHBondContact CB-O 3.45Å; A73-F551 HydrophobicContact CB-CB 4.23Å; A73-F551 HydrophobicContact CB-CD2 4.38Å; A73-F551 HydrophobicContact CB-CG 4.39Å; A73-R552 PolarHBondContact O-NE 2.71Å
74	K	76.7	Confident	80.5	Confident	70 Å²	70	64.8 Å²	64.8	30%	0.304	33%	0.33	S	S	.	.	H	α-helix	trans	-110	-8	-174.6	-73.7	-168	175.9	-178.5	0	115.1	Y62 K70 R76 F551	Y62-K74 HydrophobicContact CE2-CD 3.79Å; Y62-K74 HydrophobicContact CE2-CG 4.01Å; K70-K74 PolarHBondContact O-N 3.11Å; K70-K74 VanDerWaalsContact O-N 3.1Å; K74-R76 HydrophobicContact CB-CG 4.26Å; K74-R76 PolarHBondContact O-N 2.99Å; K74-R76 VanDerWaalsContact O-N 3.16Å; K74-F551 WeakPolarHBondContact CE-O 3.42Å
75	G	69.3	Low	80.9	Confident	41 Å²	41	65.9 Å²	65.9	42%	0.423	34%	0.339	S	S	.	.			trans	68	5.8	-176.3	0	0	0	0	0	115.1	Y71 K77	Y71-G75 WeakPolarHBondContact O-CA 3.3Å; Y71-G75 PolarHBondContact O-N 3.37Å; G75-K77 PolarHBondContact O-N 2.9Å
76	R	75.5	Confident	81.5	Confident	155 Å²	155	68.5 Å²	68.5	59%	0.585	35%	0.353	S	S	*	.			trans	-78.9	117.2	-178.3	-68.5	-174.3	-177.6	-172.9	-0.4	110.8	Y71 K74	Y71-R76 WeakPolarHBondContact CD2-O 3.5Å; K74-R76 HydrophobicContact CB-CG 4.26Å; K74-R76 PolarHBondContact O-N 2.99Å; K74-R76 VanDerWaalsContact O-N 3.16Å
77	K	77.5	Confident	82.2	Confident	129 Å²	129	66.9 Å²	66.9	56%	0.561	34%	0.341	S	S	*	.			trans	-50.6	134.5	178.3	-67.4	-174.4	-179.5	-177.6	0	111.4	G75 F79	G75-K77 PolarHBondContact O-N 2.9Å; K77-F79 HydrophobicContact CB-CD2 4.08Å; K77-F79 HydrophobicContact CB-CE2 3.77Å; K77-F79 HydrophobicContact CB-CZ 4.36Å; K77-F79 VanDerWaalsContact O-CD2 3.3Å; K77-F79 WeakPolarHBondContact O-CD2 3.27Å; K77-F79 PolarHBondContact O-N 3.45Å
78	P	81.3	Confident	82.9	Confident	61 Å²	61	66 Å²	66	40%	0.396	34%	0.335	S	S	.	.			trans	-79.9	63.7	-174.1	33.8	-37.1	0	0	0	112.3	K80 L81 G82	P78-K80 PolarHBondContact O-N 3.31Å; P78-K80 VanDerWaalsContact O-N 3.14Å; P78-L81 HydrophobicContact CB-CB 4.21Å; P78-L81 PolarHBondContact O-N 2.94Å; P78-G82 PolarHBondContact O-N 3.44Å
79	F	82.3	Confident	83.8	Confident	154 Å²	154	68 Å²	68	68%	0.675	34%	0.339	S	S	*	.	H	α-helix	trans	-52.9	-36.8	-179.6	-75.7	-80.5	0	0	0	113.2	K77 L81 G82 L83	K77-F79 HydrophobicContact CB-CD2 4.08Å; K77-F79 HydrophobicContact CB-CE2 3.77Å; K77-F79 HydrophobicContact CB-CZ 4.36Å; K77-F79 VanDerWaalsContact O-CD2 3.3Å; K77-F79 WeakPolarHBondContact O-CD2 3.27Å; K77-F79 PolarHBondContact O-N 3.45Å; F79-L81 VanDerWaalsContact C-N 3.34Å; F79-L81 PolarHBondContact O-N 3.18Å; F79-G82 PolarHBondContact O-N 2.98Å; F79-L83 WeakPolarHBondContact O-CB 3.32Å; F79-L83 PolarHBondContact O-N 2.93Å
80	K	85.8	Confident	84.6	Confident	48 Å²	48	65.8 Å²	65.8	21%	0.209	33%	0.327	C	S	.	.	H	α-helix	trans	-60.9	-40.8	177	-174.6	174.9	-175.5	173.5	0	112.6	P78 Q84 S320 Y356	P78-K80 PolarHBondContact O-N 3.31Å; P78-K80 VanDerWaalsContact O-N 3.14Å; K80-Q84 WeakPolarHBondContact O-CG 3.48Å; K80-Q84 PolarHBondContact O-N 3.48Å; K80-S320 PolarHBondContact NZ-OG 3.37Å; K80-Y356 PolarHBondContact NZ-OH 3.19Å
81	L	85.8	Confident	85.2	Confident	45 Å²	45	63.4 Å²	63.4	24%	0.236	32%	0.317	C	S	.	.	H	α-helix	trans	-68.3	-45.5	178.3	-178.3	65.9	0	0	0	110.3	P78 F79 L83 Q84 L85 Y405	P78-L81 HydrophobicContact CB-CB 4.21Å; P78-L81 PolarHBondContact O-N 2.94Å; F79-L81 VanDerWaalsContact C-N 3.34Å; F79-L81 PolarHBondContact O-N 3.18Å; L81-L83 PolarHBondContact O-N 3.31Å; L81-Q84 PolarHBondContact O-N 3.37Å; L81-L85 HydrophobicContact CG-CD1 4.34Å; L81-L85 WeakPolarHBondContact O-CG 3.46Å; L81-L85 PolarHBondContact O-N 2.99Å; L81-Y405 HydrophobicContact CD1-CD1 3.54Å; L81-Y405 HydrophobicContact CD1-CE1 3.23Å; L81-Y405 HydrophobicContact CD1-CG 4.44Å
82	G	87.6	Confident	86	Confident	40 Å²	40	60.1 Å²	60.1	41%	0.412	31%	0.308	S	S	.	.	H	α-helix	trans	-59.5	-44.1	176.6	0	0	0	0	0	112.8	P78 F79 Q84 L85 L86	P78-G82 PolarHBondContact O-N 3.44Å; F79-G82 PolarHBondContact O-N 2.98Å; G82-Q84 VanDerWaalsContact C-N 3.34Å; G82-Q84 PolarHBondContact O-N 2.87Å; G82-L85 PolarHBondContact O-N 3.41Å; G82-L86 WeakPolarHBondContact O-CB 3.3Å; G82-L86 PolarHBondContact O-N 2.97Å
83	L	89.8	Confident	86.8	Confident	29 Å²	29	56.9 Å²	56.9	15%	0.152	30%	0.297	C	S	.	.	H	α-helix	trans	-62.2	-39.8	177.6	-171.6	72.3	0	0	0	112.1	F79 L81 L86 K87 V309 L312 L316	F79-L83 WeakPolarHBondContact O-CB 3.32Å; F79-L83 PolarHBondContact O-N 2.93Å; L81-L83 PolarHBondContact O-N 3.31Å; L83-L86 PolarHBondContact O-N 3.36Å; L83-K87 WeakPolarHBondContact O-CB 3.26Å; L83-K87 PolarHBondContact O-N 3.19Å; L83-V309 HydrophobicContact CD1-CG1 4Å; L83-V309 HydrophobicContact CG-CG1 4.49Å; L83-L312 HydrophobicContact CD2-CB 3.92Å; L83-L316 HydrophobicContact CD2-CD1 3.67Å
84	Q	90.4	Very high	87.7	Confident	3 Å²	3	56.8 Å²	56.8	1%	0.014	30%	0.296	C	S	.	.	H	α-helix	trans	-70.6	-38.9	178.9	-66	-66.9	-21.8	0	0	112.2	K80 L81 G82 L86 K87 I88 S313 Y405	K80-Q84 WeakPolarHBondContact O-CG 3.48Å; K80-Q84 PolarHBondContact O-N 3.48Å; L81-Q84 PolarHBondContact O-N 3.37Å; G82-Q84 VanDerWaalsContact C-N 3.34Å; G82-Q84 PolarHBondContact O-N 2.87Å; Q84-L86 VanDerWaalsContact C-N 3.35Å; Q84-K87 WeakPolarHBondContact O-CB 3.47Å; Q84-K87 PolarHBondContact O-N 2.98Å; Q84-I88 WeakPolarHBondContact O-CD1 3.36Å; Q84-I88 VanDerWaalsContact O-CG1 3.31Å; Q84-I88 WeakPolarHBondContact O-CG1 3.47Å; Q84-I88 PolarHBondContact O-N 3.37Å; Q84-S313 PolarHBondContact NE2-OG 3.01Å; Q84-Y405 WeakPolarHBondContact CB-OH 3.42Å; Q84-Y405 VanDerWaalsContact CG-OH 3.29Å; Q84-Y405 WeakPolarHBondContact CG-OH 3.37Å
85	L	90.4	Very high	88.5	Confident	89 Å²	89	55.8 Å²	55.8	47%	0.466	29%	0.294	S	S	.	.	H	α-helix	trans	-62.4	-43.7	172.9	-71.2	172	0	0	0	111.3	L81 G82 K87 I88 I89	L81-L85 HydrophobicContact CG-CD1 4.34Å; L81-L85 WeakPolarHBondContact O-CG 3.46Å; L81-L85 PolarHBondContact O-N 2.99Å; G82-L85 PolarHBondContact O-N 3.41Å; L85-K87 VanDerWaalsContact C-N 3.34Å; L85-K87 PolarHBondContact O-N 2.91Å; L85-I88 HydrophobicContact CD2-CD1 4.4Å; L85-I88 PolarHBondContact O-N 2.94Å; L85-I89 PolarHBondContact O-N 2.85Å
86	L	92.2	Very high	89.6	Confident	81 Å²	81	57.8 Å²	57.8	42%	0.424	30%	0.298	S	S	.	.	H	α-helix	trans	-60.4	-44.5	173.9	-178.3	64.1	0	0	0	111.4	G82 L83 Q84 I88 I89 I90	G82-L86 WeakPolarHBondContact O-CB 3.3Å; G82-L86 PolarHBondContact O-N 2.97Å; L83-L86 PolarHBondContact O-N 3.36Å; Q84-L86 VanDerWaalsContact C-N 3.35Å; L86-I88 PolarHBondContact O-N 3.41Å; L86-I89 PolarHBondContact O-N 3.33Å; L86-I90 HydrophobicContact CD1-CD1 3.73Å; L86-I90 HydrophobicContact CD1-CG1 4.09Å; L86-I90 HydrophobicContact CD2-CD1 4.18Å; L86-I90 HydrophobicContact CG-CD1 3.64Å; L86-I90 HydrophobicContact CG-CG1 4.28Å; L86-I90 WeakPolarHBondContact O-CB 3.3Å; L86-I90 WeakPolarHBondContact O-CG1 3.47Å; L86-I90 PolarHBondContact O-N 2.94Å
87	K	93.8	Very high	90.3	Very high	1 Å²	1	53.5 Å²	53.5	0%	0.004	29%	0.286	C	S	.	.	H	α-helix	trans	-57.6	-45.9	177.4	-171.6	-173.2	79.7	175.9	0	112	L83 Q84 L85 I89 I90 V91 V309 D363	L83-K87 WeakPolarHBondContact O-CB 3.26Å; L83-K87 PolarHBondContact O-N 3.19Å; Q84-K87 WeakPolarHBondContact O-CB 3.47Å; Q84-K87 PolarHBondContact O-N 2.98Å; L85-K87 VanDerWaalsContact C-N 3.34Å; L85-K87 PolarHBondContact O-N 2.91Å; K87-I89 VanDerWaalsContact C-N 3.28Å; K87-I89 PolarHBondContact O-N 3.18Å; K87-I90 PolarHBondContact O-N 3.44Å; K87-V91 HydrophobicContact CG-CG2 3.9Å; K87-V91 WeakPolarHBondContact O-CB 3.5Å; K87-V91 VanDerWaalsContact O-CG2 3.28Å; K87-V91 WeakPolarHBondContact O-CG2 3.36Å; K87-V91 PolarHBondContact O-N 3.34Å; K87-V309 HydrophobicContact CB-CG1 4.05Å; K87-V309 HydrophobicContact CG-CG1 4.36Å; K87-D363 VanDerWaalsContact CD-OD1 3.29Å; K87-D363 WeakPolarHBondContact CD-OD1 3.48Å; K87-D363 WeakPolarHBondContact CE-OD1 3.44Å; K87-D363 IonicContact NZ-OD1 2.64Å; K87-D363 PolarHBondContact NZ-OD1 3.11Å; K87-D363 IonicContact NZ-OD2 3.39Å
88	I	94.1	Very high	90.9	Very high	18 Å²	18	47.9 Å²	47.9	9%	0.092	26%	0.262	C	S	.	.	H	α-helix	trans	-55.9	-46.4	178.9	-68.2	154.9	0	0	0	110.6	Q84 L85 L86 T92 V398 W399 V402 Y405	Q84-I88 WeakPolarHBondContact O-CD1 3.36Å; Q84-I88 VanDerWaalsContact O-CG1 3.31Å; Q84-I88 WeakPolarHBondContact O-CG1 3.47Å; Q84-I88 PolarHBondContact O-N 3.37Å; L85-I88 HydrophobicContact CD2-CD1 4.4Å; L85-I88 PolarHBondContact O-N 2.94Å; L86-I88 PolarHBondContact O-N 3.41Å; I88-T92 VanDerWaalsContact O-CB 3.27Å; I88-T92 WeakPolarHBondContact O-CB 3.28Å; I88-T92 PolarHBondContact O-N 3.17Å; I88-T92 VanDerWaalsContact O-N 3.13Å; I88-T92 PolarHBondContact O-OG1 3.45Å; I88-V398 HydrophobicContact CB-CG1 4.15Å; I88-V398 HydrophobicContact CG1-CG1 3.49Å; I88-V398 VanDerWaalsContact CG1-CG1 3.49Å; I88-W399 HydrophobicContact CG2-CZ2 4.29Å; I88-V402 HydrophobicContact CD1-CG2 3.69Å; I88-V402 HydrophobicContact CG1-CG2 4.28Å; I88-Y405 HydrophobicContact CD1-CE2 4.33Å
89	I	94.2	Very high	91.3	Very high	110 Å²	110	46.5 Å²	46.5	56%	0.564	26%	0.258	S	S	*	.	H	α-helix	trans	-65.7	-51.9	179.9	-62.2	169.9	0	0	0	110.2	L85 L86 K87 V91 T92 V93	L85-I89 PolarHBondContact O-N 2.85Å; L86-I89 PolarHBondContact O-N 3.33Å; K87-I89 VanDerWaalsContact C-N 3.28Å; K87-I89 PolarHBondContact O-N 3.18Å; I89-V91 PolarHBondContact O-N 3.08Å; I89-T92 PolarHBondContact O-N 3.43Å; I89-V93 HydrophobicContact CG2-CG2 4.4Å; I89-V93 WeakPolarHBondContact O-CG2 3.43Å; I89-V93 PolarHBondContact O-N 3.32Å
90	I	94.6	Very high	91.5	Very high	19 Å²	19	43.9 Å²	43.9	10%	0.097	25%	0.251	C	S	.	.	H	α-helix	trans	-62.4	-46.8	-175	-71.5	-179.6	0	0	0	111.6	L86 K87 T92 V93 Q94 F302 V306 V309	L86-I90 HydrophobicContact CD1-CD1 3.73Å; L86-I90 HydrophobicContact CD1-CG1 4.09Å; L86-I90 HydrophobicContact CD2-CD1 4.18Å; L86-I90 HydrophobicContact CG-CD1 3.64Å; L86-I90 HydrophobicContact CG-CG1 4.28Å; L86-I90 WeakPolarHBondContact O-CB 3.3Å; L86-I90 WeakPolarHBondContact O-CG1 3.47Å; L86-I90 PolarHBondContact O-N 2.94Å; K87-I90 PolarHBondContact O-N 3.44Å; I90-T92 VanDerWaalsContact C-N 3.33Å; I90-T92 PolarHBondContact O-N 2.88Å; I90-V93 PolarHBondContact O-N 2.61Å; I90-Q94 WeakPolarHBondContact O-CB 3.28Å; I90-Q94 PolarHBondContact O-N 3.02Å; I90-F302 HydrophobicContact CB-CZ 4.49Å; I90-F302 HydrophobicContact CG2-CE1 4.49Å; I90-F302 HydrophobicContact CG2-CE2 4.28Å; I90-F302 HydrophobicContact CG2-CZ 3.88Å; I90-V306 HydrophobicContact CG2-CB 3.87Å; I90-V306 HydrophobicContact CG2-CG1 3.96Å; I90-V306 HydrophobicContact CG2-CG2 3.2Å; I90-V309 HydrophobicContact CD1-CG2 4.23Å
91	V	95.5	Very high	91.4	Very high	1 Å²	1	43 Å²	43	1%	0.006	25%	0.25	C	S	.	.	H	α-helix	trans	-66.1	-37	179.3	176.3	0	0	0	0	111.3	K87 I89 Q94 L95 V306 T366	K87-V91 HydrophobicContact CG-CG2 3.9Å; K87-V91 WeakPolarHBondContact O-CB 3.5Å; K87-V91 VanDerWaalsContact O-CG2 3.28Å; K87-V91 WeakPolarHBondContact O-CG2 3.36Å; K87-V91 PolarHBondContact O-N 3.34Å; I89-V91 PolarHBondContact O-N 3.08Å; V91-Q94 WeakPolarHBondContact O-CB 3.3Å; V91-Q94 PolarHBondContact O-N 3.4Å; V91-L95 PolarHBondContact O-N 3.24Å; V91-V306 HydrophobicContact CG2-CG1 3.91Å; V91-T366 HydrophobicContact CG1-CG2 4.22Å; V91-T366 HydrophobicContact CG2-CG2 3.86Å
92	T	95.5	Very high	91.4	Very high	35 Å²	35	42.5 Å²	42.5	22%	0.215	25%	0.248	C	C	.	.	H	α-helix	trans	-66.8	-44.2	176.1	-56.6	0	0	0	0	111.2	I88 I89 I90 Q94 L95 V96 W399	I88-T92 VanDerWaalsContact O-CB 3.27Å; I88-T92 WeakPolarHBondContact O-CB 3.28Å; I88-T92 PolarHBondContact O-N 3.17Å; I88-T92 VanDerWaalsContact O-N 3.13Å; I88-T92 PolarHBondContact O-OG1 3.45Å; I89-T92 PolarHBondContact O-N 3.43Å; I90-T92 VanDerWaalsContact C-N 3.33Å; I90-T92 PolarHBondContact O-N 2.88Å; T92-Q94 VanDerWaalsContact C-N 3.31Å; T92-Q94 PolarHBondContact O-N 3.37Å; T92-L95 PolarHBondContact O-N 3.21Å; T92-V96 WeakPolarHBondContact O-CG2 3.25Å; T92-V96 PolarHBondContact O-N 2.85Å; T92-W399 HydrophobicContact CG2-CZ2 4.43Å; T92-W399 PolarHBondContact OG1-NE1 3.16Å
93	V	94.3	Very high	91.4	Very high	63 Å²	63	46.5 Å²	46.5	38%	0.382	26%	0.256	S	S	.	.	H	α-helix	trans	-62	-41.8	175.2	171.5	0	0	0	0	110.6	I89 I90 L95 V96 L97 F302	I89-V93 HydrophobicContact CG2-CG2 4.4Å; I89-V93 WeakPolarHBondContact O-CG2 3.43Å; I89-V93 PolarHBondContact O-N 3.32Å; I90-V93 PolarHBondContact O-N 2.61Å; V93-L95 VanDerWaalsContact C-N 3.35Å; V93-L95 PolarHBondContact O-N 3.01Å; V93-V96 PolarHBondContact O-N 3.07Å; V93-L97 HydrophobicContact CG1-CD1 3.94Å; V93-L97 HydrophobicContact CG1-CG 4.3Å; V93-L97 WeakPolarHBondContact O-CG 3.44Å; V93-L97 PolarHBondContact O-N 3.19Å; V93-F302 HydrophobicContact CB-CE1 4.46Å; V93-F302 HydrophobicContact CB-CZ 3.99Å; V93-F302 HydrophobicContact CG1-CE1 4.08Å; V93-F302 HydrophobicContact CG1-CE2 4.49Å; V93-F302 HydrophobicContact CG1-CZ 3.72Å
94	Q	94.3	Very high	91.2	Very high	1 Å²	1	46 Å²	46	1%	0.005	25%	0.253	C	S	.	.	H	α-helix	trans	-56.7	-48.4	175	-169.7	-173	33.8	0	0	111.7	I90 V91 T92 L97 F98 F302 D303 V306 S370 K373	I90-Q94 WeakPolarHBondContact O-CB 3.28Å; I90-Q94 PolarHBondContact O-N 3.02Å; V91-Q94 WeakPolarHBondContact O-CB 3.3Å; V91-Q94 PolarHBondContact O-N 3.4Å; T92-Q94 VanDerWaalsContact C-N 3.31Å; T92-Q94 PolarHBondContact O-N 3.37Å; Q94-L97 PolarHBondContact O-N 2.87Å; Q94-F98 WeakPolarHBondContact O-CB 3.35Å; Q94-F98 PolarHBondContact O-N 3.04Å; Q94-F302 HydrophobicContact CB-CE1 3.86Å; Q94-F302 HydrophobicContact CG-CE1 4.45Å; Q94-D303 VanDerWaalsContact CG-OD1 3.27Å; Q94-D303 WeakPolarHBondContact CG-OD1 3.35Å; Q94-D303 PolarHBondContact NE2-OD1 2.78Å; Q94-V306 HydrophobicContact CB-CG2 4.18Å; Q94-V306 HydrophobicContact CG-CG2 4.25Å; Q94-S370 PolarHBondContact NE2-OG 3.33Å; Q94-K373 HydrophobicContact CG-CD 4.43Å
95	L	94.8	Very high	91	Very high	48 Å²	48	46.7 Å²	46.7	25%	0.251	26%	0.258	S	S	.	.	H	α-helix	trans	-64	-41.9	179.7	-176.3	70.4	0	0	0	111.7	V91 T92 V93 F98 G99 L391 T395	V91-L95 PolarHBondContact O-N 3.24Å; T92-L95 PolarHBondContact O-N 3.21Å; V93-L95 VanDerWaalsContact C-N 3.35Å; V93-L95 PolarHBondContact O-N 3.01Å; L95-F98 PolarHBondContact O-N 2.9Å; L95-G99 PolarHBondContact O-N 3.49Å; L95-L391 HydrophobicContact CD1-CB 3.93Å; L95-T395 HydrophobicContact CD2-CG2 3.73Å
96	V	93.1	Very high	90.9	Very high	83 Å²	83	44.9 Å²	44.9	50%	0.503	25%	0.25	S	S	.	.	H	α-helix	trans	-65	-46.3	179	171.9	0	0	0	0	110.9	T92 V93 F98 G99 L100	T92-V96 WeakPolarHBondContact O-CG2 3.25Å; T92-V96 PolarHBondContact O-N 2.85Å; V93-V96 PolarHBondContact O-N 3.07Å; V96-F98 PolarHBondContact O-N 3.46Å; V96-G99 PolarHBondContact O-N 3.03Å; V96-L100 HydrophobicContact CG1-CD1 4.27Å; V96-L100 WeakPolarHBondContact O-CG 3.33Å; V96-L100 PolarHBondContact O-N 3.24Å
97	L	88.8	Confident	90.9	Very high	66 Å²	66	43.4 Å²	43.4	35%	0.346	24%	0.244	S	C	.	.	H	α-helix	trans	-61.5	-44.3	177	-69.4	175.6	0	0	0	111.6	V93 Q94 S101 F302	V93-L97 HydrophobicContact CG1-CD1 3.94Å; V93-L97 HydrophobicContact CG1-CG 4.3Å; V93-L97 WeakPolarHBondContact O-CG 3.44Å; V93-L97 PolarHBondContact O-N 3.19Å; Q94-L97 PolarHBondContact O-N 2.87Å; L97-S101 PolarHBondContact O-N 2.73Å; L97-F302 HydrophobicContact CD1-CD1 4.48Å; L97-F302 HydrophobicContact CD1-CE1 4.5Å
98	F	89.8	Confident	90.7	Very high	11 Å²	11	44.7 Å²	44.7	5%	0.048	25%	0.25	C	S	.	.	H	α-helix	trans	-62.4	-43.6	174.4	176.8	-105.2	0	0	0	111.8	Q94 L95 V96 L100 S101 N102 K373 Y384 C387 L391	Q94-F98 WeakPolarHBondContact O-CB 3.35Å; Q94-F98 PolarHBondContact O-N 3.04Å; L95-F98 PolarHBondContact O-N 2.9Å; V96-F98 PolarHBondContact O-N 3.46Å; F98-L100 PolarHBondContact O-N 2.75Å; F98-S101 PolarHBondContact O-N 2.77Å; F98-N102 HydrophobicContact CE1-CB 4.31Å; F98-N102 HydrophobicContact CZ-CB 4.34Å; F98-N102 VanDerWaalsContact O-CB 3.31Å; F98-N102 WeakPolarHBondContact O-CB 3.18Å; F98-N102 PolarHBondContact O-N 2.91Å; F98-K373 HydrophobicContact CB-CD 4.17Å; F98-K373 HydrophobicContact CD2-CD 3.91Å; F98-K373 HydrophobicContact CD2-CG 3.97Å; F98-K373 HydrophobicContact CE2-CG 4.45Å; F98-K373 HydrophobicContact CG-CD 4.3Å; F98-Y384 HydrophobicContact CE2-CD1 4.18Å; F98-Y384 HydrophobicContact CZ-CD1 4.23Å; F98-C387 HydrophobicContact CE2-CB 4.41Å; F98-C387 HydrophobicContact CZ-CB 3.94Å; F98-L391 HydrophobicContact CD1-CD1 4.26Å; F98-L391 HydrophobicContact CG-CD1 4.24Å
99	G	90.3	Very high	90.6	Very high	31 Å²	31	47.9 Å²	47.9	32%	0.32	26%	0.263	S	S	.	.	H	α-helix	trans	-61.6	-42.4	-179.2	0	0	0	0	0	112.7	L95 V96 N102 Q103	L95-G99 PolarHBondContact O-N 3.49Å; V96-G99 PolarHBondContact O-N 3.03Å; G99-N102 PolarHBondContact O-N 3.4Å; G99-Q103 VanDerWaalsContact O-CB 3.26Å; G99-Q103 WeakPolarHBondContact O-CB 3.31Å; G99-Q103 PolarHBondContact O-N 2.95Å
100	L	86.8	Confident	90.5	Very high	99 Å²	99	48.5 Å²	48.5	52%	0.518	26%	0.264	S	S	.	.	H	α-helix	trans	-63.7	-42.8	176.1	-69.6	171.7	0	0	0	112	V96 F98 M104	V96-L100 HydrophobicContact CG1-CD1 4.27Å; V96-L100 WeakPolarHBondContact O-CG 3.33Å; V96-L100 PolarHBondContact O-N 3.24Å; F98-L100 PolarHBondContact O-N 2.75Å; L100-M104 PolarHBondContact O-N 3.16Å
101	S	83	Confident	90.5	Very high	29 Å²	29	53.7 Å²	53.7	20%	0.203	29%	0.288	C	S	.	.	H	α-helix	trans	-65.4	-47.9	175.5	-177.4	0	0	0	0	111.5	L97 F98 Q103 M104 V105	L97-S101 PolarHBondContact O-N 2.73Å; F98-S101 PolarHBondContact O-N 2.77Å; S101-Q103 VanDerWaalsContact C-N 3.33Å; S101-Q103 PolarHBondContact O-N 2.9Å; S101-M104 PolarHBondContact O-N 3.08Å; S101-V105 WeakPolarHBondContact O-CG2 3.26Å; S101-V105 PolarHBondContact O-N 3.12Å
102	N	87	Confident	90.4	Very high	35 Å²	35	54.2 Å²	54.2	19%	0.187	29%	0.291	C	S	.	.	H	α-helix	trans	-62.1	-40.1	179.4	-170.7	43.4	0	0	0	112.1	F98 G99 M104 V105 V106 Y384	F98-N102 HydrophobicContact CE1-CB 4.31Å; F98-N102 HydrophobicContact CZ-CB 4.34Å; F98-N102 VanDerWaalsContact O-CB 3.31Å; F98-N102 WeakPolarHBondContact O-CB 3.18Å; F98-N102 PolarHBondContact O-N 2.91Å; G99-N102 PolarHBondContact O-N 3.4Å; N102-M104 VanDerWaalsContact C-N 3.32Å; N102-M104 PolarHBondContact O-N 3.46Å; N102-V105 PolarHBondContact O-N 3.39Å; N102-V106 WeakPolarHBondContact O-CG2 3.39Å; N102-V106 PolarHBondContact O-N 3.16Å; N102-Y384 HydrophobicContact CB-CD1 4.5Å; N102-Y384 WeakPolarHBondContact OD1-CD1 3.48Å
103	Q	87.8	Confident	90.4	Very high	124 Å²	124	53.7 Å²	53.7	58%	0.579	29%	0.287	S	S	*	.	H	α-helix	trans	-57.8	-44.7	176	-177.8	178.2	-17.5	0	0	111.3	G99 S101 V105 V106 T107	G99-Q103 VanDerWaalsContact O-CB 3.26Å; G99-Q103 WeakPolarHBondContact O-CB 3.31Å; G99-Q103 PolarHBondContact O-N 2.95Å; S101-Q103 VanDerWaalsContact C-N 3.33Å; S101-Q103 PolarHBondContact O-N 2.9Å; Q103-V105 VanDerWaalsContact C-N 3.35Å; Q103-V105 PolarHBondContact O-N 3Å; Q103-V106 PolarHBondContact O-N 2.91Å; Q103-T107 WeakPolarHBondContact O-CB 3.38Å; Q103-T107 PolarHBondContact O-N 3Å; Q103-T107 PolarHBondContact O-OG1 3.31Å
104	M	84.8	Confident	90.3	Very high	19 Å²	19	52.5 Å²	52.5	9%	0.094	28%	0.284	C	S	.	.	H	α-helix	trans	-61.8	-42.2	176.5	-68.6	-172.7	-75.4	0	0	112.6	L100 S101 N102 F108 N248	L100-M104 PolarHBondContact O-N 3.16Å; S101-M104 PolarHBondContact O-N 3.08Å; N102-M104 VanDerWaalsContact C-N 3.32Å; N102-M104 PolarHBondContact O-N 3.46Å; M104-F108 WeakPolarHBondContact O-CB 3.41Å; M104-F108 PolarHBondContact O-N 3.5Å; M104-N248 WeakPolarHBondContact CE-ND2 3.18Å; M104-N248 HydrophobicContact SD-CB 4.49Å; M104-N248 PolarHBondContact SD-ND2 2.9Å
105	V	85.9	Confident	90.4	Very high	17 Å²	17	54.1 Å²	54.1	10%	0.103	30%	0.297	C	S	.	.	H	α-helix	trans	-63.1	-45.1	177.9	174.8	0	0	0	0	110.9	S101 N102 Q103 K109 Y255 I282 Y384	S101-V105 WeakPolarHBondContact O-CG2 3.26Å; S101-V105 PolarHBondContact O-N 3.12Å; N102-V105 PolarHBondContact O-N 3.39Å; Q103-V105 VanDerWaalsContact C-N 3.35Å; Q103-V105 PolarHBondContact O-N 3Å; V105-K109 WeakPolarHBondContact O-CB 3.36Å; V105-K109 PolarHBondContact O-N 3.37Å; V105-Y255 HydrophobicContact CG1-CE1 4.28Å; V105-I282 HydrophobicContact CG1-CD1 3.57Å; V105-Y384 HydrophobicContact CG2-CE1 4.31Å
106	V	89.3	Confident	90.4	Very high	51 Å²	51	51.8 Å²	51.8	31%	0.309	29%	0.285	S	S	.	.	H	α-helix	trans	-65.6	-49.1	179.1	172.6	0	0	0	0	110.6	N102 Q103 F108 K109 E110	N102-V106 WeakPolarHBondContact O-CG2 3.39Å; N102-V106 PolarHBondContact O-N 3.16Å; Q103-V106 PolarHBondContact O-N 2.91Å; V106-F108 VanDerWaalsContact C-N 3.33Å; V106-F108 PolarHBondContact O-N 3.36Å; V106-K109 WeakPolarHBondContact O-CB 3.28Å; V106-K109 PolarHBondContact O-N 3.27Å; V106-K109 VanDerWaalsContact O-N 3.1Å; V106-E110 HydrophobicContact CG1-CG 4.16Å; V106-E110 WeakPolarHBondContact O-CB 2.71Å; V106-E110 WeakPolarHBondContact O-CG 3.22Å; V106-E110 PolarHBondContact O-N 3.31Å
107	T	90.9	Very high	90.5	Very high	50 Å²	50	50.8 Å²	50.8	31%	0.307	27%	0.274	S	S	.	.	H	α-helix	trans	-57.8	-46	177.2	-59.8	0	0	0	0	111	Q103 K109 E110 E111	Q103-T107 WeakPolarHBondContact O-CB 3.38Å; Q103-T107 PolarHBondContact O-N 3Å; Q103-T107 PolarHBondContact O-OG1 3.31Å; T107-K109 VanDerWaalsContact C-N 3.32Å; T107-K109 PolarHBondContact O-N 3.5Å; T107-E110 PolarHBondContact O-N 2.75Å; T107-E111 HydrophobicContact CG2-CG 4.03Å; T107-E111 WeakPolarHBondContact O-CB 3.47Å; T107-E111 VanDerWaalsContact O-CG 3.27Å; T107-E111 WeakPolarHBondContact O-CG 3.45Å; T107-E111 PolarHBondContact O-N 2.72Å
108	F	90.8	Very high	90.8	Very high	29 Å²	29	52 Å²	52	13%	0.127	28%	0.278	C	S	.	.	H	α-helix	trans	-60.8	-41	177.1	-173.6	-105.6	0	0	0	112.1	M104 V106 N112 A240 N242 Y255 F257	M104-F108 WeakPolarHBondContact O-CB 3.41Å; M104-F108 PolarHBondContact O-N 3.5Å; V106-F108 VanDerWaalsContact C-N 3.33Å; V106-F108 PolarHBondContact O-N 3.36Å; F108-N112 VanDerWaalsContact CE2-ND2 3.34Å; F108-N112 WeakPolarHBondContact CE2-ND2 3.2Å; F108-N112 VanDerWaalsContact CZ-ND2 3.33Å; F108-N112 WeakPolarHBondContact CZ-ND2 3.29Å; F108-N112 WeakPolarHBondContact O-CB 3.41Å; F108-N112 PolarHBondContact O-N 2.96Å; F108-N112 PolarHBondContact O-ND2 3.36Å; F108-A240 HydrophobicContact CZ-CB 4.29Å; F108-N242 HydrophobicContact CD1-CB 4Å; F108-N242 HydrophobicContact CD2-CB 4.09Å; F108-N242 HydrophobicContact CE1-CB 3.86Å; F108-N242 HydrophobicContact CE2-CB 3.95Å; F108-N242 HydrophobicContact CG-CB 4.12Å; F108-N242 HydrophobicContact CZ-CB 3.83Å; F108-Y255 AromaticContact CD1-CD1 3.98Å; F108-Y255 HydrophobicContact CD1-CD1 3.98Å; F108-Y255 AromaticContact CD1-CD2 3.98Å; F108-Y255 HydrophobicContact CD1-CD2 3.98Å; F108-Y255 AromaticContact CD1-CE1 3.92Å; F108-Y255 HydrophobicContact CD1-CE1 3.92Å; F108-Y255 AromaticContact CD1-CE2 3.94Å; F108-Y255 HydrophobicContact CD1-CE2 3.94Å; F108-Y255 HydrophobicContact CD1-CG 4Å; F108-Y255 AromaticContact CD1-CZ 3.91Å; F108-Y255 HydrophobicContact CE1-CD1 4.09Å; F108-Y255 AromaticContact CE1-CD2 3.63Å; F108-Y255 HydrophobicContact CE1-CD2 3.63Å; F108-Y255 HydrophobicContact CE1-CE1 4.43Å; F108-Y255 HydrophobicContact CE1-CE2 4.03Å; F108-Y255 AromaticContact CE1-CG 3.67Å; F108-Y255 HydrophobicContact CE1-CG 3.67Å; F108-F257 HydrophobicContact CD1-CZ 4.05Å; F108-F257 HydrophobicContact CE1-CE2 4.11Å; F108-F257 AromaticContact CE1-CZ 3.68Å; F108-F257 HydrophobicContact CE1-CZ 3.68Å
109	K	91	Very high	91	Very high	85 Å²	85	53 Å²	53	37%	0.37	28%	0.284	S	S	.	.	H	α-helix	trans	-65.9	-44.1	176.2	-179.4	-175.4	174.2	-171.9	0	112	V105 V106 T107 T113 A280	V105-K109 WeakPolarHBondContact O-CB 3.36Å; V105-K109 PolarHBondContact O-N 3.37Å; V106-K109 WeakPolarHBondContact O-CB 3.28Å; V106-K109 PolarHBondContact O-N 3.27Å; V106-K109 VanDerWaalsContact O-N 3.1Å; T107-K109 VanDerWaalsContact C-N 3.32Å; T107-K109 PolarHBondContact O-N 3.5Å; K109-T113 WeakPolarHBondContact O-CB 3.33Å; K109-T113 PolarHBondContact O-N 3.37Å; K109-T113 PolarHBondContact O-OG1 2.84Å; K109-A280 HydrophobicContact CD-CB 4.12Å; K109-A280 HydrophobicContact CG-CB 4.12Å
110	E	92.3	Very high	91.3	Very high	123 Å²	123	51.5 Å²	51.5	58%	0.575	27%	0.268	S	S	*	.	H	α-helix	trans	-68	-47.4	-177.9	-74.4	-177.1	164.3	0	0	111.9	V106 T107 N112 T113 A114	V106-E110 HydrophobicContact CG1-CG 4.16Å; V106-E110 WeakPolarHBondContact O-CB 2.71Å; V106-E110 WeakPolarHBondContact O-CG 3.22Å; V106-E110 PolarHBondContact O-N 3.31Å; T107-E110 PolarHBondContact O-N 2.75Å; E110-N112 PolarHBondContact O-N 3.33Å; E110-T113 CarbonylContact O-C 3.55Å; E110-T113 WeakPolarHBondContact O-CA 3.27Å; E110-T113 WeakPolarHBondContact O-CB 3.26Å; E110-T113 PolarHBondContact O-N 3.46Å; E110-T113 VanDerWaalsContact O-N 3.09Å; E110-A114 PolarHBondContact O-N 2.92Å
111	E	93.6	Very high	91.7	Very high	127 Å²	127	47.5 Å²	47.5	59%	0.593	25%	0.247	S	C	*	.	H	α-helix	trans	-61.5	-43.8	177.7	-69.8	-62.7	150.2	0	0	111.5	T107 T113 A114 A115	T107-E111 HydrophobicContact CG2-CG 4.03Å; T107-E111 WeakPolarHBondContact O-CB 3.47Å; T107-E111 VanDerWaalsContact O-CG 3.27Å; T107-E111 WeakPolarHBondContact O-CG 3.45Å; T107-E111 PolarHBondContact O-N 2.72Å; E111-T113 VanDerWaalsContact C-N 3.33Å; E111-T113 PolarHBondContact O-N 2.96Å; E111-A114 PolarHBondContact O-N 3.38Å; E111-A115 WeakPolarHBondContact O-CB 3.49Å; E111-A115 PolarHBondContact O-N 2.89Å
112	N	94.6	Very high	92.1	Very high	13 Å²	13	50.1 Å²	50.1	7%	0.07	26%	0.255	C	S	.	.	H	α-helix	trans	-64.4	-38.7	173.6	-82.2	-79.2	0	0	0	111.8	F108 E110 A114 A115 F116 Y160 F257	F108-N112 VanDerWaalsContact CE2-ND2 3.34Å; F108-N112 WeakPolarHBondContact CE2-ND2 3.2Å; F108-N112 VanDerWaalsContact CZ-ND2 3.33Å; F108-N112 WeakPolarHBondContact CZ-ND2 3.29Å; F108-N112 WeakPolarHBondContact O-CB 3.41Å; F108-N112 PolarHBondContact O-N 2.96Å; F108-N112 PolarHBondContact O-ND2 3.36Å; E110-N112 PolarHBondContact O-N 3.33Å; N112-A114 VanDerWaalsContact C-N 3.34Å; N112-A114 PolarHBondContact O-N 2.92Å; N112-A115 PolarHBondContact O-N 3.37Å; N112-F116 HydrophobicContact CB-CE2 3.93Å; N112-F116 HydrophobicContact CB-CZ 4.11Å; N112-F116 WeakPolarHBondContact O-CD2 3.31Å; N112-F116 WeakPolarHBondContact O-CG 3.49Å; N112-F116 PolarHBondContact O-N 3.04Å; N112-Y160 WeakPolarHBondContact OD1-CE1 3.39Å; N112-Y160 PolarHBondContact OD1-OH 2.99Å; N112-F257 HydrophobicContact CB-CE1 4.25Å; N112-F257 HydrophobicContact CB-CE2 4.08Å; N112-F257 HydrophobicContact CB-CZ 3.75Å
113	T	94.5	Very high	92.2	Very high	24 Å²	24	51.3 Å²	51.3	15%	0.147	28%	0.276	C	S	.	.	H	α-helix	trans	-63.8	-40.8	176.3	-56.6	0	0	0	0	111.4	K109 E110 E111 F116 K117 L276 N278	K109-T113 WeakPolarHBondContact O-CB 3.33Å; K109-T113 PolarHBondContact O-N 3.37Å; K109-T113 PolarHBondContact O-OG1 2.84Å; E110-T113 CarbonylContact O-C 3.55Å; E110-T113 WeakPolarHBondContact O-CA 3.27Å; E110-T113 WeakPolarHBondContact O-CB 3.26Å; E110-T113 PolarHBondContact O-N 3.46Å; E110-T113 VanDerWaalsContact O-N 3.09Å; E111-T113 VanDerWaalsContact C-N 3.33Å; E111-T113 PolarHBondContact O-N 2.96Å; T113-F116 PolarHBondContact O-N 2.86Å; T113-K117 WeakPolarHBondContact O-CG 3.42Å; T113-K117 PolarHBondContact O-N 3.44Å; T113-K117 VanDerWaalsContact O-N 3.09Å; T113-L276 HydrophobicContact CG2-CD2 4.38Å; T113-N278 HydrophobicContact CG2-CB 4.08Å; T113-N278 PolarHBondContact OG1-ND2 3.12Å
114	A	93.7	Very high	92.4	Very high	38 Å²	38	47.5 Å²	47.5	31%	0.314	26%	0.256	S	S	.	.	H	α-helix	trans	-62.8	-47	173.6	0	0	0	0	0	110.9	E110 E111 N112 F116 K117 H118	E110-A114 PolarHBondContact O-N 2.92Å; E111-A114 PolarHBondContact O-N 3.38Å; N112-A114 VanDerWaalsContact C-N 3.34Å; N112-A114 PolarHBondContact O-N 2.92Å; A114-F116 VanDerWaalsContact C-N 3.34Å; A114-F116 PolarHBondContact O-N 3.33Å; A114-K117 WeakPolarHBondContact O-CB 3.32Å; A114-K117 PolarHBondContact O-N 3.42Å; A114-K117 VanDerWaalsContact O-N 3.14Å; A114-H118 PolarHBondContact O-CD2 3.22Å; A114-H118 VanDerWaalsContact O-CD2 3.31Å; A114-H118 PolarHBondContact O-N 3.23Å; A114-H118 VanDerWaalsContact O-N 3.11Å
115	A	95.1	Very high	92.5	Very high	34 Å²	34	51.3 Å²	51.3	28%	0.281	27%	0.274	S	S	.	.	H	α-helix	trans	-57.4	-44.4	175.7	0	0	0	0	0	112	E111 N112 K117 H118 L119	E111-A115 WeakPolarHBondContact O-CB 3.49Å; E111-A115 PolarHBondContact O-N 2.89Å; N112-A115 PolarHBondContact O-N 3.37Å; A115-K117 VanDerWaalsContact C-N 3.34Å; A115-K117 PolarHBondContact O-N 3.46Å; A115-H118 PolarHBondContact O-N 3.24Å; A115-L119 WeakPolarHBondContact O-CB 3.46Å; A115-L119 VanDerWaalsContact O-CG 3.29Å; A115-L119 WeakPolarHBondContact O-CG 3.31Å; A115-L119 PolarHBondContact O-N 2.86Å
116	F	95.7	Very high	92.4	Very high	0 Å²	0	55.2 Å²	55.2	0%	0	29%	0.294	C	S	.	.	H	α-helix	trans	-63.1	-37.2	177	-61.3	-33.9	0	0	0	112.8	N112 T113 A114 L119 F120 Y160 L238 F257 I259 L276	N112-F116 HydrophobicContact CB-CE2 3.93Å; N112-F116 HydrophobicContact CB-CZ 4.11Å; N112-F116 WeakPolarHBondContact O-CD2 3.31Å; N112-F116 WeakPolarHBondContact O-CG 3.49Å; N112-F116 PolarHBondContact O-N 3.04Å; T113-F116 PolarHBondContact O-N 2.86Å; A114-F116 VanDerWaalsContact C-N 3.34Å; A114-F116 PolarHBondContact O-N 3.33Å; F116-L119 PolarHBondContact O-N 2.98Å; F116-F120 HydrophobicContact CB-CD2 3.96Å; F116-F120 HydrophobicContact CB-CE2 4.13Å; F116-F120 AromaticContact CD1-CE2 3.83Å; F116-F120 HydrophobicContact CD1-CE2 3.83Å; F116-F120 HydrophobicContact CG-CE2 4.23Å; F116-F120 WeakPolarHBondContact O-CB 3.4Å; F116-F120 VanDerWaalsContact O-CD2 3.22Å; F116-F120 WeakPolarHBondContact O-CD2 3.4Å; F116-F120 PolarHBondContact O-N 3.14Å; F116-Y160 HydrophobicContact CE1-CD1 4.09Å; F116-Y160 AromaticContact CE1-CE1 3.56Å; F116-Y160 HydrophobicContact CE1-CE1 3.56Å; F116-Y160 HydrophobicContact CE1-CE2 4.19Å; F116-Y160 AromaticContact CE1-CZ 3.63Å; F116-Y160 HydrophobicContact CZ-CD1 4.24Å; F116-Y160 AromaticContact CZ-CE1 3.67Å; F116-Y160 HydrophobicContact CZ-CE1 3.67Å; F116-L238 HydrophobicContact CD1-CD1 4.47Å; F116-L238 HydrophobicContact CE1-CD1 3.89Å; F116-L238 HydrophobicContact CZ-CD1 4.33Å; F116-F257 HydrophobicContact CE2-CB 3.98Å; F116-F257 HydrophobicContact CE2-CD1 4.27Å; F116-F257 AromaticContact CE2-CD2 3.94Å; F116-F257 HydrophobicContact CE2-CD2 3.94Å; F116-F257 HydrophobicContact CE2-CE2 4.46Å; F116-F257 AromaticContact CE2-CG 3.81Å; F116-F257 HydrophobicContact CE2-CG 3.81Å; F116-F257 HydrophobicContact CZ-CB 4.33Å; F116-F257 AromaticContact CZ-CD2 3.78Å; F116-F257 HydrophobicContact CZ-CD2 3.78Å; F116-F257 HydrophobicContact CZ-CE2 4.27Å; F116-F257 HydrophobicContact CZ-CG 4.11Å; F116-I259 HydrophobicContact CD1-CD1 4.05Å; F116-I259 HydrophobicContact CD2-CD1 3.54Å; F116-I259 HydrophobicContact CD2-CG1 3.96Å; F116-I259 HydrophobicContact CE1-CD1 4.1Å; F116-I259 HydrophobicContact CE2-CD1 3.61Å; F116-I259 HydrophobicContact CE2-CG1 4.16Å; F116-I259 HydrophobicContact CG-CD1 3.79Å; F116-I259 HydrophobicContact CZ-CD1 3.9Å; F116-L276 HydrophobicContact CB-CD1 4.08Å; F116-L276 HydrophobicContact CB-CD2 4.38Å
117	K	94.8	Very high	91.8	Very high	62 Å²	62	60.7 Å²	60.7	27%	0.27	32%	0.321	S	S	.	.	H	α-helix	trans	-61.4	-46.6	173.9	-70.4	171.5	-178	175	0	111	T113 A114 A115 L121 Y124 L276	T113-K117 WeakPolarHBondContact O-CG 3.42Å; T113-K117 PolarHBondContact O-N 3.44Å; T113-K117 VanDerWaalsContact O-N 3.09Å; A114-K117 WeakPolarHBondContact O-CB 3.32Å; A114-K117 PolarHBondContact O-N 3.42Å; A114-K117 VanDerWaalsContact O-N 3.14Å; A115-K117 VanDerWaalsContact C-N 3.34Å; A115-K117 PolarHBondContact O-N 3.46Å; K117-L121 HydrophobicContact CB-CD1 4.2Å; K117-L121 HydrophobicContact CG-CD1 4.23Å; K117-L121 WeakPolarHBondContact O-CA 3.37Å; K117-L121 WeakPolarHBondContact O-CB 3.38Å; K117-L121 WeakPolarHBondContact O-CG 3.39Å; K117-L121 PolarHBondContact O-N 3.46Å; K117-Y124 HydrophobicContact CB-CD1 3.9Å; K117-Y124 HydrophobicContact CB-CD2 4.39Å; K117-Y124 HydrophobicContact CB-CE1 3.76Å; K117-Y124 HydrophobicContact CB-CE2 4.3Å; K117-Y124 HydrophobicContact CB-CG 4.23Å; K117-Y124 HydrophobicContact CD-CE1 4.07Å; K117-Y124 HydrophobicContact CD-CE2 4.27Å; K117-Y124 WeakPolarHBondContact CD-OH 3.49Å; K117-L276 HydrophobicContact CG-CB 4.26Å; K117-L276 HydrophobicContact CG-CD1 4.31Å; K117-L276 HydrophobicContact CG-CD2 4.41Å
118	H	94.7	Very high	91.3	Very high	92 Å²	92	66.1 Å²	66.1	43%	0.426	34%	0.336	S	S	.	.	H	α-helix	trans	-69.1	-32.4	178.7	-77.1	-79.4	0	0	0	113.4	A114 A115 Y124 D126	A114-H118 PolarHBondContact O-CD2 3.22Å; A114-H118 VanDerWaalsContact O-CD2 3.31Å; A114-H118 PolarHBondContact O-N 3.23Å; A114-H118 VanDerWaalsContact O-N 3.11Å; A115-H118 PolarHBondContact O-N 3.24Å; H118-Y124 AromaticContact CD2-CD1 3.88Å; H118-Y124 AromaticContact CE1-CD1 3.62Å; H118-Y124 AromaticContact CG-CD1 4Å; H118-Y124 AromaticContact ND1-CD1 3.84Å; H118-Y124 AromaticContact NE2-CD1 3.62Å; H118-Y124 AromaticContact NE2-CE1 3.83Å; H118-D126 IonicContact CE1-OD1 3.52Å; H118-D126 IonicContact CE1-OD2 2.86Å; H118-D126 IonicContact NE2-OD1 2.92Å; H118-D126 PolarHBondContact NE2-OD1 3.37Å; H118-D126 IonicContact NE2-OD2 3.44Å
119	L	95.1	Very high	90.8	Very high	31 Å²	31	70.5 Å²	70.5	16%	0.162	37%	0.368	C	S	.	.	H	α-helix	trans	-75.9	-45.1	178.9	-74	169.6	0	0	0	113	A115 F116 Q148 L152 I155 A156	A115-L119 WeakPolarHBondContact O-CB 3.46Å; A115-L119 VanDerWaalsContact O-CG 3.29Å; A115-L119 WeakPolarHBondContact O-CG 3.31Å; A115-L119 PolarHBondContact O-N 2.86Å; F116-L119 PolarHBondContact O-N 2.98Å; L119-Q148 WeakPolarHBondContact O-CG 3.41Å; L119-Q148 PolarHBondContact O-NE2 3Å; L119-L152 HydrophobicContact CD1-CD1 4.17Å; L119-I155 HydrophobicContact CD2-CD1 4.4Å; L119-I155 HydrophobicContact CD2-CG1 4.48Å; L119-A156 HydrophobicContact CD1-CB 4.3Å
120	F	95.8	Very high	90.7	Very high	0 Å²	0	68.1 Å²	68.1	0%	0	36%	0.358	C	S	.	.	H	α-helix	trans	-99.1	-27.7	-170.7	-61.2	-61.8	0	0	0	113.8	F116 K122 F144 V145 Q148 L152 F236 L238 I259 I261 L276	F116-F120 HydrophobicContact CB-CD2 3.96Å; F116-F120 HydrophobicContact CB-CE2 4.13Å; F116-F120 AromaticContact CD1-CE2 3.83Å; F116-F120 HydrophobicContact CD1-CE2 3.83Å; F116-F120 HydrophobicContact CG-CE2 4.23Å; F116-F120 WeakPolarHBondContact O-CB 3.4Å; F116-F120 VanDerWaalsContact O-CD2 3.22Å; F116-F120 WeakPolarHBondContact O-CD2 3.4Å; F116-F120 PolarHBondContact O-N 3.14Å; F120-K122 PolarHBondContact O-N 2.96Å; F120-F144 WeakPolarHBondContact O-CD1 3.28Å; F120-V145 WeakPolarHBondContact O-CG2 3.21Å; F120-Q148 HydrophobicContact CD1-CB 4.1Å; F120-Q148 HydrophobicContact CE1-CB 4.44Å; F120-L152 HydrophobicContact CE1-CD1 4.35Å; F120-L152 HydrophobicContact CZ-CD1 3.93Å; F120-L152 HydrophobicContact CZ-CD2 4.45Å; F120-F236 HydrophobicContact CD1-CZ 4.18Å; F120-F236 AromaticContact CD2-CZ 3.88Å; F120-F236 HydrophobicContact CD2-CZ 3.88Å; F120-F236 HydrophobicContact CE1-CE2 4.33Å; F120-F236 AromaticContact CE1-CZ 3.92Å; F120-F236 HydrophobicContact CE1-CZ 3.92Å; F120-F236 AromaticContact CE2-CE2 3.81Å; F120-F236 HydrophobicContact CE2-CE2 3.81Å; F120-F236 AromaticContact CE2-CZ 3.59Å; F120-F236 HydrophobicContact CE2-CZ 3.59Å; F120-F236 HydrophobicContact CG-CZ 4.18Å; F120-F236 AromaticContact CZ-CE2 3.7Å; F120-F236 HydrophobicContact CZ-CE2 3.7Å; F120-F236 AromaticContact CZ-CZ 3.61Å; F120-F236 HydrophobicContact CZ-CZ 3.61Å; F120-L238 HydrophobicContact CE2-CD1 4.35Å; F120-L238 HydrophobicContact CZ-CD1 4.15Å; F120-I259 HydrophobicContact CE2-CD1 4.34Å; F120-I261 HydrophobicContact CB-CD1 3.73Å; F120-I261 HydrophobicContact CG-CD1 4.31Å; F120-L276 HydrophobicContact CD2-CD1 4.48Å
121	L	94.6	Very high	90.7	Very high	14 Å²	14	63.3 Å²	63.3	7%	0.073	34%	0.34	C	S	.	.	S	Bend	trans	-92.9	105.1	179.2	-50.7	179.9	0	0	0	109.5	K117 G123 Y124 I261 I274 L276	K117-L121 HydrophobicContact CB-CD1 4.2Å; K117-L121 HydrophobicContact CG-CD1 4.23Å; K117-L121 WeakPolarHBondContact O-CA 3.37Å; K117-L121 WeakPolarHBondContact O-CB 3.38Å; K117-L121 WeakPolarHBondContact O-CG 3.39Å; K117-L121 PolarHBondContact O-N 3.46Å; L121-G123 PolarHBondContact O-N 3.49Å; L121-Y124 HydrophobicContact CB-CD2 4.3Å; L121-Y124 HydrophobicContact CB-CG 4.45Å; L121-Y124 HydrophobicContact CD1-CD2 3.83Å; L121-Y124 HydrophobicContact CD1-CE2 4.22Å; L121-Y124 WeakPolarHBondContact O-CB 3.25Å; L121-Y124 PolarHBondContact O-N 3.28Å; L121-I261 HydrophobicContact CD2-CG2 4.07Å; L121-I274 HydrophobicContact CD2-CG2 3.8Å; L121-L276 HydrophobicContact CD1-CB 4.21Å; L121-L276 HydrophobicContact CG-CD1 4.44Å
122	K	92.9	Very high	90.7	Very high	85 Å²	85	57.4 Å²	57.4	37%	0.37	31%	0.312	S	S	.	.	T	Hydrogen-bonded Turn	trans	-51.9	131.3	176	-171.3	175.2	-178.4	173.1	0	109.8	F120 Y124 S140 R141 F144	F120-K122 PolarHBondContact O-N 2.96Å; K122-Y124 PolarHBondContact O-N 2.82Å; K122-S140 PolarHBondContact NZ-OG 3.43Å; K122-S140 VanDerWaalsContact NZ-OG 3.17Å; K122-R141 PolarHBondContact O-NH1 3.26Å; K122-F144 HydrophobicContact CB-CB 4.36Å; K122-F144 HydrophobicContact CB-CD1 3.5Å; K122-F144 HydrophobicContact CB-CD2 4.32Å; K122-F144 HydrophobicContact CB-CE1 3.73Å; K122-F144 HydrophobicContact CB-CG 3.8Å; K122-F144 HydrophobicContact CB-CZ 4.24Å; K122-F144 HydrophobicContact CD-CB 4.23Å; K122-F144 HydrophobicContact CD-CD2 4.14Å; K122-F144 HydrophobicContact CD-CG 4.09Å; K122-F144 HydrophobicContact CG-CD1 4.28Å; K122-F144 HydrophobicContact CG-CD2 4.23Å; K122-F144 HydrophobicContact CG-CE1 4.4Å; K122-F144 HydrophobicContact CG-CE2 4.36Å; K122-F144 HydrophobicContact CG-CG 4.17Å; K122-F144 HydrophobicContact CG-CZ 4.43Å
123	G	88.2	Confident	90.7	Very high	60 Å²	60	62.6 Å²	62.6	62%	0.619	34%	0.336	S	S	*	.	T	Hydrogen-bonded Turn	trans	60.9	27.5	175.2	0	0	0	0	0	115.1	L121	L121-G123 PolarHBondContact O-N 3.49Å
124	Y	91.4	Very high	90.7	Very high	43 Å²	43	65.1 Å²	65.1	17%	0.169	35%	0.351	C	S	.	.			trans	-58.6	138.7	175.8	-172.7	-110	0	0	0	111.5	K117 H118 L121 K122 D126 Q130	K117-Y124 HydrophobicContact CB-CD1 3.9Å; K117-Y124 HydrophobicContact CB-CD2 4.39Å; K117-Y124 HydrophobicContact CB-CE1 3.76Å; K117-Y124 HydrophobicContact CB-CE2 4.3Å; K117-Y124 HydrophobicContact CB-CG 4.23Å; K117-Y124 HydrophobicContact CD-CE1 4.07Å; K117-Y124 HydrophobicContact CD-CE2 4.27Å; K117-Y124 WeakPolarHBondContact CD-OH 3.49Å; H118-Y124 AromaticContact CD2-CD1 3.88Å; H118-Y124 AromaticContact CE1-CD1 3.62Å; H118-Y124 AromaticContact CG-CD1 4Å; H118-Y124 AromaticContact ND1-CD1 3.84Å; H118-Y124 AromaticContact NE2-CD1 3.62Å; H118-Y124 AromaticContact NE2-CE1 3.83Å; L121-Y124 HydrophobicContact CB-CD2 4.3Å; L121-Y124 HydrophobicContact CB-CG 4.45Å; L121-Y124 HydrophobicContact CD1-CD2 3.83Å; L121-Y124 HydrophobicContact CD1-CE2 4.22Å; L121-Y124 WeakPolarHBondContact O-CB 3.25Å; L121-Y124 PolarHBondContact O-N 3.28Å; K122-Y124 PolarHBondContact O-N 2.82Å; Y124-D126 WeakPolarHBondContact CE1-OD1 3.37Å; Y124-Q130 HydrophobicContact CD2-CG 3.75Å; Y124-Q130 HydrophobicContact CE2-CG 4.09Å
125	Q	88.5	Confident	90.7	Very high	100 Å²	100	69 Å²	69	47%	0.467	36%	0.363	S	S	.	.			trans	-130.2	134	172.5	-70.3	-177.5	-4.3	0	0	108.1	R128	Q125-R128 HydrophobicContact CB-CB 4.45Å; Q125-R128 PolarHBondContact O-N 3.46Å; Q125-R128 VanDerWaalsContact OE1-CD 3.29Å
126	D	84.1	Confident	90.6	Very high	99 Å²	99	74.2 Å²	74.2	53%	0.529	39%	0.385	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60	141.2	178.7	-58.4	-51.8	0	0	0	110.2	H118 Y124 R128	H118-D126 IonicContact CE1-OD1 3.52Å; H118-D126 IonicContact CE1-OD2 2.86Å; H118-D126 IonicContact NE2-OD1 2.92Å; H118-D126 PolarHBondContact NE2-OD1 3.37Å; H118-D126 IonicContact NE2-OD2 3.44Å; Y124-D126 WeakPolarHBondContact CE1-OD1 3.37Å; D126-R128 PolarHBondContact O-N 3.31Å; D126-R128 VanDerWaalsContact O-N 3.17Å
127	N	76.1	Confident	90.5	Very high	165 Å²	165	76.8 Å²	76.8	88%	0.882	40%	0.397	S	S	*	.	T	Hydrogen-bonded Turn	trans	63.1	12.1	179.9	-58.7	-24.1	0	0	0	117.1
128	R	80.4	Confident	90.4	Very high	164 Å²	164	73.9 Å²	73.9	62%	0.619	39%	0.385	S	S	*	.	S	Bend	trans	-112.2	130.7	173	-67.3	-172.6	178.1	-174.4	-7.6	112.5	Q125 D126 Q130	Q125-R128 HydrophobicContact CB-CB 4.45Å; Q125-R128 PolarHBondContact O-N 3.46Å; Q125-R128 VanDerWaalsContact OE1-CD 3.29Å; D126-R128 PolarHBondContact O-N 3.31Å; D126-R128 VanDerWaalsContact O-N 3.17Å; R128-Q130 PolarHBondContact O-N 2.86Å
129	P	79.9	Confident	90.3	Very high	122 Å²	122	73.9 Å²	73.9	79%	0.792	38%	0.382	S	S	*	.			trans	-66.9	125.8	176.6	27.3	-32.6	0	0	0	110.1
130	Q	88.4	Confident	90.2	Very high	34 Å²	34	74.7 Å²	74.7	16%	0.159	39%	0.39	C	S	.	.			trans	-81.7	128.2	178.3	-64.6	-64.7	-40.5	0	0	110.2	Y124 R128 I274	Y124-Q130 HydrophobicContact CD2-CG 3.75Å; Y124-Q130 HydrophobicContact CE2-CG 4.09Å; R128-Q130 PolarHBondContact O-N 2.86Å; Q130-I274 HydrophobicContact CB-CB 4.06Å; Q130-I274 PolarHBondContact O-N 3.37Å
131	A	92.4	Very high	90.1	Very high	23 Å²	23	77 Å²	77	19%	0.19	40%	0.399	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.2	155.2	175.7	0	0	0	0	0	111.1	K271 I272	A131-K271 HydrophobicContact CB-CD 4.23Å; A131-K271 HydrophobicContact CB-CG 3.88Å; A131-I272 CarbonylContact C-O 3.58Å; A131-I272 WeakPolarHBondContact CA-O 3.4Å
132	V	94	Very high	90	Very high	2 Å²	2	76.8 Å²	76.8	1%	0.012	40%	0.397	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	143.3	179.5	171.9	0	0	0	0	109.3	T134 E137 L138 R141 I272 I274	V132-T134 WeakPolarHBondContact CG1-O 3.45Å; V132-E137 HydrophobicContact CG1-CB 3.79Å; V132-E137 HydrophobicContact CG1-CG 3.75Å; V132-E137 HydrophobicContact CG2-CG 4.09Å; V132-L138 HydrophobicContact CG1-CB 4.05Å; V132-R141 HydrophobicContact CG2-CG 3.87Å; V132-I272 PolarHBondContact N-O 2.98Å; V132-I272 PolarHBondContact O-N 3.11Å; V132-I274 HydrophobicContact CG2-CD1 3.56Å; V132-I274 HydrophobicContact CG2-CG1 4.36Å
133	H	94.5	Very high	90	Very high	122 Å²	122	73.2 Å²	73.2	57%	0.565	39%	0.385	S	S	*	.			trans	-119.5	-12.6	-175	-65.7	-81	0	0	0	113.8
134	T	94.8	Very high	90.2	Very high	78 Å²	78	72.5 Å²	72.5	48%	0.479	37%	0.365	S	S	.	.	S	Bend	trans	-126.1	149.8	-178.2	71.9	0	0	0	0	111.9	V132 E137 L138	V132-T134 WeakPolarHBondContact CG1-O 3.45Å; T134-E137 PolarHBondContact O-N 3.34Å; T134-E137 WeakPolarHBondContact OG1-CB 3.44Å; T134-E137 PolarHBondContact OG1-N 3.48Å; T134-L138 PolarHBondContact O-N 2.79Å
135	Q	93	Very high	90.4	Very high	118 Å²	118	70.6 Å²	70.6	55%	0.551	36%	0.358	S	S	*	.	H	α-helix	trans	-63.8	-42.4	179.2	-62.5	-177.2	0.8	0	0	111.8	E137 L138 Y139 F226	Q135-E137 VanDerWaalsContact C-N 3.33Å; Q135-E137 PolarHBondContact O-N 3.31Å; Q135-L138 WeakPolarHBondContact O-CB 3.39Å; Q135-L138 PolarHBondContact O-N 3.5Å; Q135-Y139 VanDerWaalsContact O-CD2 3.24Å; Q135-Y139 WeakPolarHBondContact O-CD2 3.33Å; Q135-Y139 PolarHBondContact O-N 3.46Å; Q135-F226 HydrophobicContact CB-CE1 4.06Å; Q135-F226 HydrophobicContact CB-CE2 3.93Å; Q135-F226 HydrophobicContact CB-CZ 3.6Å; Q135-F226 HydrophobicContact CG-CD1 4.02Å; Q135-F226 HydrophobicContact CG-CD2 4.08Å; Q135-F226 HydrophobicContact CG-CE1 3.74Å; Q135-F226 HydrophobicContact CG-CE2 3.83Å; Q135-F226 HydrophobicContact CG-CG 4.17Å; Q135-F226 HydrophobicContact CG-CZ 3.66Å
136	L	92.8	Very high	90.6	Very high	145 Å²	145	65.9 Å²	65.9	76%	0.759	34%	0.336	S	S	*	.	H	α-helix	trans	-62	-42.3	178.2	-177.5	67.8	0	0	0	111.5	L138 Y139 S140	L136-L138 VanDerWaalsContact C-N 3.35Å; L136-Y139 PolarHBondContact O-N 3.03Å; L136-S140 WeakPolarHBondContact O-CB 3.38Å; L136-S140 PolarHBondContact O-N 3.22Å
137	E	93.3	Very high	90.9	Very high	54 Å²	54	66 Å²	66	25%	0.252	33%	0.333	S	S	.	.	H	α-helix	trans	-63.2	-42.5	175.1	-177.2	-178.4	-169.6	0	0	110.8	V132 T134 Q135 Y139 S140 R141	V132-E137 HydrophobicContact CG1-CB 3.79Å; V132-E137 HydrophobicContact CG1-CG 3.75Å; V132-E137 HydrophobicContact CG2-CG 4.09Å; T134-E137 PolarHBondContact O-N 3.34Å; T134-E137 WeakPolarHBondContact OG1-CB 3.44Å; T134-E137 PolarHBondContact OG1-N 3.48Å; Q135-E137 VanDerWaalsContact C-N 3.33Å; Q135-E137 PolarHBondContact O-N 3.31Å; E137-Y139 PolarHBondContact O-N 3.18Å; E137-S140 CarbonylContact O-C 3.52Å; E137-S140 WeakPolarHBondContact O-CB 3.45Å; E137-S140 PolarHBondContact O-N 3.21Å; E137-S140 VanDerWaalsContact O-N 3.1Å; E137-R141 HydrophobicContact CG-CG 4.22Å; E137-R141 VanDerWaalsContact O-CG 3.3Å; E137-R141 WeakPolarHBondContact O-CG 3.4Å; E137-R141 PolarHBondContact O-N 3.15Å; E137-R141 IonicContact OE1-CZ 2.7Å; E137-R141 IonicContact OE1-NE 3.13Å; E137-R141 PolarHBondContact OE1-NE 3.39Å; E137-R141 IonicContact OE1-NH2 2.74Å; E137-R141 PolarHBondContact OE1-NH2 3.44Å
138	L	92.9	Very high	91.7	Very high	1 Å²	1	60 Å²	60	1%	0.005	30%	0.3	C	S	.	.	H	α-helix	trans	-58.1	-49.3	178	-176.4	68.5	0	0	0	111.5	V132 T134 Q135 L136 S140 R141 I142 L224 F226 F263 I272	V132-L138 HydrophobicContact CG1-CB 4.05Å; T134-L138 PolarHBondContact O-N 2.79Å; Q135-L138 WeakPolarHBondContact O-CB 3.39Å; Q135-L138 PolarHBondContact O-N 3.5Å; L136-L138 VanDerWaalsContact C-N 3.35Å; L138-S140 VanDerWaalsContact C-N 3.3Å; L138-S140 PolarHBondContact O-N 2.98Å; L138-R141 PolarHBondContact O-N 3.2Å; L138-I142 HydrophobicContact CD1-CD1 4.24Å; L138-I142 HydrophobicContact CD2-CD1 4.46Å; L138-I142 HydrophobicContact CG-CD1 3.92Å; L138-I142 WeakPolarHBondContact O-CG1 3.44Å; L138-I142 PolarHBondContact O-N 3.41Å; L138-L224 HydrophobicContact CD2-CD1 3.71Å; L138-L224 HydrophobicContact CG-CD1 4.34Å; L138-F226 HydrophobicContact CD2-CD1 4.43Å; L138-F226 HydrophobicContact CD2-CE1 3.43Å; L138-F226 VanDerWaalsContact CD2-CE1 3.43Å; L138-F226 HydrophobicContact CD2-CZ 3.94Å; L138-F263 HydrophobicContact CD1-CB 4.19Å; L138-F263 HydrophobicContact CD1-CD1 3.33Å; L138-F263 HydrophobicContact CD1-CE1 3.91Å; L138-F263 HydrophobicContact CD1-CG 3.95Å; L138-I272 HydrophobicContact CD1-CD1 4.35Å; L138-I272 HydrophobicContact CD1-CG2 4.29Å; L138-I272 HydrophobicContact CD2-CD1 3.73Å
139	Y	92.7	Very high	92.2	Very high	91 Å²	91	52.2 Å²	52.2	36%	0.357	27%	0.271	S	S	.	.	H	α-helix	trans	-59.4	-40.8	175.1	-78.9	-68.2	0	0	0	112	Q135 L136 E137 I142 G143 F222 L224 F226	Q135-Y139 VanDerWaalsContact O-CD2 3.24Å; Q135-Y139 WeakPolarHBondContact O-CD2 3.33Å; Q135-Y139 PolarHBondContact O-N 3.46Å; L136-Y139 PolarHBondContact O-N 3.03Å; E137-Y139 PolarHBondContact O-N 3.18Å; Y139-I142 PolarHBondContact O-N 2.92Å; Y139-G143 PolarHBondContact O-N 3.33Å; Y139-F222 WeakPolarHBondContact CE1-O 3.45Å; Y139-L224 HydrophobicContact CD1-CD1 4.21Å; Y139-L224 HydrophobicContact CE1-CB 4.35Å; Y139-L224 HydrophobicContact CE1-CD1 3.77Å; Y139-L224 HydrophobicContact CE1-CG 3.79Å; Y139-L224 WeakPolarHBondContact OH-CB 3.43Å; Y139-L224 PolarHBondContact OH-N 2.59Å; Y139-F226 HydrophobicContact CD2-CZ 4.31Å; Y139-F226 AromaticContact CE2-CE2 3.66Å; Y139-F226 HydrophobicContact CE2-CE2 3.66Å; Y139-F226 AromaticContact CE2-CZ 3.8Å; Y139-F226 HydrophobicContact CE2-CZ 3.8Å
140	S	92.9	Very high	92.7	Very high	49 Å²	49	48.9 Å²	48.9	34%	0.343	25%	0.245	S	C	.	.	H	α-helix	trans	-64.1	-39.6	176.3	-175.5	0	0	0	0	112.7	K122 L136 E137 L138 F144	K122-S140 PolarHBondContact NZ-OG 3.43Å; K122-S140 VanDerWaalsContact NZ-OG 3.17Å; L136-S140 WeakPolarHBondContact O-CB 3.38Å; L136-S140 PolarHBondContact O-N 3.22Å; E137-S140 CarbonylContact O-C 3.52Å; E137-S140 WeakPolarHBondContact O-CB 3.45Å; E137-S140 PolarHBondContact O-N 3.21Å; E137-S140 VanDerWaalsContact O-N 3.1Å; L138-S140 VanDerWaalsContact C-N 3.3Å; L138-S140 PolarHBondContact O-N 2.98Å; S140-F144 VanDerWaalsContact O-CB 3.29Å; S140-F144 WeakPolarHBondContact O-CB 3.33Å; S140-F144 PolarHBondContact O-N 3.15Å
141	R	93.9	Very high	92.8	Very high	48 Å²	48	48.7 Å²	48.7	18%	0.181	25%	0.249	C	C	.	.	H	α-helix	trans	-67.3	-43.9	177.1	-61.9	-63.8	179.7	178.4	-1.8	111	K122 V132 E137 L138 F144 V145 F263 I274	K122-R141 PolarHBondContact O-NH1 3.26Å; V132-R141 HydrophobicContact CG2-CG 3.87Å; E137-R141 HydrophobicContact CG-CG 4.22Å; E137-R141 VanDerWaalsContact O-CG 3.3Å; E137-R141 WeakPolarHBondContact O-CG 3.4Å; E137-R141 PolarHBondContact O-N 3.15Å; E137-R141 IonicContact OE1-CZ 2.7Å; E137-R141 IonicContact OE1-NE 3.13Å; E137-R141 PolarHBondContact OE1-NE 3.39Å; E137-R141 IonicContact OE1-NH2 2.74Å; E137-R141 PolarHBondContact OE1-NH2 3.44Å; L138-R141 PolarHBondContact O-N 3.2Å; R141-F144 PolarHBondContact O-N 3.14Å; R141-V145 WeakPolarHBondContact O-CG2 3.47Å; R141-V145 PolarHBondContact O-N 3.47Å; R141-V145 VanDerWaalsContact O-N 3.1Å; R141-F263 HydrophobicContact CB-CE1 4.02Å; R141-F263 HydrophobicContact CB-CZ 4.43Å; R141-I274 HydrophobicContact CG-CD1 4.3Å
142	I	93.4	Very high	92.8	Very high	9 Å²	9	47.7 Å²	47.7	5%	0.046	24%	0.241	C	C	.	.	H	α-helix	trans	-63.6	-47.5	176.9	-66.4	166.2	0	0	0	110.3	L138 Y139 F144 V145 V146 L175 L224 V232 F263	L138-I142 HydrophobicContact CD1-CD1 4.24Å; L138-I142 HydrophobicContact CD2-CD1 4.46Å; L138-I142 HydrophobicContact CG-CD1 3.92Å; L138-I142 WeakPolarHBondContact O-CG1 3.44Å; L138-I142 PolarHBondContact O-N 3.41Å; Y139-I142 PolarHBondContact O-N 2.92Å; I142-F144 VanDerWaalsContact C-N 3.31Å; I142-F144 PolarHBondContact O-N 3.45Å; I142-V145 WeakPolarHBondContact O-CB 3.43Å; I142-V145 PolarHBondContact O-N 2.76Å; I142-V146 PolarHBondContact O-N 3.43Å; I142-V146 VanDerWaalsContact O-N 3.16Å; I142-L175 HydrophobicContact CG2-CD1 3.88Å; I142-L175 HydrophobicContact CG2-CD2 4.22Å; I142-L224 HydrophobicContact CD1-CD1 3.85Å; I142-V232 HydrophobicContact CD1-CG1 4.08Å; I142-F263 HydrophobicContact CG1-CD2 4.27Å; I142-F263 HydrophobicContact CG1-CE1 4.17Å; I142-F263 HydrophobicContact CG1-CE2 3.77Å; I142-F263 HydrophobicContact CG1-CZ 3.71Å
143	G	92	Very high	92.6	Very high	11 Å²	11	51.9 Å²	51.9	11%	0.113	27%	0.268	C	S	.	.	H	α-helix	trans	-58.4	-43.1	177	0	0	0	0	0	112.3	Y139 V145 V146 E147	Y139-G143 PolarHBondContact O-N 3.33Å; G143-V145 PolarHBondContact O-N 3.25Å; G143-V146 PolarHBondContact O-N 3.02Å; G143-E147 WeakPolarHBondContact O-CB 3.17Å; G143-E147 WeakPolarHBondContact O-CG 3.38Å; G143-E147 PolarHBondContact O-N 2.63Å
144	F	93.8	Very high	92.3	Very high	45 Å²	45	54.6 Å²	54.6	20%	0.197	28%	0.281	C	S	.	.	H	α-helix	trans	-60.1	-43.1	175.7	-179.7	-95.6	0	0	0	112.6	F120 K122 S140 R141 I142 V146 E147 Q148	F120-F144 WeakPolarHBondContact O-CD1 3.28Å; K122-F144 HydrophobicContact CB-CB 4.36Å; K122-F144 HydrophobicContact CB-CD1 3.5Å; K122-F144 HydrophobicContact CB-CD2 4.32Å; K122-F144 HydrophobicContact CB-CE1 3.73Å; K122-F144 HydrophobicContact CB-CG 3.8Å; K122-F144 HydrophobicContact CB-CZ 4.24Å; K122-F144 HydrophobicContact CD-CB 4.23Å; K122-F144 HydrophobicContact CD-CD2 4.14Å; K122-F144 HydrophobicContact CD-CG 4.09Å; K122-F144 HydrophobicContact CG-CD1 4.28Å; K122-F144 HydrophobicContact CG-CD2 4.23Å; K122-F144 HydrophobicContact CG-CE1 4.4Å; K122-F144 HydrophobicContact CG-CE2 4.36Å; K122-F144 HydrophobicContact CG-CG 4.17Å; K122-F144 HydrophobicContact CG-CZ 4.43Å; S140-F144 VanDerWaalsContact O-CB 3.29Å; S140-F144 WeakPolarHBondContact O-CB 3.33Å; S140-F144 PolarHBondContact O-N 3.15Å; R141-F144 PolarHBondContact O-N 3.14Å; I142-F144 VanDerWaalsContact C-N 3.31Å; I142-F144 PolarHBondContact O-N 3.45Å; F144-V146 VanDerWaalsContact C-N 3.31Å; F144-V146 PolarHBondContact O-N 3.24Å; F144-E147 PolarHBondContact O-N 3.29Å; F144-Q148 HydrophobicContact CD1-CG 3.88Å; F144-Q148 HydrophobicContact CD2-CG 4.15Å; F144-Q148 HydrophobicContact CE1-CG 3.55Å; F144-Q148 HydrophobicContact CE2-CG 3.82Å; F144-Q148 HydrophobicContact CG-CG 4.19Å; F144-Q148 HydrophobicContact CZ-CG 3.52Å; F144-Q148 WeakPolarHBondContact O-CB 3.15Å; F144-Q148 WeakPolarHBondContact O-CG 3.29Å; F144-Q148 PolarHBondContact O-N 3.18Å
145	V	94.5	Very high	92.2	Very high	2 Å²	2	54.1 Å²	54.1	1%	0.012	28%	0.275	C	S	.	.	H	α-helix	trans	-58	-46.5	176.2	171.8	0	0	0	0	110.7	F120 R141 I142 G143 Y149 V234 I261	F120-V145 WeakPolarHBondContact O-CG2 3.21Å; R141-V145 WeakPolarHBondContact O-CG2 3.47Å; R141-V145 PolarHBondContact O-N 3.47Å; R141-V145 VanDerWaalsContact O-N 3.1Å; I142-V145 WeakPolarHBondContact O-CB 3.43Å; I142-V145 PolarHBondContact O-N 2.76Å; G143-V145 PolarHBondContact O-N 3.25Å; V145-Y149 WeakPolarHBondContact O-CB 3.48Å; V145-Y149 PolarHBondContact O-N 3.42Å; V145-V234 HydrophobicContact CG1-CB 4.32Å; V145-V234 HydrophobicContact CG1-CG1 3.86Å; V145-V234 HydrophobicContact CG1-CG2 4.47Å; V145-I261 HydrophobicContact CB-CD1 4.46Å; V145-I261 HydrophobicContact CG1-CD1 3.56Å; V145-I261 HydrophobicContact CG2-CD1 3.96Å
146	V	91.9	Very high	92.3	Very high	2 Å²	2	49.4 Å²	49.4	1%	0.012	26%	0.256	C	S	.	.	H	α-helix	trans	-65.1	-46	-179.7	176	0	0	0	0	110.9	I142 G143 F144 Q148 Y149 M150 L205 Y219	I142-V146 PolarHBondContact O-N 3.43Å; I142-V146 VanDerWaalsContact O-N 3.16Å; G143-V146 PolarHBondContact O-N 3.02Å; F144-V146 VanDerWaalsContact C-N 3.31Å; F144-V146 PolarHBondContact O-N 3.24Å; V146-Q148 PolarHBondContact O-N 2.94Å; V146-Y149 PolarHBondContact O-N 3.38Å; V146-M150 HydrophobicContact CG1-CE 4.37Å; V146-M150 HydrophobicContact CG1-CG 4.5Å; V146-M150 VanDerWaalsContact O-CG 3.25Å; V146-M150 WeakPolarHBondContact O-CG 3.41Å; V146-M150 PolarHBondContact O-N 3.43Å; V146-L205 HydrophobicContact CG1-CD1 3.89Å; V146-L205 HydrophobicContact CG2-CD1 4.23Å; V146-Y219 HydrophobicContact CG1-CD1 4.34Å; V146-Y219 HydrophobicContact CG1-CE1 4.44Å; V146-Y219 HydrophobicContact CG1-CG 4.47Å
147	E	90.8	Very high	92.3	Very high	100 Å²	100	51.4 Å²	51.4	47%	0.467	27%	0.267	S	S	.	.	H	α-helix	trans	-60.7	-45.6	178.1	-73.6	171.6	-173.1	0	0	111.9	G143 F144 Y149 M150 A151	G143-E147 WeakPolarHBondContact O-CB 3.17Å; G143-E147 WeakPolarHBondContact O-CG 3.38Å; G143-E147 PolarHBondContact O-N 2.63Å; F144-E147 PolarHBondContact O-N 3.29Å; E147-Y149 VanDerWaalsContact C-N 3.34Å; E147-Y149 PolarHBondContact O-N 3.46Å; E147-M150 PolarHBondContact O-N 3.28Å; E147-A151 WeakPolarHBondContact O-CB 3.29Å; E147-A151 PolarHBondContact O-N 3.21Å
148	Q	92.9	Very high	92.2	Very high	41 Å²	41	50.3 Å²	50.3	19%	0.192	27%	0.27	C	S	.	.	H	α-helix	trans	-65.2	-38	177.1	-68.5	-73.3	85.8	0	0	112.1	L119 F120 F144 V146 M150 A151 L152 I155	L119-Q148 WeakPolarHBondContact O-CG 3.41Å; L119-Q148 PolarHBondContact O-NE2 3Å; F120-Q148 HydrophobicContact CD1-CB 4.1Å; F120-Q148 HydrophobicContact CE1-CB 4.44Å; F144-Q148 HydrophobicContact CD1-CG 3.88Å; F144-Q148 HydrophobicContact CD2-CG 4.15Å; F144-Q148 HydrophobicContact CE1-CG 3.55Å; F144-Q148 HydrophobicContact CE2-CG 3.82Å; F144-Q148 HydrophobicContact CG-CG 4.19Å; F144-Q148 HydrophobicContact CZ-CG 3.52Å; F144-Q148 WeakPolarHBondContact O-CB 3.15Å; F144-Q148 WeakPolarHBondContact O-CG 3.29Å; F144-Q148 PolarHBondContact O-N 3.18Å; V146-Q148 PolarHBondContact O-N 2.94Å; Q148-M150 VanDerWaalsContact C-N 3.35Å; Q148-A151 PolarHBondContact O-N 3.03Å; Q148-L152 WeakPolarHBondContact O-CA 3Å; Q148-L152 PolarHBondContact O-N 3.29Å; Q148-I155 HydrophobicContact CB-CD1 4.22Å
149	Y	92.4	Very high	92.1	Very high	0 Å²	0	61.8 Å²	61.8	0%	0	31%	0.313	C	S	.	.	H	α-helix	trans	-62.2	-42.8	173.8	177.4	-94.2	0	0	0	111.5	V145 V146 E147 L152 Y162 A172 L173 P207 F236 L238	V145-Y149 WeakPolarHBondContact O-CB 3.48Å; V145-Y149 PolarHBondContact O-N 3.42Å; V146-Y149 PolarHBondContact O-N 3.38Å; E147-Y149 VanDerWaalsContact C-N 3.34Å; E147-Y149 PolarHBondContact O-N 3.46Å; Y149-L152 VanDerWaalsContact O-CB 3.31Å; Y149-L152 WeakPolarHBondContact O-CB 3.33Å; Y149-L152 PolarHBondContact O-N 2.99Å; Y149-Y162 HydrophobicContact CD1-CE1 4.24Å; Y149-Y162 HydrophobicContact CD2-CE1 4.08Å; Y149-Y162 HydrophobicContact CE1-CD1 4.06Å; Y149-Y162 AromaticContact CE1-CE1 3.84Å; Y149-Y162 HydrophobicContact CE1-CE1 3.84Å; Y149-Y162 AromaticContact CE2-CD1 3.68Å; Y149-Y162 HydrophobicContact CE2-CD1 3.68Å; Y149-Y162 AromaticContact CE2-CE1 3.66Å; Y149-Y162 HydrophobicContact CE2-CE1 3.66Å; Y149-Y162 HydrophobicContact CG-CE1 4.37Å; Y149-Y162 AromaticContact CZ-CD1 3.4Å; Y149-Y162 VanDerWaalsContact CZ-CD1 3.4Å; Y149-Y162 AromaticContact CZ-CE1 3.54Å; Y149-Y162 WeakPolarHBondContact O-CE1 3.4Å; Y149-Y162 PolarHBondContact O-OH 2.9Å; Y149-Y162 VanDerWaalsContact OH-CD1 3.3Å; Y149-Y162 WeakPolarHBondContact OH-CD1 3.29Å; Y149-A172 WeakPolarHBondContact OH-CB 3.33Å; Y149-A172 PolarHBondContact OH-O 2.99Å; Y149-L173 HydrophobicContact CD1-CB 4.2Å; Y149-L173 HydrophobicContact CD1-CD1 3.55Å; Y149-L173 HydrophobicContact CD2-CD1 3.89Å; Y149-L173 HydrophobicContact CE1-CB 3.75Å; Y149-L173 HydrophobicContact CE1-CD1 3.95Å; Y149-L173 HydrophobicContact CE2-CD1 4.26Å; Y149-L173 HydrophobicContact CG-CD1 3.51Å; Y149-P207 HydrophobicContact CE1-CB 4.45Å; Y149-P207 HydrophobicContact CE1-CG 4.19Å; Y149-F236 HydrophobicContact CD2-CB 4.36Å; Y149-F236 HydrophobicContact CD2-CD1 4.21Å; Y149-F236 AromaticContact CD2-CD2 3.62Å; Y149-F236 HydrophobicContact CD2-CD2 3.62Å; Y149-F236 HydrophobicContact CD2-CE1 4.4Å; Y149-F236 AromaticContact CD2-CE2 3.83Å; Y149-F236 HydrophobicContact CD2-CE2 3.83Å; Y149-F236 AromaticContact CD2-CG 3.81Å; Y149-F236 HydrophobicContact CD2-CG 3.81Å; Y149-F236 HydrophobicContact CD2-CZ 4.22Å; Y149-F236 HydrophobicContact CE2-CB 3.73Å; Y149-F236 HydrophobicContact CE2-CD1 4.4Å; Y149-F236 AromaticContact CE2-CD2 3.43Å; Y149-F236 HydrophobicContact CE2-CD2 3.43Å; Y149-F236 VanDerWaalsContact CE2-CD2 3.43Å; Y149-F236 HydrophobicContact CE2-CE2 4.09Å; Y149-F236 AromaticContact CE2-CG 3.6Å; Y149-F236 HydrophobicContact CE2-CG 3.6Å; Y149-L238 HydrophobicContact CE2-CD2 4.06Å
150	M	89.4	Confident	92.1	Very high	52 Å²	52	58.9 Å²	58.9	26%	0.256	30%	0.301	S	S	.	.	H	α-helix	trans	-69.6	-33.5	178.9	-63.6	-64.2	173.4	0	0	112.8	V146 E147 Q148 Y162 L205 P207	V146-M150 HydrophobicContact CG1-CE 4.37Å; V146-M150 HydrophobicContact CG1-CG 4.5Å; V146-M150 VanDerWaalsContact O-CG 3.25Å; V146-M150 WeakPolarHBondContact O-CG 3.41Å; V146-M150 PolarHBondContact O-N 3.43Å; E147-M150 PolarHBondContact O-N 3.28Å; Q148-M150 VanDerWaalsContact C-N 3.35Å; M150-Y162 PolarHBondContact O-OH 3.43Å; M150-L205 HydrophobicContact CE-CB 3.85Å; M150-P207 HydrophobicContact SD-CB 4.04Å
151	A	90.8	Very high	92.1	Very high	30 Å²	30	59 Å²	59	25%	0.248	31%	0.306	C	S	.	.	H	α-helix	trans	-88.4	0.4	178.7	0	0	0	0	0	114.1	E147 Q148 P153 Q154 I155	E147-A151 WeakPolarHBondContact O-CB 3.29Å; E147-A151 PolarHBondContact O-N 3.21Å; Q148-A151 PolarHBondContact O-N 3.03Å; A151-P153 VanDerWaalsContact C-CD 3.48Å; A151-Q154 PolarHBondContact O-N 3.46Å; A151-I155 HydrophobicContact CB-CD1 4.44Å; A151-I155 HydrophobicContact CB-CG2 4.16Å; A151-I155 PolarHBondContact O-N 3.2Å
152	L	92.3	Very high	92.1	Very high	2 Å²	2	59.3 Å²	59.3	1%	0.01	31%	0.307	C	S	.	.	H	α-helix	trans	-49.2	-45.5	-168.2	-174.1	72.7	0	0	0	114.8	L119 F120 Q148 Y149 Q154 I155 A156 Y160 Y162 L238	L119-L152 HydrophobicContact CD1-CD1 4.17Å; F120-L152 HydrophobicContact CE1-CD1 4.35Å; F120-L152 HydrophobicContact CZ-CD1 3.93Å; F120-L152 HydrophobicContact CZ-CD2 4.45Å; Q148-L152 WeakPolarHBondContact O-CA 3Å; Q148-L152 PolarHBondContact O-N 3.29Å; Y149-L152 VanDerWaalsContact O-CB 3.31Å; Y149-L152 WeakPolarHBondContact O-CB 3.33Å; Y149-L152 PolarHBondContact O-N 2.99Å; L152-Q154 PolarHBondContact O-N 3.48Å; L152-I155 PolarHBondContact O-N 2.97Å; L152-A156 HydrophobicContact CD1-CB 3.91Å; L152-A156 HydrophobicContact CG-CB 4.33Å; L152-A156 WeakPolarHBondContact O-CB 3.37Å; L152-A156 PolarHBondContact O-N 3.29Å; L152-Y160 HydrophobicContact CD1-CD2 4.39Å; L152-Y160 HydrophobicContact CD2-CD2 4.38Å; L152-Y160 HydrophobicContact CD2-CG 4.36Å; L152-Y160 HydrophobicContact CG-CD2 4.42Å; L152-Y162 HydrophobicContact CB-CE1 4.36Å; L152-Y162 HydrophobicContact CD2-CE1 4.16Å; L152-L238 HydrophobicContact CD2-CD1 3.59Å; L152-L238 HydrophobicContact CD2-CD2 3.58Å; L152-L238 HydrophobicContact CD2-CG 4.26Å
153	P	89.8	Confident	91.9	Very high	89 Å²	89	59.9 Å²	59.9	58%	0.578	31%	0.311	S	S	*	.	H	α-helix	trans	-63.8	-22.4	-179.7	-23.7	34.4	0	0	0	114.3	A151 Y162	A151-P153 VanDerWaalsContact C-CD 3.48Å; P153-Y162 WeakPolarHBondContact CD-OH 3.49Å; P153-Y162 HydrophobicContact CG-CE2 3.89Å
154	Q	88.7	Confident	91.7	Very high	179 Å²	179	66.2 Å²	66.2	84%	0.836	34%	0.335	S	S	*	.	H	α-helix	trans	-94.1	-29.6	-177.9	-61.8	179.1	2.1	0	0	112.3	A151 L152	A151-Q154 PolarHBondContact O-N 3.46Å; L152-Q154 PolarHBondContact O-N 3.48Å
155	I	92.3	Very high	91.1	Very high	68 Å²	68	66.6 Å²	66.6	35%	0.349	35%	0.352	S	S	.	.	H	α-helix	trans	-99.3	-27.6	-174.1	65.9	176.2	0	0	0	113.7	L119 Q148 A151 L152	L119-I155 HydrophobicContact CD2-CD1 4.4Å; L119-I155 HydrophobicContact CD2-CG1 4.48Å; Q148-I155 HydrophobicContact CB-CD1 4.22Å; A151-I155 HydrophobicContact CB-CD1 4.44Å; A151-I155 HydrophobicContact CB-CG2 4.16Å; A151-I155 PolarHBondContact O-N 3.2Å; L152-I155 PolarHBondContact O-N 2.97Å
156	A	94.1	Very high	90.3	Very high	19 Å²	19	70.2 Å²	70.2	16%	0.157	37%	0.374	C	S	.	.			trans	-81.2	138.8	-172.8	0	0	0	0	0	111.8	L119 L152 Y160	L119-A156 HydrophobicContact CD1-CB 4.3Å; L152-A156 HydrophobicContact CD1-CB 3.91Å; L152-A156 HydrophobicContact CG-CB 4.33Å; L152-A156 WeakPolarHBondContact O-CB 3.37Å; L152-A156 PolarHBondContact O-N 3.29Å; A156-Y160 HydrophobicContact CB-CD2 3.83Å; A156-Y160 HydrophobicContact CB-CE2 3.96Å
157	L	94.6	Very high	89.7	Confident	188 Å²	188	70.7 Å²	70.7	98%	0.984	38%	0.38	S	S	*	.	S	Bend	trans	-72.9	-31.4	170.1	-63.9	175.4	0	0	0	111.9
158	G	89.9	Confident	89.1	Confident	31 Å²	31	67.1 Å²	67.1	32%	0.32	37%	0.367	S	S	.	.	S	Bend	trans	-81.8	146.4	175.6	0	0	0	0	0	112	Y160	G158-Y160 VanDerWaalsContact O-CD2 3.23Å; G158-Y160 WeakPolarHBondContact O-CD2 3.31Å; G158-Y160 PolarHBondContact O-N 2.92Å
159	R	91.1	Very high	88.6	Confident	241 Å²	241	72.7 Å²	72.7	91%	0.909	40%	0.398	S	S	*	.			trans	-84.2	100.3	174.8	-168.5	171.4	-172	171.9	1.7	110.1
160	Y	93.8	Very high	88	Confident	30 Å²	30	74.7 Å²	74.7	12%	0.118	42%	0.419	C	S	.	.			trans	-106.8	139.4	177.8	-56.9	-69.9	0	0	0	111.5	N112 F116 L152 A156 G158 L238 K239 A240	N112-Y160 WeakPolarHBondContact OD1-CE1 3.39Å; N112-Y160 PolarHBondContact OD1-OH 2.99Å; F116-Y160 HydrophobicContact CE1-CD1 4.09Å; F116-Y160 AromaticContact CE1-CE1 3.56Å; F116-Y160 HydrophobicContact CE1-CE1 3.56Å; F116-Y160 HydrophobicContact CE1-CE2 4.19Å; F116-Y160 AromaticContact CE1-CZ 3.63Å; F116-Y160 HydrophobicContact CZ-CD1 4.24Å; F116-Y160 AromaticContact CZ-CE1 3.67Å; F116-Y160 HydrophobicContact CZ-CE1 3.67Å; L152-Y160 HydrophobicContact CD1-CD2 4.39Å; L152-Y160 HydrophobicContact CD2-CD2 4.38Å; L152-Y160 HydrophobicContact CD2-CG 4.36Å; L152-Y160 HydrophobicContact CG-CD2 4.42Å; A156-Y160 HydrophobicContact CB-CD2 3.83Å; A156-Y160 HydrophobicContact CB-CE2 3.96Å; G158-Y160 VanDerWaalsContact O-CD2 3.23Å; G158-Y160 WeakPolarHBondContact O-CD2 3.31Å; G158-Y160 PolarHBondContact O-N 2.92Å; Y160-L238 HydrophobicContact CG-CD1 4.46Å; Y160-K239 CarbonylContact C-O 3.51Å; Y160-K239 WeakPolarHBondContact CA-O 3.27Å; Y160-A240 HydrophobicContact CD1-CB 3.99Å; Y160-A240 HydrophobicContact CE1-CB 4.05Å
161	A	92.3	Very high	87.9	Confident	52 Å²	52	72.4 Å²	72.4	43%	0.43	41%	0.408	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	139.1	173.2	0	0	0	0	0	110.8	L238 K239	A161-L238 WeakPolarHBondContact O-CA 3.27Å; A161-K239 HydrophobicContact CB-CB 4.26Å; A161-K239 PolarHBondContact N-O 3.46Å; A161-K239 PolarHBondContact O-N 3.33Å
162	Y	92.4	Very high	87.8	Confident	55 Å²	55	71 Å²	71	22%	0.216	40%	0.397	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74	147.4	177.8	-55.4	-69.5	0	0	0	112.1	Y149 M150 L152 P153 P207 L238	Y149-Y162 HydrophobicContact CD1-CE1 4.24Å; Y149-Y162 HydrophobicContact CD2-CE1 4.08Å; Y149-Y162 HydrophobicContact CE1-CD1 4.06Å; Y149-Y162 AromaticContact CE1-CE1 3.84Å; Y149-Y162 HydrophobicContact CE1-CE1 3.84Å; Y149-Y162 AromaticContact CE2-CD1 3.68Å; Y149-Y162 HydrophobicContact CE2-CD1 3.68Å; Y149-Y162 AromaticContact CE2-CE1 3.66Å; Y149-Y162 HydrophobicContact CE2-CE1 3.66Å; Y149-Y162 HydrophobicContact CG-CE1 4.37Å; Y149-Y162 AromaticContact CZ-CD1 3.4Å; Y149-Y162 VanDerWaalsContact CZ-CD1 3.4Å; Y149-Y162 AromaticContact CZ-CE1 3.54Å; Y149-Y162 WeakPolarHBondContact O-CE1 3.4Å; Y149-Y162 PolarHBondContact O-OH 2.9Å; Y149-Y162 VanDerWaalsContact OH-CD1 3.3Å; Y149-Y162 WeakPolarHBondContact OH-CD1 3.29Å; M150-Y162 PolarHBondContact O-OH 3.43Å; L152-Y162 HydrophobicContact CB-CE1 4.36Å; L152-Y162 HydrophobicContact CD2-CE1 4.16Å; P153-Y162 WeakPolarHBondContact CD-OH 3.49Å; P153-Y162 HydrophobicContact CG-CE2 3.89Å; Y162-P207 HydrophobicContact CD1-CG 4Å; Y162-P207 HydrophobicContact CD2-CB 3.99Å; Y162-P207 HydrophobicContact CD2-CG 3.57Å; Y162-P207 HydrophobicContact CE1-CB 4.34Å; Y162-P207 HydrophobicContact CE1-CG 4.21Å; Y162-P207 HydrophobicContact CE2-CB 3.71Å; Y162-P207 HydrophobicContact CE2-CG 3.83Å; Y162-P207 HydrophobicContact CG-CB 4.4Å; Y162-P207 HydrophobicContact CG-CG 3.63Å; Y162-L238 HydrophobicContact CD1-CD2 3.82Å; Y162-L238 HydrophobicContact CE1-CD2 4.23Å
163	V	90.1	Very high	87.8	Confident	21 Å²	21	71 Å²	71	13%	0.127	40%	0.396	C	S	.	.			trans	-107.5	117.2	170	-170.3	0	0	0	0	108.8	V166 A172 Q237 K239 T256	V163-V166 HydrophobicContact CG1-CG2 3.71Å; V163-A172 WeakPolarHBondContact O-CA 3.28Å; V163-A172 WeakPolarHBondContact O-CB 3.33Å; V163-Q237 HydrophobicContact CB-CB 3.92Å; V163-Q237 HydrophobicContact CG2-CB 3.92Å; V163-Q237 PolarHBondContact N-O 3.35Å; V163-K239 HydrophobicContact CG2-CD 3.99Å; V163-K239 HydrophobicContact CG2-CG 3.71Å; V163-T256 HydrophobicContact CG2-CG2 4.28Å
164	K	87.6	Confident	87.9	Confident	143 Å²	143	67.4 Å²	67.4	62%	0.622	37%	0.374	S	S	*	.			trans	-88.6	155.7	177.8	-60.3	-175.4	178.2	-173.8	0	110.9	A172	K164-A172 HydrophobicContact CG-CB 4.42Å
165	G	80.6	Confident	88.2	Confident	53 Å²	53	58.9 Å²	58.9	55%	0.546	33%	0.334	S	S	.	.	S	Bend	trans	83.2	12.5	172.3	0	0	0	0	0	115.5	G170 S171	G165-G170 WeakPolarHBondContact CA-O 3.23Å; G165-G170 PolarHBondContact N-O 3.36Å; G165-G170 VanDerWaalsContact N-O 3.13Å; G165-S171 PolarHBondContact N-O 2.85Å
166	V	79.4	Confident	88.3	Confident	78 Å²	78	56.2 Å²	56.2	47%	0.473	32%	0.321	S	S	.	.	S	Bend	trans	-109.5	-27.9	-178.2	-174.3	0	0	0	0	112.1	V163 S171 Q237	V163-V166 HydrophobicContact CG1-CG2 3.71Å; V166-S171 PolarHBondContact N-O 3.43Å; V166-Q237 HydrophobicContact CG1-CG 4.33Å
167	G	77.8	Confident	88.3	Confident	13 Å²	13	55.5 Å²	55.5	13%	0.134	31%	0.314	C	S	.	.	S	Bend	trans	-78.9	175.4	177.1	0	0	0	0	0	113.4	N169 G170 S171	G167-N169 PolarHBondContact O-N 3.49Å; G167-G170 PolarHBondContact O-N 3.45Å; G167-G170 VanDerWaalsContact O-N 3.09Å; G167-S171 WeakPolarHBondContact CA-O 3.38Å; G167-S171 PolarHBondContact N-O 3.27Å
168	A	79.9	Confident	88.4	Confident	25 Å²	25	51.5 Å²	51.5	21%	0.207	29%	0.286	C	S	.	.	G	3₁₀ helix	trans	-52.6	137.1	174.6	0	0	0	0	0	111.2	G170 S171 C202 G204	A168-G170 PolarHBondContact O-N 2.93Å; A168-G170 VanDerWaalsContact O-N 3.16Å; A168-S171 WeakPolarHBondContact O-CB 3.5Å; A168-S171 PolarHBondContact O-N 3.04Å; A168-S171 PolarHBondContact O-OG 3.29Å; A168-C202 HydrophobicContact CB-CB 3.76Å; A168-G204 WeakPolarHBondContact O-CA 3.19Å
169	N	80.7	Confident	88.6	Confident	157 Å²	157	51.5 Å²	51.5	84%	0.84	28%	0.277	S	S	*	.	G	3₁₀ helix	trans	58.4	22.2	-177.6	-53.1	-32.6	0	0	0	114.7	G167	G167-N169 PolarHBondContact O-N 3.49Å
170	G	81.1	Confident	88.8	Confident	43 Å²	43	42.4 Å²	42.4	44%	0.443	24%	0.244	S	C	.	.	G	3₁₀ helix	trans	81.5	13.1	179.2	0	0	0	0	0	114.5	G165 G167 A168	G165-G170 WeakPolarHBondContact CA-O 3.23Å; G165-G170 PolarHBondContact N-O 3.36Å; G165-G170 VanDerWaalsContact N-O 3.13Å; G167-G170 PolarHBondContact O-N 3.45Å; G167-G170 VanDerWaalsContact O-N 3.09Å; A168-G170 PolarHBondContact O-N 2.93Å; A168-G170 VanDerWaalsContact O-N 3.16Å
171	S	86.8	Confident	88.6	Confident	3 Å²	3	46.5 Å²	46.5	2%	0.021	26%	0.262	C	S	.	.			trans	-74.2	174.5	178.2	69.4	0	0	0	0	113.3	G165 V166 G167 A168 L173 G204 L205 D206	G165-S171 PolarHBondContact N-O 2.85Å; V166-S171 PolarHBondContact N-O 3.43Å; G167-S171 WeakPolarHBondContact CA-O 3.38Å; G167-S171 PolarHBondContact N-O 3.27Å; A168-S171 WeakPolarHBondContact O-CB 3.5Å; A168-S171 PolarHBondContact O-N 3.04Å; A168-S171 PolarHBondContact O-OG 3.29Å; S171-L173 PolarHBondContact OG-O 3.46Å; S171-G204 WeakPolarHBondContact OG-CA 3.49Å; S171-L205 PolarHBondContact OG-N 3.4Å; S171-D206 VanDerWaalsContact CA-OD1 3.28Å; S171-D206 WeakPolarHBondContact CA-OD1 3.48Å
172	A	88.8	Confident	88.4	Confident	2 Å²	2	47.2 Å²	47.2	2%	0.017	26%	0.261	C	S	.	.	S	Bend	trans	-87.6	-30.4	173.5	0	0	0	0	0	113.8	Y149 V163 K164 L205 D206 P207	Y149-A172 WeakPolarHBondContact OH-CB 3.33Å; Y149-A172 PolarHBondContact OH-O 2.99Å; V163-A172 WeakPolarHBondContact O-CA 3.28Å; V163-A172 WeakPolarHBondContact O-CB 3.33Å; K164-A172 HydrophobicContact CG-CB 4.42Å; A172-L205 PolarHBondContact N-O 3.2Å; A172-D206 WeakPolarHBondContact CB-OD1 3.28Å; A172-D206 PolarHBondContact N-OD1 3.22Å; A172-P207 HydrophobicContact CB-CG 4.25Å
173	L	92.1	Very high	88.1	Confident	0 Å²	0	44.9 Å²	44.9	0%	0	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124	140.5	175	179.8	150.3	0	0	0	110.1	Y149 S171 G204 L205 V234 F236	Y149-L173 HydrophobicContact CD1-CB 4.2Å; Y149-L173 HydrophobicContact CD1-CD1 3.55Å; Y149-L173 HydrophobicContact CD2-CD1 3.89Å; Y149-L173 HydrophobicContact CE1-CB 3.75Å; Y149-L173 HydrophobicContact CE1-CD1 3.95Å; Y149-L173 HydrophobicContact CE2-CD1 4.26Å; Y149-L173 HydrophobicContact CG-CD1 3.51Å; S171-L173 PolarHBondContact OG-O 3.46Å; L173-G204 CarbonylContact O-C 3.23Å; L173-G204 WeakPolarHBondContact O-CA 3.49Å; L173-L205 HydrophobicContact CB-CB 4.48Å; L173-L205 HydrophobicContact CD2-CB 4.07Å; L173-L205 HydrophobicContact CD2-CD1 3.86Å; L173-L205 HydrophobicContact CD2-CG 4.33Å; L173-L205 PolarHBondContact N-O 2.99Å; L173-L205 PolarHBondContact O-N 3.11Å; L173-V234 HydrophobicContact CD1-CG1 3.91Å; L173-V234 HydrophobicContact CD2-CG1 4.06Å; L173-V234 HydrophobicContact CG-CG1 4.09Å; L173-F236 HydrophobicContact CB-CB 4.07Å; L173-F236 HydrophobicContact CD1-CB 4.24Å; L173-F236 HydrophobicContact CD1-CD1 3.73Å; L173-F236 HydrophobicContact CD1-CE1 4.41Å; L173-F236 HydrophobicContact CD1-CG 4.2Å; L173-F236 HydrophobicContact CG-CB 4.13Å; L173-F236 HydrophobicContact CG-CD1 4.23Å
174	S	93	Very high	88	Confident	14 Å²	14	48.4 Å²	48.4	10%	0.098	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	125.5	172.2	45.2	0	0	0	0	111.5	I203 V234 D235	S174-I203 WeakPolarHBondContact CA-O 3.44Å; S174-V234 WeakPolarHBondContact O-CA 3.32Å; S174-D235 PolarHBondContact N-O 3.01Å; S174-D235 PolarHBondContact O-N 3.34Å; S174-D235 WeakPolarHBondContact OG-CB 3.35Å; S174-D235 PolarHBondContact OG-O 3.45Å
175	L	93.6	Very high	88	Confident	1 Å²	1	45.4 Å²	45.4	1%	0.005	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	114.1	170.1	171.8	64.3	0	0	0	107.8	I142 C202 I203 F222 V232 V234	I142-L175 HydrophobicContact CG2-CD1 3.88Å; I142-L175 HydrophobicContact CG2-CD2 4.22Å; L175-C202 CarbonylContact O-C 3.57Å; L175-C202 VanDerWaalsContact O-CA 3.32Å; L175-C202 WeakPolarHBondContact O-CA 3.46Å; L175-I203 PolarHBondContact N-O 2.99Å; L175-I203 PolarHBondContact O-N 3.23Å; L175-F222 HydrophobicContact CD1-CE1 4.2Å; L175-F222 HydrophobicContact CD2-CB 4.45Å; L175-F222 HydrophobicContact CD2-CD1 3.58Å; L175-F222 HydrophobicContact CD2-CE1 3.86Å; L175-F222 HydrophobicContact CD2-CG 4.04Å; L175-F222 HydrophobicContact CG-CD1 4.05Å; L175-F222 HydrophobicContact CG-CE1 3.77Å; L175-F222 HydrophobicContact CG-CZ 4.18Å; L175-V232 HydrophobicContact CD1-CG1 3.75Å; L175-V234 HydrophobicContact CD1-CG2 3.73Å
176	C	94.2	Very high	88.5	Confident	11 Å²	11	45.6 Å²	45.6	7%	0.074	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	140.6	-176.5	-64.2	0	0	0	0	111.4	T200 D201 C202 V232 T233	C176-T200 HydrophobicContact CB-CG2 4.38Å; C176-D201 CarbonylContact C-O 3.37Å; C176-D201 VanDerWaalsContact CA-O 3.26Å; C176-D201 WeakPolarHBondContact CA-O 3.21Å; C176-C202 HydrophobicContact CB-CB 4.14Å; C176-C202 WeakPolarHBondContact CB-SG 3.36Å; C176-C202 WeakPolarHBondContact SG-CB 3.33Å; C176-C202 CovalentContact SG-SG 2.04Å; C176-C202 PolarHBondContact SG-SG 3.12Å; C176-V232 CarbonylContact O-C 3.56Å; C176-V232 VanDerWaalsContact O-CA 3.32Å; C176-V232 WeakPolarHBondContact O-CA 3.38Å; C176-V232 WeakPolarHBondContact O-CG1 3.26Å; C176-T233 PolarHBondContact N-O 3.46Å; C176-T233 PolarHBondContact O-N 2.92Å
177	Q	95	Very high	89	Confident	4 Å²	4	46.7 Å²	46.7	2%	0.019	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	139.2	166.3	62.2	177.4	-30.1	0	0	109.6	Y179 T200 D201 F222 T223 L224 L229 V232	Q177-Y179 HydrophobicContact CB-CD1 4.48Å; Q177-Y179 HydrophobicContact CG-CD1 3.8Å; Q177-Y179 HydrophobicContact CG-CE1 3.87Å; Q177-T200 WeakPolarHBondContact O-CA 3.19Å; Q177-D201 HydrophobicContact CG-CB 3.9Å; Q177-D201 PolarHBondContact N-O 2.93Å; Q177-D201 PolarHBondContact NE2-OD2 3.06Å; Q177-D201 PolarHBondContact O-N 3.39Å; Q177-F222 HydrophobicContact CB-CE1 4.26Å; Q177-F222 HydrophobicContact CB-CZ 3.77Å; Q177-F222 HydrophobicContact CG-CE1 4.41Å; Q177-F222 HydrophobicContact CG-CE2 4.12Å; Q177-F222 HydrophobicContact CG-CZ 3.57Å; Q177-T223 PolarHBondContact NE2-O 3.4Å; Q177-L224 HydrophobicContact CB-CD2 4.24Å; Q177-L229 HydrophobicContact CB-CD1 4.09Å; Q177-V232 HydrophobicContact CB-CG2 4.4Å
178	R	95.6	Very high	89.7	Confident	105 Å²	105	52.1 Å²	52.1	40%	0.396	29%	0.293	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	128.1	170.6	-52.9	-174.4	-176	166.4	2.5	108.9	V198 V199 T200 I230 N231	R178-V198 HydrophobicContact CB-CG1 3.98Å; R178-V199 WeakPolarHBondContact CA-O 3.4Å; R178-T200 HydrophobicContact CG-CG2 4.19Å; R178-I230 WeakPolarHBondContact O-CB 3.23Å; R178-I230 PolarHBondContact O-N 3.4Å; R178-N231 VanDerWaalsContact CB-OD1 3.28Å; R178-N231 WeakPolarHBondContact CB-OD1 3.16Å; R178-N231 WeakPolarHBondContact CD-OD1 3.09Å; R178-N231 WeakPolarHBondContact CG-OD1 3.27Å; R178-N231 PolarHBondContact N-O 2.94Å; R178-N231 PolarHBondContact O-N 2.57Å
179	Y	94.9	Very high	90.4	Very high	31 Å²	31	56.1 Å²	56.1	12%	0.122	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.5	159.4	-176.7	58.6	-96.1	0	0	0	111.3	Q177 V199 D201 Q225 K228	Q177-Y179 HydrophobicContact CB-CD1 4.48Å; Q177-Y179 HydrophobicContact CG-CD1 3.8Å; Q177-Y179 HydrophobicContact CG-CE1 3.87Å; Y179-V199 HydrophobicContact CD2-CB 4.28Å; Y179-V199 HydrophobicContact CE1-CG1 4.49Å; Y179-V199 HydrophobicContact CE2-CB 3.81Å; Y179-V199 HydrophobicContact CE2-CG1 4.04Å; Y179-V199 HydrophobicContact CE2-CG2 4.49Å; Y179-V199 PolarHBondContact N-O 3.21Å; Y179-V199 PolarHBondContact O-N 3.01Å; Y179-D201 HydrophobicContact CE1-CB 3.89Å; Y179-Q225 VanDerWaalsContact CD2-OE1 3.25Å; Y179-K228 CarbonylContact C-O 3.57Å; Y179-K228 WeakPolarHBondContact CA-O 3.42Å; Y179-K228 WeakPolarHBondContact CB-O 3.41Å; Y179-K228 HydrophobicContact CD2-CD 4.28Å; Y179-K228 HydrophobicContact CD2-CG 4.5Å
180	F	94.4	Very high	91	Very high	49 Å²	49	55.8 Å²	55.8	22%	0.215	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.6	138.8	175.3	-62.7	-64	0	0	0	111	T182 I194 K228 I230 H268	F180-T182 PolarHBondContact O-N 3.48Å; F180-I194 HydrophobicContact CB-CG2 4.08Å; F180-I194 HydrophobicContact CD1-CG2 4.36Å; F180-I194 HydrophobicContact CD2-CG2 4.24Å; F180-I194 HydrophobicContact CG-CG2 3.98Å; F180-K228 HydrophobicContact CB-CB 4.29Å; F180-K228 PolarHBondContact N-O 2.76Å; F180-K228 VanDerWaalsContact O-CD 3.3Å; F180-K228 WeakPolarHBondContact O-CD 3.27Å; F180-I230 HydrophobicContact CD1-CD1 3.89Å; F180-I230 HydrophobicContact CD1-CG1 4.45Å; F180-I230 HydrophobicContact CD2-CD1 4.46Å; F180-I230 HydrophobicContact CD2-CG1 4.16Å; F180-I230 HydrophobicContact CE1-CD1 3.66Å; F180-I230 HydrophobicContact CE1-CG1 4.11Å; F180-I230 HydrophobicContact CE2-CD1 4.25Å; F180-I230 HydrophobicContact CE2-CG1 3.8Å; F180-I230 HydrophobicContact CG-CD1 4.29Å; F180-I230 HydrophobicContact CG-CG1 4.47Å; F180-I230 HydrophobicContact CZ-CD1 3.86Å; F180-I230 HydrophobicContact CZ-CG1 3.77Å; F180-H268 AromaticContact CE2-NE2 3.91Å
181	K	91.5	Very high	91.5	Very high	116 Å²	116	57.7 Å²	57.7	50%	0.504	31%	0.313	S	S	.	.	S	Bend	trans	-54.5	-53.6	-173.6	-175.9	172.3	168.2	-163	0	111.8	D195 H197 V199 K228	K181-D195 HydrophobicContact CB-CB 4.28Å; K181-D195 WeakPolarHBondContact CD-OD2 3.39Å; K181-H197 HydrophobicContact CB-CB 4.29Å; K181-H197 WeakPolarHBondContact CB-O 3.31Å; K181-H197 HydrophobicContact CD-CB 4.45Å; K181-H197 PolarHBondContact N-O 3.09Å; K181-V199 HydrophobicContact CB-CG2 3.8Å; K181-V199 HydrophobicContact CG-CG2 3.98Å; K181-K228 PolarHBondContact O-NZ 2.75Å; K181-K228 VanDerWaalsContact O-NZ 3.15Å
182	T	87.7	Confident	91.8	Very high	67 Å²	67	65 Å²	65	41%	0.411	34%	0.344	S	S	.	.	S	Bend	trans	-120.1	148.4	167.2	59.3	0	0	0	0	109.1	F180 I194 D195	F180-T182 PolarHBondContact O-N 3.48Å; T182-I194 WeakPolarHBondContact O-CA 3.49Å; T182-D195 PolarHBondContact O-N 2.71Å; T182-D195 WeakPolarHBondContact OG1-CB 3.37Å; T182-D195 PolarHBondContact OG1-N 2.77Å
183	G	86.1	Confident	91.9	Very high	6 Å²	6	70 Å²	70	6%	0.062	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-168.7	87.3	-179.2	0	0	0	0	0	110	D193 Y227	G183-D193 CarbonylContact C-O 3.58Å; G183-D193 VanDerWaalsContact CA-O 3.28Å; G183-D193 WeakPolarHBondContact CA-O 3.5Å; G183-Y227 WeakPolarHBondContact O-CD2 3.33Å; G183-Y227 WeakPolarHBondContact O-CE2 3.32Å
184	T	87.4	Confident	91.9	Very high	95 Å²	95	72.8 Å²	72.8	58%	0.583	39%	0.385	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-94.4	116.9	166.7	50.3	0	0	0	0	107.3	F192 D193	T184-F192 CarbonylContact O-C 3.51Å; T184-F192 WeakPolarHBondContact O-CA 3.42Å; T184-D193 PolarHBondContact N-O 2.74Å; T184-D193 PolarHBondContact O-N 2.95Å
185	I	88.1	Confident	91.9	Very high	81 Å²	81	73.8 Å²	73.8	42%	0.415	39%	0.389	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	112.6	177.6	-56.3	177	0	0	0	105.9	P187 I194 Y227	I185-P187 HydrophobicContact CG2-CG 4.41Å; I185-P187 WeakPolarHBondContact O-CD 3.34Å; I185-I194 HydrophobicContact CD1-CD1 4.01Å; I185-I194 HydrophobicContact CG1-CD1 4.06Å; I185-I194 HydrophobicContact CG1-CG1 4.35Å; I185-Y227 WeakPolarHBondContact CD1-O 3.33Å
186	D	89.9	Confident	91.8	Very high	56 Å²	56	78.1 Å²	78.1	30%	0.299	42%	0.418	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	93.4	177.1	-174	1.1	0	0	0	110.1	V188 N189 D190 T191	D186-V188 PolarHBondContact O-N 3.45Å; D186-V188 WeakPolarHBondContact OD1-CB 3.37Å; D186-V188 PolarHBondContact OD1-N 3.22Å; D186-N189 PolarHBondContact O-N 2.97Å; D186-N189 PolarHBondContact OD2-ND2 2.87Å; D186-D190 PolarHBondContact O-N 3.45Å; D186-D190 VanDerWaalsContact O-N 3.14Å; D186-T191 PolarHBondContact N-O 3.36Å; D186-T191 PolarHBondContact O-N 3.46Å
187	P	90.5	Very high	91.8	Very high	102 Å²	102	83.8 Å²	83.8	66%	0.662	44%	0.443	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.3	-16.4	177.2	-19.2	32.3	0	0	0	113.7	I185	I185-P187 HydrophobicContact CG2-CG 4.41Å; I185-P187 WeakPolarHBondContact O-CD 3.34Å
188	V	93.4	Very high	91.8	Very high	127 Å²	127	87.5 Å²	87.5	77%	0.77	47%	0.465	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.4	-37.8	178.6	-179.5	0	0	0	0	110.4	D186	D186-V188 PolarHBondContact O-N 3.45Å; D186-V188 WeakPolarHBondContact OD1-CB 3.37Å; D186-V188 PolarHBondContact OD1-N 3.22Å
189	N	94.3	Very high	91.7	Very high	109 Å²	109	84.8 Å²	84.8	58%	0.583	46%	0.46	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.7	4.7	-179.6	-71.4	-40.9	0	0	0	113.2	D186 T191	D186-N189 PolarHBondContact O-N 2.97Å; D186-N189 PolarHBondContact OD2-ND2 2.87Å; N189-T191 WeakPolarHBondContact O-CG2 3.28Å; N189-T191 PolarHBondContact O-N 3.16Å; N189-T191 VanDerWaalsContact O-N 3.12Å
190	D	92.4	Very high	91.7	Very high	150 Å²	150	87 Å²	87	80%	0.802	48%	0.477	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.2	30.8	-173.5	-64.1	-41.1	0	0	0	113.8	D186	D186-D190 PolarHBondContact O-N 3.45Å; D186-D190 VanDerWaalsContact O-N 3.14Å
191	T	92.8	Very high	91.6	Very high	83 Å²	83	87.6 Å²	87.6	51%	0.509	48%	0.483	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	144.7	-178	52.5	0	0	0	0	111.9	D186 N189	D186-T191 PolarHBondContact N-O 3.36Å; D186-T191 PolarHBondContact O-N 3.46Å; N189-T191 WeakPolarHBondContact O-CG2 3.28Å; N189-T191 PolarHBondContact O-N 3.16Å; N189-T191 VanDerWaalsContact O-N 3.12Å
192	F	91.4	Very high	91.6	Very high	155 Å²	155	84.1 Å²	84.1	68%	0.68	47%	0.472	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-144.4	146.3	171.3	65.4	-87.4	0	0	0	111.1	T184 I194	T184-F192 CarbonylContact O-C 3.51Å; T184-F192 WeakPolarHBondContact O-CA 3.42Å; F192-I194 HydrophobicContact CD2-CD1 4.13Å; F192-I194 HydrophobicContact CD2-CG1 4.25Å
193	D	91.6	Very high	91.8	Very high	107 Å²	107	82.8 Å²	82.8	57%	0.572	46%	0.463	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-136	112.3	169.5	179.2	20.4	0	0	0	107.9	G183 T184	G183-D193 CarbonylContact C-O 3.58Å; G183-D193 VanDerWaalsContact CA-O 3.28Å; G183-D193 WeakPolarHBondContact CA-O 3.5Å; T184-D193 PolarHBondContact N-O 2.74Å; T184-D193 PolarHBondContact O-N 2.95Å
194	I	92.1	Very high	91.9	Very high	59 Å²	59	83.6 Å²	83.6	30%	0.303	47%	0.471	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.3	123.7	-171.6	-57	174.2	0	0	0	109	F180 T182 I185 F192 P196	F180-I194 HydrophobicContact CB-CG2 4.08Å; F180-I194 HydrophobicContact CD1-CG2 4.36Å; F180-I194 HydrophobicContact CD2-CG2 4.24Å; F180-I194 HydrophobicContact CG-CG2 3.98Å; T182-I194 WeakPolarHBondContact O-CA 3.49Å; I185-I194 HydrophobicContact CD1-CD1 4.01Å; I185-I194 HydrophobicContact CG1-CD1 4.06Å; I185-I194 HydrophobicContact CG1-CG1 4.35Å; F192-I194 HydrophobicContact CD2-CD1 4.13Å; F192-I194 HydrophobicContact CD2-CG1 4.25Å; I194-P196 WeakPolarHBondContact O-CD 3.28Å
195	D	92.2	Very high	91.8	Very high	35 Å²	35	79.4 Å²	79.4	19%	0.187	45%	0.445	C	S	.	.			trans	-88.3	113.3	164.9	-178.8	-5.8	0	0	0	108.7	K181 T182 H197	K181-D195 HydrophobicContact CB-CB 4.28Å; K181-D195 WeakPolarHBondContact CD-OD2 3.39Å; T182-D195 PolarHBondContact O-N 2.71Å; T182-D195 WeakPolarHBondContact OG1-CB 3.37Å; T182-D195 PolarHBondContact OG1-N 2.77Å; D195-H197 PolarHBondContact O-N 3.38Å; D195-H197 WeakPolarHBondContact OD1-CB 3.44Å; D195-H197 IonicContact OD1-CE1 3.82Å; D195-H197 IonicContact OD1-CG 2.75Å; D195-H197 PolarHBondContact OD1-N 3.38Å; D195-H197 IonicContact OD1-ND1 2.76Å; D195-H197 PolarHBondContact OD1-ND1 3.39Å; D195-H197 IonicContact OD2-ND1 2.71Å
196	P	91.6	Very high	91.7	Very high	93 Å²	93	78.7 Å²	78.7	60%	0.604	44%	0.442	S	S	*	.			trans	-68.5	-5.3	-176.1	30	-36.5	0	0	0	113.7	I194 V198	I194-P196 WeakPolarHBondContact O-CD 3.28Å; P196-V198 PolarHBondContact O-N 2.98Å
197	H	94.6	Very high	91.1	Very high	129 Å²	129	76.7 Å²	76.7	60%	0.597	43%	0.432	S	S	*	.	P	Polyproline II helix	trans	-61.5	124.4	174.3	-70.5	90.5	0	0	0	111	K181 D195	K181-H197 HydrophobicContact CB-CB 4.29Å; K181-H197 WeakPolarHBondContact CB-O 3.31Å; K181-H197 HydrophobicContact CD-CB 4.45Å; K181-H197 PolarHBondContact N-O 3.09Å; D195-H197 PolarHBondContact O-N 3.38Å; D195-H197 WeakPolarHBondContact OD1-CB 3.44Å; D195-H197 IonicContact OD1-CE1 3.82Å; D195-H197 IonicContact OD1-CG 2.75Å; D195-H197 PolarHBondContact OD1-N 3.38Å; D195-H197 IonicContact OD1-ND1 2.76Å; D195-H197 PolarHBondContact OD1-ND1 3.39Å; D195-H197 IonicContact OD2-ND1 2.71Å
198	V	94.6	Very high	90.1	Very high	82 Å²	82	75.8 Å²	75.8	50%	0.497	42%	0.424	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86	122.6	-178.3	-177.8	0	0	0	0	110	R178 P196 I230	R178-V198 HydrophobicContact CB-CG1 3.98Å; P196-V198 PolarHBondContact O-N 2.98Å; V198-I230 HydrophobicContact CB-CD1 4.39Å; V198-I230 HydrophobicContact CG1-CD1 3.97Å; V198-I230 HydrophobicContact CG2-CD1 3.68Å
199	V	95.1	Very high	88.4	Confident	48 Å²	48	75 Å²	75	29%	0.291	42%	0.422	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	136.1	170.4	-178.9	0	0	0	0	108.3	R178 Y179 K181	R178-V199 WeakPolarHBondContact CA-O 3.4Å; Y179-V199 HydrophobicContact CD2-CB 4.28Å; Y179-V199 HydrophobicContact CE1-CG1 4.49Å; Y179-V199 HydrophobicContact CE2-CB 3.81Å; Y179-V199 HydrophobicContact CE2-CG1 4.04Å; Y179-V199 HydrophobicContact CE2-CG2 4.49Å; Y179-V199 PolarHBondContact N-O 3.21Å; Y179-V199 PolarHBondContact O-N 3.01Å; K181-V199 HydrophobicContact CB-CG2 3.8Å; K181-V199 HydrophobicContact CG-CG2 3.98Å
200	T	94.5	Very high	86.3	Confident	78 Å²	78	77.2 Å²	77.2	48%	0.479	43%	0.434	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	122.6	175.2	-56.5	0	0	0	0	108.6	C176 Q177 R178	C176-T200 HydrophobicContact CB-CG2 4.38Å; Q177-T200 WeakPolarHBondContact O-CA 3.19Å; R178-T200 HydrophobicContact CG-CG2 4.19Å
201	D	92.9	Very high	84.1	Confident	62 Å²	62	71.6 Å²	71.6	33%	0.332	41%	0.406	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	127.1	177.4	174.5	36.5	0	0	0	108.7	C176 Q177 Y179	C176-D201 CarbonylContact C-O 3.37Å; C176-D201 VanDerWaalsContact CA-O 3.26Å; C176-D201 WeakPolarHBondContact CA-O 3.21Å; Q177-D201 HydrophobicContact CG-CB 3.9Å; Q177-D201 PolarHBondContact N-O 2.93Å; Q177-D201 PolarHBondContact NE2-OD2 3.06Å; Q177-D201 PolarHBondContact O-N 3.39Å; Y179-D201 HydrophobicContact CE1-CB 3.89Å
202	C	91.5	Very high	81.9	Confident	42 Å²	42	72.1 Å²	72.1	28%	0.284	41%	0.411	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134	138	-170	-66.2	0	0	0	0	111.8	A168 L175 C176	A168-C202 HydrophobicContact CB-CB 3.76Å; L175-C202 CarbonylContact O-C 3.57Å; L175-C202 VanDerWaalsContact O-CA 3.32Å; L175-C202 WeakPolarHBondContact O-CA 3.46Å; C176-C202 HydrophobicContact CB-CB 4.14Å; C176-C202 WeakPolarHBondContact CB-SG 3.36Å; C176-C202 WeakPolarHBondContact SG-CB 3.33Å; C176-C202 CovalentContact SG-SG 2.04Å; C176-C202 PolarHBondContact SG-SG 3.12Å
203	I	90.5	Very high	79.9	Confident	40 Å²	40	71.2 Å²	71.2	21%	0.205	42%	0.418	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113	133.1	170.6	-60.8	-175.6	0	0	0	109.1	S174 L175 L205 F222	S174-I203 WeakPolarHBondContact CA-O 3.44Å; L175-I203 PolarHBondContact N-O 2.99Å; L175-I203 PolarHBondContact O-N 3.23Å; I203-L205 HydrophobicContact CG2-CD2 4.2Å; I203-L205 HydrophobicContact CG2-CG 4.42Å; I203-F222 HydrophobicContact CD1-CB 4.05Å; I203-F222 HydrophobicContact CD1-CD2 3.35Å; I203-F222 HydrophobicContact CD1-CE2 4.08Å; I203-F222 HydrophobicContact CD1-CG 4.06Å; I203-F222 HydrophobicContact CG1-CD2 3.91Å; I203-F222 HydrophobicContact CG1-CE2 4.14Å
204	G	87.8	Confident	77.6	Confident	23 Å²	23	71.8 Å²	71.8	24%	0.237	43%	0.425	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.2	133.1	172.8	0	0	0	0	0	111.8	A168 S171 L173	A168-G204 WeakPolarHBondContact O-CA 3.19Å; S171-G204 WeakPolarHBondContact OG-CA 3.49Å; L173-G204 CarbonylContact O-C 3.23Å; L173-G204 WeakPolarHBondContact O-CA 3.49Å
205	L	86.8	Confident	75.4	Confident	7 Å²	7	78.1 Å²	78.1	4%	0.037	45%	0.446	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	134.2	178	-61.3	172.2	0	0	0	110.3	V146 M150 S171 A172 L173 I203	V146-L205 HydrophobicContact CG1-CD1 3.89Å; V146-L205 HydrophobicContact CG2-CD1 4.23Å; M150-L205 HydrophobicContact CE-CB 3.85Å; S171-L205 PolarHBondContact OG-N 3.4Å; A172-L205 PolarHBondContact N-O 3.2Å; L173-L205 HydrophobicContact CB-CB 4.48Å; L173-L205 HydrophobicContact CD2-CB 4.07Å; L173-L205 HydrophobicContact CD2-CD1 3.86Å; L173-L205 HydrophobicContact CD2-CG 4.33Å; L173-L205 PolarHBondContact N-O 2.99Å; L173-L205 PolarHBondContact O-N 3.11Å; I203-L205 HydrophobicContact CG2-CD2 4.2Å; I203-L205 HydrophobicContact CG2-CG 4.42Å
206	D	84.9	Confident	73.5	Confident	66 Å²	66	78.6 Å²	78.6	35%	0.353	45%	0.448	S	S	.	.			trans	-114.1	137.3	178.6	-80.8	-47.3	0	0	0	112.3	S171 A172 V208	S171-D206 VanDerWaalsContact CA-OD1 3.28Å; S171-D206 WeakPolarHBondContact CA-OD1 3.48Å; A172-D206 WeakPolarHBondContact CB-OD1 3.28Å; A172-D206 PolarHBondContact N-OD1 3.22Å; D206-V208 PolarHBondContact O-N 3.38Å
207	P	77.6	Confident	71.7	Confident	13 Å²	13	76.6 Å²	76.6	8%	0.084	44%	0.439	C	S	.	.			trans	-74	113.8	170.8	28.8	-29.8	0	0	0	109.2	Y149 M150 Y162 A172	Y149-P207 HydrophobicContact CE1-CB 4.45Å; Y149-P207 HydrophobicContact CE1-CG 4.19Å; M150-P207 HydrophobicContact SD-CB 4.04Å; Y162-P207 HydrophobicContact CD1-CG 4Å; Y162-P207 HydrophobicContact CD2-CB 3.99Å; Y162-P207 HydrophobicContact CD2-CG 3.57Å; Y162-P207 HydrophobicContact CE1-CB 4.34Å; Y162-P207 HydrophobicContact CE1-CG 4.21Å; Y162-P207 HydrophobicContact CE2-CB 3.71Å; Y162-P207 HydrophobicContact CE2-CG 3.83Å; Y162-P207 HydrophobicContact CG-CB 4.4Å; Y162-P207 HydrophobicContact CG-CG 3.63Å; A172-P207 HydrophobicContact CB-CG 4.25Å
208	V	70.6	Confident	69.9	Low	83 Å²	83	75.4 Å²	75.4	50%	0.503	44%	0.437	S	S	.	.			trans	-91.8	123.9	175.8	-177.1	0	0	0	0	108.9	D206 D210	D206-V208 PolarHBondContact O-N 3.38Å; V208-D210 PolarHBondContact O-N 3.1Å
209	P	56.3	Low	68.5	Low	111 Å²	111	73.1 Å²	73.1	72%	0.721	42%	0.42	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.2	-23	-173.6	21.7	-30	0	0	0	115.4
210	D	50.3	Low	67.2	Low	156 Å²	156	78.3 Å²	78.3	83%	0.834	44%	0.439	S	S	*	.	T	Hydrogen-bonded Turn	trans	-137.4	22.4	-169.7	-73.3	-45.3	0	0	0	115.5	V208	V208-D210 PolarHBondContact O-N 3.1Å
211	S	46.5	Very low	66.1	Low	31 Å²	31	80.3 Å²	80.3	22%	0.217	45%	0.446	C	S	.	.	S	Bend	trans	-110.7	135	173.9	-175.2	0	0	0	0	110.4	R215	S211-R215 PolarHBondContact OG-NE 2.97Å
212	P	46.5	Very low	65.6	Low	95 Å²	95	78 Å²	78	62%	0.617	43%	0.433	S	S	*	.			trans	-54.4	148	165.3	24.1	-30.7	0	0	0	108.8	T214	P212-T214 PolarHBondContact O-N 3Å; P212-T214 PolarHBondContact O-OG1 3.42Å
213	V	50.1	Low	65.4	Low	136 Å²	136	80.7 Å²	80.7	82%	0.824	45%	0.449	S	S	*	.	G	3₁₀ helix	trans	-42.8	-8.1	-176.9	179.9	0	0	0	0	115.3	R215	V213-R215 PolarHBondContact O-N 2.94Å
214	T	43.1	Very low	65.5	Low	119 Å²	119	79.4 Å²	79.4	73%	0.73	44%	0.442	S	S	*	.	G	3₁₀ helix	trans	-80	-6.6	-172.3	33	0	0	0	0	116.7	P212	P212-T214 PolarHBondContact O-N 3Å; P212-T214 PolarHBondContact O-OG1 3.42Å
215	R	45.6	Very low	65.6	Low	192 Å²	192	80.8 Å²	80.8	73%	0.725	44%	0.443	S	S	*	.	G	3₁₀ helix	trans	-92.6	-10.7	179.6	-123.7	-172.4	-69.8	-167	-1.3	116	S211 V213 A217	S211-R215 PolarHBondContact OG-NE 2.97Å; V213-R215 PolarHBondContact O-N 2.94Å; R215-A217 PolarHBondContact O-N 3Å
216	N	53	Low	65.8	Low	44 Å²	44	82.3 Å²	82.3	24%	0.235	45%	0.449	C	S	.	.			trans	-101.4	53.4	-179.9	-67.1	-6.7	0	0	0	111	D218 Y219	N216-D218 PolarHBondContact O-N 2.74Å; N216-Y219 HydrophobicContact CB-CD1 4.32Å; N216-Y219 HydrophobicContact CB-CE1 4.43Å; N216-Y219 WeakPolarHBondContact O-CD1 3.45Å; N216-Y219 WeakPolarHBondContact O-CE1 3.27Å
217	A	52.3	Low	66	Low	51 Å²	51	85.3 Å²	85.3	42%	0.421	46%	0.456	S	S	.	.			trans	-70.4	-14	174.3	0	0	0	0	0	112.8	R215 Y219 K220	R215-A217 PolarHBondContact O-N 3Å; A217-Y219 PolarHBondContact O-N 3.16Å; A217-K220 WeakPolarHBondContact O-CB 3.3Å; A217-K220 PolarHBondContact O-N 3.41Å; A217-K220 VanDerWaalsContact O-N 3.13Å
218	D	56.9	Low	66.6	Low	104 Å²	104	85.7 Å²	85.7	56%	0.556	46%	0.456	S	S	*	.	G	3₁₀ helix	trans	-67.4	-33	-172.6	-66.1	-21.4	0	0	0	113.5	N216 K220 N221	N216-D218 PolarHBondContact O-N 2.74Å; D218-K220 VanDerWaalsContact C-N 3.3Å; D218-K220 PolarHBondContact O-N 3.24Å; D218-N221 PolarHBondContact O-N 3.07Å
219	Y	66.8	Low	67.8	Low	35 Å²	35	81.8 Å²	81.8	14%	0.137	43%	0.433	C	S	.	.	G	3₁₀ helix	trans	-72.5	-24.4	175.6	81.1	-90.7	0	0	0	112.7	V146 N216 A217 N221 F222	V146-Y219 HydrophobicContact CG1-CD1 4.34Å; V146-Y219 HydrophobicContact CG1-CE1 4.44Å; V146-Y219 HydrophobicContact CG1-CG 4.47Å; N216-Y219 HydrophobicContact CB-CD1 4.32Å; N216-Y219 HydrophobicContact CB-CE1 4.43Å; N216-Y219 WeakPolarHBondContact O-CD1 3.45Å; N216-Y219 WeakPolarHBondContact O-CE1 3.27Å; A217-Y219 PolarHBondContact O-N 3.16Å; Y219-N221 PolarHBondContact O-N 2.97Å; Y219-F222 VanDerWaalsContact O-CB 3.27Å; Y219-F222 WeakPolarHBondContact O-CB 3.47Å; Y219-F222 PolarHBondContact O-N 3.5Å
220	K	67.3	Low	69.6	Low	156 Å²	156	77.5 Å²	77.5	68%	0.678	40%	0.403	S	S	*	.	G	3₁₀ helix	trans	-71.2	-19.5	174.6	-66.7	-175.6	176.8	179.3	0	112	A217 D218 F222	A217-K220 WeakPolarHBondContact O-CB 3.3Å; A217-K220 PolarHBondContact O-N 3.41Å; A217-K220 VanDerWaalsContact O-N 3.13Å; D218-K220 VanDerWaalsContact C-N 3.3Å; D218-K220 PolarHBondContact O-N 3.24Å; K220-F222 VanDerWaalsContact C-N 3.34Å
221	N	72.1	Confident	71.8	Confident	120 Å²	120	70.6 Å²	70.6	64%	0.642	37%	0.367	S	S	*	.	G	3₁₀ helix	trans	-89.1	1.7	173.7	-64.6	-22.5	0	0	0	112.9	D218 Y219 T223	D218-N221 PolarHBondContact O-N 3.07Å; Y219-N221 PolarHBondContact O-N 2.97Å; N221-T223 PolarHBondContact O-N 2.91Å; N221-T223 VanDerWaalsContact O-N 3.13Å
222	F	80.8	Confident	74.2	Confident	13 Å²	13	69.1 Å²	69.1	6%	0.057	36%	0.357	C	S	.	.			trans	-76.7	100.2	179.3	-169.1	-117.2	0	0	0	111	Y139 L175 Q177 I203 Y219 K220 L224	Y139-F222 WeakPolarHBondContact CE1-O 3.45Å; L175-F222 HydrophobicContact CD1-CE1 4.2Å; L175-F222 HydrophobicContact CD2-CB 4.45Å; L175-F222 HydrophobicContact CD2-CD1 3.58Å; L175-F222 HydrophobicContact CD2-CE1 3.86Å; L175-F222 HydrophobicContact CD2-CG 4.04Å; L175-F222 HydrophobicContact CG-CD1 4.05Å; L175-F222 HydrophobicContact CG-CE1 3.77Å; L175-F222 HydrophobicContact CG-CZ 4.18Å; Q177-F222 HydrophobicContact CB-CE1 4.26Å; Q177-F222 HydrophobicContact CB-CZ 3.77Å; Q177-F222 HydrophobicContact CG-CE1 4.41Å; Q177-F222 HydrophobicContact CG-CE2 4.12Å; Q177-F222 HydrophobicContact CG-CZ 3.57Å; I203-F222 HydrophobicContact CD1-CB 4.05Å; I203-F222 HydrophobicContact CD1-CD2 3.35Å; I203-F222 HydrophobicContact CD1-CE2 4.08Å; I203-F222 HydrophobicContact CD1-CG 4.06Å; I203-F222 HydrophobicContact CG1-CD2 3.91Å; I203-F222 HydrophobicContact CG1-CE2 4.14Å; Y219-F222 VanDerWaalsContact O-CB 3.27Å; Y219-F222 WeakPolarHBondContact O-CB 3.47Å; Y219-F222 PolarHBondContact O-N 3.5Å; K220-F222 VanDerWaalsContact C-N 3.34Å; F222-L224 HydrophobicContact CD1-CD2 3.89Å; F222-L224 HydrophobicContact CD1-CG 4.47Å; F222-L224 HydrophobicContact CE1-CD2 3.46Å; F222-L224 VanDerWaalsContact CE1-CD2 3.46Å; F222-L224 HydrophobicContact CE1-CG 4.49Å; F222-L224 HydrophobicContact CZ-CD2 4.35Å
223	T	88.7	Confident	76.5	Confident	99 Å²	99	64.8 Å²	64.8	61%	0.607	33%	0.328	S	S	*	.			trans	-90.4	116.8	179.7	56.1	0	0	0	0	111.5	Q177 N221	Q177-T223 PolarHBondContact NE2-O 3.4Å; N221-T223 PolarHBondContact O-N 2.91Å; N221-T223 VanDerWaalsContact O-N 3.13Å
224	L	91.3	Very high	78.7	Confident	13 Å²	13	58.3 Å²	58.3	7%	0.068	29%	0.289	C	S	.	.			trans	-78.9	132.4	177.1	-63.6	175.1	0	0	0	111.9	L138 Y139 I142 Q177 F222 F226 V232	L138-L224 HydrophobicContact CD2-CD1 3.71Å; L138-L224 HydrophobicContact CG-CD1 4.34Å; Y139-L224 HydrophobicContact CD1-CD1 4.21Å; Y139-L224 HydrophobicContact CE1-CB 4.35Å; Y139-L224 HydrophobicContact CE1-CD1 3.77Å; Y139-L224 HydrophobicContact CE1-CG 3.79Å; Y139-L224 WeakPolarHBondContact OH-CB 3.43Å; Y139-L224 PolarHBondContact OH-N 2.59Å; I142-L224 HydrophobicContact CD1-CD1 3.85Å; Q177-L224 HydrophobicContact CB-CD2 4.24Å; F222-L224 HydrophobicContact CD1-CD2 3.89Å; F222-L224 HydrophobicContact CD1-CG 4.47Å; F222-L224 HydrophobicContact CE1-CD2 3.46Å; F222-L224 VanDerWaalsContact CE1-CD2 3.46Å; F222-L224 HydrophobicContact CE1-CG 4.49Å; F222-L224 HydrophobicContact CZ-CD2 4.35Å; L224-F226 HydrophobicContact CB-CD2 4.24Å; L224-F226 HydrophobicContact CB-CE2 3.89Å; L224-F226 HydrophobicContact CB-CZ 4.15Å; L224-F226 HydrophobicContact CD1-CZ 4.05Å; L224-F226 WeakPolarHBondContact O-CD2 3.3Å; L224-F226 PolarHBondContact O-N 3.37Å; L224-V232 HydrophobicContact CD1-CG2 4.38Å; L224-V232 HydrophobicContact CD2-CG2 3.61Å
225	Q	90.6	Very high	81.2	Confident	53 Å²	53	54.3 Å²	54.3	25%	0.248	26%	0.263	C	S	.	.			trans	-91.7	66.7	179.2	-64.2	-179.3	-20.4	0	0	111.9	Y179 Y227 K228 L229	Y179-Q225 VanDerWaalsContact CD2-OE1 3.25Å; Q225-Y227 VanDerWaalsContact C-N 3.3Å; Q225-Y227 HydrophobicContact CB-CE1 4.47Å; Q225-Y227 PolarHBondContact O-N 3.02Å; Q225-Y227 VanDerWaalsContact O-N 3.09Å; Q225-K228 HydrophobicContact CB-CG 4Å; Q225-K228 VanDerWaalsContact CD-CE 3.42Å; Q225-K228 CarbonylContact O-C 3.56Å; Q225-K228 PolarHBondContact O-N 3.4Å; Q225-K228 VanDerWaalsContact OE1-NZ 3.16Å; Q225-L229 VanDerWaalsContact O-CB 3.31Å; Q225-L229 WeakPolarHBondContact O-CB 3.23Å; Q225-L229 PolarHBondContact O-N 2.86Å
226	F	90.5	Very high	83.6	Confident	38 Å²	38	45.6 Å²	45.6	17%	0.167	23%	0.23	C	C	.	.	G	3₁₀ helix	trans	-47.1	-42.4	-170.7	-71.9	-84.3	0	0	0	115.9	Q135 L138 Y139 L224 K228 L229	Q135-F226 HydrophobicContact CB-CE1 4.06Å; Q135-F226 HydrophobicContact CB-CE2 3.93Å; Q135-F226 HydrophobicContact CB-CZ 3.6Å; Q135-F226 HydrophobicContact CG-CD1 4.02Å; Q135-F226 HydrophobicContact CG-CD2 4.08Å; Q135-F226 HydrophobicContact CG-CE1 3.74Å; Q135-F226 HydrophobicContact CG-CE2 3.83Å; Q135-F226 HydrophobicContact CG-CG 4.17Å; Q135-F226 HydrophobicContact CG-CZ 3.66Å; L138-F226 HydrophobicContact CD2-CD1 4.43Å; L138-F226 HydrophobicContact CD2-CE1 3.43Å; L138-F226 VanDerWaalsContact CD2-CE1 3.43Å; L138-F226 HydrophobicContact CD2-CZ 3.94Å; Y139-F226 HydrophobicContact CD2-CZ 4.31Å; Y139-F226 AromaticContact CE2-CE2 3.66Å; Y139-F226 HydrophobicContact CE2-CE2 3.66Å; Y139-F226 AromaticContact CE2-CZ 3.8Å; Y139-F226 HydrophobicContact CE2-CZ 3.8Å; L224-F226 HydrophobicContact CB-CD2 4.24Å; L224-F226 HydrophobicContact CB-CE2 3.89Å; L224-F226 HydrophobicContact CB-CZ 4.15Å; L224-F226 HydrophobicContact CD1-CZ 4.05Å; L224-F226 WeakPolarHBondContact O-CD2 3.3Å; L224-F226 PolarHBondContact O-N 3.37Å; F226-K228 PolarHBondContact O-N 3.37Å; F226-L229 HydrophobicContact CD1-CD2 4.38Å; F226-L229 PolarHBondContact O-N 2.79Å
227	Y	88.5	Confident	85.6	Confident	130 Å²	130	46 Å²	46	51%	0.51	23%	0.231	S	C	.	.	G	3₁₀ helix	trans	-65.4	-23	-175.3	61	-89.9	0	0	0	113.4	G183 I185 Q225	G183-Y227 WeakPolarHBondContact O-CD2 3.33Å; G183-Y227 WeakPolarHBondContact O-CE2 3.32Å; I185-Y227 WeakPolarHBondContact CD1-O 3.33Å; Q225-Y227 VanDerWaalsContact C-N 3.3Å; Q225-Y227 HydrophobicContact CB-CE1 4.47Å; Q225-Y227 PolarHBondContact O-N 3.02Å; Q225-Y227 VanDerWaalsContact O-N 3.09Å
228	K	91.9	Very high	87.6	Confident	20 Å²	20	43.6 Å²	43.6	9%	0.087	21%	0.211	C	C	.	.	G	3₁₀ helix	trans	-125	12.2	177.7	59.4	-179.7	-164.4	166.7	0	113.3	Y179 F180 K181 Q225 F226	Y179-K228 CarbonylContact C-O 3.57Å; Y179-K228 WeakPolarHBondContact CA-O 3.42Å; Y179-K228 WeakPolarHBondContact CB-O 3.41Å; Y179-K228 HydrophobicContact CD2-CD 4.28Å; Y179-K228 HydrophobicContact CD2-CG 4.5Å; F180-K228 HydrophobicContact CB-CB 4.29Å; F180-K228 PolarHBondContact N-O 2.76Å; F180-K228 VanDerWaalsContact O-CD 3.3Å; F180-K228 WeakPolarHBondContact O-CD 3.27Å; K181-K228 PolarHBondContact O-NZ 2.75Å; K181-K228 VanDerWaalsContact O-NZ 3.15Å; Q225-K228 HydrophobicContact CB-CG 4Å; Q225-K228 VanDerWaalsContact CD-CE 3.42Å; Q225-K228 CarbonylContact O-C 3.56Å; Q225-K228 PolarHBondContact O-N 3.4Å; Q225-K228 VanDerWaalsContact OE1-NZ 3.16Å; F226-K228 PolarHBondContact O-N 3.37Å
229	L	94.3	Very high	89.4	Confident	2 Å²	2	43.7 Å²	43.7	1%	0.01	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.2	122.6	-176.9	-179.4	70.5	0	0	0	111	Q177 Q225 F226 V232 N265 H268	Q177-L229 HydrophobicContact CB-CD1 4.09Å; Q225-L229 VanDerWaalsContact O-CB 3.31Å; Q225-L229 WeakPolarHBondContact O-CB 3.23Å; Q225-L229 PolarHBondContact O-N 2.86Å; F226-L229 HydrophobicContact CD1-CD2 4.38Å; F226-L229 PolarHBondContact O-N 2.79Å; L229-V232 HydrophobicContact CD1-CG2 3.82Å; L229-V232 HydrophobicContact CD2-CG2 4Å; L229-V232 HydrophobicContact CG-CG2 4.42Å; L229-N265 PolarHBondContact O-ND2 2.87Å; L229-H268 PolarHBondContact O-CE1 3.34Å
230	I	94.7	Very high	90.7	Very high	20 Å²	20	42.4 Å²	42.4	10%	0.103	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.4	-52.5	175.5	-60.4	166.4	0	0	0	109.7	R178 F180 V198 N265 K266	R178-I230 WeakPolarHBondContact O-CB 3.23Å; R178-I230 PolarHBondContact O-N 3.4Å; F180-I230 HydrophobicContact CD1-CD1 3.89Å; F180-I230 HydrophobicContact CD1-CG1 4.45Å; F180-I230 HydrophobicContact CD2-CD1 4.46Å; F180-I230 HydrophobicContact CD2-CG1 4.16Å; F180-I230 HydrophobicContact CE1-CD1 3.66Å; F180-I230 HydrophobicContact CE1-CG1 4.11Å; F180-I230 HydrophobicContact CE2-CD1 4.25Å; F180-I230 HydrophobicContact CE2-CG1 3.8Å; F180-I230 HydrophobicContact CG-CD1 4.29Å; F180-I230 HydrophobicContact CG-CG1 4.47Å; F180-I230 HydrophobicContact CZ-CD1 3.86Å; F180-I230 HydrophobicContact CZ-CG1 3.77Å; V198-I230 HydrophobicContact CB-CD1 4.39Å; V198-I230 HydrophobicContact CG1-CD1 3.97Å; V198-I230 HydrophobicContact CG2-CD1 3.68Å; I230-N265 CarbonylContact O-C 3.58Å; I230-N265 VanDerWaalsContact O-C 3.31Å; I230-N265 WeakPolarHBondContact O-CA 3.49Å; I230-N265 WeakPolarHBondContact O-CB 3.41Å; I230-N265 PolarHBondContact O-N 3.46Å; I230-K266 HydrophobicContact CG2-CG 3.83Å; I230-K266 PolarHBondContact O-N 3.31Å
231	N	96.5	Very high	91.8	Very high	12 Å²	12	39.3 Å²	39.3	6%	0.064	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-160.5	164.1	174.6	63.7	3.6	0	0	0	112	R178 V262 F263	R178-N231 VanDerWaalsContact CB-OD1 3.28Å; R178-N231 WeakPolarHBondContact CB-OD1 3.16Å; R178-N231 WeakPolarHBondContact CD-OD1 3.09Å; R178-N231 WeakPolarHBondContact CG-OD1 3.27Å; R178-N231 PolarHBondContact N-O 2.94Å; R178-N231 PolarHBondContact O-N 2.57Å; N231-V262 HydrophobicContact CB-CG1 4.48Å; N231-F263 WeakPolarHBondContact CA-O 3.35Å; N231-F263 WeakPolarHBondContact CB-O 3.49Å
232	V	96.2	Very high	92.6	Very high	0 Å²	0	33.8 Å²	33.8	0%	0	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	136.8	167.4	-177.8	0	0	0	0	107.9	I142 L175 C176 Q177 L224 L229 F263	I142-V232 HydrophobicContact CD1-CG1 4.08Å; L175-V232 HydrophobicContact CD1-CG1 3.75Å; C176-V232 CarbonylContact O-C 3.56Å; C176-V232 VanDerWaalsContact O-CA 3.32Å; C176-V232 WeakPolarHBondContact O-CA 3.38Å; C176-V232 WeakPolarHBondContact O-CG1 3.26Å; Q177-V232 HydrophobicContact CB-CG2 4.4Å; L224-V232 HydrophobicContact CD1-CG2 4.38Å; L224-V232 HydrophobicContact CD2-CG2 3.61Å; L229-V232 HydrophobicContact CD1-CG2 3.82Å; L229-V232 HydrophobicContact CD2-CG2 4Å; L229-V232 HydrophobicContact CG-CG2 4.42Å; V232-F263 HydrophobicContact CB-CB 4.1Å; V232-F263 HydrophobicContact CB-CD2 4.18Å; V232-F263 HydrophobicContact CB-CG 4.49Å; V232-F263 HydrophobicContact CG1-CD2 4.38Å; V232-F263 PolarHBondContact N-O 2.91Å; V232-F263 PolarHBondContact O-N 3.12Å
233	T	96.4	Very high	92.8	Very high	4 Å²	4	38.6 Å²	38.6	3%	0.025	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	138.7	174.7	66.8	0	0	0	0	110.8	C176 D235 I261 V262	C176-T233 PolarHBondContact N-O 3.46Å; C176-T233 PolarHBondContact O-N 2.92Å; T233-D235 WeakPolarHBondContact CB-OD2 3.23Å; T233-D235 PolarHBondContact OG1-OD2 3.3Å; T233-I261 CarbonylContact C-O 3.58Å; T233-I261 VanDerWaalsContact CA-O 3.3Å; T233-I261 WeakPolarHBondContact CA-O 3.48Å; T233-V262 HydrophobicContact CG2-CG2 4.36Å
234	V	95.5	Very high	92.4	Very high	0 Å²	0	38 Å²	38	0%	0	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	111.1	167.9	-171.7	0	0	0	0	107.2	V145 L173 S174 L175 F236 T260 I261 F263	V145-V234 HydrophobicContact CG1-CB 4.32Å; V145-V234 HydrophobicContact CG1-CG1 3.86Å; V145-V234 HydrophobicContact CG1-CG2 4.47Å; L173-V234 HydrophobicContact CD1-CG1 3.91Å; L173-V234 HydrophobicContact CD2-CG1 4.06Å; L173-V234 HydrophobicContact CG-CG1 4.09Å; S174-V234 WeakPolarHBondContact O-CA 3.32Å; L175-V234 HydrophobicContact CD1-CG2 3.73Å; V234-F236 HydrophobicContact CG1-CD1 4.15Å; V234-F236 HydrophobicContact CG1-CE1 4.3Å; V234-T260 WeakPolarHBondContact O-CA 3.31Å; V234-I261 HydrophobicContact CB-CB 4.28Å; V234-I261 PolarHBondContact N-O 2.99Å; V234-I261 PolarHBondContact O-N 3.08Å; V234-F263 HydrophobicContact CG2-CE2 4.16Å
235	D	95.6	Very high	91.7	Very high	35 Å²	35	37.7 Å²	37.7	19%	0.187	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	126.7	-171.3	-61.2	-57.5	0	0	0	109.6	S174 T233 I259 T260	S174-D235 PolarHBondContact N-O 3.01Å; S174-D235 PolarHBondContact O-N 3.34Å; S174-D235 WeakPolarHBondContact OG-CB 3.35Å; S174-D235 PolarHBondContact OG-O 3.45Å; T233-D235 WeakPolarHBondContact CB-OD2 3.23Å; T233-D235 PolarHBondContact OG1-OD2 3.3Å; D235-I259 WeakPolarHBondContact CA-O 3.41Å; D235-T260 WeakPolarHBondContact OD1-CB 3.43Å; D235-T260 WeakPolarHBondContact OD1-CG2 3.21Å; D235-T260 PolarHBondContact OD1-OG1 2.91Å
236	F	95.1	Very high	91.1	Very high	8 Å²	8	38.4 Å²	38.4	4%	0.035	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-155.7	163.1	175.6	56.7	-90	0	0	0	111.3	F120 Y149 L173 V234 L238 I259 I261	F120-F236 HydrophobicContact CD1-CZ 4.18Å; F120-F236 AromaticContact CD2-CZ 3.88Å; F120-F236 HydrophobicContact CD2-CZ 3.88Å; F120-F236 HydrophobicContact CE1-CE2 4.33Å; F120-F236 AromaticContact CE1-CZ 3.92Å; F120-F236 HydrophobicContact CE1-CZ 3.92Å; F120-F236 AromaticContact CE2-CE2 3.81Å; F120-F236 HydrophobicContact CE2-CE2 3.81Å; F120-F236 AromaticContact CE2-CZ 3.59Å; F120-F236 HydrophobicContact CE2-CZ 3.59Å; F120-F236 HydrophobicContact CG-CZ 4.18Å; F120-F236 AromaticContact CZ-CE2 3.7Å; F120-F236 HydrophobicContact CZ-CE2 3.7Å; F120-F236 AromaticContact CZ-CZ 3.61Å; F120-F236 HydrophobicContact CZ-CZ 3.61Å; Y149-F236 HydrophobicContact CD2-CB 4.36Å; Y149-F236 HydrophobicContact CD2-CD1 4.21Å; Y149-F236 AromaticContact CD2-CD2 3.62Å; Y149-F236 HydrophobicContact CD2-CD2 3.62Å; Y149-F236 HydrophobicContact CD2-CE1 4.4Å; Y149-F236 AromaticContact CD2-CE2 3.83Å; Y149-F236 HydrophobicContact CD2-CE2 3.83Å; Y149-F236 AromaticContact CD2-CG 3.81Å; Y149-F236 HydrophobicContact CD2-CG 3.81Å; Y149-F236 HydrophobicContact CD2-CZ 4.22Å; Y149-F236 HydrophobicContact CE2-CB 3.73Å; Y149-F236 HydrophobicContact CE2-CD1 4.4Å; Y149-F236 AromaticContact CE2-CD2 3.43Å; Y149-F236 HydrophobicContact CE2-CD2 3.43Å; Y149-F236 VanDerWaalsContact CE2-CD2 3.43Å; Y149-F236 HydrophobicContact CE2-CE2 4.09Å; Y149-F236 AromaticContact CE2-CG 3.6Å; Y149-F236 HydrophobicContact CE2-CG 3.6Å; L173-F236 HydrophobicContact CB-CB 4.07Å; L173-F236 HydrophobicContact CD1-CB 4.24Å; L173-F236 HydrophobicContact CD1-CD1 3.73Å; L173-F236 HydrophobicContact CD1-CE1 4.41Å; L173-F236 HydrophobicContact CD1-CG 4.2Å; L173-F236 HydrophobicContact CG-CB 4.13Å; L173-F236 HydrophobicContact CG-CD1 4.23Å; V234-F236 HydrophobicContact CG1-CD1 4.15Å; V234-F236 HydrophobicContact CG1-CE1 4.3Å; F236-L238 HydrophobicContact CD2-CD1 4.37Å; F236-L238 HydrophobicContact CD2-CD2 4.38Å; F236-L238 HydrophobicContact CD2-CG 3.98Å; F236-L238 HydrophobicContact CE2-CD1 3.9Å; F236-L238 HydrophobicContact CE2-CG 4.02Å; F236-I259 HydrophobicContact CD2-CB 4.26Å; F236-I259 HydrophobicContact CD2-CD1 4.26Å; F236-I259 HydrophobicContact CE1-CB 4.48Å; F236-I259 HydrophobicContact CE1-CG2 4.16Å; F236-I259 HydrophobicContact CE2-CB 3.85Å; F236-I259 HydrophobicContact CE2-CD1 3.55Å; F236-I259 HydrophobicContact CE2-CG1 4.31Å; F236-I259 HydrophobicContact CE2-CG2 4.08Å; F236-I259 HydrophobicContact CZ-CB 3.98Å; F236-I259 HydrophobicContact CZ-CD1 4.19Å; F236-I259 HydrophobicContact CZ-CG2 3.7Å; F236-I259 PolarHBondContact N-O 2.84Å; F236-I259 PolarHBondContact O-N 3.15Å; F236-I261 HydrophobicContact CE1-CD1 4.22Å
237	Q	95.7	Very high	90.3	Very high	54 Å²	54	42.9 Å²	42.9	25%	0.252	21%	0.207	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	137.2	176.9	-66.7	-170.5	1.1	0	0	112	V163 V166 T256 F257 A258	V163-Q237 HydrophobicContact CB-CB 3.92Å; V163-Q237 HydrophobicContact CG2-CB 3.92Å; V163-Q237 PolarHBondContact N-O 3.35Å; V166-Q237 HydrophobicContact CG1-CG 4.33Å; Q237-T256 HydrophobicContact CB-CG2 4.32Å; Q237-F257 CarbonylContact C-O 3.46Å; Q237-F257 VanDerWaalsContact CA-O 3.27Å; Q237-F257 WeakPolarHBondContact CA-O 3.38Å; Q237-A258 HydrophobicContact CG-CB 4.14Å
238	L	94.9	Very high	89.3	Confident	0 Å²	0	40.6 Å²	40.6	0%	0	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	138	175.4	-64.1	179.4	0	0	0	110.5	F116 F120 Y149 L152 Y160 A161 Y162 F236 T256 F257 I259	F116-L238 HydrophobicContact CD1-CD1 4.47Å; F116-L238 HydrophobicContact CE1-CD1 3.89Å; F116-L238 HydrophobicContact CZ-CD1 4.33Å; F120-L238 HydrophobicContact CE2-CD1 4.35Å; F120-L238 HydrophobicContact CZ-CD1 4.15Å; Y149-L238 HydrophobicContact CE2-CD2 4.06Å; L152-L238 HydrophobicContact CD2-CD1 3.59Å; L152-L238 HydrophobicContact CD2-CD2 3.58Å; L152-L238 HydrophobicContact CD2-CG 4.26Å; Y160-L238 HydrophobicContact CG-CD1 4.46Å; A161-L238 WeakPolarHBondContact O-CA 3.27Å; Y162-L238 HydrophobicContact CD1-CD2 3.82Å; Y162-L238 HydrophobicContact CE1-CD2 4.23Å; F236-L238 HydrophobicContact CD2-CD1 4.37Å; F236-L238 HydrophobicContact CD2-CD2 4.38Å; F236-L238 HydrophobicContact CD2-CG 3.98Å; F236-L238 HydrophobicContact CE2-CD1 3.9Å; F236-L238 HydrophobicContact CE2-CG 4.02Å; L238-T256 CarbonylContact O-C 3.53Å; L238-T256 WeakPolarHBondContact O-CA 3.48Å; L238-F257 PolarHBondContact N-O 3.07Å; L238-F257 PolarHBondContact O-N 3.27Å; L238-I259 HydrophobicContact CB-CD1 4.5Å; L238-I259 HydrophobicContact CD1-CD1 3.72Å; L238-I259 HydrophobicContact CG-CD1 4.15Å
239	K	93.8	Very high	88.2	Confident	105 Å²	105	45.4 Å²	45.4	46%	0.457	23%	0.23	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.3	138.5	171.3	-75	178.7	178.4	-176.7	0	110.9	Y160 A161 V163 Y255 T256	Y160-K239 CarbonylContact C-O 3.51Å; Y160-K239 WeakPolarHBondContact CA-O 3.27Å; A161-K239 HydrophobicContact CB-CB 4.26Å; A161-K239 PolarHBondContact N-O 3.46Å; A161-K239 PolarHBondContact O-N 3.33Å; V163-K239 HydrophobicContact CG2-CD 3.99Å; V163-K239 HydrophobicContact CG2-CG 3.71Å; K239-Y255 CarbonylContact C-O 3.31Å; K239-Y255 VanDerWaalsContact CA-O 3.24Å; K239-Y255 WeakPolarHBondContact CA-O 3.2Å; K239-T256 HydrophobicContact CG-CG2 4.24Å
240	A	93.9	Very high	87.1	Confident	8 Å²	8	46.9 Å²	46.9	7%	0.066	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.1	159.9	171.9	0	0	0	0	0	109.8	F108 Y160 Y255 F257	F108-A240 HydrophobicContact CZ-CB 4.29Å; Y160-A240 HydrophobicContact CD1-CB 3.99Å; Y160-A240 HydrophobicContact CE1-CB 4.05Å; A240-Y255 PolarHBondContact N-O 3.24Å; A240-Y255 PolarHBondContact O-N 3.1Å; A240-F257 HydrophobicContact CB-CD2 4.3Å; A240-F257 HydrophobicContact CB-CE2 3.78Å
241	I	91.3	Very high	86.1	Confident	92 Å²	92	49.6 Å²	49.6	47%	0.472	25%	0.25	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	130.3	176.8	-58.8	174.5	0	0	0	107.8	I243 P252	I241-I243 HydrophobicContact CG2-CG1 4.36Å; I241-I243 PolarHBondContact O-N 2.96Å; I241-P252 HydrophobicContact CG2-CB 3.64Å
242	N	87.9	Confident	85.2	Confident	3 Å²	3	49.8 Å²	49.8	2%	0.016	25%	0.252	C	S	.	.			trans	-87.2	94.4	177.2	-174.4	2.7	0	0	0	110.9	F108 Q244 T245 D253 Y255	F108-N242 HydrophobicContact CD1-CB 4Å; F108-N242 HydrophobicContact CD2-CB 4.09Å; F108-N242 HydrophobicContact CE1-CB 3.86Å; F108-N242 HydrophobicContact CE2-CB 3.95Å; F108-N242 HydrophobicContact CG-CB 4.12Å; F108-N242 HydrophobicContact CZ-CB 3.83Å; N242-Q244 VanDerWaalsContact C-N 3.31Å; N242-Q244 VanDerWaalsContact OD1-CB 3.31Å; N242-Q244 WeakPolarHBondContact OD1-CB 3.35Å; N242-Q244 PolarHBondContact OD1-N 2.71Å; N242-T245 HydrophobicContact CB-CG2 4.48Å; N242-T245 PolarHBondContact O-OG1 2.82Å; N242-D253 PolarHBondContact N-O 3.12Å; N242-D253 VanDerWaalsContact N-O 3.14Å; N242-Y255 HydrophobicContact CB-CD2 3.89Å; N242-Y255 HydrophobicContact CB-CE2 3.45Å; N242-Y255 VanDerWaalsContact CB-CE2 3.45Å
243	I	85.6	Confident	84.6	Confident	115 Å²	115	50.4 Å²	50.4	59%	0.59	26%	0.256	S	S	*	.	G	3₁₀ helix	trans	-76.1	-19.6	-177.6	-52.4	176	0	0	0	111.8	I241 T245 I246	I241-I243 HydrophobicContact CG2-CG1 4.36Å; I241-I243 PolarHBondContact O-N 2.96Å; I243-T245 PolarHBondContact O-N 2.88Å; I243-T245 VanDerWaalsContact O-N 3.15Å; I243-I246 HydrophobicContact CG2-CD1 3.78Å; I243-I246 WeakPolarHBondContact O-CB 3.17Å; I243-I246 WeakPolarHBondContact O-CG1 3.3Å; I243-I246 PolarHBondContact O-N 3.35Å; I243-I246 VanDerWaalsContact O-N 3.11Å
244	Q	81.1	Confident	84.3	Confident	87 Å²	87	52 Å²	52	41%	0.407	27%	0.266	S	S	.	.	G	3₁₀ helix	trans	-60	-28.4	-179	-175	-179.2	-11.1	0	0	112.7	N242 I246 I247	N242-Q244 VanDerWaalsContact C-N 3.31Å; N242-Q244 VanDerWaalsContact OD1-CB 3.31Å; N242-Q244 WeakPolarHBondContact OD1-CB 3.35Å; N242-Q244 PolarHBondContact OD1-N 2.71Å; Q244-I246 PolarHBondContact O-N 3.25Å; Q244-I247 HydrophobicContact CG-CD1 4.4Å; Q244-I247 WeakPolarHBondContact O-CB 3.33Å; Q244-I247 PolarHBondContact O-N 3.37Å; Q244-I247 VanDerWaalsContact O-N 3.09Å
245	T	76.6	Confident	84.1	Confident	5 Å²	5	52 Å²	52	3%	0.031	27%	0.267	C	S	.	.	G	3₁₀ helix	trans	-56.9	-30.2	176.5	53.3	0	0	0	0	113.3	N242 I243 I247 N248 N249 E250 P252	N242-T245 HydrophobicContact CB-CG2 4.48Å; N242-T245 PolarHBondContact O-OG1 2.82Å; I243-T245 PolarHBondContact O-N 2.88Å; I243-T245 VanDerWaalsContact O-N 3.15Å; T245-I247 PolarHBondContact O-N 3Å; T245-N248 CarbonylContact O-C 3.55Å; T245-N248 PolarHBondContact O-N 2.84Å; T245-N249 PolarHBondContact O-N 3Å; T245-E250 CarbonylContact C-O 3.55Å; T245-E250 PolarHBondContact O-N 2.82Å; T245-P252 VanDerWaalsContact OG1-CA 3.28Å; T245-P252 WeakPolarHBondContact OG1-CA 3.43Å
246	I	77.6	Confident	84	Confident	69 Å²	69	51 Å²	51	35%	0.354	26%	0.262	S	S	.	.	G	3₁₀ helix	trans	-61.8	-33.1	177.8	-61	175.2	0	0	0	111.3	I243 Q244 N248 N249 P252	I243-I246 HydrophobicContact CG2-CD1 3.78Å; I243-I246 WeakPolarHBondContact O-CB 3.17Å; I243-I246 WeakPolarHBondContact O-CG1 3.3Å; I243-I246 PolarHBondContact O-N 3.35Å; I243-I246 VanDerWaalsContact O-N 3.11Å; Q244-I246 PolarHBondContact O-N 3.25Å; I246-N248 PolarHBondContact O-N 3.36Å; I246-N249 PolarHBondContact O-N 3.44Å; I246-P252 HydrophobicContact CD1-CG 3.74Å; I246-P252 HydrophobicContact CG1-CG 3.6Å
247	I	72.8	Confident	84	Confident	132 Å²	132	50.7 Å²	50.7	68%	0.677	26%	0.26	S	S	*	.	G	3₁₀ helix	trans	-61.8	-29.4	178.4	-60.4	171.6	0	0	0	110.8	Q244 T245	Q244-I247 HydrophobicContact CG-CD1 4.4Å; Q244-I247 WeakPolarHBondContact O-CB 3.33Å; Q244-I247 PolarHBondContact O-N 3.37Å; Q244-I247 VanDerWaalsContact O-N 3.09Å; T245-I247 PolarHBondContact O-N 3Å
248	N	67.8	Low	84	Confident	82 Å²	82	49.3 Å²	49.3	44%	0.439	26%	0.258	S	S	.	.	G	3₁₀ helix	trans	-100.5	19.1	179.7	-71.4	-7.4	0	0	0	112.9	M104 T245 I246 E250	M104-N248 WeakPolarHBondContact CE-ND2 3.18Å; M104-N248 HydrophobicContact SD-CB 4.49Å; M104-N248 PolarHBondContact SD-ND2 2.9Å; T245-N248 CarbonylContact O-C 3.55Å; T245-N248 PolarHBondContact O-N 2.84Å; I246-N248 PolarHBondContact O-N 3.36Å; N248-E250 PolarHBondContact O-N 3.28Å
249	N	69.8	Low	84	Confident	120 Å²	120	49.3 Å²	49.3	64%	0.642	26%	0.258	S	S	*	.	T	Hydrogen-bonded Turn	trans	56.5	33.6	-177.8	-61.3	9.1	0	0	0	113.4	T245 I246	T245-N249 PolarHBondContact O-N 3Å; I246-N249 PolarHBondContact O-N 3.44Å
250	E	70.1	Confident	84.1	Confident	34 Å²	34	46.1 Å²	46.1	16%	0.159	25%	0.248	C	C	.	.			trans	-108.3	147.7	174.5	-71.8	171.7	-148.2	0	0	110.5	T245 N248 R299	T245-E250 CarbonylContact C-O 3.55Å; T245-E250 PolarHBondContact O-N 2.82Å; N248-E250 PolarHBondContact O-N 3.28Å; E250-R299 IonicContact OE1-CZ 3.47Å; E250-R299 IonicContact OE1-NH1 3.92Å; E250-R299 PolarHBondContact OE1-NH1 2.97Å; E250-R299 IonicContact OE1-NH2 2.76Å; E250-R299 PolarHBondContact OE1-NH2 3.13Å; E250-R299 IonicContact OE2-NH1 3.43Å
251	I	73.7	Confident	84.3	Confident	76 Å²	76	45.7 Å²	45.7	39%	0.39	24%	0.244	S	C	.	.	P	Polyproline II helix	trans	-71.4	134.9	176.6	-59.5	174.7	0	0	0	108.8	D253 T288	I251-D253 PolarHBondContact O-N 3.01Å; I251-T288 HydrophobicContact CG2-CG2 3.81Å
252	P	78.9	Confident	84.5	Confident	16 Å²	16	42.3 Å²	42.3	10%	0.104	23%	0.228	C	C	.	.	P	Polyproline II helix	trans	-57.5	128.4	176.3	-25.7	33.3	0	0	0	114	I241 T245 I246 C285	I241-P252 HydrophobicContact CG2-CB 3.64Å; T245-P252 VanDerWaalsContact OG1-CA 3.28Å; T245-P252 WeakPolarHBondContact OG1-CA 3.43Å; I246-P252 HydrophobicContact CD1-CG 3.74Å; I246-P252 HydrophobicContact CG1-CG 3.6Å; P252-C285 PolarHBondContact O-SG 3.47Å
253	D	83.3	Confident	84.9	Confident	14 Å²	14	42.2 Å²	42.2	8%	0.075	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.2	147.4	169.9	-73.5	-45	0	0	0	111.9	N242 I251 Y255 I282 K379	N242-D253 PolarHBondContact N-O 3.12Å; N242-D253 VanDerWaalsContact N-O 3.14Å; I251-D253 PolarHBondContact O-N 3.01Å; D253-Y255 HydrophobicContact CB-CD2 4.3Å; D253-Y255 HydrophobicContact CB-CE2 3.76Å; D253-I282 HydrophobicContact CB-CG2 3.77Å; D253-K379 VanDerWaalsContact OD1-CE 3.27Å; D253-K379 WeakPolarHBondContact OD1-CE 3.2Å; D253-K379 IonicContact OD1-NZ 3.81Å; D253-K379 PolarHBondContact OD1-NZ 3.31Å; D253-K379 IonicContact OD2-NZ 3.77Å; D253-K379 PolarHBondContact OD2-NZ 3.41Å
254	C	89.1	Confident	85.4	Confident	36 Å²	36	39.1 Å²	39.1	24%	0.243	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.5	115.1	174.2	-85.3	0	0	0	0	109.5	K283 C285	C254-K283 WeakPolarHBondContact CA-O 3.47Å; C254-K283 WeakPolarHBondContact CB-O 3.31Å; C254-K283 PolarHBondContact N-O 3.48Å; C254-K283 PolarHBondContact O-N 2.94Å; C254-C285 VanDerWaalsContact CA-SG 3.51Å; C254-C285 HydrophobicContact CB-CB 4.22Å; C254-C285 WeakPolarHBondContact CB-SG 3.34Å; C254-C285 PolarHBondContact N-SG 3.38Å; C254-C285 WeakPolarHBondContact SG-CA 3.37Å; C254-C285 WeakPolarHBondContact SG-CB 3.34Å; C254-C285 CovalentContact SG-SG 2.04Å; C254-C285 PolarHBondContact SG-SG 3.31Å
255	Y	91.5	Very high	86.1	Confident	2 Å²	2	35.6 Å²	35.6	1%	0.008	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	136	178.1	-73.5	-106.1	0	0	0	110.1	V105 F108 K239 A240 N242 D253 F257 A280 S281 I282	V105-Y255 HydrophobicContact CG1-CE1 4.28Å; F108-Y255 AromaticContact CD1-CD1 3.98Å; F108-Y255 HydrophobicContact CD1-CD1 3.98Å; F108-Y255 AromaticContact CD1-CD2 3.98Å; F108-Y255 HydrophobicContact CD1-CD2 3.98Å; F108-Y255 AromaticContact CD1-CE1 3.92Å; F108-Y255 HydrophobicContact CD1-CE1 3.92Å; F108-Y255 AromaticContact CD1-CE2 3.94Å; F108-Y255 HydrophobicContact CD1-CE2 3.94Å; F108-Y255 HydrophobicContact CD1-CG 4Å; F108-Y255 AromaticContact CD1-CZ 3.91Å; F108-Y255 HydrophobicContact CE1-CD1 4.09Å; F108-Y255 AromaticContact CE1-CD2 3.63Å; F108-Y255 HydrophobicContact CE1-CD2 3.63Å; F108-Y255 HydrophobicContact CE1-CE1 4.43Å; F108-Y255 HydrophobicContact CE1-CE2 4.03Å; F108-Y255 AromaticContact CE1-CG 3.67Å; F108-Y255 HydrophobicContact CE1-CG 3.67Å; K239-Y255 CarbonylContact C-O 3.31Å; K239-Y255 VanDerWaalsContact CA-O 3.24Å; K239-Y255 WeakPolarHBondContact CA-O 3.2Å; A240-Y255 PolarHBondContact N-O 3.24Å; A240-Y255 PolarHBondContact O-N 3.1Å; N242-Y255 HydrophobicContact CB-CD2 3.89Å; N242-Y255 HydrophobicContact CB-CE2 3.45Å; N242-Y255 VanDerWaalsContact CB-CE2 3.45Å; D253-Y255 HydrophobicContact CB-CD2 4.3Å; D253-Y255 HydrophobicContact CB-CE2 3.76Å; Y255-F257 HydrophobicContact CD1-CE1 4.38Å; Y255-F257 HydrophobicContact CD1-CZ 4.27Å; Y255-F257 HydrophobicContact CG-CZ 4.38Å; Y255-A280 HydrophobicContact CD1-CB 4.46Å; Y255-S281 WeakPolarHBondContact CA-O 3.48Å; Y255-I282 HydrophobicContact CD1-CD1 4.42Å; Y255-I282 HydrophobicContact CD1-CG1 3.93Å; Y255-I282 HydrophobicContact CE1-CD1 3.6Å; Y255-I282 HydrophobicContact CE1-CG1 3.6Å; Y255-I282 HydrophobicContact CE2-CG2 4.46Å
256	T	93.1	Very high	86.8	Confident	14 Å²	14	42 Å²	42	9%	0.086	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	111.8	165.4	-51.9	0	0	0	0	108.4	V163 Q237 L238 K239 S281	V163-T256 HydrophobicContact CG2-CG2 4.28Å; Q237-T256 HydrophobicContact CB-CG2 4.32Å; L238-T256 CarbonylContact O-C 3.53Å; L238-T256 WeakPolarHBondContact O-CA 3.48Å; K239-T256 HydrophobicContact CG-CG2 4.24Å; T256-S281 WeakPolarHBondContact CB-OG 3.43Å; T256-S281 PolarHBondContact N-O 3.04Å; T256-S281 PolarHBondContact O-N 3.29Å; T256-S281 PolarHBondContact O-OG 3.44Å; T256-S281 VanDerWaalsContact O-OG 3.14Å
257	F	95.2	Very high	87.4	Confident	0 Å²	0	42.4 Å²	42.4	0%	0	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.4	117.5	176.4	-63	-67.5	0	0	0	109.5	F108 N112 F116 Q237 L238 A240 Y255 I259 N278 A280	F108-F257 HydrophobicContact CD1-CZ 4.05Å; F108-F257 HydrophobicContact CE1-CE2 4.11Å; F108-F257 AromaticContact CE1-CZ 3.68Å; F108-F257 HydrophobicContact CE1-CZ 3.68Å; N112-F257 HydrophobicContact CB-CE1 4.25Å; N112-F257 HydrophobicContact CB-CE2 4.08Å; N112-F257 HydrophobicContact CB-CZ 3.75Å; F116-F257 HydrophobicContact CE2-CB 3.98Å; F116-F257 HydrophobicContact CE2-CD1 4.27Å; F116-F257 AromaticContact CE2-CD2 3.94Å; F116-F257 HydrophobicContact CE2-CD2 3.94Å; F116-F257 HydrophobicContact CE2-CE2 4.46Å; F116-F257 AromaticContact CE2-CG 3.81Å; F116-F257 HydrophobicContact CE2-CG 3.81Å; F116-F257 HydrophobicContact CZ-CB 4.33Å; F116-F257 AromaticContact CZ-CD2 3.78Å; F116-F257 HydrophobicContact CZ-CD2 3.78Å; F116-F257 HydrophobicContact CZ-CE2 4.27Å; F116-F257 HydrophobicContact CZ-CG 4.11Å; Q237-F257 CarbonylContact C-O 3.46Å; Q237-F257 VanDerWaalsContact CA-O 3.27Å; Q237-F257 WeakPolarHBondContact CA-O 3.38Å; L238-F257 PolarHBondContact N-O 3.07Å; L238-F257 PolarHBondContact O-N 3.27Å; A240-F257 HydrophobicContact CB-CD2 4.3Å; A240-F257 HydrophobicContact CB-CE2 3.78Å; Y255-F257 HydrophobicContact CD1-CE1 4.38Å; Y255-F257 HydrophobicContact CD1-CZ 4.27Å; Y255-F257 HydrophobicContact CG-CZ 4.38Å; F257-I259 HydrophobicContact CB-CD1 4.37Å; F257-I259 HydrophobicContact CB-CG1 4.28Å; F257-N278 WeakPolarHBondContact CB-OD1 3.49Å; F257-N278 WeakPolarHBondContact CD1-ND2 3.11Å; F257-N278 WeakPolarHBondContact CD1-OD1 3.41Å; F257-A280 HydrophobicContact CD1-CB 3.75Å; F257-A280 HydrophobicContact CE1-CB 3.77Å
258	A	95.1	Very high	88.3	Confident	26 Å²	26	39.9 Å²	39.9	22%	0.215	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.3	108.3	167.9	0	0	0	0	0	108.6	Q237 N278 Q279	Q237-A258 HydrophobicContact CG-CB 4.14Å; A258-N278 WeakPolarHBondContact O-CA 3.31Å; A258-Q279 HydrophobicContact CB-CB 4.39Å; A258-Q279 PolarHBondContact N-O 2.98Å; A258-Q279 PolarHBondContact O-N 3.43Å
259	I	96.3	Very high	89.5	Confident	0 Å²	0	40 Å²	40	0%	0	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.5	126.1	-174.6	-60.9	158.6	0	0	0	108	F116 F120 D235 F236 L238 F257 I261 L276 Q277	F116-I259 HydrophobicContact CD1-CD1 4.05Å; F116-I259 HydrophobicContact CD2-CD1 3.54Å; F116-I259 HydrophobicContact CD2-CG1 3.96Å; F116-I259 HydrophobicContact CE1-CD1 4.1Å; F116-I259 HydrophobicContact CE2-CD1 3.61Å; F116-I259 HydrophobicContact CE2-CG1 4.16Å; F116-I259 HydrophobicContact CG-CD1 3.79Å; F116-I259 HydrophobicContact CZ-CD1 3.9Å; F120-I259 HydrophobicContact CE2-CD1 4.34Å; D235-I259 WeakPolarHBondContact CA-O 3.41Å; F236-I259 HydrophobicContact CD2-CB 4.26Å; F236-I259 HydrophobicContact CD2-CD1 4.26Å; F236-I259 HydrophobicContact CE1-CB 4.48Å; F236-I259 HydrophobicContact CE1-CG2 4.16Å; F236-I259 HydrophobicContact CE2-CB 3.85Å; F236-I259 HydrophobicContact CE2-CD1 3.55Å; F236-I259 HydrophobicContact CE2-CG1 4.31Å; F236-I259 HydrophobicContact CE2-CG2 4.08Å; F236-I259 HydrophobicContact CZ-CB 3.98Å; F236-I259 HydrophobicContact CZ-CD1 4.19Å; F236-I259 HydrophobicContact CZ-CG2 3.7Å; F236-I259 PolarHBondContact N-O 2.84Å; F236-I259 PolarHBondContact O-N 3.15Å; L238-I259 HydrophobicContact CB-CD1 4.5Å; L238-I259 HydrophobicContact CD1-CD1 3.72Å; L238-I259 HydrophobicContact CG-CD1 4.15Å; F257-I259 HydrophobicContact CB-CD1 4.37Å; F257-I259 HydrophobicContact CB-CG1 4.28Å; I259-I261 HydrophobicContact CG2-CG1 4.36Å; I259-L276 HydrophobicContact CG2-CD1 4.21Å; I259-L276 HydrophobicContact CG2-CD2 4.16Å; I259-L276 HydrophobicContact CG2-CG 4.05Å; I259-Q277 WeakPolarHBondContact CA-O 3.43Å
260	T	96.3	Very high	90.5	Very high	37 Å²	37	36.8 Å²	36.8	23%	0.227	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	113.5	178.6	-69.1	0	0	0	0	108.6	V234 D235 V262 Q277	V234-T260 WeakPolarHBondContact O-CA 3.31Å; D235-T260 WeakPolarHBondContact OD1-CB 3.43Å; D235-T260 WeakPolarHBondContact OD1-CG2 3.21Å; D235-T260 PolarHBondContact OD1-OG1 2.91Å; T260-V262 HydrophobicContact CG2-CG2 3.61Å; T260-Q277 PolarHBondContact N-O 3.02Å; T260-Q277 PolarHBondContact O-N 3.36Å
261	I	96.8	Very high	91.6	Very high	0 Å²	0	39.3 Å²	39.3	0%	0	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	116.1	174.4	-60	166.7	0	0	0	107.7	F120 L121 V145 T233 V234 F236 I259 F263 I274 L275 L276	F120-I261 HydrophobicContact CB-CD1 3.73Å; F120-I261 HydrophobicContact CG-CD1 4.31Å; L121-I261 HydrophobicContact CD2-CG2 4.07Å; V145-I261 HydrophobicContact CB-CD1 4.46Å; V145-I261 HydrophobicContact CG1-CD1 3.56Å; V145-I261 HydrophobicContact CG2-CD1 3.96Å; T233-I261 CarbonylContact C-O 3.58Å; T233-I261 VanDerWaalsContact CA-O 3.3Å; T233-I261 WeakPolarHBondContact CA-O 3.48Å; V234-I261 HydrophobicContact CB-CB 4.28Å; V234-I261 PolarHBondContact N-O 2.99Å; V234-I261 PolarHBondContact O-N 3.08Å; F236-I261 HydrophobicContact CE1-CD1 4.22Å; I259-I261 HydrophobicContact CG2-CG1 4.36Å; I261-F263 HydrophobicContact CG2-CD2 4.39Å; I261-F263 HydrophobicContact CG2-CE2 3.73Å; I261-F263 HydrophobicContact CG2-CZ 4.03Å; I261-I274 HydrophobicContact CG2-CG2 4.1Å; I261-L275 CarbonylContact C-O 3.58Å; I261-L275 WeakPolarHBondContact CA-O 3.29Å; I261-L276 HydrophobicContact CD1-CD1 4.27Å; I261-L276 HydrophobicContact CG1-CB 4.39Å; I261-L276 HydrophobicContact CG1-CD1 3.99Å; I261-L276 HydrophobicContact CG1-CG 4.01Å
262	V	96.4	Very high	92.6	Very high	20 Å²	20	36.4 Å²	36.4	12%	0.121	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107	122.7	-176.5	-173	0	0	0	0	109.9	N231 T233 T260 D264 I274 L275	N231-V262 HydrophobicContact CB-CG1 4.48Å; T233-V262 HydrophobicContact CG2-CG2 4.36Å; T260-V262 HydrophobicContact CG2-CG2 3.61Å; V262-D264 HydrophobicContact CG1-CB 4.36Å; V262-I274 WeakPolarHBondContact O-CA 3.08Å; V262-L275 PolarHBondContact N-O 2.99Å; V262-L275 PolarHBondContact O-N 3.46Å
263	F	96.3	Very high	93.4	Very high	2 Å²	2	41.7 Å²	41.7	1%	0.009	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.1	96.6	167.2	-60.6	-94.1	0	0	0	108	L138 R141 I142 N231 V232 V234 I261 I272 K273 I274	L138-F263 HydrophobicContact CD1-CB 4.19Å; L138-F263 HydrophobicContact CD1-CD1 3.33Å; L138-F263 HydrophobicContact CD1-CE1 3.91Å; L138-F263 HydrophobicContact CD1-CG 3.95Å; R141-F263 HydrophobicContact CB-CE1 4.02Å; R141-F263 HydrophobicContact CB-CZ 4.43Å; I142-F263 HydrophobicContact CG1-CD2 4.27Å; I142-F263 HydrophobicContact CG1-CE1 4.17Å; I142-F263 HydrophobicContact CG1-CE2 3.77Å; I142-F263 HydrophobicContact CG1-CZ 3.71Å; N231-F263 WeakPolarHBondContact CA-O 3.35Å; N231-F263 WeakPolarHBondContact CB-O 3.49Å; V232-F263 HydrophobicContact CB-CB 4.1Å; V232-F263 HydrophobicContact CB-CD2 4.18Å; V232-F263 HydrophobicContact CB-CG 4.49Å; V232-F263 HydrophobicContact CG1-CD2 4.38Å; V232-F263 PolarHBondContact N-O 2.91Å; V232-F263 PolarHBondContact O-N 3.12Å; V234-F263 HydrophobicContact CG2-CE2 4.16Å; I261-F263 HydrophobicContact CG2-CD2 4.39Å; I261-F263 HydrophobicContact CG2-CE2 3.73Å; I261-F263 HydrophobicContact CG2-CZ 4.03Å; F263-I272 HydrophobicContact CB-CG2 3.84Å; F263-K273 CarbonylContact C-O 3.53Å; F263-K273 WeakPolarHBondContact CA-O 3.5Å; F263-I274 HydrophobicContact CD1-CD1 3.91Å; F263-I274 HydrophobicContact CD1-CG1 3.66Å; F263-I274 HydrophobicContact CD1-CG2 4.34Å; F263-I274 HydrophobicContact CE1-CD1 3.59Å; F263-I274 HydrophobicContact CE1-CG1 3.82Å; F263-I274 HydrophobicContact CE1-CG2 4.11Å
264	D	95.8	Very high	93.9	Very high	49 Å²	49	41.9 Å²	41.9	26%	0.262	24%	0.243	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.3	117	-172.2	-173	10.4	0	0	0	111.8	V262 K266 I272 K273	V262-D264 HydrophobicContact CG1-CB 4.36Å; D264-K266 WeakPolarHBondContact OD1-CB 3.46Å; D264-K266 WeakPolarHBondContact OD1-CD 3.37Å; D264-K266 WeakPolarHBondContact OD1-CG 3.39Å; D264-K266 PolarHBondContact OD1-N 3.26Å; D264-I272 WeakPolarHBondContact O-CA 3.43Å; D264-K273 HydrophobicContact CB-CB 4.48Å; D264-K273 PolarHBondContact N-O 3.12Å; D264-K273 PolarHBondContact O-N 3.44Å
265	N	95.6	Very high	94.2	Very high	13 Å²	13	44.8 Å²	44.8	7%	0.07	26%	0.255	C	S	.	.			trans	-116.5	14.8	177.3	-168	46	0	0	0	112.8	L229 I230 A267 H268 I272	L229-N265 PolarHBondContact O-ND2 2.87Å; I230-N265 CarbonylContact O-C 3.58Å; I230-N265 VanDerWaalsContact O-C 3.31Å; I230-N265 WeakPolarHBondContact O-CA 3.49Å; I230-N265 WeakPolarHBondContact O-CB 3.41Å; I230-N265 PolarHBondContact O-N 3.46Å; N265-A267 PolarHBondContact O-N 3.15Å; N265-H268 PolarHBondContact O-CD2 3.34Å; N265-H268 PolarHBondContact O-N 3.31Å; N265-I272 HydrophobicContact CB-CD1 4.35Å; N265-I272 HydrophobicContact CB-CG1 4.03Å
266	K	92	Very high	94.3	Very high	139 Å²	139	45.4 Å²	45.4	60%	0.604	26%	0.258	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.3	-29	-176.5	-75.4	170	-176.8	-179.6	0	115	I230 D264 H268	I230-K266 HydrophobicContact CG2-CG 3.83Å; I230-K266 PolarHBondContact O-N 3.31Å; D264-K266 WeakPolarHBondContact OD1-CB 3.46Å; D264-K266 WeakPolarHBondContact OD1-CD 3.37Å; D264-K266 WeakPolarHBondContact OD1-CG 3.39Å; D264-K266 PolarHBondContact OD1-N 3.26Å; K266-H268 VanDerWaalsContact C-N 3.35Å; K266-H268 PolarHBondContact O-CD2 2.83Å
267	A	90.1	Very high	94.4	Very high	79 Å²	79	49.2 Å²	49.2	65%	0.653	28%	0.276	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.3	-12.6	-180	0	0	0	0	0	113.7	N265 S269	N265-A267 PolarHBondContact O-N 3.15Å; A267-S269 PolarHBondContact O-N 2.87Å
268	H	91	Very high	94.3	Very high	79 Å²	79	50.1 Å²	50.1	37%	0.366	28%	0.28	S	S	.	.			trans	45.8	33.2	-176.3	-66.6	-90.1	0	0	0	114.5	F180 L229 N265 K266 G270	F180-H268 AromaticContact CE2-NE2 3.91Å; L229-H268 PolarHBondContact O-CE1 3.34Å; N265-H268 PolarHBondContact O-CD2 3.34Å; N265-H268 PolarHBondContact O-N 3.31Å; K266-H268 VanDerWaalsContact C-N 3.35Å; K266-H268 PolarHBondContact O-CD2 2.83Å; H268-G270 PolarHBondContact O-N 3.32Å
269	S	92.6	Very high	94.1	Very high	84 Å²	84	55.7 Å²	55.7	59%	0.587	30%	0.302	S	S	*	.	S	Bend	trans	-92.9	10.1	-171.8	58.9	0	0	0	0	114.4	A267 K271	A267-S269 PolarHBondContact O-N 2.87Å; S269-K271 PolarHBondContact O-N 3.14Å
270	G	91.6	Very high	93.8	Very high	53 Å²	53	57.1 Å²	57.1	55%	0.546	31%	0.313	S	S	.	.	S	Bend	trans	73.2	5.7	-171	0	0	0	0	0	114.3	H268	H268-G270 PolarHBondContact O-N 3.32Å
271	K	93.2	Very high	93.4	Very high	86 Å²	86	57.5 Å²	57.5	37%	0.374	32%	0.318	S	S	.	.			trans	-121	113.8	173.8	179.2	-178.7	-179.3	171.9	0	109.9	A131 S269	A131-K271 HydrophobicContact CB-CD 4.23Å; A131-K271 HydrophobicContact CB-CG 3.88Å; S269-K271 PolarHBondContact O-N 3.14Å
272	I	95	Very high	92.9	Very high	15 Å²	15	58.5 Å²	58.5	8%	0.077	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.9	121.7	176	-62.5	176.7	0	0	0	108.6	A131 V132 L138 F263 D264 N265	A131-I272 CarbonylContact C-O 3.58Å; A131-I272 WeakPolarHBondContact CA-O 3.4Å; V132-I272 PolarHBondContact N-O 2.98Å; V132-I272 PolarHBondContact O-N 3.11Å; L138-I272 HydrophobicContact CD1-CD1 4.35Å; L138-I272 HydrophobicContact CD1-CG2 4.29Å; L138-I272 HydrophobicContact CD2-CD1 3.73Å; F263-I272 HydrophobicContact CB-CG2 3.84Å; D264-I272 WeakPolarHBondContact O-CA 3.43Å; N265-I272 HydrophobicContact CB-CD1 4.35Å; N265-I272 HydrophobicContact CB-CG1 4.03Å
273	K	94.4	Very high	92.3	Very high	127 Å²	127	64 Å²	64	55%	0.552	35%	0.345	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-85.5	139	178	-63.5	175.7	-174.8	170.8	0	109.6	F263 D264	F263-K273 CarbonylContact C-O 3.53Å; F263-K273 WeakPolarHBondContact CA-O 3.5Å; D264-K273 HydrophobicContact CB-CB 4.48Å; D264-K273 PolarHBondContact N-O 3.12Å; D264-K273 PolarHBondContact O-N 3.44Å
274	I	95	Very high	91.6	Very high	19 Å²	19	70.1 Å²	70.1	10%	0.097	37%	0.374	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108	126.4	176.5	-51.8	177.6	0	0	0	109.2	L121 Q130 V132 R141 I261 V262 F263	L121-I274 HydrophobicContact CD2-CG2 3.8Å; Q130-I274 HydrophobicContact CB-CB 4.06Å; Q130-I274 PolarHBondContact O-N 3.37Å; V132-I274 HydrophobicContact CG2-CD1 3.56Å; V132-I274 HydrophobicContact CG2-CG1 4.36Å; R141-I274 HydrophobicContact CG-CD1 4.3Å; I261-I274 HydrophobicContact CG2-CG2 4.1Å; V262-I274 WeakPolarHBondContact O-CA 3.08Å; F263-I274 HydrophobicContact CD1-CD1 3.91Å; F263-I274 HydrophobicContact CD1-CG1 3.66Å; F263-I274 HydrophobicContact CD1-CG2 4.34Å; F263-I274 HydrophobicContact CE1-CD1 3.59Å; F263-I274 HydrophobicContact CE1-CG1 3.82Å; F263-I274 HydrophobicContact CE1-CG2 4.11Å
275	L	94.3	Very high	91	Very high	97 Å²	97	69 Å²	69	51%	0.508	37%	0.369	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129	132.8	177.2	-169.1	75.2	0	0	0	109.9	I261 V262 Q277	I261-L275 CarbonylContact C-O 3.58Å; I261-L275 WeakPolarHBondContact CA-O 3.29Å; V262-L275 PolarHBondContact N-O 2.99Å; V262-L275 PolarHBondContact O-N 3.46Å; L275-Q277 HydrophobicContact CD2-CG 3.75Å; L275-Q277 HydrophobicContact CG-CG 4.17Å
276	L	94.9	Very high	90.4	Very high	14 Å²	14	77.1 Å²	77.1	7%	0.073	40%	0.404	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	118.5	168.7	-173.2	156.2	0	0	0	108.5	T113 F116 K117 F120 L121 I259 I261 N278	T113-L276 HydrophobicContact CG2-CD2 4.38Å; F116-L276 HydrophobicContact CB-CD1 4.08Å; F116-L276 HydrophobicContact CB-CD2 4.38Å; K117-L276 HydrophobicContact CG-CB 4.26Å; K117-L276 HydrophobicContact CG-CD1 4.31Å; K117-L276 HydrophobicContact CG-CD2 4.41Å; F120-L276 HydrophobicContact CD2-CD1 4.48Å; L121-L276 HydrophobicContact CD1-CB 4.21Å; L121-L276 HydrophobicContact CG-CD1 4.44Å; I259-L276 HydrophobicContact CG2-CD1 4.21Å; I259-L276 HydrophobicContact CG2-CD2 4.16Å; I259-L276 HydrophobicContact CG2-CG 4.05Å; I261-L276 HydrophobicContact CD1-CD1 4.27Å; I261-L276 HydrophobicContact CG1-CB 4.39Å; I261-L276 HydrophobicContact CG1-CD1 3.99Å; I261-L276 HydrophobicContact CG1-CG 4.01Å; L276-N278 HydrophobicContact CD2-CB 4.37Å
277	Q	94.2	Very high	89.2	Confident	95 Å²	95	77.3 Å²	77.3	44%	0.444	41%	0.412	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	136.2	174.3	-63.1	-177.6	-24.1	0	0	108.8	I259 T260 L275	I259-Q277 WeakPolarHBondContact CA-O 3.43Å; T260-Q277 PolarHBondContact N-O 3.02Å; T260-Q277 PolarHBondContact O-N 3.36Å; L275-Q277 HydrophobicContact CD2-CG 3.75Å; L275-Q277 HydrophobicContact CG-CG 4.17Å
278	N	93.7	Very high	88.1	Confident	19 Å²	19	76.9 Å²	76.9	10%	0.102	40%	0.401	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	121.9	177.6	179.8	23.3	0	0	0	109.9	T113 F257 A258 L276	T113-N278 HydrophobicContact CG2-CB 4.08Å; T113-N278 PolarHBondContact OG1-ND2 3.12Å; F257-N278 WeakPolarHBondContact CB-OD1 3.49Å; F257-N278 WeakPolarHBondContact CD1-ND2 3.11Å; F257-N278 WeakPolarHBondContact CD1-OD1 3.41Å; A258-N278 WeakPolarHBondContact O-CA 3.31Å; L276-N278 HydrophobicContact CD2-CB 4.37Å
279	Q	91.3	Very high	87	Confident	143 Å²	143	80.8 Å²	80.8	67%	0.668	43%	0.425	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-111.1	122.5	171.6	-64.5	-176.5	-6.6	0	0	109	A258	A258-Q279 HydrophobicContact CB-CB 4.39Å; A258-Q279 PolarHBondContact N-O 2.98Å; A258-Q279 PolarHBondContact O-N 3.43Å
280	A	89.2	Confident	85.8	Confident	29 Å²	29	79.2 Å²	79.2	24%	0.24	41%	0.412	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	130.8	180	0	0	0	0	0	110	K109 Y255 F257	K109-A280 HydrophobicContact CD-CB 4.12Å; K109-A280 HydrophobicContact CG-CB 4.12Å; Y255-A280 HydrophobicContact CD1-CB 4.46Å; F257-A280 HydrophobicContact CD1-CB 3.75Å; F257-A280 HydrophobicContact CE1-CB 3.77Å
281	S	87.4	Confident	84.3	Confident	46 Å²	46	82.2 Å²	82.2	32%	0.322	42%	0.424	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	139.1	167.8	58.9	0	0	0	0	109.5	Y255 T256	Y255-S281 WeakPolarHBondContact CA-O 3.48Å; T256-S281 WeakPolarHBondContact CB-OG 3.43Å; T256-S281 PolarHBondContact N-O 3.04Å; T256-S281 PolarHBondContact O-N 3.29Å; T256-S281 PolarHBondContact O-OG 3.44Å; T256-S281 VanDerWaalsContact O-OG 3.14Å
282	I	87.2	Confident	82.7	Confident	21 Å²	21	82 Å²	82	11%	0.108	45%	0.446	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	132.1	-172.5	-48.5	-178.7	0	0	0	108.1	V105 D253 Y255 Y384	V105-I282 HydrophobicContact CG1-CD1 3.57Å; D253-I282 HydrophobicContact CB-CG2 3.77Å; Y255-I282 HydrophobicContact CD1-CD1 4.42Å; Y255-I282 HydrophobicContact CD1-CG1 3.93Å; Y255-I282 HydrophobicContact CE1-CD1 3.6Å; Y255-I282 HydrophobicContact CE1-CG1 3.6Å; Y255-I282 HydrophobicContact CE2-CG2 4.46Å; I282-Y384 HydrophobicContact CD1-CE2 3.75Å
283	K	83.7	Confident	80.9	Confident	135 Å²	135	84.5 Å²	84.5	59%	0.587	46%	0.457	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-140.4	155.7	176.7	-64	-173.2	179.5	-175.6	0	110.1	C254	C254-K283 WeakPolarHBondContact CA-O 3.47Å; C254-K283 WeakPolarHBondContact CB-O 3.31Å; C254-K283 PolarHBondContact N-O 3.48Å; C254-K283 PolarHBondContact O-N 2.94Å
284	E	82.4	Confident	79	Confident	131 Å²	131	82.9 Å²	82.9	61%	0.612	47%	0.468	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-65	138.5	169.5	-61.6	-172.2	163.6	0	0	110.6	K379	E284-K379 HydrophobicContact CG-CB 3.91Å; E284-K379 HydrophobicContact CG-CD 4.49Å; E284-K379 HydrophobicContact CG-CG 3.5Å; E284-K379 WeakPolarHBondContact OE1-CG 3.45Å
285	C	83.2	Confident	77.1	Confident	25 Å²	25	88.6 Å²	88.6	17%	0.169	49%	0.494	C	S	.	.	P	Polyproline II helix	trans	-74	139.2	169.9	-63	0	0	0	0	109.8	P252 C254 T288	P252-C285 PolarHBondContact O-SG 3.47Å; C254-C285 VanDerWaalsContact CA-SG 3.51Å; C254-C285 HydrophobicContact CB-CB 4.22Å; C254-C285 WeakPolarHBondContact CB-SG 3.34Å; C254-C285 PolarHBondContact N-SG 3.38Å; C254-C285 WeakPolarHBondContact SG-CA 3.37Å; C254-C285 WeakPolarHBondContact SG-CB 3.34Å; C254-C285 CovalentContact SG-SG 2.04Å; C254-C285 PolarHBondContact SG-SG 3.31Å; C285-T288 HydrophobicContact CB-CG2 3.89Å
286	K	81	Confident	75.5	Confident	183 Å²	183	88 Å²	88	80%	0.796	50%	0.498	S	S	*	.	S	Bend	trans	-76.2	138.6	175	-167.6	-175.6	172.8	-177.3	0	110.2
287	D	66.9	Low	74.5	Confident	144 Å²	144	94.1 Å²	94.1	77%	0.77	52%	0.521	S	S	*	.	S	Bend	trans	56	63.9	173.3	-55	-40.9	0	0	0	113.9
288	T	67.6	Low	73.8	Confident	69 Å²	69	92.6 Å²	92.6	42%	0.423	52%	0.524	S	S	.	.			trans	-82.7	125.9	176.4	52.1	0	0	0	0	111	I251 C285	I251-T288 HydrophobicContact CG2-CG2 3.81Å; C285-T288 HydrophobicContact CB-CG2 3.89Å
289	N	67.9	Low	73.2	Confident	161 Å²	161	95.5 Å²	95.5	86%	0.861	53%	0.534	S	S	*	.			trans	-119.5	95.1	173.9	-166.2	6.7	0	0	0	109.3
290	V	67.6	Low	72.8	Confident	52 Å²	52	91.5 Å²	91.5	32%	0.315	52%	0.515	S	S	.	.			trans	-115.6	112.9	175.7	-176.3	0	0	0	0	107.8	G292	V290-G292 PolarHBondContact O-N 3.45Å
291	S	60.2	Low	72.8	Confident	115 Å²	115	97 Å²	97	80%	0.804	53%	0.534	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.2	125.6	-178.6	56.8	0	0	0	0	111.3
292	G	60.2	Low	73	Confident	81 Å²	81	97.3 Å²	97.3	84%	0.835	53%	0.53	S	S	*	.	T	Hydrogen-bonded Turn	trans	91.6	18.1	170.6	0	0	0	0	0	116.2	V290	V290-G292 PolarHBondContact O-N 3.45Å
293	H	56.4	Low	73.2	Confident	69 Å²	69	96.3 Å²	96.3	32%	0.319	52%	0.524	S	S	.	.			trans	-104.5	130.4	174.2	-83.3	-4.8	0	0	0	112.8
294	A	54	Low	73.7	Confident	93 Å²	93	93 Å²	93	77%	0.769	52%	0.516	S	S	*	.			trans	-91.7	131.5	163	0	0	0	0	0	107.8	S296	A294-S296 PolarHBondContact O-N 2.96Å; A294-S296 VanDerWaalsContact O-N 3.12Å
295	E	55.8	Low	74.2	Confident	138 Å²	138	89 Å²	89	65%	0.645	50%	0.5	S	S	*	.			trans	-56.5	115.9	174.8	-69.1	176.3	164.5	0	0	109.6	Y297	E295-Y297 HydrophobicContact CB-CD2 4.05Å; E295-Y297 HydrophobicContact CB-CE2 3.74Å; E295-Y297 PolarHBondContact O-N 2.91Å; E295-Y297 VanDerWaalsContact O-N 3.11Å; E295-Y297 WeakPolarHBondContact OE2-CE2 3.29Å; E295-Y297 PolarHBondContact OE2-OH 3.29Å
296	S	61.4	Low	74.8	Confident	85 Å²	85	87.8 Å²	87.8	59%	0.594	49%	0.492	S	S	*	.			trans	-90.2	73	-174.5	-163.7	0	0	0	0	110.8	A294 A298	A294-S296 PolarHBondContact O-N 2.96Å; A294-S296 VanDerWaalsContact O-N 3.12Å; S296-A298 PolarHBondContact O-N 3.28Å
297	Y	73.4	Confident	75.5	Confident	143 Å²	143	79.9 Å²	79.9	56%	0.561	46%	0.46	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.7	-0.3	166.4	-68.8	-75	0	0	0	113.4	E295 R299 F301	E295-Y297 HydrophobicContact CB-CD2 4.05Å; E295-Y297 HydrophobicContact CB-CE2 3.74Å; E295-Y297 PolarHBondContact O-N 2.91Å; E295-Y297 VanDerWaalsContact O-N 3.11Å; E295-Y297 WeakPolarHBondContact OE2-CE2 3.29Å; E295-Y297 PolarHBondContact OE2-OH 3.29Å; Y297-R299 VanDerWaalsContact C-N 3.31Å; Y297-R299 PolarHBondContact O-N 3.49Å; Y297-F301 WeakPolarHBondContact O-CB 3.49Å; Y297-F301 PolarHBondContact O-N 3.38Å
298	A	79.8	Confident	76.8	Confident	62 Å²	62	77.3 Å²	77.3	51%	0.512	45%	0.446	S	S	.	.	H	α-helix	trans	-64.2	-31.6	-177.9	0	0	0	0	0	113.3	S296 F302	S296-A298 PolarHBondContact O-N 3.28Å; A298-F302 WeakPolarHBondContact O-CB 3.41Å; A298-F302 PolarHBondContact O-N 3.36Å
299	R	81.3	Confident	78.1	Confident	81 Å²	81	74.6 Å²	74.6	31%	0.306	43%	0.429	S	S	.	.	H	α-helix	trans	-75.6	-46.2	179.7	-66.8	-176.9	-176	171.4	2.7	112.1	E250 Y297 F301 F302 D303	E250-R299 IonicContact OE1-CZ 3.47Å; E250-R299 IonicContact OE1-NH1 3.92Å; E250-R299 PolarHBondContact OE1-NH1 2.97Å; E250-R299 IonicContact OE1-NH2 2.76Å; E250-R299 PolarHBondContact OE1-NH2 3.13Å; E250-R299 IonicContact OE2-NH1 3.43Å; Y297-R299 VanDerWaalsContact C-N 3.31Å; Y297-R299 PolarHBondContact O-N 3.49Å; R299-F301 VanDerWaalsContact C-N 3.3Å; R299-F301 PolarHBondContact O-N 3.32Å; R299-F302 WeakPolarHBondContact O-CB 3.49Å; R299-F302 PolarHBondContact O-N 3.43Å; R299-F302 VanDerWaalsContact O-N 3.1Å; R299-D303 PolarHBondContact O-N 2.96Å
300	E	82.9	Confident	79.4	Confident	59 Å²	59	67 Å²	67	28%	0.276	39%	0.389	S	S	.	.	H	α-helix	trans	-59.1	-44.5	173.1	-64.7	-177.2	171.3	0	0	110.8	F302 D303 V304 E377	E300-F302 VanDerWaalsContact C-N 3.32Å; E300-F302 PolarHBondContact O-N 3.02Å; E300-D303 PolarHBondContact O-N 3.06Å; E300-V304 WeakPolarHBondContact O-CG2 3.48Å; E300-V304 PolarHBondContact O-N 3.48Å; E300-E377 WeakPolarHBondContact CA-OE2 3.4Å; E300-E377 HydrophobicContact CG-CB 4.09Å; E300-E377 VanDerWaalsContact CG-OE2 3.23Å; E300-E377 WeakPolarHBondContact CG-OE2 3.34Å; E300-E377 PolarHBondContact N-OE2 2.68Å
301	F	88.4	Confident	80.7	Confident	144 Å²	144	68.7 Å²	68.7	63%	0.632	40%	0.395	S	S	*	.	H	α-helix	trans	-60.3	-42.4	175	178.8	-100.5	0	0	0	112	Y297 R299 D303 V304 V305	Y297-F301 WeakPolarHBondContact O-CB 3.49Å; Y297-F301 PolarHBondContact O-N 3.38Å; R299-F301 VanDerWaalsContact C-N 3.3Å; R299-F301 PolarHBondContact O-N 3.32Å; F301-D303 VanDerWaalsContact C-N 3.33Å; F301-D303 PolarHBondContact O-N 3.49Å; F301-V304 PolarHBondContact O-N 3.34Å; F301-V305 HydrophobicContact CD1-CG2 4.21Å; F301-V305 HydrophobicContact CE1-CG2 3.75Å; F301-V305 HydrophobicContact CE2-CG2 4.42Å; F301-V305 HydrophobicContact CZ-CG2 3.87Å; F301-V305 WeakPolarHBondContact O-CG2 3.38Å; F301-V305 PolarHBondContact O-N 2.88Å
302	F	91.6	Very high	82.3	Confident	52 Å²	52	67.2 Å²	67.2	23%	0.228	38%	0.378	C	S	.	.	H	α-helix	trans	-61.4	-41.1	176.3	-177.9	-100.4	0	0	0	111.9	I90 V93 Q94 L97 A298 R299 E300 V304 V305 V306	I90-F302 HydrophobicContact CB-CZ 4.49Å; I90-F302 HydrophobicContact CG2-CE1 4.49Å; I90-F302 HydrophobicContact CG2-CE2 4.28Å; I90-F302 HydrophobicContact CG2-CZ 3.88Å; V93-F302 HydrophobicContact CB-CE1 4.46Å; V93-F302 HydrophobicContact CB-CZ 3.99Å; V93-F302 HydrophobicContact CG1-CE1 4.08Å; V93-F302 HydrophobicContact CG1-CE2 4.49Å; V93-F302 HydrophobicContact CG1-CZ 3.72Å; Q94-F302 HydrophobicContact CB-CE1 3.86Å; Q94-F302 HydrophobicContact CG-CE1 4.45Å; L97-F302 HydrophobicContact CD1-CD1 4.48Å; L97-F302 HydrophobicContact CD1-CE1 4.5Å; A298-F302 WeakPolarHBondContact O-CB 3.41Å; A298-F302 PolarHBondContact O-N 3.36Å; R299-F302 WeakPolarHBondContact O-CB 3.49Å; R299-F302 PolarHBondContact O-N 3.43Å; R299-F302 VanDerWaalsContact O-N 3.1Å; E300-F302 VanDerWaalsContact C-N 3.32Å; E300-F302 PolarHBondContact O-N 3.02Å; F302-V304 PolarHBondContact O-N 2.9Å; F302-V305 WeakPolarHBondContact O-CB 3.48Å; F302-V305 PolarHBondContact O-N 3.45Å; F302-V306 HydrophobicContact CD1-CG2 4.01Å; F302-V306 HydrophobicContact CE1-CG2 3.79Å; F302-V306 HydrophobicContact CZ-CG2 4.21Å; F302-V306 WeakPolarHBondContact O-CG2 3.2Å; F302-V306 PolarHBondContact O-N 3.41Å
303	D	92.1	Very high	83.9	Confident	0 Å²	0	63.4 Å²	63.4	0%	0	34%	0.338	C	S	.	.	H	α-helix	trans	-64.5	-37.7	176.1	-72.1	-29.5	0	0	0	112.9	Q94 R299 E300 F301 V306 A307 K373 I374	Q94-D303 VanDerWaalsContact CG-OD1 3.27Å; Q94-D303 WeakPolarHBondContact CG-OD1 3.35Å; Q94-D303 PolarHBondContact NE2-OD1 2.78Å; R299-D303 PolarHBondContact O-N 2.96Å; E300-D303 PolarHBondContact O-N 3.06Å; F301-D303 VanDerWaalsContact C-N 3.33Å; F301-D303 PolarHBondContact O-N 3.49Å; D303-V306 PolarHBondContact O-N 2.87Å; D303-A307 PolarHBondContact O-N 3.48Å; D303-K373 IonicContact OD1-NZ 3.73Å; D303-K373 PolarHBondContact OD1-NZ 2.96Å; D303-K373 VanDerWaalsContact OD2-CD 3.23Å; D303-K373 WeakPolarHBondContact OD2-CD 3.48Å; D303-K373 WeakPolarHBondContact OD2-CE 3.32Å; D303-K373 IonicContact OD2-NZ 3.04Å; D303-K373 PolarHBondContact OD2-NZ 3.15Å; D303-I374 HydrophobicContact CB-CD1 4.08Å; D303-I374 HydrophobicContact CB-CG1 3.82Å
304	V	93.5	Very high	85.7	Confident	67 Å²	67	61.8 Å²	61.8	41%	0.406	33%	0.332	S	S	.	.	H	α-helix	trans	-63.2	-42.9	172.5	173.8	0	0	0	0	110.8	E300 F301 F302 V306 A307 I308 I374	E300-V304 WeakPolarHBondContact O-CG2 3.48Å; E300-V304 PolarHBondContact O-N 3.48Å; F301-V304 PolarHBondContact O-N 3.34Å; F302-V304 PolarHBondContact O-N 2.9Å; V304-V306 VanDerWaalsContact C-N 3.33Å; V304-V306 PolarHBondContact O-N 3.45Å; V304-A307 PolarHBondContact O-N 3.32Å; V304-I308 HydrophobicContact CG1-CD1 3.94Å; V304-I308 VanDerWaalsContact O-CG1 3.31Å; V304-I308 WeakPolarHBondContact O-CG1 3.28Å; V304-I308 PolarHBondContact O-N 2.91Å; V304-I374 HydrophobicContact CG2-CD1 4.06Å
305	V	93.9	Very high	87.6	Confident	45 Å²	45	62.5 Å²	62.5	27%	0.273	32%	0.322	S	S	.	.	H	α-helix	trans	-61.3	-42.1	175.2	171.5	0	0	0	0	111	F301 F302 I308 V309	F301-V305 HydrophobicContact CD1-CG2 4.21Å; F301-V305 HydrophobicContact CE1-CG2 3.75Å; F301-V305 HydrophobicContact CE2-CG2 4.42Å; F301-V305 HydrophobicContact CZ-CG2 3.87Å; F301-V305 WeakPolarHBondContact O-CG2 3.38Å; F301-V305 PolarHBondContact O-N 2.88Å; F302-V305 WeakPolarHBondContact O-CB 3.48Å; F302-V305 PolarHBondContact O-N 3.45Å; V305-I308 PolarHBondContact O-N 3.35Å; V305-V309 HydrophobicContact CG1-CG2 4.48Å; V305-V309 WeakPolarHBondContact O-CG2 3.24Å; V305-V309 PolarHBondContact O-N 3.2Å
306	V	95.2	Very high	89.3	Confident	1 Å²	1	59.2 Å²	59.2	1%	0.006	31%	0.309	C	S	.	.	H	α-helix	trans	-59.5	-49	176	-175.2	0	0	0	0	110.5	I90 V91 Q94 F302 D303 V304 I308 V309 C310 T366	I90-V306 HydrophobicContact CG2-CB 3.87Å; I90-V306 HydrophobicContact CG2-CG1 3.96Å; I90-V306 HydrophobicContact CG2-CG2 3.2Å; V91-V306 HydrophobicContact CG2-CG1 3.91Å; Q94-V306 HydrophobicContact CB-CG2 4.18Å; Q94-V306 HydrophobicContact CG-CG2 4.25Å; F302-V306 HydrophobicContact CD1-CG2 4.01Å; F302-V306 HydrophobicContact CE1-CG2 3.79Å; F302-V306 HydrophobicContact CZ-CG2 4.21Å; F302-V306 WeakPolarHBondContact O-CG2 3.2Å; F302-V306 PolarHBondContact O-N 3.41Å; D303-V306 PolarHBondContact O-N 2.87Å; V304-V306 VanDerWaalsContact C-N 3.33Å; V304-V306 PolarHBondContact O-N 3.45Å; V306-I308 VanDerWaalsContact C-N 3.31Å; V306-I308 PolarHBondContact O-N 3.05Å; V306-V309 PolarHBondContact O-N 2.88Å; V306-C310 WeakPolarHBondContact O-CB 3.42Å; V306-C310 PolarHBondContact O-N 2.99Å; V306-C310 PolarHBondContact O-SG 3.45Å; V306-T366 HydrophobicContact CG1-CG2 3.91Å
307	A	95.1	Very high	90.7	Very high	16 Å²	16	55.2 Å²	55.2	13%	0.132	28%	0.281	C	S	.	.	H	α-helix	trans	-59.3	-41	179.5	0	0	0	0	0	112.1	D303 V304 C310 L311	D303-A307 PolarHBondContact O-N 3.48Å; V304-A307 PolarHBondContact O-N 3.32Å; A307-C310 PolarHBondContact O-N 3.48Å; A307-L311 WeakPolarHBondContact O-CB 3.21Å; A307-L311 PolarHBondContact O-N 3.5Å
308	I	94.7	Very high	91.6	Very high	90 Å²	90	49.8 Å²	49.8	46%	0.462	27%	0.268	S	S	.	.	H	α-helix	trans	-64.3	-46.4	176.5	-68.2	166.4	0	0	0	111.2	V304 V305 V306 C310 L311 L312	V304-I308 HydrophobicContact CG1-CD1 3.94Å; V304-I308 VanDerWaalsContact O-CG1 3.31Å; V304-I308 WeakPolarHBondContact O-CG1 3.28Å; V304-I308 PolarHBondContact O-N 2.91Å; V305-I308 PolarHBondContact O-N 3.35Å; V306-I308 VanDerWaalsContact C-N 3.31Å; V306-I308 PolarHBondContact O-N 3.05Å; I308-C310 VanDerWaalsContact C-N 3.34Å; I308-C310 PolarHBondContact O-N 3.1Å; I308-L311 PolarHBondContact O-N 2.67Å; I308-L312 HydrophobicContact CG2-CD1 4.18Å; I308-L312 WeakPolarHBondContact O-CG 3.47Å; I308-L312 PolarHBondContact O-N 2.87Å
309	V	94.6	Very high	92.1	Very high	13 Å²	13	52 Å²	52	8%	0.079	26%	0.264	C	S	.	.	H	α-helix	trans	-62.4	-42.3	178.5	169.7	0	0	0	0	111	L83 K87 I90 V305 V306 L312 S313	L83-V309 HydrophobicContact CD1-CG1 4Å; L83-V309 HydrophobicContact CG-CG1 4.49Å; K87-V309 HydrophobicContact CB-CG1 4.05Å; K87-V309 HydrophobicContact CG-CG1 4.36Å; I90-V309 HydrophobicContact CD1-CG2 4.23Å; V305-V309 HydrophobicContact CG1-CG2 4.48Å; V305-V309 WeakPolarHBondContact O-CG2 3.24Å; V305-V309 PolarHBondContact O-N 3.2Å; V306-V309 PolarHBondContact O-N 2.88Å; V309-L312 PolarHBondContact O-N 3.34Å; V309-S313 WeakPolarHBondContact O-CB 3.34Å; V309-S313 PolarHBondContact O-N 3.27Å
310	C	94.9	Very high	92.5	Very high	1 Å²	1	49.6 Å²	49.6	1%	0.007	26%	0.259	C	S	.	.	H	α-helix	trans	-65.3	-38.6	175	-73.2	0	0	0	0	112.3	V306 A307 I308 S313 L314 T366 I367	V306-C310 WeakPolarHBondContact O-CB 3.42Å; V306-C310 PolarHBondContact O-N 2.99Å; V306-C310 PolarHBondContact O-SG 3.45Å; A307-C310 PolarHBondContact O-N 3.48Å; I308-C310 VanDerWaalsContact C-N 3.34Å; I308-C310 PolarHBondContact O-N 3.1Å; C310-S313 WeakPolarHBondContact O-CB 3.43Å; C310-S313 PolarHBondContact O-N 3.35Å; C310-L314 VanDerWaalsContact O-CB 3.31Å; C310-L314 WeakPolarHBondContact O-CB 3.45Å; C310-L314 PolarHBondContact O-N 3.36Å; C310-T366 VanDerWaalsContact SG-CG2 3.56Å; C310-I367 HydrophobicContact CB-CD1 4.24Å; C310-I367 HydrophobicContact CB-CG1 3.81Å
311	L	95.2	Very high	92.9	Very high	87 Å²	87	48.3 Å²	48.3	46%	0.455	25%	0.253	S	S	.	.	H	α-helix	trans	-65.3	-44	175.6	-176.6	64.6	0	0	0	111.7	A307 I308 S313 L314 L315	A307-L311 WeakPolarHBondContact O-CB 3.21Å; A307-L311 PolarHBondContact O-N 3.5Å; I308-L311 PolarHBondContact O-N 2.67Å; L311-S313 VanDerWaalsContact C-N 3.31Å; L311-S313 PolarHBondContact O-N 2.97Å; L311-L314 HydrophobicContact CD1-CD2 4.38Å; L311-L314 WeakPolarHBondContact O-CB 3.47Å; L311-L314 PolarHBondContact O-N 3.49Å; L311-L315 HydrophobicContact CG-CD1 4.44Å; L311-L315 WeakPolarHBondContact O-CG 3.47Å; L311-L315 PolarHBondContact O-N 3.39Å
312	L	94.1	Very high	93.1	Very high	85 Å²	85	47 Å²	47	45%	0.445	25%	0.253	S	S	.	.	H	α-helix	trans	-61.4	-41.4	173.9	-70	172.4	0	0	0	111.3	L83 I308 V309 L315 L316	L83-L312 HydrophobicContact CD2-CB 3.92Å; I308-L312 HydrophobicContact CG2-CD1 4.18Å; I308-L312 WeakPolarHBondContact O-CG 3.47Å; I308-L312 PolarHBondContact O-N 2.87Å; V309-L312 PolarHBondContact O-N 3.34Å; L312-L315 PolarHBondContact O-N 3.41Å; L312-L316 WeakPolarHBondContact O-CB 3.43Å; L312-L316 VanDerWaalsContact O-CG 3.25Å; L312-L316 WeakPolarHBondContact O-CG 3.26Å; L312-L316 PolarHBondContact O-N 3.03Å
313	S	93.9	Very high	93	Very high	0 Å²	0	50.1 Å²	50.1	0%	0	26%	0.263	C	S	.	.	H	α-helix	trans	-59.6	-48.3	174	170.1	0	0	0	0	111.5	Q84 V309 C310 L311 L315 L316 C317 D363	Q84-S313 PolarHBondContact NE2-OG 3.01Å; V309-S313 WeakPolarHBondContact O-CB 3.34Å; V309-S313 PolarHBondContact O-N 3.27Å; C310-S313 WeakPolarHBondContact O-CB 3.43Å; C310-S313 PolarHBondContact O-N 3.35Å; L311-S313 VanDerWaalsContact C-N 3.31Å; L311-S313 PolarHBondContact O-N 2.97Å; S313-L315 PolarHBondContact O-N 3.48Å; S313-L316 PolarHBondContact O-N 3.09Å; S313-C317 VanDerWaalsContact O-CB 3.28Å; S313-C317 WeakPolarHBondContact O-CB 3.41Å; S313-C317 PolarHBondContact O-N 2.89Å; S313-C317 PolarHBondContact O-SG 2.81Å; S313-C317 VanDerWaalsContact O-SG 3.37Å; S313-D363 VanDerWaalsContact CB-OD2 3.29Å; S313-D363 WeakPolarHBondContact CB-OD2 3.45Å; S313-D363 PolarHBondContact OG-OD1 3.23Å; S313-D363 PolarHBondContact OG-OD2 3.15Å
314	L	94.4	Very high	92.9	Very high	35 Å²	35	50.1 Å²	50.1	18%	0.183	26%	0.263	C	S	.	.	H	α-helix	trans	-58.2	-47.8	179.2	-176.9	72.8	0	0	0	111	C310 L311 C317 G318 I360 D363 L364 I367	C310-L314 VanDerWaalsContact O-CB 3.31Å; C310-L314 WeakPolarHBondContact O-CB 3.45Å; C310-L314 PolarHBondContact O-N 3.36Å; L311-L314 HydrophobicContact CD1-CD2 4.38Å; L311-L314 WeakPolarHBondContact O-CB 3.47Å; L311-L314 PolarHBondContact O-N 3.49Å; L314-C317 PolarHBondContact O-N 3.48Å; L314-G318 PolarHBondContact O-N 3.09Å; L314-I360 HydrophobicContact CD1-CB 4.14Å; L314-I360 HydrophobicContact CD1-CG1 4.12Å; L314-I360 HydrophobicContact CD1-CG2 3.72Å; L314-D363 HydrophobicContact CB-CB 4.16Å; L314-D363 HydrophobicContact CD1-CB 4.11Å; L314-D363 PolarHBondContact N-OD2 3.48Å; L314-L364 HydrophobicContact CD1-CD2 4.36Å; L314-L364 HydrophobicContact CD1-CG 4.28Å; L314-L364 HydrophobicContact CD2-CD2 4.2Å; L314-I367 HydrophobicContact CD2-CD1 4.18Å
315	L	93.8	Very high	92.7	Very high	109 Å²	109	50.7 Å²	50.7	57%	0.571	26%	0.263	S	S	*	.	H	α-helix	trans	-63.8	-45.2	178.6	-69.3	173.9	0	0	0	112.2	L311 L312 S313 G318 R319	L311-L315 HydrophobicContact CG-CD1 4.44Å; L311-L315 WeakPolarHBondContact O-CG 3.47Å; L311-L315 PolarHBondContact O-N 3.39Å; L312-L315 PolarHBondContact O-N 3.41Å; S313-L315 PolarHBondContact O-N 3.48Å; L315-G318 PolarHBondContact O-N 3.5Å; L315-R319 VanDerWaalsContact O-CB 3.31Å; L315-R319 WeakPolarHBondContact O-CB 3.32Å; L315-R319 PolarHBondContact O-N 3Å
316	L	91.4	Very high	92.6	Very high	69 Å²	69	54.5 Å²	54.5	36%	0.361	28%	0.281	S	S	.	.	H	α-helix	trans	-67.4	-37.8	178.9	-70.1	176.4	0	0	0	112.5	L83 L312 S313 S320	L83-L316 HydrophobicContact CD2-CD1 3.67Å; L312-L316 WeakPolarHBondContact O-CB 3.43Å; L312-L316 VanDerWaalsContact O-CG 3.25Å; L312-L316 WeakPolarHBondContact O-CG 3.26Å; L312-L316 PolarHBondContact O-N 3.03Å; S313-L316 PolarHBondContact O-N 3.09Å; L316-S320 PolarHBondContact O-N 3.24Å; L316-S320 PolarHBondContact O-OG 3.3Å
317	C	91.3	Very high	92.3	Very high	0 Å²	0	55.2 Å²	55.2	0%	0	29%	0.285	C	S	.	.	H	α-helix	trans	-70.5	-45.3	175.5	-73.6	0	0	0	0	111.4	S313 L314 R319 S320 I321 Y356 I360	S313-C317 VanDerWaalsContact O-CB 3.28Å; S313-C317 WeakPolarHBondContact O-CB 3.41Å; S313-C317 PolarHBondContact O-N 2.89Å; S313-C317 PolarHBondContact O-SG 2.81Å; S313-C317 VanDerWaalsContact O-SG 3.37Å; L314-C317 PolarHBondContact O-N 3.48Å; C317-R319 PolarHBondContact O-N 3.31Å; C317-S320 WeakPolarHBondContact O-CA 3.38Å; C317-S320 WeakPolarHBondContact O-CB 3.43Å; C317-S320 PolarHBondContact O-N 3.01Å; C317-I321 PolarHBondContact O-N 2.94Å; C317-Y356 HydrophobicContact CB-CD1 4.44Å; C317-I360 HydrophobicContact CB-CD1 4.29Å; C317-I360 HydrophobicContact CB-CG1 3.91Å
318	G	91	Very high	92.1	Very high	29 Å²	29	56.1 Å²	56.1	30%	0.299	29%	0.286	S	S	.	.	H	α-helix	trans	-57.5	-47.1	174.6	0	0	0	0	0	112.2	L314 L315 S320 I321 L322	L314-G318 PolarHBondContact O-N 3.09Å; L315-G318 PolarHBondContact O-N 3.5Å; G318-S320 PolarHBondContact O-N 3.45Å; G318-I321 PolarHBondContact O-N 2.99Å; G318-I321 VanDerWaalsContact O-N 3.16Å; G318-L322 PolarHBondContact O-N 3.43Å
319	R	91.4	Very high	91.8	Very high	110 Å²	110	57.2 Å²	57.2	42%	0.415	29%	0.289	S	S	.	.	H	α-helix	trans	-59.3	-33.1	173.8	178.4	170.4	154.7	102.5	-15.1	113	L315 C317 R323 D566	L315-R319 VanDerWaalsContact O-CB 3.31Å; L315-R319 WeakPolarHBondContact O-CB 3.32Å; L315-R319 PolarHBondContact O-N 3Å; C317-R319 PolarHBondContact O-N 3.31Å; R319-R323 VanDerWaalsContact CZ-NH2 3.33Å; R319-R323 WeakPolarHBondContact O-CB 3.22Å; R319-R323 WeakPolarHBondContact O-CG 3.35Å; R319-R323 PolarHBondContact O-N 3.44Å; R319-D566 PolarHBondContact NH1-OXT 3.35Å; R319-D566 PolarHBondContact NH2-O 3.45Å; R319-D566 PolarHBondContact NH2-OXT 3.39Å
320	S	89.8	Confident	91.5	Very high	30 Å²	30	59.8 Å²	59.8	21%	0.21	30%	0.3	C	S	.	.	H	α-helix	trans	-73.3	-36.9	178.1	-56.5	0	0	0	0	112.3	K80 L316 C317 G318 G324	K80-S320 PolarHBondContact NZ-OG 3.37Å; L316-S320 PolarHBondContact O-N 3.24Å; L316-S320 PolarHBondContact O-OG 3.3Å; C317-S320 WeakPolarHBondContact O-CA 3.38Å; C317-S320 WeakPolarHBondContact O-CB 3.43Å; C317-S320 PolarHBondContact O-N 3.01Å; G318-S320 PolarHBondContact O-N 3.45Å; S320-G324 PolarHBondContact O-N 3.47Å; S320-G324 VanDerWaalsContact O-N 3.08Å
321	I	91.4	Very high	91.1	Very high	31 Å²	31	59.8 Å²	59.8	16%	0.159	30%	0.3	C	S	.	.	H	α-helix	trans	-67	-45.4	172.5	-66	-174.8	0	0	0	110	C317 G318 R323 G324 I325 I357 I360	C317-I321 PolarHBondContact O-N 2.94Å; G318-I321 PolarHBondContact O-N 2.99Å; G318-I321 VanDerWaalsContact O-N 3.16Å; I321-R323 VanDerWaalsContact C-N 3.32Å; I321-R323 PolarHBondContact O-N 3.27Å; I321-G324 WeakPolarHBondContact O-CA 3.35Å; I321-G324 PolarHBondContact O-N 2.85Å; I321-I325 HydrophobicContact CG2-CD1 3.84Å; I321-I325 HydrophobicContact CG2-CG1 4.36Å; I321-I325 WeakPolarHBondContact O-CG1 3.25Å; I321-I325 PolarHBondContact O-N 2.99Å; I321-I357 HydrophobicContact CD1-CG1 3.84Å; I321-I360 HydrophobicContact CD1-CD1 3.38Å; I321-I360 HydrophobicContact CG1-CD1 4.32Å
322	L	90.9	Very high	90.7	Very high	117 Å²	117	56.6 Å²	56.6	61%	0.613	28%	0.284	S	S	*	.	H	α-helix	trans	-59	-43.2	178.1	-174.2	65.4	0	0	0	111.8	G318 G324 I325 L326	G318-L322 PolarHBondContact O-N 3.43Å; L322-G324 VanDerWaalsContact C-N 3.31Å; L322-G324 PolarHBondContact O-N 2.85Å; L322-I325 PolarHBondContact O-N 3.27Å; L322-L326 WeakPolarHBondContact O-CB 3.37Å; L322-L326 PolarHBondContact O-N 2.84Å
323	R	89.8	Confident	90.3	Very high	117 Å²	117	57.9 Å²	57.9	44%	0.442	29%	0.288	S	S	.	.	H	α-helix	trans	-62.1	-37.2	172.9	-80	-178.1	171.7	-167.9	-8.5	112.7	R319 I321 L327 D566	R319-R323 VanDerWaalsContact CZ-NH2 3.33Å; R319-R323 WeakPolarHBondContact O-CB 3.22Å; R319-R323 WeakPolarHBondContact O-CG 3.35Å; R319-R323 PolarHBondContact O-N 3.44Å; I321-R323 VanDerWaalsContact C-N 3.32Å; I321-R323 PolarHBondContact O-N 3.27Å; R323-L327 VanDerWaalsContact O-CB 3.27Å; R323-L327 WeakPolarHBondContact O-CB 3.33Å; R323-L327 PolarHBondContact O-N 2.9Å; R323-D566 PolarHBondContact NH2-O 2.91Å; R323-D566 VanDerWaalsContact NH2-O 3.1Å; R323-D566 PolarHBondContact NH2-OXT 2.92Å; R323-D566 VanDerWaalsContact NH2-OXT 3.16Å
324	G	89.8	Confident	89.9	Confident	0 Å²	0	59.1 Å²	59.1	0%	0	29%	0.293	C	S	.	.	H	α-helix	trans	-63.4	-45.2	174.2	0	0	0	0	0	112.4	S320 I321 L322 L327 Q328	S320-G324 PolarHBondContact O-N 3.47Å; S320-G324 VanDerWaalsContact O-N 3.08Å; I321-G324 WeakPolarHBondContact O-CA 3.35Å; I321-G324 PolarHBondContact O-N 2.85Å; L322-G324 VanDerWaalsContact C-N 3.31Å; L322-G324 PolarHBondContact O-N 2.85Å; G324-L327 PolarHBondContact O-N 3.38Å; G324-Q328 VanDerWaalsContact O-CB 3.29Å; G324-Q328 WeakPolarHBondContact O-CB 3.47Å; G324-Q328 PolarHBondContact O-N 3.39Å
325	I	90.1	Very high	89.5	Confident	80 Å²	80	58 Å²	58	41%	0.41	29%	0.287	S	S	.	.	H	α-helix	trans	-65.7	-42.6	177.7	-64.7	168.5	0	0	0	111.2	I321 L322 Q328 H329	I321-I325 HydrophobicContact CG2-CD1 3.84Å; I321-I325 HydrophobicContact CG2-CG1 4.36Å; I321-I325 WeakPolarHBondContact O-CG1 3.25Å; I321-I325 PolarHBondContact O-N 2.99Å; L322-I325 PolarHBondContact O-N 3.27Å; I325-Q328 WeakPolarHBondContact O-CB 3.34Å; I325-Q328 PolarHBondContact O-N 2.97Å; I325-H329 PolarHBondContact O-N 2.76Å
326	L	91.3	Very high	89	Confident	124 Å²	124	56.4 Å²	56.4	65%	0.649	28%	0.279	S	S	*	.	H	α-helix	trans	-61.2	-46.9	176.4	-169.2	85.5	0	0	0	111.1	L322 Q328 H329 E330	L322-L326 WeakPolarHBondContact O-CB 3.37Å; L322-L326 PolarHBondContact O-N 2.84Å; L326-Q328 VanDerWaalsContact C-N 3.33Å; L326-Q328 PolarHBondContact O-N 3.33Å; L326-H329 WeakPolarHBondContact O-CB 3.5Å; L326-H329 PolarHBondContact O-N 2.89Å; L326-E330 PolarHBondContact O-N 3.37Å
327	L	88.9	Confident	88.6	Confident	17 Å²	17	61 Å²	61	9%	0.089	30%	0.298	C	S	.	.	H	α-helix	trans	-66.4	-36	179.2	-172.5	66	0	0	0	112	K59 L60 F63 R323 G324 H329 E330 Y331 F351	K59-L327 HydrophobicContact CB-CD1 4.25Å; L60-L327 HydrophobicContact CD2-CD1 4.37Å; L60-L327 HydrophobicContact CD2-CD2 4Å; L60-L327 HydrophobicContact CD2-CG 4.04Å; F63-L327 HydrophobicContact CB-CD2 3.59Å; F63-L327 HydrophobicContact CD1-CD2 4.18Å; F63-L327 HydrophobicContact CD2-CD2 3.9Å; F63-L327 HydrophobicContact CG-CD2 3.63Å; R323-L327 VanDerWaalsContact O-CB 3.27Å; R323-L327 WeakPolarHBondContact O-CB 3.33Å; R323-L327 PolarHBondContact O-N 2.9Å; G324-L327 PolarHBondContact O-N 3.38Å; L327-H329 VanDerWaalsContact C-N 3.33Å; L327-E330 PolarHBondContact O-N 3.38Å; L327-Y331 VanDerWaalsContact O-CB 3.3Å; L327-Y331 WeakPolarHBondContact O-CB 3.33Å; L327-Y331 PolarHBondContact O-N 3.38Å; L327-F351 HydrophobicContact CD2-CD1 4.47Å; L327-F351 HydrophobicContact CD2-CE1 4.22Å; L327-F351 HydrophobicContact CG-CE1 4.15Å
328	Q	90.8	Very high	88	Confident	34 Å²	34	64.9 Å²	64.9	16%	0.159	32%	0.315	C	S	.	.	H	α-helix	trans	-61.6	-42.8	172.5	-177.1	-167.4	-2.6	0	0	111.1	G324 I325 L326 Y331 V332 R348 F351	G324-Q328 VanDerWaalsContact O-CB 3.29Å; G324-Q328 WeakPolarHBondContact O-CB 3.47Å; G324-Q328 PolarHBondContact O-N 3.39Å; I325-Q328 WeakPolarHBondContact O-CB 3.34Å; I325-Q328 PolarHBondContact O-N 2.97Å; L326-Q328 VanDerWaalsContact C-N 3.33Å; L326-Q328 PolarHBondContact O-N 3.33Å; Q328-Y331 PolarHBondContact O-N 3.24Å; Q328-V332 WeakPolarHBondContact O-CB 3.34Å; Q328-V332 VanDerWaalsContact O-CG2 3.26Å; Q328-V332 WeakPolarHBondContact O-CG2 3.31Å; Q328-V332 PolarHBondContact O-N 2.94Å; Q328-R348 VanDerWaalsContact NE2-CB 3.28Å; Q328-R348 PolarHBondContact NE2-O 3.37Å; Q328-F351 HydrophobicContact CB-CB 3.94Å; Q328-F351 HydrophobicContact CB-CD1 4.18Å; Q328-F351 HydrophobicContact CB-CD2 4.11Å; Q328-F351 HydrophobicContact CB-CG 3.81Å; Q328-F351 HydrophobicContact CG-CB 4.28Å; Q328-F351 HydrophobicContact CG-CD2 3.96Å; Q328-F351 HydrophobicContact CG-CG 4.14Å
329	H	88.1	Confident	87.4	Confident	114 Å²	114	66.8 Å²	66.8	53%	0.528	32%	0.318	S	S	.	.	H	α-helix	trans	-65.4	-44.6	177.2	-168.4	-85.4	0	0	0	111.6	I325 L326 L327 Y331 V332 Q333	I325-H329 PolarHBondContact O-N 2.76Å; L326-H329 WeakPolarHBondContact O-CB 3.5Å; L326-H329 PolarHBondContact O-N 2.89Å; L327-H329 VanDerWaalsContact C-N 3.33Å; H329-Y331 VanDerWaalsContact C-N 3.34Å; H329-Y331 PolarHBondContact O-N 3.2Å; H329-V332 PolarHBondContact O-N 3.35Å; H329-Q333 PolarHBondContact CE1-NE2 3.48Å; H329-Q333 PolarHBondContact CE1-OE1 3.14Å; H329-Q333 VanDerWaalsContact ND1-CD 3.28Å; H329-Q333 PolarHBondContact ND1-OE1 3.12Å; H329-Q333 WeakPolarHBondContact O-CB 3.5Å; H329-Q333 WeakPolarHBondContact O-CG 3.28Å; H329-Q333 PolarHBondContact O-N 3.47Å
330	E	88.9	Confident	86.6	Confident	67 Å²	67	70 Å²	70	31%	0.313	34%	0.338	S	S	.	.	H	α-helix	trans	-58.1	-45.7	174.4	-170	179.3	174.7	0	0	111	L56 K59 L326 L327 Q333 F334	L56-E330 HydrophobicContact CD1-CG 4.17Å; K59-E330 IonicContact NZ-OE1 3.68Å; K59-E330 PolarHBondContact NZ-OE1 2.95Å; K59-E330 IonicContact NZ-OE2 3.77Å; L326-E330 PolarHBondContact O-N 3.37Å; L327-E330 PolarHBondContact O-N 3.38Å; E330-Q333 PolarHBondContact O-N 2.92Å; E330-F334 WeakPolarHBondContact O-CB 3.38Å; E330-F334 PolarHBondContact O-N 2.92Å
331	Y	86.5	Confident	86	Confident	1 Å²	1	75.5 Å²	75.5	0%	0.004	35%	0.354	C	S	.	.	H	α-helix	trans	-61.7	-47.1	177	178.3	-104.7	0	0	0	112.8	L60 L327 Q328 H329 F334 F335 V343 F351 L535 F538	L60-Y331 HydrophobicContact CD1-CD2 3.79Å; L60-Y331 HydrophobicContact CD1-CE2 4.08Å; L60-Y331 HydrophobicContact CD2-CD2 4.31Å; L327-Y331 VanDerWaalsContact O-CB 3.3Å; L327-Y331 WeakPolarHBondContact O-CB 3.33Å; L327-Y331 PolarHBondContact O-N 3.38Å; Q328-Y331 PolarHBondContact O-N 3.24Å; H329-Y331 VanDerWaalsContact C-N 3.34Å; H329-Y331 PolarHBondContact O-N 3.2Å; Y331-F334 PolarHBondContact O-N 3.31Å; Y331-F335 AromaticContact CD2-CD2 3.87Å; Y331-F335 HydrophobicContact CD2-CD2 3.87Å; Y331-F335 AromaticContact CD2-CE2 3.9Å; Y331-F335 HydrophobicContact CD2-CE2 3.9Å; Y331-F335 HydrophobicContact CE1-CD2 4.21Å; Y331-F335 HydrophobicContact CE1-CE2 4.41Å; Y331-F335 AromaticContact CE2-CD2 3.45Å; Y331-F335 HydrophobicContact CE2-CD2 3.45Å; Y331-F335 VanDerWaalsContact CE2-CD2 3.45Å; Y331-F335 AromaticContact CE2-CE2 3.1Å; Y331-F335 HydrophobicContact CE2-CE2 3.1Å; Y331-F335 HydrophobicContact CE2-CG 4.46Å; Y331-F335 AromaticContact CE2-CZ 3.86Å; Y331-F335 HydrophobicContact CE2-CZ 3.86Å; Y331-F335 HydrophobicContact CG-CD2 4.44Å; Y331-F335 AromaticContact CZ-CD2 3.62Å; Y331-F335 AromaticContact CZ-CE2 3.4Å; Y331-F335 VanDerWaalsContact CZ-CE2 3.4Å; Y331-F335 AromaticContact CZ-CZ 3.78Å; Y331-F335 WeakPolarHBondContact O-CB 3.34Å; Y331-F335 PolarHBondContact O-N 2.7Å; Y331-F335 WeakPolarHBondContact OH-CE2 3.35Å; Y331-F335 VanDerWaalsContact OH-CZ 3.28Å; Y331-F335 WeakPolarHBondContact OH-CZ 3.39Å; Y331-V343 HydrophobicContact CD1-CG1 4.33Å; Y331-V343 HydrophobicContact CD1-CG2 4.33Å; Y331-V343 HydrophobicContact CE1-CG1 3.73Å; Y331-V343 HydrophobicContact CE1-CG2 3.92Å; Y331-F351 AromaticContact CD1-CE2 3.98Å; Y331-F351 HydrophobicContact CD1-CE2 3.98Å; Y331-F351 AromaticContact CD1-CZ 3.94Å; Y331-F351 HydrophobicContact CD1-CZ 3.94Å; Y331-F351 HydrophobicContact CD2-CZ 4.48Å; Y331-F351 HydrophobicContact CE1-CE2 4.41Å; Y331-F351 HydrophobicContact CG-CE2 4.42Å; Y331-F351 AromaticContact CG-CZ 3.91Å; Y331-F351 HydrophobicContact CG-CZ 3.91Å; Y331-L535 HydrophobicContact CD2-CD1 4.32Å; Y331-L535 HydrophobicContact CE1-CD1 4.1Å; Y331-L535 HydrophobicContact CE2-CD1 3.65Å; Y331-F538 HydrophobicContact CE2-CD1 4.24Å; Y331-F538 HydrophobicContact CE2-CE1 4.49Å
332	V	86.6	Confident	85.3	Confident	19 Å²	19	80 Å²	80	12%	0.115	38%	0.383	C	S	.	.	H	α-helix	trans	-66.3	-39.7	179.8	170.7	0	0	0	0	111.4	Q328 H329 N336 V343 R348	Q328-V332 WeakPolarHBondContact O-CB 3.34Å; Q328-V332 VanDerWaalsContact O-CG2 3.26Å; Q328-V332 WeakPolarHBondContact O-CG2 3.31Å; Q328-V332 PolarHBondContact O-N 2.94Å; H329-V332 PolarHBondContact O-N 3.35Å; V332-N336 WeakPolarHBondContact O-CB 3.3Å; V332-N336 PolarHBondContact O-N 2.04Å; V332-N336 PolarHBondContact O-ND2 3.28Å; V332-V343 HydrophobicContact CG2-CB 4.34Å; V332-V343 HydrophobicContact CG2-CG2 4.31Å; V332-R348 HydrophobicContact CG2-CG 4.27Å
333	Q	86.7	Confident	84.8	Confident	113 Å²	113	74.9 Å²	74.9	53%	0.528	36%	0.357	S	S	.	.	H	α-helix	trans	-64.1	-44.8	175.4	-76.2	-176.1	-49.5	0	0	111.5	H329 E330 N336 H337	H329-Q333 PolarHBondContact CE1-NE2 3.48Å; H329-Q333 PolarHBondContact CE1-OE1 3.14Å; H329-Q333 VanDerWaalsContact ND1-CD 3.28Å; H329-Q333 PolarHBondContact ND1-OE1 3.12Å; H329-Q333 WeakPolarHBondContact O-CB 3.5Å; H329-Q333 WeakPolarHBondContact O-CG 3.28Å; H329-Q333 PolarHBondContact O-N 3.47Å; E330-Q333 PolarHBondContact O-N 2.92Å; Q333-N336 PolarHBondContact O-N 3.46Å; Q333-H337 VanDerWaalsContact O-CB 3.25Å; Q333-H337 WeakPolarHBondContact O-CB 3.44Å; Q333-H337 PolarHBondContact O-N 3.36Å
334	F	85.8	Confident	84.4	Confident	26 Å²	26	72.1 Å²	72.1	11%	0.114	36%	0.355	C	S	.	.	H	α-helix	trans	-61.1	-47.4	177.5	-176.5	-92.5	0	0	0	111.9	E53 L56 E330 Y331 N336 H337 K338 L339 F538	E53-F334 HydrophobicContact CB-CZ 3.93Å; E53-F334 HydrophobicContact CG-CE1 4.29Å; E53-F334 HydrophobicContact CG-CZ 3.89Å; L56-F334 HydrophobicContact CD2-CB 3.7Å; L56-F334 HydrophobicContact CD2-CD1 3.53Å; L56-F334 HydrophobicContact CD2-CD2 3.9Å; L56-F334 HydrophobicContact CD2-CE1 4.11Å; L56-F334 HydrophobicContact CD2-CE2 4.42Å; L56-F334 HydrophobicContact CD2-CG 3.42Å; L56-F334 VanDerWaalsContact CD2-CG 3.42Å; E330-F334 WeakPolarHBondContact O-CB 3.38Å; E330-F334 PolarHBondContact O-N 2.92Å; Y331-F334 PolarHBondContact O-N 3.31Å; F334-N336 PolarHBondContact O-N 3.03Å; F334-H337 PolarHBondContact O-N 2.89Å; F334-K338 HydrophobicContact CD2-CD 4.45Å; F334-K338 HydrophobicContact CD2-CG 4.33Å; F334-K338 HydrophobicContact CE2-CB 4.47Å; F334-K338 HydrophobicContact CE2-CD 3.75Å; F334-K338 HydrophobicContact CE2-CG 4.08Å; F334-K338 HydrophobicContact CZ-CB 4.38Å; F334-K338 HydrophobicContact CZ-CD 4.07Å; F334-K338 HydrophobicContact CZ-CG 4.43Å; F334-K338 PolarHBondContact O-N 2.86Å; F334-L339 HydrophobicContact CD1-CD1 4.33Å; F334-L339 HydrophobicContact CE1-CD1 4.05Å; F334-F538 HydrophobicContact CE1-CE2 4.5Å; F334-F538 HydrophobicContact CE1-CZ 4.09Å
335	F	84.6	Confident	83.9	Confident	12 Å²	12	81.8 Å²	81.8	5%	0.053	39%	0.392	C	S	.	.	H	α-helix	trans	-65.1	-39.5	179.4	-98.7	-107.9	0	0	0	113.3	Y331 L339 E340 R341 V343 F538	Y331-F335 AromaticContact CD2-CD2 3.87Å; Y331-F335 HydrophobicContact CD2-CD2 3.87Å; Y331-F335 AromaticContact CD2-CE2 3.9Å; Y331-F335 HydrophobicContact CD2-CE2 3.9Å; Y331-F335 HydrophobicContact CE1-CD2 4.21Å; Y331-F335 HydrophobicContact CE1-CE2 4.41Å; Y331-F335 AromaticContact CE2-CD2 3.45Å; Y331-F335 HydrophobicContact CE2-CD2 3.45Å; Y331-F335 VanDerWaalsContact CE2-CD2 3.45Å; Y331-F335 AromaticContact CE2-CE2 3.1Å; Y331-F335 HydrophobicContact CE2-CE2 3.1Å; Y331-F335 HydrophobicContact CE2-CG 4.46Å; Y331-F335 AromaticContact CE2-CZ 3.86Å; Y331-F335 HydrophobicContact CE2-CZ 3.86Å; Y331-F335 HydrophobicContact CG-CD2 4.44Å; Y331-F335 AromaticContact CZ-CD2 3.62Å; Y331-F335 AromaticContact CZ-CE2 3.4Å; Y331-F335 VanDerWaalsContact CZ-CE2 3.4Å; Y331-F335 AromaticContact CZ-CZ 3.78Å; Y331-F335 WeakPolarHBondContact O-CB 3.34Å; Y331-F335 PolarHBondContact O-N 2.7Å; Y331-F335 WeakPolarHBondContact OH-CE2 3.35Å; Y331-F335 VanDerWaalsContact OH-CZ 3.28Å; Y331-F335 WeakPolarHBondContact OH-CZ 3.39Å; F335-L339 HydrophobicContact CD1-CD1 3.95Å; F335-L339 HydrophobicContact CD2-CD1 3.95Å; F335-L339 HydrophobicContact CE1-CD1 3.9Å; F335-L339 HydrophobicContact CE2-CD1 3.85Å; F335-L339 HydrophobicContact CG-CD1 3.99Å; F335-L339 HydrophobicContact CZ-CD1 3.85Å; F335-L339 CarbonylContact O-C 3.51Å; F335-L339 WeakPolarHBondContact O-CB 3.27Å; F335-L339 PolarHBondContact O-N 2.74Å; F335-E340 PolarHBondContact O-N 2.64Å; F335-R341 CarbonylContact C-O 3.51Å; F335-R341 PolarHBondContact O-N 2.96Å; F335-V343 HydrophobicContact CB-CG2 3.56Å; F335-V343 HydrophobicContact CD1-CG2 4.13Å; F335-V343 HydrophobicContact CG-CG2 3.92Å; F335-F538 HydrophobicContact CE2-CD1 4.3Å; F335-F538 HydrophobicContact CE2-CD2 4.22Å; F335-F538 HydrophobicContact CE2-CE1 4.3Å; F335-F538 HydrophobicContact CE2-CE2 4.21Å; F335-F538 HydrophobicContact CE2-CG 4.26Å; F335-F538 HydrophobicContact CE2-CZ 4.26Å; F335-F538 HydrophobicContact CZ-CB 4.48Å; F335-F538 HydrophobicContact CZ-CD2 4.05Å; F335-F538 HydrophobicContact CZ-CE2 4.41Å; F335-F538 HydrophobicContact CZ-CG 4.15Å
336	N	83.7	Confident	83.3	Confident	75 Å²	75	80.5 Å²	80.5	40%	0.401	40%	0.398	S	S	.	.	H	α-helix	trans	-69.8	-39.3	176.8	-77.2	-24.9	0	0	0	112	V332 Q333 F334 R341	V332-N336 WeakPolarHBondContact O-CB 3.3Å; V332-N336 PolarHBondContact O-N 2.04Å; V332-N336 PolarHBondContact O-ND2 3.28Å; Q333-N336 PolarHBondContact O-N 3.46Å; F334-N336 PolarHBondContact O-N 3.03Å; N336-R341 PolarHBondContact OD1-O 2.84Å
337	H	82.8	Confident	82.7	Confident	166 Å²	166	75.2 Å²	75.2	77%	0.769	37%	0.371	S	S	*	.	H	α-helix	trans	-86	-38.5	-172.5	-169.3	-73.8	0	0	0	113.7	Q333 F334	Q333-H337 VanDerWaalsContact O-CB 3.25Å; Q333-H337 WeakPolarHBondContact O-CB 3.44Å; Q333-H337 PolarHBondContact O-N 3.36Å; F334-H337 PolarHBondContact O-N 2.89Å
338	K	80	Confident	82.5	Confident	81 Å²	81	77.1 Å²	77.1	35%	0.352	38%	0.377	S	S	.	.	H	α-helix	trans	-98.2	-34.3	-177.2	-70.5	-139.6	-173.6	-179.5	0	113.8	E52 F334	E52-K338 WeakPolarHBondContact OE2-CE 3.25Å; E52-K338 IonicContact OE2-NZ 3.78Å; E52-K338 PolarHBondContact OE2-NZ 3.1Å; F334-K338 HydrophobicContact CD2-CD 4.45Å; F334-K338 HydrophobicContact CD2-CG 4.33Å; F334-K338 HydrophobicContact CE2-CB 4.47Å; F334-K338 HydrophobicContact CE2-CD 3.75Å; F334-K338 HydrophobicContact CE2-CG 4.08Å; F334-K338 HydrophobicContact CZ-CB 4.38Å; F334-K338 HydrophobicContact CZ-CD 4.07Å; F334-K338 HydrophobicContact CZ-CG 4.43Å; F334-K338 PolarHBondContact O-N 2.86Å
339	L	76.7	Confident	82.1	Confident	68 Å²	68	81 Å²	81	36%	0.356	40%	0.396	S	S	.	.	S	Bend	trans	-103.6	-2.7	-174.6	-73.6	147.3	0	0	0	113	F334 F335 R341	F334-L339 HydrophobicContact CD1-CD1 4.33Å; F334-L339 HydrophobicContact CE1-CD1 4.05Å; F335-L339 HydrophobicContact CD1-CD1 3.95Å; F335-L339 HydrophobicContact CD2-CD1 3.95Å; F335-L339 HydrophobicContact CE1-CD1 3.9Å; F335-L339 HydrophobicContact CE2-CD1 3.85Å; F335-L339 HydrophobicContact CG-CD1 3.99Å; F335-L339 HydrophobicContact CZ-CD1 3.85Å; F335-L339 CarbonylContact O-C 3.51Å; F335-L339 WeakPolarHBondContact O-CB 3.27Å; F335-L339 PolarHBondContact O-N 2.74Å; L339-R341 WeakPolarHBondContact O-CG 3.43Å; L339-R341 PolarHBondContact O-N 2.83Å
340	E	76.7	Confident	81.9	Confident	179 Å²	179	78.8 Å²	78.8	84%	0.836	39%	0.386	S	S	*	.			trans	46.8	28.8	-175.4	-65.3	-170.9	162.1	0	0	113.8	F335	F335-E340 PolarHBondContact O-N 2.64Å
341	R	77.1	Confident	81.7	Confident	145 Å²	145	75.8 Å²	75.8	55%	0.547	37%	0.372	S	S	.	.			trans	-116.5	138.7	-175.6	-79.7	178.4	-172.5	-163	5.9	111.2	F335 N336 L339 E534	F335-R341 CarbonylContact C-O 3.51Å; F335-R341 PolarHBondContact O-N 2.96Å; N336-R341 PolarHBondContact OD1-O 2.84Å; L339-R341 WeakPolarHBondContact O-CG 3.43Å; L339-R341 PolarHBondContact O-N 2.83Å; R341-E534 IonicContact NH1-OE1 2.7Å
342	T	76.5	Confident	81.7	Confident	124 Å²	124	78.5 Å²	78.5	76%	0.761	39%	0.386	S	S	*	.	P	Polyproline II helix	trans	-86	123.1	176.1	55.8	0	0	0	0	110.6
343	V	79.3	Confident	81.7	Confident	11 Å²	11	80 Å²	80	7%	0.067	39%	0.393	C	S	.	.	P	Polyproline II helix	trans	-73.2	134.2	179.1	-177	0	0	0	0	111	Y331 V332 F335 D347 R348	Y331-V343 HydrophobicContact CD1-CG1 4.33Å; Y331-V343 HydrophobicContact CD1-CG2 4.33Å; Y331-V343 HydrophobicContact CE1-CG1 3.73Å; Y331-V343 HydrophobicContact CE1-CG2 3.92Å; V332-V343 HydrophobicContact CG2-CB 4.34Å; V332-V343 HydrophobicContact CG2-CG2 4.31Å; F335-V343 HydrophobicContact CB-CG2 3.56Å; F335-V343 HydrophobicContact CD1-CG2 4.13Å; F335-V343 HydrophobicContact CG-CG2 3.92Å; V343-D347 HydrophobicContact CG1-CB 3.98Å; V343-R348 HydrophobicContact CG1-CG 4.2Å
344	S	81.4	Confident	81.7	Confident	58 Å²	58	76.8 Å²	76.8	41%	0.406	39%	0.39	S	S	.	.	P	Polyproline II helix	trans	-64.7	154	178.2	87.1	0	0	0	0	112.9	G346 D347 R348	S344-G346 PolarHBondContact O-N 3.44Å; S344-G346 PolarHBondContact OG-N 3.29Å; S344-D347 PolarHBondContact OG-N 3.47Å; S344-D347 PolarHBondContact OG-OD2 3.48Å; S344-R348 WeakPolarHBondContact O-CG 3.08Å; S344-R348 PolarHBondContact O-N 3.28Å
345	W	78.8	Confident	81.9	Confident	204 Å²	204	78.6 Å²	78.6	77%	0.773	40%	0.396	S	S	*	.	H	α-helix	trans	-66.4	-25.1	174.5	-76	100.2	0	0	0	113.2	M349	W345-M349 PolarHBondContact O-N 2.98Å; W345-M349 VanDerWaalsContact O-N 3.15Å
346	G	77.7	Confident	82.1	Confident	52 Å²	52	79.9 Å²	79.9	54%	0.536	40%	0.401	S	S	.	.	H	α-helix	trans	-64.2	-50.8	176.5	0	0	0	0	0	111.6	S344 R348 M349 E350	S344-G346 PolarHBondContact O-N 3.44Å; S344-G346 PolarHBondContact OG-N 3.29Å; G346-R348 VanDerWaalsContact C-N 3.28Å; G346-R348 PolarHBondContact O-N 3.46Å; G346-M349 PolarHBondContact O-N 3.24Å; G346-M349 VanDerWaalsContact O-N 3.14Å; G346-E350 PolarHBondContact O-N 3.24Å
347	D	79.4	Confident	82.5	Confident	14 Å²	14	79.7 Å²	79.7	8%	0.075	40%	0.399	C	S	.	.	H	α-helix	trans	-64.3	-36.8	180	-53	-43.8	0	0	0	111.2	V343 S344 M349 E350 F351 L535	V343-D347 HydrophobicContact CG1-CB 3.98Å; S344-D347 PolarHBondContact OG-N 3.47Å; S344-D347 PolarHBondContact OG-OD2 3.48Å; D347-M349 VanDerWaalsContact C-N 3.34Å; D347-M349 PolarHBondContact O-N 3.14Å; D347-E350 WeakPolarHBondContact O-CB 3.44Å; D347-E350 PolarHBondContact O-N 2.77Å; D347-F351 WeakPolarHBondContact O-CD2 3.45Å; D347-L535 HydrophobicContact CB-CB 4.49Å
348	R	84.6	Confident	83	Confident	57 Å²	57	73.6 Å²	73.6	22%	0.215	37%	0.372	C	S	.	.	H	α-helix	trans	-59.9	-41.6	174.1	-76.8	-178	-170.4	-161.8	1	112.8	Q328 V332 V343 S344 G346 E350	Q328-R348 VanDerWaalsContact NE2-CB 3.28Å; Q328-R348 PolarHBondContact NE2-O 3.37Å; V332-R348 HydrophobicContact CG2-CG 4.27Å; V343-R348 HydrophobicContact CG1-CG 4.2Å; S344-R348 WeakPolarHBondContact O-CG 3.08Å; S344-R348 PolarHBondContact O-N 3.28Å; G346-R348 VanDerWaalsContact C-N 3.28Å; G346-R348 PolarHBondContact O-N 3.46Å; R348-E350 PolarHBondContact O-N 3.49Å
349	M	82.3	Confident	83.6	Confident	115 Å²	115	69.9 Å²	69.9	57%	0.567	36%	0.356	S	S	*	.	H	α-helix	trans	-71.9	-20.9	-178.8	-163.1	65.9	76.1	0	0	112.2	W345 G346 D347 F351 I352	W345-M349 PolarHBondContact O-N 2.98Å; W345-M349 VanDerWaalsContact O-N 3.15Å; G346-M349 PolarHBondContact O-N 3.24Å; G346-M349 VanDerWaalsContact O-N 3.14Å; D347-M349 VanDerWaalsContact C-N 3.34Å; D347-M349 PolarHBondContact O-N 3.14Å; M349-F351 VanDerWaalsContact C-N 3.31Å; M349-F351 PolarHBondContact O-N 3.38Å; M349-I352 PolarHBondContact O-N 2.83Å; M349-I352 HydrophobicContact SD-CD1 4.44Å
350	E	83.7	Confident	84.4	Confident	68 Å²	68	68.3 Å²	68.3	32%	0.318	35%	0.348	S	S	.	.	H	α-helix	trans	-69	-27.6	179.1	-161.4	170.9	-176	0	0	113.2	F64 G346 D347 R348 I352 H536	F64-E350 HydrophobicContact CE1-CG 4.02Å; F64-E350 HydrophobicContact CZ-CG 4.44Å; G346-E350 PolarHBondContact O-N 3.24Å; D347-E350 WeakPolarHBondContact O-CB 3.44Å; D347-E350 PolarHBondContact O-N 2.77Å; R348-E350 PolarHBondContact O-N 3.49Å; E350-I352 VanDerWaalsContact C-N 3.25Å; E350-I352 PolarHBondContact O-N 2.92Å; E350-H536 IonicContact OE1-CD2 3.7Å; E350-H536 IonicContact OE1-CE1 2.61Å; E350-H536 PolarHBondContact OE1-CE1 3.27Å; E350-H536 IonicContact OE1-NE2 3.35Å; E350-H536 PolarHBondContact OE1-NE2 2.98Å; E350-H536 IonicContact OE2-NE2 2.65Å; E350-H536 PolarHBondContact OE2-NE2 2.96Å
351	F	86	Confident	85.3	Confident	4 Å²	4	63.1 Å²	63.1	2%	0.018	33%	0.325	C	S	.	.	T	Hydrogen-bonded Turn	trans	-67.3	-25.5	173.3	-69.8	-90.3	0	0	0	113	L60 F63 F64 L327 Q328 Y331 D347 M349 N353 L535	L60-F351 HydrophobicContact CD2-CE1 3.52Å; L60-F351 HydrophobicContact CD2-CZ 3.75Å; F63-F351 HydrophobicContact CE1-CD1 4.3Å; F64-F351 HydrophobicContact CE2-CE1 4.14Å; F64-F351 HydrophobicContact CE2-CZ 4.46Å; F64-F351 HydrophobicContact CZ-CD1 4.18Å; F64-F351 HydrophobicContact CZ-CE1 4.2Å; F64-F351 HydrophobicContact CZ-CG 4.47Å; F64-F351 HydrophobicContact CZ-CZ 4.5Å; L327-F351 HydrophobicContact CD2-CD1 4.47Å; L327-F351 HydrophobicContact CD2-CE1 4.22Å; L327-F351 HydrophobicContact CG-CE1 4.15Å; Q328-F351 HydrophobicContact CB-CB 3.94Å; Q328-F351 HydrophobicContact CB-CD1 4.18Å; Q328-F351 HydrophobicContact CB-CD2 4.11Å; Q328-F351 HydrophobicContact CB-CG 3.81Å; Q328-F351 HydrophobicContact CG-CB 4.28Å; Q328-F351 HydrophobicContact CG-CD2 3.96Å; Q328-F351 HydrophobicContact CG-CG 4.14Å; Y331-F351 AromaticContact CD1-CE2 3.98Å; Y331-F351 HydrophobicContact CD1-CE2 3.98Å; Y331-F351 AromaticContact CD1-CZ 3.94Å; Y331-F351 HydrophobicContact CD1-CZ 3.94Å; Y331-F351 HydrophobicContact CD2-CZ 4.48Å; Y331-F351 HydrophobicContact CE1-CE2 4.41Å; Y331-F351 HydrophobicContact CG-CE2 4.42Å; Y331-F351 AromaticContact CG-CZ 3.91Å; Y331-F351 HydrophobicContact CG-CZ 3.91Å; D347-F351 WeakPolarHBondContact O-CD2 3.45Å; M349-F351 VanDerWaalsContact C-N 3.31Å; M349-F351 PolarHBondContact O-N 3.38Å; F351-N353 PolarHBondContact O-N 2.96Å; F351-L535 HydrophobicContact CE2-CD1 4.26Å; F351-L535 HydrophobicContact CE2-CD2 4.05Å; F351-L535 HydrophobicContact CZ-CD1 3.91Å; F351-L535 HydrophobicContact CZ-CD2 4.27Å
352	I	86.5	Confident	86.2	Confident	57 Å²	57	56.2 Å²	56.2	29%	0.292	30%	0.299	S	S	.	.	S	Bend	trans	-91	100.9	179.4	-58.3	177.8	0	0	0	109.2	M349 E350 G354 I357	M349-I352 PolarHBondContact O-N 2.83Å; M349-I352 HydrophobicContact SD-CD1 4.44Å; E350-I352 VanDerWaalsContact C-N 3.25Å; E350-I352 PolarHBondContact O-N 2.92Å; I352-G354 PolarHBondContact O-N 3.07Å; I352-G354 VanDerWaalsContact O-N 3.15Å; I352-I357 HydrophobicContact CG2-CD1 3.71Å
353	N	85.1	Confident	87.1	Confident	51 Å²	51	50.3 Å²	50.3	27%	0.273	26%	0.263	S	S	.	.			trans	-77.4	104.4	179.2	-170.1	-30.1	0	0	0	111.5	F351 W355 Y356	F351-N353 PolarHBondContact O-N 2.96Å; N353-W355 PolarHBondContact O-N 3.26Å; N353-W355 VanDerWaalsContact O-N 3.12Å; N353-W355 VanDerWaalsContact OD1-CB 3.28Å; N353-W355 WeakPolarHBondContact OD1-CB 3.27Å; N353-W355 VanDerWaalsContact OD1-CD1 3.32Å; N353-W355 PolarHBondContact OD1-N 2.9Å; N353-Y356 HydrophobicContact CB-CD2 3.69Å; N353-Y356 HydrophobicContact CB-CE2 4.16Å; N353-Y356 HydrophobicContact CB-CG 4.48Å; N353-Y356 PolarHBondContact O-N 3.43Å
354	G	86.8	Confident	87.9	Confident	45 Å²	45	53.8 Å²	53.8	46%	0.464	28%	0.281	S	S	.	.	H	α-helix	trans	-55.5	-27.9	179.3	0	0	0	0	0	114.8	I352 Y356 I357 L358	I352-G354 PolarHBondContact O-N 3.07Å; I352-G354 VanDerWaalsContact O-N 3.15Å; G354-Y356 VanDerWaalsContact C-N 3.3Å; G354-Y356 PolarHBondContact O-N 3.49Å; G354-I357 PolarHBondContact O-N 3.42Å; G354-L358 PolarHBondContact O-N 3.32Å
355	W	89.8	Confident	88.7	Confident	64 Å²	64	54.6 Å²	54.6	24%	0.242	28%	0.277	C	S	.	.	H	α-helix	trans	-65.1	-32.8	174.6	-63.1	103.6	0	0	0	112.7	N353 L359 V400 I403 R404 I416	N353-W355 PolarHBondContact O-N 3.26Å; N353-W355 VanDerWaalsContact O-N 3.12Å; N353-W355 VanDerWaalsContact OD1-CB 3.28Å; N353-W355 WeakPolarHBondContact OD1-CB 3.27Å; N353-W355 VanDerWaalsContact OD1-CD1 3.32Å; N353-W355 PolarHBondContact OD1-N 2.9Å; W355-L359 VanDerWaalsContact O-CG 3.31Å; W355-L359 WeakPolarHBondContact O-CG 3.48Å; W355-L359 PolarHBondContact O-N 3.38Å; W355-L359 VanDerWaalsContact O-N 3.09Å; W355-V400 HydrophobicContact CZ3-CG1 4.39Å; W355-V400 WeakPolarHBondContact CZ3-O 3.35Å; W355-I403 HydrophobicContact CH2-CB 3.76Å; W355-I403 HydrophobicContact CH2-CG2 3.71Å; W355-I403 HydrophobicContact CZ2-CG2 4.32Å; W355-I403 HydrophobicContact CZ3-CB 4.18Å; W355-R404 HydrophobicContact CB-CB 4.47Å; W355-R404 HydrophobicContact CB-CG 4.04Å; W355-R404 HydrophobicContact CD2-CB 3.68Å; W355-R404 HydrophobicContact CD2-CG 3.95Å; W355-R404 HydrophobicContact CE3-CB 3.8Å; W355-R404 HydrophobicContact CG-CB 4Å; W355-R404 HydrophobicContact CG-CG 3.72Å; W355-R404 HydrophobicContact CZ3-CB 4.29Å; W355-I416 HydrophobicContact CZ2-CG2 4.12Å
356	Y	90.4	Very high	89.5	Confident	39 Å²	39	44.9 Å²	44.9	15%	0.153	24%	0.24	C	C	.	.	H	α-helix	trans	-72.1	-34.1	174.9	-69.3	-44.1	0	0	0	112	K80 C317 N353 G354 L359 I360 R404	K80-Y356 PolarHBondContact NZ-OH 3.19Å; C317-Y356 HydrophobicContact CB-CD1 4.44Å; N353-Y356 HydrophobicContact CB-CD2 3.69Å; N353-Y356 HydrophobicContact CB-CE2 4.16Å; N353-Y356 HydrophobicContact CB-CG 4.48Å; N353-Y356 PolarHBondContact O-N 3.43Å; G354-Y356 VanDerWaalsContact C-N 3.3Å; G354-Y356 PolarHBondContact O-N 3.49Å; Y356-L359 HydrophobicContact CD1-CD1 4.35Å; Y356-L359 PolarHBondContact O-N 2.89Å; Y356-I360 WeakPolarHBondContact O-CB 3.43Å; Y356-I360 VanDerWaalsContact O-CG1 3.25Å; Y356-I360 WeakPolarHBondContact O-CG1 3.35Å; Y356-I360 PolarHBondContact O-N 3.39Å; Y356-R404 VanDerWaalsContact CE1-CZ 3.45Å; Y356-R404 PolarHBondContact OH-NH2 2.86Å
357	I	92	Very high	90.4	Very high	71 Å²	71	43.6 Å²	43.6	36%	0.364	22%	0.221	S	C	.	.	H	α-helix	trans	-63	-46.6	173.8	-61.7	174.4	0	0	0	109.8	I321 I352 G354 L359 I360 I361	I321-I357 HydrophobicContact CD1-CG1 3.84Å; I352-I357 HydrophobicContact CG2-CD1 3.71Å; G354-I357 PolarHBondContact O-N 3.42Å; I357-L359 VanDerWaalsContact C-N 3.32Å; I357-L359 PolarHBondContact O-N 3.08Å; I357-I360 PolarHBondContact O-N 3.4Å; I357-I360 VanDerWaalsContact O-N 3.16Å; I357-I361 HydrophobicContact CG2-CD1 3.96Å; I357-I361 WeakPolarHBondContact O-CG1 3.48Å; I357-I361 PolarHBondContact O-N 3.26Å
358	L	92.3	Very high	91.1	Very high	38 Å²	38	46.4 Å²	46.4	20%	0.199	24%	0.238	C	C	.	.	H	α-helix	trans	-58	-43.9	176.7	-170.8	153.6	0	0	0	111.9	G354 I361 S362 L397 V400	G354-L358 PolarHBondContact O-N 3.32Å; L358-I361 PolarHBondContact O-N 2.79Å; L358-S362 PolarHBondContact O-N 3.42Å; L358-L397 HydrophobicContact CD1-CD2 4.47Å; L358-L397 HydrophobicContact CD2-CB 4.01Å; L358-L397 HydrophobicContact CD2-CD2 4.43Å; L358-L397 WeakPolarHBondContact CD2-O 3.17Å; L358-L397 HydrophobicContact CG-CD2 4.25Å; L358-V400 HydrophobicContact CD1-CG1 4.01Å
359	L	92.3	Very high	91.6	Very high	4 Å²	4	43.7 Å²	43.7	2%	0.021	23%	0.228	C	C	.	.	H	α-helix	trans	-66.3	-37	176.6	-69.4	171.9	0	0	0	112.9	W355 Y356 I357 S362 D363	W355-L359 VanDerWaalsContact O-CG 3.31Å; W355-L359 WeakPolarHBondContact O-CG 3.48Å; W355-L359 PolarHBondContact O-N 3.38Å; W355-L359 VanDerWaalsContact O-N 3.09Å; Y356-L359 HydrophobicContact CD1-CD1 4.35Å; Y356-L359 PolarHBondContact O-N 2.89Å; I357-L359 VanDerWaalsContact C-N 3.32Å; I357-L359 PolarHBondContact O-N 3.08Å; L359-S362 WeakPolarHBondContact CA-OG 3.48Å; L359-S362 PolarHBondContact O-N 3.42Å; L359-S362 PolarHBondContact O-OG 3.08Å; L359-D363 WeakPolarHBondContact O-CB 3.41Å; L359-D363 PolarHBondContact O-N 3.37Å
360	I	94.4	Very high	92.2	Very high	34 Å²	34	38.2 Å²	38.2	17%	0.174	20%	0.201	C	C	.	.	H	α-helix	trans	-64	-45.9	176.1	-75.1	167.5	0	0	0	110.6	L314 C317 I321 Y356 I357 S362 D363 L364	L314-I360 HydrophobicContact CD1-CB 4.14Å; L314-I360 HydrophobicContact CD1-CG1 4.12Å; L314-I360 HydrophobicContact CD1-CG2 3.72Å; C317-I360 HydrophobicContact CB-CD1 4.29Å; C317-I360 HydrophobicContact CB-CG1 3.91Å; I321-I360 HydrophobicContact CD1-CD1 3.38Å; I321-I360 HydrophobicContact CG1-CD1 4.32Å; Y356-I360 WeakPolarHBondContact O-CB 3.43Å; Y356-I360 VanDerWaalsContact O-CG1 3.25Å; Y356-I360 WeakPolarHBondContact O-CG1 3.35Å; Y356-I360 PolarHBondContact O-N 3.39Å; I357-I360 PolarHBondContact O-N 3.4Å; I357-I360 VanDerWaalsContact O-N 3.16Å; I360-S362 VanDerWaalsContact C-N 3.32Å; I360-S362 PolarHBondContact O-N 3.01Å; I360-D363 PolarHBondContact O-N 3.07Å; I360-L364 HydrophobicContact CG2-CD1 4.3Å; I360-L364 WeakPolarHBondContact O-CG 3.39Å; I360-L364 PolarHBondContact O-N 3.46Å
361	I	95.6	Very high	92.7	Very high	71 Å²	71	41.5 Å²	41.5	36%	0.364	21%	0.214	S	C	.	.	H	α-helix	trans	-61.6	-43.5	176.8	-64.8	167.7	0	0	0	110.2	I357 L358 D363 L364 F365 L397	I357-I361 HydrophobicContact CG2-CD1 3.96Å; I357-I361 WeakPolarHBondContact O-CG1 3.48Å; I357-I361 PolarHBondContact O-N 3.26Å; L358-I361 PolarHBondContact O-N 2.79Å; I361-D363 VanDerWaalsContact C-N 3.34Å; I361-D363 PolarHBondContact O-N 3.22Å; I361-L364 PolarHBondContact O-N 3.02Å; I361-F365 HydrophobicContact CG2-CD2 4.32Å; I361-F365 HydrophobicContact CG2-CE2 3.92Å; I361-F365 HydrophobicContact CG2-CZ 4.04Å; I361-F365 PolarHBondContact O-N 3.09Å; I361-F365 VanDerWaalsContact O-N 3.1Å; I361-L397 HydrophobicContact CG2-CD1 4.05Å
362	S	95.8	Very high	93	Very high	0 Å²	0	42.9 Å²	42.9	0%	0	22%	0.222	C	C	.	.	H	α-helix	trans	-61.2	-42.8	175.8	72	0	0	0	0	112.1	L358 L359 I360 L364 F365 T366	L358-S362 PolarHBondContact O-N 3.42Å; L359-S362 WeakPolarHBondContact CA-OG 3.48Å; L359-S362 PolarHBondContact O-N 3.42Å; L359-S362 PolarHBondContact O-OG 3.08Å; I360-S362 VanDerWaalsContact C-N 3.32Å; I360-S362 PolarHBondContact O-N 3.01Å; S362-L364 VanDerWaalsContact C-N 3.34Å; S362-L364 PolarHBondContact O-N 3.27Å; S362-F365 PolarHBondContact O-N 2.83Å; S362-T366 PolarHBondContact O-N 3.14Å; S362-T366 PolarHBondContact O-OG1 2.99Å
363	D	95.9	Very high	93.2	Very high	0 Å²	0	40.3 Å²	40.3	0%	0	21%	0.208	C	C	.	.	H	α-helix	trans	-65.1	-39.3	-179.1	-69	-18.3	0	0	0	111	K87 S313 L314 L359 I360 I361 T366 I367	K87-D363 VanDerWaalsContact CD-OD1 3.29Å; K87-D363 WeakPolarHBondContact CD-OD1 3.48Å; K87-D363 WeakPolarHBondContact CE-OD1 3.44Å; K87-D363 IonicContact NZ-OD1 2.64Å; K87-D363 PolarHBondContact NZ-OD1 3.11Å; K87-D363 IonicContact NZ-OD2 3.39Å; S313-D363 VanDerWaalsContact CB-OD2 3.29Å; S313-D363 WeakPolarHBondContact CB-OD2 3.45Å; S313-D363 PolarHBondContact OG-OD1 3.23Å; S313-D363 PolarHBondContact OG-OD2 3.15Å; L314-D363 HydrophobicContact CB-CB 4.16Å; L314-D363 HydrophobicContact CD1-CB 4.11Å; L314-D363 PolarHBondContact N-OD2 3.48Å; L359-D363 WeakPolarHBondContact O-CB 3.41Å; L359-D363 PolarHBondContact O-N 3.37Å; I360-D363 PolarHBondContact O-N 3.07Å; I361-D363 VanDerWaalsContact C-N 3.34Å; I361-D363 PolarHBondContact O-N 3.22Å; D363-T366 PolarHBondContact O-N 2.76Å; D363-I367 WeakPolarHBondContact O-CB 2.99Å; D363-I367 WeakPolarHBondContact O-CD1 3.49Å; D363-I367 WeakPolarHBondContact O-CG1 3.15Å; D363-I367 PolarHBondContact O-N 3.13Å
364	L	95.8	Very high	93.5	Very high	84 Å²	84	39.9 Å²	39.9	44%	0.44	21%	0.205	S	C	.	.	H	α-helix	trans	-61.3	-46.7	174.4	-70.1	171.9	0	0	0	111.7	L314 I360 I361 S362 I367 V368	L314-L364 HydrophobicContact CD1-CD2 4.36Å; L314-L364 HydrophobicContact CD1-CG 4.28Å; L314-L364 HydrophobicContact CD2-CD2 4.2Å; I360-L364 HydrophobicContact CG2-CD1 4.3Å; I360-L364 WeakPolarHBondContact O-CG 3.39Å; I360-L364 PolarHBondContact O-N 3.46Å; I361-L364 PolarHBondContact O-N 3.02Å; S362-L364 VanDerWaalsContact C-N 3.34Å; S362-L364 PolarHBondContact O-N 3.27Å; L364-I367 PolarHBondContact O-N 3.29Å; L364-V368 WeakPolarHBondContact O-CG2 3.47Å; L364-V368 PolarHBondContact O-N 3.02Å
365	F	96.8	Very high	93.5	Very high	75 Å²	75	38 Å²	38	33%	0.329	19%	0.187	S	C	.	.	H	α-helix	trans	-64.6	-40.5	177.3	-70.1	-11.6	0	0	0	112.4	I361 S362 G369 L390 L397	I361-F365 HydrophobicContact CG2-CD2 4.32Å; I361-F365 HydrophobicContact CG2-CE2 3.92Å; I361-F365 HydrophobicContact CG2-CZ 4.04Å; I361-F365 PolarHBondContact O-N 3.09Å; I361-F365 VanDerWaalsContact O-N 3.1Å; S362-F365 PolarHBondContact O-N 2.83Å; F365-G369 PolarHBondContact O-N 3.45Å; F365-L390 HydrophobicContact CB-CD2 4.46Å; F365-L390 HydrophobicContact CD1-CD2 4Å; F365-L390 HydrophobicContact CE1-CD2 4.48Å; F365-L390 HydrophobicContact CG-CD2 4.24Å; F365-L397 HydrophobicContact CD2-CD1 4.28Å; F365-L397 HydrophobicContact CE2-CD1 4.34Å
366	T	96.3	Very high	93.3	Very high	0 Å²	0	35.2 Å²	35.2	0%	0	18%	0.176	C	C	.	.	H	α-helix	trans	-66.3	-40.1	176.6	-52.5	0	0	0	0	111.9	V91 V306 C310 S362 D363 S370 S394	V91-T366 HydrophobicContact CG1-CG2 4.22Å; V91-T366 HydrophobicContact CG2-CG2 3.86Å; V306-T366 HydrophobicContact CG1-CG2 3.91Å; C310-T366 VanDerWaalsContact SG-CG2 3.56Å; S362-T366 PolarHBondContact O-N 3.14Å; S362-T366 PolarHBondContact O-OG1 2.99Å; D363-T366 PolarHBondContact O-N 2.76Å; T366-S370 VanDerWaalsContact O-CB 3.28Å; T366-S370 WeakPolarHBondContact O-CB 3.48Å; T366-S370 PolarHBondContact O-N 3.18Å; T366-S370 PolarHBondContact O-OG 3.4Å; T366-S394 WeakPolarHBondContact OG1-CB 3.32Å; T366-S394 PolarHBondContact OG1-OG 3.35Å
367	I	96.1	Very high	92.9	Very high	25 Å²	25	35.5 Å²	35.5	13%	0.128	18%	0.179	C	C	.	.	H	α-helix	trans	-64.5	-51.5	178.1	-69.8	163.7	0	0	0	110.3	C310 L314 D363 L364 G369 S370 F371	C310-I367 HydrophobicContact CB-CD1 4.24Å; C310-I367 HydrophobicContact CB-CG1 3.81Å; L314-I367 HydrophobicContact CD2-CD1 4.18Å; D363-I367 WeakPolarHBondContact O-CB 2.99Å; D363-I367 WeakPolarHBondContact O-CD1 3.49Å; D363-I367 WeakPolarHBondContact O-CG1 3.15Å; D363-I367 PolarHBondContact O-N 3.13Å; L364-I367 PolarHBondContact O-N 3.29Å; I367-G369 VanDerWaalsContact C-N 3.34Å; I367-G369 PolarHBondContact O-N 2.78Å; I367-S370 PolarHBondContact O-N 3.18Å; I367-F371 HydrophobicContact CG2-CD2 3.85Å; I367-F371 HydrophobicContact CG2-CE2 3.53Å; I367-F371 WeakPolarHBondContact O-CD2 3.07Å; I367-F371 PolarHBondContact O-N 3.39Å
368	V	95.6	Very high	92.4	Very high	73 Å²	73	34.5 Å²	34.5	44%	0.442	18%	0.178	S	C	.	.	H	α-helix	trans	-62	-43.6	178.5	177.2	0	0	0	0	110.7	L364 S370 F371 I372 L390	L364-V368 WeakPolarHBondContact O-CG2 3.47Å; L364-V368 PolarHBondContact O-N 3.02Å; V368-S370 PolarHBondContact O-N 3.19Å; V368-F371 PolarHBondContact O-N 2.84Å; V368-I372 HydrophobicContact CG1-CD1 4.07Å; V368-I372 WeakPolarHBondContact O-CG1 3.05Å; V368-I372 PolarHBondContact O-N 3.16Å; V368-I372 VanDerWaalsContact O-N 3.08Å; V368-L390 HydrophobicContact CB-CD1 4.5Å; V368-L390 HydrophobicContact CG1-CD1 3.86Å
369	G	94.9	Very high	91.7	Very high	0 Å²	0	35.4 Å²	35.4	0%	0	18%	0.181	C	C	.	.	H	α-helix	trans	-60.8	-40.7	175.6	0	0	0	0	0	113	F365 I367 I372 K373	F365-G369 PolarHBondContact O-N 3.45Å; I367-G369 VanDerWaalsContact C-N 3.34Å; I367-G369 PolarHBondContact O-N 2.78Å; G369-I372 PolarHBondContact O-N 3.09Å; G369-K373 WeakPolarHBondContact O-CB 3.43Å; G369-K373 PolarHBondContact O-N 2.82Å
370	S	94.4	Very high	91	Very high	0 Å²	0	40.4 Å²	40.4	0%	0	21%	0.211	C	C	.	.	H	α-helix	trans	-65.7	-40.6	177.7	-59.9	0	0	0	0	111.8	Q94 T366 I367 V368 K373 I374	Q94-S370 PolarHBondContact NE2-OG 3.33Å; T366-S370 VanDerWaalsContact O-CB 3.28Å; T366-S370 WeakPolarHBondContact O-CB 3.48Å; T366-S370 PolarHBondContact O-N 3.18Å; T366-S370 PolarHBondContact O-OG 3.4Å; I367-S370 PolarHBondContact O-N 3.18Å; V368-S370 PolarHBondContact O-N 3.19Å; S370-K373 PolarHBondContact O-N 3.24Å; S370-I374 VanDerWaalsContact O-CG1 3.26Å; S370-I374 WeakPolarHBondContact O-CG1 3.28Å; S370-I374 PolarHBondContact O-N 2.89Å
371	F	93.3	Very high	90.3	Very high	136 Å²	136	42.5 Å²	42.5	60%	0.596	22%	0.223	S	C	*	.	H	α-helix	trans	-63.5	-42.7	174.3	-78	-63.5	0	0	0	112.5	I367 V368 K373 I374 G375	I367-F371 HydrophobicContact CG2-CD2 3.85Å; I367-F371 HydrophobicContact CG2-CE2 3.53Å; I367-F371 WeakPolarHBondContact O-CD2 3.07Å; I367-F371 PolarHBondContact O-N 3.39Å; V368-F371 PolarHBondContact O-N 2.84Å; F371-K373 VanDerWaalsContact C-N 3.33Å; F371-I374 PolarHBondContact O-N 3.24Å; F371-G375 PolarHBondContact O-N 3.5Å
372	I	92.3	Very high	89.4	Confident	33 Å²	33	42.3 Å²	42.3	17%	0.169	23%	0.227	C	C	.	.	H	α-helix	trans	-64.8	-40.9	175.7	-64.5	169.8	0	0	0	110.2	V368 G369 G375 I376 V386 C387 L390	V368-I372 HydrophobicContact CG1-CD1 4.07Å; V368-I372 WeakPolarHBondContact O-CG1 3.05Å; V368-I372 PolarHBondContact O-N 3.16Å; V368-I372 VanDerWaalsContact O-N 3.08Å; G369-I372 PolarHBondContact O-N 3.09Å; I372-G375 CarbonylContact O-C 3.57Å; I372-G375 WeakPolarHBondContact O-CA 3.34Å; I372-G375 PolarHBondContact O-N 2.9Å; I372-G375 VanDerWaalsContact O-N 3.12Å; I372-I376 HydrophobicContact CG2-CD1 4.06Å; I372-I376 WeakPolarHBondContact O-CG1 3.26Å; I372-I376 PolarHBondContact O-N 3.42Å; I372-V386 HydrophobicContact CD1-CG1 4.13Å; I372-C387 HydrophobicContact CG2-CB 3.82Å; I372-L390 HydrophobicContact CD1-CD1 3.79Å
373	K	91.5	Very high	88.8	Confident	4 Å²	4	45.1 Å²	45.1	2%	0.017	25%	0.247	C	C	.	.	H	α-helix	trans	-60.8	-45.9	176.7	-171.1	-179.5	168.2	-137.6	0	112	Q94 F98 D303 G369 S370 F371 G375 I376 E377 L391	Q94-K373 HydrophobicContact CG-CD 4.43Å; F98-K373 HydrophobicContact CB-CD 4.17Å; F98-K373 HydrophobicContact CD2-CD 3.91Å; F98-K373 HydrophobicContact CD2-CG 3.97Å; F98-K373 HydrophobicContact CE2-CG 4.45Å; F98-K373 HydrophobicContact CG-CD 4.3Å; D303-K373 IonicContact OD1-NZ 3.73Å; D303-K373 PolarHBondContact OD1-NZ 2.96Å; D303-K373 VanDerWaalsContact OD2-CD 3.23Å; D303-K373 WeakPolarHBondContact OD2-CD 3.48Å; D303-K373 WeakPolarHBondContact OD2-CE 3.32Å; D303-K373 IonicContact OD2-NZ 3.04Å; D303-K373 PolarHBondContact OD2-NZ 3.15Å; G369-K373 WeakPolarHBondContact O-CB 3.43Å; G369-K373 PolarHBondContact O-N 2.82Å; S370-K373 PolarHBondContact O-N 3.24Å; F371-K373 VanDerWaalsContact C-N 3.33Å; K373-G375 VanDerWaalsContact C-N 3.26Å; K373-G375 PolarHBondContact O-N 3.49Å; K373-I376 CarbonylContact O-C 3.59Å; K373-I376 WeakPolarHBondContact O-CA 3.39Å; K373-I376 WeakPolarHBondContact O-CB 3.34Å; K373-I376 PolarHBondContact O-N 2.79Å; K373-E377 VanDerWaalsContact CE-OE1 3.23Å; K373-E377 WeakPolarHBondContact CE-OE1 3.47Å; K373-E377 IonicContact NZ-OE1 3.6Å; K373-E377 PolarHBondContact NZ-OE1 3.29Å; K373-E377 PolarHBondContact O-N 2.87Å; K373-L391 HydrophobicContact CB-CD1 4.48Å; K373-L391 HydrophobicContact CD-CD1 4.09Å
374	I	90.5	Very high	88.3	Confident	41 Å²	41	46.1 Å²	46.1	21%	0.21	25%	0.251	C	S	.	.	H	α-helix	trans	-60	-39	173.2	-66.1	162.4	0	0	0	110.6	D303 V304 S370 F371 I376 E377 S378	D303-I374 HydrophobicContact CB-CD1 4.08Å; D303-I374 HydrophobicContact CB-CG1 3.82Å; V304-I374 HydrophobicContact CG2-CD1 4.06Å; S370-I374 VanDerWaalsContact O-CG1 3.26Å; S370-I374 WeakPolarHBondContact O-CG1 3.28Å; S370-I374 PolarHBondContact O-N 2.89Å; F371-I374 PolarHBondContact O-N 3.24Å; I374-I376 VanDerWaalsContact C-N 3.29Å; I374-I376 PolarHBondContact O-N 2.65Å; I374-E377 PolarHBondContact O-N 3.03Å; I374-S378 WeakPolarHBondContact O-CB 3.43Å; I374-S378 PolarHBondContact O-N 2.84Å; I374-S378 PolarHBondContact O-OG 3.37Å
375	G	87.7	Confident	88	Confident	7 Å²	7	48.1 Å²	48.1	7%	0.072	26%	0.262	C	S	.	.	H	α-helix	trans	-62	-33.2	172.9	0	0	0	0	0	114	F371 I372 K373 S378 K379 T380 L381	F371-G375 PolarHBondContact O-N 3.5Å; I372-G375 CarbonylContact O-C 3.57Å; I372-G375 WeakPolarHBondContact O-CA 3.34Å; I372-G375 PolarHBondContact O-N 2.9Å; I372-G375 VanDerWaalsContact O-N 3.12Å; K373-G375 VanDerWaalsContact C-N 3.26Å; K373-G375 PolarHBondContact O-N 3.49Å; G375-S378 WeakPolarHBondContact CA-OG 3.01Å; G375-S378 PolarHBondContact O-OG 3.45Å; G375-K379 PolarHBondContact O-N 3.21Å; G375-T380 WeakPolarHBondContact CA-OG1 3.37Å; G375-T380 PolarHBondContact O-N 2.77Å; G375-T380 PolarHBondContact O-OG1 3.27Å; G375-L381 PolarHBondContact O-N 3.35Å; G375-L381 VanDerWaalsContact O-N 3.07Å
376	I	85.9	Confident	87.7	Confident	5 Å²	5	48.1 Å²	48.1	3%	0.026	27%	0.268	C	S	.	.	H	α-helix	trans	-75.2	-43.4	175.4	-69.8	167	0	0	0	111	I372 K373 I374 S378 K379 L381 Y384 C387	I372-I376 HydrophobicContact CG2-CD1 4.06Å; I372-I376 WeakPolarHBondContact O-CG1 3.26Å; I372-I376 PolarHBondContact O-N 3.42Å; K373-I376 CarbonylContact O-C 3.59Å; K373-I376 WeakPolarHBondContact O-CA 3.39Å; K373-I376 WeakPolarHBondContact O-CB 3.34Å; K373-I376 PolarHBondContact O-N 2.79Å; I374-I376 VanDerWaalsContact C-N 3.29Å; I374-I376 PolarHBondContact O-N 2.65Å; I376-S378 VanDerWaalsContact C-N 3.32Å; I376-S378 PolarHBondContact O-N 2.84Å; I376-K379 WeakPolarHBondContact O-CD 3.2Å; I376-K379 PolarHBondContact O-N 3.35Å; I376-L381 HydrophobicContact CG1-CB 4.37Å; I376-Y384 HydrophobicContact CD1-CD1 4.38Å; I376-Y384 HydrophobicContact CD1-CG 4.35Å; I376-Y384 HydrophobicContact CG2-CD1 4.19Å; I376-Y384 HydrophobicContact CG2-CE1 3.46Å; I376-Y384 VanDerWaalsContact CG2-CE1 3.46Å; I376-Y384 HydrophobicContact CG2-CE2 3.83Å; I376-Y384 VanDerWaalsContact CG2-OH 3.3Å; I376-Y384 WeakPolarHBondContact CG2-OH 3.39Å; I376-C387 HydrophobicContact CD1-CB 3.78Å
377	E	81.9	Confident	87.6	Confident	45 Å²	45	48.1 Å²	48.1	21%	0.21	27%	0.268	C	S	.	.	H	α-helix	trans	-63.8	-39.9	177.5	-69.1	-171.9	174.1	0	0	110.9	E300 K373 I374 K379	E300-E377 WeakPolarHBondContact CA-OE2 3.4Å; E300-E377 HydrophobicContact CG-CB 4.09Å; E300-E377 VanDerWaalsContact CG-OE2 3.23Å; E300-E377 WeakPolarHBondContact CG-OE2 3.34Å; E300-E377 PolarHBondContact N-OE2 2.68Å; K373-E377 VanDerWaalsContact CE-OE1 3.23Å; K373-E377 WeakPolarHBondContact CE-OE1 3.47Å; K373-E377 IonicContact NZ-OE1 3.6Å; K373-E377 PolarHBondContact NZ-OE1 3.29Å; K373-E377 PolarHBondContact O-N 2.87Å; I374-E377 PolarHBondContact O-N 3.03Å; E377-K379 PolarHBondContact O-N 2.9Å
378	S	80.4	Confident	87.5	Confident	49 Å²	49	48 Å²	48	34%	0.343	27%	0.274	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.4	4.1	171.5	61.3	0	0	0	0	115.1	I374 G375 I376 T380	I374-S378 WeakPolarHBondContact O-CB 3.43Å; I374-S378 PolarHBondContact O-N 2.84Å; I374-S378 PolarHBondContact O-OG 3.37Å; G375-S378 WeakPolarHBondContact CA-OG 3.01Å; G375-S378 PolarHBondContact O-OG 3.45Å; I376-S378 VanDerWaalsContact C-N 3.32Å; I376-S378 PolarHBondContact O-N 2.84Å; S378-T380 PolarHBondContact O-N 3.3Å; S378-T380 PolarHBondContact OG-OG1 3.35Å
379	K	78.4	Confident	87.5	Confident	58 Å²	58	50 Å²	50	25%	0.252	28%	0.28	S	S	.	.	T	Hydrogen-bonded Turn	trans	56.7	21.4	175	-48.8	-70.7	174.8	171.4	0	115.2	D253 E284 G375 I376 E377	D253-K379 VanDerWaalsContact OD1-CE 3.27Å; D253-K379 WeakPolarHBondContact OD1-CE 3.2Å; D253-K379 IonicContact OD1-NZ 3.81Å; D253-K379 PolarHBondContact OD1-NZ 3.31Å; D253-K379 IonicContact OD2-NZ 3.77Å; D253-K379 PolarHBondContact OD2-NZ 3.41Å; E284-K379 HydrophobicContact CG-CB 3.91Å; E284-K379 HydrophobicContact CG-CD 4.49Å; E284-K379 HydrophobicContact CG-CG 3.5Å; E284-K379 WeakPolarHBondContact OE1-CG 3.45Å; G375-K379 PolarHBondContact O-N 3.21Å; I376-K379 WeakPolarHBondContact O-CD 3.2Å; I376-K379 PolarHBondContact O-N 3.35Å; E377-K379 PolarHBondContact O-N 2.9Å
380	T	78.4	Confident	87.5	Confident	108 Å²	108	51.4 Å²	51.4	66%	0.663	29%	0.288	S	S	*	.	S	Bend	trans	-81.8	-28.7	172.4	56.8	0	0	0	0	111.9	G375 S378	G375-T380 WeakPolarHBondContact CA-OG1 3.37Å; G375-T380 PolarHBondContact O-N 2.77Å; G375-T380 PolarHBondContact O-OG1 3.27Å; S378-T380 PolarHBondContact O-N 3.3Å; S378-T380 PolarHBondContact OG-OG1 3.35Å
381	L	78.8	Confident	87.5	Confident	79 Å²	79	51.5 Å²	51.5	41%	0.414	29%	0.288	S	S	.	.			trans	-123.1	148.8	179.8	-62.6	176.1	0	0	0	111	G375 I376	G375-L381 PolarHBondContact O-N 3.35Å; G375-L381 VanDerWaalsContact O-N 3.07Å; I376-L381 HydrophobicContact CG1-CB 4.37Å
382	S	77.6	Confident	87.7	Confident	66 Å²	66	46.3 Å²	46.3	46%	0.462	27%	0.273	S	S	.	.			trans	-124.7	23.9	176.3	68.4	0	0	0	0	113	Y384	S382-Y384 PolarHBondContact O-N 3.46Å
383	S	81.8	Confident	87.8	Confident	60 Å²	60	47.1 Å²	47.1	42%	0.42	28%	0.279	S	S	.	.			trans	-92.1	64.1	-175.1	-58.2	0	0	0	0	112.5	D385 V386 C387	S383-D385 VanDerWaalsContact C-N 3.31Å; S383-D385 PolarHBondContact O-N 2.97Å; S383-V386 PolarHBondContact O-N 3.15Å; S383-C387 PolarHBondContact O-N 3.29Å
384	Y	86.1	Confident	88	Confident	20 Å²	20	46.9 Å²	46.9	8%	0.078	28%	0.279	C	S	.	.	H	α-helix	trans	-60.6	-36.7	-179.9	-72.2	-98.5	0	0	0	113	F98 N102 V105 I282 I376 S382 V386 C387 G388	F98-Y384 HydrophobicContact CE2-CD1 4.18Å; F98-Y384 HydrophobicContact CZ-CD1 4.23Å; N102-Y384 HydrophobicContact CB-CD1 4.5Å; N102-Y384 WeakPolarHBondContact OD1-CD1 3.48Å; V105-Y384 HydrophobicContact CG2-CE1 4.31Å; I282-Y384 HydrophobicContact CD1-CE2 3.75Å; I376-Y384 HydrophobicContact CD1-CD1 4.38Å; I376-Y384 HydrophobicContact CD1-CG 4.35Å; I376-Y384 HydrophobicContact CG2-CD1 4.19Å; I376-Y384 HydrophobicContact CG2-CE1 3.46Å; I376-Y384 VanDerWaalsContact CG2-CE1 3.46Å; I376-Y384 HydrophobicContact CG2-CE2 3.83Å; I376-Y384 VanDerWaalsContact CG2-OH 3.3Å; I376-Y384 WeakPolarHBondContact CG2-OH 3.39Å; S382-Y384 PolarHBondContact O-N 3.46Å; Y384-V386 PolarHBondContact O-N 3.19Å; Y384-C387 PolarHBondContact O-N 2.93Å; Y384-G388 PolarHBondContact O-N 3.46Å
385	D	89	Confident	88.3	Confident	127 Å²	127	45.3 Å²	45.3	68%	0.679	27%	0.271	S	S	*	.	H	α-helix	trans	-62.3	-46	-178.1	-58.4	-22.7	0	0	0	112	S383 G388 I389	S383-D385 VanDerWaalsContact C-N 3.31Å; S383-D385 PolarHBondContact O-N 2.97Å; D385-G388 PolarHBondContact O-N 2.91Å; D385-I389 VanDerWaalsContact O-CG1 3.29Å; D385-I389 WeakPolarHBondContact O-CG1 3.47Å; D385-I389 PolarHBondContact O-N 2.77Å
386	V	91.8	Very high	88.7	Confident	75 Å²	75	50.5 Å²	50.5	46%	0.455	30%	0.296	S	S	.	.	H	α-helix	trans	-65.9	-43.9	179.3	180	0	0	0	0	110.5	I372 S383 Y384 I389 L390	I372-V386 HydrophobicContact CD1-CG1 4.13Å; S383-V386 PolarHBondContact O-N 3.15Å; Y384-V386 PolarHBondContact O-N 3.19Å; V386-I389 PolarHBondContact O-N 2.89Å; V386-L390 HydrophobicContact CG1-CD1 3.98Å; V386-L390 WeakPolarHBondContact O-CB 3.37Å; V386-L390 WeakPolarHBondContact O-CG 3.39Å; V386-L390 PolarHBondContact O-N 2.8Å
387	C	93.3	Very high	89.1	Confident	0 Å²	0	52.3 Å²	52.3	0%	0	31%	0.306	C	S	.	.	H	α-helix	trans	-60.2	-46.4	176.1	-170.9	0	0	0	0	111.4	F98 I372 I376 S383 Y384 I389 L390 L391	F98-C387 HydrophobicContact CE2-CB 4.41Å; F98-C387 HydrophobicContact CZ-CB 3.94Å; I372-C387 HydrophobicContact CG2-CB 3.82Å; I376-C387 HydrophobicContact CD1-CB 3.78Å; S383-C387 PolarHBondContact O-N 3.29Å; Y384-C387 PolarHBondContact O-N 2.93Å; C387-I389 PolarHBondContact O-N 2.76Å; C387-L390 PolarHBondContact O-N 3.47Å; C387-L391 WeakPolarHBondContact O-CB 3.4Å; C387-L391 WeakPolarHBondContact O-CG 3.49Å; C387-L391 PolarHBondContact O-N 3.39Å
388	G	93.4	Very high	89.7	Confident	23 Å²	23	50.3 Å²	50.3	24%	0.237	30%	0.297	C	S	.	.	H	α-helix	trans	-62	-42.7	178.6	0	0	0	0	0	113.1	Y384 D385 G392	Y384-G388 PolarHBondContact O-N 3.46Å; D385-G388 PolarHBondContact O-N 2.91Å; G388-G392 WeakPolarHBondContact O-CA 3.08Å; G388-G392 PolarHBondContact O-N 2.9Å
389	I	95.3	Very high	90.3	Very high	113 Å²	113	54.5 Å²	54.5	58%	0.579	31%	0.305	S	S	*	.	H	α-helix	trans	-64.5	-47	176	-67.7	165.6	0	0	0	110.6	D385 V386 C387 T393	D385-I389 VanDerWaalsContact O-CG1 3.29Å; D385-I389 WeakPolarHBondContact O-CG1 3.47Å; D385-I389 PolarHBondContact O-N 2.77Å; V386-I389 PolarHBondContact O-N 2.89Å; C387-I389 PolarHBondContact O-N 2.76Å; I389-T393 HydrophobicContact CG2-CG2 4.24Å; I389-T393 VanDerWaalsContact O-CB 3.27Å; I389-T393 WeakPolarHBondContact O-CB 3.46Å; I389-T393 WeakPolarHBondContact O-CG2 3.41Å; I389-T393 PolarHBondContact O-N 3.26Å; I389-T393 PolarHBondContact O-OG1 2.97Å
390	L	95.6	Very high	90.9	Very high	31 Å²	31	54.2 Å²	54.2	16%	0.162	31%	0.308	C	S	.	.	H	α-helix	trans	-65.4	-51.1	-178.8	-71.6	172.2	0	0	0	112.1	F365 V368 I372 V386 C387 T393 S394	F365-L390 HydrophobicContact CB-CD2 4.46Å; F365-L390 HydrophobicContact CD1-CD2 4Å; F365-L390 HydrophobicContact CE1-CD2 4.48Å; F365-L390 HydrophobicContact CG-CD2 4.24Å; V368-L390 HydrophobicContact CB-CD1 4.5Å; V368-L390 HydrophobicContact CG1-CD1 3.86Å; I372-L390 HydrophobicContact CD1-CD1 3.79Å; V386-L390 HydrophobicContact CG1-CD1 3.98Å; V386-L390 WeakPolarHBondContact O-CB 3.37Å; V386-L390 WeakPolarHBondContact O-CG 3.39Å; V386-L390 PolarHBondContact O-N 2.8Å; C387-L390 PolarHBondContact O-N 3.47Å; L390-T393 PolarHBondContact O-OG1 3.17Å; L390-S394 WeakPolarHBondContact O-CB 3.45Å; L390-S394 PolarHBondContact O-N 3.36Å; L390-S394 PolarHBondContact O-OG 2.82Å
391	L	95.4	Very high	91.4	Very high	1 Å²	1	49.1 Å²	49.1	1%	0.005	28%	0.277	C	S	.	.	H	α-helix	trans	-65.6	-41.4	179.1	-68.6	-179.5	0	0	0	111.4	L95 F98 K373 C387 S394 T395	L95-L391 HydrophobicContact CD1-CB 3.93Å; F98-L391 HydrophobicContact CD1-CD1 4.26Å; F98-L391 HydrophobicContact CG-CD1 4.24Å; K373-L391 HydrophobicContact CB-CD1 4.48Å; K373-L391 HydrophobicContact CD-CD1 4.09Å; C387-L391 WeakPolarHBondContact O-CB 3.4Å; C387-L391 WeakPolarHBondContact O-CG 3.49Å; C387-L391 PolarHBondContact O-N 3.39Å; L391-S394 PolarHBondContact O-N 3.1Å; L391-S394 PolarHBondContact O-OG 3.44Å; L391-T395 WeakPolarHBondContact O-CB 3.35Å; L391-T395 PolarHBondContact O-N 2.95Å; L391-T395 PolarHBondContact O-OG1 3.38Å
392	G	96	Very high	91.9	Very high	27 Å²	27	46.5 Å²	46.5	28%	0.278	26%	0.264	S	S	.	.	H	α-helix	trans	-63.8	-49.4	177.6	0	0	0	0	0	113	G388 T395 L396	G388-G392 WeakPolarHBondContact O-CA 3.08Å; G388-G392 PolarHBondContact O-N 2.9Å; G392-T395 PolarHBondContact O-N 2.95Å; G392-L396 PolarHBondContact O-N 3.05Å
393	T	95.7	Very high	92.3	Very high	50 Å²	50	46.6 Å²	46.6	31%	0.307	26%	0.259	S	S	.	.	H	α-helix	trans	-65.4	-39.1	176.6	55.3	0	0	0	0	111.9	I389 L390 T395 L396 L397	I389-T393 HydrophobicContact CG2-CG2 4.24Å; I389-T393 VanDerWaalsContact O-CB 3.27Å; I389-T393 WeakPolarHBondContact O-CB 3.46Å; I389-T393 WeakPolarHBondContact O-CG2 3.41Å; I389-T393 PolarHBondContact O-N 3.26Å; I389-T393 PolarHBondContact O-OG1 2.97Å; L390-T393 PolarHBondContact O-OG1 3.17Å; T393-T395 VanDerWaalsContact C-N 3.34Å; T393-T395 PolarHBondContact O-N 2.96Å; T393-L396 PolarHBondContact O-N 3.25Å; T393-L397 WeakPolarHBondContact O-CG 3.31Å; T393-L397 PolarHBondContact O-N 2.92Å
394	S	95.9	Very high	92.4	Very high	0 Å²	0	44.9 Å²	44.9	0%	0	24%	0.243	C	C	.	.	H	α-helix	trans	-61.2	-43.3	175.3	77.6	0	0	0	0	111.8	T366 L390 L391 L397 V398	T366-S394 WeakPolarHBondContact OG1-CB 3.32Å; T366-S394 PolarHBondContact OG1-OG 3.35Å; L390-S394 WeakPolarHBondContact O-CB 3.45Å; L390-S394 PolarHBondContact O-N 3.36Å; L390-S394 PolarHBondContact O-OG 2.82Å; L391-S394 PolarHBondContact O-N 3.1Å; L391-S394 PolarHBondContact O-OG 3.44Å; S394-L397 PolarHBondContact O-N 2.85Å; S394-V398 WeakPolarHBondContact O-CG2 3.4Å; S394-V398 PolarHBondContact O-N 2.85Å
395	T	95.4	Very high	92.2	Very high	8 Å²	8	45.5 Å²	45.5	5%	0.049	25%	0.246	C	C	.	.	H	α-helix	trans	-65.7	-42.8	178.4	-56	0	0	0	0	110.9	L95 L391 G392 T393 L397 V398 W399	L95-T395 HydrophobicContact CD2-CG2 3.73Å; L391-T395 WeakPolarHBondContact O-CB 3.35Å; L391-T395 PolarHBondContact O-N 2.95Å; L391-T395 PolarHBondContact O-OG1 3.38Å; G392-T395 PolarHBondContact O-N 2.95Å; T393-T395 VanDerWaalsContact C-N 3.34Å; T393-T395 PolarHBondContact O-N 2.96Å; T395-L397 VanDerWaalsContact C-N 3.33Å; T395-L397 PolarHBondContact O-N 2.83Å; T395-V398 PolarHBondContact O-N 2.72Å; T395-W399 VanDerWaalsContact O-CD1 3.26Å; T395-W399 PolarHBondContact O-N 2.91Å
396	L	95.9	Very high	91.7	Very high	116 Å²	116	44.2 Å²	44.2	61%	0.607	23%	0.234	S	C	*	.	H	α-helix	trans	-55.5	-48	173.3	177.9	66	0	0	0	111.4	G392 T393 W399 V400	G392-L396 PolarHBondContact O-N 3.05Å; T393-L396 PolarHBondContact O-N 3.25Å; L396-W399 PolarHBondContact O-N 2.84Å; L396-V400 WeakPolarHBondContact O-CG2 3.34Å; L396-V400 PolarHBondContact O-N 2.63Å
397	L	94.6	Very high	90.8	Very high	43 Å²	43	42.1 Å²	42.1	23%	0.225	22%	0.223	C	C	.	.	H	α-helix	trans	-64.4	-41.1	177.5	-67.2	176.2	0	0	0	112	L358 I361 F365 T393 S394 T395 W399 V400 G401	L358-L397 HydrophobicContact CD1-CD2 4.47Å; L358-L397 HydrophobicContact CD2-CB 4.01Å; L358-L397 HydrophobicContact CD2-CD2 4.43Å; L358-L397 WeakPolarHBondContact CD2-O 3.17Å; L358-L397 HydrophobicContact CG-CD2 4.25Å; I361-L397 HydrophobicContact CG2-CD1 4.05Å; F365-L397 HydrophobicContact CD2-CD1 4.28Å; F365-L397 HydrophobicContact CE2-CD1 4.34Å; T393-L397 WeakPolarHBondContact O-CG 3.31Å; T393-L397 PolarHBondContact O-N 2.92Å; S394-L397 PolarHBondContact O-N 2.85Å; T395-L397 VanDerWaalsContact C-N 3.33Å; T395-L397 PolarHBondContact O-N 2.83Å; L397-W399 VanDerWaalsContact C-N 3.34Å; L397-W399 PolarHBondContact O-N 2.84Å; L397-V400 PolarHBondContact O-N 2.85Å; L397-G401 PolarHBondContact O-N 2.65Å
398	V	94.1	Very high	89.8	Confident	2 Å²	2	45.7 Å²	45.7	1%	0.012	24%	0.239	C	C	.	.	H	α-helix	trans	-60.6	-43.3	175.9	168.4	0	0	0	0	111.3	I88 S394 T395 G401 V402	I88-V398 HydrophobicContact CB-CG1 4.15Å; I88-V398 HydrophobicContact CG1-CG1 3.49Å; I88-V398 VanDerWaalsContact CG1-CG1 3.49Å; S394-V398 WeakPolarHBondContact O-CG2 3.4Å; S394-V398 PolarHBondContact O-N 2.85Å; T395-V398 PolarHBondContact O-N 2.72Å; V398-G401 WeakPolarHBondContact O-CA 3.23Å; V398-G401 PolarHBondContact O-N 2.96Å; V398-G401 VanDerWaalsContact O-N 3.12Å; V398-V402 PolarHBondContact O-N 2.82Å
399	W	93.9	Very high	88.9	Confident	137 Å²	137	50.5 Å²	50.5	52%	0.519	25%	0.254	S	S	.	.	H	α-helix	trans	-68.1	-40	176.6	-84.6	96.8	0	0	0	112.8	I88 T92 T395 L396 L397 G401 V402	I88-W399 HydrophobicContact CG2-CZ2 4.29Å; T92-W399 HydrophobicContact CG2-CZ2 4.43Å; T92-W399 PolarHBondContact OG1-NE1 3.16Å; T395-W399 VanDerWaalsContact O-CD1 3.26Å; T395-W399 PolarHBondContact O-N 2.91Å; L396-W399 PolarHBondContact O-N 2.84Å; L397-W399 VanDerWaalsContact C-N 3.34Å; L397-W399 PolarHBondContact O-N 2.84Å; W399-G401 PolarHBondContact O-N 2.9Å; W399-V402 HydrophobicContact CE3-CG2 4.23Å; W399-V402 WeakPolarHBondContact O-CB 3.04Å; W399-V402 WeakPolarHBondContact O-CG2 3.07Å; W399-V402 PolarHBondContact O-N 2.82Å
400	V	91.4	Very high	87.7	Confident	52 Å²	52	51.1 Å²	51.1	32%	0.315	25%	0.254	S	S	.	.	H	α-helix	trans	-59.5	-37.3	168.6	169.6	0	0	0	0	110.5	W355 L358 L396 L397 V402 I403	W355-V400 HydrophobicContact CZ3-CG1 4.39Å; W355-V400 WeakPolarHBondContact CZ3-O 3.35Å; L358-V400 HydrophobicContact CD1-CG1 4.01Å; L396-V400 WeakPolarHBondContact O-CG2 3.34Å; L396-V400 PolarHBondContact O-N 2.63Å; L397-V400 PolarHBondContact O-N 2.85Å; V400-V402 PolarHBondContact O-N 2.04Å; V400-V402 VanDerWaalsContact O-N 3.15Å; V400-I403 HydrophobicContact CG1-CD1 4.35Å; V400-I403 WeakPolarHBondContact O-CB 3.37Å; V400-I403 VanDerWaalsContact O-CG1 3.3Å; V400-I403 WeakPolarHBondContact O-CG1 3.4Å; V400-I403 PolarHBondContact O-N 2.98Å
401	G	88.9	Confident	86.6	Confident	2 Å²	2	58.4 Å²	58.4	2%	0.021	28%	0.284	C	S	.	.	H	α-helix	trans	-58.2	-23.6	173.6	0	0	0	0	0	114.2	L397 V398 W399 I403 R404	L397-G401 PolarHBondContact O-N 2.65Å; V398-G401 WeakPolarHBondContact O-CA 3.23Å; V398-G401 PolarHBondContact O-N 2.96Å; V398-G401 VanDerWaalsContact O-N 3.12Å; W399-G401 PolarHBondContact O-N 2.9Å; G401-I403 PolarHBondContact O-N 2.91Å; G401-R404 WeakPolarHBondContact O-CB 3.44Å; G401-R404 PolarHBondContact O-N 3.39Å
402	V	88.3	Confident	85.6	Confident	23 Å²	23	65.1 Å²	65.1	14%	0.139	31%	0.31	C	S	.	.	H	α-helix	trans	-64.3	-29.7	174.5	-177	0	0	0	0	111.7	I88 V398 W399 V400 R404 Y405 F406	I88-V402 HydrophobicContact CD1-CG2 3.69Å; I88-V402 HydrophobicContact CG1-CG2 4.28Å; V398-V402 PolarHBondContact O-N 2.82Å; W399-V402 HydrophobicContact CE3-CG2 4.23Å; W399-V402 WeakPolarHBondContact O-CB 3.04Å; W399-V402 WeakPolarHBondContact O-CG2 3.07Å; W399-V402 PolarHBondContact O-N 2.82Å; V400-V402 PolarHBondContact O-N 2.04Å; V400-V402 VanDerWaalsContact O-N 3.15Å; V402-R404 PolarHBondContact O-N 2.86Å; V402-R404 VanDerWaalsContact O-N 3.14Å; V402-Y405 WeakPolarHBondContact O-CA 3.32Å; V402-Y405 WeakPolarHBondContact O-CB 3.47Å; V402-Y405 PolarHBondContact O-N 2.84Å; V402-F406 HydrophobicContact CG1-CD2 4.29Å; V402-F406 HydrophobicContact CG1-CE2 3.73Å; V402-F406 HydrophobicContact CG1-CZ 4.17Å; V402-F406 PolarHBondContact O-N 3.06Å
403	I	85.6	Confident	84.9	Confident	69 Å²	69	66.3 Å²	66.3	35%	0.354	31%	0.311	S	S	.	.	H	α-helix	trans	-56.5	-33.1	177.8	-61.4	175.2	0	0	0	111.3	W355 V400 G401 Y405 F406 S407 I416	W355-I403 HydrophobicContact CH2-CB 3.76Å; W355-I403 HydrophobicContact CH2-CG2 3.71Å; W355-I403 HydrophobicContact CZ2-CG2 4.32Å; W355-I403 HydrophobicContact CZ3-CB 4.18Å; V400-I403 HydrophobicContact CG1-CD1 4.35Å; V400-I403 WeakPolarHBondContact O-CB 3.37Å; V400-I403 VanDerWaalsContact O-CG1 3.3Å; V400-I403 WeakPolarHBondContact O-CG1 3.4Å; V400-I403 PolarHBondContact O-N 2.98Å; G401-I403 PolarHBondContact O-N 2.91Å; I403-Y405 VanDerWaalsContact C-N 3.28Å; I403-Y405 PolarHBondContact O-N 3.06Å; I403-F406 PolarHBondContact O-N 3.07Å; I403-F406 VanDerWaalsContact O-N 3.15Å; I403-S407 PolarHBondContact O-N 3.03Å; I403-S407 VanDerWaalsContact O-N 3.11Å; I403-I416 HydrophobicContact CG2-CD1 3.39Å; I403-I416 HydrophobicContact CG2-CG1 3.65Å
404	R	84.9	Confident	84.2	Confident	23 Å²	23	65.7 Å²	65.7	9%	0.087	31%	0.305	C	S	.	.	H	α-helix	trans	-57.8	-38.2	172.1	-172.8	-153.6	169.8	125.5	7.1	113	W355 Y356 G401 V402 F406 S407	W355-R404 HydrophobicContact CB-CB 4.47Å; W355-R404 HydrophobicContact CB-CG 4.04Å; W355-R404 HydrophobicContact CD2-CB 3.68Å; W355-R404 HydrophobicContact CD2-CG 3.95Å; W355-R404 HydrophobicContact CE3-CB 3.8Å; W355-R404 HydrophobicContact CG-CB 4Å; W355-R404 HydrophobicContact CG-CG 3.72Å; W355-R404 HydrophobicContact CZ3-CB 4.29Å; Y356-R404 VanDerWaalsContact CE1-CZ 3.45Å; Y356-R404 PolarHBondContact OH-NH2 2.86Å; G401-R404 WeakPolarHBondContact O-CB 3.44Å; G401-R404 PolarHBondContact O-N 3.39Å; V402-R404 PolarHBondContact O-N 2.86Å; V402-R404 VanDerWaalsContact O-N 3.14Å; R404-F406 VanDerWaalsContact C-N 3.34Å; R404-S407 WeakPolarHBondContact O-CB 3.49Å; R404-S407 PolarHBondContact O-N 3.28Å; R404-S407 PolarHBondContact O-OG 2.87Å
405	Y	80.9	Confident	83.5	Confident	33 Å²	33	71.3 Å²	71.3	13%	0.129	34%	0.335	C	S	.	.	H	α-helix	trans	-75.3	-29	179.6	-58	-56.7	0	0	0	111.4	L81 Q84 I88 V402 I403 S407 F408	L81-Y405 HydrophobicContact CD1-CD1 3.54Å; L81-Y405 HydrophobicContact CD1-CE1 3.23Å; L81-Y405 HydrophobicContact CD1-CG 4.44Å; Q84-Y405 WeakPolarHBondContact CB-OH 3.42Å; Q84-Y405 VanDerWaalsContact CG-OH 3.29Å; Q84-Y405 WeakPolarHBondContact CG-OH 3.37Å; I88-Y405 HydrophobicContact CD1-CE2 4.33Å; V402-Y405 WeakPolarHBondContact O-CA 3.32Å; V402-Y405 WeakPolarHBondContact O-CB 3.47Å; V402-Y405 PolarHBondContact O-N 2.84Å; I403-Y405 VanDerWaalsContact C-N 3.28Å; I403-Y405 PolarHBondContact O-N 3.06Å; Y405-S407 VanDerWaalsContact C-N 3.26Å; Y405-S407 PolarHBondContact O-N 3.35Å; Y405-F408 AromaticContact CD1-CE2 3.77Å; Y405-F408 HydrophobicContact CD1-CE2 3.77Å; Y405-F408 HydrophobicContact CD1-CZ 4.27Å; Y405-F408 VanDerWaalsContact O-CD2 3.27Å; Y405-F408 WeakPolarHBondContact O-CD2 3.3Å; Y405-F408 PolarHBondContact O-N 2.88Å
406	F	79.6	Confident	82.9	Confident	100 Å²	100	72.7 Å²	72.7	44%	0.439	34%	0.341	S	S	.	.	H	α-helix	trans	-68.6	-25	170.2	-66.1	-51.8	0	0	0	112.9	V402 I403 R404 F408 F409 Y412	V402-F406 HydrophobicContact CG1-CD2 4.29Å; V402-F406 HydrophobicContact CG1-CE2 3.73Å; V402-F406 HydrophobicContact CG1-CZ 4.17Å; V402-F406 PolarHBondContact O-N 3.06Å; I403-F406 PolarHBondContact O-N 3.07Å; I403-F406 VanDerWaalsContact O-N 3.15Å; R404-F406 VanDerWaalsContact C-N 3.34Å; F406-F408 PolarHBondContact O-N 3.22Å; F406-F408 VanDerWaalsContact O-N 3.12Å; F406-F409 WeakPolarHBondContact O-CB 3.32Å; F406-F409 PolarHBondContact O-N 3Å; F406-Y412 HydrophobicContact CB-CG 4.5Å
407	S	72.8	Confident	82.3	Confident	32 Å²	32	69.8 Å²	69.8	22%	0.224	33%	0.328	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.7	-12	176	90.3	0	0	0	0	113.8	I403 R404 Y405 F409	I403-S407 PolarHBondContact O-N 3.03Å; I403-S407 VanDerWaalsContact O-N 3.11Å; R404-S407 WeakPolarHBondContact O-CB 3.49Å; R404-S407 PolarHBondContact O-N 3.28Å; R404-S407 PolarHBondContact O-OG 2.87Å; Y405-S407 VanDerWaalsContact C-N 3.26Å; Y405-S407 PolarHBondContact O-N 3.35Å; S407-F409 PolarHBondContact O-N 3.44Å
408	F	71.9	Confident	81.9	Confident	75 Å²	75	68 Å²	68	33%	0.329	32%	0.319	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.6	-22.1	170.1	-61.4	-36.8	0	0	0	112.8	P67 Y405 F406	P67-F408 HydrophobicContact CG-CE1 4.05Å; P67-F408 HydrophobicContact CG-CE2 4.26Å; P67-F408 HydrophobicContact CG-CZ 3.51Å; Y405-F408 AromaticContact CD1-CE2 3.77Å; Y405-F408 HydrophobicContact CD1-CE2 3.77Å; Y405-F408 HydrophobicContact CD1-CZ 4.27Å; Y405-F408 VanDerWaalsContact O-CD2 3.27Å; Y405-F408 WeakPolarHBondContact O-CD2 3.3Å; Y405-F408 PolarHBondContact O-N 2.88Å; F406-F408 PolarHBondContact O-N 3.22Å; F406-F408 VanDerWaalsContact O-N 3.12Å
409	F	75.8	Confident	81.5	Confident	124 Å²	124	73.5 Å²	73.5	54%	0.544	35%	0.348	S	S	.	.	S	Bend	trans	-91.4	120	174.9	-63	-75.7	0	0	0	109.7	F406 S407 K411 Y412 N413	F406-F409 WeakPolarHBondContact O-CB 3.32Å; F406-F409 PolarHBondContact O-N 3Å; S407-F409 PolarHBondContact O-N 3.44Å; F409-K411 PolarHBondContact O-N 2.86Å; F409-K411 VanDerWaalsContact O-N 3.09Å; F409-Y412 HydrophobicContact CB-CD2 3.66Å; F409-Y412 HydrophobicContact CB-CE2 4.37Å; F409-Y412 HydrophobicContact CD2-CD2 4.49Å; F409-Y412 HydrophobicContact CG-CD2 4.34Å; F409-Y412 PolarHBondContact O-N 2.73Å; F409-N413 PolarHBondContact O-N 3.49Å; F409-N413 VanDerWaalsContact O-N 3.09Å
410	Q	68.4	Low	81.1	Confident	126 Å²	126	76 Å²	76	59%	0.589	36%	0.357	S	S	*	.	H	α-helix	trans	-50.2	-39.5	-176.7	-68.8	-69.5	-18.3	0	0	113.4	Y412 N413	Q410-Y412 PolarHBondContact O-N 3.19Å; Q410-N413 PolarHBondContact O-N 2.96Å
411	K	72.9	Confident	80.9	Confident	184 Å²	184	75.8 Å²	75.8	80%	0.8	36%	0.361	S	S	*	.	H	α-helix	trans	-65.2	-38.7	179.6	-67.3	-172.3	177.5	-177.6	0	113.9	F409	F409-K411 PolarHBondContact O-N 2.86Å; F409-K411 VanDerWaalsContact O-N 3.09Å
412	Y	75.6	Confident	81	Confident	141 Å²	141	75.9 Å²	75.9	55%	0.553	36%	0.361	S	S	*	.	H	α-helix	trans	-83.7	-25.4	-178.9	-64.1	-83.7	0	0	0	112.1	F406 F409 Q410 I414 L415 I416	F406-Y412 HydrophobicContact CB-CG 4.5Å; F409-Y412 HydrophobicContact CB-CD2 3.66Å; F409-Y412 HydrophobicContact CB-CE2 4.37Å; F409-Y412 HydrophobicContact CD2-CD2 4.49Å; F409-Y412 HydrophobicContact CG-CD2 4.34Å; F409-Y412 PolarHBondContact O-N 2.73Å; Q410-Y412 PolarHBondContact O-N 3.19Å; Y412-I414 VanDerWaalsContact C-N 3.29Å; Y412-I414 PolarHBondContact O-N 3.2Å; Y412-L415 PolarHBondContact O-N 2.93Å; Y412-I416 PolarHBondContact O-N 3.48Å
413	N	80	Confident	81	Confident	53 Å²	53	80.8 Å²	80.8	28%	0.283	38%	0.381	S	S	.	.	H	α-helix	trans	-61	-37.9	176	-167.1	38.3	0	0	0	112.1	F409 Q410 L415 I416 V417	F409-N413 PolarHBondContact O-N 3.49Å; F409-N413 VanDerWaalsContact O-N 3.09Å; Q410-N413 PolarHBondContact O-N 2.96Å; N413-L415 VanDerWaalsContact C-N 3.35Å; N413-L415 PolarHBondContact O-N 3.31Å; N413-I416 PolarHBondContact O-N 2.99Å; N413-V417 WeakPolarHBondContact O-CB 3.2Å; N413-V417 VanDerWaalsContact O-CG2 3.28Å; N413-V417 WeakPolarHBondContact O-CG2 3.17Å; N413-V417 PolarHBondContact O-N 3.47Å
414	I	82.4	Confident	81.2	Confident	37 Å²	37	80.5 Å²	80.5	19%	0.19	38%	0.384	C	S	.	.	H	α-helix	trans	-55	-49.3	178.4	-64	171.7	0	0	0	110.9	Y412 I416 V417 T418 Y519 I522 M523 T526	Y412-I414 VanDerWaalsContact C-N 3.29Å; Y412-I414 PolarHBondContact O-N 3.2Å; I414-I416 PolarHBondContact O-N 3.1Å; I414-V417 PolarHBondContact O-N 2.9Å; I414-T418 WeakPolarHBondContact O-CB 3.41Å; I414-T418 PolarHBondContact O-N 3.47Å; I414-T418 PolarHBondContact O-OG1 2.95Å; I414-Y519 HydrophobicContact CG2-CE2 4.3Å; I414-I522 HydrophobicContact CG2-CG2 4.19Å; I414-M523 HydrophobicContact CD1-SD 4.07Å; I414-M523 HydrophobicContact CG2-CG 4.38Å; I414-M523 HydrophobicContact CG2-SD 3.83Å; I414-T526 HydrophobicContact CD1-CG2 4.41Å
415	L	80.8	Confident	81.5	Confident	118 Å²	118	82.2 Å²	82.2	62%	0.618	40%	0.399	S	S	*	.	H	α-helix	trans	-61.8	-41.9	-178.6	-172.1	72.8	0	0	0	112.6	Y412 N413 T418 L419	Y412-L415 PolarHBondContact O-N 2.93Å; N413-L415 VanDerWaalsContact C-N 3.35Å; N413-L415 PolarHBondContact O-N 3.31Å; L415-T418 PolarHBondContact O-N 2.91Å; L415-L419 PolarHBondContact O-N 3.44Å
416	I	82.8	Confident	82.1	Confident	36 Å²	36	81.7 Å²	81.7	19%	0.185	40%	0.399	C	S	.	.	H	α-helix	trans	-66.8	-43.9	179.5	-61.9	163.2	0	0	0	110.3	W355 I403 Y412 N413 I414 L419 R420	W355-I416 HydrophobicContact CZ2-CG2 4.12Å; I403-I416 HydrophobicContact CG2-CD1 3.39Å; I403-I416 HydrophobicContact CG2-CG1 3.65Å; Y412-I416 PolarHBondContact O-N 3.48Å; N413-I416 PolarHBondContact O-N 2.99Å; I414-I416 PolarHBondContact O-N 3.1Å; I416-L419 PolarHBondContact O-N 3.09Å; I416-R420 PolarHBondContact O-N 3.18Å
417	V	83.3	Confident	82.7	Confident	56 Å²	56	80.5 Å²	80.5	34%	0.339	40%	0.397	S	S	.	.	H	α-helix	trans	-64.5	-42.1	177.7	173.3	0	0	0	0	110.4	N413 I414 L419 R420 A421 I522	N413-V417 WeakPolarHBondContact O-CB 3.2Å; N413-V417 VanDerWaalsContact O-CG2 3.28Å; N413-V417 WeakPolarHBondContact O-CG2 3.17Å; N413-V417 PolarHBondContact O-N 3.47Å; I414-V417 PolarHBondContact O-N 2.9Å; V417-L419 PolarHBondContact O-N 3.41Å; V417-R420 PolarHBondContact O-N 2.84Å; V417-A421 VanDerWaalsContact O-CB 3.31Å; V417-A421 WeakPolarHBondContact O-CB 3.14Å; V417-A421 PolarHBondContact O-N 3Å; V417-I522 HydrophobicContact CG1-CD1 3.91Å; V417-I522 HydrophobicContact CG1-CG1 4.35Å; V417-I522 HydrophobicContact CG1-CG2 4.12Å
418	T	86.8	Confident	83.7	Confident	5 Å²	5	87.5 Å²	87.5	3%	0.031	42%	0.418	C	S	.	.	H	α-helix	trans	-56.6	-48	172.7	-64.3	0	0	0	0	111.7	I414 L415 R420 A421 A422 A518 Y519	I414-T418 WeakPolarHBondContact O-CB 3.41Å; I414-T418 PolarHBondContact O-N 3.47Å; I414-T418 PolarHBondContact O-OG1 2.95Å; L415-T418 PolarHBondContact O-N 2.91Å; T418-R420 VanDerWaalsContact C-N 3.34Å; T418-R420 PolarHBondContact O-N 3.27Å; T418-A421 PolarHBondContact O-N 2.86Å; T418-A422 VanDerWaalsContact O-CB 3.31Å; T418-A422 WeakPolarHBondContact O-CB 3.3Å; T418-A422 PolarHBondContact O-N 3.16Å; T418-A518 HydrophobicContact CG2-CB 4.35Å; T418-Y519 VanDerWaalsContact CG2-CA 3.46Å; T418-Y519 HydrophobicContact CG2-CD2 4.19Å; T418-Y519 HydrophobicContact CG2-CG 4.48Å
419	L	85.7	Confident	84.8	Confident	117 Å²	117	85.9 Å²	85.9	61%	0.613	41%	0.411	S	S	*	.	H	α-helix	trans	-62.5	-42.3	179	-172	68.9	0	0	0	111.5	L415 I416 V417 A422 F423	L415-L419 PolarHBondContact O-N 3.44Å; I416-L419 PolarHBondContact O-N 3.09Å; V417-L419 PolarHBondContact O-N 3.41Å; L419-A422 PolarHBondContact O-N 3.37Å; L419-F423 WeakPolarHBondContact O-CB 3.42Å; L419-F423 PolarHBondContact O-N 3.31Å
420	R	85.4	Confident	85.6	Confident	191 Å²	191	83.2 Å²	83.2	72%	0.721	41%	0.407	S	S	*	.	H	α-helix	trans	-64.4	-39.9	176.5	-174.4	-178.9	179.7	-166.6	-0.8	112.1	I416 V417 T418 P424	I416-R420 PolarHBondContact O-N 3.18Å; V417-R420 PolarHBondContact O-N 2.84Å; T418-R420 VanDerWaalsContact C-N 3.34Å; T418-R420 PolarHBondContact O-N 3.27Å; R420-P424 WeakPolarHBondContact O-CD 3.16Å
421	A	86.8	Confident	86.8	Confident	47 Å²	47	80.8 Å²	80.8	39%	0.388	40%	0.403	S	S	.	.	H	α-helix	trans	-70.9	-37.4	178.3	0	0	0	0	0	112	V417 T418 P424 I522	V417-A421 VanDerWaalsContact O-CB 3.31Å; V417-A421 WeakPolarHBondContact O-CB 3.14Å; V417-A421 PolarHBondContact O-N 3Å; T418-A421 PolarHBondContact O-N 2.86Å; A421-P424 WeakPolarHBondContact O-CD 3.37Å; A421-I522 HydrophobicContact CB-CD1 4.11Å; A421-I522 HydrophobicContact CB-CG1 4.25Å
422	A	90.4	Very high	87.9	Confident	4 Å²	4	76.1 Å²	76.1	3%	0.033	39%	0.393	C	S	.	.	H	α-helix	trans	-71.2	-32	176.8	0	0	0	0	0	112.7	T418 L419 S425 V426 A518	T418-A422 VanDerWaalsContact O-CB 3.31Å; T418-A422 WeakPolarHBondContact O-CB 3.3Å; T418-A422 PolarHBondContact O-N 3.16Å; L419-A422 PolarHBondContact O-N 3.37Å; A422-S425 PolarHBondContact O-N 3.46Å; A422-S425 VanDerWaalsContact O-N 3.12Å; A422-V426 HydrophobicContact CB-CG2 4.29Å; A422-V426 WeakPolarHBondContact O-CB 3.35Å; A422-V426 WeakPolarHBondContact O-CG2 3.48Å; A422-V426 PolarHBondContact O-N 3.31Å; A422-A518 HydrophobicContact CB-CB 3.66Å
423	F	88.1	Confident	88.8	Confident	125 Å²	125	70.4 Å²	70.4	55%	0.548	37%	0.372	S	S	.	.	H	α-helix	trans	-51.7	-47.6	-169.7	-174.9	-106.5	0	0	0	115.2	L419 S425 V426 I427	L419-F423 WeakPolarHBondContact O-CB 3.42Å; L419-F423 PolarHBondContact O-N 3.31Å; F423-S425 PolarHBondContact O-N 2.88Å; F423-V426 PolarHBondContact O-N 3.42Å; F423-I427 HydrophobicContact CD1-CD1 3.68Å; F423-I427 HydrophobicContact CD2-CD1 4.29Å; F423-I427 HydrophobicContact CE1-CD1 3.22Å; F423-I427 HydrophobicContact CE1-CG1 4.4Å; F423-I427 HydrophobicContact CE2-CD1 3.89Å; F423-I427 HydrophobicContact CE2-CG1 4.36Å; F423-I427 HydrophobicContact CG-CD1 4.21Å; F423-I427 HydrophobicContact CZ-CD1 3.36Å; F423-I427 HydrophobicContact CZ-CG1 4.29Å; F423-I427 WeakPolarHBondContact O-CG1 3.28Å; F423-I427 PolarHBondContact O-N 2.56Å
424	P	90.3	Very high	89.5	Confident	64 Å²	64	69.7 Å²	69.7	42%	0.416	37%	0.374	S	S	.	.	H	α-helix	trans	-64.7	-40.3	179.1	-20.7	33.9	0	0	0	113	R420 A421 I427 R428	R420-P424 WeakPolarHBondContact O-CD 3.16Å; A421-P424 WeakPolarHBondContact O-CD 3.37Å; P424-I427 PolarHBondContact O-N 3.28Å; P424-R428 WeakPolarHBondContact O-CG 3.34Å; P424-R428 PolarHBondContact O-N 2.73Å; P424-R428 VanDerWaalsContact O-N 3.14Å
425	S	90.6	Very high	90.2	Very high	58 Å²	58	73 Å²	73	41%	0.406	40%	0.395	S	S	.	.	H	α-helix	trans	-66.8	-42.3	177.8	-60.7	0	0	0	0	111	A422 F423 R428 F429	A422-S425 PolarHBondContact O-N 3.46Å; A422-S425 VanDerWaalsContact O-N 3.12Å; F423-S425 PolarHBondContact O-N 2.88Å; S425-R428 PolarHBondContact O-N 3.3Å; S425-F429 WeakPolarHBondContact O-CB 3.14Å; S425-F429 PolarHBondContact O-N 2.9Å
426	V	93.6	Very high	90.9	Very high	23 Å²	23	71.2 Å²	71.2	14%	0.139	39%	0.386	C	S	.	.	H	α-helix	trans	-61.9	-43.9	175.8	167.7	0	0	0	0	111.4	A422 F423 F429 C430 F511 I515	A422-V426 HydrophobicContact CB-CG2 4.29Å; A422-V426 WeakPolarHBondContact O-CB 3.35Å; A422-V426 WeakPolarHBondContact O-CG2 3.48Å; A422-V426 PolarHBondContact O-N 3.31Å; F423-V426 PolarHBondContact O-N 3.42Å; V426-F429 PolarHBondContact O-N 3.46Å; V426-C430 WeakPolarHBondContact O-CB 3.26Å; V426-C430 PolarHBondContact O-N 3.49Å; V426-F511 HydrophobicContact CG1-CD2 4.47Å; V426-F511 HydrophobicContact CG1-CE2 3.45Å; V426-F511 VanDerWaalsContact CG1-CE2 3.45Å; V426-F511 HydrophobicContact CG1-CZ 3.6Å; V426-I515 HydrophobicContact CG2-CG1 4.17Å
427	I	92.7	Very high	91.6	Very high	74 Å²	74	71 Å²	71	38%	0.379	38%	0.383	S	S	.	.	H	α-helix	trans	-61.5	-47	176.8	-74.9	170.5	0	0	0	111.2	F423 P424 F429 C430 C431	F423-I427 HydrophobicContact CD1-CD1 3.68Å; F423-I427 HydrophobicContact CD2-CD1 4.29Å; F423-I427 HydrophobicContact CE1-CD1 3.22Å; F423-I427 HydrophobicContact CE1-CG1 4.4Å; F423-I427 HydrophobicContact CE2-CD1 3.89Å; F423-I427 HydrophobicContact CE2-CG1 4.36Å; F423-I427 HydrophobicContact CG-CD1 4.21Å; F423-I427 HydrophobicContact CZ-CD1 3.36Å; F423-I427 HydrophobicContact CZ-CG1 4.29Å; F423-I427 WeakPolarHBondContact O-CG1 3.28Å; F423-I427 PolarHBondContact O-N 2.56Å; P424-I427 PolarHBondContact O-N 3.28Å; I427-F429 VanDerWaalsContact C-N 3.32Å; I427-F429 PolarHBondContact O-N 2.83Å; I427-C430 WeakPolarHBondContact O-CB 3.45Å; I427-C430 PolarHBondContact O-N 3.09Å; I427-C431 PolarHBondContact O-N 3.45Å; I427-C431 PolarHBondContact O-SG 3.09Å; I427-C431 VanDerWaalsContact O-SG 3.32Å
428	R	93.7	Very high	92.2	Very high	180 Å²	180	72.4 Å²	72.4	68%	0.679	39%	0.388	S	S	*	.	H	α-helix	trans	-59.5	-45.4	179.2	-71.4	173.8	-175.6	160.3	1.1	111.2	P424 S425 C431 C432	P424-R428 WeakPolarHBondContact O-CG 3.34Å; P424-R428 PolarHBondContact O-N 2.73Å; P424-R428 VanDerWaalsContact O-N 3.14Å; S425-R428 PolarHBondContact O-N 3.3Å; R428-C431 PolarHBondContact O-N 3.01Å; R428-C432 PolarHBondContact O-N 2.85Å; R428-C432 PolarHBondContact O-SG 2.88Å; R428-C432 VanDerWaalsContact O-SG 3.42Å
429	F	94.2	Very high	92.7	Very high	41 Å²	41	74.1 Å²	74.1	18%	0.18	41%	0.407	C	S	.	.	H	α-helix	trans	-62.6	-44.2	175.4	-179.9	-108.4	0	0	0	111.8	S425 V426 I427 C431 C432 V433 V507 L510 F511 L514	S425-F429 WeakPolarHBondContact O-CB 3.14Å; S425-F429 PolarHBondContact O-N 2.9Å; V426-F429 PolarHBondContact O-N 3.46Å; I427-F429 VanDerWaalsContact C-N 3.32Å; I427-F429 PolarHBondContact O-N 2.83Å; F429-C431 VanDerWaalsContact C-N 3.33Å; F429-C431 PolarHBondContact O-N 2.79Å; F429-C432 WeakPolarHBondContact O-CB 3.48Å; F429-C432 PolarHBondContact O-N 2.84Å; F429-C432 VanDerWaalsContact O-N 3.15Å; F429-V433 HydrophobicContact CD1-CG2 4.13Å; F429-V433 HydrophobicContact CD2-CG2 4.41Å; F429-V433 HydrophobicContact CE1-CG2 3.73Å; F429-V433 HydrophobicContact CE2-CG2 4.02Å; F429-V433 HydrophobicContact CG-CG2 4.46Å; F429-V433 HydrophobicContact CZ-CG2 3.67Å; F429-V433 WeakPolarHBondContact O-CG2 3.25Å; F429-V433 PolarHBondContact O-N 2.83Å; F429-V507 HydrophobicContact CE1-CG1 4.02Å; F429-V507 HydrophobicContact CZ-CG1 3.99Å; F429-L510 HydrophobicContact CE1-CB 4.44Å; F429-L510 HydrophobicContact CE2-CB 4.13Å; F429-L510 HydrophobicContact CE2-CD1 4.13Å; F429-L510 HydrophobicContact CZ-CB 3.71Å; F429-L510 HydrophobicContact CZ-CD1 4.23Å; F429-F511 AromaticContact CD1-CD2 3.99Å; F429-F511 HydrophobicContact CD1-CD2 3.99Å; F429-F511 HydrophobicContact CE1-CB 4.13Å; F429-F511 HydrophobicContact CE1-CD2 4.13Å; F429-L514 HydrophobicContact CB-CD1 3.76Å; F429-L514 HydrophobicContact CD1-CD1 3.95Å; F429-L514 HydrophobicContact CD2-CD1 4.15Å; F429-L514 HydrophobicContact CG-CD1 3.68Å
430	C	93.4	Very high	93.3	Very high	68 Å²	68	70.8 Å²	70.8	46%	0.459	39%	0.386	S	S	.	.	H	α-helix	trans	-60.2	-40.2	177.2	-172.5	0	0	0	0	111.9	V426 I427 C432 V433 A434	V426-C430 WeakPolarHBondContact O-CB 3.26Å; V426-C430 PolarHBondContact O-N 3.49Å; I427-C430 WeakPolarHBondContact O-CB 3.45Å; I427-C430 PolarHBondContact O-N 3.09Å; C430-C432 PolarHBondContact O-N 2.84Å; C430-V433 PolarHBondContact O-N 3.22Å; C430-A434 WeakPolarHBondContact O-CB 3.21Å; C430-A434 PolarHBondContact O-N 2.77Å
431	C	94.4	Very high	93.8	Very high	75 Å²	75	61.8 Å²	61.8	51%	0.507	35%	0.352	S	S	.	.	H	α-helix	trans	-60.2	-43.7	174.1	-69.9	0	0	0	0	112.2	I427 R428 F429 A434 V435	I427-C431 PolarHBondContact O-N 3.45Å; I427-C431 PolarHBondContact O-SG 3.09Å; I427-C431 VanDerWaalsContact O-SG 3.32Å; R428-C431 PolarHBondContact O-N 3.01Å; F429-C431 VanDerWaalsContact C-N 3.33Å; F429-C431 PolarHBondContact O-N 2.79Å; C431-A434 PolarHBondContact O-N 3.46Å; C431-V435 PolarHBondContact O-N 3.33Å
432	C	94.1	Very high	94.3	Very high	86 Å²	86	64.8 Å²	64.8	58%	0.581	36%	0.357	S	S	*	.	H	α-helix	trans	-63.4	-44.3	176.4	-63.6	0	0	0	0	111.7	R428 F429 C430 A434 V435	R428-C432 PolarHBondContact O-N 2.85Å; R428-C432 PolarHBondContact O-SG 2.88Å; R428-C432 VanDerWaalsContact O-SG 3.42Å; F429-C432 WeakPolarHBondContact O-CB 3.48Å; F429-C432 PolarHBondContact O-N 2.84Å; F429-C432 VanDerWaalsContact O-N 3.15Å; C430-C432 PolarHBondContact O-N 2.84Å; C432-A434 VanDerWaalsContact C-N 3.35Å; C432-V435 PolarHBondContact O-N 3.05Å
433	V	95.4	Very high	94.7	Very high	21 Å²	21	66.6 Å²	66.6	13%	0.127	37%	0.369	C	S	.	.	H	α-helix	trans	-65.6	-38.4	177.9	171.7	0	0	0	0	111.4	F429 C430 V435 I436 Y437 F503 V507	F429-V433 HydrophobicContact CD1-CG2 4.13Å; F429-V433 HydrophobicContact CD2-CG2 4.41Å; F429-V433 HydrophobicContact CE1-CG2 3.73Å; F429-V433 HydrophobicContact CE2-CG2 4.02Å; F429-V433 HydrophobicContact CG-CG2 4.46Å; F429-V433 HydrophobicContact CZ-CG2 3.67Å; F429-V433 WeakPolarHBondContact O-CG2 3.25Å; F429-V433 PolarHBondContact O-N 2.83Å; C430-V433 PolarHBondContact O-N 3.22Å; V433-V435 VanDerWaalsContact C-N 3.29Å; V433-V435 PolarHBondContact O-N 3.15Å; V433-I436 PolarHBondContact O-N 3.36Å; V433-I436 VanDerWaalsContact O-N 3.16Å; V433-Y437 WeakPolarHBondContact O-CB 3.48Å; V433-Y437 PolarHBondContact O-N 3.27Å; V433-F503 HydrophobicContact CG1-CD1 4.33Å; V433-F503 HydrophobicContact CG1-CE1 3.6Å; V433-F503 HydrophobicContact CG1-CZ 4.41Å; V433-V507 HydrophobicContact CB-CG1 4.33Å; V433-V507 HydrophobicContact CG1-CG1 3.71Å; V433-V507 HydrophobicContact CG2-CG1 3.59Å; V433-V507 HydrophobicContact CG2-CG2 4.43Å
434	A	95.3	Very high	95	Very high	37 Å²	37	60.7 Å²	60.7	31%	0.306	34%	0.343	S	S	.	.	H	α-helix	trans	-61.5	-36.2	-179.9	0	0	0	0	0	112	C430 C431 C432 Y437 L438	C430-A434 WeakPolarHBondContact O-CB 3.21Å; C430-A434 PolarHBondContact O-N 2.77Å; C431-A434 PolarHBondContact O-N 3.46Å; C432-A434 VanDerWaalsContact C-N 3.35Å; A434-Y437 PolarHBondContact O-N 2.89Å; A434-L438 WeakPolarHBondContact O-CB 3.26Å; A434-L438 VanDerWaalsContact O-CG 3.25Å; A434-L438 WeakPolarHBondContact O-CG 3.3Å; A434-L438 PolarHBondContact O-N 2.82Å
435	V	96.6	Very high	95.3	Very high	107 Å²	107	62.8 Å²	62.8	65%	0.648	34%	0.343	S	S	*	.	H	α-helix	trans	-61.5	-45.7	175.1	174.9	0	0	0	0	111.1	C431 C432 V433 G439	C431-V435 PolarHBondContact O-N 3.33Å; C432-V435 PolarHBondContact O-N 3.05Å; V433-V435 VanDerWaalsContact C-N 3.29Å; V433-V435 PolarHBondContact O-N 3.15Å; V435-G439 PolarHBondContact O-N 2.83Å; V435-G439 VanDerWaalsContact O-N 3.09Å
436	I	96.3	Very high	95.6	Very high	80 Å²	80	65.8 Å²	65.8	41%	0.41	35%	0.353	S	S	.	.	H	α-helix	trans	-65.4	-46.5	177.4	-59.1	172.9	0	0	0	109.8	V433 L438 G439 Y440 L502 F503	V433-I436 PolarHBondContact O-N 3.36Å; V433-I436 VanDerWaalsContact O-N 3.16Å; I436-L438 PolarHBondContact O-N 3.44Å; I436-G439 WeakPolarHBondContact O-CA 3.39Å; I436-G439 PolarHBondContact O-N 3.25Å; I436-G439 VanDerWaalsContact O-N 3.1Å; I436-Y440 HydrophobicContact CG2-CD2 3.94Å; I436-Y440 HydrophobicContact CG2-CE2 3.91Å; I436-Y440 WeakPolarHBondContact O-CD2 3.26Å; I436-Y440 PolarHBondContact O-N 2.97Å; I436-L502 HydrophobicContact CG2-CD2 4.16Å; I436-F503 HydrophobicContact CB-CZ 4.4Å; I436-F503 HydrophobicContact CG2-CE2 4.04Å; I436-F503 HydrophobicContact CG2-CZ 4.03Å
437	Y	96.7	Very high	95.6	Very high	33 Å²	33	66.9 Å²	66.9	13%	0.129	36%	0.36	C	S	.	.	H	α-helix	trans	-59.1	-43.4	179.7	178	-96.5	0	0	0	112.3	V433 A434 G439 Y440 C441 S462 L465 I469 F499 F503	V433-Y437 WeakPolarHBondContact O-CB 3.48Å; V433-Y437 PolarHBondContact O-N 3.27Å; A434-Y437 PolarHBondContact O-N 2.89Å; Y437-G439 VanDerWaalsContact C-N 3.34Å; Y437-Y440 PolarHBondContact O-N 2.97Å; Y437-C441 WeakPolarHBondContact CE1-SG 3.29Å; Y437-C441 PolarHBondContact O-N 3.05Å; Y437-C441 PolarHBondContact O-SG 3.02Å; Y437-S462 WeakPolarHBondContact OH-CA 3.44Å; Y437-S462 PolarHBondContact OH-O 3.23Å; Y437-S462 PolarHBondContact OH-OG 3.36Å; Y437-L465 HydrophobicContact CE2-CB 3.71Å; Y437-L465 HydrophobicContact CE2-CD1 4.45Å; Y437-I469 HydrophobicContact CD2-CD1 4.08Å; Y437-I469 HydrophobicContact CE2-CD1 3.95Å; Y437-F499 HydrophobicContact CD2-CE2 4.17Å; Y437-F499 HydrophobicContact CD2-CZ 4.31Å; Y437-F499 HydrophobicContact CE2-CZ 4.29Å; Y437-F503 HydrophobicContact CD2-CE1 4.12Å; Y437-F503 HydrophobicContact CD2-CZ 4.27Å
438	L	96.5	Very high	95.6	Very high	85 Å²	85	63.4 Å²	63.4	45%	0.445	34%	0.342	S	S	.	.	H	α-helix	trans	-64.9	-37.9	174.9	-73.2	172.8	0	0	0	111.8	A434 I436 Y440 C441 F442	A434-L438 WeakPolarHBondContact O-CB 3.26Å; A434-L438 VanDerWaalsContact O-CG 3.25Å; A434-L438 WeakPolarHBondContact O-CG 3.3Å; A434-L438 PolarHBondContact O-N 2.82Å; I436-L438 PolarHBondContact O-N 3.44Å; L438-Y440 VanDerWaalsContact C-N 3.34Å; L438-Y440 PolarHBondContact O-N 2.96Å; L438-C441 WeakPolarHBondContact O-CB 3.49Å; L438-C441 PolarHBondContact O-N 3.15Å; L438-F442 HydrophobicContact CB-CD2 4.48Å; L438-F442 HydrophobicContact CB-CE2 4.2Å; L438-F442 WeakPolarHBondContact O-CD2 3.2Å; L438-F442 PolarHBondContact O-N 3.06Å
439	G	97.2	Very high	95.6	Very high	41 Å²	41	55.3 Å²	55.3	42%	0.423	31%	0.314	S	S	.	.	H	α-helix	trans	-57.3	-46.2	172.4	0	0	0	0	0	112.2	V435 I436 Y437 C443	V435-G439 PolarHBondContact O-N 2.83Å; V435-G439 VanDerWaalsContact O-N 3.09Å; I436-G439 WeakPolarHBondContact O-CA 3.39Å; I436-G439 PolarHBondContact O-N 3.25Å; I436-G439 VanDerWaalsContact O-N 3.1Å; Y437-G439 VanDerWaalsContact C-N 3.34Å; G439-C443 WeakPolarHBondContact O-CB 3.47Å; G439-C443 PolarHBondContact O-N 3.38Å; G439-C443 VanDerWaalsContact O-N 3.1Å
440	Y	97.1	Very high	95.5	Very high	46 Å²	46	57.9 Å²	57.9	18%	0.18	34%	0.335	C	S	.	.	H	α-helix	trans	-62.4	-47.1	171.8	-84.4	-88	0	0	0	111.3	I436 Y437 L438 F442 C443 G444 Y495 T498 F499 L502 F503	I436-Y440 HydrophobicContact CG2-CD2 3.94Å; I436-Y440 HydrophobicContact CG2-CE2 3.91Å; I436-Y440 WeakPolarHBondContact O-CD2 3.26Å; I436-Y440 PolarHBondContact O-N 2.97Å; Y437-Y440 PolarHBondContact O-N 2.97Å; L438-Y440 VanDerWaalsContact C-N 3.34Å; L438-Y440 PolarHBondContact O-N 2.96Å; Y440-F442 PolarHBondContact O-N 3.47Å; Y440-C443 PolarHBondContact O-N 2.94Å; Y440-G444 PolarHBondContact O-N 3.11Å; Y440-Y495 VanDerWaalsContact C-OH 3.27Å; Y440-Y495 AromaticContact CD1-CD2 3.99Å; Y440-Y495 HydrophobicContact CD1-CD2 3.99Å; Y440-Y495 HydrophobicContact CD1-CE1 4.46Å; Y440-Y495 AromaticContact CD1-CE2 3.44Å; Y440-Y495 HydrophobicContact CD1-CE2 3.44Å; Y440-Y495 VanDerWaalsContact CD1-CE2 3.44Å; Y440-Y495 AromaticContact CD1-CZ 3.69Å; Y440-Y495 HydrophobicContact CE1-CD2 4.26Å; Y440-Y495 HydrophobicContact CE1-CE2 4.16Å; Y440-Y495 HydrophobicContact CG-CE2 4.32Å; Y440-Y495 PolarHBondContact O-OH 3.15Å; Y440-T498 PolarHBondContact OH-OG1 3.12Å; Y440-F499 HydrophobicContact CD1-CB 3.86Å; Y440-F499 AromaticContact CD1-CD2 3.64Å; Y440-F499 HydrophobicContact CD1-CD2 3.64Å; Y440-F499 HydrophobicContact CD1-CG 4.16Å; Y440-F499 HydrophobicContact CD2-CD2 4.09Å; Y440-F499 HydrophobicContact CE1-CB 3.69Å; Y440-F499 HydrophobicContact CE1-CD2 4.13Å; Y440-F499 HydrophobicContact CE1-CG 4.41Å; Y440-F499 AromaticContact CG-CD2 3.64Å; Y440-F499 HydrophobicContact CG-CD2 3.64Å; Y440-F499 HydrophobicContact CG-CE2 4.32Å; Y440-L502 HydrophobicContact CE2-CD2 4.28Å; Y440-F503 HydrophobicContact CD2-CE2 4.09Å; Y440-F503 HydrophobicContact CE2-CE2 4.27Å
441	C	97	Very high	95.3	Very high	2 Å²	2	60.9 Å²	60.9	1%	0.014	34%	0.338	C	S	.	.	H	α-helix	trans	-54.9	-49.8	178.8	-68.6	0	0	0	0	112.8	Y437 L438 W445 L458 V461 L465	Y437-C441 WeakPolarHBondContact CE1-SG 3.29Å; Y437-C441 PolarHBondContact O-N 3.05Å; Y437-C441 PolarHBondContact O-SG 3.02Å; L438-C441 WeakPolarHBondContact O-CB 3.49Å; L438-C441 PolarHBondContact O-N 3.15Å; C441-W445 WeakPolarHBondContact O-CB 3.34Å; C441-W445 PolarHBondContact O-N 3.2Å; C441-L458 HydrophobicContact CB-CD1 4.03Å; C441-V461 HydrophobicContact CB-CG1 4.21Å; C441-L465 HydrophobicContact CB-CD1 4.47Å
442	F	97.6	Very high	95.1	Very high	110 Å²	110	57.4 Å²	57.4	48%	0.482	31%	0.314	S	S	.	.	H	α-helix	trans	-65.6	-41.7	179.7	-69.1	-56.3	0	0	0	112.1	L438 Y440 W445 I446 L458	L438-F442 HydrophobicContact CB-CD2 4.48Å; L438-F442 HydrophobicContact CB-CE2 4.2Å; L438-F442 WeakPolarHBondContact O-CD2 3.2Å; L438-F442 PolarHBondContact O-N 3.06Å; Y440-F442 PolarHBondContact O-N 3.47Å; F442-W445 HydrophobicContact CD1-CE3 4.49Å; F442-W445 PolarHBondContact O-N 3.42Å; F442-I446 WeakPolarHBondContact O-CG2 3.18Å; F442-I446 PolarHBondContact O-N 3.45Å; F442-I446 VanDerWaalsContact O-N 3.16Å; F442-L458 HydrophobicContact CD1-CD1 4.15Å; F442-L458 HydrophobicContact CE1-CD1 4.21Å; F442-L458 HydrophobicContact CE1-CD2 4.05Å
443	C	97.1	Very high	94.9	Very high	43 Å²	43	56.3 Å²	56.3	29%	0.291	31%	0.305	S	S	.	.	H	α-helix	trans	-63.6	-49.6	177.9	-174.9	0	0	0	0	111.8	G439 Y440 W445 I446 V447 Y495	G439-C443 WeakPolarHBondContact O-CB 3.47Å; G439-C443 PolarHBondContact O-N 3.38Å; G439-C443 VanDerWaalsContact O-N 3.1Å; Y440-C443 PolarHBondContact O-N 2.94Å; C443-W445 PolarHBondContact O-N 2.83Å; C443-I446 PolarHBondContact O-N 3.42Å; C443-V447 WeakPolarHBondContact O-CB 3.47Å; C443-V447 WeakPolarHBondContact O-CG2 3.42Å; C443-V447 PolarHBondContact O-N 2.87Å; C443-Y495 HydrophobicContact CB-CE2 4.15Å
444	G	95.4	Very high	94.7	Very high	0 Å²	0	57.1 Å²	57.1	0%	0	31%	0.306	C	S	.	.	H	α-helix	trans	-62.7	-40.5	176.6	0	0	0	0	0	112.3	Y440 L448 G449	Y440-G444 PolarHBondContact O-N 3.11Å; G444-L448 WeakPolarHBondContact O-CA 3.21Å; G444-L448 VanDerWaalsContact O-CB 3.26Å; G444-L448 WeakPolarHBondContact O-CB 3.43Å; G444-L448 PolarHBondContact O-N 3.45Å; G444-G449 PolarHBondContact O-N 2.93Å
445	W	96.6	Very high	94.6	Very high	108 Å²	108	55.4 Å²	55.4	41%	0.409	29%	0.292	S	S	.	.	H	α-helix	trans	-60.1	-49.8	178.8	-178.7	35.7	0	0	0	112.1	C441 F442 C443 G449 R456 L458 V461	C441-W445 WeakPolarHBondContact O-CB 3.34Å; C441-W445 PolarHBondContact O-N 3.2Å; F442-W445 HydrophobicContact CD1-CE3 4.49Å; F442-W445 PolarHBondContact O-N 3.42Å; C443-W445 PolarHBondContact O-N 2.83Å; W445-G449 VanDerWaalsContact O-CA 3.25Å; W445-G449 WeakPolarHBondContact O-CA 3.28Å; W445-G449 PolarHBondContact O-N 3.38Å; W445-G449 VanDerWaalsContact O-N 3.12Å; W445-R456 PolarHBondContact NE1-O 3.39Å; W445-L458 HydrophobicContact CB-CD1 4.49Å; W445-L458 HydrophobicContact CD2-CB 4.47Å; W445-L458 HydrophobicContact CE3-CD1 4.43Å; W445-V461 HydrophobicContact CB-CG2 3.93Å; W445-V461 HydrophobicContact CG-CG2 4.39Å
446	I	95.8	Very high	94.3	Very high	122 Å²	122	58.2 Å²	58.2	63%	0.626	29%	0.291	S	S	*	.	H	α-helix	trans	-78.1	-38.2	-174.9	-162.3	63.3	0	0	0	112.7	F442 C443	F442-I446 WeakPolarHBondContact O-CG2 3.18Å; F442-I446 PolarHBondContact O-N 3.45Å; F442-I446 VanDerWaalsContact O-N 3.16Å; C443-I446 PolarHBondContact O-N 3.42Å
447	V	94.4	Very high	94.3	Very high	46 Å²	46	56.6 Å²	56.6	28%	0.279	29%	0.287	S	S	.	.	H	α-helix	trans	-83.7	-44.7	-175.3	-176.5	0	0	0	0	111.7	C443 Y451 F491	C443-V447 WeakPolarHBondContact O-CB 3.47Å; C443-V447 WeakPolarHBondContact O-CG2 3.42Å; C443-V447 PolarHBondContact O-N 2.87Å; V447-Y451 WeakPolarHBondContact O-CD2 3.49Å; V447-F491 HydrophobicContact CB-CD1 4.29Å; V447-F491 HydrophobicContact CB-CE1 3.79Å; V447-F491 HydrophobicContact CB-CZ 4.4Å; V447-F491 HydrophobicContact CG1-CD1 3.45Å; V447-F491 VanDerWaalsContact CG1-CD1 3.45Å; V447-F491 HydrophobicContact CG1-CE1 3.45Å; V447-F491 VanDerWaalsContact CG1-CE1 3.45Å; V447-F491 HydrophobicContact CG1-CG 4.21Å; V447-F491 HydrophobicContact CG1-CZ 4.2Å; V447-F491 HydrophobicContact CG2-CE1 4.06Å; V447-F491 HydrophobicContact CG2-CZ 4.16Å
448	L	93.5	Very high	94.1	Very high	1 Å²	1	58.1 Å²	58.1	1%	0.005	30%	0.297	C	S	.	.	H	α-helix	trans	-94	-21.2	-175.3	-52.2	178	0	0	0	112.7	G444 Y451 H452 F455 M481 V488 F491 Y495	G444-L448 WeakPolarHBondContact O-CA 3.21Å; G444-L448 VanDerWaalsContact O-CB 3.26Å; G444-L448 WeakPolarHBondContact O-CB 3.43Å; G444-L448 PolarHBondContact O-N 3.45Å; L448-Y451 PolarHBondContact O-N 3.46Å; L448-H452 WeakPolarHBondContact O-CB 3.11Å; L448-H452 PolarHBondContact O-N 3.38Å; L448-F455 HydrophobicContact CB-CB 3.98Å; L448-F455 HydrophobicContact CB-CD1 4.08Å; L448-F455 HydrophobicContact CB-CD2 4.24Å; L448-F455 HydrophobicContact CB-CG 3.84Å; L448-F455 HydrophobicContact CD1-CD1 4.13Å; L448-F455 HydrophobicContact CD1-CD2 4.46Å; L448-F455 HydrophobicContact CD1-CE1 3.94Å; L448-F455 HydrophobicContact CD1-CE2 4.26Å; L448-F455 HydrophobicContact CD1-CG 4.41Å; L448-F455 HydrophobicContact CD1-CZ 4.01Å; L448-M481 HydrophobicContact CD2-CE 3.91Å; L448-M481 HydrophobicContact CD2-SD 4.41Å; L448-V488 HydrophobicContact CD2-CG1 4.47Å; L448-F491 HydrophobicContact CD2-CD1 4.32Å; L448-Y495 HydrophobicContact CD1-CD1 3.79Å; L448-Y495 HydrophobicContact CD1-CE1 3.97Å; L448-Y495 HydrophobicContact CD1-CG 4.41Å
449	G	92.9	Very high	94.1	Very high	9 Å²	9	57.6 Å²	57.6	9%	0.093	30%	0.3	C	S	.	.	T	Hydrogen-bonded Turn	trans	-56	-38.9	-175.6	0	0	0	0	0	116.5	G444 W445 Y451 F455	G444-G449 PolarHBondContact O-N 2.93Å; W445-G449 VanDerWaalsContact O-CA 3.25Å; W445-G449 WeakPolarHBondContact O-CA 3.28Å; W445-G449 PolarHBondContact O-N 3.38Å; W445-G449 VanDerWaalsContact O-N 3.12Å; G449-Y451 VanDerWaalsContact C-N 3.26Å; G449-Y451 PolarHBondContact O-N 3.49Å; G449-F455 WeakPolarHBondContact CA-O 3.22Å
450	P	91.4	Very high	93.9	Very high	96 Å²	96	59.2 Å²	59.2	62%	0.623	30%	0.297	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.9	-27.4	175	-23.9	35.2	0	0	0	113.9
451	Y	90.1	Very high	93.9	Very high	130 Å²	130	57 Å²	57	51%	0.51	29%	0.289	S	S	.	.	T	Hydrogen-bonded Turn	trans	-104.5	-27.8	-170.3	-55.9	-77.2	0	0	0	113.1	V447 L448 G449 V488	V447-Y451 WeakPolarHBondContact O-CD2 3.49Å; L448-Y451 PolarHBondContact O-N 3.46Å; G449-Y451 VanDerWaalsContact C-N 3.26Å; G449-Y451 PolarHBondContact O-N 3.49Å; Y451-V488 HydrophobicContact CD2-CG1 3.64Å; Y451-V488 HydrophobicContact CD2-CG2 4.41Å; Y451-V488 HydrophobicContact CE2-CB 4.47Å; Y451-V488 HydrophobicContact CE2-CG1 3.92Å; Y451-V488 HydrophobicContact CE2-CG2 3.84Å; Y451-V488 HydrophobicContact CG-CG1 4.13Å
452	H	90.1	Very high	93.9	Very high	3 Å²	3	59.1 Å²	59.1	1%	0.014	30%	0.304	C	S	.	.			trans	-119.6	132	-173.1	-165.6	-54.3	0	0	0	111.8	L448 K454 F455 T477 E480 M481	L448-H452 WeakPolarHBondContact O-CB 3.11Å; L448-H452 PolarHBondContact O-N 3.38Å; H452-K454 PolarHBondContact ND1-N 3.04Å; H452-K454 PolarHBondContact O-N 2.88Å; H452-F455 HydrophobicContact CB-CB 4.33Å; H452-F455 HydrophobicContact CB-CD2 3.84Å; H452-F455 AromaticContact CG-CD2 3.6Å; H452-F455 AromaticContact ND1-CD2 3.68Å; H452-F455 PolarHBondContact O-N 3.35Å; H452-F455 VanDerWaalsContact O-N 3.15Å; H452-T477 PolarHBondContact NE2-O 2.85Å; H452-E480 IonicContact CE1-OE2 3.34Å; H452-E480 PolarHBondContact CE1-OE2 3.42Å; H452-E480 IonicContact ND1-OE2 2.71Å; H452-E480 IonicContact NE2-OE2 3.43Å; H452-E480 PolarHBondContact NE2-OE2 3.11Å; H452-M481 HydrophobicContact CB-SD 3.76Å; H452-M481 VanDerWaalsContact CD2-SD 3.58Å
453	V	89	Confident	93.7	Very high	63 Å²	63	59.1 Å²	59.1	38%	0.382	31%	0.305	S	S	.	.	G	3₁₀ helix	trans	-65.3	-40.4	-175.3	-62.7	0	0	0	0	113.3	F455 R456 M460 E480	V453-F455 PolarHBondContact O-N 3.35Å; V453-R456 WeakPolarHBondContact O-CG 3.25Å; V453-R456 PolarHBondContact O-N 3.48Å; V453-M460 WeakPolarHBondContact O-CE 2.98Å; V453-E480 WeakPolarHBondContact CG2-OE2 3.45Å
454	K	92.2	Very high	93.6	Very high	38 Å²	38	57.6 Å²	57.6	17%	0.165	30%	0.295	C	S	.	.	G	3₁₀ helix	trans	-64.9	-16.9	174.8	-59.7	-176.3	179.3	-173	0	114.8	H452 M460 V461 C464 D473 T477	H452-K454 PolarHBondContact ND1-N 3.04Å; H452-K454 PolarHBondContact O-N 2.88Å; K454-M460 CarbonylContact O-C 3.52Å; K454-M460 VanDerWaalsContact O-C 3.23Å; K454-M460 VanDerWaalsContact O-CB 3.26Å; K454-M460 WeakPolarHBondContact O-CB 3.41Å; K454-V461 PolarHBondContact O-N 3.22Å; K454-C464 HydrophobicContact CB-CB 4.13Å; K454-D473 VanDerWaalsContact NZ-CG 3.33Å; K454-D473 IonicContact NZ-OD2 3.41Å; K454-D473 PolarHBondContact NZ-OD2 3.22Å; K454-T477 HydrophobicContact CD-CG2 4.08Å
455	F	93.8	Very high	93.6	Very high	1 Å²	1	57.6 Å²	57.6	0%	0.004	30%	0.295	C	S	.	.	G	3₁₀ helix	trans	-103.7	10.3	-178.1	-70.6	-98.2	0	0	0	113.9	L448 G449 H452 V453 S457 V461 L465 Y495 L496	L448-F455 HydrophobicContact CB-CB 3.98Å; L448-F455 HydrophobicContact CB-CD1 4.08Å; L448-F455 HydrophobicContact CB-CD2 4.24Å; L448-F455 HydrophobicContact CB-CG 3.84Å; L448-F455 HydrophobicContact CD1-CD1 4.13Å; L448-F455 HydrophobicContact CD1-CD2 4.46Å; L448-F455 HydrophobicContact CD1-CE1 3.94Å; L448-F455 HydrophobicContact CD1-CE2 4.26Å; L448-F455 HydrophobicContact CD1-CG 4.41Å; L448-F455 HydrophobicContact CD1-CZ 4.01Å; G449-F455 WeakPolarHBondContact CA-O 3.22Å; H452-F455 HydrophobicContact CB-CB 4.33Å; H452-F455 HydrophobicContact CB-CD2 3.84Å; H452-F455 AromaticContact CG-CD2 3.6Å; H452-F455 AromaticContact ND1-CD2 3.68Å; H452-F455 PolarHBondContact O-N 3.35Å; H452-F455 VanDerWaalsContact O-N 3.15Å; V453-F455 PolarHBondContact O-N 3.35Å; F455-S457 PolarHBondContact O-N 3.39Å; F455-V461 HydrophobicContact CB-CG2 4.01Å; F455-V461 HydrophobicContact CD1-CB 4.33Å; F455-V461 HydrophobicContact CD1-CG1 3.89Å; F455-V461 HydrophobicContact CD1-CG2 3.77Å; F455-V461 HydrophobicContact CE1-CG1 4.05Å; F455-V461 HydrophobicContact CG-CG2 4.21Å; F455-L465 HydrophobicContact CE1-CD2 4.37Å; F455-L465 HydrophobicContact CZ-CD2 4.44Å; F455-Y495 HydrophobicContact CE1-CE1 4.21Å; F455-Y495 HydrophobicContact CZ-CE1 4.47Å; F455-L496 HydrophobicContact CZ-CD2 4.44Å
456	R	90.8	Very high	93.5	Very high	166 Å²	166	58.6 Å²	58.6	63%	0.626	30%	0.302	S	S	*	.	S	Bend	trans	-69.6	-31.1	-173.3	-75	-178.5	174.1	171.4	1.7	115.1	W445 V453	W445-R456 PolarHBondContact NE1-O 3.39Å; V453-R456 WeakPolarHBondContact O-CG 3.25Å; V453-R456 PolarHBondContact O-N 3.48Å
457	S	94.3	Very high	93.5	Very high	46 Å²	46	54.6 Å²	54.6	32%	0.322	29%	0.285	S	S	.	.	S	Bend	trans	-131.2	151.1	179.2	72.9	0	0	0	0	110.3	F455 S459 M460 V461	F455-S457 PolarHBondContact O-N 3.39Å; S457-S459 PolarHBondContact O-N 2.95Å; S457-M460 PolarHBondContact O-N 3.27Å; S457-M460 VanDerWaalsContact O-N 3.11Å; S457-M460 VanDerWaalsContact OG-CG 3.26Å; S457-M460 WeakPolarHBondContact OG-CG 3.07Å; S457-M460 PolarHBondContact OG-N 2.89Å; S457-V461 VanDerWaalsContact O-CG2 3.25Å; S457-V461 WeakPolarHBondContact O-CG2 3.33Å; S457-V461 PolarHBondContact O-N 2.86Å
458	L	94.4	Very high	93.5	Very high	65 Å²	65	52.4 Å²	52.4	34%	0.34	27%	0.272	S	S	.	.	H	α-helix	trans	-58.1	-34.8	-178.6	-171.4	65.9	0	0	0	112.9	C441 F442 W445 V461 S462	C441-L458 HydrophobicContact CB-CD1 4.03Å; F442-L458 HydrophobicContact CD1-CD1 4.15Å; F442-L458 HydrophobicContact CE1-CD1 4.21Å; F442-L458 HydrophobicContact CE1-CD2 4.05Å; W445-L458 HydrophobicContact CB-CD1 4.49Å; W445-L458 HydrophobicContact CD2-CB 4.47Å; W445-L458 HydrophobicContact CE3-CD1 4.43Å; L458-V461 PolarHBondContact O-N 3.46Å; L458-S462 PolarHBondContact O-N 3.47Å
459	S	95.1	Very high	93.5	Very high	73 Å²	73	53.8 Å²	53.8	51%	0.51	28%	0.279	S	S	.	.	H	α-helix	trans	-62.8	-50.3	174.9	-166.2	0	0	0	0	111.3	S457 V461 S462 E463	S457-S459 PolarHBondContact O-N 2.95Å; S459-V461 VanDerWaalsContact C-N 3.28Å; S459-V461 PolarHBondContact O-N 3.17Å; S459-S462 WeakPolarHBondContact O-CB 3.29Å; S459-S462 PolarHBondContact O-N 2.67Å; S459-S462 VanDerWaalsContact O-N 3.07Å; S459-E463 WeakPolarHBondContact O-CG 3.22Å; S459-E463 PolarHBondContact O-N 3.49Å; S459-E463 PolarHBondContact OG-OE1 3.06Å
460	M	94.3	Very high	93.5	Very high	75 Å²	75	58.5 Å²	58.5	37%	0.369	30%	0.302	S	S	.	.	H	α-helix	trans	-64	-34.8	179.2	-66.2	175	75.2	0	0	112	V453 K454 S457 S462 E463 C464	V453-M460 WeakPolarHBondContact O-CE 2.98Å; K454-M460 CarbonylContact O-C 3.52Å; K454-M460 VanDerWaalsContact O-C 3.23Å; K454-M460 VanDerWaalsContact O-CB 3.26Å; K454-M460 WeakPolarHBondContact O-CB 3.41Å; S457-M460 PolarHBondContact O-N 3.27Å; S457-M460 VanDerWaalsContact O-N 3.11Å; S457-M460 VanDerWaalsContact OG-CG 3.26Å; S457-M460 WeakPolarHBondContact OG-CG 3.07Å; S457-M460 PolarHBondContact OG-N 2.89Å; M460-S462 VanDerWaalsContact C-N 3.35Å; M460-E463 PolarHBondContact O-N 3.16Å; M460-C464 WeakPolarHBondContact O-CB 3.44Å; M460-C464 PolarHBondContact O-N 2.78Å
461	V	96.3	Very high	93.5	Very high	0 Å²	0	55.5 Å²	55.5	0%	0	29%	0.288	C	S	.	.	H	α-helix	trans	-62.5	-45.3	173.4	177.2	0	0	0	0	110.1	C441 W445 K454 F455 S457 L458 S459 C464 L465	C441-V461 HydrophobicContact CB-CG1 4.21Å; W445-V461 HydrophobicContact CB-CG2 3.93Å; W445-V461 HydrophobicContact CG-CG2 4.39Å; K454-V461 PolarHBondContact O-N 3.22Å; F455-V461 HydrophobicContact CB-CG2 4.01Å; F455-V461 HydrophobicContact CD1-CB 4.33Å; F455-V461 HydrophobicContact CD1-CG1 3.89Å; F455-V461 HydrophobicContact CD1-CG2 3.77Å; F455-V461 HydrophobicContact CE1-CG1 4.05Å; F455-V461 HydrophobicContact CG-CG2 4.21Å; S457-V461 VanDerWaalsContact O-CG2 3.25Å; S457-V461 WeakPolarHBondContact O-CG2 3.33Å; S457-V461 PolarHBondContact O-N 2.86Å; L458-V461 PolarHBondContact O-N 3.46Å; S459-V461 VanDerWaalsContact C-N 3.28Å; S459-V461 PolarHBondContact O-N 3.17Å; V461-C464 PolarHBondContact O-N 3.13Å; V461-L465 HydrophobicContact CG1-CD1 3.9Å; V461-L465 HydrophobicContact CG1-CG 4.23Å; V461-L465 WeakPolarHBondContact O-CB 3.47Å; V461-L465 VanDerWaalsContact O-CG 3.3Å; V461-L465 WeakPolarHBondContact O-CG 3.22Å; V461-L465 PolarHBondContact O-N 3.3Å
462	S	96.1	Very high	93.6	Very high	47 Å²	47	53.4 Å²	53.4	33%	0.329	29%	0.286	S	S	.	.	H	α-helix	trans	-63.4	-45.6	177.5	-173.6	0	0	0	0	111.5	Y437 L458 S459 M460 C464 L465 F466	Y437-S462 WeakPolarHBondContact OH-CA 3.44Å; Y437-S462 PolarHBondContact OH-O 3.23Å; Y437-S462 PolarHBondContact OH-OG 3.36Å; L458-S462 PolarHBondContact O-N 3.47Å; S459-S462 WeakPolarHBondContact O-CB 3.29Å; S459-S462 PolarHBondContact O-N 2.67Å; S459-S462 VanDerWaalsContact O-N 3.07Å; M460-S462 VanDerWaalsContact C-N 3.35Å; S462-C464 PolarHBondContact O-N 2.94Å; S462-L465 PolarHBondContact O-N 3.01Å; S462-F466 WeakPolarHBondContact O-CB 3.45Å; S462-F466 PolarHBondContact O-N 3.1Å
463	E	95	Very high	93.5	Very high	110 Å²	110	56.9 Å²	56.9	51%	0.514	31%	0.305	S	S	.	.	H	α-helix	trans	-57.7	-48.1	174.7	-69.9	158.8	-144.5	0	0	111.2	S459 M460 F466 S467	S459-E463 WeakPolarHBondContact O-CG 3.22Å; S459-E463 PolarHBondContact O-N 3.49Å; S459-E463 PolarHBondContact OG-OE1 3.06Å; M460-E463 PolarHBondContact O-N 3.16Å; E463-F466 PolarHBondContact O-N 2.78Å; E463-S467 WeakPolarHBondContact O-CB 3.27Å; E463-S467 PolarHBondContact O-N 2.91Å; E463-S467 PolarHBondContact O-OG 3.49Å
464	C	95	Very high	93.6	Very high	10 Å²	10	57.4 Å²	57.4	7%	0.068	30%	0.304	C	S	.	.	H	α-helix	trans	-62.2	-48.5	179.2	-173.4	0	0	0	0	112.2	K454 M460 V461 S462 F466 S467 L468	K454-C464 HydrophobicContact CB-CB 4.13Å; M460-C464 WeakPolarHBondContact O-CB 3.44Å; M460-C464 PolarHBondContact O-N 2.78Å; V461-C464 PolarHBondContact O-N 3.13Å; S462-C464 PolarHBondContact O-N 2.94Å; C464-F466 VanDerWaalsContact C-N 3.33Å; C464-F466 PolarHBondContact O-N 3.19Å; C464-S467 PolarHBondContact O-N 3.49Å; C464-L468 WeakPolarHBondContact O-CB 3.43Å; C464-L468 VanDerWaalsContact O-CG 3.26Å; C464-L468 WeakPolarHBondContact O-CG 3.15Å; C464-L468 PolarHBondContact O-N 2.68Å
465	L	95.3	Very high	93.6	Very high	0 Å²	0	63.3 Å²	63.3	0%	0	33%	0.33	C	S	.	.	H	α-helix	trans	-67.1	-35.5	179.6	-69.2	-178.5	0	0	0	111.5	Y437 C441 F455 V461 S462 L468 I469 Y495 F499	Y437-L465 HydrophobicContact CE2-CB 3.71Å; Y437-L465 HydrophobicContact CE2-CD1 4.45Å; C441-L465 HydrophobicContact CB-CD1 4.47Å; F455-L465 HydrophobicContact CE1-CD2 4.37Å; F455-L465 HydrophobicContact CZ-CD2 4.44Å; V461-L465 HydrophobicContact CG1-CD1 3.9Å; V461-L465 HydrophobicContact CG1-CG 4.23Å; V461-L465 WeakPolarHBondContact O-CB 3.47Å; V461-L465 VanDerWaalsContact O-CG 3.3Å; V461-L465 WeakPolarHBondContact O-CG 3.22Å; V461-L465 PolarHBondContact O-N 3.3Å; S462-L465 PolarHBondContact O-N 3.01Å; L465-L468 HydrophobicContact CD2-CD1 4.18Å; L465-L468 PolarHBondContact O-N 3.43Å; L465-I469 VanDerWaalsContact O-CG1 3.29Å; L465-I469 WeakPolarHBondContact O-CG1 3.46Å; L465-I469 PolarHBondContact O-N 2.98Å; L465-Y495 HydrophobicContact CD2-CE1 4.25Å; L465-F499 HydrophobicContact CB-CE1 4.07Å; L465-F499 HydrophobicContact CB-CE2 4.32Å; L465-F499 HydrophobicContact CB-CZ 3.65Å; L465-F499 HydrophobicContact CD1-CE2 4.3Å; L465-F499 HydrophobicContact CD1-CZ 4.42Å; L465-F499 HydrophobicContact CD2-CD1 3.9Å; L465-F499 HydrophobicContact CD2-CD2 4.32Å; L465-F499 HydrophobicContact CD2-CE1 3.71Å; L465-F499 HydrophobicContact CD2-CE2 4.13Å; L465-F499 HydrophobicContact CD2-CG 4.2Å; L465-F499 HydrophobicContact CD2-CZ 3.84Å; L465-F499 HydrophobicContact CG-CE1 4.44Å; L465-F499 HydrophobicContact CG-CE2 4.49Å; L465-F499 HydrophobicContact CG-CZ 4.16Å; L465-F499 WeakPolarHBondContact O-CE1 3.46Å
466	F	95.1	Very high	93.4	Very high	129 Å²	129	65.9 Å²	65.9	57%	0.566	35%	0.346	S	S	*	.	H	α-helix	trans	-67.4	-42.3	174.9	-176.2	-101.6	0	0	0	111.9	S462 E463 C464 L468 I469 N470	S462-F466 WeakPolarHBondContact O-CB 3.45Å; S462-F466 PolarHBondContact O-N 3.1Å; E463-F466 PolarHBondContact O-N 2.78Å; C464-F466 VanDerWaalsContact C-N 3.33Å; C464-F466 PolarHBondContact O-N 3.19Å; F466-L468 VanDerWaalsContact C-N 3.33Å; F466-L468 PolarHBondContact O-N 3.25Å; F466-I469 PolarHBondContact O-N 3.28Å; F466-N470 PolarHBondContact O-N 3.42Å; F466-N470 PolarHBondContact O-ND2 3.23Å
467	S	94.8	Very high	93.3	Very high	38 Å²	38	58 Å²	58	27%	0.266	32%	0.316	S	S	.	.	H	α-helix	trans	-58.7	-43.6	171.2	-72.6	0	0	0	0	111.8	E463 C464 I469 N470 G471 D472	E463-S467 WeakPolarHBondContact O-CB 3.27Å; E463-S467 PolarHBondContact O-N 2.91Å; E463-S467 PolarHBondContact O-OG 3.49Å; C464-S467 PolarHBondContact O-N 3.49Å; S467-I469 PolarHBondContact O-N 2.96Å; S467-N470 CarbonylContact O-C 3.59Å; S467-N470 WeakPolarHBondContact O-CA 3.36Å; S467-N470 PolarHBondContact O-N 3.01Å; S467-G471 PolarHBondContact O-N 3.36Å; S467-G471 VanDerWaalsContact O-N 3.15Å; S467-D472 PolarHBondContact O-N 3.42Å
468	L	94.1	Very high	93.1	Very high	1 Å²	1	57.4 Å²	57.4	1%	0.005	31%	0.308	C	S	.	.	H	α-helix	trans	-63.3	-38.3	178.1	-74.4	172.1	0	0	0	113.2	C464 L465 F466 N470 G471 M474 T477 L496 F499 I500	C464-L468 WeakPolarHBondContact O-CB 3.43Å; C464-L468 VanDerWaalsContact O-CG 3.26Å; C464-L468 WeakPolarHBondContact O-CG 3.15Å; C464-L468 PolarHBondContact O-N 2.68Å; L465-L468 HydrophobicContact CD2-CD1 4.18Å; L465-L468 PolarHBondContact O-N 3.43Å; F466-L468 VanDerWaalsContact C-N 3.33Å; F466-L468 PolarHBondContact O-N 3.25Å; L468-N470 PolarHBondContact O-N 3.49Å; L468-G471 PolarHBondContact O-N 3.48Å; L468-M474 HydrophobicContact CD2-CB 4.18Å; L468-M474 HydrophobicContact CD2-CG 3.76Å; L468-T477 HydrophobicContact CD1-CG2 4.46Å; L468-T477 HydrophobicContact CD2-CG2 4.26Å; L468-L496 HydrophobicContact CD1-CD2 3.97Å; L468-F499 HydrophobicContact CB-CE1 4.05Å; L468-I500 HydrophobicContact CD2-CD1 4.48Å
469	I	94.4	Very high	92.8	Very high	29 Å²	29	56.1 Å²	56.1	15%	0.149	31%	0.306	C	S	.	.	H	α-helix	trans	-59.3	-33.2	174.3	-67.1	167.1	0	0	0	111	Y437 L465 F466 S467 G471 F499 F503	Y437-I469 HydrophobicContact CD2-CD1 4.08Å; Y437-I469 HydrophobicContact CE2-CD1 3.95Å; L465-I469 VanDerWaalsContact O-CG1 3.29Å; L465-I469 WeakPolarHBondContact O-CG1 3.46Å; L465-I469 PolarHBondContact O-N 2.98Å; F466-I469 PolarHBondContact O-N 3.28Å; S467-I469 PolarHBondContact O-N 2.96Å; I469-G471 VanDerWaalsContact C-N 3.34Å; I469-F499 HydrophobicContact CD1-CZ 3.83Å; I469-F499 HydrophobicContact CG1-CE1 3.89Å; I469-F499 HydrophobicContact CG1-CZ 3.64Å; I469-F503 HydrophobicContact CD1-CB 4.43Å; I469-F503 HydrophobicContact CD1-CD1 3.67Å; I469-F503 HydrophobicContact CD1-CE1 4.24Å; I469-F503 HydrophobicContact CD1-CG 4.24Å; I469-F503 HydrophobicContact CG1-CB 3.9Å; I469-F503 HydrophobicContact CG1-CD1 4.1Å; I469-F503 HydrophobicContact CG1-CG 4.2Å
470	N	92.4	Very high	92.4	Very high	108 Å²	108	56.6 Å²	56.6	58%	0.578	30%	0.301	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.1	3	177.9	-65.6	-73.7	0	0	0	113.4	F466 S467 L468	F466-N470 PolarHBondContact O-N 3.42Å; F466-N470 PolarHBondContact O-ND2 3.23Å; S467-N470 CarbonylContact O-C 3.59Å; S467-N470 WeakPolarHBondContact O-CA 3.36Å; S467-N470 PolarHBondContact O-N 3.01Å; L468-N470 PolarHBondContact O-N 3.49Å
471	G	90.3	Very high	91.9	Very high	33 Å²	33	53.1 Å²	53.1	34%	0.34	28%	0.283	S	S	.	.	T	Hydrogen-bonded Turn	trans	79.7	15.1	178.1	0	0	0	0	0	115.1	S467 L468 I469	S467-G471 PolarHBondContact O-N 3.36Å; S467-G471 VanDerWaalsContact O-N 3.15Å; L468-G471 PolarHBondContact O-N 3.48Å; I469-G471 VanDerWaalsContact C-N 3.34Å
472	D	93.8	Very high	90.9	Very high	87 Å²	87	60.3 Å²	60.3	47%	0.465	32%	0.317	S	S	.	.			trans	-88.4	142.1	178.7	-174.9	32.6	0	0	0	111.7	S467 M474	S467-D472 PolarHBondContact O-N 3.42Å; D472-M474 PolarHBondContact O-N 2.92Å
473	D	88.1	Confident	89.8	Confident	76 Å²	76	67.4 Å²	67.4	41%	0.406	35%	0.345	S	S	.	.	S	Bend	trans	56.4	21.5	173.1	-99.1	-1.7	0	0	0	117.4	K454 F475 V476 T477	K454-D473 VanDerWaalsContact NZ-CG 3.33Å; K454-D473 IonicContact NZ-OD2 3.41Å; K454-D473 PolarHBondContact NZ-OD2 3.22Å; D473-F475 PolarHBondContact O-N 2.91Å; D473-V476 PolarHBondContact O-N 3.42Å; D473-T477 PolarHBondContact O-N 2.86Å
474	M	90.6	Very high	89	Confident	73 Å²	73	63.2 Å²	63.2	36%	0.36	33%	0.328	S	S	.	.	H	α-helix	trans	-55.8	-54.9	-175.7	-65.2	-173.9	-67.2	0	0	113.2	L468 D472 V476 T477 F478	L468-M474 HydrophobicContact CD2-CB 4.18Å; L468-M474 HydrophobicContact CD2-CG 3.76Å; D472-M474 PolarHBondContact O-N 2.92Å; M474-V476 VanDerWaalsContact C-N 3.32Å; M474-V476 PolarHBondContact O-N 3.37Å; M474-T477 PolarHBondContact O-N 3.13Å; M474-T477 PolarHBondContact O-OG1 2.9Å; M474-F478 WeakPolarHBondContact O-CD2 3.49Å; M474-F478 PolarHBondContact O-N 3.37Å
475	F	91	Very high	88.6	Confident	162 Å²	162	64.9 Å²	64.9	71%	0.711	35%	0.346	S	S	*	.	H	α-helix	trans	-62.4	-38.5	-176.5	178.4	-102.6	0	0	0	112.7	D473 T477 F478 A479	D473-F475 PolarHBondContact O-N 2.91Å; F475-T477 VanDerWaalsContact C-N 3.27Å; F475-T477 PolarHBondContact O-N 3.4Å; F475-F478 PolarHBondContact O-N 3.42Å; F475-F478 VanDerWaalsContact O-N 3.08Å; F475-A479 HydrophobicContact CD1-CB 4.45Å; F475-A479 HydrophobicContact CE1-CB 4.03Å; F475-A479 HydrophobicContact CZ-CB 4.2Å; F475-A479 WeakPolarHBondContact O-CB 3.46Å; F475-A479 PolarHBondContact O-N 3.23Å
476	V	89.8	Confident	88.3	Confident	56 Å²	56	70.2 Å²	70.2	34%	0.339	38%	0.379	S	S	.	.	H	α-helix	trans	-59.8	-41.2	179.7	-179.8	0	0	0	0	110.5	D473 M474 F478 A479 E480	D473-V476 PolarHBondContact O-N 3.42Å; M474-V476 VanDerWaalsContact C-N 3.32Å; M474-V476 PolarHBondContact O-N 3.37Å; V476-F478 VanDerWaalsContact C-N 3.3Å; V476-F478 PolarHBondContact O-N 3.16Å; V476-A479 PolarHBondContact O-N 2.96Å; V476-E480 HydrophobicContact CG1-CG 4.47Å; V476-E480 PolarHBondContact O-N 2.94Å; V476-E480 VanDerWaalsContact O-N 3.08Å
477	T	90.4	Very high	88.1	Confident	1 Å²	1	71 Å²	71	1%	0.006	39%	0.388	C	S	.	.	H	α-helix	trans	-64.8	-31.6	177.3	62.3	0	0	0	0	113.7	H452 K454 L468 D473 M474 F475 M481	H452-T477 PolarHBondContact NE2-O 2.85Å; K454-T477 HydrophobicContact CD-CG2 4.08Å; L468-T477 HydrophobicContact CD1-CG2 4.46Å; L468-T477 HydrophobicContact CD2-CG2 4.26Å; D473-T477 PolarHBondContact O-N 2.86Å; M474-T477 PolarHBondContact O-N 3.13Å; M474-T477 PolarHBondContact O-OG1 2.9Å; F475-T477 VanDerWaalsContact C-N 3.27Å; F475-T477 PolarHBondContact O-N 3.4Å; T477-M481 WeakPolarHBondContact O-CG 3.49Å
478	F	89.4	Confident	88	Confident	33 Å²	33	70 Å²	70	15%	0.145	38%	0.381	C	S	.	.	H	α-helix	trans	-77.2	-42	175	-73.7	-73.7	0	0	0	112.2	M474 F475 V476 M481 L496 Y497 I500	M474-F478 WeakPolarHBondContact O-CD2 3.49Å; M474-F478 PolarHBondContact O-N 3.37Å; F475-F478 PolarHBondContact O-N 3.42Å; F475-F478 VanDerWaalsContact O-N 3.08Å; V476-F478 VanDerWaalsContact C-N 3.3Å; V476-F478 PolarHBondContact O-N 3.16Å; F478-M481 PolarHBondContact O-N 3.14Å; F478-L496 HydrophobicContact CD1-CB 4.41Å; F478-L496 HydrophobicContact CD1-CD1 3.7Å; F478-L496 HydrophobicContact CE1-CB 3.5Å; F478-L496 VanDerWaalsContact CE1-CB 3.5Å; F478-L496 HydrophobicContact CE1-CD1 3.65Å; F478-L496 HydrophobicContact CE1-CG 4.22Å; F478-L496 HydrophobicContact CE2-CB 4.45Å; F478-L496 HydrophobicContact CG-CD1 4.21Å; F478-L496 HydrophobicContact CZ-CB 3.51Å; F478-L496 HydrophobicContact CZ-CD1 4.08Å; F478-L496 HydrophobicContact CZ-CG 4.43Å; F478-Y497 HydrophobicContact CE1-CD2 4.36Å; F478-Y497 HydrophobicContact CE1-CE1 4.45Å; F478-Y497 HydrophobicContact CE1-CE2 4.1Å; F478-Y497 HydrophobicContact CZ-CD1 4.26Å; F478-Y497 HydrophobicContact CZ-CE1 4.1Å; F478-I500 HydrophobicContact CE2-CD1 3.86Å; F478-I500 HydrophobicContact CZ-CD1 3.94Å
479	A	88.6	Confident	87.9	Confident	37 Å²	37	74.9 Å²	74.9	31%	0.306	40%	0.4	S	S	.	.	H	α-helix	trans	-66.8	-39.1	-176.5	0	0	0	0	0	112.3	F475 V476 M481 E482	F475-A479 HydrophobicContact CD1-CB 4.45Å; F475-A479 HydrophobicContact CE1-CB 4.03Å; F475-A479 HydrophobicContact CZ-CB 4.2Å; F475-A479 WeakPolarHBondContact O-CB 3.46Å; F475-A479 PolarHBondContact O-N 3.23Å; V476-A479 PolarHBondContact O-N 2.96Å; A479-M481 PolarHBondContact O-N 3.37Å; A479-E482 WeakPolarHBondContact O-CB 3.38Å; A479-E482 PolarHBondContact O-N 3.46Å
480	E	86.9	Confident	87.9	Confident	84 Å²	84	77 Å²	77	39%	0.393	41%	0.414	S	S	.	.	G	3₁₀ helix	trans	-65.2	-21.9	177.9	-74.6	-172.6	170	0	0	113.1	H452 V453 V476	H452-E480 IonicContact CE1-OE2 3.34Å; H452-E480 PolarHBondContact CE1-OE2 3.42Å; H452-E480 IonicContact ND1-OE2 2.71Å; H452-E480 IonicContact NE2-OE2 3.43Å; H452-E480 PolarHBondContact NE2-OE2 3.11Å; V453-E480 WeakPolarHBondContact CG2-OE2 3.45Å; V476-E480 HydrophobicContact CG1-CG 4.47Å; V476-E480 PolarHBondContact O-N 2.94Å; V476-E480 VanDerWaalsContact O-N 3.08Å
481	M	83.6	Confident	88	Confident	1 Å²	1	75.3 Å²	75.3	1%	0.005	40%	0.401	C	S	.	.	G	3₁₀ helix	trans	-80.7	-13.9	178.9	-70.2	-56.9	-53.3	0	0	114.3	L448 H452 T477 F478 A479 Q483 S484 V488	L448-M481 HydrophobicContact CD2-CE 3.91Å; L448-M481 HydrophobicContact CD2-SD 4.41Å; H452-M481 HydrophobicContact CB-SD 3.76Å; H452-M481 VanDerWaalsContact CD2-SD 3.58Å; T477-M481 WeakPolarHBondContact O-CG 3.49Å; F478-M481 PolarHBondContact O-N 3.14Å; A479-M481 PolarHBondContact O-N 3.37Å; M481-Q483 PolarHBondContact O-N 3.31Å; M481-Q483 VanDerWaalsContact O-N 3.11Å; M481-S484 WeakPolarHBondContact CE-OG 3.38Å; M481-S484 WeakPolarHBondContact O-CB 3.49Å; M481-S484 PolarHBondContact O-N 3.19Å; M481-S484 VanDerWaalsContact O-N 3.11Å; M481-S484 PolarHBondContact O-OG 3.23Å; M481-V488 HydrophobicContact CE-CG1 3.85Å
482	E	74.4	Confident	88.1	Confident	152 Å²	152	73.8 Å²	73.8	71%	0.71	39%	0.385	S	S	*	.	G	3₁₀ helix	trans	-60.7	-24.2	-173.9	-166.9	174.7	-176.1	0	0	113.2	A479	A479-E482 WeakPolarHBondContact O-CB 3.38Å; A479-E482 PolarHBondContact O-N 3.46Å
483	Q	73.2	Confident	88.1	Confident	196 Å²	196	71 Å²	71	92%	0.916	37%	0.369	S	S	*	.	G	3₁₀ helix	trans	-88.8	3.5	-178.8	-60.4	-174.9	-4.3	0	0	114.4	M481	M481-Q483 PolarHBondContact O-N 3.31Å; M481-Q483 VanDerWaalsContact O-N 3.11Å
484	S	78.1	Confident	88.5	Confident	21 Å²	21	71.4 Å²	71.4	15%	0.147	38%	0.375	C	S	.	.	S	Bend	trans	-90.5	165.3	-177.6	66.9	0	0	0	0	113	M481	M481-S484 WeakPolarHBondContact CE-OG 3.38Å; M481-S484 WeakPolarHBondContact O-CB 3.49Å; M481-S484 PolarHBondContact O-N 3.19Å; M481-S484 VanDerWaalsContact O-N 3.11Å; M481-S484 PolarHBondContact O-OG 3.23Å
485	G	86.8	Confident	88.8	Confident	45 Å²	45	68.4 Å²	68.4	46%	0.464	36%	0.359	S	S	.	.			trans	-59.3	144	176.6	0	0	0	0	0	111.8	L487 V488 W489	G485-L487 VanDerWaalsContact C-N 3.26Å; G485-L487 PolarHBondContact O-N 3.4Å; G485-V488 WeakPolarHBondContact O-CA 3.31Å; G485-V488 PolarHBondContact O-N 3.13Å; G485-W489 PolarHBondContact O-N 3.21Å
486	T	88.4	Confident	89	Confident	113 Å²	113	60.8 Å²	60.8	69%	0.693	33%	0.326	S	S	*	.	H	α-helix	trans	-50.5	-40.7	-171.2	-49.2	0	0	0	0	113.9	W489 V490	T486-W489 PolarHBondContact O-N 2.81Å; T486-V490 WeakPolarHBondContact O-CG2 3.42Å; T486-V490 PolarHBondContact O-N 3.09Å
487	L	91.1	Very high	89.2	Confident	144 Å²	144	65 Å²	65	75%	0.754	34%	0.337	S	S	*	.	H	α-helix	trans	-63	-46.6	177.7	-171.8	159.2	0	0	0	111.7	G485 W489 V490 F491	G485-L487 VanDerWaalsContact C-N 3.26Å; G485-L487 PolarHBondContact O-N 3.4Å; L487-W489 VanDerWaalsContact C-N 3.35Å; L487-V490 PolarHBondContact O-N 2.96Å; L487-F491 WeakPolarHBondContact O-CB 3.04Å; L487-F491 PolarHBondContact O-N 3.44Å
488	V	92	Very high	89.5	Confident	19 Å²	19	67.5 Å²	67.5	12%	0.115	35%	0.352	C	S	.	.	H	α-helix	trans	-67.1	-39.9	179.1	-179.4	0	0	0	0	110.4	L448 Y451 M481 G485 F491 S492	L448-V488 HydrophobicContact CD2-CG1 4.47Å; Y451-V488 HydrophobicContact CD2-CG1 3.64Å; Y451-V488 HydrophobicContact CD2-CG2 4.41Å; Y451-V488 HydrophobicContact CE2-CB 4.47Å; Y451-V488 HydrophobicContact CE2-CG1 3.92Å; Y451-V488 HydrophobicContact CE2-CG2 3.84Å; Y451-V488 HydrophobicContact CG-CG1 4.13Å; M481-V488 HydrophobicContact CE-CG1 3.85Å; G485-V488 WeakPolarHBondContact O-CA 3.31Å; G485-V488 PolarHBondContact O-N 3.13Å; V488-F491 PolarHBondContact O-N 2.89Å; V488-S492 WeakPolarHBondContact O-CB 3.05Å; V488-S492 PolarHBondContact O-N 3.05Å; V488-S492 PolarHBondContact O-OG 2.97Å
489	W	92.8	Very high	89.9	Confident	103 Å²	103	65.9 Å²	65.9	39%	0.39	35%	0.345	S	S	.	.	H	α-helix	trans	-60.5	-52.4	174.8	178.1	82.3	0	0	0	111	G485 T486 L487 F491 S492 Q493	G485-W489 PolarHBondContact O-N 3.21Å; T486-W489 PolarHBondContact O-N 2.81Å; L487-W489 VanDerWaalsContact C-N 3.35Å; W489-F491 VanDerWaalsContact C-N 3.31Å; W489-F491 PolarHBondContact O-N 3.06Å; W489-S492 PolarHBondContact O-N 3.05Å; W489-S492 VanDerWaalsContact O-N 3.09Å; W489-S492 PolarHBondContact O-OG 3.23Å; W489-Q493 HydrophobicContact CD2-CG 4.21Å; W489-Q493 HydrophobicContact CH2-CG 4.35Å; W489-Q493 HydrophobicContact CZ2-CG 4Å; W489-Q493 WeakPolarHBondContact O-CG 3.47Å; W489-Q493 PolarHBondContact O-N 3.44Å
490	V	93.6	Very high	90.2	Very high	73 Å²	73	65.1 Å²	65.1	44%	0.442	34%	0.335	S	S	.	.	H	α-helix	trans	-58	-45	176.9	172.1	0	0	0	0	111.2	T486 L487 S492 Q493 V494	T486-V490 WeakPolarHBondContact O-CG2 3.42Å; T486-V490 PolarHBondContact O-N 3.09Å; L487-V490 PolarHBondContact O-N 2.96Å; V490-S492 VanDerWaalsContact C-N 3.31Å; V490-S492 PolarHBondContact O-N 2.89Å; V490-Q493 PolarHBondContact O-N 2.91Å; V490-V494 WeakPolarHBondContact O-CG2 3.41Å; V490-V494 PolarHBondContact O-N 2.64Å
491	F	94.8	Very high	90.5	Very high	73 Å²	73	63.6 Å²	63.6	32%	0.32	33%	0.334	S	S	.	.	H	α-helix	trans	-58.1	-44.6	176.3	-179.7	-88.9	0	0	0	111.6	V447 L448 L487 V488 W489 Q493 V494 Y495	V447-F491 HydrophobicContact CB-CD1 4.29Å; V447-F491 HydrophobicContact CB-CE1 3.79Å; V447-F491 HydrophobicContact CB-CZ 4.4Å; V447-F491 HydrophobicContact CG1-CD1 3.45Å; V447-F491 VanDerWaalsContact CG1-CD1 3.45Å; V447-F491 HydrophobicContact CG1-CE1 3.45Å; V447-F491 VanDerWaalsContact CG1-CE1 3.45Å; V447-F491 HydrophobicContact CG1-CG 4.21Å; V447-F491 HydrophobicContact CG1-CZ 4.2Å; V447-F491 HydrophobicContact CG2-CE1 4.06Å; V447-F491 HydrophobicContact CG2-CZ 4.16Å; L448-F491 HydrophobicContact CD2-CD1 4.32Å; L487-F491 WeakPolarHBondContact O-CB 3.04Å; L487-F491 PolarHBondContact O-N 3.44Å; V488-F491 PolarHBondContact O-N 2.89Å; W489-F491 VanDerWaalsContact C-N 3.31Å; W489-F491 PolarHBondContact O-N 3.06Å; F491-Q493 PolarHBondContact O-N 3.01Å; F491-V494 PolarHBondContact O-N 3.06Å; F491-Y495 HydrophobicContact CE1-CD2 4.19Å; F491-Y495 HydrophobicContact CE1-CG 4.37Å; F491-Y495 HydrophobicContact CZ-CD2 4.43Å; F491-Y495 WeakPolarHBondContact O-CB 3.25Å; F491-Y495 PolarHBondContact O-N 2.99Å
492	S	93.8	Very high	91.1	Very high	0 Å²	0	66 Å²	66	0%	0	35%	0.347	C	S	.	.	H	α-helix	trans	-64	-38.5	178.9	73.6	0	0	0	0	112.9	V488 W489 V490 Y495 L496	V488-S492 WeakPolarHBondContact O-CB 3.05Å; V488-S492 PolarHBondContact O-N 3.05Å; V488-S492 PolarHBondContact O-OG 2.97Å; W489-S492 PolarHBondContact O-N 3.05Å; W489-S492 VanDerWaalsContact O-N 3.09Å; W489-S492 PolarHBondContact O-OG 3.23Å; V490-S492 VanDerWaalsContact C-N 3.31Å; V490-S492 PolarHBondContact O-N 2.89Å; S492-Y495 PolarHBondContact O-N 3.46Å; S492-L496 WeakPolarHBondContact O-CB 3.26Å; S492-L496 VanDerWaalsContact O-CG 3.32Å; S492-L496 WeakPolarHBondContact O-CG 3.5Å; S492-L496 PolarHBondContact O-N 3.33Å
493	Q	93.7	Very high	92.1	Very high	29 Å²	29	58.9 Å²	58.9	14%	0.136	31%	0.314	C	S	.	.	H	α-helix	trans	-61.8	-51.7	175.3	-63.9	-55.4	-39.8	0	0	109.7	W489 V490 F491 Y495 L496 Y497	W489-Q493 HydrophobicContact CD2-CG 4.21Å; W489-Q493 HydrophobicContact CH2-CG 4.35Å; W489-Q493 HydrophobicContact CZ2-CG 4Å; W489-Q493 WeakPolarHBondContact O-CG 3.47Å; W489-Q493 PolarHBondContact O-N 3.44Å; V490-Q493 PolarHBondContact O-N 2.91Å; F491-Q493 PolarHBondContact O-N 3.01Å; Q493-Y495 VanDerWaalsContact C-N 3.34Å; Q493-Y495 PolarHBondContact O-N 3.28Å; Q493-L496 PolarHBondContact O-N 3.44Å; Q493-Y497 HydrophobicContact CB-CD2 4.22Å; Q493-Y497 HydrophobicContact CB-CE2 4.25Å; Q493-Y497 WeakPolarHBondContact O-CB 3.32Å; Q493-Y497 WeakPolarHBondContact O-CD2 3.42Å; Q493-Y497 PolarHBondContact O-N 2.9Å
494	V	95.7	Very high	93.1	Very high	85 Å²	85	51.2 Å²	51.2	52%	0.515	28%	0.279	S	S	.	.	H	α-helix	trans	-60.6	-45	178.2	175.5	0	0	0	0	111.1	V490 F491 T498	V490-V494 WeakPolarHBondContact O-CG2 3.41Å; V490-V494 PolarHBondContact O-N 2.64Å; F491-V494 PolarHBondContact O-N 3.06Å; V494-T498 HydrophobicContact CG1-CG2 4.17Å; V494-T498 VanDerWaalsContact O-CB 3.29Å; V494-T498 WeakPolarHBondContact O-CB 3.19Å; V494-T498 WeakPolarHBondContact O-CG2 3.12Å; V494-T498 PolarHBondContact O-N 3.39Å; V494-T498 PolarHBondContact O-OG1 3.4Å
495	Y	96.3	Very high	93.8	Very high	9 Å²	9	58 Å²	58	4%	0.035	30%	0.302	C	S	.	.	H	α-helix	trans	-59.1	-51.6	178.5	174.7	-86.5	0	0	0	111.8	Y440 C443 L448 F455 L465 F491 S492 Q493 T498 F499	Y440-Y495 VanDerWaalsContact C-OH 3.27Å; Y440-Y495 AromaticContact CD1-CD2 3.99Å; Y440-Y495 HydrophobicContact CD1-CD2 3.99Å; Y440-Y495 HydrophobicContact CD1-CE1 4.46Å; Y440-Y495 AromaticContact CD1-CE2 3.44Å; Y440-Y495 HydrophobicContact CD1-CE2 3.44Å; Y440-Y495 VanDerWaalsContact CD1-CE2 3.44Å; Y440-Y495 AromaticContact CD1-CZ 3.69Å; Y440-Y495 HydrophobicContact CE1-CD2 4.26Å; Y440-Y495 HydrophobicContact CE1-CE2 4.16Å; Y440-Y495 HydrophobicContact CG-CE2 4.32Å; Y440-Y495 PolarHBondContact O-OH 3.15Å; C443-Y495 HydrophobicContact CB-CE2 4.15Å; L448-Y495 HydrophobicContact CD1-CD1 3.79Å; L448-Y495 HydrophobicContact CD1-CE1 3.97Å; L448-Y495 HydrophobicContact CD1-CG 4.41Å; F455-Y495 HydrophobicContact CE1-CE1 4.21Å; F455-Y495 HydrophobicContact CZ-CE1 4.47Å; L465-Y495 HydrophobicContact CD2-CE1 4.25Å; F491-Y495 HydrophobicContact CE1-CD2 4.19Å; F491-Y495 HydrophobicContact CE1-CG 4.37Å; F491-Y495 HydrophobicContact CZ-CD2 4.43Å; F491-Y495 WeakPolarHBondContact O-CB 3.25Å; F491-Y495 PolarHBondContact O-N 2.99Å; S492-Y495 PolarHBondContact O-N 3.46Å; Q493-Y495 VanDerWaalsContact C-N 3.34Å; Q493-Y495 PolarHBondContact O-N 3.28Å; Y495-T498 PolarHBondContact O-OG1 2.93Å; Y495-F499 VanDerWaalsContact O-CB 3.26Å; Y495-F499 WeakPolarHBondContact O-CB 3.33Å; Y495-F499 PolarHBondContact O-N 2.88Å
496	L	95	Very high	94.1	Very high	2 Å²	2	61.3 Å²	61.3	1%	0.01	31%	0.307	C	S	.	.	H	α-helix	trans	-69.9	-44.2	-178.1	-69	174	0	0	0	111.7	F455 L468 F478 S492 Q493 T498 F499 I500	F455-L496 HydrophobicContact CZ-CD2 4.44Å; L468-L496 HydrophobicContact CD1-CD2 3.97Å; F478-L496 HydrophobicContact CD1-CB 4.41Å; F478-L496 HydrophobicContact CD1-CD1 3.7Å; F478-L496 HydrophobicContact CE1-CB 3.5Å; F478-L496 VanDerWaalsContact CE1-CB 3.5Å; F478-L496 HydrophobicContact CE1-CD1 3.65Å; F478-L496 HydrophobicContact CE1-CG 4.22Å; F478-L496 HydrophobicContact CE2-CB 4.45Å; F478-L496 HydrophobicContact CG-CD1 4.21Å; F478-L496 HydrophobicContact CZ-CB 3.51Å; F478-L496 HydrophobicContact CZ-CD1 4.08Å; F478-L496 HydrophobicContact CZ-CG 4.43Å; S492-L496 WeakPolarHBondContact O-CB 3.26Å; S492-L496 VanDerWaalsContact O-CG 3.32Å; S492-L496 WeakPolarHBondContact O-CG 3.5Å; S492-L496 PolarHBondContact O-N 3.33Å; Q493-L496 PolarHBondContact O-N 3.44Å; L496-T498 PolarHBondContact O-N 3.07Å; L496-F499 PolarHBondContact O-N 3Å; L496-I500 VanDerWaalsContact O-CB 3.32Å; L496-I500 WeakPolarHBondContact O-CB 3.43Å; L496-I500 WeakPolarHBondContact O-CD1 3.18Å; L496-I500 WeakPolarHBondContact O-CG1 3.39Å; L496-I500 PolarHBondContact O-N 3.36Å
497	Y	95.6	Very high	94.4	Very high	144 Å²	144	57 Å²	57	57%	0.565	28%	0.28	S	S	*	.	H	α-helix	trans	-63.3	-42.5	177.6	-77.7	-58.6	0	0	0	112.3	F478 Q493 S501	F478-Y497 HydrophobicContact CE1-CD2 4.36Å; F478-Y497 HydrophobicContact CE1-CE1 4.45Å; F478-Y497 HydrophobicContact CE1-CE2 4.1Å; F478-Y497 HydrophobicContact CZ-CD1 4.26Å; F478-Y497 HydrophobicContact CZ-CE1 4.1Å; Q493-Y497 HydrophobicContact CB-CD2 4.22Å; Q493-Y497 HydrophobicContact CB-CE2 4.25Å; Q493-Y497 WeakPolarHBondContact O-CB 3.32Å; Q493-Y497 WeakPolarHBondContact O-CD2 3.42Å; Q493-Y497 PolarHBondContact O-N 2.9Å; Y497-S501 VanDerWaalsContact O-CB 3.26Å; Y497-S501 WeakPolarHBondContact O-CB 3.34Å; Y497-S501 PolarHBondContact O-N 3.5Å; Y497-S501 PolarHBondContact O-OG 2.98Å
498	T	96.6	Very high	94.5	Very high	54 Å²	54	53.5 Å²	53.5	33%	0.331	26%	0.262	S	S	.	.	H	α-helix	trans	-66.3	-42.4	177	57.1	0	0	0	0	111.4	Y440 V494 Y495 L496 S501 L502	Y440-T498 PolarHBondContact OH-OG1 3.12Å; V494-T498 HydrophobicContact CG1-CG2 4.17Å; V494-T498 VanDerWaalsContact O-CB 3.29Å; V494-T498 WeakPolarHBondContact O-CB 3.19Å; V494-T498 WeakPolarHBondContact O-CG2 3.12Å; V494-T498 PolarHBondContact O-N 3.39Å; V494-T498 PolarHBondContact O-OG1 3.4Å; Y495-T498 PolarHBondContact O-OG1 2.93Å; L496-T498 PolarHBondContact O-N 3.07Å; T498-S501 PolarHBondContact O-OG 3.03Å; T498-L502 WeakPolarHBondContact O-CB 3.17Å; T498-L502 PolarHBondContact O-N 2.75Å
499	F	96.3	Very high	94.6	Very high	0 Å²	0	55.7 Å²	55.7	0%	0	28%	0.278	C	S	.	.	H	α-helix	trans	-61.3	-53.6	176.5	179.4	-99.8	0	0	0	112.1	Y437 Y440 L465 L468 I469 Y495 L496 S501 L502 F503	Y437-F499 HydrophobicContact CD2-CE2 4.17Å; Y437-F499 HydrophobicContact CD2-CZ 4.31Å; Y437-F499 HydrophobicContact CE2-CZ 4.29Å; Y440-F499 HydrophobicContact CD1-CB 3.86Å; Y440-F499 AromaticContact CD1-CD2 3.64Å; Y440-F499 HydrophobicContact CD1-CD2 3.64Å; Y440-F499 HydrophobicContact CD1-CG 4.16Å; Y440-F499 HydrophobicContact CD2-CD2 4.09Å; Y440-F499 HydrophobicContact CE1-CB 3.69Å; Y440-F499 HydrophobicContact CE1-CD2 4.13Å; Y440-F499 HydrophobicContact CE1-CG 4.41Å; Y440-F499 AromaticContact CG-CD2 3.64Å; Y440-F499 HydrophobicContact CG-CD2 3.64Å; Y440-F499 HydrophobicContact CG-CE2 4.32Å; L465-F499 HydrophobicContact CB-CE1 4.07Å; L465-F499 HydrophobicContact CB-CE2 4.32Å; L465-F499 HydrophobicContact CB-CZ 3.65Å; L465-F499 HydrophobicContact CD1-CE2 4.3Å; L465-F499 HydrophobicContact CD1-CZ 4.42Å; L465-F499 HydrophobicContact CD2-CD1 3.9Å; L465-F499 HydrophobicContact CD2-CD2 4.32Å; L465-F499 HydrophobicContact CD2-CE1 3.71Å; L465-F499 HydrophobicContact CD2-CE2 4.13Å; L465-F499 HydrophobicContact CD2-CG 4.2Å; L465-F499 HydrophobicContact CD2-CZ 3.84Å; L465-F499 HydrophobicContact CG-CE1 4.44Å; L465-F499 HydrophobicContact CG-CE2 4.49Å; L465-F499 HydrophobicContact CG-CZ 4.16Å; L465-F499 WeakPolarHBondContact O-CE1 3.46Å; L468-F499 HydrophobicContact CB-CE1 4.05Å; I469-F499 HydrophobicContact CD1-CZ 3.83Å; I469-F499 HydrophobicContact CG1-CE1 3.89Å; I469-F499 HydrophobicContact CG1-CZ 3.64Å; Y495-F499 VanDerWaalsContact O-CB 3.26Å; Y495-F499 WeakPolarHBondContact O-CB 3.33Å; Y495-F499 PolarHBondContact O-N 2.88Å; L496-F499 PolarHBondContact O-N 3Å; F499-S501 PolarHBondContact O-N 3.02Å; F499-L502 PolarHBondContact O-N 3.28Å; F499-F503 AromaticContact CD2-CD2 3.49Å; F499-F503 HydrophobicContact CD2-CD2 3.49Å; F499-F503 VanDerWaalsContact CD2-CD2 3.49Å; F499-F503 AromaticContact CD2-CE2 3.6Å; F499-F503 HydrophobicContact CD2-CE2 3.6Å; F499-F503 HydrophobicContact CD2-CG 4.36Å; F499-F503 HydrophobicContact CE2-CD1 4.42Å; F499-F503 AromaticContact CE2-CD2 3.42Å; F499-F503 HydrophobicContact CE2-CD2 3.42Å; F499-F503 VanDerWaalsContact CE2-CD2 3.42Å; F499-F503 HydrophobicContact CE2-CE1 4.43Å; F499-F503 AromaticContact CE2-CE2 3.45Å; F499-F503 HydrophobicContact CE2-CE2 3.45Å; F499-F503 VanDerWaalsContact CE2-CE2 3.45Å; F499-F503 AromaticContact CE2-CG 3.95Å; F499-F503 HydrophobicContact CE2-CG 3.95Å; F499-F503 AromaticContact CE2-CZ 3.99Å; F499-F503 HydrophobicContact CE2-CZ 3.99Å; F499-F503 HydrophobicContact CG-CD2 4.22Å; F499-F503 HydrophobicContact CZ-CD2 4.09Å; F499-F503 HydrophobicContact CZ-CE2 4.44Å; F499-F503 HydrophobicContact CZ-CG 4.19Å; F499-F503 WeakPolarHBondContact O-CB 3.34Å; F499-F503 WeakPolarHBondContact O-CD2 3.5Å; F499-F503 PolarHBondContact O-N 3.02Å
500	I	95.1	Very high	94.6	Very high	20 Å²	20	55.2 Å²	55.2	10%	0.103	28%	0.283	C	S	.	.	H	α-helix	trans	-61.6	-48.5	-177.1	-67.9	169.1	0	0	0	110.3	L468 F478 L496 L502 I504	L468-I500 HydrophobicContact CD2-CD1 4.48Å; F478-I500 HydrophobicContact CE2-CD1 3.86Å; F478-I500 HydrophobicContact CZ-CD1 3.94Å; L496-I500 VanDerWaalsContact O-CB 3.32Å; L496-I500 WeakPolarHBondContact O-CB 3.43Å; L496-I500 WeakPolarHBondContact O-CD1 3.18Å; L496-I500 WeakPolarHBondContact O-CG1 3.39Å; L496-I500 PolarHBondContact O-N 3.36Å; I500-L502 PolarHBondContact O-N 3.48Å; I500-I504 HydrophobicContact CG2-CD1 3.66Å; I500-I504 HydrophobicContact CG2-CG1 4.31Å; I500-I504 VanDerWaalsContact O-CB 3.23Å; I500-I504 WeakPolarHBondContact O-CB 3.23Å; I500-I504 WeakPolarHBondContact O-CG1 3.14Å; I500-I504 PolarHBondContact O-N 3.21Å
501	S	94.1	Very high	94.6	Very high	52 Å²	52	55.3 Å²	55.3	36%	0.364	28%	0.277	S	S	.	.	I	π-helix	trans	-64.2	-42.9	-179.3	58.2	0	0	0	0	112.6	Y497 T498 F499 Y505	Y497-S501 VanDerWaalsContact O-CB 3.26Å; Y497-S501 WeakPolarHBondContact O-CB 3.34Å; Y497-S501 PolarHBondContact O-N 3.5Å; Y497-S501 PolarHBondContact O-OG 2.98Å; T498-S501 PolarHBondContact O-OG 3.03Å; F499-S501 PolarHBondContact O-N 3.02Å; S501-Y505 WeakPolarHBondContact O-CB 3.39Å; S501-Y505 PolarHBondContact O-N 2.67Å
502	L	95.2	Very high	94.5	Very high	51 Å²	51	56.4 Å²	56.4	27%	0.267	29%	0.286	S	S	.	.	I	π-helix	trans	-65.9	-51.4	179	-178.6	66.9	0	0	0	111.5	I436 Y440 T498 F499 I500 M506 V507	I436-L502 HydrophobicContact CG2-CD2 4.16Å; Y440-L502 HydrophobicContact CE2-CD2 4.28Å; T498-L502 WeakPolarHBondContact O-CB 3.17Å; T498-L502 PolarHBondContact O-N 2.75Å; F499-L502 PolarHBondContact O-N 3.28Å; I500-L502 PolarHBondContact O-N 3.48Å; L502-M506 HydrophobicContact CD1-CB 4.48Å; L502-M506 HydrophobicContact CD1-SD 3.88Å; L502-M506 WeakPolarHBondContact O-CA 3.26Å; L502-M506 VanDerWaalsContact O-CB 3.28Å; L502-M506 WeakPolarHBondContact O-CB 3.26Å; L502-M506 PolarHBondContact O-N 2.94Å; L502-M506 VanDerWaalsContact O-N 3.13Å; L502-V507 PolarHBondContact O-N 3.42Å
503	F	95.6	Very high	94.4	Very high	4 Å²	4	59.1 Å²	59.1	2%	0.018	31%	0.308	C	S	.	.	I	π-helix	trans	-76.3	-40.7	-172.6	-83.1	-97.4	0	0	0	113.1	V433 I436 Y437 Y440 I469 F499 V507 L508	V433-F503 HydrophobicContact CG1-CD1 4.33Å; V433-F503 HydrophobicContact CG1-CE1 3.6Å; V433-F503 HydrophobicContact CG1-CZ 4.41Å; I436-F503 HydrophobicContact CB-CZ 4.4Å; I436-F503 HydrophobicContact CG2-CE2 4.04Å; I436-F503 HydrophobicContact CG2-CZ 4.03Å; Y437-F503 HydrophobicContact CD2-CE1 4.12Å; Y437-F503 HydrophobicContact CD2-CZ 4.27Å; Y440-F503 HydrophobicContact CD2-CE2 4.09Å; Y440-F503 HydrophobicContact CE2-CE2 4.27Å; I469-F503 HydrophobicContact CD1-CB 4.43Å; I469-F503 HydrophobicContact CD1-CD1 3.67Å; I469-F503 HydrophobicContact CD1-CE1 4.24Å; I469-F503 HydrophobicContact CD1-CG 4.24Å; I469-F503 HydrophobicContact CG1-CB 3.9Å; I469-F503 HydrophobicContact CG1-CD1 4.1Å; I469-F503 HydrophobicContact CG1-CG 4.2Å; F499-F503 AromaticContact CD2-CD2 3.49Å; F499-F503 HydrophobicContact CD2-CD2 3.49Å; F499-F503 VanDerWaalsContact CD2-CD2 3.49Å; F499-F503 AromaticContact CD2-CE2 3.6Å; F499-F503 HydrophobicContact CD2-CE2 3.6Å; F499-F503 HydrophobicContact CD2-CG 4.36Å; F499-F503 HydrophobicContact CE2-CD1 4.42Å; F499-F503 AromaticContact CE2-CD2 3.42Å; F499-F503 HydrophobicContact CE2-CD2 3.42Å; F499-F503 VanDerWaalsContact CE2-CD2 3.42Å; F499-F503 HydrophobicContact CE2-CE1 4.43Å; F499-F503 AromaticContact CE2-CE2 3.45Å; F499-F503 HydrophobicContact CE2-CE2 3.45Å; F499-F503 VanDerWaalsContact CE2-CE2 3.45Å; F499-F503 AromaticContact CE2-CG 3.95Å; F499-F503 HydrophobicContact CE2-CG 3.95Å; F499-F503 AromaticContact CE2-CZ 3.99Å; F499-F503 HydrophobicContact CE2-CZ 3.99Å; F499-F503 HydrophobicContact CG-CD2 4.22Å; F499-F503 HydrophobicContact CZ-CD2 4.09Å; F499-F503 HydrophobicContact CZ-CE2 4.44Å; F499-F503 HydrophobicContact CZ-CG 4.19Å; F499-F503 WeakPolarHBondContact O-CB 3.34Å; F499-F503 WeakPolarHBondContact O-CD2 3.5Å; F499-F503 PolarHBondContact O-N 3.02Å; F503-V507 HydrophobicContact CD1-CB 4.36Å; F503-V507 HydrophobicContact CD1-CG1 4.37Å; F503-V507 HydrophobicContact CD1-CG2 4.3Å; F503-V507 HydrophobicContact CG-CG2 4.49Å; F503-V507 WeakPolarHBondContact O-CB 3.46Å; F503-L508 PolarHBondContact O-N 2.99Å
504	I	93.8	Very high	94.4	Very high	35 Å²	35	61 Å²	61	18%	0.179	32%	0.318	C	S	.	.	I	π-helix	trans	-75.6	-49.4	-179.4	-58.6	-173.3	0	0	0	110.8	I500 L508	I500-I504 HydrophobicContact CG2-CD1 3.66Å; I500-I504 HydrophobicContact CG2-CG1 4.31Å; I500-I504 VanDerWaalsContact O-CB 3.23Å; I500-I504 WeakPolarHBondContact O-CB 3.23Å; I500-I504 WeakPolarHBondContact O-CG1 3.14Å; I500-I504 PolarHBondContact O-N 3.21Å; I504-L508 WeakPolarHBondContact O-CB 3.36Å
505	Y	93.4	Very high	94.3	Very high	163 Å²	163	59.8 Å²	59.8	64%	0.639	31%	0.308	S	S	*	.	I	π-helix	trans	-85.3	-35.2	-172	-56.6	-48.4	0	0	0	113.5	S501 S509	S501-Y505 WeakPolarHBondContact O-CB 3.39Å; S501-Y505 PolarHBondContact O-N 2.67Å; Y505-S509 WeakPolarHBondContact O-CB 3.29Å; Y505-S509 PolarHBondContact O-OG 3.41Å
506	M	93.9	Very high	94.1	Very high	115 Å²	115	62.5 Å²	62.5	57%	0.567	33%	0.326	S	S	*	.	I	π-helix	trans	-96.3	-58.4	-177.8	-52.4	-170.2	73.9	0	0	111.8	L502 S509 L510	L502-M506 HydrophobicContact CD1-CB 4.48Å; L502-M506 HydrophobicContact CD1-SD 3.88Å; L502-M506 WeakPolarHBondContact O-CA 3.26Å; L502-M506 VanDerWaalsContact O-CB 3.28Å; L502-M506 WeakPolarHBondContact O-CB 3.26Å; L502-M506 PolarHBondContact O-N 2.94Å; L502-M506 VanDerWaalsContact O-N 3.13Å; M506-S509 PolarHBondContact O-N 3.1Å; M506-L510 WeakPolarHBondContact O-CB 3.41Å; M506-L510 WeakPolarHBondContact O-CG 3.46Å; M506-L510 PolarHBondContact O-N 2.95Å
507	V	94.8	Very high	94	Very high	22 Å²	22	64 Å²	64	13%	0.133	34%	0.342	C	S	.	.	I	π-helix	trans	-66.7	-48.8	-171.9	176	0	0	0	0	111.8	F429 V433 L502 F503 S509 L510 F511	F429-V507 HydrophobicContact CE1-CG1 4.02Å; F429-V507 HydrophobicContact CZ-CG1 3.99Å; V433-V507 HydrophobicContact CB-CG1 4.33Å; V433-V507 HydrophobicContact CG1-CG1 3.71Å; V433-V507 HydrophobicContact CG2-CG1 3.59Å; V433-V507 HydrophobicContact CG2-CG2 4.43Å; L502-V507 PolarHBondContact O-N 3.42Å; F503-V507 HydrophobicContact CD1-CB 4.36Å; F503-V507 HydrophobicContact CD1-CG1 4.37Å; F503-V507 HydrophobicContact CD1-CG2 4.3Å; F503-V507 HydrophobicContact CG-CG2 4.49Å; F503-V507 WeakPolarHBondContact O-CB 3.46Å; V507-S509 PolarHBondContact O-N 3.18Å; V507-L510 PolarHBondContact O-N 3.49Å; V507-F511 WeakPolarHBondContact O-CB 3.24Å; V507-F511 PolarHBondContact O-N 3.3Å
508	L	93.3	Very high	93.7	Very high	71 Å²	71	57.7 Å²	57.7	37%	0.372	32%	0.32	S	S	.	.	H	α-helix	trans	-63.5	-41.7	179.6	-173.1	67.7	0	0	0	111.5	F503 I504 L510 F511 I512	F503-L508 PolarHBondContact O-N 2.99Å; I504-L508 WeakPolarHBondContact O-CB 3.36Å; L508-L510 PolarHBondContact O-N 2.91Å; L508-F511 WeakPolarHBondContact O-CB 3.3Å; L508-F511 PolarHBondContact O-N 3.22Å; L508-I512 HydrophobicContact CG-CD1 4.28Å; L508-I512 WeakPolarHBondContact O-CG1 3.47Å; L508-I512 PolarHBondContact O-N 3.45Å
509	S	92.9	Very high	93.4	Very high	65 Å²	65	59.7 Å²	59.7	46%	0.455	32%	0.322	S	S	.	.	H	α-helix	trans	-61.9	-41.8	176.1	-59.7	0	0	0	0	112.3	Y505 M506 V507 I512 A513	Y505-S509 WeakPolarHBondContact O-CB 3.29Å; Y505-S509 PolarHBondContact O-OG 3.41Å; M506-S509 PolarHBondContact O-N 3.1Å; V507-S509 PolarHBondContact O-N 3.18Å; S509-I512 PolarHBondContact O-N 3.04Å; S509-A513 WeakPolarHBondContact O-CB 3.19Å; S509-A513 PolarHBondContact O-N 2.86Å
510	L	93.6	Very high	93.1	Very high	93 Å²	93	64 Å²	64	49%	0.487	35%	0.345	S	S	.	.	H	α-helix	trans	-65.4	-39.1	174.4	-75.4	172.3	0	0	0	111.9	F429 M506 V507 L508 A513 L514	F429-L510 HydrophobicContact CE1-CB 4.44Å; F429-L510 HydrophobicContact CE2-CB 4.13Å; F429-L510 HydrophobicContact CE2-CD1 4.13Å; F429-L510 HydrophobicContact CZ-CB 3.71Å; F429-L510 HydrophobicContact CZ-CD1 4.23Å; M506-L510 WeakPolarHBondContact O-CB 3.41Å; M506-L510 WeakPolarHBondContact O-CG 3.46Å; M506-L510 PolarHBondContact O-N 2.95Å; V507-L510 PolarHBondContact O-N 3.49Å; L508-L510 PolarHBondContact O-N 2.91Å; L510-A513 PolarHBondContact O-N 3.39Å; L510-L514 WeakPolarHBondContact O-CG 3.39Å; L510-L514 PolarHBondContact O-N 3.44Å
511	F	92.8	Very high	92.8	Very high	74 Å²	74	66.8 Å²	66.8	33%	0.325	36%	0.363	S	S	.	.	H	α-helix	trans	-61	-45.8	176.2	-166	-88.2	0	0	0	111.5	V426 F429 V507 L508 L514 I515	V426-F511 HydrophobicContact CG1-CD2 4.47Å; V426-F511 HydrophobicContact CG1-CE2 3.45Å; V426-F511 VanDerWaalsContact CG1-CE2 3.45Å; V426-F511 HydrophobicContact CG1-CZ 3.6Å; F429-F511 AromaticContact CD1-CD2 3.99Å; F429-F511 HydrophobicContact CD1-CD2 3.99Å; F429-F511 HydrophobicContact CE1-CB 4.13Å; F429-F511 HydrophobicContact CE1-CD2 4.13Å; V507-F511 WeakPolarHBondContact O-CB 3.24Å; V507-F511 PolarHBondContact O-N 3.3Å; L508-F511 WeakPolarHBondContact O-CB 3.3Å; L508-F511 PolarHBondContact O-N 3.22Å; F511-L514 PolarHBondContact O-N 2.97Å; F511-I515 HydrophobicContact CD1-CD1 3.86Å; F511-I515 HydrophobicContact CE1-CD1 3.49Å; F511-I515 VanDerWaalsContact CE1-CD1 3.49Å; F511-I515 HydrophobicContact CZ-CD1 4.32Å; F511-I515 PolarHBondContact O-N 2.61Å
512	I	92.4	Very high	92.4	Very high	97 Å²	97	65.1 Å²	65.1	50%	0.497	35%	0.35	S	S	.	.	H	α-helix	trans	-62.6	-46.5	174.9	-65.9	167.6	0	0	0	110.2	L508 S509 L514 I515 T516	L508-I512 HydrophobicContact CG-CD1 4.28Å; L508-I512 WeakPolarHBondContact O-CG1 3.47Å; L508-I512 PolarHBondContact O-N 3.45Å; S509-I512 PolarHBondContact O-N 3.04Å; I512-L514 VanDerWaalsContact C-N 3.31Å; I512-L514 PolarHBondContact O-N 2.82Å; I512-I515 PolarHBondContact O-N 3.26Å; I512-T516 PolarHBondContact O-N 2.9Å; I512-T516 PolarHBondContact O-OG1 3.06Å
513	A	93.3	Very high	91.9	Very high	57 Å²	57	65.2 Å²	65.2	47%	0.471	35%	0.349	S	S	.	.	H	α-helix	trans	-60.7	-37.4	179.5	0	0	0	0	0	113	S509 L510 T516 G517	S509-A513 WeakPolarHBondContact O-CB 3.19Å; S509-A513 PolarHBondContact O-N 2.86Å; L510-A513 PolarHBondContact O-N 3.39Å; A513-T516 PolarHBondContact O-N 3.47Å; A513-G517 PolarHBondContact O-N 3.43Å
514	L	93.1	Very high	91.3	Very high	68 Å²	68	67.2 Å²	67.2	36%	0.356	37%	0.367	S	S	.	.	H	α-helix	trans	-64.1	-43.1	175.8	-77.3	171.2	0	0	0	112.2	F429 L510 F511 I512 A518	F429-L514 HydrophobicContact CB-CD1 3.76Å; F429-L514 HydrophobicContact CD1-CD1 3.95Å; F429-L514 HydrophobicContact CD2-CD1 4.15Å; F429-L514 HydrophobicContact CG-CD1 3.68Å; L510-L514 WeakPolarHBondContact O-CG 3.39Å; L510-L514 PolarHBondContact O-N 3.44Å; F511-L514 PolarHBondContact O-N 2.97Å; I512-L514 VanDerWaalsContact C-N 3.31Å; I512-L514 PolarHBondContact O-N 2.82Å; L514-A518 PolarHBondContact O-N 3.21Å; L514-A518 VanDerWaalsContact O-N 3.08Å
515	I	92.6	Very high	90.6	Very high	59 Å²	59	70.2 Å²	70.2	30%	0.303	38%	0.38	S	S	.	.	H	α-helix	trans	-69	-43.6	178	-65.1	175.5	0	0	0	110.3	V426 F511 I512 G517 A518 Y519	V426-I515 HydrophobicContact CG2-CG1 4.17Å; F511-I515 HydrophobicContact CD1-CD1 3.86Å; F511-I515 HydrophobicContact CE1-CD1 3.49Å; F511-I515 VanDerWaalsContact CE1-CD1 3.49Å; F511-I515 HydrophobicContact CZ-CD1 4.32Å; F511-I515 PolarHBondContact O-N 2.61Å; I512-I515 PolarHBondContact O-N 3.26Å; I515-G517 PolarHBondContact O-N 3.39Å; I515-A518 PolarHBondContact O-N 3.17Å; I515-Y519 PolarHBondContact O-N 3.49Å
516	T	92.8	Very high	89.6	Confident	66 Å²	66	66.5 Å²	66.5	41%	0.405	38%	0.375	S	S	.	.	H	α-helix	trans	-62.2	-42.3	176.5	-56.4	0	0	0	0	111.6	I512 A513 A518 Y519 D520	I512-T516 PolarHBondContact O-N 2.9Å; I512-T516 PolarHBondContact O-OG1 3.06Å; A513-T516 PolarHBondContact O-N 3.47Å; T516-A518 VanDerWaalsContact C-N 3.34Å; T516-A518 PolarHBondContact O-N 2.87Å; T516-Y519 WeakPolarHBondContact O-CA 3.49Å; T516-Y519 WeakPolarHBondContact O-CB 3.49Å; T516-Y519 PolarHBondContact O-N 3.33Å; T516-Y519 VanDerWaalsContact O-N 3.07Å; T516-D520 PolarHBondContact O-N 3.34Å
517	G	92.6	Very high	88.4	Confident	33 Å²	33	71.2 Å²	71.2	34%	0.34	39%	0.386	S	S	.	.	H	α-helix	trans	-63.2	-38.2	175.5	0	0	0	0	0	113.1	A513 I515 Y519 T521	A513-G517 PolarHBondContact O-N 3.43Å; I515-G517 PolarHBondContact O-N 3.39Å; G517-Y519 VanDerWaalsContact C-N 3.32Å; G517-T521 WeakPolarHBondContact O-CG2 3.35Å; G517-T521 PolarHBondContact O-N 3.32Å; G517-T521 VanDerWaalsContact O-N 3.08Å; G517-T521 PolarHBondContact O-OG1 3.44Å
518	A	89.9	Confident	86.7	Confident	13 Å²	13	77.3 Å²	77.3	11%	0.107	41%	0.413	C	S	.	.	H	α-helix	trans	-66.1	-34.8	172	0	0	0	0	0	112.1	T418 A422 L514 I515 T516 T521 I522	T418-A518 HydrophobicContact CG2-CB 4.35Å; A422-A518 HydrophobicContact CB-CB 3.66Å; L514-A518 PolarHBondContact O-N 3.21Å; L514-A518 VanDerWaalsContact O-N 3.08Å; I515-A518 PolarHBondContact O-N 3.17Å; T516-A518 VanDerWaalsContact C-N 3.34Å; T516-A518 PolarHBondContact O-N 2.87Å; A518-T521 WeakPolarHBondContact CA-OG1 3.19Å; A518-T521 PolarHBondContact O-OG1 2.93Å; A518-I522 VanDerWaalsContact O-CG1 3.29Å; A518-I522 WeakPolarHBondContact O-CG1 3.49Å; A518-I522 PolarHBondContact O-N 3.28Å
519	Y	90	Very high	84.7	Confident	95 Å²	95	83.4 Å²	83.4	37%	0.373	44%	0.44	S	S	.	.	H	α-helix	trans	-65.9	-48.9	175.2	178.2	-101.8	0	0	0	111.6	I414 T418 I515 T516 G517 T521 I522 M523	I414-Y519 HydrophobicContact CG2-CE2 4.3Å; T418-Y519 VanDerWaalsContact CG2-CA 3.46Å; T418-Y519 HydrophobicContact CG2-CD2 4.19Å; T418-Y519 HydrophobicContact CG2-CG 4.48Å; I515-Y519 PolarHBondContact O-N 3.49Å; T516-Y519 WeakPolarHBondContact O-CA 3.49Å; T516-Y519 WeakPolarHBondContact O-CB 3.49Å; T516-Y519 PolarHBondContact O-N 3.33Å; T516-Y519 VanDerWaalsContact O-N 3.07Å; G517-Y519 VanDerWaalsContact C-N 3.32Å; Y519-T521 VanDerWaalsContact C-N 3.35Å; Y519-T521 PolarHBondContact O-N 3.34Å; Y519-I522 PolarHBondContact O-N 3.41Å; Y519-M523 HydrophobicContact CD1-CG 4.2Å; Y519-M523 HydrophobicContact CD2-CG 4.34Å; Y519-M523 HydrophobicContact CE1-CG 3.78Å; Y519-M523 HydrophobicContact CE2-CG 3.92Å; Y519-M523 HydrophobicContact CE2-SD 4.41Å; Y519-M523 HydrophobicContact CG-CG 4.48Å; Y519-M523 WeakPolarHBondContact O-CB 3.47Å; Y519-M523 WeakPolarHBondContact O-CG 3.32Å; Y519-M523 PolarHBondContact O-N 3.38Å
520	D	90.1	Very high	82.9	Confident	92 Å²	92	85.1 Å²	85.1	49%	0.492	45%	0.447	S	S	.	.	H	α-helix	trans	-63.5	-39.9	-178.3	-69.2	-24.2	0	0	0	112	T516 M523 A524	T516-D520 PolarHBondContact O-N 3.34Å; D520-M523 PolarHBondContact O-N 3.08Å; D520-A524 WeakPolarHBondContact O-CB 3.34Å; D520-A524 PolarHBondContact O-N 3.41Å
521	T	88.5	Confident	80.9	Confident	77 Å²	77	85.5 Å²	85.5	47%	0.472	46%	0.455	S	S	.	.	H	α-helix	trans	-64	-45	176.1	48.1	0	0	0	0	112.5	G517 A518 Y519 A524 Q525	G517-T521 WeakPolarHBondContact O-CG2 3.35Å; G517-T521 PolarHBondContact O-N 3.32Å; G517-T521 VanDerWaalsContact O-N 3.08Å; G517-T521 PolarHBondContact O-OG1 3.44Å; A518-T521 WeakPolarHBondContact CA-OG1 3.19Å; A518-T521 PolarHBondContact O-OG1 2.93Å; Y519-T521 VanDerWaalsContact C-N 3.35Å; Y519-T521 PolarHBondContact O-N 3.34Å; T521-A524 PolarHBondContact O-N 2.66Å; T521-Q525 WeakPolarHBondContact O-CB 3.48Å; T521-Q525 VanDerWaalsContact O-CG 3.3Å; T521-Q525 WeakPolarHBondContact O-CG 3.49Å; T521-Q525 PolarHBondContact O-N 3.34Å
522	I	86.1	Confident	79.2	Confident	17 Å²	17	87 Å²	87	9%	0.087	46%	0.463	C	S	.	.	H	α-helix	trans	-66.6	-37.9	175.8	-65.3	-59.2	0	0	0	111.3	I414 V417 A421 A518 Y519 Q525 T526	I414-I522 HydrophobicContact CG2-CG2 4.19Å; V417-I522 HydrophobicContact CG1-CD1 3.91Å; V417-I522 HydrophobicContact CG1-CG1 4.35Å; V417-I522 HydrophobicContact CG1-CG2 4.12Å; A421-I522 HydrophobicContact CB-CD1 4.11Å; A421-I522 HydrophobicContact CB-CG1 4.25Å; A518-I522 VanDerWaalsContact O-CG1 3.29Å; A518-I522 WeakPolarHBondContact O-CG1 3.49Å; A518-I522 PolarHBondContact O-N 3.28Å; Y519-I522 PolarHBondContact O-N 3.41Å; I522-Q525 PolarHBondContact O-N 2.92Å; I522-T526 PolarHBondContact O-N 3.45Å; I522-T526 PolarHBondContact O-OG1 2.83Å
523	M	84.3	Confident	78.1	Confident	53 Å²	53	85 Å²	85	26%	0.261	46%	0.456	S	S	.	.	H	α-helix	trans	-64.8	-39.6	175.6	-79.4	-67.6	-76.8	0	0	112.3	I414 Y519 D520 T526 R527	I414-M523 HydrophobicContact CD1-SD 4.07Å; I414-M523 HydrophobicContact CG2-CG 4.38Å; I414-M523 HydrophobicContact CG2-SD 3.83Å; Y519-M523 HydrophobicContact CD1-CG 4.2Å; Y519-M523 HydrophobicContact CD2-CG 4.34Å; Y519-M523 HydrophobicContact CE1-CG 3.78Å; Y519-M523 HydrophobicContact CE2-CG 3.92Å; Y519-M523 HydrophobicContact CE2-SD 4.41Å; Y519-M523 HydrophobicContact CG-CG 4.48Å; Y519-M523 WeakPolarHBondContact O-CB 3.47Å; Y519-M523 WeakPolarHBondContact O-CG 3.32Å; Y519-M523 PolarHBondContact O-N 3.38Å; D520-M523 PolarHBondContact O-N 3.08Å; M523-T526 PolarHBondContact O-N 3.22Å; M523-R527 PolarHBondContact O-N 3Å
524	A	84.1	Confident	77	Confident	47 Å²	47	87.1 Å²	87.1	39%	0.388	46%	0.456	S	S	.	.	H	α-helix	trans	-65.7	-45.5	173.6	0	0	0	0	0	111.7	D520 T521 T526 R527 E528	D520-A524 WeakPolarHBondContact O-CB 3.34Å; D520-A524 PolarHBondContact O-N 3.41Å; T521-A524 PolarHBondContact O-N 2.66Å; A524-T526 PolarHBondContact O-N 2.94Å; A524-R527 WeakPolarHBondContact O-CA 3.37Å; A524-R527 WeakPolarHBondContact O-CB 3.32Å; A524-R527 PolarHBondContact O-N 2.71Å; A524-E528 PolarHBondContact O-N 3.21Å
525	Q	77.9	Confident	76.2	Confident	97 Å²	97	83.9 Å²	83.9	45%	0.453	44%	0.439	S	S	.	.	H	α-helix	trans	-64.2	-17.6	174.5	-73.7	178	-7.1	0	0	114.3	T521 I522 E528	T521-Q525 WeakPolarHBondContact O-CB 3.48Å; T521-Q525 VanDerWaalsContact O-CG 3.3Å; T521-Q525 WeakPolarHBondContact O-CG 3.49Å; T521-Q525 PolarHBondContact O-N 3.34Å; I522-Q525 PolarHBondContact O-N 2.92Å; Q525-E528 CarbonylContact C-O 3.6Å
526	T	72.1	Confident	75.4	Confident	85 Å²	85	84.2 Å²	84.2	52%	0.521	44%	0.439	S	S	.	.	H	α-helix	trans	-84.2	-22.3	172.8	-53.7	0	0	0	0	111.3	I414 I522 M523 A524	I414-T526 HydrophobicContact CD1-CG2 4.41Å; I522-T526 PolarHBondContact O-N 3.45Å; I522-T526 PolarHBondContact O-OG1 2.83Å; M523-T526 PolarHBondContact O-N 3.22Å; A524-T526 PolarHBondContact O-N 2.94Å
527	R	69.6	Low	74.6	Confident	215 Å²	215	82.3 Å²	82.3	81%	0.811	43%	0.43	S	S	*	.	H	α-helix	trans	-88.5	-33.6	177.2	-71.9	-178.7	177.6	178.8	0.8	112.7	M523 A524	M523-R527 PolarHBondContact O-N 3Å; A524-R527 WeakPolarHBondContact O-CA 3.37Å; A524-R527 WeakPolarHBondContact O-CB 3.32Å; A524-R527 PolarHBondContact O-N 2.71Å
528	E	59	Low	74	Confident	149 Å²	149	81.4 Å²	81.4	70%	0.696	42%	0.417	S	S	*	.	S	Bend	trans	-99.7	138.3	174.7	-65.2	179.5	174.9	0	0	109.3	A524 Q525 V530	A524-E528 PolarHBondContact O-N 3.21Å; Q525-E528 CarbonylContact C-O 3.6Å; E528-V530 PolarHBondContact O-N 3.12Å
529	Q	51.6	Low	73.4	Confident	200 Å²	200	81.6 Å²	81.6	94%	0.935	42%	0.416	S	S	*	.	P	Polyproline II helix	trans	-54.7	127.6	-178.1	-78	175.6	-25.2	0	0	111.1
530	V	55.5	Low	72.6	Confident	100 Å²	100	78.9 Å²	78.9	61%	0.606	41%	0.413	S	S	*	.	P	Polyproline II helix	trans	-53.8	136.1	-176.3	-179.2	0	0	0	0	110.7	E528 E532	E528-V530 PolarHBondContact O-N 3.12Å; V530-E532 PolarHBondContact O-N 3.14Å
531	P	49.7	Very low	71.8	Confident	102 Å²	102	80 Å²	80	66%	0.662	42%	0.415	S	S	*	.			trans	-63.8	106.4	165.1	24.7	-29.7	0	0	0	108.5	T533	P531-T533 PolarHBondContact O-N 3.31Å
532	E	59.2	Low	70.8	Confident	105 Å²	105	76.9 Å²	76.9	49%	0.491	40%	0.397	S	S	.	.			trans	-62.1	117.7	179.6	-66.3	-171.9	153.7	0	0	109.3	V530 A537	V530-E532 PolarHBondContact O-N 3.14Å; E532-A537 HydrophobicContact CB-CB 4.02Å; E532-A537 WeakPolarHBondContact OE2-CA 3.35Å
533	T	69.1	Low	69.9	Low	56 Å²	56	82 Å²	82	34%	0.344	43%	0.429	S	S	.	.			trans	-55.2	151.2	163.8	57.5	0	0	0	0	108.9	P531 L535 H536 A537	P531-T533 PolarHBondContact O-N 3.31Å; T533-L535 PolarHBondContact O-N 3.23Å; T533-H536 PolarHBondContact O-N 3.34Å; T533-H536 WeakPolarHBondContact OG1-CB 3.29Å; T533-H536 PolarHBondContact OG1-CD2 3.47Å; T533-H536 PolarHBondContact OG1-N 3.06Å; T533-A537 PolarHBondContact O-N 2.86Å
534	E	69.6	Low	69.1	Low	100 Å²	100	80 Å²	80	47%	0.467	42%	0.419	S	S	.	.	H	α-helix	trans	-53.5	-33.4	-179.9	-66.8	-168.4	150.7	0	0	112.8	R341 F538	R341-E534 IonicContact NH1-OE1 2.7Å; E534-F538 VanDerWaalsContact O-CB 3.27Å; E534-F538 WeakPolarHBondContact O-CB 3.45Å; E534-F538 PolarHBondContact O-N 3.09Å
535	L	76.6	Confident	68.1	Low	0 Å²	0	80.6 Å²	80.6	0%	0	42%	0.418	C	S	.	.	H	α-helix	trans	-62.7	-53.2	173	-179.7	65.5	0	0	0	112.5	F64 Y331 D347 F351 T533 A537 F538 I539	F64-L535 HydrophobicContact CE2-CD2 4.05Å; F64-L535 HydrophobicContact CZ-CD2 3.94Å; Y331-L535 HydrophobicContact CD2-CD1 4.32Å; Y331-L535 HydrophobicContact CE1-CD1 4.1Å; Y331-L535 HydrophobicContact CE2-CD1 3.65Å; D347-L535 HydrophobicContact CB-CB 4.49Å; F351-L535 HydrophobicContact CE2-CD1 4.26Å; F351-L535 HydrophobicContact CE2-CD2 4.05Å; F351-L535 HydrophobicContact CZ-CD1 3.91Å; F351-L535 HydrophobicContact CZ-CD2 4.27Å; T533-L535 PolarHBondContact O-N 3.23Å; L535-A537 VanDerWaalsContact C-N 3.35Å; L535-A537 PolarHBondContact O-N 3.42Å; L535-F538 WeakPolarHBondContact O-CB 3.14Å; L535-F538 PolarHBondContact O-N 2.79Å; L535-I539 HydrophobicContact CD1-CD1 4.12Å; L535-I539 HydrophobicContact CG-CD1 3.98Å; L535-I539 VanDerWaalsContact O-CG1 3.28Å; L535-I539 WeakPolarHBondContact O-CG1 3.06Å; L535-I539 PolarHBondContact O-N 3.43Å
536	H	76.3	Confident	67.3	Low	66 Å²	66	77.9 Å²	77.9	31%	0.306	41%	0.409	S	S	.	.	H	α-helix	trans	-64.8	-36.6	178.5	-73.7	-55.4	0	0	0	112.5	E350 T533 I539 A540	E350-H536 IonicContact OE1-CD2 3.7Å; E350-H536 IonicContact OE1-CE1 2.61Å; E350-H536 PolarHBondContact OE1-CE1 3.27Å; E350-H536 IonicContact OE1-NE2 3.35Å; E350-H536 PolarHBondContact OE1-NE2 2.98Å; E350-H536 IonicContact OE2-NE2 2.65Å; E350-H536 PolarHBondContact OE2-NE2 2.96Å; T533-H536 PolarHBondContact O-N 3.34Å; T533-H536 WeakPolarHBondContact OG1-CB 3.29Å; T533-H536 PolarHBondContact OG1-CD2 3.47Å; T533-H536 PolarHBondContact OG1-N 3.06Å; H536-I539 PolarHBondContact O-N 2.82Å; H536-A540 VanDerWaalsContact O-CB 3.26Å; H536-A540 WeakPolarHBondContact O-CB 3.05Å; H536-A540 PolarHBondContact O-N 3.41Å
537	A	75.8	Confident	66.7	Low	27 Å²	27	78.7 Å²	78.7	22%	0.223	42%	0.418	C	S	.	.	H	α-helix	trans	-63.2	-42.1	173.1	0	0	0	0	0	111.6	E532 T533 L535 A540 Q541	E532-A537 HydrophobicContact CB-CB 4.02Å; E532-A537 WeakPolarHBondContact OE2-CA 3.35Å; T533-A537 PolarHBondContact O-N 2.86Å; L535-A537 VanDerWaalsContact C-N 3.35Å; L535-A537 PolarHBondContact O-N 3.42Å; A537-A540 PolarHBondContact O-N 2.95Å; A537-Q541 WeakPolarHBondContact O-CG 3.33Å; A537-Q541 PolarHBondContact O-N 3.41Å
538	F	78.3	Confident	66.4	Low	13 Å²	13	70.7 Å²	70.7	6%	0.057	40%	0.395	C	S	.	.	H	α-helix	trans	-64.6	-38.2	175.2	-176.5	-103.4	0	0	0	112.5	E53 R57 L60 Y331 F334 F335 E534 L535	E53-F538 HydrophobicContact CG-CE2 4.11Å; E53-F538 HydrophobicContact CG-CZ 3.98Å; E53-F538 VanDerWaalsContact OE1-CE2 3.28Å; E53-F538 WeakPolarHBondContact OE1-CE2 3.46Å; R57-F538 HydrophobicContact CG-CD1 3.93Å; R57-F538 HydrophobicContact CG-CE1 3.44Å; R57-F538 VanDerWaalsContact CG-CE1 3.44Å; R57-F538 HydrophobicContact CG-CE2 4.23Å; R57-F538 HydrophobicContact CG-CG 4.49Å; R57-F538 HydrophobicContact CG-CZ 3.62Å; L60-F538 HydrophobicContact CD1-CD1 3.84Å; L60-F538 HydrophobicContact CD1-CE1 3.7Å; Y331-F538 HydrophobicContact CE2-CD1 4.24Å; Y331-F538 HydrophobicContact CE2-CE1 4.49Å; F334-F538 HydrophobicContact CE1-CE2 4.5Å; F334-F538 HydrophobicContact CE1-CZ 4.09Å; F335-F538 HydrophobicContact CE2-CD1 4.3Å; F335-F538 HydrophobicContact CE2-CD2 4.22Å; F335-F538 HydrophobicContact CE2-CE1 4.3Å; F335-F538 HydrophobicContact CE2-CE2 4.21Å; F335-F538 HydrophobicContact CE2-CG 4.26Å; F335-F538 HydrophobicContact CE2-CZ 4.26Å; F335-F538 HydrophobicContact CZ-CB 4.48Å; F335-F538 HydrophobicContact CZ-CD2 4.05Å; F335-F538 HydrophobicContact CZ-CE2 4.41Å; F335-F538 HydrophobicContact CZ-CG 4.15Å; E534-F538 VanDerWaalsContact O-CB 3.27Å; E534-F538 WeakPolarHBondContact O-CB 3.45Å; E534-F538 PolarHBondContact O-N 3.09Å; L535-F538 WeakPolarHBondContact O-CB 3.14Å; L535-F538 PolarHBondContact O-N 2.79Å
539	I	78.5	Confident	66.5	Low	17 Å²	17	65.2 Å²	65.2	9%	0.087	38%	0.378	C	S	.	.	H	α-helix	trans	-70.8	-38.6	175.9	-66.7	165.8	0	0	0	111.4	L60 K61 F64 L535 H536 Q541 C542	L60-I539 HydrophobicContact CB-CD1 4.17Å; L60-I539 HydrophobicContact CB-CG1 3.92Å; K61-I539 HydrophobicContact CB-CG2 3.91Å; K61-I539 HydrophobicContact CG-CG2 4.06Å; F64-I539 HydrophobicContact CD2-CD1 3.67Å; F64-I539 HydrophobicContact CE2-CD1 3.98Å; L535-I539 HydrophobicContact CD1-CD1 4.12Å; L535-I539 HydrophobicContact CG-CD1 3.98Å; L535-I539 VanDerWaalsContact O-CG1 3.28Å; L535-I539 WeakPolarHBondContact O-CG1 3.06Å; L535-I539 PolarHBondContact O-N 3.43Å; H536-I539 PolarHBondContact O-N 2.82Å; I539-Q541 PolarHBondContact O-N 2.88Å; I539-C542 WeakPolarHBondContact O-CB 3.42Å; I539-C542 PolarHBondContact O-N 3.1Å; I539-C542 VanDerWaalsContact O-N 3.08Å
540	A	72.4	Confident	67.1	Low	38 Å²	38	61.2 Å²	61.2	31%	0.314	36%	0.358	S	S	.	.	H	α-helix	trans	-64.2	-27.2	-177.7	0	0	0	0	0	113	H536 A537 C542	H536-A540 VanDerWaalsContact O-CB 3.26Å; H536-A540 WeakPolarHBondContact O-CB 3.05Å; H536-A540 PolarHBondContact O-N 3.41Å; A537-A540 PolarHBondContact O-N 2.95Å; A540-C542 PolarHBondContact O-N 3.4Å
541	Q	74.5	Confident	67.4	Low	115 Å²	115	57.1 Å²	57.1	54%	0.537	33%	0.332	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.3	-16.1	174.1	-69.9	175.6	18.8	0	0	113.4	R57 A537 I539 T543	R57-Q541 VanDerWaalsContact CZ-OE1 3.31Å; A537-Q541 WeakPolarHBondContact O-CG 3.33Å; A537-Q541 PolarHBondContact O-N 3.41Å; I539-Q541 PolarHBondContact O-N 2.88Å; Q541-T543 PolarHBondContact O-N 3.17Å
542	C	67.1	Low	67.8	Low	12 Å²	12	59.5 Å²	59.5	8%	0.081	33%	0.328	C	S	.	.			trans	-80.8	104.7	170.1	-175.5	0	0	0	0	110.6	R57 K61 I539 A540 D544	R57-C542 HydrophobicContact CB-CB 4.1Å; K61-C542 HydrophobicContact CD-CB 4.1Å; K61-C542 PolarHBondContact NZ-O 2.92Å; I539-C542 WeakPolarHBondContact O-CB 3.42Å; I539-C542 PolarHBondContact O-N 3.1Å; I539-C542 VanDerWaalsContact O-N 3.08Å; A540-C542 PolarHBondContact O-N 3.4Å; C542-D544 VanDerWaalsContact C-N 3.27Å; C542-D544 PolarHBondContact O-N 3.34Å
543	T	66.2	Low	67.3	Low	124 Å²	124	56.4 Å²	56.4	76%	0.761	32%	0.324	S	S	*	.			trans	-77.2	-6.9	-178.9	55.3	0	0	0	0	114.4	Q541 T545	Q541-T543 PolarHBondContact O-N 3.17Å; T543-T545 PolarHBondContact O-N 3.03Å
544	D	68.5	Low	65.9	Low	12 Å²	12	60.4 Å²	60.4	6%	0.064	35%	0.351	C	S	.	.			trans	-66.6	122.5	-174.8	-66.6	-33.8	0	0	0	111.9	R58 K61 C542 K550 F551	R58-D544 IonicContact CZ-OD2 3.61Å; R58-D544 IonicContact NE-OD2 3.86Å; R58-D544 PolarHBondContact NE-OD2 3.39Å; R58-D544 IonicContact NH2-OD2 2.64Å; R58-D544 PolarHBondContact NH2-OD2 3.46Å; R58-D544 VanDerWaalsContact NH2-OD2 3.14Å; K61-D544 PolarHBondContact NZ-O 3.18Å; C542-D544 VanDerWaalsContact C-N 3.27Å; C542-D544 PolarHBondContact O-N 3.34Å; D544-K550 VanDerWaalsContact CG-CD 3.49Å; D544-K550 WeakPolarHBondContact OD1-CD 3.46Å; D544-K550 WeakPolarHBondContact OD1-CE 3.5Å; D544-K550 IonicContact OD1-NZ 2.78Å; D544-K550 PolarHBondContact OD1-NZ 3.26Å; D544-F551 HydrophobicContact CB-CE2 4.12Å; D544-F551 HydrophobicContact CB-CZ 4.29Å
545	T	63.3	Low	64.3	Low	59 Å²	59	61.9 Å²	61.9	36%	0.362	36%	0.362	S	S	.	.			trans	-77.6	154.2	177.9	57.7	0	0	0	0	111.3	T543 S547 S548 F551	T543-T545 PolarHBondContact O-N 3.03Å; T545-S547 PolarHBondContact O-N 3.23Å; T545-S547 VanDerWaalsContact O-N 3.11Å; T545-S548 WeakPolarHBondContact O-CB 3.33Å; T545-S548 PolarHBondContact O-N 2.71Å; T545-S548 PolarHBondContact O-OG 3.28Å; T545-S548 PolarHBondContact OG1-N 3.23Å; T545-F551 WeakPolarHBondContact O-CE2 3.47Å
546	P	60.1	Low	62.2	Low	41 Å²	41	65.2 Å²	65.2	27%	0.266	40%	0.397	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.3	-32.6	177.6	-9.5	10.9	0	0	0	112.6	M65 A73	M65-P546 HydrophobicContact CE-CB 3.6Å; M65-P546 HydrophobicContact CE-CG 3.47Å; M65-P546 VanDerWaalsContact CE-CG 3.47Å; A73-P546 WeakPolarHBondContact CA-O 3.43Å; A73-P546 HydrophobicContact CB-CB 4.38Å; A73-P546 WeakPolarHBondContact CB-O 3.45Å
547	S	60.5	Low	60	Low	102 Å²	102	66.9 Å²	66.9	71%	0.713	42%	0.416	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.7	-2.5	178.7	50	0	0	0	0	115	T545 G549	T545-S547 PolarHBondContact O-N 3.23Å; T545-S547 VanDerWaalsContact O-N 3.11Å; S547-G549 PolarHBondContact O-N 3.39Å; S547-G549 VanDerWaalsContact O-N 3.08Å
548	S	62.6	Low	58.2	Low	46 Å²	46	71.9 Å²	71.9	32%	0.322	45%	0.449	S	S	.	.	S	Bend	trans	-67.3	-8.1	-173.2	64.6	0	0	0	0	115.3	T545 K550	T545-S548 WeakPolarHBondContact O-CB 3.33Å; T545-S548 PolarHBondContact O-N 2.71Å; T545-S548 PolarHBondContact O-OG 3.28Å; T545-S548 PolarHBondContact OG1-N 3.23Å; S548-K550 PolarHBondContact O-N 3.08Å
549	G	61.5	Low	55.9	Low	34 Å²	34	76 Å²	76	35%	0.351	48%	0.479	S	S	.	.	S	Bend	trans	74.1	-20.1	-178.2	0	0	0	0	0	114.8	S547 F551 R552	S547-G549 PolarHBondContact O-N 3.39Å; S547-G549 VanDerWaalsContact O-N 3.08Å; G549-F551 PolarHBondContact O-N 3.35Å; G549-R552 WeakPolarHBondContact O-CA 3.45Å; G549-R552 VanDerWaalsContact O-CB 3.28Å; G549-R552 WeakPolarHBondContact O-CB 3.32Å; G549-R552 PolarHBondContact O-N 2.98Å
550	K	64.5	Low	53.6	Low	116 Å²	116	80 Å²	80	50%	0.504	51%	0.508	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.4	-19.4	179.8	-69.5	179.1	177.2	-177.7	0	115	D544 S548 R552	D544-K550 VanDerWaalsContact CG-CD 3.49Å; D544-K550 WeakPolarHBondContact OD1-CD 3.46Å; D544-K550 WeakPolarHBondContact OD1-CE 3.5Å; D544-K550 IonicContact OD1-NZ 2.78Å; D544-K550 PolarHBondContact OD1-NZ 3.26Å; S548-K550 PolarHBondContact O-N 3.08Å; K550-R552 PolarHBondContact O-N 3.11Å
551	F	60.8	Low	51.8	Low	15 Å²	15	87.2 Å²	87.2	7%	0.066	53%	0.532	C	S	.	.	T	Hydrogen-bonded Turn	trans	-74.6	-13	171.4	-66.3	-79.5	0	0	0	113	R58 K61 A73 K74 D544 T545 G549 G553	R58-F551 HydrophobicContact CB-CE1 4.21Å; R58-F551 HydrophobicContact CG-CE1 4.39Å; K61-F551 HydrophobicContact CD-CZ 4.25Å; A73-F551 HydrophobicContact CB-CB 4.23Å; A73-F551 HydrophobicContact CB-CD2 4.38Å; A73-F551 HydrophobicContact CB-CG 4.39Å; K74-F551 WeakPolarHBondContact CE-O 3.42Å; D544-F551 HydrophobicContact CB-CE2 4.12Å; D544-F551 HydrophobicContact CB-CZ 4.29Å; T545-F551 WeakPolarHBondContact O-CE2 3.47Å; G549-F551 PolarHBondContact O-N 3.35Å; F551-G553 PolarHBondContact O-N 2.89Å
552	R	57.8	Low	49.7	Very low	151 Å²	151	89.5 Å²	89.5	57%	0.57	55%	0.548	S	S	*	.	S	Bend	trans	-93	79.3	167.1	-55.1	177.1	-176.2	-178.7	-2.5	106.9	A73 G549 K550	A73-R552 PolarHBondContact O-NE 2.71Å; G549-R552 WeakPolarHBondContact O-CA 3.45Å; G549-R552 VanDerWaalsContact O-CB 3.28Å; G549-R552 WeakPolarHBondContact O-CB 3.32Å; G549-R552 PolarHBondContact O-N 2.98Å; K550-R552 PolarHBondContact O-N 3.11Å
553	G	48.6	Very low	47.8	Very low	40 Å²	40	93.2 Å²	93.2	41%	0.412	57%	0.572	S	S	.	*			trans	-57	164.8	167.5	0	0	0	0	0	110.5	F551 D555	F551-G553 PolarHBondContact O-N 2.89Å; G553-D555 PolarHBondContact O-N 3.11Å
554	P	40	Very low	46.1	Very low	141 Å²	141	93.6 Å²	93.6	92%	0.916	58%	0.579	S	S	*	*			trans	-59.6	104.9	-179.7	25.7	-31.1	0	0	0	108.2	G556	P554-G556 PolarHBondContact O-N 2.9Å
555	D	36.6	Very low	44.2	Very low	131 Å²	131	98 Å²	98	70%	0.701	61%	0.61	S	S	*	*			trans	-61.5	110.7	177.9	-75.1	-42.4	0	0	0	107	G553 S557	G553-D555 PolarHBondContact O-N 3.11Å; D555-S557 PolarHBondContact O-N 3.43Å
556	G	33	Very low	42.5	Very low	70 Å²	70	103.5 Å²	103.5	72%	0.722	64%	0.636	S	S	*	*	S	Bend	trans	-55.9	109.2	160.4	0	0	0	0	0	107.9	P554	P554-G556 PolarHBondContact O-N 2.9Å
557	S	30.6	Very low	41.6	Very low	101 Å²	101	106.6 Å²	106.6	71%	0.706	66%	0.655	S	S	*	*	S	Bend	trans	49.3	121.4	169.7	57.5	0	0	0	0	117.6	D555 C559	D555-S557 PolarHBondContact O-N 3.43Å; S557-C559 PolarHBondContact O-N 3.39Å
558	S	36.8	Very low	40.6	Very low	132 Å²	132	106.8 Å²	106.8	92%	0.923	65%	0.652	S	S	*	*			trans	-41.5	111.1	163	-75.7	0	0	0	0	111.5
559	C	29.7	Very low	39.4	Very low	100 Å²	100	110.2 Å²	110.2	68%	0.676	67%	0.67	S	S	*	*			trans	-118.6	127.9	171	-126.3	0	0	0	0	109.2	S557	S557-C559 PolarHBondContact O-N 3.39Å
560	S	31.2	Very low	38.1	Very low	99 Å²	99	114.7 Å²	114.7	69%	0.692	69%	0.689	S	S	*	*			trans	-53.4	160.1	-167.7	-55.3	0	0	0	0	115	L562 C563	S560-L562 PolarHBondContact O-N 3.45Å; S560-C563 PolarHBondContact O-N 3.07Å; S560-C563 VanDerWaalsContact O-N 3.16Å
561	F	33.3	Very low	36.5	Very low	191 Å²	191	114.6 Å²	114.6	84%	0.838	70%	0.701	S	S	*	*	T	Hydrogen-bonded Turn	trans	-54.4	9.2	-177.4	-151.8	-100.5	0	0	0	116.6
562	L	30.3	Very low	34.9	Very low	163 Å²	163	121.3 Å²	121.3	85%	0.853	74%	0.743	S	S	*	*	T	Hydrogen-bonded Turn	trans	-135.2	5.2	-175.3	-100	140.7	0	0	0	115	S560 C564	S560-L562 PolarHBondContact O-N 3.45Å; L562-C564 PolarHBondContact O-N 2.92Å
563	C	28.3	Very low	33.2	Very low	89 Å²	89	119.1 Å²	119.1	60%	0.601	76%	0.755	S	S	*	*			trans	-90	97.3	176.8	-95.9	0	0	0	0	112.8	S560 C565	S560-C563 PolarHBondContact O-N 3.07Å; S560-C563 VanDerWaalsContact O-N 3.16Å; C563-C565 VanDerWaalsContact C-N 3.28Å; C563-C565 PolarHBondContact O-N 2.65Å
564	C	30.7	Very low	32	Very low	133 Å²	133	125.2 Å²	125.2	90%	0.899	78%	0.782	S	S	*	*			trans	-84.5	48.1	165.1	-77.1	0	0	0	0	112.8	L562	L562-C564 PolarHBondContact O-N 2.92Å
565	C	27.2	Very low	31.4	Very low	105 Å²	105	123.9 Å²	123.9	71%	0.709	77%	0.77	S	S	*	*			trans	-134.1	98.1	172.6	-69.3	0	0	0	0	110.1	C563	C563-C565 VanDerWaalsContact C-N 3.28Å; C563-C565 PolarHBondContact O-N 2.65Å
566	D	28.8	Very low	30.9	Very low	173 Å²	173	123.3 Å²	123.3	93%	0.925	78%	0.777	S	S	*	*			trans	163.8	0	138.4	-81.9	-15	0	0	0	113.2	R319 R323	R319-D566 PolarHBondContact NH1-OXT 3.35Å; R319-D566 PolarHBondContact NH2-O 3.45Å; R319-D566 PolarHBondContact NH2-OXT 3.39Å; R323-D566 PolarHBondContact NH2-O 2.91Å; R323-D566 VanDerWaalsContact NH2-O 3.1Å; R323-D566 PolarHBondContact NH2-OXT 2.92Å; R323-D566 VanDerWaalsContact NH2-OXT 3.16Å

Retrieved 566 of 566 residues in 438.4 ms (Link to these results)

U.S. Privacy Notice - Disclaimer / Registrations / Copyright Statement - Linking Policy - Notice of Privacy Practices (HIPAA) - Notice of Non‑Discrimination
© Copyright 2026 St. Jude Children's Research Hospital, a not-for-profit, section 501(c)(3).