A0A087XN91_POEFO Loading...

Ribosomal RNA-processing protein 8

Essential component of the eNoSC (energy-dependent nucleolar silencing) complex, a complex that mediates silencing of rDNA in response to intracellular energy status and acts by recruiting histone-modifying enzymes. The eNoSC complex is able to sense the energy status of cell: upon glucose starvation, elevation of NAD(+)/NADP(+) ratio activates SIRT1, leading to histone H3 deacetylation followed by dimethylation of H3 at 'Lys-9' (H3K9me2) by SUV39H1 and the formation of silent chromatin in the rDNA locus. In the complex, RRP8 binds to H3K9me2 and probably acts as a methyltransferase. Its substrates are however unknown. Probable methyltransferase required to silence rDNA.

AlphaFold DB , UniProt , Accession A0A087XN91, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 548 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	31.4	Very low	41.1	Very low	234 Å²	234	137.5 Å²	137.5	100%	1.153	67%	0.67	S	S	*	*				0	141.6	0	-77	135.3	143.4	0	0	108.1
2	F	33.1	Very low	41.6	Very low	198 Å²	198	136.8 Å²	136.8	87%	0.868	67%	0.665	S	S	*	*	P	Polyproline II helix	trans	-93.7	124.8	167.3	-71.1	-95.3	0	0	0	107.2
3	N	32.9	Very low	42.6	Very low	146 Å²	146	132.9 Å²	132.9	78%	0.781	65%	0.645	S	S	*	*	P	Polyproline II helix	trans	-94.1	154.4	159.8	-76.5	1.2	0	0	0	107.9
4	E	35.2	Very low	43.6	Very low	194 Å²	194	126.1 Å²	126.1	91%	0.907	63%	0.626	S	S	*	*	P	Polyproline II helix	trans	-74.4	135.1	-154	-62.4	171.4	119.7	0	0	113.9	E6	E4-E6 PolarHBondContact O-N 2.83Å
5	D	42.7	Very low	44.1	Very low	142 Å²	142	126.5 Å²	126.5	76%	0.759	62%	0.618	S	S	*	*			trans	-74.7	99.2	178.3	-62.4	-79.7	0	0	0	111.4	D7	D5-D7 PolarHBondContact O-N 3.2Å
6	E	42.5	Very low	45.2	Very low	162 Å²	162	125.6 Å²	125.6	76%	0.757	62%	0.615	S	S	*	*			trans	-70.6	69.7	154.2	-77.9	-156	142.4	0	0	109.6	E4 W8	E4-E6 PolarHBondContact O-N 2.83Å; E6-W8 VanDerWaalsContact O-CD1 3.3Å; E6-W8 PolarHBondContact O-N 2.74Å
7	D	43.5	Very low	45.6	Very low	111 Å²	111	123.9 Å²	123.9	59%	0.594	61%	0.609	S	S	*	*			trans	-70.3	122.7	173.9	-171.8	30.4	0	0	0	109.6	D5 S9	D5-D7 PolarHBondContact O-N 3.2Å; D7-S9 PolarHBondContact O-N 3.21Å; D7-S9 VanDerWaalsContact OD2-CB 3.25Å; D7-S9 WeakPolarHBondContact OD2-CB 3Å
8	W	48.3	Very low	46.1	Very low	108 Å²	108	120.1 Å²	120.1	41%	0.409	60%	0.596	S	S	.	*			trans	-78.5	53	-179.5	-80.3	60.8	0	0	0	111.1	E6 Q338 A342	E6-W8 VanDerWaalsContact O-CD1 3.3Å; E6-W8 PolarHBondContact O-N 2.74Å; W8-Q338 HydrophobicContact CH2-CB 4.38Å; W8-A342 HydrophobicContact CE3-CB 4.45Å; W8-A342 HydrophobicContact CH2-CB 4.48Å; W8-A342 HydrophobicContact CZ3-CB 3.72Å
9	S	44.1	Very low	46.8	Very low	39 Å²	39	121.4 Å²	121.4	27%	0.273	60%	0.598	S	S	.	*			trans	-104.6	98.7	-176.8	-179.2	0	0	0	0	109.9	D7 E11 Q12	D7-S9 PolarHBondContact O-N 3.21Å; D7-S9 VanDerWaalsContact OD2-CB 3.25Å; D7-S9 WeakPolarHBondContact OD2-CB 3Å; S9-E11 PolarHBondContact O-N 2.9Å; S9-Q12 PolarHBondContact O-N 3.13Å
10	D	50.7	Low	47.4	Very low	60 Å²	60	118.1 Å²	118.1	32%	0.321	59%	0.591	S	S	.	*	H	α-helix	trans	-54.8	-19.5	175.2	-77.8	-70.5	0	0	0	112.5	G14 R339	D10-G14 PolarHBondContact O-N 3.4Å; D10-R339 IonicContact OD1-CZ 2.84Å; D10-R339 IonicContact OD1-NH2 2.64Å; D10-R339 PolarHBondContact OD1-NH2 2.76Å
11	E	47.7	Very low	47.7	Very low	118 Å²	118	118 Å²	118	55%	0.551	59%	0.591	S	S	*	*	H	α-helix	trans	-67.7	-37.7	174.3	-179.6	164.2	-146.2	0	0	113.3	S9 R15	S9-E11 PolarHBondContact O-N 2.9Å; E11-R15 VanDerWaalsContact O-CD 3.24Å; E11-R15 WeakPolarHBondContact O-CD 3.27Å; E11-R15 WeakPolarHBondContact O-CG 3.23Å; E11-R15 PolarHBondContact O-N 2.81Å; E11-R15 IonicContact OE1-CZ 2.78Å; E11-R15 IonicContact OE1-NE 2.64Å; E11-R15 IonicContact OE1-NH2 2.65Å; E11-R15 PolarHBondContact OE1-NH2 3.06Å
12	Q	46.8	Very low	48.5	Very low	130 Å²	130	114 Å²	114	61%	0.607	57%	0.568	S	S	*	*	H	α-helix	trans	-70.3	-47.1	-178.3	-155.7	84.2	-44.6	0	0	110.2	S9 R15 I16	S9-Q12 PolarHBondContact O-N 3.13Å; Q12-R15 PolarHBondContact O-N 2.72Å; Q12-I16 WeakPolarHBondContact O-CG1 3.2Å; Q12-I16 PolarHBondContact O-N 3.31Å
13	E	55.3	Low	49.3	Very low	86 Å²	86	112.4 Å²	112.4	40%	0.402	56%	0.56	S	S	.	*	H	α-helix	trans	-71.2	-39.3	177.5	-69.6	-158.2	143.2	0	0	113.5	R15 I16 L17 R339	E13-R15 PolarHBondContact O-N 3.36Å; E13-I16 CarbonylContact O-C 3.58Å; E13-I16 WeakPolarHBondContact O-CA 3.39Å; E13-I16 WeakPolarHBondContact O-CB 3.46Å; E13-I16 PolarHBondContact O-N 2.89Å; E13-L17 PolarHBondContact O-N 2.98Å; E13-R339 IonicContact OE2-CZ 3.11Å; E13-R339 IonicContact OE2-NH1 2.62Å; E13-R339 PolarHBondContact OE2-NH1 3.25Å; E13-R339 IonicContact OE2-NH2 3.68Å; E13-R339 PolarHBondContact OE2-NH2 2.92Å; E13-R339 VanDerWaalsContact OE2-NH2 3.13Å
14	G	55.6	Low	50	Low	37 Å²	37	113.8 Å²	113.8	38%	0.381	56%	0.559	S	S	.	*	H	α-helix	trans	-58.2	-33.4	176.5	0	0	0	0	0	112.2	D10 S18	D10-G14 PolarHBondContact O-N 3.4Å; G14-S18 WeakPolarHBondContact O-CB 3.16Å; G14-S18 PolarHBondContact O-N 3.32Å; G14-S18 VanDerWaalsContact O-N 3.12Å; G14-S18 PolarHBondContact O-OG 2.82Å
15	R	52.1	Low	50.3	Low	133 Å²	133	107.7 Å²	107.7	50%	0.502	54%	0.538	S	S	.	.	H	α-helix	trans	-73.1	-26.2	172	-68.7	167.3	179.9	-149.2	2.7	113.5	E11 Q12 E13 S18 K19	E11-R15 VanDerWaalsContact O-CD 3.24Å; E11-R15 WeakPolarHBondContact O-CD 3.27Å; E11-R15 WeakPolarHBondContact O-CG 3.23Å; E11-R15 PolarHBondContact O-N 2.81Å; E11-R15 IonicContact OE1-CZ 2.78Å; E11-R15 IonicContact OE1-NE 2.64Å; E11-R15 IonicContact OE1-NH2 2.65Å; E11-R15 PolarHBondContact OE1-NH2 3.06Å; Q12-R15 PolarHBondContact O-N 2.72Å; E13-R15 PolarHBondContact O-N 3.36Å; R15-S18 WeakPolarHBondContact CA-OG 3.42Å; R15-S18 PolarHBondContact O-OG 2.72Å; R15-K19 WeakPolarHBondContact O-CB 3.35Å; R15-K19 VanDerWaalsContact O-CD 3.3Å; R15-K19 WeakPolarHBondContact O-CD 3.39Å; R15-K19 WeakPolarHBondContact O-CG 3.46Å; R15-K19 PolarHBondContact O-N 2.75Å
16	I	62.1	Low	50.5	Low	111 Å²	111	109 Å²	109	57%	0.569	54%	0.539	S	S	*	.	H	α-helix	trans	-79.1	-48.6	175.2	-67	166.5	0	0	0	110.3	Q12 E13 S18 K19 A20	Q12-I16 WeakPolarHBondContact O-CG1 3.2Å; Q12-I16 PolarHBondContact O-N 3.31Å; E13-I16 CarbonylContact O-C 3.58Å; E13-I16 WeakPolarHBondContact O-CA 3.39Å; E13-I16 WeakPolarHBondContact O-CB 3.46Å; E13-I16 PolarHBondContact O-N 2.89Å; I16-S18 PolarHBondContact O-N 2.91Å; I16-K19 PolarHBondContact O-N 3.45Å; I16-A20 WeakPolarHBondContact O-CB 3.15Å; I16-A20 PolarHBondContact O-N 2.87Å
17	L	51.8	Low	50.6	Low	98 Å²	98	110.9 Å²	110.9	51%	0.513	55%	0.545	S	S	.	.	H	α-helix	trans	-58.6	-47.3	177.4	-84	158.2	0	0	0	112	E13 K19 A20 I21	E13-L17 PolarHBondContact O-N 2.98Å; L17-K19 PolarHBondContact O-N 3Å; L17-A20 PolarHBondContact O-N 2.73Å; L17-I21 WeakPolarHBondContact O-CG1 3.28Å; L17-I21 PolarHBondContact O-N 2.91Å
18	S	54.1	Low	50.9	Low	54 Å²	54	109.2 Å²	109.2	38%	0.378	55%	0.547	S	S	.	.	H	α-helix	trans	-61.5	-44.1	175.5	51.5	0	0	0	0	112.4	G14 R15 I16 A20 I21 F22	G14-S18 WeakPolarHBondContact O-CB 3.16Å; G14-S18 PolarHBondContact O-N 3.32Å; G14-S18 VanDerWaalsContact O-N 3.12Å; G14-S18 PolarHBondContact O-OG 2.82Å; R15-S18 WeakPolarHBondContact CA-OG 3.42Å; R15-S18 PolarHBondContact O-OG 2.72Å; I16-S18 PolarHBondContact O-N 2.91Å; S18-A20 VanDerWaalsContact C-N 3.33Å; S18-A20 PolarHBondContact O-N 3.02Å; S18-I21 PolarHBondContact O-N 3.41Å; S18-F22 WeakPolarHBondContact O-CD2 3.04Å; S18-F22 PolarHBondContact O-N 2.83Å
19	K	58.8	Low	50.3	Low	145 Å²	145	109.9 Å²	109.9	63%	0.63	56%	0.558	S	S	*	*	H	α-helix	trans	-61.3	-37.5	174	-77.6	173.9	-176.2	178.1	0	112.9	R15 I16 L17 K23	R15-K19 WeakPolarHBondContact O-CB 3.35Å; R15-K19 VanDerWaalsContact O-CD 3.3Å; R15-K19 WeakPolarHBondContact O-CD 3.39Å; R15-K19 WeakPolarHBondContact O-CG 3.46Å; R15-K19 PolarHBondContact O-N 2.75Å; I16-K19 PolarHBondContact O-N 3.45Å; L17-K19 PolarHBondContact O-N 3Å; K19-K23 WeakPolarHBondContact O-CB 3.39Å; K19-K23 PolarHBondContact O-N 3.09Å
20	A	59.2	Low	50.1	Low	55 Å²	55	116 Å²	116	46%	0.455	59%	0.586	S	S	.	*	H	α-helix	trans	-66.3	-42.4	177.2	0	0	0	0	0	111.9	I16 L17 S18 K23 K24	I16-A20 WeakPolarHBondContact O-CB 3.15Å; I16-A20 PolarHBondContact O-N 2.87Å; L17-A20 PolarHBondContact O-N 2.73Å; S18-A20 VanDerWaalsContact C-N 3.33Å; S18-A20 PolarHBondContact O-N 3.02Å; A20-K23 PolarHBondContact O-N 3.09Å; A20-K24 PolarHBondContact O-N 2.84Å
21	I	54.9	Low	49.7	Very low	118 Å²	118	118.1 Å²	118.1	61%	0.605	61%	0.606	S	S	*	*	H	α-helix	trans	-62.4	-46.5	175.1	-66.7	164.7	0	0	0	110.7	L17 S18 K23 K24 S25	L17-I21 WeakPolarHBondContact O-CG1 3.28Å; L17-I21 PolarHBondContact O-N 2.91Å; S18-I21 PolarHBondContact O-N 3.41Å; I21-K23 PolarHBondContact O-N 2.85Å; I21-K24 PolarHBondContact O-N 3.39Å; I21-S25 PolarHBondContact O-N 3.48Å; I21-S25 VanDerWaalsContact O-N 3.09Å
22	F	47.8	Very low	49.3	Very low	150 Å²	150	118.6 Å²	118.6	66%	0.658	62%	0.617	S	S	*	*	H	α-helix	trans	-61.2	-42.2	175.5	-93.6	-88.9	0	0	0	112.8	S18 K24 S25 Q26	S18-F22 WeakPolarHBondContact O-CD2 3.04Å; S18-F22 PolarHBondContact O-N 2.83Å; F22-K24 PolarHBondContact O-N 3.25Å; F22-S25 WeakPolarHBondContact O-CB 3.2Å; F22-S25 PolarHBondContact O-N 2.9Å; F22-Q26 PolarHBondContact O-N 3.3Å
23	K	48.8	Very low	49.1	Very low	164 Å²	164	119.9 Å²	119.9	71%	0.713	62%	0.623	S	S	*	*	H	α-helix	trans	-64.7	-34	175.8	-81.6	-170.2	172.7	-172.3	0	113.4	K19 A20 I21	K19-K23 WeakPolarHBondContact O-CB 3.39Å; K19-K23 PolarHBondContact O-N 3.09Å; A20-K23 PolarHBondContact O-N 3.09Å; I21-K23 PolarHBondContact O-N 2.85Å
24	K	47.3	Very low	48.1	Very low	175 Å²	175	123.7 Å²	123.7	76%	0.761	65%	0.645	S	S	*	*	H	α-helix	trans	-67	-40.7	172.9	-110.4	-176.3	176.3	-178.3	0	111.7	A20 I21 F22 Q26 K27	A20-K24 PolarHBondContact O-N 2.84Å; I21-K24 PolarHBondContact O-N 3.39Å; F22-K24 PolarHBondContact O-N 3.25Å; K24-Q26 VanDerWaalsContact C-N 3.33Å; K24-Q26 PolarHBondContact O-N 2.74Å; K24-K27 PolarHBondContact O-N 3.47Å
25	S	43.1	Very low	47.5	Very low	65 Å²	65	130.3 Å²	130.3	46%	0.455	66%	0.663	S	S	.	*	H	α-helix	trans	-61.8	-36.2	178.3	-167.1	0	0	0	0	113.4	I21 F22 K27 A28 N29	I21-S25 PolarHBondContact O-N 3.48Å; I21-S25 VanDerWaalsContact O-N 3.09Å; F22-S25 WeakPolarHBondContact O-CB 3.2Å; F22-S25 PolarHBondContact O-N 2.9Å; S25-K27 VanDerWaalsContact C-N 3.31Å; S25-K27 PolarHBondContact O-N 2.9Å; S25-A28 PolarHBondContact O-N 3.06Å; S25-N29 PolarHBondContact O-ND2 2.95Å; S25-N29 VanDerWaalsContact O-ND2 3.1Å
26	Q	45.7	Very low	47	Very low	170 Å²	170	129.5 Å²	129.5	79%	0.794	68%	0.678	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.2	-11.3	178.4	-73.7	-165	-50	0	0	115.3	F22 K24	F22-Q26 PolarHBondContact O-N 3.3Å; K24-Q26 VanDerWaalsContact C-N 3.33Å; K24-Q26 PolarHBondContact O-N 2.74Å
27	K	45.5	Very low	46.1	Very low	202 Å²	202	129.3 Å²	129.3	88%	0.878	69%	0.687	S	S	*	*	T	Hydrogen-bonded Turn	trans	-98.5	1	173.8	-92.7	-162.4	171.8	-167.4	0	114.5	K24 S25	K24-K27 PolarHBondContact O-N 3.47Å; S25-K27 VanDerWaalsContact C-N 3.31Å; S25-K27 PolarHBondContact O-N 2.9Å
28	A	50.1	Low	46	Very low	76 Å²	76	130.2 Å²	130.2	63%	0.628	70%	0.696	S	S	*	*			trans	-143.4	76.5	-178.9	0	0	0	0	0	111.5	S25	S25-A28 PolarHBondContact O-N 3.06Å
29	N	34.4	Very low	46	Very low	121 Å²	121	129.6 Å²	129.6	65%	0.647	70%	0.698	S	S	*	*			trans	-147.4	76.7	168.9	-94.7	-73.6	0	0	0	111.2	S25	S25-N29 PolarHBondContact O-ND2 2.95Å; S25-N29 VanDerWaalsContact O-ND2 3.1Å
30	I	41.5	Very low	46	Very low	167 Å²	167	131.5 Å²	131.5	86%	0.856	71%	0.706	S	S	*	*	S	Bend	trans	-78	142.7	137.3	-69.5	176.9	0	0	0	105.9	T32	I30-T32 PolarHBondContact O-N 3.26Å
31	S	42.2	Very low	46.1	Very low	106 Å²	106	137.7 Å²	137.7	74%	0.741	72%	0.723	S	S	*	*	S	Bend	trans	-52.8	127.4	-169.5	-176.6	0	0	0	0	114.5
32	T	38	Very low	46.4	Very low	127 Å²	127	135.3 Å²	135.3	78%	0.779	72%	0.717	S	S	*	*			trans	-160.1	145.3	137	5.7	0	0	0	0	110.9	I30	I30-T32 PolarHBondContact O-N 3.26Å
33	H	42.5	Very low	46.8	Very low	157 Å²	157	133.2 Å²	133.2	73%	0.727	71%	0.712	S	S	*	*			trans	-107.2	90.1	-157.5	-165.2	-88.6	0	0	0	112.7
34	L	34.6	Very low	47.3	Very low	167 Å²	167	130.2 Å²	130.2	87%	0.874	70%	0.703	S	S	*	*			trans	-117.3	116.1	178.9	-74.5	174.7	0	0	0	113.1
35	K	43.2	Very low	48.3	Very low	175 Å²	175	130.5 Å²	130.5	76%	0.761	70%	0.699	S	S	*	*			trans	-89.4	109.3	174.5	-65.4	177.4	180	175.3	0	110.3	S37	K35-S37 PolarHBondContact O-N 2.77Å
36	S	41.5	Very low	49.4	Very low	117 Å²	117	131.2 Å²	131.2	82%	0.818	70%	0.701	S	S	*	*			trans	-93.1	59.6	177.3	51.2	0	0	0	0	113.3	V38	S36-V38 PolarHBondContact O-N 2.99Å
37	S	42.8	Very low	50.1	Low	107 Å²	107	128 Å²	128	75%	0.748	69%	0.689	S	S	*	*			trans	-72.4	109.5	165.2	47.4	0	0	0	0	109.8	K35 G39	K35-S37 PolarHBondContact O-N 2.77Å; S37-G39 VanDerWaalsContact C-N 3.28Å; S37-G39 PolarHBondContact O-N 3.4Å
38	V	49.1	Very low	51	Low	116 Å²	116	125.6 Å²	125.6	70%	0.703	68%	0.681	S	S	*	*			trans	-69.5	88.3	173.5	-177.2	0	0	0	0	108.6	S36	S36-V38 PolarHBondContact O-N 2.99Å
39	G	55.7	Low	51.5	Low	41 Å²	41	127.3 Å²	127.3	42%	0.423	68%	0.684	S	S	.	*			trans	-61.6	146.4	-178.4	0	0	0	0	0	111.9	S37 K41 S42	S37-G39 VanDerWaalsContact C-N 3.28Å; S37-G39 PolarHBondContact O-N 3.4Å; G39-K41 PolarHBondContact O-N 3.49Å; G39-S42 WeakPolarHBondContact O-CB 3.27Å; G39-S42 PolarHBondContact O-N 3.36Å
40	K	57.4	Low	52.4	Low	185 Å²	185	128.1 Å²	128.1	80%	0.804	69%	0.687	S	S	*	*	H	α-helix	trans	-48.2	-32.6	-176.2	-61.7	-178.1	179.8	-178.5	0	113.9	S42 L43 L44	K40-S42 VanDerWaalsContact C-N 3.32Å; K40-S42 PolarHBondContact O-N 3Å; K40-L43 PolarHBondContact O-N 3.34Å; K40-L44 WeakPolarHBondContact O-CG 3.23Å; K40-L44 PolarHBondContact O-N 2.85Å
41	K	61.3	Low	52.6	Low	185 Å²	185	122.6 Å²	122.6	80%	0.804	67%	0.672	S	S	*	*	H	α-helix	trans	-60.6	-33.5	176	-60.1	-172.8	179.3	-173.4	0	113.8	G39 R45	G39-K41 PolarHBondContact O-N 3.49Å; K41-R45 WeakPolarHBondContact O-CB 3.4Å; K41-R45 PolarHBondContact O-N 2.95Å
42	S	62.9	Low	52.9	Low	68 Å²	68	123.4 Å²	123.4	48%	0.476	68%	0.677	S	S	.	*	H	α-helix	trans	-68.2	-42.3	175.2	-164.1	0	0	0	0	111.2	G39 K40 R45 T46	G39-S42 WeakPolarHBondContact O-CB 3.27Å; G39-S42 PolarHBondContact O-N 3.36Å; K40-S42 VanDerWaalsContact C-N 3.32Å; K40-S42 PolarHBondContact O-N 3Å; S42-R45 PolarHBondContact O-N 3.13Å; S42-T46 PolarHBondContact O-N 3.17Å; S42-T46 PolarHBondContact O-OG1 2.89Å
43	L	55.8	Low	53.4	Low	106 Å²	106	123.4 Å²	123.4	56%	0.555	68%	0.677	S	S	*	*	H	α-helix	trans	-71.4	-38.9	-179.2	-152.1	157.3	0	0	0	111.5	K40 T46 L47	K40-L43 PolarHBondContact O-N 3.34Å; L43-T46 PolarHBondContact O-N 3.45Å; L43-L47 HydrophobicContact CD2-CD1 3.96Å; L43-L47 PolarHBondContact O-N 2.86Å
44	L	58.9	Low	53.4	Low	102 Å²	102	120.1 Å²	120.1	53%	0.534	67%	0.67	S	S	.	*	H	α-helix	trans	-59.6	-44.4	169.2	-74	167.6	0	0	0	111.8	K40 T46 L47 E48	K40-L44 WeakPolarHBondContact O-CG 3.23Å; K40-L44 PolarHBondContact O-N 2.85Å; L44-T46 VanDerWaalsContact C-N 3.3Å; L44-T46 PolarHBondContact O-N 2.81Å; L44-L47 CarbonylContact O-C 3.59Å; L44-L47 WeakPolarHBondContact O-CA 3.49Å; L44-L47 WeakPolarHBondContact O-CB 3.41Å; L44-L47 PolarHBondContact O-N 2.85Å; L44-E48 WeakPolarHBondContact O-CG 3.3Å; L44-E48 PolarHBondContact O-N 3.43Å
45	R	67.4	Low	53.4	Low	180 Å²	180	118.6 Å²	118.6	68%	0.679	66%	0.662	S	S	*	*	H	α-helix	trans	-63.5	-35	177.3	-159.4	-177.6	-161.8	-175.5	4.6	113	K41 S42 E48 T49	K41-R45 WeakPolarHBondContact O-CB 3.4Å; K41-R45 PolarHBondContact O-N 2.95Å; S42-R45 PolarHBondContact O-N 3.13Å; R45-E48 WeakPolarHBondContact CA-OE2 3.36Å; R45-T49 WeakPolarHBondContact O-CB 3.47Å; R45-T49 PolarHBondContact O-N 3.21Å; R45-T49 PolarHBondContact O-OG1 3.46Å
46	T	67.9	Low	53.3	Low	80 Å²	80	121.2 Å²	121.2	49%	0.491	67%	0.668	S	S	.	*	H	α-helix	trans	-66.1	-39.3	171.7	-55.2	0	0	0	0	111.5	S42 L43 L44 T49 L50	S42-T46 PolarHBondContact O-N 3.17Å; S42-T46 PolarHBondContact O-OG1 2.89Å; L43-T46 PolarHBondContact O-N 3.45Å; L44-T46 VanDerWaalsContact C-N 3.3Å; L44-T46 PolarHBondContact O-N 2.81Å; T46-T49 PolarHBondContact O-N 3.18Å; T46-L50 HydrophobicContact CG2-CD1 4.45Å; T46-L50 WeakPolarHBondContact O-CG 3.48Å; T46-L50 PolarHBondContact O-N 2.72Å
47	L	58.5	Low	52.9	Low	102 Å²	102	125.5 Å²	125.5	53%	0.534	67%	0.666	S	S	.	*	H	α-helix	trans	-64.5	-44.5	173.7	-77.3	159.8	0	0	0	112	L43 L44 T49 L50 G51	L43-L47 HydrophobicContact CD2-CD1 3.96Å; L43-L47 PolarHBondContact O-N 2.86Å; L44-L47 CarbonylContact O-C 3.59Å; L44-L47 WeakPolarHBondContact O-CA 3.49Å; L44-L47 WeakPolarHBondContact O-CB 3.41Å; L44-L47 PolarHBondContact O-N 2.85Å; L47-T49 PolarHBondContact O-N 3.19Å; L47-L50 PolarHBondContact O-N 2.89Å; L47-L50 VanDerWaalsContact O-N 3.13Å; L47-G51 PolarHBondContact O-N 2.62Å
48	E	64.7	Low	52.9	Low	152 Å²	152	126.1 Å²	126.1	71%	0.71	67%	0.67	S	S	*	*	H	α-helix	trans	-57.4	-35.6	172.6	-69.2	172.4	144	0	0	112	L44 R45 L50	L44-E48 WeakPolarHBondContact O-CG 3.3Å; L44-E48 PolarHBondContact O-N 3.43Å; R45-E48 WeakPolarHBondContact CA-OE2 3.36Å; E48-L50 VanDerWaalsContact C-N 3.34Å
49	T	60.4	Low	51.9	Low	113 Å²	113	124.4 Å²	124.4	69%	0.693	68%	0.676	S	S	*	*	H	α-helix	trans	-74.9	-21.6	179.9	-52.7	0	0	0	0	113.2	R45 T46 L47	R45-T49 WeakPolarHBondContact O-CB 3.47Å; R45-T49 PolarHBondContact O-N 3.21Å; R45-T49 PolarHBondContact O-OG1 3.46Å; T46-T49 PolarHBondContact O-N 3.18Å; L47-T49 PolarHBondContact O-N 3.19Å
50	L	54.2	Low	50.7	Low	138 Å²	138	129.8 Å²	129.8	72%	0.723	70%	0.695	S	S	*	*	H	α-helix	trans	-86.1	-12.7	178.8	-72.2	169	0	0	0	113.3	T46 L47 E48	T46-L50 HydrophobicContact CG2-CD1 4.45Å; T46-L50 WeakPolarHBondContact O-CG 3.48Å; T46-L50 PolarHBondContact O-N 2.72Å; L47-L50 PolarHBondContact O-N 2.89Å; L47-L50 VanDerWaalsContact O-N 3.13Å; E48-L50 VanDerWaalsContact C-N 3.34Å
51	G	44.8	Very low	49.8	Very low	51 Å²	51	128.6 Å²	128.6	53%	0.526	69%	0.692	S	S	.	*			trans	75.3	161.2	-178.5	0	0	0	0	0	113.9	L47	L47-G51 PolarHBondContact O-N 2.62Å
52	S	49.6	Very low	48.3	Very low	122 Å²	122	129.1 Å²	129.1	85%	0.853	70%	0.697	S	S	*	*	P	Polyproline II helix	trans	-72.1	135.6	173	-61.4	0	0	0	0	110.6
53	T	47.8	Very low	47	Very low	127 Å²	127	134.3 Å²	134.3	78%	0.779	71%	0.714	S	S	*	*	P	Polyproline II helix	trans	-57.2	135.4	164.6	47	0	0	0	0	109.8	D55	T53-D55 PolarHBondContact O-N 3.34Å
54	P	43	Very low	45.7	Very low	88 Å²	88	137.3 Å²	137.3	57%	0.571	73%	0.731	S	S	*	*	P	Polyproline II helix	trans	-60	127.9	178.4	-22.3	32.4	0	0	0	111.6	W56	P54-W56 HydrophobicContact CB-CZ2 4.1Å; P54-W56 HydrophobicContact CG-CZ2 4.5Å; P54-W56 PolarHBondContact O-N 3.02Å
55	D	34.7	Very low	44.6	Very low	135 Å²	135	137.8 Å²	137.8	72%	0.722	74%	0.742	S	S	*	*			trans	-83.6	95.2	175.7	-170.3	8.6	0	0	0	109.1	T53 R57	T53-D55 PolarHBondContact O-N 3.34Å; D55-R57 VanDerWaalsContact C-N 3.26Å; D55-R57 PolarHBondContact O-N 2.92Å
56	W	41.5	Very low	42.8	Very low	230 Å²	230	133.2 Å²	133.2	87%	0.871	75%	0.751	S	S	*	*			trans	-77.4	73.2	-175.7	-66.9	106.3	0	0	0	112	P54	P54-W56 HydrophobicContact CB-CZ2 4.1Å; P54-W56 HydrophobicContact CG-CZ2 4.5Å; P54-W56 PolarHBondContact O-N 3.02Å
57	R	33.4	Very low	41.1	Very low	208 Å²	208	134.5 Å²	134.5	79%	0.785	76%	0.763	S	S	*	*			trans	-109.1	121.8	164.8	-72.7	-176.2	173.6	-89.5	-0.5	110.5	D55	D55-R57 VanDerWaalsContact C-N 3.26Å; D55-R57 PolarHBondContact O-N 2.92Å
58	S	41.1	Very low	39.9	Very low	120 Å²	120	139.2 Å²	139.2	84%	0.839	78%	0.783	S	S	*	*			trans	24.8	103.7	160.8	-53.7	0	0	0	0	118.4
59	G	28.8	Very low	38.3	Very low	79 Å²	79	137.5 Å²	137.5	81%	0.814	78%	0.783	S	S	*	*			trans	-111	137	146.9	0	0	0	0	0	108.4
60	D	31.4	Very low	36.8	Very low	154 Å²	154	140.1 Å²	140.1	82%	0.824	79%	0.787	S	S	*	*			trans	-86.6	178.7	-169.2	-84.1	-66.1	0	0	0	114.4
61	H	37.3	Very low	35.8	Very low	160 Å²	160	139.3 Å²	139.3	74%	0.741	79%	0.787	S	S	*	*			trans	-42.6	134.7	170.4	-91.8	-93	0	0	0	114.1
62	E	30.4	Very low	36	Very low	196 Å²	196	142.1 Å²	142.1	92%	0.916	80%	0.797	S	S	*	*				-122.3	143	124.1	-70.5	-162.9	124.8	0	0	109.1
63	Q	36.3	Very low	35.9	Very low	178 Å²	178	142.4 Å²	142.4	83%	0.832	80%	0.796	S	S	*	*			trans	-98.2	142.3	164.2	-59.7	-179.5	-81.8	0	0	106.7
64	D	27.7	Very low	35	Very low	169 Å²	169	142 Å²	142	90%	0.904	80%	0.798	S	S	*	*			trans	-133.7	148.6	161.1	-147	-18.3	0	0	0	110.9
65	S	36.8	Very low	34.5	Very low	112 Å²	112	143.9 Å²	143.9	78%	0.783	81%	0.808	S	S	*	*			trans	-136	85.5	-163.9	-151.9	0	0	0	0	110.9
66	G	27.9	Very low	34.3	Very low	84 Å²	84	143.2 Å²	143.2	87%	0.866	81%	0.814	S	S	*	*			trans	-90	108.7	176.8	0	0	0	0	0	112.1
67	S	32.8	Very low	33.8	Very low	106 Å²	106	141.1 Å²	141.1	74%	0.741	81%	0.811	S	S	*	*			trans	-103.4	132.5	171.5	60.4	0	0	0	0	111.7
68	E	33	Very low	33.7	Very low	202 Å²	202	140.3 Å²	140.3	94%	0.944	82%	0.816	S	S	*	*			trans	-123.2	152.1	165.5	-67.8	-162.8	127.1	0	0	111.3
69	T	30.9	Very low	33.2	Very low	116 Å²	116	144.1 Å²	144.1	71%	0.712	82%	0.817	S	S	*	*			trans	-136.6	135.2	-174.1	-39.2	0	0	0	0	105.6
70	E	29.1	Very low	33.2	Very low	167 Å²	167	150.3 Å²	150.3	78%	0.78	82%	0.822	S	S	*	*				-171.6	118.8	91.9	-86.2	-108.4	107.4	0	0	112.9
71	V	34.1	Very low	33.2	Very low	121 Å²	121	154.7 Å²	154.7	73%	0.733	83%	0.827	S	S	*	*			trans	49.5	143.7	139.1	-85.3	0	0	0	0	126.5
72	P	48.7	Very low	33	Very low	111 Å²	111	156.7 Å²	156.7	72%	0.721	83%	0.833	S	S	*	*			trans	-131.4	162	-169.8	44.5	-28	0	0	0	118
73	P	47.3	Very low	33	Very low	128 Å²	128	156.4 Å²	156.4	83%	0.831	83%	0.829	S	S	*	*			trans	-99.9	159.2	149.3	35.9	-27.2	0	0	0	111.5
74	S	29.9	Very low	32.7	Very low	118 Å²	118	158.6 Å²	158.6	83%	0.825	83%	0.83	S	S	*	*			cis	-144.1	174.4	-3.7	70.6	0	0	0	0	112.2
75	T	30.7	Very low	32.9	Very low	127 Å²	127	162 Å²	162	78%	0.779	83%	0.83	S	S	*	*			trans	-71.3	146.7	-164.3	53.2	0	0	0	0	118.1
76	S	31.6	Very low	32.5	Very low	121 Å²	121	166.7 Å²	166.7	85%	0.846	84%	0.836	S	S	*	*				-152.4	163	121.6	71.1	0	0	0	0	111.8
77	K	30.5	Very low	32.6	Very low	187 Å²	187	170.5 Å²	170.5	81%	0.813	83%	0.831	S	S	*	*			trans	-131.6	138.5	-173.7	-61.1	170.1	-178.3	169.2	0	110.4
78	Q	31.5	Very low	32.3	Very low	191 Å²	191	175.1 Å²	175.1	89%	0.893	83%	0.832	S	S	*	*			trans	-166.2	115.6	131.1	-110	173.1	70.7	0	0	117.8
79	K	29.8	Very low	32.3	Very low	200 Å²	200	171.5 Å²	171.5	87%	0.87	82%	0.815	S	S	*	*			trans	15.6	123	145.6	-62.3	175.6	179.4	174.6	0	121.2
80	K	30.2	Very low	32.3	Very low	208 Å²	208	173.9 Å²	173.9	90%	0.904	82%	0.819	S	S	*	*			trans	-65	151.9	153.5	-62.2	170.2	179.3	169.9	0	111.7
81	R	30.8	Very low	32.4	Very low	246 Å²	246	170.4 Å²	170.4	93%	0.928	81%	0.812	S	S	*	*			trans	-130.8	139.1	155.1	-79.5	179.4	71.8	157.8	-2.3	111.3
82	K	32.3	Very low	32.4	Very low	202 Å²	202	172.4 Å²	172.4	88%	0.878	81%	0.814	S	S	*	*			trans	-113.7	177.3	168.5	-86.9	-173.7	174.3	-178.8	0	109
83	K	31.1	Very low	31.6	Very low	190 Å²	190	175.2 Å²	175.2	83%	0.826	82%	0.817	S	S	*	*			trans	87.4	143.1	176.1	-65.7	-174.8	178.2	178.3	0	114.8
84	R	29.7	Very low	30.8	Very low	225 Å²	225	173.8 Å²	173.8	85%	0.849	81%	0.807	S	S	*	*			cis	-162.9	162.8	-22.2	-129.3	168.5	68.6	166.4	-1.4	109.2
85	R	32.2	Very low	30.9	Very low	240 Å²	240	177.2 Å²	177.2	91%	0.906	81%	0.81	S	S	*	*			trans	-59.5	152.9	167.2	-67.5	175.8	172.3	167.5	-5.6	112.1
86	K	29.4	Very low	30.7	Very low	211 Å²	211	174.8 Å²	174.8	92%	0.917	81%	0.81	S	S	*	*			trans	-131.2	163.5	151.9	-151.9	-179.7	179.2	-170.3	0	108.8
87	H	28.5	Very low	30.5	Very low	164 Å²	164	173.3 Å²	173.3	76%	0.759	81%	0.813	S	S	*	*			trans	-136.5	-173.8	-172.9	-159.4	-97.3	0	0	0	108.9
88	R	26.9	Very low	30.4	Very low	203 Å²	203	167.5 Å²	167.5	77%	0.766	81%	0.806	S	S	*	*			trans	101.5	108.2	171.4	-152.6	152.8	-143.3	-148	-10.8	113.4
89	E	32.5	Very low	30.4	Very low	125 Å²	125	165.8 Å²	165.8	58%	0.584	80%	0.803	S	S	*	*				60.6	150.1	83.8	-54.4	148.7	-143	0	0	114
90	Q	31.4	Very low	30.7	Very low	167 Å²	167	162.3 Å²	162.3	78%	0.78	79%	0.794	S	S	*	*			cis	-175.3	166.8	-29.7	-172.3	162.9	-6.2	0	0	106.7
91	S	31.6	Very low	30.7	Very low	93 Å²	93	156.7 Å²	156.7	65%	0.65	78%	0.78	S	S	*	*			trans	62.5	156.9	164.8	27.2	0	0	0	0	118.5
92	E	33.4	Very low	30.9	Very low	164 Å²	164	152.2 Å²	152.2	77%	0.766	77%	0.77	S	S	*	*			cis	-164.4	160.2	-16.5	-114	154	-171.8	0	0	110.3
93	E	33	Very low	30.7	Very low	170 Å²	170	147.8 Å²	147.8	79%	0.794	76%	0.76	S	S	*	*			trans	57.2	151.7	145.6	-61.9	-109.5	155.3	0	0	122.3
94	T	29.9	Very low	30.8	Very low	98 Å²	98	145.6 Å²	145.6	60%	0.601	76%	0.756	S	S	*	*			cis	-166.5	173	-20	-78.5	0	0	0	0	109.2
95	Q	32.4	Very low	30.9	Very low	190 Å²	190	141.8 Å²	141.8	89%	0.888	75%	0.745	S	S	*	*			trans	88.1	137.9	167.1	-50.9	-172	-6.8	0	0	117.9
96	G	26.1	Very low	30.9	Very low	76 Å²	76	137.3 Å²	137.3	78%	0.784	74%	0.735	S	S	*	*			cis	173.1	163.2	-8.8	0	0	0	0	0	115.3
97	G	27.1	Very low	31	Very low	89 Å²	89	136.1 Å²	136.1	92%	0.918	73%	0.732	S	S	*	*			trans	82.5	139.3	171.2	0	0	0	0	0	116.3
98	G	29.2	Very low	31	Very low	65 Å²	65	137.3 Å²	137.3	67%	0.67	74%	0.735	S	S	*	*			cis	178.2	149.7	-8.7	0	0	0	0	0	112.5
99	D	31.4	Very low	32	Very low	155 Å²	155	132.6 Å²	132.6	83%	0.829	73%	0.731	S	S	*	*			trans	54.5	145.7	150.2	-45.1	-12.8	0	0	0	120
100	D	35.2	Very low	31.7	Very low	127 Å²	127	135 Å²	135	68%	0.679	74%	0.742	S	S	*	*			cis	-158.2	143.1	-7.5	-121.6	-0.3	0	0	0	108.3
101	C	29.9	Very low	31.6	Very low	91 Å²	91	134.2 Å²	134.2	62%	0.615	74%	0.743	S	S	*	*				71.1	150.5	81.9	-69.7	0	0	0	0	115.8
102	Q	34.7	Very low	31.4	Very low	151 Å²	151	138.9 Å²	138.9	71%	0.706	75%	0.751	S	S	*	*			cis	-166	150.4	2.7	-126.9	169.9	60.2	0	0	115
103	T	29.3	Very low	31.3	Very low	110 Å²	110	140.5 Å²	140.5	68%	0.675	76%	0.756	S	S	*	*			trans	43.5	174.4	141.3	49	0	0	0	0	122
104	I	32	Very low	31	Very low	143 Å²	143	140.7 Å²	140.7	73%	0.733	75%	0.754	S	S	*	*			cis	-159.7	118.7	48.6	-80.7	-178.3	0	0	0	109.1
105	K	33.5	Very low	30.9	Very low	145 Å²	145	144.9 Å²	144.9	63%	0.63	76%	0.759	S	S	*	*				83.3	133.2	95.9	-73.1	172.3	143.7	-78.7	0	118.6
106	E	32.4	Very low	30.8	Very low	147 Å²	147	142.4 Å²	142.4	69%	0.687	75%	0.747	S	S	*	*			trans	60.6	159.1	136.9	-69.5	146.1	-164.8	0	0	120.8
107	E	30.1	Very low	30.9	Very low	185 Å²	185	146 Å²	146	86%	0.864	75%	0.749	S	S	*	*			cis	-146.4	-147.1	5	-142.7	-174	169	0	0	114.4
108	K	29.6	Very low	31.1	Very low	189 Å²	189	151.2 Å²	151.2	82%	0.822	75%	0.746	S	S	*	*			trans	-140.7	-170.6	-171.5	-117.6	178.7	-176.1	172	0	109.6
109	P	47.5	Very low	31.7	Very low	104 Å²	104	153.4 Å²	153.4	68%	0.675	75%	0.749	S	S	*	*			cis	-130.8	-172.8	-35.7	41	-25.6	0	0	0	112.8
110	Q	26.8	Very low	31.5	Very low	176 Å²	176	152.2 Å²	152.2	82%	0.822	75%	0.747	S	S	*	*			trans	-173.3	173.4	138.8	-110.5	-178.6	74.5	0	0	115.8
111	L	28.2	Very low	31.2	Very low	151 Å²	151	150.7 Å²	150.7	79%	0.791	75%	0.746	S	S	*	*			trans	-122.3	155.5	-176.9	-72.8	75.7	0	0	0	112.5
112	K	28.7	Very low	31.1	Very low	191 Å²	191	156.1 Å²	156.1	83%	0.83	76%	0.759	S	S	*	*			trans	-173.6	118.3	132	-101.2	149.1	-169.5	169.3	0	117.3
113	K	29.5	Very low	30.8	Very low	197 Å²	197	153.3 Å²	153.3	86%	0.857	76%	0.761	S	S	*	*			trans	14.7	137.5	143.7	-57	178.5	176.1	175.3	0	123.5
114	K	27.7	Very low	31.4	Very low	175 Å²	175	153.6 Å²	153.6	76%	0.761	77%	0.765	S	S	*	*				102.1	124.2	123.8	-113.3	-171.5	177.6	-178	0	122.9
115	R	28.3	Very low	31.3	Very low	185 Å²	185	158 Å²	158	70%	0.698	77%	0.773	S	S	*	*				83.4	111.3	129.1	-109.2	-168.2	169.5	168.4	0.2	124.2
116	E	29.3	Very low	31.1	Very low	138 Å²	138	158 Å²	158	65%	0.645	78%	0.777	S	S	*	*				40.4	134.9	122.9	-57.9	177.8	113.5	0	0	123.6
117	N	28.6	Very low	32	Very low	153 Å²	153	156.1 Å²	156.1	82%	0.818	78%	0.777	S	S	*	*			trans	105.2	141.1	145.4	-67.5	-27.3	0	0	0	122.3
118	K	32.1	Very low	32.1	Very low	197 Å²	197	152.5 Å²	152.5	86%	0.857	77%	0.772	S	S	*	*			trans	-74.9	175.7	172.3	-68.1	-178.4	177.2	179.1	0	110.3
119	P	40.8	Very low	32	Very low	112 Å²	112	146.9 Å²	146.9	73%	0.727	77%	0.768	S	S	*	*			cis	-155.4	167.3	27	47.2	-26	0	0	0	121.5
120	V	27.1	Very low	31.2	Very low	130 Å²	130	151 Å²	151	79%	0.788	78%	0.778	S	S	*	*			trans	54.2	117.9	132.2	172	0	0	0	0	122.1
121	S	29.6	Very low	31.5	Very low	95 Å²	95	148.2 Å²	148.2	66%	0.664	77%	0.773	S	S	*	*				135.3	148.5	119.8	66	0	0	0	0	119.9
122	K	28.2	Very low	31.7	Very low	205 Å²	205	149 Å²	149	89%	0.891	77%	0.773	S	S	*	*			trans	78.9	141.9	152.5	-75	161.6	-178.9	178.8	0	120.5
123	A	28.7	Very low	31.9	Very low	91 Å²	91	145.9 Å²	145.9	75%	0.752	77%	0.769	S	S	*	*			trans	-114.4	-177.1	175.2	0	0	0	0	0	109.8
124	P	41.1	Very low	32.1	Very low	116 Å²	116	143.7 Å²	143.7	75%	0.753	76%	0.762	S	S	*	*				-152.9	160.8	96.9	40.1	-23.2	0	0	0	117.6
125	R	29.3	Very low	32.2	Very low	236 Å²	236	144.9 Å²	144.9	89%	0.891	77%	0.767	S	S	*	*			trans	37.8	158.6	137	-67.3	-161.7	161.4	-156.5	-4.6	122.3
126	M	30.3	Very low	32.5	Very low	145 Å²	145	141.3 Å²	141.3	71%	0.714	77%	0.766	S	S	*	*			cis	-174.4	-170.8	-12.8	-98.9	-62	-87.8	0	0	106.4
127	P	51.2	Low	33.1	Very low	107 Å²	107	140.8 Å²	140.8	70%	0.695	77%	0.774	S	S	*	*			cis	-123.1	-148.5	-2.7	42.7	-23	0	0	0	111.2
128	S	31.6	Very low	33.2	Very low	109 Å²	109	142 Å²	142	76%	0.762	78%	0.775	S	S	*	*			cis	-166.5	171.4	-15.8	29.8	0	0	0	0	106.5
129	G	28.6	Very low	33.6	Very low	71 Å²	71	137.3 Å²	137.3	73%	0.732	77%	0.765	S	S	*	*			cis	-127.4	-134.8	-10	0	0	0	0	0	109
130	E	29.4	Very low	33	Very low	192 Å²	192	137 Å²	137	90%	0.897	77%	0.766	S	S	*	*			cis	-137.1	174.2	-14.2	-76	-168.1	140.9	0	0	108.7
131	T	32.7	Very low	33.3	Very low	116 Å²	116	140.4 Å²	140.4	71%	0.712	77%	0.773	S	S	*	*			trans	-25.2	158.7	178.1	5.8	0	0	0	0	119.9
132	E	32.6	Very low	33.3	Very low	167 Å²	167	144.6 Å²	144.6	78%	0.78	78%	0.782	S	S	*	*			cis	-160.2	126.1	13.7	-152.4	152.1	-136.9	0	0	107.8
133	V	33.8	Very low	33.3	Very low	126 Å²	126	140.1 Å²	140.1	76%	0.764	78%	0.777	S	S	*	*				62.9	138.9	79.5	174.6	0	0	0	0	114.9
134	E	33.4	Very low	33.3	Very low	151 Å²	151	141.9 Å²	141.9	71%	0.706	78%	0.778	S	S	*	*			cis	-177.5	145.9	-27	-168.9	-161.9	151.4	0	0	109.2
135	K	28.8	Very low	32.9	Very low	200 Å²	200	144 Å²	144	87%	0.87	78%	0.783	S	S	*	*			trans	-174.2	154.5	132.4	-108.7	171.8	-178.2	175	0	115.8
136	V	35	Very low	33.1	Very low	111 Å²	111	141.7 Å²	141.7	67%	0.673	78%	0.779	S	S	*	*			trans	-129.6	165.8	-177	-147.6	0	0	0	0	109.1
137	P	42.9	Very low	33.3	Very low	126 Å²	126	142.9 Å²	142.9	82%	0.818	78%	0.783	S	S	*	*				-148.6	174.3	90.6	38	-18.8	0	0	0	117
138	E	30.6	Very low	32.5	Very low	178 Å²	178	146.3 Å²	146.3	83%	0.832	79%	0.79	S	S	*	*			trans	-85.3	-172.3	173.6	-112.9	-175.8	143.7	0	0	112.8
139	P	39.8	Very low	32.5	Very low	99 Å²	99	143.6 Å²	143.6	64%	0.643	78%	0.779	S	S	*	*			cis	-137.5	177.7	-18.4	33.6	-12.2	0	0	0	116.3
140	S	29.3	Very low	33.1	Very low	107 Å²	107	147 Å²	147	75%	0.748	79%	0.788	S	S	*	*			trans	16.5	134.9	151.2	65.1	0	0	0	0	124.7
141	Q	32.3	Very low	33.8	Very low	201 Å²	201	147.2 Å²	147.2	94%	0.939	79%	0.789	S	S	*	*			trans	-151.1	174.5	137	-81.9	-144.7	-49.4	0	0	111.4
142	E	28.8	Very low	34.7	Very low	182 Å²	182	153.3 Å²	153.3	85%	0.85	80%	0.799	S	S	*	*			trans	-107.5	164.1	-153.5	-59.7	-179	90.5	0	0	118.8
143	S	28.6	Very low	36.2	Very low	111 Å²	111	151.8 Å²	151.8	78%	0.776	80%	0.796	S	S	*	*			trans	94.4	168.9	138.2	81.5	0	0	0	0	122.1
144	V	29.7	Very low	38.2	Very low	129 Å²	129	148.8 Å²	148.8	78%	0.782	78%	0.781	S	S	*	*			trans	88.7	89.6	169.2	-163.9	0	0	0	0	120.6
145	N	31.7	Very low	39.6	Very low	160 Å²	160	152.4 Å²	152.4	86%	0.856	79%	0.788	S	S	*	*			trans	72.7	170.4	132.2	-143.2	-1.8	0	0	0	122.2
146	K	34.9	Very low	41.2	Very low	187 Å²	187	150.1 Å²	150.1	81%	0.813	78%	0.78	S	S	*	*			trans	-123.1	171.5	-164.2	-96	-178.4	175.9	174.8	0	114.1
147	Q	33.7	Very low	42.7	Very low	171 Å²	171	149.7 Å²	149.7	80%	0.799	77%	0.771	S	S	*	*			trans	79.5	145.2	171.3	-49.9	-165.4	27.5	0	0	114.1
148	Q	33.8	Very low	43.8	Very low	178 Å²	178	151.4 Å²	151.4	83%	0.832	76%	0.761	S	S	*	*			cis	-141.5	-175.8	2.3	-115.6	159	65.2	0	0	107.1
149	G	33.1	Very low	45.6	Very low	52 Å²	52	151.7 Å²	151.7	54%	0.536	75%	0.754	S	S	.	*			cis	167.7	156.9	3.2	0	0	0	0	0	108.6
150	P	39.5	Very low	46.8	Very low	143 Å²	143	152 Å²	152	93%	0.929	75%	0.751	S	S	*	*	P	Polyproline II helix	trans	-72.4	147.5	-170.1	28.6	-34.7	0	0	0	114.7
151	E	45.6	Very low	48.7	Very low	197 Å²	197	154.6 Å²	154.6	92%	0.921	75%	0.749	S	S	*	*	P	Polyproline II helix	trans	-84	171.6	-158.5	-76.2	-166.9	90.3	0	0	118.4
152	R	51.5	Low	50.3	Low	244 Å²	244	153.4 Å²	153.4	92%	0.921	74%	0.735	S	S	*	*	P	Polyproline II helix	trans	-80	144	-174.8	-65.1	171.5	171.1	171.3	-3.3	113.2
153	L	63.8	Low	51.6	Low	134 Å²	134	152 Å²	152	70%	0.702	73%	0.727	S	S	*	*	P	Polyproline II helix	trans	-59.8	141.2	174.1	-69.8	167.7	0	0	0	113.2
154	S	76	Confident	52.7	Low	64 Å²	64	152.5 Å²	152.5	45%	0.448	72%	0.72	S	S	.	*	P	Polyproline II helix	trans	-64.9	147.6	179.9	170.7	0	0	0	0	113.3	Q156 Q157 W158	S154-Q156 PolarHBondContact O-N 2.92Å; S154-Q156 PolarHBondContact OG-N 3.14Å; S154-Q157 WeakPolarHBondContact O-CB 3.5Å; S154-Q157 PolarHBondContact O-N 2.89Å; S154-W158 PolarHBondContact O-N 2.86Å
155	R	61.9	Low	54.2	Low	227 Å²	227	155.2 Å²	155.2	86%	0.857	72%	0.722	S	S	*	*	H	α-helix	trans	-53.1	-25.7	178.4	-150.5	178.2	-167.5	-152.8	6.3	113.3
156	Q	62	Low	55.2	Low	151 Å²	151	156.2 Å²	156.2	71%	0.706	72%	0.718	S	S	*	*	H	α-helix	trans	-77.6	-40.7	178.1	-153.2	172	13.9	0	0	112.4	S154 W158 R159 N160	S154-Q156 PolarHBondContact O-N 2.92Å; S154-Q156 PolarHBondContact OG-N 3.14Å; Q156-W158 VanDerWaalsContact C-N 3.31Å; Q156-W158 PolarHBondContact O-N 2.83Å; Q156-R159 PolarHBondContact O-N 3.06Å; Q156-N160 PolarHBondContact O-N 2.87Å
157	Q	67.1	Low	55.8	Low	103 Å²	103	157.9 Å²	157.9	48%	0.481	72%	0.72	S	S	.	*	H	α-helix	trans	-63.6	-38.4	175.7	-65.8	163.9	-40.3	0	0	110.9	S154 R159 N160 K161	S154-Q157 WeakPolarHBondContact O-CB 3.5Å; S154-Q157 PolarHBondContact O-N 2.89Å; Q157-R159 VanDerWaalsContact C-N 3.32Å; Q157-R159 PolarHBondContact O-N 2.79Å; Q157-N160 PolarHBondContact O-N 2.85Å; Q157-K161 PolarHBondContact O-N 3.38Å; Q157-K161 VanDerWaalsContact O-N 3.15Å
158	W	66.4	Low	56.7	Low	161 Å²	161	160.1 Å²	160.1	61%	0.61	72%	0.722	S	S	*	*	H	α-helix	trans	-62.1	-35.8	175.9	-155.4	85.4	0	0	0	113	S154 Q156 K161 R162	S154-W158 PolarHBondContact O-N 2.86Å; Q156-W158 VanDerWaalsContact C-N 3.31Å; Q156-W158 PolarHBondContact O-N 2.83Å; W158-K161 PolarHBondContact O-N 3.42Å; W158-R162 VanDerWaalsContact CZ3-CD 3.43Å; W158-R162 HydrophobicContact CZ3-CG 4.46Å; W158-R162 PolarHBondContact O-N 3.24Å
159	R	68.6	Low	57.4	Low	184 Å²	184	160.6 Å²	160.6	69%	0.694	72%	0.722	S	S	*	*	H	α-helix	trans	-66.1	-39	174.7	-79.9	-173.3	163.7	-144.7	-4.5	112.6	Q156 Q157 R162 K163	Q156-R159 PolarHBondContact O-N 3.06Å; Q157-R159 VanDerWaalsContact C-N 3.32Å; Q157-R159 PolarHBondContact O-N 2.79Å; R159-R162 PolarHBondContact O-N 3.42Å; R159-K163 PolarHBondContact O-N 2.89Å; R159-K163 VanDerWaalsContact O-N 3.13Å
160	N	64.9	Low	57.9	Low	107 Å²	107	165 Å²	165	57%	0.572	73%	0.733	S	S	*	*	H	α-helix	trans	-66.7	-40.4	176.3	-75	-8.5	0	0	0	111.7	Q156 Q157 R162 K163 N164	Q156-N160 PolarHBondContact O-N 2.87Å; Q157-N160 PolarHBondContact O-N 2.85Å; N160-R162 VanDerWaalsContact C-N 3.3Å; N160-R162 PolarHBondContact O-N 2.95Å; N160-K163 PolarHBondContact O-N 2.96Å; N160-K163 VanDerWaalsContact O-N 3.14Å; N160-N164 PolarHBondContact O-N 2.94Å; N160-N164 VanDerWaalsContact O-N 3.17Å
161	K	68.8	Low	57.7	Low	161 Å²	161	168 Å²	168	70%	0.7	73%	0.732	S	S	*	*	H	α-helix	trans	-60	-36.2	175.7	-155.2	166.9	-173.2	173	0	112.5	Q157 W158	Q157-K161 PolarHBondContact O-N 3.38Å; Q157-K161 VanDerWaalsContact O-N 3.15Å; W158-K161 PolarHBondContact O-N 3.42Å
162	R	64.8	Low	57	Low	175 Å²	175	166.9 Å²	166.9	66%	0.66	72%	0.724	S	S	*	*	H	α-helix	trans	-73.4	-33.2	173.3	-75.7	-173.8	70.1	175.6	2.4	114.4	W158 R159 N160	W158-R162 VanDerWaalsContact CZ3-CD 3.43Å; W158-R162 HydrophobicContact CZ3-CG 4.46Å; W158-R162 PolarHBondContact O-N 3.24Å; R159-R162 PolarHBondContact O-N 3.42Å; N160-R162 VanDerWaalsContact C-N 3.3Å; N160-R162 PolarHBondContact O-N 2.95Å
163	K	56.1	Low	56.1	Low	153 Å²	153	161.6 Å²	161.6	67%	0.665	72%	0.723	S	S	*	*	H	α-helix	trans	-67	-41.9	176.8	-78.1	-176.4	175.8	-178.7	0	112	R159 N160 K166	R159-K163 PolarHBondContact O-N 2.89Å; R159-K163 VanDerWaalsContact O-N 3.13Å; N160-K163 PolarHBondContact O-N 2.96Å; N160-K163 VanDerWaalsContact O-N 3.14Å; K163-K166 PolarHBondContact O-N 2.97Å
164	N	53.3	Low	54.8	Low	121 Å²	121	162.9 Å²	162.9	65%	0.647	73%	0.725	S	S	*	*	H	α-helix	trans	-66.3	-43.7	-176.5	-143.5	15.3	0	0	0	112	N160 K166 R167	N160-N164 PolarHBondContact O-N 2.94Å; N160-N164 VanDerWaalsContact O-N 3.17Å; N164-K166 PolarHBondContact O-N 3.11Å; N164-K166 VanDerWaalsContact O-N 3.07Å; N164-R167 PolarHBondContact O-N 3.35Å
165	K	60	Low	52.7	Low	186 Å²	186	168 Å²	168	81%	0.809	75%	0.748	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.5	-11.7	-179.4	-160.6	168.5	-175.8	175.9	0	114.6
166	K	53.7	Low	51.4	Low	181 Å²	181	165.8 Å²	165.8	79%	0.787	74%	0.744	S	S	*	*	T	Hydrogen-bonded Turn	trans	-100.3	-7.4	-179.4	-143	-178.7	-175.6	-173.8	0	114.8	K163 N164	K163-K166 PolarHBondContact O-N 2.97Å; N164-K166 PolarHBondContact O-N 3.11Å; N164-K166 VanDerWaalsContact O-N 3.07Å
167	R	47.5	Very low	50.5	Low	223 Å²	223	164.2 Å²	164.2	84%	0.842	75%	0.747	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.3	-23.6	176.2	-76.3	-171.8	169.7	-171.2	-3.6	114	N164 K169	N164-R167 PolarHBondContact O-N 3.35Å; R167-K169 PolarHBondContact O-N 3.09Å
168	Y	51.5	Low	49.3	Very low	218 Å²	218	167.4 Å²	167.4	86%	0.855	76%	0.762	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.5	14.1	-169.5	-123.3	-80.2	0	0	0	115.8
169	K	49.8	Very low	47.7	Very low	187 Å²	187	167.8 Å²	167.8	81%	0.813	78%	0.776	S	S	*	*	T	Hydrogen-bonded Turn	trans	-131.7	-3.1	-172	-83.7	-151.1	169.6	-159.6	0	117.6	R167	R167-K169 PolarHBondContact O-N 3.09Å
170	N	42.8	Very low	46	Very low	144 Å²	144	166.4 Å²	166.4	77%	0.77	78%	0.782	S	S	*	*			trans	-119.3	117.3	-176.6	-79.6	21.9	0	0	0	113
171	K	34.7	Very low	44.5	Very low	208 Å²	208	164.6 Å²	164.6	90%	0.904	78%	0.783	S	S	*	*	S	Bend	trans	77.1	140.2	174.9	-54.3	-177.8	177.5	-173.6	0	117.2
172	F	31	Very low	42.7	Very low	172 Å²	172	165 Å²	165	75%	0.754	79%	0.792	S	S	*	*			cis	-162.9	111.5	-31.5	-170.7	-95.6	0	0	0	107.9
173	C	33.5	Very low	41	Very low	134 Å²	134	160.5 Å²	160.5	91%	0.905	80%	0.801	S	S	*	*			trans	-145.9	110.3	168.6	-81.4	0	0	0	0	108.9
174	Q	35.3	Very low	39.7	Very low	160 Å²	160	157.9 Å²	157.9	75%	0.748	81%	0.807	S	S	*	*			trans	-122.2	122.6	156.3	-83.5	-175	-34.9	0	0	107.1
175	N	32.1	Very low	39.5	Very low	172 Å²	172	157.3 Å²	157.3	92%	0.92	81%	0.81	S	S	*	*			trans	-168.3	130.3	149.5	-95.4	-14.7	0	0	0	106.4
176	K	34.7	Very low	38	Very low	180 Å²	180	154.8 Å²	154.8	78%	0.783	81%	0.81	S	S	*	*			trans	-147.1	130.5	177.2	-124.7	-158.1	176.9	-155.5	0	106.2
177	P	44.3	Very low	36.9	Very low	119 Å²	119	151.1 Å²	151.1	77%	0.773	81%	0.814	S	S	*	*			trans	-74.3	161.5	140.2	-1.7	21.6	0	0	0	108.9
178	E	41.5	Very low	36	Very low	170 Å²	170	148.2 Å²	148.2	79%	0.794	82%	0.815	S	S	*	*			trans	-104.1	156.3	163.5	-56.3	-170.6	130.1	0	0	108
179	D	33.5	Very low	35.3	Very low	168 Å²	168	145.2 Å²	145.2	90%	0.898	81%	0.814	S	S	*	*			trans	-156.7	158.8	153.1	-127	-36.2	0	0	0	109.2
180	D	31.4	Very low	34.3	Very low	155 Å²	155	147.7 Å²	147.7	83%	0.829	82%	0.818	S	S	*	*			trans	-95.1	172.1	-139.7	-126.8	-43.3	0	0	0	117.6
181	A	34	Very low	33.7	Very low	70 Å²	70	149.5 Å²	149.5	58%	0.579	82%	0.822	S	S	*	*			trans	-85.2	161.4	-174.2	0	0	0	0	0	114.7
182	N	31.4	Very low	34.6	Very low	169 Å²	169	144.9 Å²	144.9	90%	0.904	81%	0.813	S	S	*	*				171.1	153.2	110.6	-91	-66.1	0	0	0	112.5
183	G	28.2	Very low	34.6	Very low	81 Å²	81	140.9 Å²	140.9	84%	0.835	81%	0.812	S	S	*	*			trans	141.2	86.6	170.9	0	0	0	0	0	115.9
184	A	30	Very low	34.4	Very low	97 Å²	97	143.3 Å²	143.3	80%	0.802	81%	0.81	S	S	*	*			trans	-132.1	175.4	171.5	0	0	0	0	0	108.2
185	P	47.8	Very low	34.2	Very low	109 Å²	109	142 Å²	142	71%	0.708	81%	0.808	S	S	*	*			cis	-142.8	175.7	11.5	41.1	-20.8	0	0	0	118.3
186	T	29.9	Very low	34.1	Very low	133 Å²	133	139.3 Å²	139.3	82%	0.816	80%	0.798	S	S	*	*			trans	54.1	119.4	145.9	51.9	0	0	0	0	122.7
187	A	30.8	Very low	33.9	Very low	105 Å²	105	138.7 Å²	138.7	87%	0.868	80%	0.795	S	S	*	*				-157.9	154.1	117.7	0	0	0	0	0	110.3
188	D	27.9	Very low	33.1	Very low	161 Å²	161	142.4 Å²	142.4	86%	0.861	80%	0.799	S	S	*	*			trans	-87.5	155.9	-174.4	-101.6	-41.9	0	0	0	114.5
189	N	37.2	Very low	32.6	Very low	156 Å²	156	141.4 Å²	141.4	83%	0.834	80%	0.799	S	S	*	*			trans	-80.1	147.9	159.4	-84.1	-71	0	0	0	110.4
190	R	28.5	Very low	33.3	Very low	239 Å²	239	138.7 Å²	138.7	90%	0.902	79%	0.79	S	S	*	*			trans	-136	139.7	157.4	-76.8	-165.4	175.2	-178.8	-0.5	113.1
191	E	29	Very low	33.2	Very low	182 Å²	182	139.3 Å²	139.3	85%	0.85	79%	0.788	S	S	*	*			trans	-81.7	-165.7	169.9	-54.4	-177	133.2	0	0	110.1
192	P	54.5	Low	32.8	Very low	110 Å²	110	143.3 Å²	143.3	71%	0.714	80%	0.8	S	S	*	*				-133.1	-170.3	-56.7	32.8	-14.8	0	0	0	112.8
193	A	31.1	Very low	32.6	Very low	88 Å²	88	140 Å²	140	73%	0.727	79%	0.785	S	S	*	*			trans	77	134.1	141.6	0	0	0	0	0	121.2
194	E	29	Very low	32.5	Very low	186 Å²	186	143.9 Å²	143.9	87%	0.869	79%	0.787	S	S	*	*				-155.7	170.8	121.8	-105.1	-58.8	144.1	0	0	108.4
195	D	31.3	Very low	32.3	Very low	132 Å²	132	142.7 Å²	142.7	71%	0.706	78%	0.784	S	S	*	*			trans	-111	-165.5	-161.3	-163.2	-4	0	0	0	114.2
196	V	29.8	Very low	31.5	Very low	115 Å²	115	146.4 Å²	146.4	70%	0.697	79%	0.792	S	S	*	*			trans	97.2	81.8	159.6	-163.5	0	0	0	0	118.9
197	K	31.7	Very low	31.5	Very low	168 Å²	168	146.7 Å²	146.7	73%	0.73	79%	0.788	S	S	*	*				45.9	130	119.4	-72.2	167.1	-177.5	149.4	0	122.8
198	K	26.8	Very low	31.6	Very low	197 Å²	197	148.1 Å²	148.1	86%	0.857	78%	0.78	S	S	*	*			trans	94.9	118.2	137	-78.1	179.4	173.9	-171.4	0	121.8
199	D	30.1	Very low	31.8	Very low	149 Å²	149	144.9 Å²	144.9	80%	0.797	77%	0.77	S	S	*	*			trans	-46.9	166.3	147.3	-66.6	-74.8	0	0	0	115.2
200	P	48.9	Very low	31.4	Very low	110 Å²	110	145.8 Å²	145.8	71%	0.714	77%	0.769	S	S	*	*			cis	-147.9	165.5	29.7	42.6	-22.3	0	0	0	121.5
201	H	29.5	Very low	31.4	Very low	168 Å²	168	140.3 Å²	140.3	78%	0.778	76%	0.763	S	S	*	*			trans	27.9	116.8	146.8	-67	-65	0	0	0	122.9
202	N	24.9	Very low	31.4	Very low	155 Å²	155	135.8 Å²	135.8	83%	0.829	76%	0.756	S	S	*	*				-173.1	171.4	116.8	-109.2	2.2	0	0	0	109.7
203	V	28.7	Very low	30.3	Very low	99 Å²	99	138.3 Å²	138.3	60%	0.6	76%	0.762	S	S	*	*				-179.7	138.2	-55.4	140.6	0	0	0	0	108.1
204	N	26	Very low	30.4	Very low	163 Å²	163	143.6 Å²	143.6	87%	0.872	76%	0.763	S	S	*	*			trans	69.7	150.1	166.6	-67.5	-8.2	0	0	0	121.7
205	G	25.6	Very low	30.4	Very low	71 Å²	71	141.9 Å²	141.9	73%	0.732	75%	0.753	S	S	*	*			trans	102.9	127.6	163.9	0	0	0	0	0	115.5
206	E	30.4	Very low	30.4	Very low	187 Å²	187	143.4 Å²	143.4	87%	0.874	76%	0.756	S	S	*	*			cis	-163.1	-178.3	-20	-138.3	154.9	-164.5	0	0	110.4
207	D	29.4	Very low	30.7	Very low	139 Å²	139	148.2 Å²	148.2	74%	0.743	76%	0.761	S	S	*	*			trans	65.7	161.7	165	-85.9	8	0	0	0	123
208	I	33.1	Very low	30.8	Very low	135 Å²	135	148.6 Å²	148.6	69%	0.692	76%	0.763	S	S	*	*				-162.7	143.3	-67	-113.2	176.1	0	0	0	112.2
209	S	31.6	Very low	31.2	Very low	93 Å²	93	144.7 Å²	144.7	65%	0.65	75%	0.748	S	S	*	*			trans	62.3	130.6	161.9	72.1	0	0	0	0	120.1
210	Q	30.7	Very low	31.1	Very low	175 Å²	175	145.4 Å²	145.4	82%	0.818	74%	0.744	S	S	*	*				52.3	122.1	90.8	-49.7	175.7	21.6	0	0	115.2
211	T	27.3	Very low	30.4	Very low	125 Å²	125	146.2 Å²	146.2	77%	0.767	75%	0.746	S	S	*	*				-173.7	139.1	78	29.3	0	0	0	0	109.4
212	A	29.5	Very low	30.5	Very low	86 Å²	86	148.4 Å²	148.4	71%	0.711	75%	0.753	S	S	*	*				79.1	164.5	77.1	0	0	0	0	0	115.9
213	I	31.7	Very low	31	Very low	163 Å²	163	149.3 Å²	149.3	84%	0.836	75%	0.75	S	S	*	*			trans	77.8	148.4	168.4	-63.5	170.9	0	0	0	116.7
214	R	31.8	Very low	31.3	Very low	199 Å²	199	153.4 Å²	153.4	75%	0.751	76%	0.76	S	S	*	*			cis	-177.6	131.5	-28.8	-169.5	-177.1	-167.5	-156.4	9.2	112
215	K	29.3	Very low	31.6	Very low	151 Å²	151	150.9 Å²	150.9	66%	0.657	75%	0.746	S	S	*	*			trans	54.2	135.9	151.7	-75.6	-177.4	177	-174.5	0	123.8
216	Q	31.2	Very low	31.8	Very low	163 Å²	163	152.8 Å²	152.8	76%	0.762	74%	0.744	S	S	*	*			trans	70.7	168.3	136.7	-71	179.2	0.2	0	0	120
217	R	36.3	Very low	31.9	Very low	216 Å²	216	150.2 Å²	150.2	82%	0.815	73%	0.732	S	S	*	*			cis	178.4	167	-32.2	-173.1	175.9	-177.5	-154.4	1.7	108.8
218	K	33.4	Very low	32.1	Very low	177 Å²	177	153.2 Å²	153.2	77%	0.77	73%	0.733	S	S	*	*			trans	93	158.3	172.6	-60.7	163.9	156.8	-95.9	0	114.4
219	E	35.3	Very low	32	Very low	114 Å²	114	154.4 Å²	154.4	53%	0.533	74%	0.736	S	S	.	*			cis	-168.6	178.1	-7.1	-115.2	167	-131.8	0	0	108.7
220	K	27.6	Very low	31.9	Very low	165 Å²	165	153.4 Å²	153.4	72%	0.717	73%	0.733	S	S	*	*			cis	-133.4	172.5	4.7	-71.8	94.1	171.7	77.1	0	108.4
221	V	36	Very low	31.7	Very low	127 Å²	127	153.3 Å²	153.3	77%	0.77	74%	0.738	S	S	*	*			cis	94.3	92.5	9.5	-174.4	0	0	0	0	118.1
222	K	31.6	Very low	31.6	Very low	213 Å²	213	151.2 Å²	151.2	93%	0.926	74%	0.741	S	S	*	*			trans	169.5	165.4	157.4	-98.7	174.4	-177	-179.4	0	109.2
223	K	34.3	Very low	31.4	Very low	174 Å²	174	153.2 Å²	153.2	76%	0.757	75%	0.749	S	S	*	*			cis	-163.7	97.5	-11.4	160.4	-110.3	151.9	-167.5	0	112.5
224	K	34.7	Very low	31.1	Very low	185 Å²	185	151.3 Å²	151.3	80%	0.804	75%	0.75	S	S	*	*			trans	59.3	158.5	155.5	-78.1	178.4	152.4	-89.9	0	119
225	N	32.4	Very low	30.9	Very low	110 Å²	110	146.1 Å²	146.1	59%	0.588	75%	0.75	S	S	*	*			cis	-151.8	-169.7	9.6	-141.1	60.2	0	0	0	107.7
226	T	31	Very low	30.9	Very low	112 Å²	112	143.4 Å²	143.4	69%	0.687	76%	0.755	S	S	*	*			cis	-136.4	-107.5	6.6	-53	0	0	0	0	112.4
227	E	32	Very low	30.8	Very low	133 Å²	133	146.4 Å²	146.4	62%	0.621	76%	0.76	S	S	*	*			trans	-154.5	148.8	-160.1	-73.6	-166.7	112	0	0	114.2
228	R	33.1	Very low	30.3	Very low	201 Å²	201	139.1 Å²	139.1	76%	0.758	75%	0.751	S	S	*	*			trans	55.5	151.6	131.5	-62.8	-178	-150.2	-113.6	7.8	122
229	E	30.3	Very low	30.4	Very low	161 Å²	161	137.4 Å²	137.4	75%	0.752	75%	0.746	S	S	*	*			cis	-161.1	168.5	-7	-103.2	-79.1	-177.1	0	0	110.1
230	A	30	Very low	30.3	Very low	72 Å²	72	136.8 Å²	136.8	60%	0.595	75%	0.746	S	S	*	*			trans	19.2	145.6	163.6	0	0	0	0	0	126
231	D	27.2	Very low	30.6	Very low	172 Å²	172	136.1 Å²	136.1	92%	0.92	75%	0.746	S	S	*	*			trans	61.7	160.1	145.7	-70.7	-26.9	0	0	0	123
232	G	25	Very low	30.5	Very low	81 Å²	81	136.4 Å²	136.4	84%	0.835	74%	0.743	S	S	*	*			trans	131.7	118.5	157.2	0	0	0	0	0	116.5
233	C	25.7	Very low	30.5	Very low	129 Å²	129	134.5 Å²	134.5	87%	0.872	74%	0.737	S	S	*	*			trans	-92.8	177.3	173	-166.9	0	0	0	0	111.9
234	S	25.5	Very low	30.5	Very low	122 Å²	122	130.7 Å²	130.7	85%	0.853	73%	0.728	S	S	*	*			trans	102.1	167.1	161	82.3	0	0	0	0	118.3
235	A	26.4	Very low	30.3	Very low	91 Å²	91	127.2 Å²	127.2	75%	0.752	72%	0.715	S	S	*	*			trans	-131.4	178.6	-151.8	0	0	0	0	0	112.8
236	A	29.4	Very low	30.2	Very low	94 Å²	94	129.7 Å²	129.7	78%	0.777	72%	0.72	S	S	*	*			trans	71	160	168.7	0	0	0	0	0	114.8
237	R	28.8	Very low	30.1	Very low	226 Å²	226	130.4 Å²	130.4	85%	0.853	72%	0.719	S	S	*	*			cis	-159.7	169.2	-17.2	-122.9	-178.1	-174.9	-153.9	6.4	108.4
238	G	27.6	Very low	29.9	Very low	62 Å²	62	132.7 Å²	132.7	64%	0.639	73%	0.727	S	S	*	*			trans	146.6	96.3	169.9	0	0	0	0	0	110.4
239	E	34.2	Very low	29.5	Very low	141 Å²	141	126.9 Å²	126.9	66%	0.659	72%	0.717	S	S	*	*				70.7	138.8	63.6	-63.6	-171.9	-150.5	0	0	112.4
240	N	33.3	Very low	29.4	Very low	101 Å²	101	123.9 Å²	123.9	54%	0.54	72%	0.72	S	S	.	*			cis	-152.1	-179.3	7.1	-111.8	-31.3	0	0	0	108.5
241	Q	33.8	Very low	29.2	Very low	152 Å²	152	125 Å²	125	71%	0.71	72%	0.723	S	S	*	*			cis	-144.4	148.4	5.4	-112.7	130.7	33.6	0	0	106.3
242	L	34.3	Very low	29.2	Very low	133 Å²	133	126 Å²	126	70%	0.696	72%	0.722	S	S	*	*				62.5	153.6	75.7	-60.4	171.9	0	0	0	113.6	V244	L242-V244 HydrophobicContact CD2-CG2 4.21Å
243	E	31.7	Very low	29.2	Very low	172 Å²	172	126 Å²	126	80%	0.804	72%	0.723	S	S	*	*			cis	-142.8	179.8	27.6	-98.4	-155.7	105.6	0	0	111.5
244	V	33.6	Very low	29.1	Very low	94 Å²	94	126 Å²	126	57%	0.57	72%	0.724	S	S	*	*			cis	176.1	150.9	-34	136.7	0	0	0	0	105.4	L242	L242-V244 HydrophobicContact CD2-CG2 4.21Å
245	E	31.7	Very low	29.2	Very low	113 Å²	113	124.3 Å²	124.3	53%	0.528	72%	0.717	S	S	.	*			cis	-128.3	-100.3	8.6	-154.6	-177.4	94.6	0	0	110.8	L247	E245-L247 HydrophobicContact CG-CG 4.4Å; E245-L247 WeakPolarHBondContact OE1-CD1 3.43Å; E245-L247 VanDerWaalsContact OE1-CG 3.23Å; E245-L247 WeakPolarHBondContact OE1-CG 3.45Å
246	K	29.2	Very low	29.3	Very low	161 Å²	161	129.5 Å²	129.5	70%	0.7	73%	0.726	S	S	*	*			cis	-156.3	117.6	-22.1	-141.1	135.7	-168	69.8	0	105.6
247	L	29	Very low	29.1	Very low	127 Å²	127	128.7 Å²	128.7	67%	0.665	73%	0.727	S	S	*	*				64.8	138.7	73.8	-64.2	-156.7	0	0	0	115.1	E245	E245-L247 HydrophobicContact CG-CG 4.4Å; E245-L247 WeakPolarHBondContact OE1-CD1 3.43Å; E245-L247 VanDerWaalsContact OE1-CG 3.23Å; E245-L247 WeakPolarHBondContact OE1-CG 3.45Å
248	K	27.2	Very low	29.2	Very low	181 Å²	181	124.8 Å²	124.8	79%	0.787	72%	0.722	S	S	*	*			cis	-158	175.4	8.6	-122.9	-147.9	167.3	-171	0	109.2
249	S	26.4	Very low	29.3	Very low	80 Å²	80	129.5 Å²	129.5	56%	0.559	73%	0.725	S	S	*	*				-175.9	145.8	-55.6	62.2	0	0	0	0	110.5
250	A	28.1	Very low	29	Very low	97 Å²	97	131.4 Å²	131.4	80%	0.802	73%	0.734	S	S	*	*			trans	67	165.2	165.9	0	0	0	0	0	115.5
251	S	26	Very low	28.6	Very low	95 Å²	95	130.4 Å²	130.4	66%	0.664	75%	0.747	S	S	*	*			cis	-166.4	161.8	-11.9	32.7	0	0	0	0	110.4
252	E	25.6	Very low	28.3	Very low	194 Å²	194	128.6 Å²	128.6	91%	0.907	76%	0.759	S	S	*	*			trans	62.8	168.5	156.7	-71.1	166.1	-169.1	0	0	118.9
253	G	25	Very low	27.9	Very low	82 Å²	82	126.1 Å²	126.1	85%	0.845	77%	0.765	S	S	*	*			trans	132.7	108.6	173.1	0	0	0	0	0	114.4
254	S	24.7	Very low	27.8	Very low	127 Å²	127	126.6 Å²	126.6	89%	0.888	77%	0.767	S	S	*	*			trans	-99.9	176.7	178.5	-167.4	0	0	0	0	112.5
255	A	28	Very low	27.6	Very low	87 Å²	87	129.2 Å²	129.2	72%	0.719	78%	0.783	S	S	*	*			trans	87.8	130	158.1	0	0	0	0	0	121
256	E	26.8	Very low	27.6	Very low	201 Å²	201	132 Å²	132	94%	0.939	80%	0.796	S	S	*	*			trans	7.3	147.8	144.7	-47.6	-169.8	142.7	0	0	121.9
257	G	27	Very low	27.6	Very low	77 Å²	77	130.2 Å²	130.2	79%	0.794	80%	0.798	S	S	*	*			trans	-178.4	80.5	171.3	0	0	0	0	0	115.9
258	L	29.2	Very low	27.6	Very low	144 Å²	144	129.2 Å²	129.2	75%	0.754	81%	0.808	S	S	*	*			trans	-64.5	144.9	-178.7	-108.9	62.6	0	0	0	115.9
259	K	30.2	Very low	27.7	Very low	161 Å²	161	125.4 Å²	125.4	70%	0.7	80%	0.804	S	S	*	*			trans	81.6	126.7	139.3	-71.5	173.7	177.7	170.6	0	122.7
260	H	27.9	Very low	27.8	Very low	180 Å²	180	128.7 Å²	128.7	83%	0.833	82%	0.821	S	S	*	*			trans	49.9	125	137.6	-54.1	118.7	0	0	0	122.1
261	G	25	Very low	28.3	Very low	80 Å²	80	130.7 Å²	130.7	83%	0.825	82%	0.819	S	S	*	*			trans	-168.2	125.4	155.1	0	0	0	0	0	110.1
262	A	28.3	Very low	28.6	Very low	115 Å²	115	137.5 Å²	137.5	95%	0.95	83%	0.83	S	S	*	*			trans	-97.8	148.3	178.4	0	0	0	0	0	111.2
263	G	26.4	Very low	29.5	Very low	80 Å²	80	136.1 Å²	136.1	83%	0.825	82%	0.823	S	S	*	*			trans	-164.9	114.9	174.7	0	0	0	0	0	110.9
264	E	28.7	Very low	30.2	Very low	182 Å²	182	140.7 Å²	140.7	85%	0.85	82%	0.82	S	S	*	*			trans	-82.5	140.8	179.6	-64.7	174.1	87.2	0	0	111.9
265	V	30.3	Very low	31.2	Very low	149 Å²	149	138.8 Å²	138.8	90%	0.903	81%	0.805	S	S	*	*			trans	-134.4	142	149.7	-178.4	0	0	0	0	108.1
266	Q	30.4	Very low	32	Very low	171 Å²	171	140.6 Å²	140.6	80%	0.799	80%	0.798	S	S	*	*			trans	-87.4	133.7	-161.7	-65.9	172	-7.2	0	0	114.4
267	V	29.1	Very low	32.8	Very low	125 Å²	125	136.6 Å²	136.6	76%	0.758	78%	0.782	S	S	*	*			trans	19.6	119.5	135.1	-173.8	0	0	0	0	118.3	S269	V267-S269 WeakPolarHBondContact CG1-OG 3.13Å
268	A	28.6	Very low	34.3	Very low	106 Å²	106	136.3 Å²	136.3	88%	0.876	77%	0.769	S	S	*	*			trans	-128.7	135.2	143.2	0	0	0	0	0	109.1
269	S	29.1	Very low	36	Very low	100 Å²	100	135.6 Å²	135.6	70%	0.699	76%	0.759	S	S	*	*			trans	-105.3	138.7	-157.4	-67.3	0	0	0	0	115.1	V267	V267-S269 WeakPolarHBondContact CG1-OG 3.13Å
270	T	30.3	Very low	37.7	Very low	150 Å²	150	132.9 Å²	132.9	92%	0.92	75%	0.749	S	S	*	*			trans	-129.8	115	148.7	51.3	0	0	0	0	110.5
271	N	37	Very low	39.1	Very low	139 Å²	139	133.2 Å²	133.2	74%	0.743	74%	0.743	S	S	*	*			trans	-95.9	126.4	-176.1	174.8	2.6	0	0	0	111	Q273	N271-Q273 PolarHBondContact OD1-N 3.07Å
272	R	33.6	Very low	41.5	Very low	238 Å²	238	132.6 Å²	132.6	90%	0.898	72%	0.721	S	S	*	*			trans	-155.3	77.5	159.4	-112.7	164.6	-163.1	-153.5	2.3	114.5
273	Q	43.6	Very low	43.9	Very low	164 Å²	164	131.7 Å²	131.7	77%	0.766	70%	0.699	S	S	*	*			trans	39.6	104.4	143.2	-61.4	177.1	-14.7	0	0	119.5	N271	N271-Q273 PolarHBondContact OD1-N 3.07Å
274	K	40	Very low	46.3	Very low	179 Å²	179	132.9 Å²	132.9	78%	0.778	68%	0.682	S	S	*	*			trans	-163.6	66.7	150.1	-118.9	164.3	-169.9	167.4	0	117.2
275	P	44.9	Very low	48.4	Very low	87 Å²	87	131.5 Å²	131.5	57%	0.565	67%	0.669	S	S	*	*			trans	-83.3	-33	177.7	-10.9	29.4	0	0	0	114.7	L277 S278	P275-L277 PolarHBondContact O-N 3.39Å; P275-S278 PolarHBondContact O-N 3.05Å
276	E	45.7	Very low	50.7	Low	125 Å²	125	129.9 Å²	129.9	58%	0.584	65%	0.651	S	S	*	*	H	α-helix	trans	-67	-43.6	-161.1	-72.2	-64.2	98.1	0	0	114.9	S278 K279 E280	E276-S278 PolarHBondContact O-N 3.34Å; E276-S278 VanDerWaalsContact O-N 3.13Å; E276-K279 PolarHBondContact O-N 3.15Å; E276-K279 VanDerWaalsContact O-N 3.14Å; E276-K279 IonicContact OE1-NZ 2.84Å; E276-K279 PolarHBondContact OE1-NZ 2.82Å; E276-E280 PolarHBondContact O-N 3.23Å
277	L	44.5	Very low	53	Low	116 Å²	116	128.3 Å²	128.3	61%	0.607	64%	0.642	S	S	*	*	H	α-helix	trans	-62	-25.7	-175.7	-64.6	172.8	0	0	0	113.2	P275 W281	P275-L277 PolarHBondContact O-N 3.39Å; L277-W281 PolarHBondContact O-N 3.03Å
278	S	57.7	Low	55	Low	72 Å²	72	127.8 Å²	127.8	50%	0.503	64%	0.635	S	S	.	*	H	α-helix	trans	-71	-40.4	177.7	-177.7	0	0	0	0	112.3	P275 E276 N282	P275-S278 PolarHBondContact O-N 3.05Å; E276-S278 PolarHBondContact O-N 3.34Å; E276-S278 VanDerWaalsContact O-N 3.13Å; S278-N282 PolarHBondContact O-N 2.97Å; S278-N282 VanDerWaalsContact O-N 3.09Å; S278-N282 PolarHBondContact O-ND2 2.96Å; S278-N282 PolarHBondContact OG-ND2 2.84Å
279	K	64.2	Low	57.2	Low	129 Å²	129	127.8 Å²	127.8	56%	0.561	62%	0.616	S	S	*	*	H	α-helix	trans	-65.5	-44.9	-178.6	-61.5	175	-172.2	161.1	0	111.1	E276 W281 N282 L283	E276-K279 PolarHBondContact O-N 3.15Å; E276-K279 VanDerWaalsContact O-N 3.14Å; E276-K279 IonicContact OE1-NZ 2.84Å; E276-K279 PolarHBondContact OE1-NZ 2.82Å; K279-W281 PolarHBondContact O-N 2.87Å; K279-N282 PolarHBondContact O-N 3.47Å; K279-L283 WeakPolarHBondContact O-CB 3.5Å; K279-L283 PolarHBondContact O-N 3.47Å
280	E	65.9	Low	59.5	Low	104 Å²	104	130.9 Å²	130.9	49%	0.486	62%	0.617	S	S	.	*	H	α-helix	trans	-66.9	-38.1	-178.1	-149.7	-148.4	171.8	0	0	112.1	E276 L283 K284	E276-E280 PolarHBondContact O-N 3.23Å; E280-L283 PolarHBondContact O-N 3.14Å; E280-K284 VanDerWaalsContact CD-CE 3.45Å; E280-K284 WeakPolarHBondContact O-CD 3.25Å; E280-K284 VanDerWaalsContact O-CG 3.27Å; E280-K284 WeakPolarHBondContact O-CG 3.3Å; E280-K284 PolarHBondContact O-N 3.27Å; E280-K284 WeakPolarHBondContact OE1-CE 3.26Å; E280-K284 IonicContact OE1-NZ 3.53Å; E280-K284 PolarHBondContact OE1-NZ 3.1Å; E280-K284 IonicContact OE2-NZ 3.18Å; E280-K284 PolarHBondContact OE2-NZ 3.43Å
281	W	57.8	Low	61.7	Low	186 Å²	186	128.7 Å²	128.7	71%	0.705	60%	0.599	S	S	*	*	H	α-helix	trans	-64.4	-45.8	174.7	-173.2	-105.4	0	0	0	112.2	L277 K279 L283 K284 R285	L277-W281 PolarHBondContact O-N 3.03Å; K279-W281 PolarHBondContact O-N 2.87Å; W281-L283 PolarHBondContact O-N 2.94Å; W281-K284 PolarHBondContact O-N 2.91Å; W281-R285 PolarHBondContact O-N 3.29Å
282	N	74.8	Confident	63	Low	67 Å²	67	126.7 Å²	126.7	36%	0.358	59%	0.588	S	S	.	*	H	α-helix	trans	-64.5	-39.5	176.6	-78.6	-65.9	0	0	0	112.3	S278 K279 K284 R285 Q286	S278-N282 PolarHBondContact O-N 2.97Å; S278-N282 VanDerWaalsContact O-N 3.09Å; S278-N282 PolarHBondContact O-ND2 2.96Å; S278-N282 PolarHBondContact OG-ND2 2.84Å; K279-N282 PolarHBondContact O-N 3.47Å; N282-K284 VanDerWaalsContact C-N 3.35Å; N282-K284 PolarHBondContact O-N 3.01Å; N282-R285 PolarHBondContact O-N 2.98Å; N282-Q286 WeakPolarHBondContact O-CG 3.35Å; N282-Q286 PolarHBondContact O-N 3.36Å
283	L	78.6	Confident	64.6	Low	96 Å²	96	120.3 Å²	120.3	50%	0.503	57%	0.571	S	S	.	*	H	α-helix	trans	-65.2	-36.8	175.7	-170.4	65.8	0	0	0	112.2	K279 E280 W281 K287	K279-L283 WeakPolarHBondContact O-CB 3.5Å; K279-L283 PolarHBondContact O-N 3.47Å; E280-L283 PolarHBondContact O-N 3.14Å; W281-L283 PolarHBondContact O-N 2.94Å; L283-K287 WeakPolarHBondContact O-CG 3.49Å; L283-K287 PolarHBondContact O-N 2.82Å
284	K	76.6	Confident	65.5	Low	106 Å²	106	121.9 Å²	121.9	46%	0.461	57%	0.57	S	S	.	*	H	α-helix	trans	-64.4	-44.7	172.5	-73.6	164.5	-176.4	170.6	0	111.4	E280 W281 N282 K287 L288	E280-K284 VanDerWaalsContact CD-CE 3.45Å; E280-K284 WeakPolarHBondContact O-CD 3.25Å; E280-K284 VanDerWaalsContact O-CG 3.27Å; E280-K284 WeakPolarHBondContact O-CG 3.3Å; E280-K284 PolarHBondContact O-N 3.27Å; E280-K284 WeakPolarHBondContact OE1-CE 3.26Å; E280-K284 IonicContact OE1-NZ 3.53Å; E280-K284 PolarHBondContact OE1-NZ 3.1Å; E280-K284 IonicContact OE2-NZ 3.18Å; E280-K284 PolarHBondContact OE2-NZ 3.43Å; W281-K284 PolarHBondContact O-N 2.91Å; N282-K284 VanDerWaalsContact C-N 3.35Å; N282-K284 PolarHBondContact O-N 3.01Å; K284-K287 PolarHBondContact O-N 3.45Å; K284-L288 PolarHBondContact O-N 3.27Å
285	R	74.6	Confident	66.1	Low	153 Å²	153	120.4 Å²	120.4	58%	0.577	57%	0.565	S	S	*	*	H	α-helix	trans	-60.9	-45	175.8	-170.8	179.9	-179.5	-158.3	0.8	112.4	W281 N282 L288 Q289	W281-R285 PolarHBondContact O-N 3.29Å; N282-R285 PolarHBondContact O-N 2.98Å; R285-L288 WeakPolarHBondContact O-CB 3.5Å; R285-L288 PolarHBondContact O-N 3.47Å; R285-Q289 PolarHBondContact O-N 3.06Å
286	Q	77	Confident	66.1	Low	114 Å²	114	122.9 Å²	122.9	53%	0.533	57%	0.57	S	S	.	*	H	α-helix	trans	-66	-37.5	176.9	-72.4	179.2	4.4	0	0	112.8	N282 L288 Q289 K290	N282-Q286 WeakPolarHBondContact O-CG 3.35Å; N282-Q286 PolarHBondContact O-N 3.36Å; Q286-L288 VanDerWaalsContact C-N 3.34Å; Q286-Q289 PolarHBondContact O-N 3.32Å; Q286-K290 PolarHBondContact O-N 2.84Å
287	K	79.5	Confident	66.1	Low	139 Å²	139	127.2 Å²	127.2	60%	0.604	58%	0.581	S	S	*	*	H	α-helix	trans	-62.2	-41.7	171.7	-81.5	-174.4	175	-175.8	0	111.6	L283 K284 K290 I291	L283-K287 WeakPolarHBondContact O-CG 3.49Å; L283-K287 PolarHBondContact O-N 2.82Å; K284-K287 PolarHBondContact O-N 3.45Å; K287-K290 PolarHBondContact O-N 2.9Å; K287-I291 WeakPolarHBondContact O-CG1 3.44Å; K287-I291 PolarHBondContact O-N 3.31Å
288	L	71.6	Confident	66.1	Low	114 Å²	114	127.9 Å²	127.9	60%	0.597	59%	0.589	S	S	*	*	H	α-helix	trans	-63.4	-44.7	178.2	-158.7	74	0	0	0	111.8	K284 R285 Q286 K290 I291 L292	K284-L288 PolarHBondContact O-N 3.27Å; R285-L288 WeakPolarHBondContact O-CB 3.5Å; R285-L288 PolarHBondContact O-N 3.47Å; Q286-L288 VanDerWaalsContact C-N 3.34Å; L288-K290 PolarHBondContact O-N 3.27Å; L288-I291 PolarHBondContact O-N 2.71Å; L288-I291 VanDerWaalsContact O-N 3.12Å; L288-L292 PolarHBondContact O-N 3.36Å; L288-L292 VanDerWaalsContact O-N 3.16Å
289	Q	74.1	Confident	65.4	Low	105 Å²	105	127.3 Å²	127.3	49%	0.491	60%	0.595	S	S	.	*	H	α-helix	trans	-61.5	-41.2	174.6	-72.7	178.9	-59.1	0	0	112.5	R285 Q286 I291 L292 L293	R285-Q289 PolarHBondContact O-N 3.06Å; Q286-Q289 PolarHBondContact O-N 3.32Å; Q289-I291 PolarHBondContact O-N 3.03Å; Q289-L292 PolarHBondContact O-N 3.44Å; Q289-L293 VanDerWaalsContact O-CD1 3.22Å; Q289-L293 WeakPolarHBondContact O-CD1 3.46Å; Q289-L293 PolarHBondContact O-N 2.93Å
290	K	76.9	Confident	64.2	Low	165 Å²	165	127.4 Å²	127.4	72%	0.717	61%	0.606	S	S	*	*	H	α-helix	trans	-66.6	-15.9	175.5	-78.4	-171.7	175.1	-176	0	114.4	Q286 K287 L288	Q286-K290 PolarHBondContact O-N 2.84Å; K287-K290 PolarHBondContact O-N 2.9Å; L288-K290 PolarHBondContact O-N 3.27Å
291	I	76.6	Confident	62.5	Low	104 Å²	104	132.4 Å²	132.4	53%	0.533	63%	0.63	S	S	.	*	H	α-helix	trans	-84.2	-46.6	172.5	-68.2	163.7	0	0	0	110	K287 L288 Q289 R294 Q295	K287-I291 WeakPolarHBondContact O-CG1 3.44Å; K287-I291 PolarHBondContact O-N 3.31Å; L288-I291 PolarHBondContact O-N 2.71Å; L288-I291 VanDerWaalsContact O-N 3.12Å; Q289-I291 PolarHBondContact O-N 3.03Å; I291-R294 WeakPolarHBondContact O-CB 3.29Å; I291-R294 PolarHBondContact O-N 2.81Å; I291-R294 VanDerWaalsContact O-N 3.08Å; I291-Q295 PolarHBondContact O-N 3.11Å
292	L	63.8	Low	61.1	Low	98 Å²	98	129 Å²	129	51%	0.513	63%	0.634	S	S	.	*	H	α-helix	trans	-56.6	-52.3	175.2	-98	69.5	0	0	0	112.3	L288 Q289 R294 Q295 E296	L288-L292 PolarHBondContact O-N 3.36Å; L288-L292 VanDerWaalsContact O-N 3.16Å; Q289-L292 PolarHBondContact O-N 3.44Å; L292-R294 PolarHBondContact O-N 3.26Å; L292-Q295 WeakPolarHBondContact O-CB 3.47Å; L292-Q295 PolarHBondContact O-N 3.38Å; L292-E296 PolarHBondContact O-N 2.69Å
293	L	67.6	Low	59.4	Low	103 Å²	103	132 Å²	132	54%	0.539	66%	0.657	S	S	.	*	H	α-helix	trans	-68.4	-2.3	178.6	-80.4	89.9	0	0	0	114.4	Q289	Q289-L293 VanDerWaalsContact O-CD1 3.22Å; Q289-L293 WeakPolarHBondContact O-CD1 3.46Å; Q289-L293 PolarHBondContact O-N 2.93Å
294	R	63.7	Low	57.2	Low	198 Å²	198	131.9 Å²	131.9	75%	0.747	67%	0.67	S	S	*	*	H	α-helix	trans	-93.8	-23.4	167.7	-106.8	-178.2	172.5	-95	0.6	112.7	I291 L292	I291-R294 WeakPolarHBondContact O-CB 3.29Å; I291-R294 PolarHBondContact O-N 2.81Å; I291-R294 VanDerWaalsContact O-N 3.08Å; L292-R294 PolarHBondContact O-N 3.26Å
295	Q	52.2	Low	55	Low	147 Å²	147	136.2 Å²	136.2	69%	0.687	69%	0.692	S	S	*	*	H	α-helix	trans	-84.1	-35	-179.2	-163	164.8	-0.8	0	0	111.5	I291 L292 R297	I291-Q295 PolarHBondContact O-N 3.11Å; L292-Q295 WeakPolarHBondContact O-CB 3.47Å; L292-Q295 PolarHBondContact O-N 3.38Å; Q295-R297 VanDerWaalsContact C-N 3.31Å; Q295-R297 PolarHBondContact O-N 3.22Å
296	E	45.7	Very low	53.3	Low	140 Å²	140	140.3 Å²	140.3	65%	0.654	71%	0.708	S	S	*	*	G	3₁₀ helix	trans	-67.5	-26.9	176.4	-66	170	142.8	0	0	113.3	L292 V298	L292-E296 PolarHBondContact O-N 2.69Å; E296-V298 VanDerWaalsContact C-N 3.27Å; E296-V298 PolarHBondContact O-N 2.96Å
297	R	44.2	Very low	51.1	Low	216 Å²	216	141.8 Å²	141.8	82%	0.815	72%	0.724	S	S	*	*	G	3₁₀ helix	trans	-85.8	18.8	-178.8	-80.4	-160.2	-75	173.5	-9.2	115.6	Q295	Q295-R297 VanDerWaalsContact C-N 3.31Å; Q295-R297 PolarHBondContact O-N 3.22Å
298	V	45	Very low	48.9	Very low	129 Å²	129	143.7 Å²	143.7	78%	0.782	74%	0.736	S	S	*	*	G	3₁₀ helix	trans	-109.1	6.4	172.5	-167.7	0	0	0	0	110.9	E296	E296-V298 VanDerWaalsContact C-N 3.27Å; E296-V298 PolarHBondContact O-N 2.96Å
299	G	43	Very low	47	Very low	61 Å²	61	145.8 Å²	145.8	63%	0.629	74%	0.744	S	S	*	*	S	Bend	trans	-108.3	-0.9	-163.2	0	0	0	0	0	118.7
300	T	37.9	Very low	45	Very low	131 Å²	131	149.1 Å²	149.1	80%	0.804	76%	0.76	S	S	*	*			trans	-153.9	100.1	-179.5	48.9	0	0	0	0	113.6
301	E	31	Very low	43.2	Very low	208 Å²	208	145.9 Å²	145.9	97%	0.972	76%	0.763	S	S	*	*			trans	-146.3	156.2	141.4	-71.6	-158.6	158	0	0	108.3
302	S	29.7	Very low	41.2	Very low	114 Å²	114	147.3 Å²	147.3	80%	0.797	78%	0.777	S	S	*	*			trans	-123.7	146.4	-173	-162.7	0	0	0	0	109.6
303	P	39	Very low	40.1	Very low	131 Å²	131	149.1 Å²	149.1	85%	0.851	79%	0.792	S	S	*	*			trans	-81.2	139.2	-161.6	31.4	-35.5	0	0	0	114
304	A	30.5	Very low	38.9	Very low	93 Å²	93	149.2 Å²	149.2	77%	0.769	80%	0.799	S	S	*	*			trans	-138.9	131.1	166	0	0	0	0	0	111.1
305	E	31.6	Very low	37.5	Very low	197 Å²	197	148.6 Å²	148.6	92%	0.921	80%	0.804	S	S	*	*			trans	52.9	146.4	161.7	-61.9	-171.6	120.1	0	0	121.9
306	R	39.6	Very low	37.2	Very low	240 Å²	240	146.6 Å²	146.6	91%	0.906	81%	0.812	S	S	*	*			trans	-111.3	146.8	168	-59.5	176	178.4	-172.9	-1.4	107.9
307	T	29.2	Very low	37	Very low	144 Å²	144	144.6 Å²	144.6	88%	0.883	82%	0.82	S	S	*	*			trans	-148.6	153.7	147.9	-71	0	0	0	0	107.8
308	E	33.8	Very low	37.2	Very low	180 Å²	180	141.1 Å²	141.1	84%	0.841	82%	0.823	S	S	*	*			trans	-87.6	156.4	-169	-62.8	155.4	178.9	0	0	111.6
309	M	32.1	Very low	37.3	Very low	157 Å²	157	140.5 Å²	140.5	77%	0.773	82%	0.821	S	S	*	*				-176.2	131.8	118.3	-98.8	-176.9	79.3	0	0	113.1
310	E	32.4	Very low	37.8	Very low	176 Å²	176	145.1 Å²	145.1	82%	0.822	83%	0.826	S	S	*	*			trans	53.6	154.7	146.9	-56.4	-157	120.4	0	0	122.6
311	A	38.8	Very low	38.4	Very low	96 Å²	96	142.5 Å²	142.5	79%	0.793	82%	0.818	S	S	*	*			trans	-111.8	134.9	-177.5	0	0	0	0	0	111.1
312	V	33.6	Very low	39.4	Very low	135 Å²	135	134.8 Å²	134.8	82%	0.818	79%	0.794	S	S	*	*			trans	-130.5	127.3	166.7	-177.7	0	0	0	0	108.3
313	V	41.1	Very low	40.5	Very low	136 Å²	136	131 Å²	131	82%	0.824	77%	0.77	S	S	*	*			trans	-104.7	123	174.1	179.2	0	0	0	0	109
314	P	43.4	Very low	41.4	Very low	105 Å²	105	126.8 Å²	126.8	68%	0.682	75%	0.746	S	S	*	*			trans	-118.8	121.3	134	3.1	17.9	0	0	0	108.1
315	E	33.2	Very low	42.8	Very low	185 Å²	185	128.5 Å²	128.5	86%	0.864	74%	0.738	S	S	*	*				85.3	146.8	77.6	-168.3	164.3	-166.8	0	0	112.1
316	A	47	Very low	44.2	Very low	104 Å²	104	125.1 Å²	125.1	86%	0.86	72%	0.722	S	S	*	*			trans	-80.8	133.6	-149.8	0	0	0	0	0	115.3
317	A	40.3	Very low	46.2	Very low	98 Å²	98	117.5 Å²	117.5	81%	0.81	71%	0.706	S	S	*	*			trans	-120.9	152.1	161.4	0	0	0	0	0	110.5
318	V	49.8	Very low	48.9	Very low	144 Å²	144	118.8 Å²	118.8	87%	0.873	69%	0.694	S	S	*	*			trans	-91	171.8	-165	-118	0	0	0	0	113.2
319	P	47.2	Very low	51.4	Low	115 Å²	115	112.3 Å²	112.3	75%	0.747	67%	0.669	S	S	*	*				-86.4	167.5	-119.1	38.9	-38.9	0	0	0	115.9	A321	P319-A321 PolarHBondContact O-N 2.93Å
320	E	52.6	Low	54.2	Low	158 Å²	158	108.3 Å²	108.3	74%	0.738	65%	0.651	S	S	*	*			trans	-59.1	115.7	171	-63.7	-166.1	128.7	0	0	113.3	A323	E320-A323 HydrophobicContact CB-CB 4.43Å; E320-A323 HydrophobicContact CG-CB 4.4Å; E320-A323 WeakPolarHBondContact OE1-CB 3.49Å
321	A	50.7	Low	57	Low	77 Å²	77	102.6 Å²	102.6	64%	0.636	63%	0.63	S	S	*	*	S	Bend	trans	-102.2	-35.4	157.9	0	0	0	0	0	112.1	P319 E325	P319-A321 PolarHBondContact O-N 2.93Å; A321-E325 PolarHBondContact O-N 2.93Å
322	G	51.6	Low	59.5	Low	45 Å²	45	102.6 Å²	102.6	46%	0.464	62%	0.617	S	S	.	*	H	α-helix	trans	-70.7	-46.9	-173.1	0	0	0	0	0	114.6	A324 E325 Q326	G322-A324 VanDerWaalsContact C-N 3.32Å; G322-A324 PolarHBondContact O-N 2.83Å; G322-E325 PolarHBondContact O-N 2.82Å; G322-Q326 WeakPolarHBondContact O-CG 3.28Å; G322-Q326 PolarHBondContact O-N 2.85Å
323	A	53.3	Low	62.3	Low	36 Å²	36	102.7 Å²	102.7	30%	0.298	60%	0.602	S	S	.	*	H	α-helix	trans	-62.9	-38.1	-177.8	0	0	0	0	0	112.4	E320 Q326 S327	E320-A323 HydrophobicContact CB-CB 4.43Å; E320-A323 HydrophobicContact CG-CB 4.4Å; E320-A323 WeakPolarHBondContact OE1-CB 3.49Å; A323-Q326 PolarHBondContact O-N 3.08Å; A323-S327 WeakPolarHBondContact O-CB 3.2Å; A323-S327 PolarHBondContact O-N 3.19Å
324	A	57.3	Low	64.8	Low	42 Å²	42	98.5 Å²	98.5	35%	0.347	58%	0.579	S	S	.	*	H	α-helix	trans	-66.4	-35.4	176.6	0	0	0	0	0	113.1	G322 R328	G322-A324 VanDerWaalsContact C-N 3.32Å; G322-A324 PolarHBondContact O-N 2.83Å; A324-R328 WeakPolarHBondContact O-CD 3.36Å; A324-R328 WeakPolarHBondContact O-CG 3.29Å; A324-R328 PolarHBondContact O-N 2.96Å
325	E	59.6	Low	67	Low	128 Å²	128	100.1 Å²	100.1	60%	0.598	57%	0.572	S	S	*	*	H	α-helix	trans	-71.8	-42.6	173.4	-74.3	-91.7	110.2	0	0	111.5	A321 G322 R328 S329	A321-E325 PolarHBondContact O-N 2.93Å; G322-E325 PolarHBondContact O-N 2.82Å; E325-R328 PolarHBondContact O-N 2.87Å; E325-R328 IonicContact OE1-NH1 3.88Å; E325-S329 PolarHBondContact O-N 2.84Å
326	Q	61.1	Low	69.8	Low	127 Å²	127	97.1 Å²	97.1	59%	0.593	56%	0.559	S	S	*	*	H	α-helix	trans	-61.7	-52	176.5	-74.1	172.2	-23.4	0	0	111	G322 A323 R328 S329 D330	G322-Q326 WeakPolarHBondContact O-CG 3.28Å; G322-Q326 PolarHBondContact O-N 2.85Å; A323-Q326 PolarHBondContact O-N 3.08Å; Q326-R328 VanDerWaalsContact C-N 3.29Å; Q326-R328 PolarHBondContact O-N 2.57Å; Q326-S329 CarbonylContact O-C 3.55Å; Q326-S329 WeakPolarHBondContact O-CA 3.36Å; Q326-S329 WeakPolarHBondContact O-CB 3.04Å; Q326-S329 PolarHBondContact O-N 3.05Å; Q326-S329 PolarHBondContact O-OG 3.39Å; Q326-D330 PolarHBondContact O-N 3.5Å
327	S	81.6	Confident	71.9	Confident	80 Å²	80	97.6 Å²	97.6	56%	0.559	54%	0.543	S	S	*	.	H	α-helix	trans	-52	-42.1	174.2	176.4	0	0	0	0	113.1	A323 D330 S331	A323-S327 WeakPolarHBondContact O-CB 3.2Å; A323-S327 PolarHBondContact O-N 3.19Å; S327-D330 PolarHBondContact O-N 2.79Å; S327-S331 VanDerWaalsContact O-CB 3.32Å; S327-S331 WeakPolarHBondContact O-CB 3.34Å; S327-S331 PolarHBondContact O-N 2.9Å
328	R	85.4	Confident	74.2	Confident	170 Å²	170	97.4 Å²	97.4	64%	0.642	53%	0.526	S	S	*	.	H	α-helix	trans	-65.9	-38.9	173	-74.7	168.1	179.7	171.3	2.4	112.8	A324 E325 Q326 L332	A324-R328 WeakPolarHBondContact O-CD 3.36Å; A324-R328 WeakPolarHBondContact O-CG 3.29Å; A324-R328 PolarHBondContact O-N 2.96Å; E325-R328 PolarHBondContact O-N 2.87Å; E325-R328 IonicContact OE1-NH1 3.88Å; Q326-R328 VanDerWaalsContact C-N 3.29Å; Q326-R328 PolarHBondContact O-N 2.57Å; R328-L332 WeakPolarHBondContact O-CB 3.33Å; R328-L332 PolarHBondContact O-N 2.84Å
329	S	87.3	Confident	76.1	Confident	44 Å²	44	94.9 Å²	94.9	31%	0.308	50%	0.501	S	S	.	.	H	α-helix	trans	-67.4	-36.9	177.3	84	0	0	0	0	112.3	E325 Q326 L332 R333	E325-S329 PolarHBondContact O-N 2.84Å; Q326-S329 CarbonylContact O-C 3.55Å; Q326-S329 WeakPolarHBondContact O-CA 3.36Å; Q326-S329 WeakPolarHBondContact O-CB 3.04Å; Q326-S329 PolarHBondContact O-N 3.05Å; Q326-S329 PolarHBondContact O-OG 3.39Å; S329-L332 WeakPolarHBondContact O-CB 3.32Å; S329-L332 PolarHBondContact O-N 3.36Å; S329-R333 WeakPolarHBondContact O-CG 3.48Å; S329-R333 PolarHBondContact O-N 3.21Å
330	D	90.9	Very high	78.2	Confident	74 Å²	74	94.4 Å²	94.4	40%	0.396	49%	0.491	S	S	.	.	H	α-helix	trans	-77.8	-36.5	179.3	-65	-46.8	0	0	0	112	Q326 S327 L332 R333 S334	Q326-D330 PolarHBondContact O-N 3.5Å; S327-D330 PolarHBondContact O-N 2.79Å; D330-L332 VanDerWaalsContact C-N 3.26Å; D330-L332 PolarHBondContact O-N 2.93Å; D330-R333 PolarHBondContact O-N 3.48Å; D330-R333 WeakPolarHBondContact OD1-CD 3.49Å; D330-R333 IonicContact OD1-CZ 2.64Å; D330-R333 IonicContact OD1-NE 3.42Å; D330-R333 IonicContact OD1-NH1 3.91Å; D330-R333 PolarHBondContact OD1-NH1 3.41Å; D330-S334 WeakPolarHBondContact O-CB 3.43Å; D330-S334 PolarHBondContact O-N 3.47Å
331	S	91	Very high	79.9	Confident	55 Å²	55	90.7 Å²	90.7	39%	0.385	47%	0.474	S	S	.	.	H	α-helix	trans	-58.4	-38.2	166.3	-178.2	0	0	0	0	112.1	S327 R335	S327-S331 VanDerWaalsContact O-CB 3.32Å; S327-S331 WeakPolarHBondContact O-CB 3.34Å; S327-S331 PolarHBondContact O-N 2.9Å; S331-R335 WeakPolarHBondContact O-CB 3.43Å; S331-R335 WeakPolarHBondContact O-CG 3.27Å; S331-R335 PolarHBondContact O-N 3.42Å; S331-R335 VanDerWaalsContact O-N 3.15Å
332	L	91.9	Very high	81.8	Confident	97 Å²	97	88 Å²	88	51%	0.508	45%	0.451	S	S	.	.	H	α-helix	trans	-71.1	-42.1	175.8	-175.7	62.3	0	0	0	112.3	R328 S329 D330 R335 M336	R328-L332 WeakPolarHBondContact O-CB 3.33Å; R328-L332 PolarHBondContact O-N 2.84Å; S329-L332 WeakPolarHBondContact O-CB 3.32Å; S329-L332 PolarHBondContact O-N 3.36Å; D330-L332 VanDerWaalsContact C-N 3.26Å; D330-L332 PolarHBondContact O-N 2.93Å; L332-R335 PolarHBondContact O-N 3.24Å; L332-M336 HydrophobicContact CD1-CE 4Å; L332-M336 HydrophobicContact CD2-CE 4.24Å; L332-M336 HydrophobicContact CG-CE 3.99Å; L332-M336 WeakPolarHBondContact O-CG 3.44Å; L332-M336 PolarHBondContact O-N 2.65Å
333	R	92.6	Very high	83.7	Confident	137 Å²	137	88 Å²	88	52%	0.517	45%	0.447	S	S	.	.	H	α-helix	trans	-57.6	-53.6	173.7	-75.4	164.9	173.9	150.1	-0	111.1	S329 D330 R335 M336 E337	S329-R333 WeakPolarHBondContact O-CG 3.48Å; S329-R333 PolarHBondContact O-N 3.21Å; D330-R333 PolarHBondContact O-N 3.48Å; D330-R333 WeakPolarHBondContact OD1-CD 3.49Å; D330-R333 IonicContact OD1-CZ 2.64Å; D330-R333 IonicContact OD1-NE 3.42Å; D330-R333 IonicContact OD1-NH1 3.91Å; D330-R333 PolarHBondContact OD1-NH1 3.41Å; R333-R335 VanDerWaalsContact C-N 3.3Å; R333-R335 PolarHBondContact O-N 2.86Å; R333-M336 CarbonylContact O-C 3.57Å; R333-M336 WeakPolarHBondContact O-CA 3.42Å; R333-M336 WeakPolarHBondContact O-CB 3.42Å; R333-M336 PolarHBondContact O-N 3.37Å; R333-E337 WeakPolarHBondContact O-CG 3.29Å; R333-E337 PolarHBondContact O-N 3.42Å
334	S	92	Very high	85.7	Confident	48 Å²	48	91.4 Å²	91.4	34%	0.336	45%	0.452	S	S	.	.	H	α-helix	trans	-57.2	-41.6	179.4	-172.9	0	0	0	0	112.1	D330 E337 Q338	D330-S334 WeakPolarHBondContact O-CB 3.43Å; D330-S334 PolarHBondContact O-N 3.47Å; S334-E337 PolarHBondContact O-N 2.77Å; S334-Q338 WeakPolarHBondContact O-CB 3.44Å; S334-Q338 WeakPolarHBondContact O-CG 3.27Å; S334-Q338 PolarHBondContact O-N 3.28Å
335	R	90.3	Very high	87.5	Confident	139 Å²	139	89.7 Å²	89.7	53%	0.525	44%	0.437	S	S	.	.	H	α-helix	trans	-65.4	-35.8	173.4	-78.6	174.1	165.1	154.3	-4.9	113.6	S331 L332 R333 R339	S331-R335 WeakPolarHBondContact O-CB 3.43Å; S331-R335 WeakPolarHBondContact O-CG 3.27Å; S331-R335 PolarHBondContact O-N 3.42Å; S331-R335 VanDerWaalsContact O-N 3.15Å; L332-R335 PolarHBondContact O-N 3.24Å; R333-R335 VanDerWaalsContact C-N 3.3Å; R333-R335 PolarHBondContact O-N 2.86Å; R335-R339 VanDerWaalsContact O-CG 3.28Å; R335-R339 WeakPolarHBondContact O-CG 3.39Å; R335-R339 PolarHBondContact O-N 3.16Å
336	M	92.8	Very high	89.1	Confident	121 Å²	121	86.8 Å²	86.8	60%	0.596	42%	0.42	S	S	*	.	H	α-helix	trans	-69.2	-41.5	174.3	-72.4	-177.7	177	0	0	111.7	L332 R333 R339 L340	L332-M336 HydrophobicContact CD1-CE 4Å; L332-M336 HydrophobicContact CD2-CE 4.24Å; L332-M336 HydrophobicContact CG-CE 3.99Å; L332-M336 WeakPolarHBondContact O-CG 3.44Å; L332-M336 PolarHBondContact O-N 2.65Å; R333-M336 CarbonylContact O-C 3.57Å; R333-M336 WeakPolarHBondContact O-CA 3.42Å; R333-M336 WeakPolarHBondContact O-CB 3.42Å; R333-M336 PolarHBondContact O-N 3.37Å; M336-R339 PolarHBondContact O-N 3.48Å; M336-L340 WeakPolarHBondContact O-CB 3.31Å; M336-L340 PolarHBondContact O-N 3.16Å
337	E	90.8	Very high	90.6	Very high	114 Å²	114	87 Å²	87	53%	0.533	42%	0.417	S	S	.	.	H	α-helix	trans	-62.7	-50.3	176.1	-71.6	156.9	-171.4	0	0	111.1	R333 S334 R339 L340 E341	R333-E337 WeakPolarHBondContact O-CG 3.29Å; R333-E337 PolarHBondContact O-N 3.42Å; S334-E337 PolarHBondContact O-N 2.77Å; E337-R339 VanDerWaalsContact C-N 3.28Å; E337-R339 PolarHBondContact O-N 2.96Å; E337-L340 CarbonylContact O-C 3.59Å; E337-L340 WeakPolarHBondContact O-CA 3.4Å; E337-L340 WeakPolarHBondContact O-CB 3.37Å; E337-L340 PolarHBondContact O-N 2.7Å; E337-E341 WeakPolarHBondContact O-CG 3.43Å; E337-E341 PolarHBondContact O-N 3.14Å
338	Q	88.3	Confident	91.3	Very high	94 Å²	94	83.6 Å²	83.6	44%	0.439	39%	0.392	S	S	.	.	H	α-helix	trans	-55.3	-40.3	175	-74.5	170.4	-2.2	0	0	112.7	W8 S334 A342	W8-Q338 HydrophobicContact CH2-CB 4.38Å; S334-Q338 WeakPolarHBondContact O-CB 3.44Å; S334-Q338 WeakPolarHBondContact O-CG 3.27Å; S334-Q338 PolarHBondContact O-N 3.28Å; Q338-A342 VanDerWaalsContact O-CB 3.31Å; Q338-A342 WeakPolarHBondContact O-CB 3.43Å; Q338-A342 PolarHBondContact O-N 3.49Å
339	R	88.9	Confident	91.8	Very high	92 Å²	92	75.6 Å²	75.6	35%	0.347	36%	0.362	S	S	.	.	H	α-helix	trans	-69.8	-35.6	175.4	-71.9	175.7	91.3	145.1	16.8	112.5	D10 E13 R335 M336 E337 A343	D10-R339 IonicContact OD1-CZ 2.84Å; D10-R339 IonicContact OD1-NH2 2.64Å; D10-R339 PolarHBondContact OD1-NH2 2.76Å; E13-R339 IonicContact OE2-CZ 3.11Å; E13-R339 IonicContact OE2-NH1 2.62Å; E13-R339 PolarHBondContact OE2-NH1 3.25Å; E13-R339 IonicContact OE2-NH2 3.68Å; E13-R339 PolarHBondContact OE2-NH2 2.92Å; E13-R339 VanDerWaalsContact OE2-NH2 3.13Å; R335-R339 VanDerWaalsContact O-CG 3.28Å; R335-R339 WeakPolarHBondContact O-CG 3.39Å; R335-R339 PolarHBondContact O-N 3.16Å; M336-R339 PolarHBondContact O-N 3.48Å; E337-R339 VanDerWaalsContact C-N 3.28Å; E337-R339 PolarHBondContact O-N 2.96Å; R339-A343 VanDerWaalsContact O-CB 3.31Å; R339-A343 WeakPolarHBondContact O-CB 3.24Å; R339-A343 PolarHBondContact O-N 3.19Å
340	L	91.6	Very high	92.1	Very high	105 Å²	105	76.8 Å²	76.8	55%	0.55	36%	0.363	S	S	.	.	H	α-helix	trans	-68.3	-42.9	175.4	-177.5	61.3	0	0	0	111.5	M336 E337 A343 R344	M336-L340 WeakPolarHBondContact O-CB 3.31Å; M336-L340 PolarHBondContact O-N 3.16Å; E337-L340 CarbonylContact O-C 3.59Å; E337-L340 WeakPolarHBondContact O-CA 3.4Å; E337-L340 WeakPolarHBondContact O-CB 3.37Å; E337-L340 PolarHBondContact O-N 2.7Å; L340-A343 PolarHBondContact O-N 3.05Å; L340-R344 PolarHBondContact O-N 2.84Å
341	E	89	Confident	92.3	Very high	79 Å²	79	77.7 Å²	77.7	37%	0.369	36%	0.361	S	S	.	.	H	α-helix	trans	-63.8	-44.7	174.3	-65.7	-156.1	142	0	0	111.5	E337 A343 R344 F345 R376	E337-E341 WeakPolarHBondContact O-CG 3.43Å; E337-E341 PolarHBondContact O-N 3.14Å; E341-A343 VanDerWaalsContact C-N 3.27Å; E341-A343 PolarHBondContact O-N 3.25Å; E341-R344 PolarHBondContact O-N 3.25Å; E341-F345 WeakPolarHBondContact O-CB 3.48Å; E341-F345 PolarHBondContact O-N 3.09Å; E341-R376 IonicContact OE1-CZ 3.96Å; E341-R376 IonicContact OE1-NH1 2.85Å; E341-R376 PolarHBondContact OE1-NH1 3.26Å; E341-R376 IonicContact OE1-NH2 2.72Å; E341-R376 PolarHBondContact OE1-NH2 3Å; E341-R376 IonicContact OE2-CZ 2.65Å; E341-R376 IonicContact OE2-NH1 3.9Å; E341-R376 PolarHBondContact OE2-NH1 2.93Å; E341-R376 VanDerWaalsContact OE2-NH1 3.08Å
342	A	89.8	Confident	92.5	Very high	20 Å²	20	75.4 Å²	75.4	17%	0.165	34%	0.344	C	S	.	.	H	α-helix	trans	-62.8	-32.6	174.2	0	0	0	0	0	112.7	W8 Q338 R346	W8-A342 HydrophobicContact CE3-CB 4.45Å; W8-A342 HydrophobicContact CH2-CB 4.48Å; W8-A342 HydrophobicContact CZ3-CB 3.72Å; Q338-A342 VanDerWaalsContact O-CB 3.31Å; Q338-A342 WeakPolarHBondContact O-CB 3.43Å; Q338-A342 PolarHBondContact O-N 3.49Å; A342-R346 WeakPolarHBondContact O-CB 3.49Å; A342-R346 VanDerWaalsContact O-CG 3.31Å; A342-R346 WeakPolarHBondContact O-CG 3.41Å; A342-R346 PolarHBondContact O-N 2.97Å; A342-R346 PolarHBondContact O-NE 3.13Å
343	A	92.6	Very high	92.7	Very high	45 Å²	45	71.5 Å²	71.5	37%	0.372	32%	0.323	S	S	.	.	H	α-helix	trans	-70.8	-46.4	172.8	0	0	0	0	0	112.2	R339 L340 E341 R346 Y347	R339-A343 VanDerWaalsContact O-CB 3.31Å; R339-A343 WeakPolarHBondContact O-CB 3.24Å; R339-A343 PolarHBondContact O-N 3.19Å; L340-A343 PolarHBondContact O-N 3.05Å; E341-A343 VanDerWaalsContact C-N 3.27Å; E341-A343 PolarHBondContact O-N 3.25Å; A343-R346 PolarHBondContact O-N 3.48Å; A343-Y347 PolarHBondContact O-N 3.48Å
344	R	94.6	Very high	92.7	Very high	109 Å²	109	68.4 Å²	68.4	41%	0.411	32%	0.322	S	S	.	.	H	α-helix	trans	-56.8	-51	173.6	-76.6	-177.1	164.7	-157	-6.3	110.8	L340 E341 R346 Y347 I348 E369 V373	L340-R344 PolarHBondContact O-N 2.84Å; E341-R344 PolarHBondContact O-N 3.25Å; R344-R346 PolarHBondContact O-N 2.62Å; R344-Y347 PolarHBondContact O-N 2.98Å; R344-I348 HydrophobicContact CB-CD1 4.47Å; R344-I348 WeakPolarHBondContact O-CD1 3.44Å; R344-I348 VanDerWaalsContact O-CG1 3.25Å; R344-I348 WeakPolarHBondContact O-CG1 3.32Å; R344-I348 PolarHBondContact O-N 3.13Å; R344-E369 IonicContact CZ-OE2 2.78Å; R344-E369 IonicContact NH1-OE1 3.14Å; R344-E369 PolarHBondContact NH1-OE1 3.24Å; R344-E369 IonicContact NH1-OE2 3.73Å; R344-E369 PolarHBondContact NH1-OE2 3.39Å; R344-V373 HydrophobicContact CB-CG1 3.73Å
345	F	94.6	Very high	92.9	Very high	5 Å²	5	67.7 Å²	67.7	2%	0.022	32%	0.316	C	S	.	.	H	α-helix	trans	-53.3	-51.5	177.1	165.7	-110.5	0	0	0	112.1	E341 Y347 I348 N349 Y374 Y378 Q381 Y545	E341-F345 WeakPolarHBondContact O-CB 3.48Å; E341-F345 PolarHBondContact O-N 3.09Å; F345-Y347 VanDerWaalsContact C-N 3.34Å; F345-Y347 PolarHBondContact O-N 2.92Å; F345-I348 PolarHBondContact O-N 3.16Å; F345-N349 HydrophobicContact CE2-CB 4.24Å; F345-N349 HydrophobicContact CZ-CB 4.39Å; F345-N349 VanDerWaalsContact O-CB 3.23Å; F345-N349 WeakPolarHBondContact O-CB 3.32Å; F345-N349 PolarHBondContact O-N 2.91Å; F345-Y374 HydrophobicContact CD2-CD2 4.16Å; F345-Y374 AromaticContact CE2-CD2 3.9Å; F345-Y374 HydrophobicContact CE2-CD2 3.9Å; F345-Y374 HydrophobicContact CE2-CE2 4.02Å; F345-Y378 VanDerWaalsContact CE2-N 3.29Å; F345-Q381 HydrophobicContact CE1-CG 3.85Å; F345-Q381 HydrophobicContact CZ-CG 4.11Å; F345-Y545 HydrophobicContact CE1-CD2 4.22Å; F345-Y545 AromaticContact CZ-CD2 4Å; F345-Y545 HydrophobicContact CZ-CD2 4Å; F345-Y545 HydrophobicContact CZ-CE2 4.07Å
346	R	93.4	Very high	93.2	Very high	68 Å²	68	62.8 Å²	62.8	26%	0.257	30%	0.304	S	S	.	.	H	α-helix	trans	-60.4	-42.6	-179.7	-76.3	175.9	-69.6	-165.2	5	111.9	A342 A343 R344 E350	A342-R346 WeakPolarHBondContact O-CB 3.49Å; A342-R346 VanDerWaalsContact O-CG 3.31Å; A342-R346 WeakPolarHBondContact O-CG 3.41Å; A342-R346 PolarHBondContact O-N 2.97Å; A342-R346 PolarHBondContact O-NE 3.13Å; A343-R346 PolarHBondContact O-N 3.48Å; R344-R346 PolarHBondContact O-N 2.62Å; R346-E350 VanDerWaalsContact O-CB 3.28Å; R346-E350 WeakPolarHBondContact O-CB 3.09Å; R346-E350 PolarHBondContact O-N 3.21Å
347	Y	94.2	Very high	93.3	Very high	131 Å²	131	57.4 Å²	57.4	51%	0.514	28%	0.279	S	S	.	.	H	α-helix	trans	-62.3	-47.6	175.6	172.7	-97.3	0	0	0	112.6	A343 R344 F345 E350 R351	A343-Y347 PolarHBondContact O-N 3.48Å; R344-Y347 PolarHBondContact O-N 2.98Å; F345-Y347 VanDerWaalsContact C-N 3.34Å; F345-Y347 PolarHBondContact O-N 2.92Å; Y347-E350 PolarHBondContact O-N 3Å; Y347-R351 WeakPolarHBondContact O-CB 3.45Å; Y347-R351 PolarHBondContact O-N 3.12Å; Y347-R351 PolarHBondContact OH-NH1 3.25Å
348	I	95.8	Very high	93.6	Very high	8 Å²	8	53.7 Å²	53.7	4%	0.041	27%	0.271	C	S	.	.	H	α-helix	trans	-61.3	-51.7	179	-63.8	157.8	0	0	0	109.8	R344 F345 E350 R351 L352 M363 F364 A370 V373 Y374	R344-I348 HydrophobicContact CB-CD1 4.47Å; R344-I348 WeakPolarHBondContact O-CD1 3.44Å; R344-I348 VanDerWaalsContact O-CG1 3.25Å; R344-I348 WeakPolarHBondContact O-CG1 3.32Å; R344-I348 PolarHBondContact O-N 3.13Å; F345-I348 PolarHBondContact O-N 3.16Å; I348-E350 VanDerWaalsContact C-N 3.35Å; I348-E350 PolarHBondContact O-N 3.31Å; I348-R351 WeakPolarHBondContact O-CB 3.46Å; I348-R351 PolarHBondContact O-N 2.84Å; I348-R351 VanDerWaalsContact O-N 3.1Å; I348-L352 HydrophobicContact CG2-CD1 3.98Å; I348-L352 HydrophobicContact CG2-CG 4.25Å; I348-L352 VanDerWaalsContact O-CG 3.31Å; I348-L352 WeakPolarHBondContact O-CG 3.41Å; I348-L352 PolarHBondContact O-N 3.45Å; I348-M363 HydrophobicContact CB-CE 4.2Å; I348-M363 HydrophobicContact CG1-CE 3.79Å; I348-M363 HydrophobicContact CG2-CE 3.91Å; I348-F364 HydrophobicContact CG2-CE1 4.24Å; I348-F364 HydrophobicContact CG2-CZ 4.49Å; I348-A370 HydrophobicContact CD1-CB 3.89Å; I348-A370 HydrophobicContact CG1-CB 4.34Å; I348-V373 HydrophobicContact CD1-CB 4.01Å; I348-V373 HydrophobicContact CD1-CG1 3.8Å; I348-Y374 HydrophobicContact CG2-CD2 4.36Å; I348-Y374 HydrophobicContact CG2-CG 4.49Å
349	N	95.8	Very high	94	Very high	3 Å²	3	53.2 Å²	53.2	2%	0.016	27%	0.269	C	S	.	.	H	α-helix	trans	-56.9	-43.1	178.2	169.7	88.5	0	0	0	112.9	F345 L352 Y353 Y374 C543 Y545	F345-N349 HydrophobicContact CE2-CB 4.24Å; F345-N349 HydrophobicContact CZ-CB 4.39Å; F345-N349 VanDerWaalsContact O-CB 3.23Å; F345-N349 WeakPolarHBondContact O-CB 3.32Å; F345-N349 PolarHBondContact O-N 2.91Å; N349-L352 PolarHBondContact O-N 2.77Å; N349-Y353 VanDerWaalsContact O-CD2 3.23Å; N349-Y353 WeakPolarHBondContact O-CD2 3.49Å; N349-Y353 PolarHBondContact O-N 2.93Å; N349-Y353 WeakPolarHBondContact OD1-CE2 3.24Å; N349-Y374 HydrophobicContact CB-CD2 4.46Å; N349-Y374 HydrophobicContact CB-CE2 4.29Å; N349-C543 PolarHBondContact ND2-O 3.1Å; N349-Y545 WeakPolarHBondContact OD1-CE2 3.48Å
350	E	93.6	Very high	94.3	Very high	68 Å²	68	49.1 Å²	49.1	32%	0.318	26%	0.255	S	S	.	.	H	α-helix	trans	-65	-38.9	176	-174.5	169.1	166.1	0	0	111.9	R346 Y347 I348 Y353 S354 R548	R346-E350 VanDerWaalsContact O-CB 3.28Å; R346-E350 WeakPolarHBondContact O-CB 3.09Å; R346-E350 PolarHBondContact O-N 3.21Å; Y347-E350 PolarHBondContact O-N 3Å; I348-E350 VanDerWaalsContact C-N 3.35Å; I348-E350 PolarHBondContact O-N 3.31Å; E350-Y353 PolarHBondContact O-N 2.91Å; E350-S354 WeakPolarHBondContact O-CB 3.08Å; E350-S354 PolarHBondContact O-N 2.84Å; E350-S354 PolarHBondContact O-OG 3.39Å; E350-R548 IonicContact OE1-NH2 3.85Å; E350-R548 PolarHBondContact OE1-NH2 3.19Å; E350-R548 IonicContact OE2-CZ 2.7Å; E350-R548 IonicContact OE2-NH2 3.13Å; E350-R548 PolarHBondContact OE2-NH2 3.07Å
351	R	94.8	Very high	94.5	Very high	94 Å²	94	47.9 Å²	47.9	36%	0.355	24%	0.243	S	C	.	.	H	α-helix	trans	-68.2	-38.9	175.7	-174.7	164	170.9	174.5	-7.2	112.3	Y347 I348 Y353 S354 T355 M363	Y347-R351 WeakPolarHBondContact O-CB 3.45Å; Y347-R351 PolarHBondContact O-N 3.12Å; Y347-R351 PolarHBondContact OH-NH1 3.25Å; I348-R351 WeakPolarHBondContact O-CB 3.46Å; I348-R351 PolarHBondContact O-N 2.84Å; I348-R351 VanDerWaalsContact O-N 3.1Å; R351-Y353 VanDerWaalsContact C-N 3.3Å; R351-Y353 PolarHBondContact O-N 2.86Å; R351-S354 PolarHBondContact O-N 3.16Å; R351-T355 HydrophobicContact CG-CG2 4.17Å; R351-T355 PolarHBondContact O-N 2.65Å; R351-T355 PolarHBondContact O-OG1 3.1Å; R351-M363 VanDerWaalsContact CD-SD 3.54Å; R351-M363 HydrophobicContact CG-SD 3.98Å; R351-M363 PolarHBondContact NE-SD 3Å
352	L	96	Very high	94.9	Very high	7 Å²	7	49 Å²	49	4%	0.037	24%	0.243	C	C	.	.	H	α-helix	trans	-61.8	-32.7	174.8	-70.1	173.6	0	0	0	112.9	I348 N349 A360 F364 Y374 M461 G462	I348-L352 HydrophobicContact CG2-CD1 3.98Å; I348-L352 HydrophobicContact CG2-CG 4.25Å; I348-L352 VanDerWaalsContact O-CG 3.31Å; I348-L352 WeakPolarHBondContact O-CG 3.41Å; I348-L352 PolarHBondContact O-N 3.45Å; N349-L352 PolarHBondContact O-N 2.77Å; L352-A360 HydrophobicContact CD2-CB 3.59Å; L352-F364 HydrophobicContact CD1-CZ 4Å; L352-F364 HydrophobicContact CD2-CE2 3.84Å; L352-F364 HydrophobicContact CD2-CZ 3.82Å; L352-F364 HydrophobicContact CG-CZ 4.43Å; L352-Y374 HydrophobicContact CD1-CD1 4.37Å; L352-Y374 HydrophobicContact CD1-CD2 3.68Å; L352-Y374 HydrophobicContact CD1-CE1 4.41Å; L352-Y374 HydrophobicContact CD1-CE2 3.73Å; L352-Y374 HydrophobicContact CD1-CG 4.03Å; L352-M461 HydrophobicContact CB-CE 3.61Å; L352-M461 HydrophobicContact CB-SD 4.14Å; L352-M461 HydrophobicContact CD1-CE 3.83Å; L352-M461 HydrophobicContact CD1-SD 4Å; L352-M461 HydrophobicContact CG-CE 4.39Å; L352-G462 WeakPolarHBondContact O-CA 3.46Å; L352-G462 PolarHBondContact O-N 3.1Å
353	Y	95.2	Very high	95.2	Very high	15 Å²	15	48.7 Å²	48.7	6%	0.059	24%	0.239	C	C	.	.	H	α-helix	trans	-83.7	-14.3	172.8	-72.4	-58.6	0	0	0	114.6	N349 E350 R351 M461 P542 C543	N349-Y353 VanDerWaalsContact O-CD2 3.23Å; N349-Y353 WeakPolarHBondContact O-CD2 3.49Å; N349-Y353 PolarHBondContact O-N 2.93Å; N349-Y353 WeakPolarHBondContact OD1-CE2 3.24Å; E350-Y353 PolarHBondContact O-N 2.91Å; R351-Y353 VanDerWaalsContact C-N 3.3Å; R351-Y353 PolarHBondContact O-N 2.86Å; Y353-M461 HydrophobicContact CD1-CB 4.21Å; Y353-M461 HydrophobicContact CD1-CE 4.37Å; Y353-M461 HydrophobicContact CD1-CG 4.35Å; Y353-M461 HydrophobicContact CD2-CE 4.05Å; Y353-M461 HydrophobicContact CE1-CB 4.05Å; Y353-M461 HydrophobicContact CE1-CE 3.92Å; Y353-M461 HydrophobicContact CE1-CG 3.72Å; Y353-M461 HydrophobicContact CE2-CE 3.59Å; Y353-M461 HydrophobicContact CG-CE 4.41Å; Y353-P542 HydrophobicContact CD2-CB 3.87Å; Y353-P542 HydrophobicContact CG-CB 3.88Å; Y353-C543 HydrophobicContact CE2-CB 3.6Å; Y353-C543 WeakPolarHBondContact CE2-O 3.28Å; Y353-C543 WeakPolarHBondContact OH-CB 3.39Å
354	S	93.5	Very high	95.4	Very high	71 Å²	71	47.1 Å²	47.1	50%	0.497	22%	0.224	S	C	.	.	H	α-helix	trans	-107.3	1.9	-171.4	-51.9	0	0	0	0	114.3	E350 R351	E350-S354 WeakPolarHBondContact O-CB 3.08Å; E350-S354 PolarHBondContact O-N 2.84Å; E350-S354 PolarHBondContact O-OG 3.39Å; R351-S354 PolarHBondContact O-N 3.16Å
355	T	95.3	Very high	95.3	Very high	34 Å²	34	48 Å²	48	21%	0.209	23%	0.232	C	C	.	.	S	Bend	trans	-130.7	168.5	-177.4	58.5	0	0	0	0	111.2	R351 E359 G462 T463	R351-T355 HydrophobicContact CG-CG2 4.17Å; R351-T355 PolarHBondContact O-N 2.65Å; R351-T355 PolarHBondContact O-OG1 3.1Å; T355-E359 HydrophobicContact CG2-CB 4.48Å; T355-G462 CarbonylContact O-C 3.5Å; T355-G462 WeakPolarHBondContact O-CA 3.35Å; T355-T463 PolarHBondContact O-N 2.8Å; T355-T463 PolarHBondContact O-OG1 2.79Å
356	A	96.2	Very high	95.4	Very high	35 Å²	35	54.4 Å²	54.4	29%	0.289	26%	0.262	S	S	.	.			trans	-77.1	158.2	171.9	0	0	0	0	0	111.3	G358 E359 A360 N464	A356-G358 VanDerWaalsContact C-N 3.27Å; A356-G358 PolarHBondContact O-N 2.91Å; A356-E359 HydrophobicContact CB-CG 4.4Å; A356-E359 WeakPolarHBondContact O-CB 3.43Å; A356-E359 PolarHBondContact O-N 3.44Å; A356-A360 PolarHBondContact O-N 3.42Å; A356-A360 VanDerWaalsContact O-N 3.11Å; A356-N464 WeakPolarHBondContact CA-OD1 3.5Å
357	S	96.4	Very high	95.5	Very high	9 Å²	9	54.4 Å²	54.4	6%	0.063	27%	0.267	C	S	.	.	H	α-helix	trans	-55.6	-37.4	179.7	56.3	0	0	0	0	114	E359 A360 R361 D440 N464	S357-E359 VanDerWaalsContact C-N 3.3Å; S357-E359 PolarHBondContact O-N 3.26Å; S357-A360 WeakPolarHBondContact O-CB 3.38Å; S357-A360 PolarHBondContact O-N 3.06Å; S357-R361 WeakPolarHBondContact O-CB 3.48Å; S357-R361 PolarHBondContact O-N 3.37Å; S357-D440 VanDerWaalsContact CB-OD1 3.28Å; S357-D440 WeakPolarHBondContact CB-OD1 3.26Å; S357-D440 WeakPolarHBondContact CB-OD2 2.93Å; S357-D440 PolarHBondContact OG-OD1 3.32Å; S357-D440 PolarHBondContact OG-OD2 3.09Å; S357-N464 PolarHBondContact N-OD1 2.78Å; S357-N464 PolarHBondContact OG-ND2 3.46Å
358	G	95.9	Very high	95.5	Very high	36 Å²	36	52.1 Å²	52.1	37%	0.371	27%	0.269	S	S	.	.	H	α-helix	trans	-63.8	-31.2	174.8	0	0	0	0	0	114	A356 R362 D440	A356-G358 VanDerWaalsContact C-N 3.27Å; A356-G358 PolarHBondContact O-N 2.91Å; G358-R362 PolarHBondContact O-N 3.03Å; G358-D440 PolarHBondContact N-OD2 3.38Å
359	E	96.5	Very high	95.4	Very high	84 Å²	84	55.9 Å²	55.9	39%	0.393	29%	0.286	S	S	.	.	H	α-helix	trans	-73.6	-41.6	174.3	-60.7	-65.2	102.9	0	0	111	T355 A356 S357 R361 R362 M363	T355-E359 HydrophobicContact CG2-CB 4.48Å; A356-E359 HydrophobicContact CB-CG 4.4Å; A356-E359 WeakPolarHBondContact O-CB 3.43Å; A356-E359 PolarHBondContact O-N 3.44Å; S357-E359 VanDerWaalsContact C-N 3.3Å; S357-E359 PolarHBondContact O-N 3.26Å; E359-R361 VanDerWaalsContact C-N 3.33Å; E359-R362 PolarHBondContact O-N 3.02Å; E359-R362 IonicContact OE1-CZ 2.75Å; E359-R362 IonicContact OE1-NH1 2.71Å; E359-R362 PolarHBondContact OE1-NH1 2.91Å; E359-R362 IonicContact OE1-NH2 3.45Å; E359-R362 PolarHBondContact OE1-NH2 3.14Å; E359-R362 IonicContact OE2-CZ 2.72Å; E359-R362 IonicContact OE2-NH1 2.73Å; E359-R362 IonicContact OE2-NH2 3.51Å; E359-R362 PolarHBondContact OE2-NH2 2.9Å; E359-M363 WeakPolarHBondContact O-CB 3.18Å; E359-M363 PolarHBondContact O-N 2.95Å
360	A	96.3	Very high	95.3	Very high	5 Å²	5	55.9 Å²	55.9	4%	0.041	29%	0.286	C	S	.	.	H	α-helix	trans	-62.4	-40	173	0	0	0	0	0	111.8	L352 A356 S357 M363 F364 L429	L352-A360 HydrophobicContact CD2-CB 3.59Å; A356-A360 PolarHBondContact O-N 3.42Å; A356-A360 VanDerWaalsContact O-N 3.11Å; S357-A360 WeakPolarHBondContact O-CB 3.38Å; S357-A360 PolarHBondContact O-N 3.06Å; A360-M363 WeakPolarHBondContact O-CB 3.5Å; A360-M363 PolarHBondContact O-N 2.87Å; A360-F364 WeakPolarHBondContact O-CD2 3.49Å; A360-F364 PolarHBondContact O-N 2.72Å; A360-L429 HydrophobicContact CB-CD1 3.85Å
361	R	95.9	Very high	95.4	Very high	79 Å²	79	52.8 Å²	52.8	30%	0.298	27%	0.272	S	S	.	.	H	α-helix	trans	-62	-47.1	174.4	-162.7	175.4	-166.1	-136.1	2.9	111.3	S357 E359 M363 F364 Q365 L429 V438	S357-R361 WeakPolarHBondContact O-CB 3.48Å; S357-R361 PolarHBondContact O-N 3.37Å; E359-R361 VanDerWaalsContact C-N 3.33Å; R361-M363 VanDerWaalsContact C-N 3.3Å; R361-M363 PolarHBondContact O-N 3.15Å; R361-F364 PolarHBondContact O-N 3.48Å; R361-Q365 VanDerWaalsContact O-CG 3.27Å; R361-Q365 WeakPolarHBondContact O-CG 3.31Å; R361-Q365 PolarHBondContact O-N 2.88Å; R361-L429 HydrophobicContact CB-CD2 4.04Å; R361-L429 HydrophobicContact CG-CD2 4.12Å; R361-V438 PolarHBondContact NH2-O 3.31Å
362	R	96.5	Very high	95.3	Very high	102 Å²	102	54.3 Å²	54.3	39%	0.385	28%	0.278	S	S	.	.	H	α-helix	trans	-62.8	-37.5	175.8	-170.3	173.8	68.9	-100.4	0.3	111.8	G358 E359 Q365 Q366	G358-R362 PolarHBondContact O-N 3.03Å; E359-R362 PolarHBondContact O-N 3.02Å; E359-R362 IonicContact OE1-CZ 2.75Å; E359-R362 IonicContact OE1-NH1 2.71Å; E359-R362 PolarHBondContact OE1-NH1 2.91Å; E359-R362 IonicContact OE1-NH2 3.45Å; E359-R362 PolarHBondContact OE1-NH2 3.14Å; E359-R362 IonicContact OE2-CZ 2.72Å; E359-R362 IonicContact OE2-NH1 2.73Å; E359-R362 IonicContact OE2-NH2 3.51Å; E359-R362 PolarHBondContact OE2-NH2 2.9Å; R362-Q365 PolarHBondContact O-N 3.19Å; R362-Q366 HydrophobicContact CG-CG 4.32Å; R362-Q366 WeakPolarHBondContact O-CB 3.2Å; R362-Q366 VanDerWaalsContact O-CG 3.29Å; R362-Q366 WeakPolarHBondContact O-CG 3.34Å; R362-Q366 PolarHBondContact O-N 2.87Å
363	M	96.1	Very high	95.3	Very high	15 Å²	15	54.2 Å²	54.2	7%	0.074	28%	0.278	C	S	.	.	H	α-helix	trans	-59.3	-48.4	174.8	176.4	173.8	169	0	0	112	I348 R351 E359 A360 R361 Q365 Q366 D367 A370	I348-M363 HydrophobicContact CB-CE 4.2Å; I348-M363 HydrophobicContact CG1-CE 3.79Å; I348-M363 HydrophobicContact CG2-CE 3.91Å; R351-M363 VanDerWaalsContact CD-SD 3.54Å; R351-M363 HydrophobicContact CG-SD 3.98Å; R351-M363 PolarHBondContact NE-SD 3Å; E359-M363 WeakPolarHBondContact O-CB 3.18Å; E359-M363 PolarHBondContact O-N 2.95Å; A360-M363 WeakPolarHBondContact O-CB 3.5Å; A360-M363 PolarHBondContact O-N 2.87Å; R361-M363 VanDerWaalsContact C-N 3.3Å; R361-M363 PolarHBondContact O-N 3.15Å; M363-Q365 VanDerWaalsContact C-N 3.33Å; M363-Q365 PolarHBondContact O-N 2.63Å; M363-Q366 PolarHBondContact O-N 3.37Å; M363-D367 PolarHBondContact O-N 2.94Å; M363-A370 HydrophobicContact CE-CB 4.3Å
364	F	95.8	Very high	95.3	Very high	12 Å²	12	54.4 Å²	54.4	5%	0.053	28%	0.278	C	S	.	.	H	α-helix	trans	-72.9	-21.7	177.3	-65.4	-44.3	0	0	0	114.3	I348 L352 A360 R361 D367 A370 F371 L429	I348-F364 HydrophobicContact CG2-CE1 4.24Å; I348-F364 HydrophobicContact CG2-CZ 4.49Å; L352-F364 HydrophobicContact CD1-CZ 4Å; L352-F364 HydrophobicContact CD2-CE2 3.84Å; L352-F364 HydrophobicContact CD2-CZ 3.82Å; L352-F364 HydrophobicContact CG-CZ 4.43Å; A360-F364 WeakPolarHBondContact O-CD2 3.49Å; A360-F364 PolarHBondContact O-N 2.72Å; R361-F364 PolarHBondContact O-N 3.48Å; F364-D367 CarbonylContact O-C 3.59Å; F364-A370 HydrophobicContact CD1-CB 4.22Å; F364-A370 HydrophobicContact CE1-CB 4.26Å; F364-F371 HydrophobicContact CD1-CB 3.74Å; F364-F371 HydrophobicContact CD1-CD2 4.35Å; F364-F371 HydrophobicContact CD2-CD2 4.08Å; F364-F371 HydrophobicContact CE1-CB 3.96Å; F364-F371 HydrophobicContact CE1-CD2 4.24Å; F364-F371 AromaticContact CE2-CD2 3.94Å; F364-F371 HydrophobicContact CE2-CD2 3.94Å; F364-F371 HydrophobicContact CG-CB 4.2Å; F364-F371 HydrophobicContact CG-CD2 4.27Å; F364-F371 HydrophobicContact CZ-CD2 4Å; F364-L429 HydrophobicContact CD2-CB 3.92Å; F364-L429 HydrophobicContact CD2-CD1 4.02Å; F364-L429 HydrophobicContact CE2-CB 4.42Å; F364-L429 HydrophobicContact CE2-CD1 4.08Å
365	Q	94.5	Very high	95.3	Very high	126 Å²	126	52.1 Å²	52.1	59%	0.589	26%	0.26	S	S	*	.	H	α-helix	trans	-74.5	-31.3	170	-72.8	172.2	-36.4	0	0	112.6	R361 R362 M363	R361-Q365 VanDerWaalsContact O-CG 3.27Å; R361-Q365 WeakPolarHBondContact O-CG 3.31Å; R361-Q365 PolarHBondContact O-N 2.88Å; R362-Q365 PolarHBondContact O-N 3.19Å; M363-Q365 VanDerWaalsContact C-N 3.33Å; M363-Q365 PolarHBondContact O-N 2.63Å
366	Q	96	Very high	95.2	Very high	140 Å²	140	56 Å²	56	65%	0.654	27%	0.27	S	S	*	.	H	α-helix	trans	-83.8	-33.4	176.8	-72	176.2	-29.9	0	0	112.5	R362 M363	R362-Q366 HydrophobicContact CG-CG 4.32Å; R362-Q366 WeakPolarHBondContact O-CB 3.2Å; R362-Q366 VanDerWaalsContact O-CG 3.29Å; R362-Q366 WeakPolarHBondContact O-CG 3.34Å; R362-Q366 PolarHBondContact O-N 2.87Å; M363-Q366 PolarHBondContact O-N 3.37Å
367	D	95.4	Very high	95	Very high	68 Å²	68	55 Å²	55	36%	0.364	26%	0.263	S	S	.	.			trans	-132.8	91.3	176.3	-177.8	-7.8	0	0	0	110.2	M363 F364 E369 A370	M363-D367 PolarHBondContact O-N 2.94Å; F364-D367 CarbonylContact O-C 3.59Å; D367-E369 VanDerWaalsContact C-N 3.25Å; D367-E369 PolarHBondContact O-N 3.32Å; D367-E369 WeakPolarHBondContact OD1-CA 3.4Å; D367-E369 VanDerWaalsContact OD1-CB 3.3Å; D367-E369 WeakPolarHBondContact OD1-CB 3.21Å; D367-E369 PolarHBondContact OD1-N 2.86Å; D367-A370 HydrophobicContact CB-CB 4.09Å; D367-A370 WeakPolarHBondContact O-CB 3.44Å; D367-A370 PolarHBondContact O-N 2.89Å; D367-A370 PolarHBondContact OD1-N 3.1Å
368	P	93.5	Very high	94.8	Very high	83 Å²	83	56.3 Å²	56.3	54%	0.539	27%	0.267	S	S	.	.	H	α-helix	trans	-67.6	-20.4	173.6	-22.6	35.2	0	0	0	113.9
369	E	93.8	Very high	94.6	Very high	88 Å²	88	57.6 Å²	57.6	41%	0.411	27%	0.268	S	S	.	.	H	α-helix	trans	-69.7	-38.1	176.3	-157	-138.1	128.9	0	0	110.2	R344 D367 F371 W372 V373	R344-E369 IonicContact CZ-OE2 2.78Å; R344-E369 IonicContact NH1-OE1 3.14Å; R344-E369 PolarHBondContact NH1-OE1 3.24Å; R344-E369 IonicContact NH1-OE2 3.73Å; R344-E369 PolarHBondContact NH1-OE2 3.39Å; D367-E369 VanDerWaalsContact C-N 3.25Å; D367-E369 PolarHBondContact O-N 3.32Å; D367-E369 WeakPolarHBondContact OD1-CA 3.4Å; D367-E369 VanDerWaalsContact OD1-CB 3.3Å; D367-E369 WeakPolarHBondContact OD1-CB 3.21Å; D367-E369 PolarHBondContact OD1-N 2.86Å; E369-F371 PolarHBondContact O-N 3.36Å; E369-F371 VanDerWaalsContact O-N 3.15Å; E369-W372 PolarHBondContact O-N 3.34Å; E369-V373 HydrophobicContact CG-CG2 4.38Å; E369-V373 WeakPolarHBondContact O-CG2 3.44Å; E369-V373 PolarHBondContact O-N 3.13Å; E369-V373 WeakPolarHBondContact OE1-CG2 3.43Å
370	A	94.3	Very high	94.2	Very high	2 Å²	2	55.4 Å²	55.4	2%	0.017	26%	0.264	C	S	.	.	H	α-helix	trans	-56.1	-30.9	178	0	0	0	0	0	113.6	I348 M363 F364 D367 Y374	I348-A370 HydrophobicContact CD1-CB 3.89Å; I348-A370 HydrophobicContact CG1-CB 4.34Å; M363-A370 HydrophobicContact CE-CB 4.3Å; F364-A370 HydrophobicContact CD1-CB 4.22Å; F364-A370 HydrophobicContact CE1-CB 4.26Å; D367-A370 HydrophobicContact CB-CB 4.09Å; D367-A370 WeakPolarHBondContact O-CB 3.44Å; D367-A370 PolarHBondContact O-N 2.89Å; D367-A370 PolarHBondContact OD1-N 3.1Å; A370-Y374 VanDerWaalsContact O-CB 3.28Å; A370-Y374 WeakPolarHBondContact O-CB 3.17Å; A370-Y374 PolarHBondContact O-N 2.95Å
371	F	94.6	Very high	93.9	Very high	3 Å²	3	57.3 Å²	57.3	1%	0.013	27%	0.272	C	S	.	.	H	α-helix	trans	-66	-45.2	174.5	-176.8	-108.4	0	0	0	111.5	F364 E369 Y374 H375 A430 T432	F364-F371 HydrophobicContact CD1-CB 3.74Å; F364-F371 HydrophobicContact CD1-CD2 4.35Å; F364-F371 HydrophobicContact CD2-CD2 4.08Å; F364-F371 HydrophobicContact CE1-CB 3.96Å; F364-F371 HydrophobicContact CE1-CD2 4.24Å; F364-F371 AromaticContact CE2-CD2 3.94Å; F364-F371 HydrophobicContact CE2-CD2 3.94Å; F364-F371 HydrophobicContact CG-CB 4.2Å; F364-F371 HydrophobicContact CG-CD2 4.27Å; F364-F371 HydrophobicContact CZ-CD2 4Å; E369-F371 PolarHBondContact O-N 3.36Å; E369-F371 VanDerWaalsContact O-N 3.15Å; F371-Y374 WeakPolarHBondContact O-CB 3.07Å; F371-Y374 PolarHBondContact O-N 3.16Å; F371-H375 AromaticContact CD2-CD2 3.95Å; F371-H375 AromaticContact CE1-CD2 3.73Å; F371-H375 AromaticContact CE2-CD2 3.6Å; F371-H375 AromaticContact CE2-NE2 3.34Å; F371-H375 VanDerWaalsContact CE2-NE2 3.34Å; F371-H375 WeakPolarHBondContact CE2-NE2 3.46Å; F371-H375 AromaticContact CZ-CD2 3.49Å; F371-H375 VanDerWaalsContact CZ-CD2 3.49Å; F371-H375 WeakPolarHBondContact CZ-CD2 3.39Å; F371-H375 AromaticContact CZ-NE2 3.31Å; F371-H375 VanDerWaalsContact CZ-NE2 3.31Å; F371-H375 WeakPolarHBondContact CZ-NE2 3.38Å; F371-H375 PolarHBondContact O-CD2 3.29Å; F371-H375 PolarHBondContact O-N 3.5Å; F371-A430 HydrophobicContact CB-CB 4.49Å; F371-A430 HydrophobicContact CD1-CB 3.77Å; F371-A430 HydrophobicContact CD2-CB 3.86Å; F371-A430 HydrophobicContact CE1-CB 3.81Å; F371-A430 HydrophobicContact CE2-CB 3.91Å; F371-A430 HydrophobicContact CG-CB 3.79Å; F371-A430 HydrophobicContact CZ-CB 3.88Å; F371-A430 WeakPolarHBondContact CZ-O 3.35Å; F371-T432 HydrophobicContact CE1-CG2 3.64Å; F371-T432 HydrophobicContact CZ-CG2 3.89Å
372	W	94.3	Very high	93.5	Very high	127 Å²	127	54.1 Å²	54.1	48%	0.481	26%	0.262	S	S	.	.	H	α-helix	trans	-70.5	-36.3	176.4	-65.1	105.3	0	0	0	112.6	E369 Y374 H375 R376	E369-W372 PolarHBondContact O-N 3.34Å; W372-Y374 VanDerWaalsContact C-N 3.34Å; W372-H375 PolarHBondContact O-N 3.44Å; W372-R376 WeakPolarHBondContact O-CB 3.33Å; W372-R376 VanDerWaalsContact O-CG 3.27Å; W372-R376 WeakPolarHBondContact O-CG 3.35Å; W372-R376 PolarHBondContact O-N 2.93Å
373	V	94.5	Very high	93.1	Very high	5 Å²	5	56.7 Å²	56.7	3%	0.03	28%	0.278	C	S	.	.	H	α-helix	trans	-63.4	-40.7	171.4	176.7	0	0	0	0	110.9	R344 I348 E369 G377	R344-V373 HydrophobicContact CB-CG1 3.73Å; I348-V373 HydrophobicContact CD1-CB 4.01Å; I348-V373 HydrophobicContact CD1-CG1 3.8Å; E369-V373 HydrophobicContact CG-CG2 4.38Å; E369-V373 WeakPolarHBondContact O-CG2 3.44Å; E369-V373 PolarHBondContact O-N 3.13Å; E369-V373 WeakPolarHBondContact OE1-CG2 3.43Å; V373-G377 PolarHBondContact O-N 3.42Å; V373-G377 VanDerWaalsContact O-N 3.08Å
374	Y	95.6	Very high	92.7	Very high	19 Å²	19	62.1 Å²	62.1	8%	0.075	30%	0.298	C	S	.	.	H	α-helix	trans	-60.3	-52.6	173.4	174	-105.9	0	0	0	111.5	F345 I348 N349 L352 A370 F371 W372 R376 G377 Y378 M461	F345-Y374 HydrophobicContact CD2-CD2 4.16Å; F345-Y374 AromaticContact CE2-CD2 3.9Å; F345-Y374 HydrophobicContact CE2-CD2 3.9Å; F345-Y374 HydrophobicContact CE2-CE2 4.02Å; I348-Y374 HydrophobicContact CG2-CD2 4.36Å; I348-Y374 HydrophobicContact CG2-CG 4.49Å; N349-Y374 HydrophobicContact CB-CD2 4.46Å; N349-Y374 HydrophobicContact CB-CE2 4.29Å; L352-Y374 HydrophobicContact CD1-CD1 4.37Å; L352-Y374 HydrophobicContact CD1-CD2 3.68Å; L352-Y374 HydrophobicContact CD1-CE1 4.41Å; L352-Y374 HydrophobicContact CD1-CE2 3.73Å; L352-Y374 HydrophobicContact CD1-CG 4.03Å; A370-Y374 VanDerWaalsContact O-CB 3.28Å; A370-Y374 WeakPolarHBondContact O-CB 3.17Å; A370-Y374 PolarHBondContact O-N 2.95Å; F371-Y374 WeakPolarHBondContact O-CB 3.07Å; F371-Y374 PolarHBondContact O-N 3.16Å; W372-Y374 VanDerWaalsContact C-N 3.34Å; Y374-R376 PolarHBondContact O-N 3.13Å; Y374-G377 PolarHBondContact O-N 3.4Å; Y374-Y378 WeakPolarHBondContact O-CB 3.17Å; Y374-Y378 PolarHBondContact O-N 3.4Å; Y374-M461 HydrophobicContact CE2-CE 3.99Å; Y374-M461 HydrophobicContact CE2-SD 4.46Å; Y374-M461 PolarHBondContact OH-SD 3.28Å; Y374-M461 VanDerWaalsContact OH-SD 3.34Å
375	H	93.8	Very high	92.4	Very high	23 Å²	23	63.3 Å²	63.3	11%	0.106	30%	0.302	C	S	.	.	H	α-helix	trans	-65.2	-37.5	-178.5	-85.5	-69.3	0	0	0	113.8	F371 W372 T379	F371-H375 AromaticContact CD2-CD2 3.95Å; F371-H375 AromaticContact CE1-CD2 3.73Å; F371-H375 AromaticContact CE2-CD2 3.6Å; F371-H375 AromaticContact CE2-NE2 3.34Å; F371-H375 VanDerWaalsContact CE2-NE2 3.34Å; F371-H375 WeakPolarHBondContact CE2-NE2 3.46Å; F371-H375 AromaticContact CZ-CD2 3.49Å; F371-H375 VanDerWaalsContact CZ-CD2 3.49Å; F371-H375 WeakPolarHBondContact CZ-CD2 3.39Å; F371-H375 AromaticContact CZ-NE2 3.31Å; F371-H375 VanDerWaalsContact CZ-NE2 3.31Å; F371-H375 WeakPolarHBondContact CZ-NE2 3.38Å; F371-H375 PolarHBondContact O-CD2 3.29Å; F371-H375 PolarHBondContact O-N 3.5Å; W372-H375 PolarHBondContact O-N 3.44Å; H375-T379 VanDerWaalsContact O-CB 3.3Å; H375-T379 WeakPolarHBondContact O-CB 3.23Å; H375-T379 PolarHBondContact O-N 2.96Å; H375-T379 PolarHBondContact O-OG1 2.96Å
376	R	92.5	Very high	92.2	Very high	114 Å²	114	62.6 Å²	62.6	43%	0.43	31%	0.308	S	S	.	.	H	α-helix	trans	-62.2	-48.2	173.6	-73.3	-171.4	-65.9	141.1	-3.3	111.2	E341 W372 Y374 T379 A380	E341-R376 IonicContact OE1-CZ 3.96Å; E341-R376 IonicContact OE1-NH1 2.85Å; E341-R376 PolarHBondContact OE1-NH1 3.26Å; E341-R376 IonicContact OE1-NH2 2.72Å; E341-R376 PolarHBondContact OE1-NH2 3Å; E341-R376 IonicContact OE2-CZ 2.65Å; E341-R376 IonicContact OE2-NH1 3.9Å; E341-R376 PolarHBondContact OE2-NH1 2.93Å; E341-R376 VanDerWaalsContact OE2-NH1 3.08Å; W372-R376 WeakPolarHBondContact O-CB 3.33Å; W372-R376 VanDerWaalsContact O-CG 3.27Å; W372-R376 WeakPolarHBondContact O-CG 3.35Å; W372-R376 PolarHBondContact O-N 2.93Å; Y374-R376 PolarHBondContact O-N 3.13Å; R376-T379 PolarHBondContact O-N 2.82Å; R376-A380 WeakPolarHBondContact O-CB 3.46Å; R376-A380 PolarHBondContact O-N 3.02Å; R376-A380 VanDerWaalsContact O-N 3.09Å
377	G	92.6	Very high	92	Very high	14 Å²	14	58 Å²	58	14%	0.144	30%	0.295	C	S	.	.	H	α-helix	trans	-63.7	-45.3	177.4	0	0	0	0	0	113.4	V373 Y374 T379 A380 Q381	V373-G377 PolarHBondContact O-N 3.42Å; V373-G377 VanDerWaalsContact O-N 3.08Å; Y374-G377 PolarHBondContact O-N 3.4Å; G377-T379 PolarHBondContact O-N 2.79Å; G377-A380 PolarHBondContact O-N 2.8Å; G377-Q381 WeakPolarHBondContact O-CG 3.37Å; G377-Q381 PolarHBondContact O-N 3.2Å; G377-Q381 VanDerWaalsContact O-N 3.09Å
378	Y	92.3	Very high	91.9	Very high	37 Å²	37	56.5 Å²	56.5	15%	0.145	29%	0.286	C	S	.	.	H	α-helix	trans	-58	-47.4	175.6	166.7	-99.1	0	0	0	111.8	F345 Y374 A380 Q381 V382 L458	F345-Y378 VanDerWaalsContact CE2-N 3.29Å; Y374-Y378 WeakPolarHBondContact O-CB 3.17Å; Y374-Y378 PolarHBondContact O-N 3.4Å; Y378-A380 VanDerWaalsContact C-N 3.35Å; Y378-A380 PolarHBondContact O-N 2.92Å; Y378-Q381 WeakPolarHBondContact O-CB 3.41Å; Y378-Q381 PolarHBondContact O-N 2.66Å; Y378-Q381 VanDerWaalsContact O-N 3.09Å; Y378-V382 HydrophobicContact CD2-CG2 4.07Å; Y378-V382 HydrophobicContact CE1-CG2 4.33Å; Y378-V382 HydrophobicContact CE2-CG2 3.63Å; Y378-V382 PolarHBondContact O-N 3.19Å; Y378-L458 HydrophobicContact CE2-CB 4.37Å; Y378-L458 HydrophobicContact CE2-CD1 4.01Å
379	T	91.3	Very high	92.1	Very high	64 Å²	64	52.5 Å²	52.5	39%	0.393	26%	0.261	S	S	.	.	H	α-helix	trans	-59.6	-46.3	178.8	-57.4	0	0	0	0	111	H375 R376 G377 Q381 V382 Q383	H375-T379 VanDerWaalsContact O-CB 3.3Å; H375-T379 WeakPolarHBondContact O-CB 3.23Å; H375-T379 PolarHBondContact O-N 2.96Å; H375-T379 PolarHBondContact O-OG1 2.96Å; R376-T379 PolarHBondContact O-N 2.82Å; G377-T379 PolarHBondContact O-N 2.79Å; T379-Q381 PolarHBondContact O-N 2.73Å; T379-V382 PolarHBondContact O-N 3.33Å; T379-Q383 HydrophobicContact CG2-CG 4.34Å; T379-Q383 WeakPolarHBondContact O-CB 3.35Å; T379-Q383 VanDerWaalsContact O-CG 3.29Å; T379-Q383 WeakPolarHBondContact O-CG 3.27Å; T379-Q383 PolarHBondContact O-N 2.81Å
380	A	89.6	Confident	92.2	Very high	37 Å²	37	49.1 Å²	49.1	31%	0.306	25%	0.245	S	C	.	.	H	α-helix	trans	-66.2	-19.4	177.6	0	0	0	0	0	114.2	R376 G377 Y378 R384	R376-A380 WeakPolarHBondContact O-CB 3.46Å; R376-A380 PolarHBondContact O-N 3.02Å; R376-A380 VanDerWaalsContact O-N 3.09Å; G377-A380 PolarHBondContact O-N 2.8Å; Y378-A380 VanDerWaalsContact C-N 3.35Å; Y378-A380 PolarHBondContact O-N 2.92Å; A380-R384 WeakPolarHBondContact O-CG 3.31Å; A380-R384 PolarHBondContact O-NE 2.93Å
381	Q	88.6	Confident	92.3	Very high	45 Å²	45	52.4 Å²	52.4	21%	0.21	26%	0.262	C	S	.	.	H	α-helix	trans	-81.9	-48.4	170.6	-68.5	-61.9	-39.7	0	0	112	F345 G377 Y378 T379 R384 W385 Y545	F345-Q381 HydrophobicContact CE1-CG 3.85Å; F345-Q381 HydrophobicContact CZ-CG 4.11Å; G377-Q381 WeakPolarHBondContact O-CG 3.37Å; G377-Q381 PolarHBondContact O-N 3.2Å; G377-Q381 VanDerWaalsContact O-N 3.09Å; Y378-Q381 WeakPolarHBondContact O-CB 3.41Å; Y378-Q381 PolarHBondContact O-N 2.66Å; Y378-Q381 VanDerWaalsContact O-N 3.09Å; T379-Q381 PolarHBondContact O-N 2.73Å; Q381-R384 PolarHBondContact O-N 3.31Å; Q381-W385 PolarHBondContact O-NE1 3.04Å; Q381-Y545 HydrophobicContact CB-CD1 3.62Å; Q381-Y545 HydrophobicContact CB-CE1 3.68Å; Q381-Y545 HydrophobicContact CB-CG 4.47Å; Q381-Y545 HydrophobicContact CG-CD1 3.6Å; Q381-Y545 HydrophobicContact CG-CE1 4.06Å; Q381-Y545 HydrophobicContact CG-CG 3.97Å
382	V	87.6	Confident	92.4	Very high	13 Å²	13	55 Å²	55	8%	0.079	28%	0.284	C	S	.	.	H	α-helix	trans	-71.6	-30.3	-174.8	177.4	0	0	0	0	112.1	Y378 T379 R384 W385 N388 L458	Y378-V382 HydrophobicContact CD2-CG2 4.07Å; Y378-V382 HydrophobicContact CE1-CG2 4.33Å; Y378-V382 HydrophobicContact CE2-CG2 3.63Å; Y378-V382 PolarHBondContact O-N 3.19Å; T379-V382 PolarHBondContact O-N 3.33Å; V382-R384 PolarHBondContact O-N 3.28Å; V382-R384 VanDerWaalsContact O-N 3.08Å; V382-W385 WeakPolarHBondContact O-CB 3.45Å; V382-W385 PolarHBondContact O-N 2.85Å; V382-W385 VanDerWaalsContact O-N 3.08Å; V382-N388 HydrophobicContact CG1-CB 4.15Å; V382-L458 HydrophobicContact CG2-CD1 4.32Å
383	Q	88.1	Confident	92.6	Very high	155 Å²	155	49.4 Å²	49.4	72%	0.724	26%	0.264	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.2	-20.4	171	-79.5	175.1	-14.4	0	0	114	T379	T379-Q383 HydrophobicContact CG2-CG 4.34Å; T379-Q383 WeakPolarHBondContact O-CB 3.35Å; T379-Q383 VanDerWaalsContact O-CG 3.29Å; T379-Q383 WeakPolarHBondContact O-CG 3.27Å; T379-Q383 PolarHBondContact O-N 2.81Å
384	R	87.5	Confident	92.8	Very high	130 Å²	130	49.8 Å²	49.8	49%	0.491	27%	0.265	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.3	3	-179.9	-53.3	177.6	-167.7	-157.8	-2.9	113.3	A380 Q381 V382	A380-R384 WeakPolarHBondContact O-CG 3.31Å; A380-R384 PolarHBondContact O-NE 2.93Å; Q381-R384 PolarHBondContact O-N 3.31Å; V382-R384 PolarHBondContact O-N 3.28Å; V382-R384 VanDerWaalsContact O-N 3.08Å
385	W	89.8	Confident	92.9	Very high	36 Å²	36	50.9 Å²	50.9	14%	0.136	28%	0.278	C	S	.	.	S	Bend	trans	-94.3	143.2	-177.7	-66.6	16.2	0	0	0	110.5	Q381 V382 A387 L458 V487 H517 F518 Y545	Q381-W385 PolarHBondContact O-NE1 3.04Å; V382-W385 WeakPolarHBondContact O-CB 3.45Å; V382-W385 PolarHBondContact O-N 2.85Å; V382-W385 VanDerWaalsContact O-N 3.08Å; W385-A387 WeakPolarHBondContact CB-O 3.37Å; W385-A387 PolarHBondContact O-N 2.84Å; W385-L458 HydrophobicContact CH2-CD1 3.94Å; W385-L458 HydrophobicContact CZ3-CD1 3.92Å; W385-V487 HydrophobicContact CH2-CG1 4.22Å; W385-V487 HydrophobicContact CH2-CG2 4.02Å; W385-H517 AromaticContact CD1-CE1 3.84Å; W385-H517 AromaticContact CD1-ND1 3.39Å; W385-H517 HydrophobicContact CD2-CB 3.92Å; W385-H517 AromaticContact CD2-ND1 3.49Å; W385-H517 AromaticContact CE2-ND1 3.67Å; W385-H517 HydrophobicContact CE3-CB 3.75Å; W385-H517 HydrophobicContact CG-CB 4.49Å; W385-H517 AromaticContact CG-CE1 3.95Å; W385-H517 AromaticContact CG-ND1 3.32Å; W385-H517 VanDerWaalsContact CG-ND1 3.32Å; W385-H517 HydrophobicContact CH2-CB 4.44Å; W385-H517 HydrophobicContact CZ3-CB 4.04Å; W385-H517 AromaticContact NE1-ND1 3.59Å; W385-F518 AromaticContact CE3-CD1 3.98Å; W385-F518 HydrophobicContact CE3-CD1 3.98Å; W385-F518 HydrophobicContact CZ3-CB 4.22Å; W385-F518 AromaticContact CZ3-CD1 3.89Å; W385-F518 HydrophobicContact CZ3-CD1 3.89Å; W385-F518 HydrophobicContact CZ3-CG 4.49Å; W385-Y545 AromaticContact CZ2-CE1 3.95Å; W385-Y545 HydrophobicContact CZ2-CE1 3.95Å
386	P	90.1	Very high	93.1	Very high	111 Å²	111	51.3 Å²	51.3	72%	0.721	28%	0.279	S	S	*	.	S	Bend	trans	-68.5	-16.3	-179.2	29.2	-36.1	0	0	0	113.4	H517	P386-H517 WeakPolarHBondContact CD-NE2 3.44Å
387	A	92	Very high	93.4	Very high	45 Å²	45	45.9 Å²	45.9	37%	0.372	26%	0.259	S	S	.	.	S	Bend	trans	-151.7	150.8	170.4	0	0	0	0	0	109.4	W385 F518	W385-A387 WeakPolarHBondContact CB-O 3.37Å; W385-A387 PolarHBondContact O-N 2.84Å; A387-F518 HydrophobicContact CB-CE1 4.39Å; A387-F518 WeakPolarHBondContact O-CE1 3.47Å
388	N	94.2	Very high	93.6	Very high	35 Å²	35	50.8 Å²	50.8	19%	0.187	28%	0.278	C	S	.	.			trans	-107.3	129	173.6	177.4	-15.4	0	0	0	109	V382 L390 D391	V382-N388 HydrophobicContact CG1-CB 4.15Å; N388-L390 PolarHBondContact O-N 2.84Å; N388-L390 VanDerWaalsContact O-N 3.16Å; N388-L390 WeakPolarHBondContact OD1-CB 3.48Å; N388-L390 PolarHBondContact OD1-N 2.91Å; N388-D391 WeakPolarHBondContact CB-OD2 3.39Å; N388-D391 PolarHBondContact O-N 3.43Å
389	P	96.2	Very high	93.9	Very high	0 Å²	0	57.2 Å²	57.2	0%	0	31%	0.307	C	S	.	.	H	α-helix	trans	-57.7	-29.3	179.7	20.3	-31.2	0	0	0	113.6	D391 A392 I393 L458 A485 F518	P389-D391 VanDerWaalsContact C-N 3.3Å; P389-D391 PolarHBondContact O-N 3.5Å; P389-A392 PolarHBondContact O-N 3.13Å; P389-I393 WeakPolarHBondContact O-CG1 3.31Å; P389-I393 PolarHBondContact O-N 3.3Å; P389-I393 VanDerWaalsContact O-N 3.13Å; P389-L458 HydrophobicContact CG-CD1 4Å; P389-L458 HydrophobicContact CG-CD2 4.04Å; P389-L458 HydrophobicContact CG-CG 3.92Å; P389-A485 HydrophobicContact CB-CB 3.52Å; P389-A485 HydrophobicContact CG-CB 4.36Å; P389-F518 HydrophobicContact CB-CD1 4.38Å; P389-F518 HydrophobicContact CB-CD2 3.71Å; P389-F518 HydrophobicContact CB-CE1 4.36Å; P389-F518 HydrophobicContact CB-CE2 3.7Å; P389-F518 HydrophobicContact CB-CG 4.06Å; P389-F518 HydrophobicContact CB-CZ 4.03Å; P389-F518 HydrophobicContact CG-CD1 4.21Å; P389-F518 HydrophobicContact CG-CD2 4.29Å; P389-F518 HydrophobicContact CG-CE1 4.45Å; P389-F518 HydrophobicContact CG-CG 4.12Å
390	L	96.5	Very high	94.1	Very high	17 Å²	17	60 Å²	60	9%	0.089	31%	0.31	C	S	.	.	H	α-helix	trans	-64.7	-34.8	-177.1	-161.8	56.3	0	0	0	112	N388 I393 I394 K415 I416 C457	N388-L390 PolarHBondContact O-N 2.84Å; N388-L390 VanDerWaalsContact O-N 3.16Å; N388-L390 WeakPolarHBondContact OD1-CB 3.48Å; N388-L390 PolarHBondContact OD1-N 2.91Å; L390-I393 PolarHBondContact O-N 3.08Å; L390-I394 HydrophobicContact CG-CD1 4.37Å; L390-I394 WeakPolarHBondContact O-CD1 3.41Å; L390-I394 VanDerWaalsContact O-CG1 3.32Å; L390-I394 WeakPolarHBondContact O-CG1 3.3Å; L390-I394 PolarHBondContact O-N 3.48Å; L390-K415 HydrophobicContact CD2-CB 4Å; L390-K415 HydrophobicContact CD2-CD 4.16Å; L390-K415 HydrophobicContact CD2-CG 4.46Å; L390-I416 HydrophobicContact CD1-CD1 3.64Å; L390-I416 HydrophobicContact CD1-CG1 3.51Å; L390-I416 HydrophobicContact CG-CG1 4.31Å; L390-C457 HydrophobicContact CD1-CB 3.92Å
391	D	96.6	Very high	94.5	Very high	70 Å²	70	61 Å²	61	37%	0.374	32%	0.315	S	S	.	.	H	α-helix	trans	-70.2	-36.2	177.6	-68.2	-56	0	0	0	112	N388 P389 I393 I394 A395 K415	N388-D391 WeakPolarHBondContact CB-OD2 3.39Å; N388-D391 PolarHBondContact O-N 3.43Å; P389-D391 VanDerWaalsContact C-N 3.3Å; P389-D391 PolarHBondContact O-N 3.5Å; D391-I393 VanDerWaalsContact C-N 3.32Å; D391-I393 PolarHBondContact O-N 3.46Å; D391-I394 PolarHBondContact O-N 3.11Å; D391-A395 VanDerWaalsContact O-CB 3.32Å; D391-A395 WeakPolarHBondContact O-CB 3.47Å; D391-A395 PolarHBondContact O-N 3.18Å; D391-K415 VanDerWaalsContact CG-NZ 3.25Å; D391-K415 VanDerWaalsContact OD1-CE 3.22Å; D391-K415 WeakPolarHBondContact OD1-CE 3.32Å; D391-K415 IonicContact OD1-NZ 2.73Å; D391-K415 PolarHBondContact OD1-NZ 3.46Å; D391-K415 IonicContact OD2-NZ 3.67Å; D391-K415 PolarHBondContact OD2-NZ 3.04Å; D391-K415 VanDerWaalsContact OD2-NZ 3.11Å
392	A	96.6	Very high	94.9	Very high	58 Å²	58	62.5 Å²	62.5	48%	0.479	33%	0.328	S	S	.	.	H	α-helix	trans	-67.2	-33.3	172.8	0	0	0	0	0	112.3	P389 Y396	P389-A392 PolarHBondContact O-N 3.13Å; A392-Y396 PolarHBondContact O-N 2.85Å
393	I	98.4	Very high	95.4	Very high	10 Å²	10	66.1 Å²	66.1	5%	0.051	35%	0.354	C	S	.	.	H	α-helix	trans	-71.7	-43.1	175.1	-67.5	162.5	0	0	0	111	P389 L390 D391 A395 Y396 I397 I416 V455 C457 A485	P389-I393 WeakPolarHBondContact O-CG1 3.31Å; P389-I393 PolarHBondContact O-N 3.3Å; P389-I393 VanDerWaalsContact O-N 3.13Å; L390-I393 PolarHBondContact O-N 3.08Å; D391-I393 VanDerWaalsContact C-N 3.32Å; D391-I393 PolarHBondContact O-N 3.46Å; I393-A395 VanDerWaalsContact C-N 3.35Å; I393-A395 PolarHBondContact O-N 2.7Å; I393-Y396 WeakPolarHBondContact O-CB 3.31Å; I393-Y396 PolarHBondContact O-N 2.96Å; I393-Y396 VanDerWaalsContact O-N 3.13Å; I393-I397 HydrophobicContact CG2-CD1 3.97Å; I393-I397 WeakPolarHBondContact O-CG1 3.46Å; I393-I397 PolarHBondContact O-N 3.45Å; I393-I416 HydrophobicContact CG2-CD1 4.02Å; I393-V455 HydrophobicContact CD1-CG1 4.06Å; I393-V455 HydrophobicContact CG2-CG1 3.99Å; I393-V455 HydrophobicContact CG2-CG2 4.08Å; I393-C457 HydrophobicContact CD1-CB 3.86Å; I393-A485 HydrophobicContact CD1-CB 4.11Å
394	I	98.6	Very high	95.9	Very high	12 Å²	12	61 Å²	61	6%	0.062	33%	0.332	C	S	.	.	H	α-helix	trans	-59.9	-46	173.6	-70.6	160.5	0	0	0	110.4	L390 D391 Y396 I397 H398 K415 I416 V420	L390-I394 HydrophobicContact CG-CD1 4.37Å; L390-I394 WeakPolarHBondContact O-CD1 3.41Å; L390-I394 VanDerWaalsContact O-CG1 3.32Å; L390-I394 WeakPolarHBondContact O-CG1 3.3Å; L390-I394 PolarHBondContact O-N 3.48Å; D391-I394 PolarHBondContact O-N 3.11Å; I394-Y396 VanDerWaalsContact C-N 3.26Å; I394-Y396 PolarHBondContact O-N 2.64Å; I394-I397 PolarHBondContact O-N 3.04Å; I394-I397 VanDerWaalsContact O-N 3.13Å; I394-H398 PolarHBondContact O-N 2.92Å; I394-K415 HydrophobicContact CD1-CD 4.4Å; I394-K415 HydrophobicContact CD1-CG 3.98Å; I394-I416 HydrophobicContact CG1-CG1 4.34Å; I394-V420 HydrophobicContact CG2-CG1 4.25Å
395	A	98.3	Very high	96.5	Very high	42 Å²	42	56 Å²	56	35%	0.347	32%	0.315	S	S	.	.	H	α-helix	trans	-65.5	-23.5	175.9	0	0	0	0	0	114	D391 I393 K399	D391-A395 VanDerWaalsContact O-CB 3.32Å; D391-A395 WeakPolarHBondContact O-CB 3.47Å; D391-A395 PolarHBondContact O-N 3.18Å; I393-A395 VanDerWaalsContact C-N 3.35Å; I393-A395 PolarHBondContact O-N 2.7Å; A395-K399 WeakPolarHBondContact O-CD 3.24Å; A395-K399 WeakPolarHBondContact O-CG 3.43Å
396	Y	98.2	Very high	96.9	Very high	32 Å²	32	54.3 Å²	54.3	13%	0.125	31%	0.309	C	S	.	.	H	α-helix	trans	-73.1	-46.8	168.7	176.7	-85.1	0	0	0	111.1	A392 I393 I394 K399 R400 I453 K483 E522	A392-Y396 PolarHBondContact O-N 2.85Å; I393-Y396 WeakPolarHBondContact O-CB 3.31Å; I393-Y396 PolarHBondContact O-N 2.96Å; I393-Y396 VanDerWaalsContact O-N 3.13Å; I394-Y396 VanDerWaalsContact C-N 3.26Å; I394-Y396 PolarHBondContact O-N 2.64Å; Y396-K399 PolarHBondContact O-N 3.28Å; Y396-K399 VanDerWaalsContact O-N 3.16Å; Y396-R400 HydrophobicContact CE1-CG 4.25Å; Y396-R400 PolarHBondContact OH-NH2 3.23Å; Y396-R400 VanDerWaalsContact OH-NH2 3.08Å; Y396-I453 HydrophobicContact CE1-CD1 4.36Å; Y396-K483 VanDerWaalsContact CD2-NZ 3.32Å; Y396-K483 VanDerWaalsContact CE2-CE 3.43Å; Y396-E522 WeakPolarHBondContact CE2-OE1 3.28Å; Y396-E522 VanDerWaalsContact CE2-OE2 3.23Å; Y396-E522 WeakPolarHBondContact CE2-OE2 3.41Å; Y396-E522 VanDerWaalsContact CZ-OE1 3.27Å; Y396-E522 PolarHBondContact OH-OE1 3.26Å
397	I	98.4	Very high	97.3	Very high	1 Å²	1	49 Å²	49	1%	0.005	28%	0.275	C	S	.	.	H	α-helix	trans	-64.6	-41.6	-178.5	-65.1	163.9	0	0	0	110.9	I393 I394 K399 R400 V406 I416 V420 N422 I453	I393-I397 HydrophobicContact CG2-CD1 3.97Å; I393-I397 WeakPolarHBondContact O-CG1 3.46Å; I393-I397 PolarHBondContact O-N 3.45Å; I394-I397 PolarHBondContact O-N 3.04Å; I394-I397 VanDerWaalsContact O-N 3.13Å; I397-K399 PolarHBondContact O-N 2.86Å; I397-K399 VanDerWaalsContact O-N 3.12Å; I397-R400 PolarHBondContact O-N 3.29Å; I397-V406 HydrophobicContact CD1-CG1 4.25Å; I397-V406 HydrophobicContact CD1-CG2 4.36Å; I397-V406 HydrophobicContact CG2-CG2 4.34Å; I397-I416 HydrophobicContact CD1-CG2 3.7Å; I397-V420 HydrophobicContact CB-CG1 4.17Å; I397-V420 HydrophobicContact CG2-CB 4.03Å; I397-V420 HydrophobicContact CG2-CG1 3.8Å; I397-V420 HydrophobicContact CG2-CG2 4.31Å; I397-N422 HydrophobicContact CG2-CB 4.34Å; I397-N422 VanDerWaalsContact CG2-OD1 3.31Å; I397-N422 WeakPolarHBondContact CG2-OD1 3.41Å; I397-I453 HydrophobicContact CG1-CD1 4.39Å
398	H	97.6	Very high	97.6	Very high	116 Å²	116	47 Å²	47	54%	0.537	26%	0.258	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.2	-27.5	173.6	-82.6	-163.8	0	0	0	114.3	I394 R400 S419	I394-H398 PolarHBondContact O-N 2.92Å; H398-R400 VanDerWaalsContact C-N 3.28Å; H398-R400 PolarHBondContact O-N 3.42Å; H398-S419 PolarHBondContact NE2-O 3.08Å
399	K	97.5	Very high	97.9	Very high	172 Å²	172	45.3 Å²	45.3	75%	0.748	25%	0.249	S	C	*	.	T	Hydrogen-bonded Turn	trans	-88.7	10.2	179.6	-66.1	172.2	-174.1	177.6	0	113	A395 Y396 I397	A395-K399 WeakPolarHBondContact O-CD 3.24Å; A395-K399 WeakPolarHBondContact O-CG 3.43Å; Y396-K399 PolarHBondContact O-N 3.28Å; Y396-K399 VanDerWaalsContact O-N 3.16Å; I397-K399 PolarHBondContact O-N 2.86Å; I397-K399 VanDerWaalsContact O-N 3.12Å
400	R	96.3	Very high	98	Very high	123 Å²	123	46.3 Å²	46.3	46%	0.464	26%	0.259	S	S	.	.	S	Bend	trans	-120.2	171.2	178.1	-58.9	-56.8	-167	-170.4	5.6	110.9	Y396 I397 H398 L404	Y396-R400 HydrophobicContact CE1-CG 4.25Å; Y396-R400 PolarHBondContact OH-NH2 3.23Å; Y396-R400 VanDerWaalsContact OH-NH2 3.08Å; I397-R400 PolarHBondContact O-N 3.29Å; H398-R400 VanDerWaalsContact C-N 3.28Å; H398-R400 PolarHBondContact O-N 3.42Å; R400-L404 HydrophobicContact CB-CD1 3.85Å; R400-L404 HydrophobicContact CG-CD1 4.42Å
401	S	97.5	Very high	98	Very high	58 Å²	58	45.9 Å²	45.9	41%	0.406	26%	0.257	S	S	.	.			trans	-62.2	136.9	176.7	-179.4	0	0	0	0	110.9	S403 L404 N422	S401-S403 PolarHBondContact O-N 3.4Å; S401-S403 PolarHBondContact OG-N 3.19Å; S401-S403 PolarHBondContact OG-OG 3.37Å; S401-L404 PolarHBondContact O-N 2.99Å; S401-N422 PolarHBondContact O-ND2 3.5Å
402	P	97.3	Very high	98	Very high	77 Å²	77	43 Å²	43	50%	0.5	24%	0.244	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.6	-14.7	171.7	28.7	-35.8	0	0	0	112.8	L404 K421 N422	P402-L404 VanDerWaalsContact C-N 3.27Å; P402-L404 PolarHBondContact O-N 3.09Å; P402-K421 HydrophobicContact CB-CB 4.06Å; P402-N422 WeakPolarHBondContact O-CA 3.22Å; P402-N422 PolarHBondContact O-ND2 3.04Å
403	S	98.1	Very high	97.9	Very high	89 Å²	89	43.3 Å²	43.3	62%	0.622	24%	0.237	S	C	*	.	T	Hydrogen-bonded Turn	trans	-74	-11.7	175.3	66.2	0	0	0	0	114.6	S401	S401-S403 PolarHBondContact O-N 3.4Å; S401-S403 PolarHBondContact OG-N 3.19Å; S401-S403 PolarHBondContact OG-OG 3.37Å
404	L	98.6	Very high	97.9	Very high	47 Å²	47	42.9 Å²	42.9	25%	0.246	24%	0.235	C	C	.	.	S	Bend	trans	-73.6	133.5	176.8	-59.8	-172.2	0	0	0	110.6	R400 S401 P402 N422 D452 I453	R400-L404 HydrophobicContact CB-CD1 3.85Å; R400-L404 HydrophobicContact CG-CD1 4.42Å; S401-L404 PolarHBondContact O-N 2.99Å; P402-L404 VanDerWaalsContact C-N 3.27Å; P402-L404 PolarHBondContact O-N 3.09Å; L404-N422 WeakPolarHBondContact O-CB 3.47Å; L404-N422 PolarHBondContact O-ND2 2.62Å; L404-D452 HydrophobicContact CB-CB 3.94Å; L404-D452 HydrophobicContact CD2-CB 3.95Å; L404-D452 HydrophobicContact CG-CB 4.38Å; L404-I453 HydrophobicContact CD1-CD1 4.13Å; L404-I453 HydrophobicContact CD1-CG1 4.47Å
405	V	98.9	Very high	97.8	Very high	25 Å²	25	45 Å²	45	15%	0.152	24%	0.244	C	C	.	.			trans	-88.1	131.1	175.8	-176.1	0	0	0	0	109.6	K423 V451 D452 I453	V405-K423 HydrophobicContact CG1-CD 4.27Å; V405-K423 HydrophobicContact CG2-CB 4.5Å; V405-K423 HydrophobicContact CG2-CD 4.44Å; V405-V451 HydrophobicContact CB-CB 4.44Å; V405-V451 HydrophobicContact CB-CG1 4.5Å; V405-V451 HydrophobicContact CG1-CB 4.22Å; V405-V451 HydrophobicContact CG1-CG1 3.79Å; V405-D452 PolarHBondContact N-OD2 2.79Å; V405-D452 PolarHBondContact O-N 3.12Å; V405-I453 PolarHBondContact O-N 2.94Å
406	V	98.9	Very high	97.8	Very high	0 Å²	0	43 Å²	43	0%	0	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	141.2	179.3	-172.5	0	0	0	0	109.6	I397 N422 K423 V424 H425 I453 V455	I397-V406 HydrophobicContact CD1-CG1 4.25Å; I397-V406 HydrophobicContact CD1-CG2 4.36Å; I397-V406 HydrophobicContact CG2-CG2 4.34Å; V406-N422 HydrophobicContact CG2-CB 4.02Å; V406-K423 PolarHBondContact N-O 2.91Å; V406-V424 HydrophobicContact CB-CB 4.49Å; V406-V424 HydrophobicContact CB-CG1 4.3Å; V406-V424 HydrophobicContact CB-CG2 4.16Å; V406-V424 HydrophobicContact CG1-CG1 4.37Å; V406-V424 HydrophobicContact CG2-CG2 4.48Å; V406-V424 CarbonylContact O-C 3.29Å; V406-V424 WeakPolarHBondContact O-CA 3.32Å; V406-H425 PolarHBondContact O-N 3.28Å; V406-I453 CarbonylContact C-O 3.52Å; V406-I453 WeakPolarHBondContact CA-O 3.22Å; V406-I453 HydrophobicContact CG1-CB 4.41Å; V406-I453 HydrophobicContact CG1-CG2 4.44Å; V406-I453 HydrophobicContact CG2-CB 4.32Å; V406-I453 HydrophobicContact CG2-CD1 4.43Å; V406-V455 HydrophobicContact CG1-CG2 4.02Å
407	A	98.9	Very high	97.8	Very high	0 Å²	0	42.6 Å²	42.6	0%	0	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114	130.3	161.4	0	0	0	0	0	109.9	F409 H425 F427 V451 I453 A454 V455	A407-F409 HydrophobicContact CB-CD2 4.09Å; A407-F409 HydrophobicContact CB-CE2 3.54Å; A407-F409 HydrophobicContact CB-CZ 4.42Å; A407-H425 CarbonylContact C-O 3.54Å; A407-H425 WeakPolarHBondContact CA-O 3.23Å; A407-F427 HydrophobicContact CB-CE2 4.13Å; A407-V451 HydrophobicContact CB-CB 4.45Å; A407-V451 HydrophobicContact CB-CG1 4.12Å; A407-V451 HydrophobicContact CB-CG2 4.03Å; A407-I453 PolarHBondContact N-O 3.49Å; A407-A454 CarbonylContact O-C 3.58Å; A407-A454 WeakPolarHBondContact O-CA 3.31Å; A407-V455 PolarHBondContact O-N 2.78Å
408	D	98.9	Very high	97.8	Very high	3 Å²	3	49 Å²	49	2%	0.016	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	100.6	-174.9	-172.8	20.2	0	0	0	108.2	C411 I416 V424 H425 F427	D408-C411 HydrophobicContact CB-CB 4.09Å; D408-C411 WeakPolarHBondContact OD2-CB 3.49Å; D408-I416 WeakPolarHBondContact OD1-CD1 3.25Å; D408-V424 HydrophobicContact CB-CG1 3.96Å; D408-H425 PolarHBondContact N-O 2.97Å; D408-F427 PolarHBondContact O-N 3.08Å
409	F	98.8	Very high	97.8	Very high	0 Å²	0	45.6 Å²	45.6	0%	0	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.5	114.3	-171.6	-70.8	-115	0	0	0	109.6	A407 M441 V444 A454 V455 F456 S459 E471 A472 V475	A407-F409 HydrophobicContact CB-CD2 4.09Å; A407-F409 HydrophobicContact CB-CE2 3.54Å; A407-F409 HydrophobicContact CB-CZ 4.42Å; F409-M441 HydrophobicContact CB-CB 4.48Å; F409-M441 HydrophobicContact CB-SD 3.99Å; F409-M441 HydrophobicContact CD1-CB 3.97Å; F409-V444 HydrophobicContact CD1-CG1 4.34Å; F409-V444 HydrophobicContact CE1-CG1 3.96Å; F409-V444 HydrophobicContact CE1-CG2 4.44Å; F409-V444 HydrophobicContact CZ-CG2 4.44Å; F409-A454 HydrophobicContact CE2-CB 4.06Å; F409-V455 WeakPolarHBondContact CB-O 3.23Å; F409-V455 PolarHBondContact N-O 3.47Å; F409-F456 HydrophobicContact CB-CD1 3.54Å; F409-F456 HydrophobicContact CB-CE1 3.31Å; F409-F456 HydrophobicContact CB-CE2 4.47Å; F409-F456 HydrophobicContact CB-CG 4.23Å; F409-F456 HydrophobicContact CB-CZ 3.83Å; F409-F456 AromaticContact CD1-CE1 3.76Å; F409-F456 HydrophobicContact CD1-CE1 3.76Å; F409-F456 AromaticContact CD1-CZ 3.62Å; F409-F456 HydrophobicContact CD1-CZ 3.62Å; F409-F456 HydrophobicContact CD2-CZ 4.27Å; F409-F456 HydrophobicContact CE1-CZ 4.23Å; F409-F456 HydrophobicContact CG-CD1 4.33Å; F409-F456 AromaticContact CG-CE1 3.7Å; F409-F456 HydrophobicContact CG-CE1 3.7Å; F409-F456 HydrophobicContact CG-CE2 4.31Å; F409-F456 AromaticContact CG-CZ 3.68Å; F409-F456 HydrophobicContact CG-CZ 3.68Å; F409-S459 WeakPolarHBondContact O-CB 3.46Å; F409-S459 PolarHBondContact O-OG 2.91Å; F409-E471 HydrophobicContact CE1-CG 4.25Å; F409-A472 HydrophobicContact CE1-CB 4.32Å; F409-A472 HydrophobicContact CE2-CB 4.32Å; F409-A472 HydrophobicContact CZ-CB 3.98Å; F409-V475 HydrophobicContact CE2-CG2 4.34Å; F409-V475 HydrophobicContact CZ-CG2 3.82Å
410	G	98.1	Very high	97.9	Very high	20 Å²	20	38.2 Å²	38.2	21%	0.206	21%	0.213	C	C	.	.	T	Hydrogen-bonded Turn	trans	71.7	53.8	-167.5	0	0	0	0	0	110.8	G412 F427 D428	G410-G412 PolarHBondContact O-N 3.14Å; G410-F427 VanDerWaalsContact CA-O 3.24Å; G410-F427 WeakPolarHBondContact CA-O 3.4Å; G410-F427 PolarHBondContact N-O 2.7Å; G410-D428 VanDerWaalsContact C-OD2 3.23Å; G410-D428 WeakPolarHBondContact CA-OD2 3.4Å
411	C	98	Very high	97.9	Very high	8 Å²	8	41.7 Å²	41.7	5%	0.054	23%	0.232	C	C	.	.			trans	-68.6	-13.3	-171.7	62	0	0	0	0	114.6	D408 D413 C414 F427 D428	D408-C411 HydrophobicContact CB-CB 4.09Å; D408-C411 WeakPolarHBondContact OD2-CB 3.49Å; C411-D413 PolarHBondContact O-N 3.12Å; C411-D413 VanDerWaalsContact O-N 3.09Å; C411-C414 PolarHBondContact O-N 3.21Å; C411-F427 PolarHBondContact N-O 2.84Å; C411-F427 VanDerWaalsContact SG-C 3.58Å; C411-F427 PolarHBondContact SG-N 2.68Å; C411-F427 VanDerWaalsContact SG-N 3.44Å; C411-F427 PolarHBondContact SG-O 3.25Å; C411-D428 PolarHBondContact N-OD2 2.97Å
412	G	95.9	Very high	98	Very high	9 Å²	9	39.6 Å²	39.6	9%	0.093	22%	0.216	C	C	.	.	T	Hydrogen-bonded Turn	trans	54.7	-112.9	-178.9	0	0	0	0	0	112.5	G410 C414 D428 T432	G410-G412 PolarHBondContact O-N 3.14Å; G412-C414 VanDerWaalsContact C-N 3.26Å; G412-C414 PolarHBondContact O-N 2.86Å; G412-D428 WeakPolarHBondContact CA-OD2 3.44Å; G412-D428 PolarHBondContact N-OD2 3.35Å; G412-T432 WeakPolarHBondContact O-CB 3.44Å; G412-T432 WeakPolarHBondContact O-CG2 3.23Å; G412-T432 PolarHBondContact O-OG1 2.83Å
413	D	94.9	Very high	98.1	Very high	66 Å²	66	42 Å²	42	35%	0.353	22%	0.218	S	C	.	.	T	Hydrogen-bonded Turn	trans	-73.3	-12.4	-179.7	83.4	-42	0	0	0	114	C411 K415 R418 T432 C433	C411-D413 PolarHBondContact O-N 3.12Å; C411-D413 VanDerWaalsContact O-N 3.09Å; D413-K415 WeakPolarHBondContact OD1-CB 3.2Å; D413-K415 PolarHBondContact OD1-N 3.33Å; D413-R418 VanDerWaalsContact CG-NH2 3.29Å; D413-R418 PolarHBondContact O-NH1 3.3Å; D413-R418 PolarHBondContact O-NH2 2.85Å; D413-R418 IonicContact OD2-CZ 3.56Å; D413-R418 IonicContact OD2-NH2 3.48Å; D413-R418 PolarHBondContact OD2-NH2 2.87Å; D413-T432 WeakPolarHBondContact CA-OG1 3.43Å; D413-C433 PolarHBondContact O-SG 3.43Å
414	C	97.3	Very high	98.1	Very high	0 Å²	0	39 Å²	39	0%	0	20%	0.196	C	C	.	.			trans	70.6	30	-167.7	-56.2	0	0	0	0	115.9	C411 G412 I416 A417 R418 S426 L435 V436	C411-C414 PolarHBondContact O-N 3.21Å; G412-C414 VanDerWaalsContact C-N 3.26Å; G412-C414 PolarHBondContact O-N 2.86Å; C414-I416 PolarHBondContact O-N 2.64Å; C414-A417 HydrophobicContact CB-CB 4.25Å; C414-A417 PolarHBondContact O-N 3.41Å; C414-A417 VanDerWaalsContact O-N 3.16Å; C414-R418 PolarHBondContact O-N 3.24Å; C414-R418 VanDerWaalsContact O-N 3.14Å; C414-S426 VanDerWaalsContact SG-CB 3.55Å; C414-L435 HydrophobicContact CB-CB 4.17Å; C414-L435 HydrophobicContact CB-CD1 4.26Å; C414-V436 WeakPolarHBondContact SG-CG2 3.24Å
415	K	97.4	Very high	98.1	Very high	58 Å²	58	38.7 Å²	38.7	25%	0.252	19%	0.193	S	C	.	.	H	α-helix	trans	-55	-33.3	176.1	-177.1	176.6	167.7	-173.7	0	113.5	L390 D391 I394 D413 S419	L390-K415 HydrophobicContact CD2-CB 4Å; L390-K415 HydrophobicContact CD2-CD 4.16Å; L390-K415 HydrophobicContact CD2-CG 4.46Å; D391-K415 VanDerWaalsContact CG-NZ 3.25Å; D391-K415 VanDerWaalsContact OD1-CE 3.22Å; D391-K415 WeakPolarHBondContact OD1-CE 3.32Å; D391-K415 IonicContact OD1-NZ 2.73Å; D391-K415 PolarHBondContact OD1-NZ 3.46Å; D391-K415 IonicContact OD2-NZ 3.67Å; D391-K415 PolarHBondContact OD2-NZ 3.04Å; D391-K415 VanDerWaalsContact OD2-NZ 3.11Å; I394-K415 HydrophobicContact CD1-CD 4.4Å; I394-K415 HydrophobicContact CD1-CG 3.98Å; D413-K415 WeakPolarHBondContact OD1-CB 3.2Å; D413-K415 PolarHBondContact OD1-N 3.33Å; K415-S419 VanDerWaalsContact O-CB 3.24Å; K415-S419 WeakPolarHBondContact O-CB 3.35Å; K415-S419 PolarHBondContact O-N 3.27Å; K415-S419 VanDerWaalsContact O-N 3.16Å; K415-S419 PolarHBondContact O-OG 3.26Å
416	I	98.4	Very high	98.1	Very high	0 Å²	0	37.6 Å²	37.6	0%	0	19%	0.187	C	C	.	.	H	α-helix	trans	-61.5	-54.8	175	-52.6	-168.3	0	0	0	110.4	L390 I393 I394 I397 D408 C414 R418 S419 V420 V424 V455	L390-I416 HydrophobicContact CD1-CD1 3.64Å; L390-I416 HydrophobicContact CD1-CG1 3.51Å; L390-I416 HydrophobicContact CG-CG1 4.31Å; I393-I416 HydrophobicContact CG2-CD1 4.02Å; I394-I416 HydrophobicContact CG1-CG1 4.34Å; I397-I416 HydrophobicContact CD1-CG2 3.7Å; D408-I416 WeakPolarHBondContact OD1-CD1 3.25Å; C414-I416 PolarHBondContact O-N 2.64Å; I416-R418 VanDerWaalsContact C-N 3.28Å; I416-R418 PolarHBondContact O-N 3.06Å; I416-S419 PolarHBondContact O-N 3Å; I416-V420 HydrophobicContact CG2-CG1 4.27Å; I416-V420 HydrophobicContact CG2-CG2 4.35Å; I416-V420 WeakPolarHBondContact O-CG2 3.34Å; I416-V420 PolarHBondContact O-N 3.16Å; I416-V424 HydrophobicContact CG2-CG2 4.34Å; I416-V455 HydrophobicContact CD1-CB 4.44Å; I416-V455 HydrophobicContact CD1-CG1 3.93Å; I416-V455 HydrophobicContact CD1-CG2 4.44Å
417	A	98.3	Very high	98.1	Very high	22 Å²	22	37.6 Å²	37.6	18%	0.182	19%	0.187	C	C	.	.	H	α-helix	trans	-58.2	-36.9	-177.8	0	0	0	0	0	113.2	C414 S419 V424 L435	C414-A417 HydrophobicContact CB-CB 4.25Å; C414-A417 PolarHBondContact O-N 3.41Å; C414-A417 VanDerWaalsContact O-N 3.16Å; A417-S419 VanDerWaalsContact C-N 3.33Å; A417-V424 HydrophobicContact CB-CB 3.84Å; A417-V424 HydrophobicContact CB-CG1 4.05Å; A417-V424 HydrophobicContact CB-CG2 4.28Å; A417-L435 HydrophobicContact CB-CD1 3.97Å
418	R	98.1	Very high	98.1	Very high	135 Å²	135	38.5 Å²	38.5	51%	0.509	19%	0.192	S	C	.	.	H	α-helix	trans	-73	-20	173.8	-75.2	-166.6	-70.1	-80.7	0.8	114.6	D413 C414 I416 C433 L435	D413-R418 VanDerWaalsContact CG-NH2 3.29Å; D413-R418 PolarHBondContact O-NH1 3.3Å; D413-R418 PolarHBondContact O-NH2 2.85Å; D413-R418 IonicContact OD2-CZ 3.56Å; D413-R418 IonicContact OD2-NH2 3.48Å; D413-R418 PolarHBondContact OD2-NH2 2.87Å; C414-R418 PolarHBondContact O-N 3.24Å; C414-R418 VanDerWaalsContact O-N 3.14Å; I416-R418 VanDerWaalsContact C-N 3.28Å; I416-R418 PolarHBondContact O-N 3.06Å; R418-C433 PolarHBondContact NH1-SG 3.32Å; R418-L435 HydrophobicContact CG-CD1 4.1Å
419	S	98.3	Very high	98	Very high	45 Å²	45	39.8 Å²	39.8	32%	0.315	20%	0.199	S	C	.	.	H	α-helix	trans	-101	-12.1	-171.6	-56.3	0	0	0	0	114.6	H398 K415 I416 A417	H398-S419 PolarHBondContact NE2-O 3.08Å; K415-S419 VanDerWaalsContact O-CB 3.24Å; K415-S419 WeakPolarHBondContact O-CB 3.35Å; K415-S419 PolarHBondContact O-N 3.27Å; K415-S419 VanDerWaalsContact O-N 3.16Å; K415-S419 PolarHBondContact O-OG 3.26Å; I416-S419 PolarHBondContact O-N 3Å; A417-S419 VanDerWaalsContact C-N 3.33Å
420	V	98.1	Very high	97.8	Very high	18 Å²	18	41 Å²	41	11%	0.109	21%	0.208	C	C	.	.			trans	-124.4	154.4	-171.2	-51.7	0	0	0	0	112.3	I394 I397 I416 N422 V424	I394-V420 HydrophobicContact CG2-CG1 4.25Å; I397-V420 HydrophobicContact CB-CG1 4.17Å; I397-V420 HydrophobicContact CG2-CB 4.03Å; I397-V420 HydrophobicContact CG2-CG1 3.8Å; I397-V420 HydrophobicContact CG2-CG2 4.31Å; I416-V420 HydrophobicContact CG2-CG1 4.27Å; I416-V420 HydrophobicContact CG2-CG2 4.35Å; I416-V420 WeakPolarHBondContact O-CG2 3.34Å; I416-V420 PolarHBondContact O-N 3.16Å; V420-N422 VanDerWaalsContact C-N 3.3Å; V420-N422 HydrophobicContact CG2-CB 3.9Å; V420-V424 HydrophobicContact CG2-CG2 3.44Å; V420-V424 VanDerWaalsContact CG2-CG2 3.44Å
421	K	98	Very high	97.6	Very high	195 Å²	195	42.3 Å²	42.3	85%	0.848	22%	0.217	S	C	*	.	S	Bend	trans	-82.6	-7.8	174.6	-64.1	-175.8	179.9	-178.3	0	113.5	P402	P402-K421 HydrophobicContact CB-CB 4.06Å
422	N	98.6	Very high	97.3	Very high	14 Å²	14	43.4 Å²	43.4	8%	0.075	22%	0.224	C	C	.	.	S	Bend	trans	-71	152.4	179.9	-66.3	75.1	0	0	0	111.5	I397 S401 P402 L404 V406 V420 V424	I397-N422 HydrophobicContact CG2-CB 4.34Å; I397-N422 VanDerWaalsContact CG2-OD1 3.31Å; I397-N422 WeakPolarHBondContact CG2-OD1 3.41Å; S401-N422 PolarHBondContact O-ND2 3.5Å; P402-N422 WeakPolarHBondContact O-CA 3.22Å; P402-N422 PolarHBondContact O-ND2 3.04Å; L404-N422 WeakPolarHBondContact O-CB 3.47Å; L404-N422 PolarHBondContact O-ND2 2.62Å; V406-N422 HydrophobicContact CG2-CB 4.02Å; V420-N422 VanDerWaalsContact C-N 3.3Å; V420-N422 HydrophobicContact CG2-CB 3.9Å; N422-V424 PolarHBondContact O-N 2.84Å; N422-V424 VanDerWaalsContact O-N 3.14Å
423	K	98.6	Very high	97.2	Very high	127 Å²	127	44.7 Å²	44.7	55%	0.552	23%	0.231	S	C	*	.			trans	-68.2	111.6	164.8	-170.4	-165.9	-174.7	-159.1	0	108.8	V405 V406 H425	V405-K423 HydrophobicContact CG1-CD 4.27Å; V405-K423 HydrophobicContact CG2-CB 4.5Å; V405-K423 HydrophobicContact CG2-CD 4.44Å; V406-K423 PolarHBondContact N-O 2.91Å; K423-H425 VanDerWaalsContact CE-NE2 3.29Å; K423-H425 WeakPolarHBondContact CE-NE2 3.32Å; K423-H425 PolarHBondContact NZ-CE1 3.24Å; K423-H425 VanDerWaalsContact NZ-CE1 3.32Å; K423-H425 PolarHBondContact NZ-NE2 3.04Å
424	V	98.8	Very high	97.3	Very high	26 Å²	26	49.8 Å²	49.8	16%	0.158	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	131.5	175.4	-171.1	0	0	0	0	109.8	V406 D408 I416 A417 V420 N422	V406-V424 HydrophobicContact CB-CB 4.49Å; V406-V424 HydrophobicContact CB-CG1 4.3Å; V406-V424 HydrophobicContact CB-CG2 4.16Å; V406-V424 HydrophobicContact CG1-CG1 4.37Å; V406-V424 HydrophobicContact CG2-CG2 4.48Å; V406-V424 CarbonylContact O-C 3.29Å; V406-V424 WeakPolarHBondContact O-CA 3.32Å; D408-V424 HydrophobicContact CB-CG1 3.96Å; I416-V424 HydrophobicContact CG2-CG2 4.34Å; A417-V424 HydrophobicContact CB-CB 3.84Å; A417-V424 HydrophobicContact CB-CG1 4.05Å; A417-V424 HydrophobicContact CB-CG2 4.28Å; V420-V424 HydrophobicContact CG2-CG2 3.44Å; V420-V424 VanDerWaalsContact CG2-CG2 3.44Å; N422-V424 PolarHBondContact O-N 2.84Å; N422-V424 VanDerWaalsContact O-N 3.14Å
425	H	98.9	Very high	97.3	Very high	41 Å²	41	54 Å²	54	19%	0.19	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	107.5	166.5	-75	-81.8	0	0	0	108.5	V406 A407 D408 K423 F427 L446	V406-H425 PolarHBondContact O-N 3.28Å; A407-H425 CarbonylContact C-O 3.54Å; A407-H425 WeakPolarHBondContact CA-O 3.23Å; D408-H425 PolarHBondContact N-O 2.97Å; K423-H425 VanDerWaalsContact CE-NE2 3.29Å; K423-H425 WeakPolarHBondContact CE-NE2 3.32Å; K423-H425 PolarHBondContact NZ-CE1 3.24Å; K423-H425 VanDerWaalsContact NZ-CE1 3.32Å; K423-H425 PolarHBondContact NZ-NE2 3.04Å; H425-F427 HydrophobicContact CB-CE2 3.74Å; H425-F427 HydrophobicContact CB-CZ 3.66Å; H425-L446 HydrophobicContact CB-CD1 4.4Å
426	S	98.8	Very high	97.3	Very high	2 Å²	2	51.9 Å²	51.9	1%	0.014	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	125.6	-175.6	-73.9	0	0	0	0	110.8	C414 T437	C414-S426 VanDerWaalsContact SG-CB 3.55Å; S426-T437 WeakPolarHBondContact O-CB 3.38Å; S426-T437 PolarHBondContact O-N 3.29Å
427	F	98.8	Very high	97.4	Very high	1 Å²	1	54.5 Å²	54.5	0%	0.004	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124	130.8	-174	-58.6	-64.5	0	0	0	111.7	A407 D408 G410 C411 H425 T437 C439 V444 P445 L446	A407-F427 HydrophobicContact CB-CE2 4.13Å; D408-F427 PolarHBondContact O-N 3.08Å; G410-F427 VanDerWaalsContact CA-O 3.24Å; G410-F427 WeakPolarHBondContact CA-O 3.4Å; G410-F427 PolarHBondContact N-O 2.7Å; C411-F427 PolarHBondContact N-O 2.84Å; C411-F427 VanDerWaalsContact SG-C 3.58Å; C411-F427 PolarHBondContact SG-N 2.68Å; C411-F427 VanDerWaalsContact SG-N 3.44Å; C411-F427 PolarHBondContact SG-O 3.25Å; H425-F427 HydrophobicContact CB-CE2 3.74Å; H425-F427 HydrophobicContact CB-CZ 3.66Å; F427-T437 HydrophobicContact CD1-CG2 3.93Å; F427-T437 HydrophobicContact CE1-CG2 3.83Å; F427-C439 WeakPolarHBondContact CD1-SG 3.25Å; F427-V444 HydrophobicContact CB-CG1 4.23Å; F427-V444 HydrophobicContact CD1-CB 4.14Å; F427-V444 HydrophobicContact CD1-CG1 4.03Å; F427-V444 HydrophobicContact CD2-CB 4.18Å; F427-V444 HydrophobicContact CD2-CG1 3.72Å; F427-V444 HydrophobicContact CE1-CB 3.98Å; F427-V444 HydrophobicContact CE1-CG1 4.35Å; F427-V444 HydrophobicContact CE2-CB 3.99Å; F427-V444 HydrophobicContact CE2-CG1 4.03Å; F427-V444 HydrophobicContact CE2-CG2 4.22Å; F427-V444 HydrophobicContact CG-CB 4.25Å; F427-V444 HydrophobicContact CG-CG1 3.71Å; F427-V444 HydrophobicContact CZ-CB 3.9Å; F427-V444 HydrophobicContact CZ-CG1 4.34Å; F427-V444 HydrophobicContact CZ-CG2 4.31Å; F427-P445 HydrophobicContact CE1-CG 4.17Å; F427-L446 HydrophobicContact CE2-CD1 3.79Å; F427-L446 HydrophobicContact CE2-CG 4.37Å; F427-L446 HydrophobicContact CZ-CD1 3.62Å; F427-L446 HydrophobicContact CZ-CD2 4.24Å; F427-L446 HydrophobicContact CZ-CG 3.72Å
428	D	98.3	Very high	97.3	Very high	19 Å²	19	56.6 Å²	56.6	10%	0.102	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.6	170.5	173.3	-141.8	-64.5	0	0	0	112	G410 C411 G412 A430 V436 T437 V438 C439	G410-D428 VanDerWaalsContact C-OD2 3.23Å; G410-D428 WeakPolarHBondContact CA-OD2 3.4Å; C411-D428 PolarHBondContact N-OD2 2.97Å; G412-D428 WeakPolarHBondContact CA-OD2 3.44Å; G412-D428 PolarHBondContact N-OD2 3.35Å; D428-A430 VanDerWaalsContact C-N 3.34Å; D428-V436 HydrophobicContact CB-CG1 3.82Å; D428-T437 PolarHBondContact N-O 2.98Å; D428-V438 CarbonylContact O-C 3.47Å; D428-V438 WeakPolarHBondContact O-CA 3.26Å; D428-C439 CarbonylContact C-O 3.29Å; D428-C439 PolarHBondContact O-N 3.06Å; D428-C439 VanDerWaalsContact O-O 3.09Å
429	L	97	Very high	97.3	Very high	30 Å²	30	50.8 Å²	50.8	16%	0.157	28%	0.278	C	S	.	.	S	Bend	trans	-74.9	-21.6	-178.9	-63.4	-177.6	0	0	0	113.4	A360 R361 F364 V438 D440	A360-L429 HydrophobicContact CB-CD1 3.85Å; R361-L429 HydrophobicContact CB-CD2 4.04Å; R361-L429 HydrophobicContact CG-CD2 4.12Å; F364-L429 HydrophobicContact CD2-CB 3.92Å; F364-L429 HydrophobicContact CD2-CD1 4.02Å; F364-L429 HydrophobicContact CE2-CB 4.42Å; F364-L429 HydrophobicContact CE2-CD1 4.08Å; L429-V438 WeakPolarHBondContact O-CG1 3.43Å; L429-D440 HydrophobicContact CD2-CB 4.49Å
430	A	94.7	Very high	97.3	Very high	24 Å²	24	50 Å²	50	20%	0.198	27%	0.271	C	S	.	.	S	Bend	trans	-148.9	160	171.5	0	0	0	0	0	110.9	F371 D428	F371-A430 HydrophobicContact CB-CB 4.49Å; F371-A430 HydrophobicContact CD1-CB 3.77Å; F371-A430 HydrophobicContact CD2-CB 3.86Å; F371-A430 HydrophobicContact CE1-CB 3.81Å; F371-A430 HydrophobicContact CE2-CB 3.91Å; F371-A430 HydrophobicContact CG-CB 3.79Å; F371-A430 HydrophobicContact CZ-CB 3.88Å; F371-A430 WeakPolarHBondContact CZ-O 3.35Å; D428-A430 VanDerWaalsContact C-N 3.34Å
431	A	94.2	Very high	97.3	Very high	48 Å²	48	50 Å²	50	40%	0.397	27%	0.27	S	S	.	.			trans	-86.4	126.5	-176	0	0	0	0	0	112.7	V436 V438	A431-V436 HydrophobicContact CB-CB 4.1Å; A431-V436 HydrophobicContact CB-CG1 4.48Å; A431-V438 HydrophobicContact CB-CG2 3.74Å
432	T	91.6	Very high	97.3	Very high	32 Å²	32	41.6 Å²	41.6	20%	0.196	24%	0.237	C	C	.	.	S	Bend	trans	-89.4	-25.3	164.8	55.3	0	0	0	0	112.7	F371 G412 D413	F371-T432 HydrophobicContact CE1-CG2 3.64Å; F371-T432 HydrophobicContact CZ-CG2 3.89Å; G412-T432 WeakPolarHBondContact O-CB 3.44Å; G412-T432 WeakPolarHBondContact O-CG2 3.23Å; G412-T432 PolarHBondContact O-OG1 2.83Å; D413-T432 WeakPolarHBondContact CA-OG1 3.43Å
433	C	93.9	Very high	97.3	Very high	35 Å²	35	49.1 Å²	49.1	24%	0.236	27%	0.269	C	S	.	.	S	Bend	trans	-163.9	168.7	180	60.4	0	0	0	0	110.2	D413 R418 L435 V436	D413-C433 PolarHBondContact O-SG 3.43Å; R418-C433 PolarHBondContact NH1-SG 3.32Å; C433-L435 PolarHBondContact O-N 3.27Å; C433-V436 PolarHBondContact O-N 3.09Å
434	D	96.9	Very high	97.3	Very high	173 Å²	173	43.3 Å²	43.3	93%	0.925	24%	0.244	S	C	*	.	T	Hydrogen-bonded Turn	trans	-63.5	-9.1	-173.2	-46.9	-39.5	0	0	0	115.1
435	L	97.8	Very high	97.3	Very high	88 Å²	88	46.4 Å²	46.4	46%	0.461	27%	0.265	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80	-16.8	174.7	-57.2	179.2	0	0	0	112.8	C414 A417 R418 C433 T437	C414-L435 HydrophobicContact CB-CB 4.17Å; C414-L435 HydrophobicContact CB-CD1 4.26Å; A417-L435 HydrophobicContact CB-CD1 3.97Å; R418-L435 HydrophobicContact CG-CD1 4.1Å; C433-L435 PolarHBondContact O-N 3.27Å; L435-T437 PolarHBondContact O-N 3.26Å
436	V	98.4	Very high	97.3	Very high	15 Å²	15	45.8 Å²	45.8	9%	0.091	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.4	119.9	-178.2	-177.2	0	0	0	0	111	C414 D428 A431 C433 V438	C414-V436 WeakPolarHBondContact SG-CG2 3.24Å; D428-V436 HydrophobicContact CB-CG1 3.82Å; A431-V436 HydrophobicContact CB-CB 4.1Å; A431-V436 HydrophobicContact CB-CG1 4.48Å; C433-V436 PolarHBondContact O-N 3.09Å; V436-V438 HydrophobicContact CG1-CG2 4.08Å; V436-V438 PolarHBondContact O-N 3.06Å
437	T	98.5	Very high	97.2	Very high	54 Å²	54	47.9 Å²	47.9	33%	0.331	29%	0.285	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84	108.8	162.5	-60	0	0	0	0	109.2	S426 F427 D428 L435 C439 P445	S426-T437 WeakPolarHBondContact O-CB 3.38Å; S426-T437 PolarHBondContact O-N 3.29Å; F427-T437 HydrophobicContact CD1-CG2 3.93Å; F427-T437 HydrophobicContact CE1-CG2 3.83Å; D428-T437 PolarHBondContact N-O 2.98Å; L435-T437 PolarHBondContact O-N 3.26Å; T437-C439 PolarHBondContact O-N 3.03Å; T437-C439 VanDerWaalsContact O-N 3.13Å; T437-P445 HydrophobicContact CG2-CG 3.57Å
438	V	98.1	Very high	97.2	Very high	66 Å²	66	52.8 Å²	52.8	40%	0.4	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.9	96.8	-171.3	-178.1	0	0	0	0	112.3	R361 D428 L429 A431 V436	R361-V438 PolarHBondContact NH2-O 3.31Å; D428-V438 CarbonylContact O-C 3.47Å; D428-V438 WeakPolarHBondContact O-CA 3.26Å; L429-V438 WeakPolarHBondContact O-CG1 3.43Å; A431-V438 HydrophobicContact CB-CG2 3.74Å; V436-V438 HydrophobicContact CG1-CG2 4.08Å; V436-V438 PolarHBondContact O-N 3.06Å
439	C	97.8	Very high	97.3	Very high	13 Å²	13	55 Å²	55	9%	0.088	32%	0.323	C	S	.	.	S	Bend	trans	-148.4	159.5	-178.6	62.1	0	0	0	0	112.8	F427 D428 T437 M441	F427-C439 WeakPolarHBondContact CD1-SG 3.25Å; D428-C439 CarbonylContact C-O 3.29Å; D428-C439 PolarHBondContact O-N 3.06Å; D428-C439 VanDerWaalsContact O-O 3.09Å; T437-C439 PolarHBondContact O-N 3.03Å; T437-C439 VanDerWaalsContact O-N 3.13Å; C439-M441 PolarHBondContact O-N 3.38Å
440	D	98.1	Very high	97.3	Very high	28 Å²	28	55.5 Å²	55.5	15%	0.15	33%	0.329	C	S	.	.			trans	-67.1	124.1	162.6	-169.5	-30.7	0	0	0	108.9	S357 G358 L429 A442 K443	S357-D440 VanDerWaalsContact CB-OD1 3.28Å; S357-D440 WeakPolarHBondContact CB-OD1 3.26Å; S357-D440 WeakPolarHBondContact CB-OD2 2.93Å; S357-D440 PolarHBondContact OG-OD1 3.32Å; S357-D440 PolarHBondContact OG-OD2 3.09Å; G358-D440 PolarHBondContact N-OD2 3.38Å; L429-D440 HydrophobicContact CD2-CB 4.49Å; D440-A442 PolarHBondContact O-N 3.05Å; D440-A442 VanDerWaalsContact O-N 3.14Å; D440-A442 WeakPolarHBondContact OD1-CB 3.39Å; D440-A442 PolarHBondContact OD1-N 2.89Å; D440-K443 CarbonylContact O-C 3.5Å; D440-K443 VanDerWaalsContact O-C 3.29Å; D440-K443 PolarHBondContact O-N 3.19Å
441	M	98.1	Very high	97.5	Very high	18 Å²	18	54.4 Å²	54.4	9%	0.089	32%	0.32	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68.9	-7.2	-178.4	75.1	169.4	176	0	0	113.9	F409 C439 F456 S459 F468	F409-M441 HydrophobicContact CB-CB 4.48Å; F409-M441 HydrophobicContact CB-SD 3.99Å; F409-M441 HydrophobicContact CD1-CB 3.97Å; C439-M441 PolarHBondContact O-N 3.38Å; M441-F456 HydrophobicContact CE-CE1 4.37Å; M441-F456 HydrophobicContact SD-CD1 4.17Å; M441-F456 HydrophobicContact SD-CE1 3.81Å; M441-S459 WeakPolarHBondContact CE-O 3.15Å; M441-F468 HydrophobicContact CE-CB 4.3Å; M441-F468 HydrophobicContact CE-CD1 3.85Å; M441-F468 HydrophobicContact CE-CD2 3.61Å; M441-F468 HydrophobicContact CE-CE1 4.02Å; M441-F468 HydrophobicContact CE-CE2 3.82Å; M441-F468 HydrophobicContact CE-CG 3.65Å; M441-F468 HydrophobicContact CE-CZ 4.02Å; M441-F468 HydrophobicContact CG-CD1 3.7Å; M441-F468 HydrophobicContact CG-CE1 4.14Å; M441-F468 HydrophobicContact CG-CG 4.2Å; M441-F468 HydrophobicContact SD-CD1 4.49Å; M441-F468 HydrophobicContact SD-CG 4.45Å
442	A	97.5	Very high	97.8	Very high	20 Å²	20	53.6 Å²	53.6	17%	0.165	31%	0.309	C	S	.	.	T	Hydrogen-bonded Turn	trans	-71	-15.3	165	0	0	0	0	0	113.4	D440 E467 F468	D440-A442 PolarHBondContact O-N 3.05Å; D440-A442 VanDerWaalsContact O-N 3.14Å; D440-A442 WeakPolarHBondContact OD1-CB 3.39Å; D440-A442 PolarHBondContact OD1-N 2.89Å; A442-E467 HydrophobicContact CB-CB 4.04Å; A442-F468 HydrophobicContact CB-CD1 3.77Å; A442-F468 HydrophobicContact CB-CE1 3.88Å
443	K	98	Very high	98.1	Very high	171 Å²	171	52.2 Å²	52.2	74%	0.743	30%	0.3	S	S	*	.	S	Bend	trans	-152.8	84.9	177.1	-168.5	176.9	180	179.5	0	111.5	D440 E471	D440-K443 CarbonylContact O-C 3.5Å; D440-K443 VanDerWaalsContact O-C 3.29Å; D440-K443 PolarHBondContact O-N 3.19Å; K443-E471 WeakPolarHBondContact CA-OE1 3.38Å
444	V	98.7	Very high	98.3	Very high	5 Å²	5	50.6 Å²	50.6	3%	0.03	29%	0.289	C	S	.	.			trans	-83.5	148.4	-179.3	-58.9	0	0	0	0	111.4	F409 F427 L446 E471 R474 V475	F409-V444 HydrophobicContact CD1-CG1 4.34Å; F409-V444 HydrophobicContact CE1-CG1 3.96Å; F409-V444 HydrophobicContact CE1-CG2 4.44Å; F409-V444 HydrophobicContact CZ-CG2 4.44Å; F427-V444 HydrophobicContact CB-CG1 4.23Å; F427-V444 HydrophobicContact CD1-CB 4.14Å; F427-V444 HydrophobicContact CD1-CG1 4.03Å; F427-V444 HydrophobicContact CD2-CB 4.18Å; F427-V444 HydrophobicContact CD2-CG1 3.72Å; F427-V444 HydrophobicContact CE1-CB 3.98Å; F427-V444 HydrophobicContact CE1-CG1 4.35Å; F427-V444 HydrophobicContact CE2-CB 3.99Å; F427-V444 HydrophobicContact CE2-CG1 4.03Å; F427-V444 HydrophobicContact CE2-CG2 4.22Å; F427-V444 HydrophobicContact CG-CB 4.25Å; F427-V444 HydrophobicContact CG-CG1 3.71Å; F427-V444 HydrophobicContact CZ-CB 3.9Å; F427-V444 HydrophobicContact CZ-CG1 4.34Å; F427-V444 HydrophobicContact CZ-CG2 4.31Å; V444-L446 HydrophobicContact CG2-CB 4.2Å; V444-L446 HydrophobicContact CG2-CD1 4.22Å; V444-L446 HydrophobicContact CG2-CG 4.19Å; V444-L446 PolarHBondContact O-N 3.08Å; V444-E471 HydrophobicContact CG2-CG 4.12Å; V444-E471 WeakPolarHBondContact CG2-OE1 3.27Å; V444-E471 PolarHBondContact N-OE1 3Å; V444-R474 PolarHBondContact O-NH2 2.96Å; V444-V475 HydrophobicContact CG2-CG1 3.77Å
445	P	98.5	Very high	98.4	Very high	92 Å²	92	42.3 Å²	42.3	60%	0.597	25%	0.245	S	C	*	.	S	Bend	trans	-77.5	52.3	-178	32.9	-37.4	0	0	0	113.3	F427 T437	F427-P445 HydrophobicContact CE1-CG 4.17Å; T437-P445 HydrophobicContact CG2-CG 3.57Å
446	L	98.7	Very high	98.5	Very high	28 Å²	28	38.1 Å²	38.1	15%	0.147	22%	0.223	C	C	.	.			trans	-120.7	152.8	176.8	-64.5	-178.7	0	0	0	111.9	H425 F427 V444 V451 R474 V475	H425-L446 HydrophobicContact CB-CD1 4.4Å; F427-L446 HydrophobicContact CE2-CD1 3.79Å; F427-L446 HydrophobicContact CE2-CG 4.37Å; F427-L446 HydrophobicContact CZ-CD1 3.62Å; F427-L446 HydrophobicContact CZ-CD2 4.24Å; F427-L446 HydrophobicContact CZ-CG 3.72Å; V444-L446 HydrophobicContact CG2-CB 4.2Å; V444-L446 HydrophobicContact CG2-CD1 4.22Å; V444-L446 HydrophobicContact CG2-CG 4.19Å; V444-L446 PolarHBondContact O-N 3.08Å; L446-V451 HydrophobicContact CD1-CG1 3.89Å; L446-R474 PolarHBondContact O-NH1 3.38Å; L446-R474 PolarHBondContact O-NH2 3.29Å; L446-V475 HydrophobicContact CB-CB 4.43Å; L446-V475 HydrophobicContact CB-CG1 3.8Å; L446-V475 HydrophobicContact CD1-CB 4.38Å; L446-V475 HydrophobicContact CD1-CG1 4.34Å
447	G	98.6	Very high	98.5	Very high	46 Å²	46	37.9 Å²	37.9	47%	0.474	22%	0.222	S	C	.	.			trans	-74.9	163.6	170.2	0	0	0	0	0	113	S450	G447-S450 WeakPolarHBondContact O-CB 3.4Å; G447-S450 PolarHBondContact O-OG 2.86Å
448	D	98.7	Very high	98.4	Very high	103 Å²	103	35.5 Å²	35.5	55%	0.551	21%	0.207	S	C	*	.	T	Hydrogen-bonded Turn	trans	-63.5	140.7	175.5	-67.9	22.6	0	0	0	110.9	S450 R474	D448-S450 PolarHBondContact O-N 3.08Å; D448-R474 WeakPolarHBondContact CA-O 3.27Å; D448-R474 HydrophobicContact CB-CG 4.36Å; D448-R474 VanDerWaalsContact OD1-CD 3.27Å; D448-R474 WeakPolarHBondContact OD1-CD 3.48Å; D448-R474 WeakPolarHBondContact OD1-CG 3.42Å; D448-R474 IonicContact OD1-CZ 3.87Å; D448-R474 IonicContact OD1-NE 3.08Å; D448-R474 IonicContact OD1-NH1 2.74Å; D448-R474 PolarHBondContact OD1-NH1 2.88Å
449	N	98.6	Very high	98.4	Very high	66 Å²	66	32.9 Å²	32.9	35%	0.353	19%	0.192	S	C	.	.	T	Hydrogen-bonded Turn	trans	53.5	33.4	179	-51.7	-86	0	0	0	114	R474 V475 L476 K477 K525	N449-R474 PolarHBondContact N-O 3.2Å; N449-V475 CarbonylContact C-O 3.43Å; N449-V475 VanDerWaalsContact C-O 3.29Å; N449-V475 VanDerWaalsContact CA-O 3.27Å; N449-V475 WeakPolarHBondContact CA-O 3.47Å; N449-V475 PolarHBondContact N-O 3.39Å; N449-L476 PolarHBondContact OD1-O 3.21Å; N449-K477 HydrophobicContact CB-CG 4.19Å; N449-K477 WeakPolarHBondContact O-CE 3.39Å; N449-K477 WeakPolarHBondContact O-CG 3.38Å; N449-K525 PolarHBondContact OD1-NZ 2.92Å; N449-K525 VanDerWaalsContact OD1-NZ 3.13Å
450	S	98.7	Very high	98.4	Very high	41 Å²	41	32.3 Å²	32.3	29%	0.287	19%	0.188	S	C	.	.			trans	-81.1	-27.2	179	60.5	0	0	0	0	114.8	G447 D448 V475	G447-S450 WeakPolarHBondContact O-CB 3.4Å; G447-S450 PolarHBondContact O-OG 2.86Å; D448-S450 PolarHBondContact O-N 3.08Å; S450-V475 PolarHBondContact N-O 3.46Å
451	V	98.9	Very high	98.3	Very high	0 Å²	0	32.2 Å²	32.2	0%	0	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	155.6	-172.6	-50.5	0	0	0	0	113.6	V405 A407 L446 V475 L476 K477	V405-V451 HydrophobicContact CB-CB 4.44Å; V405-V451 HydrophobicContact CB-CG1 4.5Å; V405-V451 HydrophobicContact CG1-CB 4.22Å; V405-V451 HydrophobicContact CG1-CG1 3.79Å; A407-V451 HydrophobicContact CB-CB 4.45Å; A407-V451 HydrophobicContact CB-CG1 4.12Å; A407-V451 HydrophobicContact CB-CG2 4.03Å; L446-V451 HydrophobicContact CD1-CG1 3.89Å; V451-V475 HydrophobicContact CG2-CB 4.38Å; V451-V475 HydrophobicContact CG2-CG2 3.92Å; V451-V475 PolarHBondContact N-O 3.5Å; V451-L476 HydrophobicContact CG2-CD1 4.07Å; V451-K477 WeakPolarHBondContact O-CD 3.42Å; V451-K477 VanDerWaalsContact O-CG 3.28Å; V451-K477 WeakPolarHBondContact O-CG 3.32Å; V451-K477 PolarHBondContact O-N 3.19Å
452	D	98.9	Very high	98.1	Very high	32 Å²	32	31.7 Å²	31.7	17%	0.171	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	-28.9	-177.1	-56.1	-85.7	0	0	0	112.5	L404 V405 L476 K477 G480 V481	L404-D452 HydrophobicContact CB-CB 3.94Å; L404-D452 HydrophobicContact CD2-CB 3.95Å; L404-D452 HydrophobicContact CG-CB 4.38Å; V405-D452 PolarHBondContact N-OD2 2.79Å; V405-D452 PolarHBondContact O-N 3.12Å; D452-L476 VanDerWaalsContact C-CD1 3.49Å; D452-L476 WeakPolarHBondContact O-CD1 3.49Å; D452-K477 WeakPolarHBondContact OD1-CD 3.43Å; D452-K477 IonicContact OD1-NZ 3.69Å; D452-K477 PolarHBondContact OD1-NZ 2.7Å; D452-K477 IonicContact OD2-NZ 2.72Å; D452-K477 PolarHBondContact OD2-NZ 3.13Å; D452-G480 WeakPolarHBondContact O-CA 3.38Å; D452-V481 PolarHBondContact O-N 2.8Å
453	I	98.9	Very high	97.9	Very high	3 Å²	3	34.8 Å²	34.8	2%	0.015	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131	131.8	176.6	-53.8	177.6	0	0	0	108.9	Y396 I397 L404 V405 V406 A407 V455 V481	Y396-I453 HydrophobicContact CE1-CD1 4.36Å; I397-I453 HydrophobicContact CG1-CD1 4.39Å; L404-I453 HydrophobicContact CD1-CD1 4.13Å; L404-I453 HydrophobicContact CD1-CG1 4.47Å; V405-I453 PolarHBondContact O-N 2.94Å; V406-I453 CarbonylContact C-O 3.52Å; V406-I453 WeakPolarHBondContact CA-O 3.22Å; V406-I453 HydrophobicContact CG1-CB 4.41Å; V406-I453 HydrophobicContact CG1-CG2 4.44Å; V406-I453 HydrophobicContact CG2-CB 4.32Å; V406-I453 HydrophobicContact CG2-CD1 4.43Å; A407-I453 PolarHBondContact N-O 3.49Å; I453-V455 HydrophobicContact CG2-CG2 4.09Å; I453-V481 CarbonylContact C-O 3.5Å; I453-V481 VanDerWaalsContact CA-O 3.29Å; I453-V481 WeakPolarHBondContact CA-O 3.3Å
454	A	98.9	Very high	97.8	Very high	0 Å²	0	27.8 Å²	27.8	0%	0	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	139.8	166.8	0	0	0	0	0	109.6	A407 F409 A472 L476 V481 L482 K483	A407-A454 CarbonylContact O-C 3.58Å; A407-A454 WeakPolarHBondContact O-CA 3.31Å; F409-A454 HydrophobicContact CE2-CB 4.06Å; A454-A472 HydrophobicContact CB-CB 4.35Å; A454-L476 HydrophobicContact CB-CD1 4.22Å; A454-L476 HydrophobicContact CB-CD2 4.46Å; A454-V481 PolarHBondContact N-O 3.48Å; A454-L482 HydrophobicContact CB-CD1 4.04Å; A454-L482 WeakPolarHBondContact O-CA 3.46Å; A454-K483 PolarHBondContact O-N 3.44Å
455	V	98.9	Very high	97.6	Very high	0 Å²	0	27.8 Å²	27.8	0%	0	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	132	-176.8	-179.1	0	0	0	0	110.4	I393 V406 A407 F409 I416 I453 C457 K483	I393-V455 HydrophobicContact CD1-CG1 4.06Å; I393-V455 HydrophobicContact CG2-CG1 3.99Å; I393-V455 HydrophobicContact CG2-CG2 4.08Å; V406-V455 HydrophobicContact CG1-CG2 4.02Å; A407-V455 PolarHBondContact O-N 2.78Å; F409-V455 WeakPolarHBondContact CB-O 3.23Å; F409-V455 PolarHBondContact N-O 3.47Å; I416-V455 HydrophobicContact CD1-CB 4.44Å; I416-V455 HydrophobicContact CD1-CG1 3.93Å; I416-V455 HydrophobicContact CD1-CG2 4.44Å; I453-V455 HydrophobicContact CG2-CG2 4.09Å; V455-C457 HydrophobicContact CG1-CB 4.26Å; V455-K483 WeakPolarHBondContact CA-O 3.47Å; V455-K483 HydrophobicContact CG2-CB 4.36Å
456	F	98.9	Very high	97.5	Very high	0 Å²	0	24.6 Å²	24.6	0%	0	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	125.2	155.9	-62.6	-92.5	0	0	0	108.4	F409 M441 S459 L460 F468 L469 A472 L482 K483 V484 A485	F409-F456 HydrophobicContact CB-CD1 3.54Å; F409-F456 HydrophobicContact CB-CE1 3.31Å; F409-F456 HydrophobicContact CB-CE2 4.47Å; F409-F456 HydrophobicContact CB-CG 4.23Å; F409-F456 HydrophobicContact CB-CZ 3.83Å; F409-F456 AromaticContact CD1-CE1 3.76Å; F409-F456 HydrophobicContact CD1-CE1 3.76Å; F409-F456 AromaticContact CD1-CZ 3.62Å; F409-F456 HydrophobicContact CD1-CZ 3.62Å; F409-F456 HydrophobicContact CD2-CZ 4.27Å; F409-F456 HydrophobicContact CE1-CZ 4.23Å; F409-F456 HydrophobicContact CG-CD1 4.33Å; F409-F456 AromaticContact CG-CE1 3.7Å; F409-F456 HydrophobicContact CG-CE1 3.7Å; F409-F456 HydrophobicContact CG-CE2 4.31Å; F409-F456 AromaticContact CG-CZ 3.68Å; F409-F456 HydrophobicContact CG-CZ 3.68Å; M441-F456 HydrophobicContact CE-CE1 4.37Å; M441-F456 HydrophobicContact SD-CD1 4.17Å; M441-F456 HydrophobicContact SD-CE1 3.81Å; F456-S459 WeakPolarHBondContact CA-OG 3.28Å; F456-L460 HydrophobicContact CB-CD1 4.48Å; F456-L460 HydrophobicContact CB-CD2 4.31Å; F456-L460 HydrophobicContact CB-CG 4Å; F456-L460 HydrophobicContact CD1-CD2 3.42Å; F456-L460 VanDerWaalsContact CD1-CD2 3.42Å; F456-L460 HydrophobicContact CD1-CG 3.97Å; F456-L460 HydrophobicContact CD2-CD2 4.33Å; F456-L460 HydrophobicContact CE1-CD2 3.71Å; F456-L460 HydrophobicContact CG-CD2 3.77Å; F456-L460 HydrophobicContact CG-CG 4.02Å; F456-L460 HydrophobicContact CZ-CD2 4.29Å; F456-F468 HydrophobicContact CE1-CB 3.79Å; F456-F468 HydrophobicContact CZ-CB 3.93Å; F456-L469 HydrophobicContact CD2-CD2 4.3Å; F456-L469 HydrophobicContact CE2-CD2 3.93Å; F456-A472 HydrophobicContact CE2-CB 3.65Å; F456-A472 HydrophobicContact CZ-CB 3.9Å; F456-L482 HydrophobicContact CD2-CD1 3.8Å; F456-L482 HydrophobicContact CE2-CD1 3.87Å; F456-K483 PolarHBondContact N-O 3.39Å; F456-V484 HydrophobicContact CD2-CG2 4.33Å; F456-V484 CarbonylContact O-C 3.43Å; F456-V484 WeakPolarHBondContact O-CA 3.47Å; F456-A485 PolarHBondContact O-N 3.09Å
457	C	98.5	Very high	97.3	Very high	10 Å²	10	28.4 Å²	28.4	7%	0.068	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	99.8	-179.9	-168.3	0	0	0	0	110	L390 I393 V455 S459	L390-C457 HydrophobicContact CD1-CB 3.92Å; I393-C457 HydrophobicContact CD1-CB 3.86Å; V455-C457 HydrophobicContact CG1-CB 4.26Å; C457-S459 PolarHBondContact N-OG 3.33Å; C457-S459 VanDerWaalsContact N-OG 3.1Å; C457-S459 PolarHBondContact O-N 3.49Å; C457-S459 VanDerWaalsContact O-N 3.13Å
458	L	97.5	Very high	97.3	Very high	3 Å²	3	26.2 Å²	26.2	2%	0.016	15%	0.147	C	C	.	.	S	Bend	trans	58.8	15.9	-172.7	-50	-173.5	0	0	0	114	Y378 V382 W385 P389 A485 E486 V487	Y378-L458 HydrophobicContact CE2-CB 4.37Å; Y378-L458 HydrophobicContact CE2-CD1 4.01Å; V382-L458 HydrophobicContact CG2-CD1 4.32Å; W385-L458 HydrophobicContact CH2-CD1 3.94Å; W385-L458 HydrophobicContact CZ3-CD1 3.92Å; P389-L458 HydrophobicContact CG-CD1 4Å; P389-L458 HydrophobicContact CG-CD2 4.04Å; P389-L458 HydrophobicContact CG-CG 3.92Å; L458-A485 PolarHBondContact N-O 3.22Å; L458-E486 VanDerWaalsContact C-OE1 3.24Å; L458-E486 WeakPolarHBondContact CA-OE1 3.45Å; L458-V487 HydrophobicContact CD2-CG2 3.86Å
459	S	97.9	Very high	97.2	Very high	12 Å²	12	21.3 Å²	21.3	8%	0.084	12%	0.121	C	C	.	.			trans	-107.8	-1.4	-166.5	58.5	0	0	0	0	115.3	F409 M441 F456 C457 M461 E486	F409-S459 WeakPolarHBondContact O-CB 3.46Å; F409-S459 PolarHBondContact O-OG 2.91Å; M441-S459 WeakPolarHBondContact CE-O 3.15Å; F456-S459 WeakPolarHBondContact CA-OG 3.28Å; C457-S459 PolarHBondContact N-OG 3.33Å; C457-S459 VanDerWaalsContact N-OG 3.1Å; C457-S459 PolarHBondContact O-N 3.49Å; C457-S459 VanDerWaalsContact O-N 3.13Å; S459-M461 PolarHBondContact O-N 3.01Å; S459-E486 PolarHBondContact N-OE1 3.37Å; S459-E486 VanDerWaalsContact N-OE1 3.16Å
460	L	97.5	Very high	97.2	Very high	1 Å²	1	19.2 Å²	19.2	1%	0.005	11%	0.112	C	C	.	.			trans	-75.4	58.7	174.5	-69.8	174.2	0	0	0	110.9	F456 L465 F468 L469 V484 E486 R490 F497	F456-L460 HydrophobicContact CB-CD1 4.48Å; F456-L460 HydrophobicContact CB-CD2 4.31Å; F456-L460 HydrophobicContact CB-CG 4Å; F456-L460 HydrophobicContact CD1-CD2 3.42Å; F456-L460 VanDerWaalsContact CD1-CD2 3.42Å; F456-L460 HydrophobicContact CD1-CG 3.97Å; F456-L460 HydrophobicContact CD2-CD2 4.33Å; F456-L460 HydrophobicContact CE1-CD2 3.71Å; F456-L460 HydrophobicContact CG-CD2 3.77Å; F456-L460 HydrophobicContact CG-CG 4.02Å; F456-L460 HydrophobicContact CZ-CD2 4.29Å; L460-L465 HydrophobicContact CB-CD2 4.09Å; L460-L465 VanDerWaalsContact O-CD2 3.31Å; L460-L465 WeakPolarHBondContact O-CD2 3.49Å; L460-F468 HydrophobicContact CD2-CB 4.38Å; L460-F468 HydrophobicContact CD2-CD2 4.19Å; L460-L469 HydrophobicContact CD2-CD2 4.48Å; L460-L469 HydrophobicContact CD2-CG 4.43Å; L460-V484 HydrophobicContact CD1-CG1 3.65Å; L460-E486 HydrophobicContact CB-CG 4.33Å; L460-E486 WeakPolarHBondContact CB-OE1 3.48Å; L460-E486 HydrophobicContact CD1-CG 4.14Å; L460-E486 PolarHBondContact N-OE1 3.31Å; L460-R490 VanDerWaalsContact O-CZ 3.25Å; L460-R490 PolarHBondContact O-NH1 3Å; L460-R490 PolarHBondContact O-NH2 3.32Å; L460-F497 HydrophobicContact CD1-CE2 4.35Å
461	M	95	Very high	97.2	Very high	25 Å²	25	18 Å²	18	12%	0.123	10%	0.102	C	C	.	.			trans	-85.3	160.6	174.8	-51.3	-169	92.4	0	0	110.6	L352 Y353 Y374 S459 F468	L352-M461 HydrophobicContact CB-CE 3.61Å; L352-M461 HydrophobicContact CB-SD 4.14Å; L352-M461 HydrophobicContact CD1-CE 3.83Å; L352-M461 HydrophobicContact CD1-SD 4Å; L352-M461 HydrophobicContact CG-CE 4.39Å; Y353-M461 HydrophobicContact CD1-CB 4.21Å; Y353-M461 HydrophobicContact CD1-CE 4.37Å; Y353-M461 HydrophobicContact CD1-CG 4.35Å; Y353-M461 HydrophobicContact CD2-CE 4.05Å; Y353-M461 HydrophobicContact CE1-CB 4.05Å; Y353-M461 HydrophobicContact CE1-CE 3.92Å; Y353-M461 HydrophobicContact CE1-CG 3.72Å; Y353-M461 HydrophobicContact CE2-CE 3.59Å; Y353-M461 HydrophobicContact CG-CE 4.41Å; Y374-M461 HydrophobicContact CE2-CE 3.99Å; Y374-M461 HydrophobicContact CE2-SD 4.46Å; Y374-M461 PolarHBondContact OH-SD 3.28Å; Y374-M461 VanDerWaalsContact OH-SD 3.34Å; S459-M461 PolarHBondContact O-N 3.01Å; M461-F468 WeakPolarHBondContact O-CE2 3.47Å; M461-F468 WeakPolarHBondContact O-CZ 3.3Å
462	G	94.4	Very high	97.2	Very high	7 Å²	7	18 Å²	18	7%	0.072	10%	0.102	C	C	.	.	S	Bend	trans	82.5	168.2	-179	0	0	0	0	0	115.3	L352 T355 L465	L352-G462 WeakPolarHBondContact O-CA 3.46Å; L352-G462 PolarHBondContact O-N 3.1Å; T355-G462 CarbonylContact O-C 3.5Å; T355-G462 WeakPolarHBondContact O-CA 3.35Å; G462-L465 VanDerWaalsContact O-CD2 3.27Å; G462-L465 WeakPolarHBondContact O-CD2 3.48Å
463	T	94.1	Very high	97.1	Very high	86 Å²	86	16.5 Å²	16.5	53%	0.528	9%	0.094	S	C	.	.	S	Bend	trans	-84.6	-22.6	-173.1	55.4	0	0	0	0	113.9	T355 L465	T355-T463 PolarHBondContact O-N 2.8Å; T355-T463 PolarHBondContact O-OG1 2.79Å; T463-L465 VanDerWaalsContact C-N 3.26Å; T463-L465 PolarHBondContact O-N 3.49Å
464	N	94.7	Very high	97.1	Very high	23 Å²	23	19.4 Å²	19.4	12%	0.123	11%	0.105	C	C	.	.			trans	-88.1	39.5	-176.5	56	-44.6	0	0	0	113.6	A356 S357 V466 E467 F468	A356-N464 WeakPolarHBondContact CA-OD1 3.5Å; S357-N464 PolarHBondContact N-OD1 2.78Å; S357-N464 PolarHBondContact OG-ND2 3.46Å; N464-V466 PolarHBondContact O-N 3.02Å; N464-E467 HydrophobicContact CB-CG 4.28Å; N464-E467 WeakPolarHBondContact CB-OE2 3.45Å; N464-E467 PolarHBondContact ND2-OE2 3.49Å; N464-E467 WeakPolarHBondContact O-CB 3.48Å; N464-E467 PolarHBondContact O-N 3.13Å; N464-F468 VanDerWaalsContact OD1-CZ 3.32Å; N464-F468 WeakPolarHBondContact OD1-CZ 3.47Å
465	L	95.6	Very high	97.1	Very high	6 Å²	6	19.4 Å²	19.4	3%	0.031	11%	0.105	C	C	.	.	H	α-helix	trans	-47.6	-33.6	-177.2	-60.7	-178.5	0	0	0	115	L460 G462 T463 E467 F468 L469 L538 L540	L460-L465 HydrophobicContact CB-CD2 4.09Å; L460-L465 VanDerWaalsContact O-CD2 3.31Å; L460-L465 WeakPolarHBondContact O-CD2 3.49Å; G462-L465 VanDerWaalsContact O-CD2 3.27Å; G462-L465 WeakPolarHBondContact O-CD2 3.48Å; T463-L465 VanDerWaalsContact C-N 3.26Å; T463-L465 PolarHBondContact O-N 3.49Å; L465-E467 VanDerWaalsContact C-N 3.33Å; L465-F468 HydrophobicContact CD2-CD2 4.35Å; L465-F468 HydrophobicContact CD2-CE2 4.13Å; L465-L469 PolarHBondContact O-N 3.48Å; L465-L538 HydrophobicContact CB-CD2 3.8Å; L465-L538 HydrophobicContact CB-CG 4.03Å; L465-L538 HydrophobicContact CD1-CG 4.15Å; L465-L540 HydrophobicContact CD1-CB 3.97Å; L465-L540 HydrophobicContact CD1-CD1 4.2Å; L465-L540 HydrophobicContact CD1-CG 3.95Å
466	V	94.9	Very high	97.1	Very high	25 Å²	25	19.4 Å²	19.4	15%	0.152	11%	0.105	C	C	.	.	H	α-helix	trans	-68.7	-31.5	-178.7	-177.4	0	0	0	0	111.9	N464 A470 L504 V533 L538	N464-V466 PolarHBondContact O-N 3.02Å; V466-A470 VanDerWaalsContact O-CB 3.23Å; V466-A470 WeakPolarHBondContact O-CB 3.17Å; V466-A470 PolarHBondContact O-N 3.14Å; V466-L504 HydrophobicContact CG1-CD1 4.32Å; V466-L504 HydrophobicContact CG1-CD2 3.99Å; V466-V533 HydrophobicContact CG1-CG1 3.41Å; V466-V533 VanDerWaalsContact CG1-CG1 3.41Å; V466-L538 HydrophobicContact CG2-CB 3.79Å; V466-L538 HydrophobicContact CG2-CD2 4.31Å
467	E	95.8	Very high	97.1	Very high	107 Å²	107	22.5 Å²	22.5	50%	0.5	12%	0.118	S	C	.	.	H	α-helix	trans	-71.5	-44.4	-179.4	-65.5	172	-173.1	0	0	110.8	A442 N464 L465 L469 A470 E471	A442-E467 HydrophobicContact CB-CB 4.04Å; N464-E467 HydrophobicContact CB-CG 4.28Å; N464-E467 WeakPolarHBondContact CB-OE2 3.45Å; N464-E467 PolarHBondContact ND2-OE2 3.49Å; N464-E467 WeakPolarHBondContact O-CB 3.48Å; N464-E467 PolarHBondContact O-N 3.13Å; L465-E467 VanDerWaalsContact C-N 3.33Å; E467-L469 VanDerWaalsContact C-N 3.33Å; E467-L469 PolarHBondContact O-N 2.85Å; E467-A470 PolarHBondContact O-N 3.36Å; E467-E471 WeakPolarHBondContact O-CB 3.43Å; E467-E471 PolarHBondContact O-N 2.87Å
468	F	97.9	Very high	97.1	Very high	1 Å²	1	26.3 Å²	26.3	0%	0.004	14%	0.136	C	C	.	.	H	α-helix	trans	-59.8	-42.9	176.5	-39.6	-47.5	0	0	0	112	M441 A442 F456 L460 M461 N464 L465 E471 A472	M441-F468 HydrophobicContact CE-CB 4.3Å; M441-F468 HydrophobicContact CE-CD1 3.85Å; M441-F468 HydrophobicContact CE-CD2 3.61Å; M441-F468 HydrophobicContact CE-CE1 4.02Å; M441-F468 HydrophobicContact CE-CE2 3.82Å; M441-F468 HydrophobicContact CE-CG 3.65Å; M441-F468 HydrophobicContact CE-CZ 4.02Å; M441-F468 HydrophobicContact CG-CD1 3.7Å; M441-F468 HydrophobicContact CG-CE1 4.14Å; M441-F468 HydrophobicContact CG-CG 4.2Å; M441-F468 HydrophobicContact SD-CD1 4.49Å; M441-F468 HydrophobicContact SD-CG 4.45Å; A442-F468 HydrophobicContact CB-CD1 3.77Å; A442-F468 HydrophobicContact CB-CE1 3.88Å; F456-F468 HydrophobicContact CE1-CB 3.79Å; F456-F468 HydrophobicContact CZ-CB 3.93Å; L460-F468 HydrophobicContact CD2-CB 4.38Å; L460-F468 HydrophobicContact CD2-CD2 4.19Å; M461-F468 WeakPolarHBondContact O-CE2 3.47Å; M461-F468 WeakPolarHBondContact O-CZ 3.3Å; N464-F468 VanDerWaalsContact OD1-CZ 3.32Å; N464-F468 WeakPolarHBondContact OD1-CZ 3.47Å; L465-F468 HydrophobicContact CD2-CD2 4.35Å; L465-F468 HydrophobicContact CD2-CE2 4.13Å; F468-E471 PolarHBondContact O-N 3.26Å; F468-A472 WeakPolarHBondContact O-CB 3.4Å; F468-A472 PolarHBondContact O-N 3.37Å
469	L	97.8	Very high	97.2	Very high	0 Å²	0	36.3 Å²	36.3	0%	0	17%	0.174	C	C	.	.	H	α-helix	trans	-74.9	-29.9	180	-68.9	168.1	0	0	0	112.7	F456 L460 L465 E467 N473 L482 L501 L504 L538	F456-L469 HydrophobicContact CD2-CD2 4.3Å; F456-L469 HydrophobicContact CE2-CD2 3.93Å; L460-L469 HydrophobicContact CD2-CD2 4.48Å; L460-L469 HydrophobicContact CD2-CG 4.43Å; L465-L469 PolarHBondContact O-N 3.48Å; E467-L469 VanDerWaalsContact C-N 3.33Å; E467-L469 PolarHBondContact O-N 2.85Å; L469-N473 WeakPolarHBondContact O-CB 3.22Å; L469-N473 PolarHBondContact O-N 3.21Å; L469-L482 HydrophobicContact CD2-CD2 4.03Å; L469-L501 HydrophobicContact CD1-CD1 3.69Å; L469-L501 HydrophobicContact CD1-CG 4.13Å; L469-L501 HydrophobicContact CD2-CD2 4.27Å; L469-L504 HydrophobicContact CB-CD1 3.64Å; L469-L504 HydrophobicContact CD1-CD1 4.27Å; L469-L538 HydrophobicContact CD1-CD2 3.35Å
470	A	97.1	Very high	97.2	Very high	21 Å²	21	36 Å²	36	17%	0.174	17%	0.173	C	C	.	.	H	α-helix	trans	-69.3	-39.4	170.5	0	0	0	0	0	111.6	V466 E467 N473 R474 V529	V466-A470 VanDerWaalsContact O-CB 3.23Å; V466-A470 WeakPolarHBondContact O-CB 3.17Å; V466-A470 PolarHBondContact O-N 3.14Å; E467-A470 PolarHBondContact O-N 3.36Å; A470-N473 WeakPolarHBondContact O-CB 3.44Å; A470-N473 PolarHBondContact O-N 3.38Å; A470-R474 PolarHBondContact O-N 2.66Å; A470-V529 HydrophobicContact CB-CG1 4.31Å; A470-V529 HydrophobicContact CB-CG2 4.02Å
471	E	98.5	Very high	97.3	Very high	15 Å²	15	37.2 Å²	37.2	7%	0.07	18%	0.18	C	C	.	.	H	α-helix	trans	-67.7	-42.6	175.4	-178.4	66.4	169.6	0	0	111.6	F409 K443 V444 E467 F468 N473 R474 V475	F409-E471 HydrophobicContact CE1-CG 4.25Å; K443-E471 WeakPolarHBondContact CA-OE1 3.38Å; V444-E471 HydrophobicContact CG2-CG 4.12Å; V444-E471 WeakPolarHBondContact CG2-OE1 3.27Å; V444-E471 PolarHBondContact N-OE1 3Å; E467-E471 WeakPolarHBondContact O-CB 3.43Å; E467-E471 PolarHBondContact O-N 2.87Å; F468-E471 PolarHBondContact O-N 3.26Å; E471-N473 VanDerWaalsContact C-N 3.3Å; E471-N473 PolarHBondContact O-N 2.83Å; E471-R474 WeakPolarHBondContact O-CB 3.49Å; E471-R474 PolarHBondContact O-N 2.69Å; E471-R474 VanDerWaalsContact O-N 3.09Å; E471-R474 IonicContact OE1-CZ 2.81Å; E471-R474 IonicContact OE1-NE 2.68Å; E471-R474 IonicContact OE1-NH2 2.66Å; E471-R474 PolarHBondContact OE1-NH2 2.96Å; E471-R474 IonicContact OE2-CZ 3.57Å; E471-R474 IonicContact OE2-NE 3.66Å; E471-R474 PolarHBondContact OE2-NE 2.92Å; E471-R474 IonicContact OE2-NH2 3.55Å; E471-R474 PolarHBondContact OE2-NH2 2.78Å; E471-V475 PolarHBondContact O-N 2.95Å
472	A	98.7	Very high	97.5	Very high	0 Å²	0	36 Å²	36	0%	0	17%	0.174	C	C	.	.	H	α-helix	trans	-58.8	-40.3	169.9	0	0	0	0	0	111.8	F409 A454 F456 F468 L476 L482	F409-A472 HydrophobicContact CE1-CB 4.32Å; F409-A472 HydrophobicContact CE2-CB 4.32Å; F409-A472 HydrophobicContact CZ-CB 3.98Å; A454-A472 HydrophobicContact CB-CB 4.35Å; F456-A472 HydrophobicContact CE2-CB 3.65Å; F456-A472 HydrophobicContact CZ-CB 3.9Å; F468-A472 WeakPolarHBondContact O-CB 3.4Å; F468-A472 PolarHBondContact O-N 3.37Å; A472-L476 WeakPolarHBondContact O-CB 3.47Å; A472-L476 PolarHBondContact O-N 2.99Å; A472-L476 VanDerWaalsContact O-N 3.09Å; A472-L482 HydrophobicContact CB-CD1 4.49Å
473	N	98.6	Very high	97.7	Very high	2 Å²	2	37.1 Å²	37.1	1%	0.011	18%	0.177	C	C	.	.	H	α-helix	trans	-62	-43.5	172.2	-174.6	-72.5	0	0	0	111.5	L469 A470 E471 L504 F506 K525 G527 N528 V529	L469-N473 WeakPolarHBondContact O-CB 3.22Å; L469-N473 PolarHBondContact O-N 3.21Å; A470-N473 WeakPolarHBondContact O-CB 3.44Å; A470-N473 PolarHBondContact O-N 3.38Å; E471-N473 VanDerWaalsContact C-N 3.3Å; E471-N473 PolarHBondContact O-N 2.83Å; N473-L504 PolarHBondContact ND2-O 3.14Å; N473-F506 HydrophobicContact CB-CE2 3.81Å; N473-F506 HydrophobicContact CB-CZ 3.63Å; N473-K525 WeakPolarHBondContact O-CD 3.24Å; N473-K525 WeakPolarHBondContact O-CE 3.17Å; N473-K525 PolarHBondContact O-NZ 3.48Å; N473-K525 VanDerWaalsContact OD1-CE 3.3Å; N473-K525 WeakPolarHBondContact OD1-CE 3.19Å; N473-G527 PolarHBondContact ND2-O 2.83Å; N473-G527 PolarHBondContact OD1-O 2.93Å; N473-N528 WeakPolarHBondContact OD1-CA 3.39Å; N473-V529 HydrophobicContact CB-CG2 3.54Å; N473-V529 PolarHBondContact OD1-N 2.81Å
474	R	98.6	Very high	97.9	Very high	63 Å²	63	33.1 Å²	33.1	24%	0.238	15%	0.152	C	C	.	.	H	α-helix	trans	-58.8	-52.1	-179.7	-173.1	-173.4	67.1	80.6	-1.4	112	V444 L446 D448 N449 A470 E471	V444-R474 PolarHBondContact O-NH2 2.96Å; L446-R474 PolarHBondContact O-NH1 3.38Å; L446-R474 PolarHBondContact O-NH2 3.29Å; D448-R474 WeakPolarHBondContact CA-O 3.27Å; D448-R474 HydrophobicContact CB-CG 4.36Å; D448-R474 VanDerWaalsContact OD1-CD 3.27Å; D448-R474 WeakPolarHBondContact OD1-CD 3.48Å; D448-R474 WeakPolarHBondContact OD1-CG 3.42Å; D448-R474 IonicContact OD1-CZ 3.87Å; D448-R474 IonicContact OD1-NE 3.08Å; D448-R474 IonicContact OD1-NH1 2.74Å; D448-R474 PolarHBondContact OD1-NH1 2.88Å; N449-R474 PolarHBondContact N-O 3.2Å; A470-R474 PolarHBondContact O-N 2.66Å; E471-R474 WeakPolarHBondContact O-CB 3.49Å; E471-R474 PolarHBondContact O-N 2.69Å; E471-R474 VanDerWaalsContact O-N 3.09Å; E471-R474 IonicContact OE1-CZ 2.81Å; E471-R474 IonicContact OE1-NE 2.68Å; E471-R474 IonicContact OE1-NH2 2.66Å; E471-R474 PolarHBondContact OE1-NH2 2.96Å; E471-R474 IonicContact OE2-CZ 3.57Å; E471-R474 IonicContact OE2-NE 3.66Å; E471-R474 PolarHBondContact OE2-NE 2.92Å; E471-R474 IonicContact OE2-NH2 3.55Å; E471-R474 PolarHBondContact OE2-NH2 2.78Å
475	V	98.8	Very high	98.1	Very high	0 Å²	0	32 Å²	32	0%	0	15%	0.147	C	C	.	.	H	α-helix	trans	-75.8	-25.8	-176.2	-56.7	0	0	0	0	113.3	F409 V444 L446 N449 S450 V451 E471	F409-V475 HydrophobicContact CE2-CG2 4.34Å; F409-V475 HydrophobicContact CZ-CG2 3.82Å; V444-V475 HydrophobicContact CG2-CG1 3.77Å; L446-V475 HydrophobicContact CB-CB 4.43Å; L446-V475 HydrophobicContact CB-CG1 3.8Å; L446-V475 HydrophobicContact CD1-CB 4.38Å; L446-V475 HydrophobicContact CD1-CG1 4.34Å; N449-V475 CarbonylContact C-O 3.43Å; N449-V475 VanDerWaalsContact C-O 3.29Å; N449-V475 VanDerWaalsContact CA-O 3.27Å; N449-V475 WeakPolarHBondContact CA-O 3.47Å; N449-V475 PolarHBondContact N-O 3.39Å; S450-V475 PolarHBondContact N-O 3.46Å; V451-V475 HydrophobicContact CG2-CB 4.38Å; V451-V475 HydrophobicContact CG2-CG2 3.92Å; V451-V475 PolarHBondContact N-O 3.5Å; E471-V475 PolarHBondContact O-N 2.95Å
476	L	98.9	Very high	98.1	Very high	0 Å²	0	31.7 Å²	31.7	0%	0	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77	133.1	-178.7	-169.9	66.4	0	0	0	111.2	N449 V451 D452 A454 A472 L482 F506 K525	N449-L476 PolarHBondContact OD1-O 3.21Å; V451-L476 HydrophobicContact CG2-CD1 4.07Å; D452-L476 VanDerWaalsContact C-CD1 3.49Å; D452-L476 WeakPolarHBondContact O-CD1 3.49Å; A454-L476 HydrophobicContact CB-CD1 4.22Å; A454-L476 HydrophobicContact CB-CD2 4.46Å; A472-L476 WeakPolarHBondContact O-CB 3.47Å; A472-L476 PolarHBondContact O-N 2.99Å; A472-L476 VanDerWaalsContact O-N 3.09Å; L476-L482 HydrophobicContact CD2-CB 4.2Å; L476-F506 HydrophobicContact CD2-CE1 3.98Å; L476-K525 HydrophobicContact CB-CD 4.4Å; L476-K525 HydrophobicContact CD2-CB 4.09Å; L476-K525 WeakPolarHBondContact O-CD 3.4Å; L476-K525 PolarHBondContact O-NZ 3.28Å
477	K	98.8	Very high	98.2	Very high	65 Å²	65	30.9 Å²	30.9	28%	0.283	14%	0.14	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-59.7	152	174	-70.4	158.9	-175.1	170	0	111.2	N449 V451 D452 R479 G480	N449-K477 HydrophobicContact CB-CG 4.19Å; N449-K477 WeakPolarHBondContact O-CE 3.39Å; N449-K477 WeakPolarHBondContact O-CG 3.38Å; V451-K477 WeakPolarHBondContact O-CD 3.42Å; V451-K477 VanDerWaalsContact O-CG 3.28Å; V451-K477 WeakPolarHBondContact O-CG 3.32Å; V451-K477 PolarHBondContact O-N 3.19Å; D452-K477 WeakPolarHBondContact OD1-CD 3.43Å; D452-K477 IonicContact OD1-NZ 3.69Å; D452-K477 PolarHBondContact OD1-NZ 2.7Å; D452-K477 IonicContact OD2-NZ 2.72Å; D452-K477 PolarHBondContact OD2-NZ 3.13Å; K477-R479 PolarHBondContact O-N 3.42Å; K477-G480 WeakPolarHBondContact O-CA 3.29Å; K477-G480 PolarHBondContact O-N 3.15Å
478	M	98.5	Very high	98.2	Very high	90 Å²	90	26.5 Å²	26.5	44%	0.443	12%	0.122	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-56.9	134.4	167.4	-167.2	58.4	68.5	0	0	109.8	G480 K525 T526	M478-G480 PolarHBondContact O-N 2.64Å; M478-K525 HydrophobicContact SD-CG 4.18Å; M478-T526 VanDerWaalsContact SD-C 3.53Å
479	R	98.4	Very high	98	Very high	213 Å²	213	30.3 Å²	30.3	80%	0.804	15%	0.149	S	C	*	.	E	Extended strand (participates in β ladder)	trans	64.7	5.5	-168	-54	175.3	60.9	-171.2	-1.7	116.3	K477 V524 K525	K477-R479 PolarHBondContact O-N 3.42Å; R479-V524 HydrophobicContact CB-CG2 4.37Å; R479-V524 WeakPolarHBondContact O-CG2 3.35Å; R479-K525 WeakPolarHBondContact CA-O 3.42Å; R479-K525 PolarHBondContact N-O 3.24Å
480	G	98.7	Very high	97.9	Very high	7 Å²	7	30.5 Å²	30.5	7%	0.072	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.3	161	168.1	0	0	0	0	0	112.2	D452 K477 M478 V524 K525	D452-G480 WeakPolarHBondContact O-CA 3.38Å; K477-G480 WeakPolarHBondContact O-CA 3.29Å; K477-G480 PolarHBondContact O-N 3.15Å; M478-G480 PolarHBondContact O-N 2.64Å; G480-V524 WeakPolarHBondContact O-CA 3.32Å; G480-K525 PolarHBondContact O-N 2.84Å
481	V	98.8	Very high	97.8	Very high	26 Å²	26	30.5 Å²	30.5	16%	0.158	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101	132.3	-172.9	179.5	0	0	0	0	111.4	D452 I453 A454 K483 E522 F523	D452-V481 PolarHBondContact O-N 2.8Å; I453-V481 CarbonylContact C-O 3.5Å; I453-V481 VanDerWaalsContact CA-O 3.29Å; I453-V481 WeakPolarHBondContact CA-O 3.3Å; A454-V481 PolarHBondContact N-O 3.48Å; V481-K483 HydrophobicContact CG1-CG 4.31Å; V481-E522 HydrophobicContact CG1-CG 3.76Å; V481-F523 CarbonylContact C-O 3.51Å; V481-F523 WeakPolarHBondContact CA-O 3.31Å
482	L	98.9	Very high	97.4	Very high	0 Å²	0	35.7 Å²	35.7	0%	0	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	122.3	166.7	169.8	66.2	0	0	0	109	A454 F456 L469 A472 L476 V484 L501 F506 F523	A454-L482 HydrophobicContact CB-CD1 4.04Å; A454-L482 WeakPolarHBondContact O-CA 3.46Å; F456-L482 HydrophobicContact CD2-CD1 3.8Å; F456-L482 HydrophobicContact CE2-CD1 3.87Å; L469-L482 HydrophobicContact CD2-CD2 4.03Å; A472-L482 HydrophobicContact CB-CD1 4.49Å; L476-L482 HydrophobicContact CD2-CB 4.2Å; L482-V484 HydrophobicContact CD1-CG2 4.14Å; L482-V484 HydrophobicContact CD2-CG2 4.29Å; L482-V484 HydrophobicContact CG-CG2 4.07Å; L482-L501 HydrophobicContact CD2-CD2 3.85Å; L482-F506 HydrophobicContact CB-CD1 4.05Å; L482-F506 HydrophobicContact CB-CE1 3.74Å; L482-F506 HydrophobicContact CB-CZ 4.49Å; L482-F506 HydrophobicContact CD2-CD1 3.86Å; L482-F506 HydrophobicContact CD2-CD2 4.2Å; L482-F506 HydrophobicContact CD2-CE1 3.59Å; L482-F506 HydrophobicContact CD2-CE2 3.95Å; L482-F506 HydrophobicContact CD2-CG 4.15Å; L482-F506 HydrophobicContact CD2-CZ 3.63Å; L482-F506 HydrophobicContact CG-CE1 4.26Å; L482-F523 HydrophobicContact CB-CB 4.24Å; L482-F523 PolarHBondContact N-O 3.42Å; L482-F523 PolarHBondContact O-N 2.86Å
483	K	98.8	Very high	97	Very high	29 Å²	29	39.4 Å²	39.4	13%	0.126	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	129.4	170.1	-73.9	-74.5	176.4	175.8	0	109.3	Y396 A454 V455 F456 V481 E522	Y396-K483 VanDerWaalsContact CD2-NZ 3.32Å; Y396-K483 VanDerWaalsContact CE2-CE 3.43Å; A454-K483 PolarHBondContact O-N 3.44Å; V455-K483 WeakPolarHBondContact CA-O 3.47Å; V455-K483 HydrophobicContact CG2-CB 4.36Å; F456-K483 PolarHBondContact N-O 3.39Å; V481-K483 HydrophobicContact CG1-CG 4.31Å; K483-E522 HydrophobicContact CD-CB 4.39Å; K483-E522 HydrophobicContact CD-CG 4.38Å; K483-E522 WeakPolarHBondContact CE-OE2 3.47Å; K483-E522 VanDerWaalsContact NZ-CD 3.31Å; K483-E522 IonicContact NZ-OE2 3.36Å; K483-E522 PolarHBondContact NZ-OE2 2.82Å
484	V	98.8	Very high	96.9	Very high	2 Å²	2	40.5 Å²	40.5	1%	0.012	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	127.8	170	-177.6	0	0	0	0	108.5	F456 L460 L482 E486 F497 S520 F521	F456-V484 HydrophobicContact CD2-CG2 4.33Å; F456-V484 CarbonylContact O-C 3.43Å; F456-V484 WeakPolarHBondContact O-CA 3.47Å; L460-V484 HydrophobicContact CD1-CG1 3.65Å; L482-V484 HydrophobicContact CD1-CG2 4.14Å; L482-V484 HydrophobicContact CD2-CG2 4.29Å; L482-V484 HydrophobicContact CG-CG2 4.07Å; V484-E486 HydrophobicContact CG1-CG 3.99Å; V484-F497 HydrophobicContact CB-CZ 4.47Å; V484-F497 HydrophobicContact CG1-CZ 4.04Å; V484-F497 HydrophobicContact CG2-CZ 4.47Å; V484-S520 CarbonylContact O-C 3.59Å; V484-S520 WeakPolarHBondContact O-CA 3.4Å; V484-F521 PolarHBondContact N-O 3.02Å; V484-F521 VanDerWaalsContact N-O 3.1Å; V484-F521 PolarHBondContact O-N 3.22Å
485	A	98.2	Very high	96.7	Very high	0 Å²	0	42.1 Å²	42.1	0%	0	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	129.1	165.7	0	0	0	0	0	109.3	P389 I393 F456 L458 F519	P389-A485 HydrophobicContact CB-CB 3.52Å; P389-A485 HydrophobicContact CG-CB 4.36Å; I393-A485 HydrophobicContact CD1-CB 4.11Å; F456-A485 PolarHBondContact O-N 3.09Å; L458-A485 PolarHBondContact N-O 3.22Å; A485-F519 WeakPolarHBondContact CA-O 3.46Å
486	E	97.6	Very high	96.4	Very high	0 Å²	0	47.2 Å²	47.2	0%	0	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.3	152.4	-171.7	-89.6	-58.6	159.3	0	0	112.1	L458 S459 L460 V484 A488 R490 F491 F518 F519	L458-E486 VanDerWaalsContact C-OE1 3.24Å; L458-E486 WeakPolarHBondContact CA-OE1 3.45Å; S459-E486 PolarHBondContact N-OE1 3.37Å; S459-E486 VanDerWaalsContact N-OE1 3.16Å; L460-E486 HydrophobicContact CB-CG 4.33Å; L460-E486 WeakPolarHBondContact CB-OE1 3.48Å; L460-E486 HydrophobicContact CD1-CG 4.14Å; L460-E486 PolarHBondContact N-OE1 3.31Å; V484-E486 HydrophobicContact CG1-CG 3.99Å; E486-A488 PolarHBondContact O-N 2.99Å; E486-R490 IonicContact OE1-NH1 3.93Å; E486-R490 PolarHBondContact OE1-NH1 3.38Å; E486-R490 VanDerWaalsContact OE2-CD 3.24Å; E486-R490 WeakPolarHBondContact OE2-CD 3.38Å; E486-R490 IonicContact OE2-CZ 3.56Å; E486-R490 IonicContact OE2-NE 3.25Å; E486-R490 IonicContact OE2-NH1 2.69Å; E486-R490 PolarHBondContact OE2-NH1 3.15Å; E486-F491 HydrophobicContact CB-CE2 3.64Å; E486-F491 HydrophobicContact CB-CZ 3.67Å; E486-F518 CarbonylContact O-C 3.59Å; E486-F518 VanDerWaalsContact O-CA 3.25Å; E486-F518 WeakPolarHBondContact O-CA 3.46Å; E486-F518 WeakPolarHBondContact O-CB 3.43Å; E486-F519 PolarHBondContact N-O 2.91Å; E486-F519 PolarHBondContact O-N 3Å
487	V	95.8	Very high	96.3	Very high	8 Å²	8	47.5 Å²	47.5	5%	0.048	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-64	128.7	-173.6	-165.2	0	0	0	0	110.3	W385 L458 S489 R490 H517 C543	W385-V487 HydrophobicContact CH2-CG1 4.22Å; W385-V487 HydrophobicContact CH2-CG2 4.02Å; L458-V487 HydrophobicContact CD2-CG2 3.86Å; V487-S489 PolarHBondContact O-N 3.07Å; V487-S489 VanDerWaalsContact O-N 3.12Å; V487-R490 HydrophobicContact CB-CG 4.07Å; V487-R490 VanDerWaalsContact O-CB 3.26Å; V487-R490 WeakPolarHBondContact O-CB 3.43Å; V487-R490 WeakPolarHBondContact O-CG 3.47Å; V487-R490 PolarHBondContact O-N 3.17Å; V487-H517 CarbonylContact C-O 3.52Å; V487-H517 WeakPolarHBondContact CA-O 3.43Å; V487-H517 WeakPolarHBondContact CG1-O 3.49Å; V487-C543 HydrophobicContact CB-CB 4.32Å; V487-C543 HydrophobicContact CG2-CB 4.02Å
488	A	95.3	Very high	96.2	Very high	14 Å²	14	45.1 Å²	45.1	12%	0.116	23%	0.229	C	C	.	.	G	3₁₀ helix	trans	-57.3	-35.8	-168.6	0	0	0	0	0	113	E486 R490 F491 H517 F519	E486-A488 PolarHBondContact O-N 2.99Å; A488-R490 PolarHBondContact O-N 3.45Å; A488-F491 PolarHBondContact O-N 3.23Å; A488-H517 PolarHBondContact N-O 3.21Å; A488-F519 HydrophobicContact CB-CD1 3.7Å; A488-F519 HydrophobicContact CB-CD2 4.31Å; A488-F519 HydrophobicContact CB-CE1 3.52Å; A488-F519 HydrophobicContact CB-CE2 4.14Å; A488-F519 HydrophobicContact CB-CG 4.12Å; A488-F519 HydrophobicContact CB-CZ 3.76Å
489	S	94.4	Very high	96	Very high	82 Å²	82	44 Å²	44	57%	0.573	23%	0.23	S	C	*	.	G	3₁₀ helix	trans	-68.2	-10.1	177.6	56.9	0	0	0	0	115.1	V487 F491	V487-S489 PolarHBondContact O-N 3.07Å; V487-S489 VanDerWaalsContact O-N 3.12Å; S489-F491 VanDerWaalsContact C-N 3.33Å
490	R	95.6	Very high	95.8	Very high	3 Å²	3	34.2 Å²	34.2	1%	0.011	20%	0.196	C	C	.	.	G	3₁₀ helix	trans	-76.1	-20.4	175.1	-61	-171.5	70.2	-163.3	-2.1	113.3	L460 E486 V487 A488 L540 K541 C543	L460-R490 VanDerWaalsContact O-CZ 3.25Å; L460-R490 PolarHBondContact O-NH1 3Å; L460-R490 PolarHBondContact O-NH2 3.32Å; E486-R490 IonicContact OE1-NH1 3.93Å; E486-R490 PolarHBondContact OE1-NH1 3.38Å; E486-R490 VanDerWaalsContact OE2-CD 3.24Å; E486-R490 WeakPolarHBondContact OE2-CD 3.38Å; E486-R490 IonicContact OE2-CZ 3.56Å; E486-R490 IonicContact OE2-NE 3.25Å; E486-R490 IonicContact OE2-NH1 2.69Å; E486-R490 PolarHBondContact OE2-NH1 3.15Å; V487-R490 HydrophobicContact CB-CG 4.07Å; V487-R490 VanDerWaalsContact O-CB 3.26Å; V487-R490 WeakPolarHBondContact O-CB 3.43Å; V487-R490 WeakPolarHBondContact O-CG 3.47Å; V487-R490 PolarHBondContact O-N 3.17Å; A488-R490 PolarHBondContact O-N 3.45Å; R490-L540 HydrophobicContact CB-CB 4.32Å; R490-K541 WeakPolarHBondContact CB-O 3.3Å; R490-K541 VanDerWaalsContact CG-O 3.23Å; R490-K541 WeakPolarHBondContact CG-O 3.15Å; R490-K541 PolarHBondContact NE-O 3.38Å; R490-K541 PolarHBondContact O-N 2.95Å; R490-C543 HydrophobicContact CG-CB 4.3Å
491	F	94.8	Very high	95.7	Very high	21 Å²	21	33.9 Å²	33.9	9%	0.092	19%	0.192	C	C	.	.			trans	-95.1	106.8	-173.7	-63.2	-87.6	0	0	0	112	E486 A488 S489 V494 F497 F519 F521 L540	E486-F491 HydrophobicContact CB-CE2 3.64Å; E486-F491 HydrophobicContact CB-CZ 3.67Å; A488-F491 PolarHBondContact O-N 3.23Å; S489-F491 VanDerWaalsContact C-N 3.33Å; F491-V494 HydrophobicContact CB-CG2 3.79Å; F491-V494 HydrophobicContact CD1-CG2 4.18Å; F491-V494 HydrophobicContact CG-CG2 4.06Å; F491-F497 HydrophobicContact CD1-CB 4.18Å; F491-F497 HydrophobicContact CD1-CG 4.32Å; F491-F497 HydrophobicContact CE1-CB 4.05Å; F491-F497 AromaticContact CE1-CD1 3.97Å; F491-F497 HydrophobicContact CE1-CD1 3.97Å; F491-F497 AromaticContact CE1-CD2 3.85Å; F491-F497 HydrophobicContact CE1-CD2 3.85Å; F491-F497 HydrophobicContact CE1-CE1 4.4Å; F491-F497 HydrophobicContact CE1-CE2 4.31Å; F491-F497 AromaticContact CE1-CG 3.69Å; F491-F497 HydrophobicContact CE1-CG 3.69Å; F491-F519 HydrophobicContact CB-CD2 4.37Å; F491-F519 HydrophobicContact CB-CE2 4.31Å; F491-F519 HydrophobicContact CD2-CB 4.5Å; F491-F519 AromaticContact CD2-CD2 3.56Å; F491-F519 HydrophobicContact CD2-CD2 3.56Å; F491-F519 HydrophobicContact CD2-CE2 4.21Å; F491-F519 HydrophobicContact CD2-CG 4.39Å; F491-F519 HydrophobicContact CE2-CB 4.12Å; F491-F519 HydrophobicContact CE2-CD2 4.03Å; F491-F519 HydrophobicContact CE2-CG 4.49Å; F491-F519 HydrophobicContact CG-CD2 4.06Å; F491-F519 HydrophobicContact CG-CE2 4.49Å; F491-F521 AromaticContact CE1-CE2 3.99Å; F491-F521 HydrophobicContact CE1-CE2 3.99Å; F491-F521 HydrophobicContact CE1-CZ 4.16Å; F491-F521 HydrophobicContact CE2-CE2 4.19Å; F491-F521 AromaticContact CZ-CE2 3.57Å; F491-F521 HydrophobicContact CZ-CE2 3.57Å; F491-F521 HydrophobicContact CZ-CZ 4.13Å; F491-L540 HydrophobicContact CD1-CD2 3.62Å; F491-L540 HydrophobicContact CE1-CD2 3.67Å; F491-L540 HydrophobicContact CG-CD2 4.26Å; F491-L540 HydrophobicContact CZ-CD2 4.35Å
492	D	90.4	Very high	95.6	Very high	124 Å²	124	35.4 Å²	35.4	66%	0.663	21%	0.207	S	C	*	.	S	Bend	trans	-71.8	-42.8	166.5	-86.3	-55.4	0	0	0	112.2	K541	D492-K541 IonicContact OD1-NZ 3.04Å; D492-K541 PolarHBondContact OD1-NZ 3.41Å; D492-K541 VanDerWaalsContact OD2-CD 3.27Å; D492-K541 WeakPolarHBondContact OD2-CD 3.39Å; D492-K541 WeakPolarHBondContact OD2-CE 3.46Å; D492-K541 IonicContact OD2-NZ 2.69Å; D492-K541 PolarHBondContact OD2-NZ 3.39Å
493	N	91.2	Very high	95.3	Very high	79 Å²	79	36.2 Å²	36.2	42%	0.422	22%	0.215	S	C	.	.			trans	-143.6	106.8	173.8	-175.1	-6.6	0	0	0	109.7	Q495 N496 F497	N493-Q495 PolarHBondContact O-N 2.98Å; N493-Q495 VanDerWaalsContact OD1-CB 3.31Å; N493-Q495 WeakPolarHBondContact OD1-CB 3.2Å; N493-Q495 PolarHBondContact OD1-N 2.85Å; N493-N496 HydrophobicContact CB-CB 4.31Å; N493-N496 PolarHBondContact ND2-OD1 2.74Å; N493-N496 VanDerWaalsContact ND2-OD1 3.14Å; N493-N496 WeakPolarHBondContact O-CB 3.42Å; N493-N496 PolarHBondContact O-N 3.46Å; N493-F497 PolarHBondContact O-N 3.34Å
494	V	95.1	Very high	95.2	Very high	25 Å²	25	34.8 Å²	34.8	15%	0.152	21%	0.209	C	C	.	.	H	α-helix	trans	-57	-30.1	177.1	174.8	0	0	0	0	111.9	F491 F497 I498 T513 F519 F521	F491-V494 HydrophobicContact CB-CG2 3.79Å; F491-V494 HydrophobicContact CD1-CG2 4.18Å; F491-V494 HydrophobicContact CG-CG2 4.06Å; V494-F497 WeakPolarHBondContact O-CB 3.46Å; V494-F497 PolarHBondContact O-N 2.91Å; V494-I498 HydrophobicContact CG1-CD1 3.78Å; V494-I498 HydrophobicContact CG1-CG1 4.42Å; V494-I498 WeakPolarHBondContact O-CD1 3.4Å; V494-I498 VanDerWaalsContact O-CG1 3.31Å; V494-I498 WeakPolarHBondContact O-CG1 3.27Å; V494-I498 PolarHBondContact O-N 3.06Å; V494-T513 HydrophobicContact CG1-CG2 4.49Å; V494-F519 HydrophobicContact CG2-CD2 3.84Å; V494-F519 HydrophobicContact CG2-CE2 3.75Å; V494-F521 HydrophobicContact CG1-CE1 3.56Å; V494-F521 HydrophobicContact CG1-CZ 3.71Å
495	Q	94.4	Very high	95.1	Very high	96 Å²	96	35.2 Å²	35.2	45%	0.449	21%	0.214	S	C	.	.	H	α-helix	trans	-69.8	-32	177.1	-168.8	54.6	55.4	0	0	112.8	N493 F497 I498 S499	N493-Q495 PolarHBondContact O-N 2.98Å; N493-Q495 VanDerWaalsContact OD1-CB 3.31Å; N493-Q495 WeakPolarHBondContact OD1-CB 3.2Å; N493-Q495 PolarHBondContact OD1-N 2.85Å; Q495-F497 VanDerWaalsContact C-N 3.34Å; Q495-I498 PolarHBondContact O-N 3.24Å; Q495-S499 PolarHBondContact NE2-OG 3.31Å; Q495-S499 WeakPolarHBondContact O-CB 3.36Å; Q495-S499 PolarHBondContact O-N 2.9Å; Q495-S499 PolarHBondContact O-OG 2.87Å
496	N	93.9	Very high	95.1	Very high	108 Å²	108	35.4 Å²	35.4	58%	0.578	22%	0.215	S	C	*	.	H	α-helix	trans	-65.9	-40.2	174.9	-69.4	6.1	0	0	0	110.8	N493 S499 A500	N493-N496 HydrophobicContact CB-CB 4.31Å; N493-N496 PolarHBondContact ND2-OD1 2.74Å; N493-N496 VanDerWaalsContact ND2-OD1 3.14Å; N493-N496 WeakPolarHBondContact O-CB 3.42Å; N493-N496 PolarHBondContact O-N 3.46Å; N496-S499 PolarHBondContact O-N 3.17Å; N496-A500 WeakPolarHBondContact O-CB 3.28Å; N496-A500 PolarHBondContact O-N 3.21Å
497	F	95.5	Very high	95.2	Very high	5 Å²	5	41.7 Å²	41.7	2%	0.022	24%	0.242	C	C	.	.	H	α-helix	trans	-60.5	-51.1	173.6	178.9	-96	0	0	0	111.5	L460 V484 F491 N493 V494 Q495 S499 A500 L501 F521 F523 L538 L540	L460-F497 HydrophobicContact CD1-CE2 4.35Å; V484-F497 HydrophobicContact CB-CZ 4.47Å; V484-F497 HydrophobicContact CG1-CZ 4.04Å; V484-F497 HydrophobicContact CG2-CZ 4.47Å; F491-F497 HydrophobicContact CD1-CB 4.18Å; F491-F497 HydrophobicContact CD1-CG 4.32Å; F491-F497 HydrophobicContact CE1-CB 4.05Å; F491-F497 AromaticContact CE1-CD1 3.97Å; F491-F497 HydrophobicContact CE1-CD1 3.97Å; F491-F497 AromaticContact CE1-CD2 3.85Å; F491-F497 HydrophobicContact CE1-CD2 3.85Å; F491-F497 HydrophobicContact CE1-CE1 4.4Å; F491-F497 HydrophobicContact CE1-CE2 4.31Å; F491-F497 AromaticContact CE1-CG 3.69Å; F491-F497 HydrophobicContact CE1-CG 3.69Å; N493-F497 PolarHBondContact O-N 3.34Å; V494-F497 WeakPolarHBondContact O-CB 3.46Å; V494-F497 PolarHBondContact O-N 2.91Å; Q495-F497 VanDerWaalsContact C-N 3.34Å; F497-S499 VanDerWaalsContact C-N 3.34Å; F497-S499 PolarHBondContact O-N 2.87Å; F497-A500 PolarHBondContact O-N 2.95Å; F497-L501 HydrophobicContact CD1-CD1 4.23Å; F497-L501 HydrophobicContact CD2-CD1 4.04Å; F497-L501 HydrophobicContact CE1-CD1 3.92Å; F497-L501 HydrophobicContact CE1-CD2 4.08Å; F497-L501 HydrophobicContact CE2-CD1 3.71Å; F497-L501 HydrophobicContact CG-CD1 4.27Å; F497-L501 HydrophobicContact CZ-CD1 3.63Å; F497-L501 HydrophobicContact CZ-CD2 4Å; F497-L501 VanDerWaalsContact O-CD1 3.28Å; F497-L501 WeakPolarHBondContact O-CD1 3.31Å; F497-L501 PolarHBondContact O-N 3.12Å; F497-F521 HydrophobicContact CE1-CD2 4.18Å; F497-F521 HydrophobicContact CE1-CE2 4.41Å; F497-F521 HydrophobicContact CE1-CG 4.33Å; F497-F523 HydrophobicContact CD1-CZ 4.35Å; F497-F523 HydrophobicContact CE1-CE2 4.01Å; F497-F523 AromaticContact CE1-CZ 3.92Å; F497-F523 HydrophobicContact CE1-CZ 3.92Å; F497-L538 HydrophobicContact CD2-CD1 3.67Å; F497-L538 HydrophobicContact CE2-CD1 4.25Å; F497-L540 HydrophobicContact CD2-CD1 4.4Å; F497-L540 HydrophobicContact CD2-CD2 4.1Å; F497-L540 HydrophobicContact CE2-CD1 4.27Å
498	I	96.4	Very high	95.3	Very high	15 Å²	15	44.1 Å²	44.1	8%	0.077	25%	0.254	C	S	.	.	H	α-helix	trans	-57.8	-46	177.7	-66.2	157.1	0	0	0	111.2	V494 Q495 A500 L501 A502 M508 K511	V494-I498 HydrophobicContact CG1-CD1 3.78Å; V494-I498 HydrophobicContact CG1-CG1 4.42Å; V494-I498 WeakPolarHBondContact O-CD1 3.4Å; V494-I498 VanDerWaalsContact O-CG1 3.31Å; V494-I498 WeakPolarHBondContact O-CG1 3.27Å; V494-I498 PolarHBondContact O-N 3.06Å; Q495-I498 PolarHBondContact O-N 3.24Å; I498-A500 VanDerWaalsContact C-N 3.35Å; I498-A500 PolarHBondContact O-N 3.47Å; I498-L501 PolarHBondContact O-N 2.87Å; I498-A502 PolarHBondContact O-N 3.33Å; I498-M508 HydrophobicContact CD1-CE 3.56Å; I498-M508 HydrophobicContact CG1-CE 4.03Å; I498-M508 HydrophobicContact CG2-CB 4.38Å; I498-M508 HydrophobicContact CG2-CE 3.93Å; I498-K511 HydrophobicContact CD1-CD 4.43Å
499	S	95.1	Very high	95.4	Very high	66 Å²	66	48.2 Å²	48.2	46%	0.462	27%	0.272	S	S	.	.	H	α-helix	trans	-67.7	-31.9	179.8	-63.6	0	0	0	0	112.9	Q495 N496 F497 A502 G503	Q495-S499 PolarHBondContact NE2-OG 3.31Å; Q495-S499 WeakPolarHBondContact O-CB 3.36Å; Q495-S499 PolarHBondContact O-N 2.9Å; Q495-S499 PolarHBondContact O-OG 2.87Å; N496-S499 PolarHBondContact O-N 3.17Å; F497-S499 VanDerWaalsContact C-N 3.34Å; F497-S499 PolarHBondContact O-N 2.87Å; S499-A502 PolarHBondContact O-N 2.65Å; S499-G503 PolarHBondContact O-N 3.13Å; S499-G503 VanDerWaalsContact O-N 3.1Å
500	A	94.4	Very high	95.6	Very high	9 Å²	9	46.8 Å²	46.8	7%	0.074	26%	0.263	C	S	.	.	H	α-helix	trans	-67.4	-45.3	173	0	0	0	0	0	111.6	N496 F497 I498 A502 G503 L504 L538	N496-A500 WeakPolarHBondContact O-CB 3.28Å; N496-A500 PolarHBondContact O-N 3.21Å; F497-A500 PolarHBondContact O-N 2.95Å; I498-A500 VanDerWaalsContact C-N 3.35Å; I498-A500 PolarHBondContact O-N 3.47Å; A500-A502 VanDerWaalsContact C-N 3.28Å; A500-A502 PolarHBondContact O-N 3.33Å; A500-G503 WeakPolarHBondContact O-CA 3.31Å; A500-G503 PolarHBondContact O-N 2.68Å; A500-L504 PolarHBondContact O-N 3.14Å; A500-L504 VanDerWaalsContact O-N 3.11Å; A500-L538 HydrophobicContact CB-CB 4.01Å; A500-L538 HydrophobicContact CB-CD1 4.13Å; A500-L538 HydrophobicContact CB-CG 4.5Å
501	L	96.2	Very high	95.6	Very high	0 Å²	0	51.7 Å²	51.7	0%	0	28%	0.284	C	S	.	.	H	α-helix	trans	-65.1	-32	175.5	-86	75.9	0	0	0	112	L469 L482 F497 I498 G503 L504 G505 F506 F523	L469-L501 HydrophobicContact CD1-CD1 3.69Å; L469-L501 HydrophobicContact CD1-CG 4.13Å; L469-L501 HydrophobicContact CD2-CD2 4.27Å; L482-L501 HydrophobicContact CD2-CD2 3.85Å; F497-L501 HydrophobicContact CD1-CD1 4.23Å; F497-L501 HydrophobicContact CD2-CD1 4.04Å; F497-L501 HydrophobicContact CE1-CD1 3.92Å; F497-L501 HydrophobicContact CE1-CD2 4.08Å; F497-L501 HydrophobicContact CE2-CD1 3.71Å; F497-L501 HydrophobicContact CG-CD1 4.27Å; F497-L501 HydrophobicContact CZ-CD1 3.63Å; F497-L501 HydrophobicContact CZ-CD2 4Å; F497-L501 VanDerWaalsContact O-CD1 3.28Å; F497-L501 WeakPolarHBondContact O-CD1 3.31Å; F497-L501 PolarHBondContact O-N 3.12Å; I498-L501 PolarHBondContact O-N 2.87Å; L501-G503 VanDerWaalsContact C-N 3.34Å; L501-L504 CarbonylContact O-C 3.59Å; L501-L504 WeakPolarHBondContact O-CA 3.37Å; L501-L504 PolarHBondContact O-N 3.38Å; L501-L504 VanDerWaalsContact O-N 3.09Å; L501-G505 PolarHBondContact O-N 3.44Å; L501-F506 HydrophobicContact CB-CB 4.3Å; L501-F506 HydrophobicContact CB-CD2 4.46Å; L501-F506 WeakPolarHBondContact O-CB 3.11Å; L501-F506 PolarHBondContact O-N 3.28Å; L501-F523 HydrophobicContact CB-CD1 4.3Å; L501-F523 HydrophobicContact CB-CE1 3.88Å; L501-F523 HydrophobicContact CB-CZ 4.22Å; L501-F523 HydrophobicContact CD2-CD1 4.23Å; L501-F523 HydrophobicContact CD2-CD2 3.82Å; L501-F523 HydrophobicContact CD2-CE1 3.95Å; L501-F523 HydrophobicContact CD2-CE2 3.48Å; L501-F523 VanDerWaalsContact CD2-CE2 3.48Å; L501-F523 HydrophobicContact CD2-CG 4.2Å; L501-F523 HydrophobicContact CD2-CZ 3.58Å; L501-F523 HydrophobicContact CG-CZ 4.43Å
502	A	95.9	Very high	95.7	Very high	57 Å²	57	53.7 Å²	53.7	47%	0.471	30%	0.296	S	S	.	.	H	α-helix	trans	-60.9	-41.2	169.3	0	0	0	0	0	112.7	I498 S499 A500 L504 G505 F506	I498-A502 PolarHBondContact O-N 3.33Å; S499-A502 PolarHBondContact O-N 2.65Å; A500-A502 VanDerWaalsContact C-N 3.28Å; A500-A502 PolarHBondContact O-N 3.33Å; A502-L504 PolarHBondContact O-N 3.22Å; A502-G505 PolarHBondContact O-N 3.36Å; A502-G505 VanDerWaalsContact O-N 3.15Å; A502-F506 VanDerWaalsContact CA-O 3.27Å; A502-F506 WeakPolarHBondContact CA-O 3.34Å
503	G	94.4	Very high	95.9	Very high	17 Å²	17	50.3 Å²	50.3	18%	0.175	28%	0.28	C	S	.	.	H	α-helix	trans	-61.7	-28.1	171	0	0	0	0	0	114.4	S499 A500 L501 G505 P530 F536	S499-G503 PolarHBondContact O-N 3.13Å; S499-G503 VanDerWaalsContact O-N 3.1Å; A500-G503 WeakPolarHBondContact O-CA 3.31Å; A500-G503 PolarHBondContact O-N 2.68Å; L501-G503 VanDerWaalsContact C-N 3.34Å; G503-G505 VanDerWaalsContact C-N 3.31Å; G503-P530 VanDerWaalsContact O-CD 3.25Å; G503-P530 WeakPolarHBondContact O-CD 3.34Å; G503-P530 WeakPolarHBondContact O-CG 3.2Å; G503-F536 VanDerWaalsContact CA-CE1 3.48Å; G503-F536 WeakPolarHBondContact O-CE2 3.44Å; G503-F536 VanDerWaalsContact O-CZ 3.26Å; G503-F536 WeakPolarHBondContact O-CZ 3.42Å
504	L	95.9	Very high	95.9	Very high	0 Å²	0	55.4 Å²	55.4	0%	0	30%	0.301	C	S	.	.	T	Hydrogen-bonded Turn	trans	-89.5	15.1	175.5	-59	177.1	0	0	0	113.7	V466 L469 N473 A500 L501 A502 F506 V529 V533 F536	V466-L504 HydrophobicContact CG1-CD1 4.32Å; V466-L504 HydrophobicContact CG1-CD2 3.99Å; L469-L504 HydrophobicContact CB-CD1 3.64Å; L469-L504 HydrophobicContact CD1-CD1 4.27Å; N473-L504 PolarHBondContact ND2-O 3.14Å; A500-L504 PolarHBondContact O-N 3.14Å; A500-L504 VanDerWaalsContact O-N 3.11Å; L501-L504 CarbonylContact O-C 3.59Å; L501-L504 WeakPolarHBondContact O-CA 3.37Å; L501-L504 PolarHBondContact O-N 3.38Å; L501-L504 VanDerWaalsContact O-N 3.09Å; A502-L504 PolarHBondContact O-N 3.22Å; L504-F506 HydrophobicContact CB-CD2 4.08Å; L504-F506 HydrophobicContact CB-CE2 4.27Å; L504-V529 HydrophobicContact CD2-CG1 3.74Å; L504-V533 HydrophobicContact CD2-CG1 4.03Å; L504-F536 HydrophobicContact CD2-CD2 3.71Å; L504-F536 HydrophobicContact CD2-CE2 4.07Å; L504-F536 HydrophobicContact CG-CD2 4.46Å
505	G	96.8	Very high	95.6	Very high	10 Å²	10	55.8 Å²	55.8	10%	0.103	30%	0.302	C	S	.	.	T	Hydrogen-bonded Turn	trans	83.1	18.5	172.9	0	0	0	0	0	115.4	L501 A502 G503 T526 G527	L501-G505 PolarHBondContact O-N 3.44Å; A502-G505 PolarHBondContact O-N 3.36Å; A502-G505 VanDerWaalsContact O-N 3.15Å; G503-G505 VanDerWaalsContact C-N 3.31Å; G505-T526 PolarHBondContact O-N 3.38Å; G505-T526 PolarHBondContact O-OG1 3.23Å; G505-G527 PolarHBondContact O-N 3Å
506	F	98.4	Very high	95.3	Very high	4 Å²	4	56 Å²	56	2%	0.018	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	141.5	176.5	-64.3	-80.8	0	0	0	112.8	N473 L476 L482 L501 A502 L504 F523 V524 K525	N473-F506 HydrophobicContact CB-CE2 3.81Å; N473-F506 HydrophobicContact CB-CZ 3.63Å; L476-F506 HydrophobicContact CD2-CE1 3.98Å; L482-F506 HydrophobicContact CB-CD1 4.05Å; L482-F506 HydrophobicContact CB-CE1 3.74Å; L482-F506 HydrophobicContact CB-CZ 4.49Å; L482-F506 HydrophobicContact CD2-CD1 3.86Å; L482-F506 HydrophobicContact CD2-CD2 4.2Å; L482-F506 HydrophobicContact CD2-CE1 3.59Å; L482-F506 HydrophobicContact CD2-CE2 3.95Å; L482-F506 HydrophobicContact CD2-CG 4.15Å; L482-F506 HydrophobicContact CD2-CZ 3.63Å; L482-F506 HydrophobicContact CG-CE1 4.26Å; L501-F506 HydrophobicContact CB-CB 4.3Å; L501-F506 HydrophobicContact CB-CD2 4.46Å; L501-F506 WeakPolarHBondContact O-CB 3.11Å; L501-F506 PolarHBondContact O-N 3.28Å; A502-F506 VanDerWaalsContact CA-O 3.27Å; A502-F506 WeakPolarHBondContact CA-O 3.34Å; L504-F506 HydrophobicContact CB-CD2 4.08Å; L504-F506 HydrophobicContact CB-CE2 4.27Å; F506-F523 HydrophobicContact CB-CB 4.06Å; F506-F523 HydrophobicContact CB-CD1 4.13Å; F506-F523 HydrophobicContact CB-CG 4.38Å; F506-F523 HydrophobicContact CD1-CB 4.32Å; F506-V524 CarbonylContact C-O 3.54Å; F506-V524 WeakPolarHBondContact CA-O 3.37Å; F506-K525 HydrophobicContact CD1-CB 4.38Å; F506-K525 HydrophobicContact CE1-CB 4.31Å
507	K	98.4	Very high	95.1	Very high	133 Å²	133	53.7 Å²	53.7	58%	0.578	30%	0.3	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-108.6	128.4	169.3	-179	178.5	177.5	-179.2	0	110.1	I509 F523 V524 T526	K507-I509 PolarHBondContact O-N 2.99Å; K507-F523 CarbonylContact O-C 3.59Å; K507-F523 VanDerWaalsContact O-CA 3.24Å; K507-F523 WeakPolarHBondContact O-CA 3.44Å; K507-V524 HydrophobicContact CB-CG1 4.03Å; K507-V524 PolarHBondContact N-O 3.5Å; K507-V524 PolarHBondContact O-N 2.87Å; K507-T526 HydrophobicContact CB-CG2 3.63Å
508	M	98.4	Very high	95.1	Very high	59 Å²	59	53.8 Å²	53.8	29%	0.291	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.4	134	173.2	-166.6	-126.8	-56.4	0	0	110.2	I498 K511 F523	I498-M508 HydrophobicContact CD1-CE 3.56Å; I498-M508 HydrophobicContact CG1-CE 4.03Å; I498-M508 HydrophobicContact CG2-CB 4.38Å; I498-M508 HydrophobicContact CG2-CE 3.93Å; M508-K511 HydrophobicContact CE-CD 4.35Å; M508-K511 HydrophobicContact SD-CB 4.23Å; M508-K511 HydrophobicContact SD-CD 4.45Å; M508-K511 HydrophobicContact SD-CG 4.17Å; M508-F523 HydrophobicContact CB-CD1 3.84Å; M508-F523 HydrophobicContact CB-CE1 3.77Å; M508-F523 HydrophobicContact CG-CD1 4.35Å; M508-F523 HydrophobicContact CG-CE1 4.11Å; M508-F523 HydrophobicContact CG-CZ 4.48Å
509	I	98.2	Very high	95.2	Very high	99 Å²	99	54.7 Å²	54.7	51%	0.508	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	-45.3	174.6	-63.6	-56.8	0	0	0	110	K507 E522 V524	K507-I509 PolarHBondContact O-N 2.99Å; I509-E522 HydrophobicContact CB-CB 4.49Å; I509-E522 HydrophobicContact CB-CG 4.33Å; I509-E522 PolarHBondContact N-O 3.49Å; I509-V524 HydrophobicContact CD1-CB 4.24Å; I509-V524 HydrophobicContact CD1-CG1 3.64Å; I509-V524 HydrophobicContact CG1-CB 4.01Å; I509-V524 HydrophobicContact CG1-CG1 3.89Å
510	S	97.8	Very high	95.3	Very high	53 Å²	53	52.8 Å²	52.8	37%	0.371	29%	0.29	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.2	163.4	177.2	65.8	0	0	0	0	111.4	E522	S510-E522 PolarHBondContact N-O 3.23Å; S510-E522 PolarHBondContact O-N 3.32Å; S510-E522 WeakPolarHBondContact OG-CB 3.36Å
511	K	96.8	Very high	95.5	Very high	105 Å²	105	52.6 Å²	52.6	46%	0.457	29%	0.288	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.6	147.6	169.8	63.2	174	-174.4	163.9	0	109.8	I498 M508 T513 S520 F521	I498-K511 HydrophobicContact CD1-CD 4.43Å; M508-K511 HydrophobicContact CE-CD 4.35Å; M508-K511 HydrophobicContact SD-CB 4.23Å; M508-K511 HydrophobicContact SD-CD 4.45Å; M508-K511 HydrophobicContact SD-CG 4.17Å; K511-T513 HydrophobicContact CD-CG2 4.17Å; K511-S520 CarbonylContact C-O 3.55Å; K511-S520 VanDerWaalsContact CA-O 3.26Å; K511-S520 WeakPolarHBondContact CA-O 3.5Å; K511-F521 HydrophobicContact CB-CD1 3.59Å; K511-F521 HydrophobicContact CB-CE1 3.87Å; K511-F521 HydrophobicContact CB-CG 4.5Å; K511-F521 HydrophobicContact CD-CE1 4.35Å
512	D	96.4	Very high	95.6	Very high	64 Å²	64	53.7 Å²	53.7	34%	0.342	29%	0.293	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	121.7	162.7	172.4	2.2	0	0	0	106.9	E514 F519 S520	D512-E514 PolarHBondContact OD1-N 3.39Å; D512-F519 WeakPolarHBondContact O-CA 3.38Å; D512-S520 PolarHBondContact N-O 3.35Å; D512-S520 PolarHBondContact O-N 3.38Å
513	T	94.7	Very high	95.8	Very high	53 Å²	53	51 Å²	51	33%	0.325	27%	0.271	S	S	.	.			trans	-131.2	27.7	172.8	64.6	0	0	0	0	111.3	V494 K511 F519 F521	V494-T513 HydrophobicContact CG1-CG2 4.49Å; K511-T513 HydrophobicContact CD-CG2 4.17Å; T513-F519 VanDerWaalsContact CA-CD1 3.48Å; T513-F519 HydrophobicContact CG2-CB 4.12Å; T513-F519 HydrophobicContact CG2-CD1 4.06Å; T513-F519 HydrophobicContact CG2-CD2 3.98Å; T513-F519 HydrophobicContact CG2-CE1 4.44Å; T513-F519 HydrophobicContact CG2-CE2 4.39Å; T513-F519 HydrophobicContact CG2-CG 3.8Å; T513-F521 HydrophobicContact CG2-CE1 4.44Å; T513-F521 HydrophobicContact CG2-CZ 4.35Å
514	E	90.7	Very high	96	Very high	186 Å²	186	51.5 Å²	51.5	87%	0.869	27%	0.27	S	S	*	.			trans	-94	-31.7	178.9	-60.9	-173.8	-176.6	0	0	111.4	D512	D512-E514 PolarHBondContact OD1-N 3.39Å
515	N	88.4	Confident	96.1	Very high	33 Å²	33	51.6 Å²	51.6	18%	0.176	27%	0.271	C	S	.	.			trans	-65.1	132.5	174.2	-175	-59.9	0	0	0	111.6	H517 F518	N515-H517 WeakPolarHBondContact OD1-CB 3.39Å; N515-H517 PolarHBondContact OD1-N 2.95Å; N515-F518 WeakPolarHBondContact CB-O 3.38Å; N515-F518 VanDerWaalsContact ND2-CE1 3.3Å; N515-F518 WeakPolarHBondContact ND2-CE1 3.25Å; N515-F518 WeakPolarHBondContact ND2-CZ 3.46Å; N515-F518 WeakPolarHBondContact OD1-CD1 3.38Å; N515-F518 PolarHBondContact OD1-N 3.47Å; N515-F518 VanDerWaalsContact OD1-N 3.14Å
516	S	88.6	Confident	96.2	Very high	101 Å²	101	55 Å²	55	71%	0.706	29%	0.29	S	S	*	.	S	Bend	trans	-80.6	-13.6	-174.2	54.5	0	0	0	0	114.9
517	H	90.6	Very high	96.1	Very high	58 Å²	58	55.8 Å²	55.8	27%	0.269	30%	0.299	S	S	.	.	S	Bend	trans	-99.1	-43.5	-179.8	-68.7	-116.5	0	0	0	111.7	W385 P386 V487 A488 N515	W385-H517 AromaticContact CD1-CE1 3.84Å; W385-H517 AromaticContact CD1-ND1 3.39Å; W385-H517 HydrophobicContact CD2-CB 3.92Å; W385-H517 AromaticContact CD2-ND1 3.49Å; W385-H517 AromaticContact CE2-ND1 3.67Å; W385-H517 HydrophobicContact CE3-CB 3.75Å; W385-H517 HydrophobicContact CG-CB 4.49Å; W385-H517 AromaticContact CG-CE1 3.95Å; W385-H517 AromaticContact CG-ND1 3.32Å; W385-H517 VanDerWaalsContact CG-ND1 3.32Å; W385-H517 HydrophobicContact CH2-CB 4.44Å; W385-H517 HydrophobicContact CZ3-CB 4.04Å; W385-H517 AromaticContact NE1-ND1 3.59Å; P386-H517 WeakPolarHBondContact CD-NE2 3.44Å; V487-H517 CarbonylContact C-O 3.52Å; V487-H517 WeakPolarHBondContact CA-O 3.43Å; V487-H517 WeakPolarHBondContact CG1-O 3.49Å; A488-H517 PolarHBondContact N-O 3.21Å; N515-H517 WeakPolarHBondContact OD1-CB 3.39Å; N515-H517 PolarHBondContact OD1-N 2.95Å
518	F	95.2	Very high	96	Very high	7 Å²	7	54.4 Å²	54.4	3%	0.031	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.3	152.4	-176.2	63.8	-91.3	0	0	0	112.1	W385 A387 P389 E486 N515 S520	W385-F518 AromaticContact CE3-CD1 3.98Å; W385-F518 HydrophobicContact CE3-CD1 3.98Å; W385-F518 HydrophobicContact CZ3-CB 4.22Å; W385-F518 AromaticContact CZ3-CD1 3.89Å; W385-F518 HydrophobicContact CZ3-CD1 3.89Å; W385-F518 HydrophobicContact CZ3-CG 4.49Å; A387-F518 HydrophobicContact CB-CE1 4.39Å; A387-F518 WeakPolarHBondContact O-CE1 3.47Å; P389-F518 HydrophobicContact CB-CD1 4.38Å; P389-F518 HydrophobicContact CB-CD2 3.71Å; P389-F518 HydrophobicContact CB-CE1 4.36Å; P389-F518 HydrophobicContact CB-CE2 3.7Å; P389-F518 HydrophobicContact CB-CG 4.06Å; P389-F518 HydrophobicContact CB-CZ 4.03Å; P389-F518 HydrophobicContact CG-CD1 4.21Å; P389-F518 HydrophobicContact CG-CD2 4.29Å; P389-F518 HydrophobicContact CG-CE1 4.45Å; P389-F518 HydrophobicContact CG-CG 4.12Å; E486-F518 CarbonylContact O-C 3.59Å; E486-F518 VanDerWaalsContact O-CA 3.25Å; E486-F518 WeakPolarHBondContact O-CA 3.46Å; E486-F518 WeakPolarHBondContact O-CB 3.43Å; N515-F518 WeakPolarHBondContact CB-O 3.38Å; N515-F518 VanDerWaalsContact ND2-CE1 3.3Å; N515-F518 WeakPolarHBondContact ND2-CE1 3.25Å; N515-F518 WeakPolarHBondContact ND2-CZ 3.46Å; N515-F518 WeakPolarHBondContact OD1-CD1 3.38Å; N515-F518 PolarHBondContact OD1-N 3.47Å; N515-F518 VanDerWaalsContact OD1-N 3.14Å; F518-S520 WeakPolarHBondContact CE2-OG 3.47Å
519	F	97.6	Very high	95.7	Very high	35 Å²	35	53.3 Å²	53.3	15%	0.154	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	142.4	168.8	-64.1	-20	0	0	0	109.5	A485 E486 A488 F491 V494 D512 T513 F521	A485-F519 WeakPolarHBondContact CA-O 3.46Å; E486-F519 PolarHBondContact N-O 2.91Å; E486-F519 PolarHBondContact O-N 3Å; A488-F519 HydrophobicContact CB-CD1 3.7Å; A488-F519 HydrophobicContact CB-CD2 4.31Å; A488-F519 HydrophobicContact CB-CE1 3.52Å; A488-F519 HydrophobicContact CB-CE2 4.14Å; A488-F519 HydrophobicContact CB-CG 4.12Å; A488-F519 HydrophobicContact CB-CZ 3.76Å; F491-F519 HydrophobicContact CB-CD2 4.37Å; F491-F519 HydrophobicContact CB-CE2 4.31Å; F491-F519 HydrophobicContact CD2-CB 4.5Å; F491-F519 AromaticContact CD2-CD2 3.56Å; F491-F519 HydrophobicContact CD2-CD2 3.56Å; F491-F519 HydrophobicContact CD2-CE2 4.21Å; F491-F519 HydrophobicContact CD2-CG 4.39Å; F491-F519 HydrophobicContact CE2-CB 4.12Å; F491-F519 HydrophobicContact CE2-CD2 4.03Å; F491-F519 HydrophobicContact CE2-CG 4.49Å; F491-F519 HydrophobicContact CG-CD2 4.06Å; F491-F519 HydrophobicContact CG-CE2 4.49Å; V494-F519 HydrophobicContact CG2-CD2 3.84Å; V494-F519 HydrophobicContact CG2-CE2 3.75Å; D512-F519 WeakPolarHBondContact O-CA 3.38Å; T513-F519 VanDerWaalsContact CA-CD1 3.48Å; T513-F519 HydrophobicContact CG2-CB 4.12Å; T513-F519 HydrophobicContact CG2-CD1 4.06Å; T513-F519 HydrophobicContact CG2-CD2 3.98Å; T513-F519 HydrophobicContact CG2-CE1 4.44Å; T513-F519 HydrophobicContact CG2-CE2 4.39Å; T513-F519 HydrophobicContact CG2-CG 3.8Å; F519-F521 HydrophobicContact CB-CE2 3.65Å; F519-F521 HydrophobicContact CB-CZ 3.86Å
520	S	98	Very high	95.2	Very high	26 Å²	26	51.6 Å²	51.6	18%	0.182	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	144.6	179.3	-57.4	0	0	0	0	111.1	V484 K511 D512 F518	V484-S520 CarbonylContact O-C 3.59Å; V484-S520 WeakPolarHBondContact O-CA 3.4Å; K511-S520 CarbonylContact C-O 3.55Å; K511-S520 VanDerWaalsContact CA-O 3.26Å; K511-S520 WeakPolarHBondContact CA-O 3.5Å; D512-S520 PolarHBondContact N-O 3.35Å; D512-S520 PolarHBondContact O-N 3.38Å; F518-S520 WeakPolarHBondContact CE2-OG 3.47Å
521	F	98.6	Very high	94.2	Very high	4 Å²	4	58.4 Å²	58.4	2%	0.018	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.2	140.9	-176.6	-55.6	-91.2	0	0	0	111	V484 F491 V494 F497 K511 T513 F519 F523	V484-F521 PolarHBondContact N-O 3.02Å; V484-F521 VanDerWaalsContact N-O 3.1Å; V484-F521 PolarHBondContact O-N 3.22Å; F491-F521 AromaticContact CE1-CE2 3.99Å; F491-F521 HydrophobicContact CE1-CE2 3.99Å; F491-F521 HydrophobicContact CE1-CZ 4.16Å; F491-F521 HydrophobicContact CE2-CE2 4.19Å; F491-F521 AromaticContact CZ-CE2 3.57Å; F491-F521 HydrophobicContact CZ-CE2 3.57Å; F491-F521 HydrophobicContact CZ-CZ 4.13Å; V494-F521 HydrophobicContact CG1-CE1 3.56Å; V494-F521 HydrophobicContact CG1-CZ 3.71Å; F497-F521 HydrophobicContact CE1-CD2 4.18Å; F497-F521 HydrophobicContact CE1-CE2 4.41Å; F497-F521 HydrophobicContact CE1-CG 4.33Å; K511-F521 HydrophobicContact CB-CD1 3.59Å; K511-F521 HydrophobicContact CB-CE1 3.87Å; K511-F521 HydrophobicContact CB-CG 4.5Å; K511-F521 HydrophobicContact CD-CE1 4.35Å; T513-F521 HydrophobicContact CG2-CE1 4.44Å; T513-F521 HydrophobicContact CG2-CZ 4.35Å; F519-F521 HydrophobicContact CB-CE2 3.65Å; F519-F521 HydrophobicContact CB-CZ 3.86Å; F521-F523 HydrophobicContact CB-CD2 4.02Å; F521-F523 HydrophobicContact CB-CE2 3.37Å; F521-F523 HydrophobicContact CB-CZ 4.14Å; F521-F523 HydrophobicContact CD1-CE2 4.48Å; F521-F523 HydrophobicContact CD1-CZ 4.46Å; F521-F523 HydrophobicContact CG-CE2 4.1Å; F521-F523 HydrophobicContact CG-CZ 4.49Å
522	E	98.7	Very high	92.8	Very high	24 Å²	24	60 Å²	60	11%	0.112	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117	123.8	168.6	-170.2	167.3	170.8	0	0	109.1	Y396 V481 K483 I509 S510	Y396-E522 WeakPolarHBondContact CE2-OE1 3.28Å; Y396-E522 VanDerWaalsContact CE2-OE2 3.23Å; Y396-E522 WeakPolarHBondContact CE2-OE2 3.41Å; Y396-E522 VanDerWaalsContact CZ-OE1 3.27Å; Y396-E522 PolarHBondContact OH-OE1 3.26Å; V481-E522 HydrophobicContact CG1-CG 3.76Å; K483-E522 HydrophobicContact CD-CB 4.39Å; K483-E522 HydrophobicContact CD-CG 4.38Å; K483-E522 WeakPolarHBondContact CE-OE2 3.47Å; K483-E522 VanDerWaalsContact NZ-CD 3.31Å; K483-E522 IonicContact NZ-OE2 3.36Å; K483-E522 PolarHBondContact NZ-OE2 2.82Å; I509-E522 HydrophobicContact CB-CB 4.49Å; I509-E522 HydrophobicContact CB-CG 4.33Å; I509-E522 PolarHBondContact N-O 3.49Å; S510-E522 PolarHBondContact N-O 3.23Å; S510-E522 PolarHBondContact O-N 3.32Å; S510-E522 WeakPolarHBondContact OG-CB 3.36Å
523	F	98.8	Very high	91.3	Very high	0 Å²	0	58.9 Å²	58.9	0%	0	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	157	173.5	-59.6	-100.3	0	0	0	110.4	V481 L482 F497 L501 F506 K507 M508 F521	V481-F523 CarbonylContact C-O 3.51Å; V481-F523 WeakPolarHBondContact CA-O 3.31Å; L482-F523 HydrophobicContact CB-CB 4.24Å; L482-F523 PolarHBondContact N-O 3.42Å; L482-F523 PolarHBondContact O-N 2.86Å; F497-F523 HydrophobicContact CD1-CZ 4.35Å; F497-F523 HydrophobicContact CE1-CE2 4.01Å; F497-F523 AromaticContact CE1-CZ 3.92Å; F497-F523 HydrophobicContact CE1-CZ 3.92Å; L501-F523 HydrophobicContact CB-CD1 4.3Å; L501-F523 HydrophobicContact CB-CE1 3.88Å; L501-F523 HydrophobicContact CB-CZ 4.22Å; L501-F523 HydrophobicContact CD2-CD1 4.23Å; L501-F523 HydrophobicContact CD2-CD2 3.82Å; L501-F523 HydrophobicContact CD2-CE1 3.95Å; L501-F523 HydrophobicContact CD2-CE2 3.48Å; L501-F523 VanDerWaalsContact CD2-CE2 3.48Å; L501-F523 HydrophobicContact CD2-CG 4.2Å; L501-F523 HydrophobicContact CD2-CZ 3.58Å; L501-F523 HydrophobicContact CG-CZ 4.43Å; F506-F523 HydrophobicContact CB-CB 4.06Å; F506-F523 HydrophobicContact CB-CD1 4.13Å; F506-F523 HydrophobicContact CB-CG 4.38Å; F506-F523 HydrophobicContact CD1-CB 4.32Å; K507-F523 CarbonylContact O-C 3.59Å; K507-F523 VanDerWaalsContact O-CA 3.24Å; K507-F523 WeakPolarHBondContact O-CA 3.44Å; M508-F523 HydrophobicContact CB-CD1 3.84Å; M508-F523 HydrophobicContact CB-CE1 3.77Å; M508-F523 HydrophobicContact CG-CD1 4.35Å; M508-F523 HydrophobicContact CG-CE1 4.11Å; M508-F523 HydrophobicContact CG-CZ 4.48Å; F521-F523 HydrophobicContact CB-CD2 4.02Å; F521-F523 HydrophobicContact CB-CE2 3.37Å; F521-F523 HydrophobicContact CB-CZ 4.14Å; F521-F523 HydrophobicContact CD1-CE2 4.48Å; F521-F523 HydrophobicContact CD1-CZ 4.46Å; F521-F523 HydrophobicContact CG-CE2 4.1Å; F521-F523 HydrophobicContact CG-CZ 4.49Å
524	V	98.8	Very high	89.5	Confident	28 Å²	28	66.8 Å²	66.8	17%	0.17	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	139.2	169.3	66.1	0	0	0	0	109.7	R479 G480 F506 K507 I509 T526	R479-V524 HydrophobicContact CB-CG2 4.37Å; R479-V524 WeakPolarHBondContact O-CG2 3.35Å; G480-V524 WeakPolarHBondContact O-CA 3.32Å; F506-V524 CarbonylContact C-O 3.54Å; F506-V524 WeakPolarHBondContact CA-O 3.37Å; K507-V524 HydrophobicContact CB-CG1 4.03Å; K507-V524 PolarHBondContact N-O 3.5Å; K507-V524 PolarHBondContact O-N 2.87Å; I509-V524 HydrophobicContact CD1-CB 4.24Å; I509-V524 HydrophobicContact CD1-CG1 3.64Å; I509-V524 HydrophobicContact CG1-CB 4.01Å; I509-V524 HydrophobicContact CG1-CG1 3.89Å; V524-T526 HydrophobicContact CG1-CG2 4.01Å; V524-T526 PolarHBondContact O-N 3.33Å
525	K	98.7	Very high	87.9	Confident	1 Å²	1	66.9 Å²	66.9	0%	0.004	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.7	119.8	171.6	-179.3	175.9	171.6	-177.6	0	110	N449 N473 L476 M478 R479 G480 F506 G527 N528	N449-K525 PolarHBondContact OD1-NZ 2.92Å; N449-K525 VanDerWaalsContact OD1-NZ 3.13Å; N473-K525 WeakPolarHBondContact O-CD 3.24Å; N473-K525 WeakPolarHBondContact O-CE 3.17Å; N473-K525 PolarHBondContact O-NZ 3.48Å; N473-K525 VanDerWaalsContact OD1-CE 3.3Å; N473-K525 WeakPolarHBondContact OD1-CE 3.19Å; L476-K525 HydrophobicContact CB-CD 4.4Å; L476-K525 HydrophobicContact CD2-CB 4.09Å; L476-K525 WeakPolarHBondContact O-CD 3.4Å; L476-K525 PolarHBondContact O-NZ 3.28Å; M478-K525 HydrophobicContact SD-CG 4.18Å; R479-K525 WeakPolarHBondContact CA-O 3.42Å; R479-K525 PolarHBondContact N-O 3.24Å; G480-K525 PolarHBondContact O-N 2.84Å; F506-K525 HydrophobicContact CD1-CB 4.38Å; F506-K525 HydrophobicContact CE1-CB 4.31Å; K525-G527 WeakPolarHBondContact CE-O 3.2Å; K525-G527 WeakPolarHBondContact CG-O 3.45Å; K525-N528 WeakPolarHBondContact CE-OD1 3.35Å; K525-N528 PolarHBondContact NZ-OD1 3.21Å
526	T	98.3	Very high	86.7	Confident	82 Å²	82	68.3 Å²	68.3	50%	0.503	36%	0.357	S	S	.	.			trans	-113.5	-14.7	178.4	50.3	0	0	0	0	113.7	M478 G505 K507 V524	M478-T526 VanDerWaalsContact SD-C 3.53Å; G505-T526 PolarHBondContact O-N 3.38Å; G505-T526 PolarHBondContact O-OG1 3.23Å; K507-T526 HydrophobicContact CB-CG2 3.63Å; V524-T526 HydrophobicContact CG1-CG2 4.01Å; V524-T526 PolarHBondContact O-N 3.33Å
527	G	97.1	Very high	85.8	Confident	21 Å²	21	67.1 Å²	67.1	22%	0.216	36%	0.36	C	S	.	.	S	Bend	trans	-156.2	165.7	177.5	0	0	0	0	0	111.5	N473 G505 K525	N473-G527 PolarHBondContact ND2-O 2.83Å; N473-G527 PolarHBondContact OD1-O 2.93Å; G505-G527 PolarHBondContact O-N 3Å; K525-G527 WeakPolarHBondContact CE-O 3.2Å; K525-G527 WeakPolarHBondContact CG-O 3.45Å
528	N	95.9	Very high	85.7	Confident	104 Å²	104	65 Å²	65	56%	0.556	35%	0.351	S	S	*	.	P	Polyproline II helix	trans	-80.3	157.9	166.4	-66.7	-21.1	0	0	0	109.8	N473 K525	N473-N528 WeakPolarHBondContact OD1-CA 3.39Å; K525-N528 WeakPolarHBondContact CE-OD1 3.35Å; K525-N528 PolarHBondContact NZ-OD1 3.21Å
529	V	93	Very high	85.5	Confident	35 Å²	35	73 Å²	73	21%	0.212	39%	0.388	C	S	.	.	P	Polyproline II helix	trans	-62.2	131.5	-179.3	-162.7	0	0	0	0	111.4	A470 N473 L504 V533	A470-V529 HydrophobicContact CB-CG1 4.31Å; A470-V529 HydrophobicContact CB-CG2 4.02Å; N473-V529 HydrophobicContact CB-CG2 3.54Å; N473-V529 PolarHBondContact OD1-N 2.81Å; L504-V529 HydrophobicContact CD2-CG1 3.74Å; V529-V533 HydrophobicContact CG1-CG1 4.32Å; V529-V533 HydrophobicContact CG1-CG2 3.76Å
530	P	87.7	Confident	85.3	Confident	63 Å²	63	72.5 Å²	72.5	41%	0.409	39%	0.387	S	S	.	.	P	Polyproline II helix	trans	-65.2	141.4	175.8	-21.1	33	0	0	0	112.5	G503 N532 V533	G503-P530 VanDerWaalsContact O-CD 3.25Å; G503-P530 WeakPolarHBondContact O-CD 3.34Å; G503-P530 WeakPolarHBondContact O-CG 3.2Å; P530-N532 PolarHBondContact O-N 3.09Å; P530-V533 WeakPolarHBondContact O-CG2 3.46Å; P530-V533 PolarHBondContact O-N 3.24Å
531	Q	76.4	Confident	85.1	Confident	197 Å²	197	75.9 Å²	75.9	92%	0.921	40%	0.399	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.3	-23.6	-175.6	-69.1	177.3	-18.6	0	0	115	V533	Q531-V533 VanDerWaalsContact C-N 3.35Å; Q531-V533 PolarHBondContact O-N 3.25Å
532	N	67.6	Low	84.9	Confident	137 Å²	137	78 Å²	78	73%	0.733	41%	0.413	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.6	44.1	-178.9	-77.1	-49.9	0	0	0	113.6	P530 K534	P530-N532 PolarHBondContact O-N 3.09Å; N532-K534 PolarHBondContact O-N 3.46Å
533	V	64.9	Low	84.5	Confident	42 Å²	42	77 Å²	77	26%	0.255	41%	0.408	S	S	.	.	G	3₁₀ helix	trans	-52.3	-31.9	-173.2	-165.8	0	0	0	0	114.5	V466 L504 V529 P530 Q531 K535 F536	V466-V533 HydrophobicContact CG1-CG1 3.41Å; V466-V533 VanDerWaalsContact CG1-CG1 3.41Å; L504-V533 HydrophobicContact CD2-CG1 4.03Å; V529-V533 HydrophobicContact CG1-CG1 4.32Å; V529-V533 HydrophobicContact CG1-CG2 3.76Å; P530-V533 WeakPolarHBondContact O-CG2 3.46Å; P530-V533 PolarHBondContact O-N 3.24Å; Q531-V533 VanDerWaalsContact C-N 3.35Å; Q531-V533 PolarHBondContact O-N 3.25Å; V533-K535 PolarHBondContact O-N 3.4Å; V533-F536 HydrophobicContact CG1-CD2 4.31Å; V533-F536 VanDerWaalsContact O-CD2 3.3Å; V533-F536 WeakPolarHBondContact O-CD2 3.48Å; V533-F536 PolarHBondContact O-N 3.26Å
534	K	57.1	Low	83.8	Confident	218 Å²	218	81.5 Å²	81.5	95%	0.948	43%	0.432	S	S	*	.	G	3₁₀ helix	trans	-64	12.2	-171.1	-62.7	-171.2	176.1	-174.5	0	116.3	N532	N532-K534 PolarHBondContact O-N 3.46Å
535	K	55.8	Low	82.7	Confident	189 Å²	189	81.5 Å²	81.5	82%	0.822	43%	0.429	S	S	*	.	G	3₁₀ helix	trans	-113.7	-5.3	178.1	-67.6	-171.1	176	-175.7	0	114.7	V533 G537	V533-K535 PolarHBondContact O-N 3.4Å; K535-G537 PolarHBondContact O-N 3.02Å
536	F	64	Low	81.3	Confident	63 Å²	63	90.4 Å²	90.4	28%	0.276	47%	0.468	S	S	.	.			trans	-82.4	100.8	178.6	-60.5	-60.2	0	0	0	111.2	G503 L504 V533 L538	G503-F536 VanDerWaalsContact CA-CE1 3.48Å; G503-F536 WeakPolarHBondContact O-CE2 3.44Å; G503-F536 VanDerWaalsContact O-CZ 3.26Å; G503-F536 WeakPolarHBondContact O-CZ 3.42Å; L504-F536 HydrophobicContact CD2-CD2 3.71Å; L504-F536 HydrophobicContact CD2-CE2 4.07Å; L504-F536 HydrophobicContact CG-CD2 4.46Å; V533-F536 HydrophobicContact CG1-CD2 4.31Å; V533-F536 VanDerWaalsContact O-CD2 3.3Å; V533-F536 WeakPolarHBondContact O-CD2 3.48Å; V533-F536 PolarHBondContact O-N 3.26Å; F536-L538 PolarHBondContact O-N 3.47Å
537	G	69.4	Low	78.8	Confident	75 Å²	75	95.4 Å²	95.4	77%	0.773	48%	0.482	S	S	*	.			trans	-71.6	56.1	177.2	0	0	0	0	0	113.9	K535 Q539	K535-G537 PolarHBondContact O-N 3.02Å; G537-Q539 PolarHBondContact O-N 3.37Å
538	L	88.2	Confident	76.2	Confident	13 Å²	13	104.7 Å²	104.7	7%	0.068	51%	0.511	C	S	.	.			trans	-78.7	112.9	174.4	174.9	60.5	0	0	0	110	L465 V466 L469 F497 A500 F536	L465-L538 HydrophobicContact CB-CD2 3.8Å; L465-L538 HydrophobicContact CB-CG 4.03Å; L465-L538 HydrophobicContact CD1-CG 4.15Å; V466-L538 HydrophobicContact CG2-CB 3.79Å; V466-L538 HydrophobicContact CG2-CD2 4.31Å; L469-L538 HydrophobicContact CD1-CD2 3.35Å; F497-L538 HydrophobicContact CD2-CD1 3.67Å; F497-L538 HydrophobicContact CE2-CD1 4.25Å; A500-L538 HydrophobicContact CB-CB 4.01Å; A500-L538 HydrophobicContact CB-CD1 4.13Å; A500-L538 HydrophobicContact CB-CG 4.5Å; F536-L538 PolarHBondContact O-N 3.47Å
539	Q	90.5	Very high	75.3	Confident	175 Å²	175	104.8 Å²	104.8	82%	0.818	51%	0.509	S	S	*	.			trans	-134.4	143.4	172.2	-66.6	-178.2	-10.5	0	0	109.5	G537	G537-Q539 PolarHBondContact O-N 3.37Å
540	L	93.7	Very high	74.3	Confident	26 Å²	26	108.4 Å²	108.4	14%	0.136	52%	0.524	C	S	.	.			trans	-128.7	140.1	172.9	-69.8	178	0	0	0	107.6	L465 R490 F491 F497	L465-L540 HydrophobicContact CD1-CB 3.97Å; L465-L540 HydrophobicContact CD1-CD1 4.2Å; L465-L540 HydrophobicContact CD1-CG 3.95Å; R490-L540 HydrophobicContact CB-CB 4.32Å; F491-L540 HydrophobicContact CD1-CD2 3.62Å; F491-L540 HydrophobicContact CE1-CD2 3.67Å; F491-L540 HydrophobicContact CG-CD2 4.26Å; F491-L540 HydrophobicContact CZ-CD2 4.35Å; F497-L540 HydrophobicContact CD2-CD1 4.4Å; F497-L540 HydrophobicContact CD2-CD2 4.1Å; F497-L540 HydrophobicContact CE2-CD1 4.27Å
541	K	94.6	Very high	73.6	Confident	97 Å²	97	110.9 Å²	110.9	42%	0.422	53%	0.531	S	S	.	.	P	Polyproline II helix	trans	-62.4	153.4	174.6	-82.6	169.4	165.2	161.1	0	111	R490 D492	R490-K541 WeakPolarHBondContact CB-O 3.3Å; R490-K541 VanDerWaalsContact CG-O 3.23Å; R490-K541 WeakPolarHBondContact CG-O 3.15Å; R490-K541 PolarHBondContact NE-O 3.38Å; R490-K541 PolarHBondContact O-N 2.95Å; D492-K541 IonicContact OD1-NZ 3.04Å; D492-K541 PolarHBondContact OD1-NZ 3.41Å; D492-K541 VanDerWaalsContact OD2-CD 3.27Å; D492-K541 WeakPolarHBondContact OD2-CD 3.39Å; D492-K541 WeakPolarHBondContact OD2-CE 3.46Å; D492-K541 IonicContact OD2-NZ 2.69Å; D492-K541 PolarHBondContact OD2-NZ 3.39Å
542	P	93.2	Very high	73.4	Confident	49 Å²	49	105.9 Å²	105.9	32%	0.318	51%	0.508	S	S	.	.	P	Polyproline II helix	trans	-57.3	142.8	166.9	-24.8	35	0	0	0	111.7	Y353 L544	Y353-P542 HydrophobicContact CD2-CB 3.87Å; Y353-P542 HydrophobicContact CG-CB 3.88Å; P542-L544 HydrophobicContact CB-CD2 3.93Å; P542-L544 HydrophobicContact CB-CG 4.37Å
543	C	90.8	Very high	73.8	Confident	2 Å²	2	103.9 Å²	103.9	1%	0.014	49%	0.494	C	S	.	.	P	Polyproline II helix	trans	-78.5	123.3	161.3	-177.6	0	0	0	0	108.7	N349 Y353 V487 R490 Y545	N349-C543 PolarHBondContact ND2-O 3.1Å; Y353-C543 HydrophobicContact CE2-CB 3.6Å; Y353-C543 WeakPolarHBondContact CE2-O 3.28Å; Y353-C543 WeakPolarHBondContact OH-CB 3.39Å; V487-C543 HydrophobicContact CB-CB 4.32Å; V487-C543 HydrophobicContact CG2-CB 4.02Å; R490-C543 HydrophobicContact CG-CB 4.3Å; C543-Y545 HydrophobicContact CB-CE2 4.16Å; C543-Y545 WeakPolarHBondContact SG-CE2 3.49Å
544	L	84.7	Confident	74.4	Confident	94 Å²	94	108.1 Å²	108.1	49%	0.492	51%	0.51	S	S	.	.			trans	-107.4	-1.3	-175.9	-61.6	178.4	0	0	0	114.1	P542 K546	P542-L544 HydrophobicContact CB-CD2 3.93Å; P542-L544 HydrophobicContact CB-CG 4.37Å; L544-K546 PolarHBondContact O-N 3.37Å; L544-K546 VanDerWaalsContact O-O 3.11Å
545	Y	75.6	Confident	75.6	Confident	29 Å²	29	100.2 Å²	100.2	11%	0.114	48%	0.478	C	S	.	.			trans	49.5	56.3	178.8	-66.6	-82.6	0	0	0	114.3	F345 N349 Q381 W385 C543	F345-Y545 HydrophobicContact CE1-CD2 4.22Å; F345-Y545 AromaticContact CZ-CD2 4Å; F345-Y545 HydrophobicContact CZ-CD2 4Å; F345-Y545 HydrophobicContact CZ-CE2 4.07Å; N349-Y545 WeakPolarHBondContact OD1-CE2 3.48Å; Q381-Y545 HydrophobicContact CB-CD1 3.62Å; Q381-Y545 HydrophobicContact CB-CE1 3.68Å; Q381-Y545 HydrophobicContact CB-CG 4.47Å; Q381-Y545 HydrophobicContact CG-CD1 3.6Å; Q381-Y545 HydrophobicContact CG-CE1 4.06Å; Q381-Y545 HydrophobicContact CG-CG 3.97Å; W385-Y545 AromaticContact CZ2-CE1 3.95Å; W385-Y545 HydrophobicContact CZ2-CE1 3.95Å; C543-Y545 HydrophobicContact CB-CE2 4.16Å; C543-Y545 WeakPolarHBondContact SG-CE2 3.49Å
546	K	67.9	Low	77.1	Confident	187 Å²	187	93.4 Å²	93.4	81%	0.813	45%	0.452	S	S	*	.	S	Bend	trans	66.7	-162.7	-172.7	-63.4	-176.9	177.4	177.4	0	112.7	L544	L544-K546 PolarHBondContact O-N 3.37Å; L544-K546 VanDerWaalsContact O-O 3.11Å
547	K	47.1	Very low	78.2	Confident	188 Å²	188	95.9 Å²	95.9	82%	0.817	47%	0.467	S	S	*	.			trans	-95.8	152.7	-164.3	-83.9	-167.9	173.4	-171.7	0	113.2
548	R	42.9	Very low	79	Confident	216 Å²	216	97.8 Å²	97.8	82%	0.815	44%	0.439	S	S	*	.			trans	-81.9	0	155.6	-45.1	179.5	-164.5	152.4	3.6	109.9	E350	E350-R548 IonicContact OE1-NH2 3.85Å; E350-R548 PolarHBondContact OE1-NH2 3.19Å; E350-R548 IonicContact OE2-CZ 2.7Å; E350-R548 IonicContact OE2-NH2 3.13Å; E350-R548 PolarHBondContact OE2-NH2 3.07Å

Retrieved 548 of 548 residues in 294.9 ms (Link to these results)

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