A0A087YD28_POEFO Loading...

Axonemal dynein light chain domain containing 1

AlphaFold DB , UniProt , Accession A0A087YD28, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 874 aa.

						>A0A087YD28_POEFO|A0A087YD28
IRRPDGVWHYPLGRTKYKYFLEQPTSLTEAGRDISFLCDAVLTQKKMTALPPLHEKSCNGDTNYRNLDVKQNVIPEEYRIVKNKGIRCLQLYEDAFTVQLKDEEQKLRVLPSLRPSGRLEVIQLMRMMDDMLEKAGVDQEDEELTDLCQLESLLELVKTEQNIYNIVFHELIRQVTVGCAERGQLLAKLRQRYQSLLERIPRRLTSLHAEVVAQRALDRRLIEEIYHIKATIQEINMELAKVRDHDAFVSDKVQHAQEELAKSYKDTLSCSDVVQGYHRMYELHRTRLEDQLLKMTGDRDYWSQFTFNLALKVIKVKKLRLVSELYVSEEGWFKTAQDCLIYISTQDICDLDVIVELTNRWRDQLIDLMFFVKKIQLVQFEQLSSIQGDIEKWHYYISTQNLYEVPEYDVTTLAEIHEDLWKWSNKLSLASEECQGERKILFKKRLSELYHTLDKFIKISFHIVERHTFPDVESALSLETIKELENDVIELLKQYDTQVSGESTIHRLLTSMFKLLDFWASETHVVLQLLCPLSAMSPSDWAKLEEALSNCQKMSAEIFLYFSFTCIEQERFISVLCVSVQKDEVLELPKRLFSFTETENKKLQEEVTCLHKGQTNWMLDLLLHMLPDQTEEGDKYLKREDKLENSRQALVKDAKRLSKKLVYYSRFITRSCNLILEQSLVVDPYFAEVGDRRKQLKKLQTDGNKWLESVKILLKGLNEKFEEELIEQPEETSSSPQPPESMETQAESYCHYYSKINNAVVLQRPTVKLIDYDGNIIQVYQDDNMVQLPGGNELVMCPVTEEAQKAFSDLTTVLLLQKELSDSEKLAIIAENRARAAEEALTEALIKIKDLERLLQRQPAPEPPSKDAEEKKTP
					

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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	I	36.6	Very low	35.5	Very low	229 Å²	229	158.6 Å²	158.6	100%	1.174	76%	0.761	S	S	*	*				0	114.1	0	-62.5	168.2	0	0	0	106.6
2	R	25.7	Very low	36.3	Very low	246 Å²	246	157.6 Å²	157.6	93%	0.928	76%	0.761	S	S	*	*	P	Polyproline II helix	trans	-63.6	140.1	-173.4	-92.9	-179	173	172.4	-2.9	110.9
3	R	26.3	Very low	37.3	Very low	239 Å²	239	148 Å²	148	90%	0.902	73%	0.729	S	S	*	*	P	Polyproline II helix	trans	-64.6	136	166.2	-75.1	-177	178.3	167.3	-0.6	108.9
4	P	31.4	Very low	38	Very low	124 Å²	124	148.3 Å²	148.3	81%	0.805	72%	0.718	S	S	*	*	P	Polyproline II helix	trans	-76.8	137.6	168.2	30.2	-27	0	0	0	109.2
5	D	31.2	Very low	38.8	Very low	147 Å²	147	144.7 Å²	144.7	79%	0.786	71%	0.709	S	S	*	*	P	Polyproline II helix	trans	-66.8	143.1	178.7	-84.9	-35.7	0	0	0	111.7
6	G	35.7	Very low	39.3	Very low	42 Å²	42	142.3 Å²	142.3	43%	0.433	69%	0.693	S	S	.	*	P	Polyproline II helix	trans	-66.7	140	173.7	0	0	0	0	0	111.4	W8 H9	G6-W8 PolarHBondContact O-N 3.34Å; G6-H9 PolarHBondContact O-N 3.46Å
7	V	37.7	Very low	40.1	Very low	89 Å²	89	138.2 Å²	138.2	54%	0.539	67%	0.669	S	S	.	*	G	3₁₀ helix	trans	-52	-14.4	178.4	176.7	0	0	0	0	113.9	H9 L91	V7-H9 VanDerWaalsContact C-N 3.29Å; V7-H9 PolarHBondContact O-N 3.12Å; V7-L91 HydrophobicContact CG1-CD1 3.8Å; V7-L91 HydrophobicContact CG2-CD1 4.35Å
8	W	40.4	Very low	40.7	Very low	197 Å²	197	136.7 Å²	136.7	75%	0.746	66%	0.659	S	S	*	*	G	3₁₀ helix	trans	-77.1	4.6	-179	-66.9	98.6	0	0	0	116	G6	G6-W8 PolarHBondContact O-N 3.34Å
9	H	37.5	Very low	41.4	Very low	143 Å²	143	132 Å²	132	66%	0.662	63%	0.634	S	S	*	*	G	3₁₀ helix	trans	-111.4	17.1	-174.4	-71.6	-2.7	0	0	0	115.9	G6 V7 P11	G6-H9 PolarHBondContact O-N 3.46Å; V7-H9 VanDerWaalsContact C-N 3.29Å; V7-H9 PolarHBondContact O-N 3.12Å; H9-P11 WeakPolarHBondContact O-CD 3.44Å
10	Y	43.5	Very low	41.7	Very low	189 Å²	189	127.9 Å²	127.9	74%	0.741	61%	0.613	S	S	*	*			trans	-99.1	93.1	171.8	-76.8	-81.9	0	0	0	112.8	L12 G13	Y10-L12 VanDerWaalsContact C-N 3.28Å; Y10-L12 PolarHBondContact O-N 3.29Å; Y10-G13 PolarHBondContact O-N 3.35Å
11	P	44.4	Very low	42.1	Very low	100 Å²	100	127.2 Å²	127.2	65%	0.649	61%	0.612	S	S	*	*	H	α-helix	trans	-65.7	-23.6	-178.2	23.3	-33	0	0	0	114.7	H9 T15	H9-P11 WeakPolarHBondContact O-CD 3.44Å; P11-T15 PolarHBondContact O-N 3.35Å; P11-T15 PolarHBondContact O-OG1 3.2Å
12	L	45.7	Very low	42.5	Very low	146 Å²	146	122.4 Å²	122.4	76%	0.764	59%	0.585	S	S	*	*	H	α-helix	trans	-73.3	-31.7	179.5	-78.1	158.1	0	0	0	113.4	Y10 T15 K16	Y10-L12 VanDerWaalsContact C-N 3.28Å; Y10-L12 PolarHBondContact O-N 3.29Å; L12-T15 PolarHBondContact O-OG1 2.94Å; L12-T15 VanDerWaalsContact O-OG1 3.12Å; L12-K16 WeakPolarHBondContact O-CB 3.42Å; L12-K16 PolarHBondContact O-N 3.39Å
13	G	49	Very low	43.6	Very low	33 Å²	33	114.9 Å²	114.9	34%	0.34	56%	0.56	S	S	.	*	H	α-helix	trans	-73.5	-36.8	176.7	0	0	0	0	0	112.5	Y10 K16 Y17	Y10-G13 PolarHBondContact O-N 3.35Å; G13-K16 PolarHBondContact O-N 3.02Å; G13-Y17 VanDerWaalsContact O-CD2 3.31Å; G13-Y17 WeakPolarHBondContact O-CD2 3.39Å; G13-Y17 PolarHBondContact O-N 3.27Å
14	R	46.6	Very low	44.3	Very low	152 Å²	152	108.3 Å²	108.3	57%	0.574	55%	0.549	S	S	*	.	H	α-helix	trans	-71.1	-32	-178	-140.3	177.2	-176.1	157.9	0.1	113	K18 L21	R14-K18 VanDerWaalsContact O-CA 3.32Å; R14-K18 WeakPolarHBondContact O-CA 3.25Å; R14-K18 WeakPolarHBondContact O-CB 3.38Å; R14-K18 PolarHBondContact O-N 2.77Å; R14-K18 VanDerWaalsContact O-N 3.16Å; R14-L21 HydrophobicContact CG-CD1 4.25Å
15	T	50.7	Low	44.8	Very low	95 Å²	95	106.8 Å²	106.8	58%	0.583	54%	0.537	S	S	*	.	H	α-helix	trans	-75.2	-38.9	174.2	40.3	0	0	0	0	112	P11 L12 Y17	P11-T15 PolarHBondContact O-N 3.35Å; P11-T15 PolarHBondContact O-OG1 3.2Å; L12-T15 PolarHBondContact O-OG1 2.94Å; L12-T15 VanDerWaalsContact O-OG1 3.12Å; T15-Y17 VanDerWaalsContact C-N 3.33Å; T15-Y17 PolarHBondContact O-N 2.9Å
16	K	47.3	Very low	45.1	Very low	105 Å²	105	102.9 Å²	102.9	46%	0.457	52%	0.521	S	S	.	.	H	α-helix	trans	-64.3	-32.9	178.3	-168.3	177.3	179.7	-174.8	0	113.7	L12 G13 Y19	L12-K16 WeakPolarHBondContact O-CB 3.42Å; L12-K16 PolarHBondContact O-N 3.39Å; G13-K16 PolarHBondContact O-N 3.02Å; K16-Y19 WeakPolarHBondContact O-CE1 3.47Å
17	Y	51.5	Low	45.4	Very low	73 Å²	73	107.7 Å²	107.7	29%	0.286	54%	0.536	S	S	.	.	T	Hydrogen-bonded Turn	trans	-115.6	20.4	-179.2	-55.5	-66.7	0	0	0	113.6	G13 T15 Y19 F20 L21 T176 V177	G13-Y17 VanDerWaalsContact O-CD2 3.31Å; G13-Y17 WeakPolarHBondContact O-CD2 3.39Å; G13-Y17 PolarHBondContact O-N 3.27Å; T15-Y17 VanDerWaalsContact C-N 3.33Å; T15-Y17 PolarHBondContact O-N 2.9Å; Y17-Y19 VanDerWaalsContact C-N 3.33Å; Y17-Y19 PolarHBondContact O-N 2.85Å; Y17-F20 WeakPolarHBondContact O-CA 3.32Å; Y17-F20 VanDerWaalsContact O-CB 3.25Å; Y17-F20 WeakPolarHBondContact O-CB 3.47Å; Y17-F20 PolarHBondContact O-N 3.06Å; Y17-L21 PolarHBondContact O-N 3.12Å; Y17-L21 VanDerWaalsContact O-N 3.13Å; Y17-T176 HydrophobicContact CD1-CG2 3.81Å; Y17-T176 HydrophobicContact CE1-CG2 3.98Å; Y17-V177 HydrophobicContact CE1-CG2 4.45Å
18	K	52.1	Low	45.4	Very low	112 Å²	112	109.6 Å²	109.6	49%	0.487	55%	0.548	S	S	.	.	H	α-helix	trans	-54.2	-46.5	-174.7	-176	176.3	173	-178.8	0	113	R14 F20 L21 E22	R14-K18 VanDerWaalsContact O-CA 3.32Å; R14-K18 WeakPolarHBondContact O-CA 3.25Å; R14-K18 WeakPolarHBondContact O-CB 3.38Å; R14-K18 PolarHBondContact O-N 2.77Å; R14-K18 VanDerWaalsContact O-N 3.16Å; K18-F20 VanDerWaalsContact C-N 3.26Å; K18-F20 PolarHBondContact O-N 2.85Å; K18-L21 PolarHBondContact O-N 2.95Å; K18-E22 WeakPolarHBondContact CE-OE1 3.43Å; K18-E22 HydrophobicContact CG-CG 4.37Å; K18-E22 WeakPolarHBondContact CG-OE1 3.46Å; K18-E22 IonicContact NZ-OE1 3.41Å; K18-E22 WeakPolarHBondContact O-CB 3.48Å; K18-E22 WeakPolarHBondContact O-CG 3.44Å; K18-E22 PolarHBondContact O-N 3.47Å
19	Y	53.3	Low	45.3	Very low	47 Å²	47	107.1 Å²	107.1	18%	0.184	55%	0.545	C	S	.	.	H	α-helix	trans	-72.4	-17.6	-179.6	54	-92.4	0	0	0	113.6	K16 Y17 T176 A180	K16-Y19 WeakPolarHBondContact O-CE1 3.47Å; Y17-Y19 VanDerWaalsContact C-N 3.33Å; Y17-Y19 PolarHBondContact O-N 2.85Å; Y19-T176 HydrophobicContact CE2-CG2 3.7Å; Y19-T176 VanDerWaalsContact CE2-OG1 3.22Å; Y19-T176 WeakPolarHBondContact CE2-OG1 3.43Å; Y19-T176 WeakPolarHBondContact OH-CB 3.31Å; Y19-T176 WeakPolarHBondContact OH-CG2 3.5Å; Y19-T176 PolarHBondContact OH-OG1 3.02Å; Y19-T176 VanDerWaalsContact OH-OG1 3.1Å; Y19-A180 VanDerWaalsContact OH-CA 3.29Å; Y19-A180 WeakPolarHBondContact OH-CA 3.45Å; Y19-A180 WeakPolarHBondContact OH-CB 3.44Å; Y19-A180 PolarHBondContact OH-O 3.28Å
20	F	48.3	Very low	45.2	Very low	49 Å²	49	103 Å²	103	22%	0.215	54%	0.535	C	S	.	.	H	α-helix	trans	-76.3	-39	169.4	-109.6	-74	0	0	0	112.2	Y17 K18 I172 R173 T176	Y17-F20 WeakPolarHBondContact O-CA 3.32Å; Y17-F20 VanDerWaalsContact O-CB 3.25Å; Y17-F20 WeakPolarHBondContact O-CB 3.47Å; Y17-F20 PolarHBondContact O-N 3.06Å; K18-F20 VanDerWaalsContact C-N 3.26Å; K18-F20 PolarHBondContact O-N 2.85Å; F20-I172 HydrophobicContact CE2-CB 4.44Å; F20-I172 HydrophobicContact CE2-CG2 3.66Å; F20-I172 WeakPolarHBondContact CE2-O 3.34Å; F20-I172 HydrophobicContact CZ-CB 4.01Å; F20-I172 HydrophobicContact CZ-CG2 3.65Å; F20-R173 HydrophobicContact CE1-CB 3.65Å; F20-R173 HydrophobicContact CE1-CG 3.88Å; F20-R173 HydrophobicContact CE2-CB 4.36Å; F20-R173 HydrophobicContact CZ-CB 3.52Å; F20-R173 HydrophobicContact CZ-CG 4.09Å; F20-T176 HydrophobicContact CD2-CG2 3.74Å; F20-T176 HydrophobicContact CE2-CG2 3.85Å; F20-T176 WeakPolarHBondContact CE2-OG1 3.25Å
21	L	49.8	Very low	45.3	Very low	115 Å²	115	96.7 Å²	96.7	60%	0.602	53%	0.528	S	S	*	.	H	α-helix	trans	-82.7	-26.7	-175.8	-65.9	168.9	0	0	0	112.6	R14 Y17 K18 Q23	R14-L21 HydrophobicContact CG-CD1 4.25Å; Y17-L21 PolarHBondContact O-N 3.12Å; Y17-L21 VanDerWaalsContact O-N 3.13Å; K18-L21 PolarHBondContact O-N 2.95Å; L21-Q23 VanDerWaalsContact C-N 3.29Å
22	E	44.9	Very low	45.1	Very low	128 Å²	128	103.3 Å²	103.3	60%	0.598	54%	0.54	S	S	*	.	S	Bend	trans	-78.2	-10.4	177.1	-73.8	177.1	169.8	0	0	113.5	K18	K18-E22 WeakPolarHBondContact CE-OE1 3.43Å; K18-E22 HydrophobicContact CG-CG 4.37Å; K18-E22 WeakPolarHBondContact CG-OE1 3.46Å; K18-E22 IonicContact NZ-OE1 3.41Å; K18-E22 WeakPolarHBondContact O-CB 3.48Å; K18-E22 WeakPolarHBondContact O-CG 3.44Å; K18-E22 PolarHBondContact O-N 3.47Å
23	Q	48.6	Very low	44.8	Very low	87 Å²	87	101.6 Å²	101.6	41%	0.407	53%	0.532	S	S	.	.	S	Bend	trans	-136.7	74.8	176.6	-65.7	-172.2	-2.3	0	0	110.9	L21	L21-Q23 VanDerWaalsContact C-N 3.29Å
24	P	41.4	Very low	44.6	Very low	102 Å²	102	102.8 Å²	102.8	66%	0.662	53%	0.53	S	S	*	.			trans	-66.3	142.8	-179.7	27.4	-33.3	0	0	0	111.8	S26	P24-S26 PolarHBondContact O-N 3.35Å; P24-S26 VanDerWaalsContact O-N 3.16Å
25	T	40.5	Very low	44.4	Very low	91 Å²	91	98.3 Å²	98.3	56%	0.558	52%	0.522	S	S	*	.			trans	-67.3	100.7	165.5	46.1	0	0	0	0	109.1	L27 H169	T25-L27 PolarHBondContact O-N 3.38Å; T25-H169 HydrophobicContact CG2-CB 3.68Å; T25-H169 WeakPolarHBondContact CG2-CD2 3.46Å
26	S	38.6	Very low	44.3	Very low	66 Å²	66	100 Å²	100	46%	0.462	52%	0.522	S	S	.	.			trans	-76.5	109.8	159.3	43.5	0	0	0	0	107.5	P24 T28 E29	P24-S26 PolarHBondContact O-N 3.35Å; P24-S26 VanDerWaalsContact O-N 3.16Å; S26-T28 PolarHBondContact O-N 3.32Å; S26-E29 WeakPolarHBondContact CB-O 3.31Å; S26-E29 PolarHBondContact OG-O 2.99Å
27	L	41.6	Very low	44.1	Very low	142 Å²	142	98.6 Å²	98.6	74%	0.743	52%	0.519	S	S	*	.	S	Bend	trans	-70.2	-3.7	173.5	-118.5	134.5	0	0	0	112.4	T25	T25-L27 PolarHBondContact O-N 3.38Å
28	T	38.2	Very low	43.8	Very low	129 Å²	129	98.1 Å²	98.1	79%	0.791	53%	0.525	S	S	*	.	S	Bend	trans	-134.9	-1.6	-175.6	21.2	0	0	0	0	115.3	S26	S26-T28 PolarHBondContact O-N 3.32Å
29	E	37.2	Very low	43.1	Very low	146 Å²	146	98 Å²	98	68%	0.682	53%	0.53	S	S	*	.			trans	-147.7	87	179.6	-74.4	-174.2	171.8	0	0	112.1	S26 G31	S26-E29 WeakPolarHBondContact CB-O 3.31Å; S26-E29 PolarHBondContact OG-O 2.99Å; E29-G31 PolarHBondContact O-N 2.97Å
30	A	36.5	Very low	42.6	Very low	55 Å²	55	99.3 Å²	99.3	46%	0.455	55%	0.55	S	S	.	*			trans	-72.4	100.5	172.9	0	0	0	0	0	110.9
31	G	44.3	Very low	42.3	Very low	58 Å²	58	100.6 Å²	100.6	60%	0.598	56%	0.562	S	S	*	*	S	Bend	trans	61.7	-172.9	173.5	0	0	0	0	0	113.6	E29 D33	E29-G31 PolarHBondContact O-N 2.97Å; G31-D33 PolarHBondContact O-N 3.22Å
32	R	41.2	Very low	41.7	Very low	239 Å²	239	101.4 Å²	101.4	90%	0.902	57%	0.566	S	S	*	*	S	Bend	trans	-60	118.8	179	-73.5	-179.1	-173.5	169.5	1.5	108.9	I34	R32-I34 PolarHBondContact O-N 2.86Å
33	D	38.9	Very low	41.3	Very low	109 Å²	109	101 Å²	101	58%	0.583	57%	0.573	S	S	*	*			trans	-43.1	124.3	176.4	-169.3	5.4	0	0	0	110.7	G31 S35 F36	G31-D33 PolarHBondContact O-N 3.22Å; D33-S35 WeakPolarHBondContact OD1-CB 3.21Å; D33-S35 PolarHBondContact OD1-N 2.91Å; D33-S35 PolarHBondContact OD1-OG 2.85Å; D33-S35 PolarHBondContact OD2-OG 3.11Å; D33-F36 WeakPolarHBondContact O-CD1 3.3Å; D33-F36 WeakPolarHBondContact O-CE1 3.42Å
34	I	44.8	Very low	41	Very low	59 Å²	59	105.5 Å²	105.5	30%	0.303	59%	0.593	S	S	.	*			trans	-106.7	10	178.9	20.8	172.8	0	0	0	111.1	R32 F36 L37	R32-I34 PolarHBondContact O-N 2.86Å; I34-F36 HydrophobicContact CB-CE1 4.45Å; I34-F36 HydrophobicContact CG2-CE1 3.82Å; I34-F36 HydrophobicContact CG2-CZ 4.2Å; I34-F36 PolarHBondContact O-N 3.44Å; I34-L37 HydrophobicContact CB-CD1 3.98Å; I34-L37 HydrophobicContact CB-CG 4.48Å; I34-L37 HydrophobicContact CG2-CD1 3.41Å; I34-L37 VanDerWaalsContact CG2-CD1 3.41Å; I34-L37 HydrophobicContact CG2-CG 4.12Å; I34-L37 VanDerWaalsContact O-CB 3.29Å; I34-L37 WeakPolarHBondContact O-CB 3.28Å; I34-L37 PolarHBondContact O-N 2.64Å
35	S	42.3	Very low	40.9	Very low	57 Å²	57	108.8 Å²	108.8	40%	0.399	60%	0.598	S	S	.	*	G	3₁₀ helix	trans	-52.9	-32.4	170.7	59.9	0	0	0	0	112.7	D33 L37 C38	D33-S35 WeakPolarHBondContact OD1-CB 3.21Å; D33-S35 PolarHBondContact OD1-N 2.91Å; D33-S35 PolarHBondContact OD1-OG 2.85Å; D33-S35 PolarHBondContact OD2-OG 3.11Å; S35-L37 PolarHBondContact O-N 3.26Å; S35-C38 PolarHBondContact O-N 2.96Å
36	F	48.5	Very low	40.6	Very low	132 Å²	132	113.6 Å²	113.6	58%	0.579	61%	0.611	S	S	*	*	G	3₁₀ helix	trans	-59.2	-16.3	173.5	76.7	-91.5	0	0	0	114.3	D33 I34	D33-F36 WeakPolarHBondContact O-CD1 3.3Å; D33-F36 WeakPolarHBondContact O-CE1 3.42Å; I34-F36 HydrophobicContact CB-CE1 4.45Å; I34-F36 HydrophobicContact CG2-CE1 3.82Å; I34-F36 HydrophobicContact CG2-CZ 4.2Å; I34-F36 PolarHBondContact O-N 3.44Å
37	L	43.4	Very low	40.2	Very low	75 Å²	75	120 Å²	120	39%	0.393	64%	0.635	S	S	.	*	G	3₁₀ helix	trans	-85.7	-22.8	176.7	-63.5	176.2	0	0	0	113.1	I34 S35 T205	I34-L37 HydrophobicContact CB-CD1 3.98Å; I34-L37 HydrophobicContact CB-CG 4.48Å; I34-L37 HydrophobicContact CG2-CD1 3.41Å; I34-L37 VanDerWaalsContact CG2-CD1 3.41Å; I34-L37 HydrophobicContact CG2-CG 4.12Å; I34-L37 VanDerWaalsContact O-CB 3.29Å; I34-L37 WeakPolarHBondContact O-CB 3.28Å; I34-L37 PolarHBondContact O-N 2.64Å; S35-L37 PolarHBondContact O-N 3.26Å; L37-T205 HydrophobicContact CD1-CG2 4.44Å
38	C	45.3	Very low	39.7	Very low	62 Å²	62	119.2 Å²	119.2	42%	0.419	64%	0.637	S	S	.	*	T	Hydrogen-bonded Turn	trans	-82.2	-30.9	176.6	-65	0	0	0	0	111.8	S35 A40 V41	S35-C38 PolarHBondContact O-N 2.96Å; C38-A40 PolarHBondContact O-N 2.99Å; C38-V41 PolarHBondContact O-N 3.13Å; C38-V41 VanDerWaalsContact O-N 3.14Å
39	D	37.6	Very low	39.3	Very low	111 Å²	111	117.6 Å²	117.6	59%	0.594	64%	0.637	S	S	*	*	H	α-helix	trans	-65.5	-20.8	-179.6	-81.2	-17.1	0	0	0	114.1	V41	D39-V41 PolarHBondContact O-N 3.46Å
40	A	42.1	Very low	38.9	Very low	74 Å²	74	118.7 Å²	118.7	61%	0.612	65%	0.646	S	S	*	*	H	α-helix	trans	-70	-18.8	175.6	0	0	0	0	0	113.4	C38	C38-A40 PolarHBondContact O-N 2.99Å
41	V	42.3	Very low	38.6	Very low	76 Å²	76	121.3 Å²	121.3	46%	0.461	66%	0.659	S	S	.	*	H	α-helix	trans	-95.2	-28.6	-174.9	-178.8	0	0	0	0	112.3	C38 D39 T43	C38-V41 PolarHBondContact O-N 3.13Å; C38-V41 VanDerWaalsContact O-N 3.14Å; D39-V41 PolarHBondContact O-N 3.46Å; V41-T43 PolarHBondContact O-N 2.94Å
42	L	36.7	Very low	38	Very low	131 Å²	131	124.7 Å²	124.7	69%	0.686	67%	0.67	S	S	*	*	H	α-helix	trans	-79.2	-15.1	-176.5	-72.2	173.3	0	0	0	114.5	Q44	L42-Q44 PolarHBondContact O-N 3.27Å
43	T	36.6	Very low	37.4	Very low	121 Å²	121	121.8 Å²	121.8	74%	0.742	67%	0.672	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.6	-8.4	-179.3	44.3	0	0	0	0	114.4	V41	V41-T43 PolarHBondContact O-N 2.94Å
44	Q	42.2	Very low	36.8	Very low	180 Å²	180	125.6 Å²	125.6	84%	0.841	69%	0.685	S	S	*	*	T	Hydrogen-bonded Turn	trans	-99.1	-3.5	179.3	-78	-171.2	-5.1	0	0	115.7	L42	L42-Q44 PolarHBondContact O-N 3.27Å
45	K	40.4	Very low	36	Very low	172 Å²	172	131.2 Å²	131.2	75%	0.748	71%	0.71	S	S	*	*	S	Bend	trans	-112.7	66.1	-175.2	-133.5	177.5	-173.3	179.5	0	112.8
46	K	34.9	Very low	35.3	Very low	192 Å²	192	138.2 Å²	138.2	84%	0.835	73%	0.734	S	S	*	*			trans	172.9	81.3	145.7	-98	170.1	-177.6	177.8	0	111.7
47	M	29.2	Very low	34.1	Very low	199 Å²	199	137 Å²	137	98%	0.98	74%	0.741	S	S	*	*			trans	-119.1	75.2	148.3	-87.5	176.7	70.8	0	0	107.1
48	T	30.1	Very low	33.2	Very low	127 Å²	127	138.5 Å²	138.5	78%	0.779	76%	0.757	S	S	*	*	P	Polyproline II helix	trans	-87.3	125.1	163.9	-25.5	0	0	0	0	106.9
49	A	30.4	Very low	32.2	Very low	95 Å²	95	143.2 Å²	143.2	79%	0.785	78%	0.778	S	S	*	*	P	Polyproline II helix	trans	-54.9	136.3	-175.7	0	0	0	0	0	113.1
50	L	29.3	Very low	31.7	Very low	168 Å²	168	141.3 Å²	141.3	88%	0.88	79%	0.785	S	S	*	*	P	Polyproline II helix	trans	-77.2	136.5	161.2	-78.8	160.1	0	0	0	109.2
51	P	30.6	Very low	30.9	Very low	111 Å²	111	145 Å²	145	72%	0.721	80%	0.795	S	S	*	*	P	Polyproline II helix	trans	-79.2	160.4	167.9	32.4	-30	0	0	0	111.1
52	P	30.5	Very low	30.3	Very low	129 Å²	129	146.3 Å²	146.3	84%	0.838	80%	0.803	S	S	*	*	P	Polyproline II helix	trans	-78.6	153.5	-164.2	18.9	-11.1	0	0	0	114.2
53	L	28.8	Very low	29.9	Very low	178 Å²	178	146.4 Å²	146.4	93%	0.932	80%	0.804	S	S	*	*	P	Polyproline II helix	trans	-54.2	126.7	177.6	-75	156.2	0	0	0	112.8
54	H	27.4	Very low	29.7	Very low	188 Å²	188	150.5 Å²	150.5	87%	0.87	81%	0.807	S	S	*	*			trans	-121.7	115	156.4	-141.8	-9.6	0	0	0	109.1
55	E	28.2	Very low	29.1	Very low	177 Å²	177	153.5 Å²	153.5	83%	0.827	81%	0.811	S	S	*	*			trans	-70.1	126.4	166.9	-73.5	-179.9	149	0	0	110.4
56	K	25.8	Very low	28.5	Very low	204 Å²	204	151.6 Å²	151.6	89%	0.887	81%	0.809	S	S	*	*				177.8	142.1	123.9	-100.8	169.8	-178.9	175.3	0	113.7
57	S	24.1	Very low	28.3	Very low	106 Å²	106	150.1 Å²	150.1	74%	0.741	81%	0.809	S	S	*	*			trans	87.8	98.4	145.9	-162.6	0	0	0	0	120.2
58	C	24.3	Very low	28.3	Very low	107 Å²	107	147.1 Å²	147.1	72%	0.723	80%	0.797	S	S	*	*				14.3	119.6	124.2	-45.8	0	0	0	0	118.6
59	N	24.5	Very low	28.2	Very low	161 Å²	161	147.1 Å²	147.1	86%	0.861	80%	0.797	S	S	*	*				159.9	136.9	103.4	-91.2	-5.7	0	0	0	109.6
60	G	27.5	Very low	28.4	Very low	72 Å²	72	151.4 Å²	151.4	74%	0.742	80%	0.798	S	S	*	*			trans	-75.1	170.9	-172.4	0	0	0	0	0	114.6
61	D	25.5	Very low	28.8	Very low	152 Å²	152	151.2 Å²	151.2	81%	0.813	79%	0.793	S	S	*	*				-165.5	132.5	121	-119.9	-33.3	0	0	0	113.6
62	T	28.6	Very low	29.1	Very low	102 Å²	102	151.5 Å²	151.5	63%	0.626	79%	0.788	S	S	*	*			trans	47.8	126.8	140	31.2	0	0	0	0	124.7
63	N	28.6	Very low	29.8	Very low	134 Å²	134	152.3 Å²	152.3	72%	0.717	79%	0.79	S	S	*	*				91.2	103.7	128.7	-75.2	-20.1	0	0	0	122.4
64	Y	33.8	Very low	30	Very low	207 Å²	207	148.5 Å²	148.5	81%	0.812	77%	0.77	S	S	*	*				28.9	119.6	122.6	-72.8	-85.4	0	0	0	119.3
65	R	28.5	Very low	30.7	Very low	243 Å²	243	143.2 Å²	143.2	92%	0.917	75%	0.752	S	S	*	*				-150.4	117.7	128.5	-110	179.2	-166.1	-177.2	4.7	112.3
66	N	28.5	Very low	31.4	Very low	131 Å²	131	142.4 Å²	142.4	70%	0.701	75%	0.748	S	S	*	*			trans	-19	140.4	157.7	-58.1	-46.5	0	0	0	115.9
67	L	29.4	Very low	32	Very low	162 Å²	162	140.4 Å²	140.4	85%	0.848	74%	0.742	S	S	*	*				-177.7	127	93.9	-119.5	93.1	0	0	0	112
68	D	29.6	Very low	32.8	Very low	135 Å²	135	142.8 Å²	142.8	72%	0.722	74%	0.736	S	S	*	*			trans	65.6	87.9	139.7	-142.7	28.6	0	0	0	120	K70	D68-K70 PolarHBondContact O-N 3.09Å
69	V	27.7	Very low	33.8	Very low	128 Å²	128	144.7 Å²	144.7	78%	0.776	73%	0.728	S	S	*	*			trans	-71	100.6	161.1	178.4	0	0	0	0	108.6	Q71	V69-Q71 VanDerWaalsContact C-N 3.31Å; V69-Q71 HydrophobicContact CG1-CG 4.2Å; V69-Q71 PolarHBondContact O-N 3.39Å
70	K	34.4	Very low	34.5	Very low	184 Å²	184	144.7 Å²	144.7	80%	0.8	73%	0.726	S	S	*	*			trans	-68.4	93.9	157.5	-83.6	-172.4	178.3	178.5	0	108.7	D68 N72	D68-K70 PolarHBondContact O-N 3.09Å; K70-N72 PolarHBondContact O-N 3.15Å; K70-N72 VanDerWaalsContact O-N 3.12Å
71	Q	38.6	Very low	34.8	Very low	165 Å²	165	147.5 Å²	147.5	77%	0.771	73%	0.729	S	S	*	*			trans	-61.4	107.5	157.1	-82	179.6	-16.7	0	0	108.3	V69	V69-Q71 VanDerWaalsContact C-N 3.31Å; V69-Q71 HydrophobicContact CG1-CG 4.2Å; V69-Q71 PolarHBondContact O-N 3.39Å
72	N	36	Very low	35.1	Very low	117 Å²	117	149.7 Å²	149.7	63%	0.626	73%	0.731	S	S	*	*			trans	162.5	99.3	134.4	-77.4	-30	0	0	0	109.1	K70 I74	K70-N72 PolarHBondContact O-N 3.15Å; K70-N72 VanDerWaalsContact O-N 3.12Å; N72-I74 PolarHBondContact O-N 2.93Å
73	V	45	Very low	35.2	Very low	145 Å²	145	152.2 Å²	152.2	88%	0.879	74%	0.74	S	S	*	*			trans	-81.9	11	178.7	-178.9	0	0	0	0	111.8
74	I	34.5	Very low	35.3	Very low	99 Å²	99	155.4 Å²	155.4	51%	0.508	75%	0.748	S	S	.	*	S	Bend	trans	-107.4	115.1	-176.3	-54.6	178.9	0	0	0	108.2	N72	N72-I74 PolarHBondContact O-N 2.93Å
75	P	41.2	Very low	35.4	Very low	76 Å²	76	148.8 Å²	148.8	49%	0.494	74%	0.743	S	S	.	*			trans	-50.8	145.7	169.6	-24.1	33.1	0	0	0	110.6	E77 Y78	P75-E77 PolarHBondContact O-N 3.2Å; P75-Y78 HydrophobicContact CB-CD2 4.38Å; P75-Y78 PolarHBondContact O-N 3.26Å
76	E	42.8	Very low	35.8	Very low	160 Å²	160	145.1 Å²	145.1	75%	0.748	74%	0.74	S	S	*	*	G	3₁₀ helix	trans	-54	-24.3	-172.6	-64.5	-169.9	150.5	0	0	113.9	Y78	E76-Y78 VanDerWaalsContact C-N 3.28Å; E76-Y78 PolarHBondContact O-N 2.95Å
77	E	39.5	Very low	36.3	Very low	163 Å²	163	149 Å²	149	76%	0.762	75%	0.745	S	S	*	*	G	3₁₀ helix	trans	-62.7	-25.7	179	-57.8	166.8	-146.9	0	0	114.5	P75	P75-E77 PolarHBondContact O-N 3.2Å
78	Y	39.8	Very low	36.7	Very low	155 Å²	155	146.2 Å²	146.2	61%	0.608	74%	0.738	S	S	*	*	G	3₁₀ helix	trans	-109.4	15.7	-174	-63.9	-81.6	0	0	0	113.5	P75 E76 I80	P75-Y78 HydrophobicContact CB-CD2 4.38Å; P75-Y78 PolarHBondContact O-N 3.26Å; E76-Y78 VanDerWaalsContact C-N 3.28Å; E76-Y78 PolarHBondContact O-N 2.95Å; Y78-I80 PolarHBondContact O-N 3.36Å; Y78-I80 VanDerWaalsContact O-N 3.17Å
79	R	46.9	Very low	37.3	Very low	147 Å²	147	143.3 Å²	143.3	56%	0.555	72%	0.722	S	S	*	*			trans	-74.5	104	168.8	-76.2	-177.7	176	160.3	1.3	109.9	V81	R79-V81 PolarHBondContact O-N 3.32Å
80	I	38.1	Very low	37.6	Very low	162 Å²	162	142.8 Å²	142.8	83%	0.831	71%	0.711	S	S	*	*			trans	-65.4	106.4	175	-58.5	172	0	0	0	109.6	Y78 K82	Y78-I80 PolarHBondContact O-N 3.36Å; Y78-I80 VanDerWaalsContact O-N 3.17Å; I80-K82 PolarHBondContact O-N 3.19Å
81	V	33.2	Very low	38	Very low	131 Å²	131	138 Å²	138	79%	0.794	69%	0.694	S	S	*	*			trans	-76.8	116.5	171.2	179.8	0	0	0	0	109	R79 N83	R79-V81 PolarHBondContact O-N 3.32Å; V81-N83 PolarHBondContact O-N 3.03Å
82	K	31.9	Very low	38.2	Very low	198 Å²	198	136.5 Å²	136.5	86%	0.861	68%	0.682	S	S	*	*			trans	-66.3	110.4	173.5	-77.4	-178.8	175.7	177.6	0	110.6	I80	I80-K82 PolarHBondContact O-N 3.19Å
83	N	31.6	Very low	38.3	Very low	154 Å²	154	139.8 Å²	139.8	82%	0.824	69%	0.693	S	S	*	*			trans	31.4	99.1	157	-65.3	-23.3	0	0	0	118.6	V81	V81-N83 PolarHBondContact O-N 3.03Å
84	K	31	Very low	38.1	Very low	201 Å²	201	138 Å²	138	87%	0.874	68%	0.679	S	S	*	*				-102.8	126.5	126.9	-69.6	-178.2	-178.7	176.4	0	105.7	I86	K84-I86 PolarHBondContact O-N 2.83Å
85	G	35.1	Very low	38.5	Very low	69 Å²	69	137 Å²	137	71%	0.711	69%	0.685	S	S	*	*			trans	-49.8	129.7	-179.1	0	0	0	0	0	110.6	R87	G85-R87 PolarHBondContact O-N 2.94Å
86	I	36.5	Very low	38.6	Very low	165 Å²	165	138.1 Å²	138.1	85%	0.846	68%	0.682	S	S	*	*			trans	-61.5	99.1	178.5	-57.3	168.6	0	0	0	107.1	K84	K84-I86 PolarHBondContact O-N 2.83Å
87	R	39.8	Very low	38.6	Very low	212 Å²	212	132.1 Å²	132.1	80%	0.8	66%	0.657	S	S	*	*	P	Polyproline II helix	trans	-72.5	139.6	164	-83.7	-177.8	170.7	-180	-2	107.3	G85 L89	G85-R87 PolarHBondContact O-N 2.94Å; R87-L89 PolarHBondContact O-N 2.91Å
88	C	37.4	Very low	38.9	Very low	104 Å²	104	126.7 Å²	126.7	70%	0.703	64%	0.635	S	S	*	*	P	Polyproline II helix	trans	-52.3	128.5	-167.7	-63	0	0	0	0	112.3	Q90	C88-Q90 PolarHBondContact O-N 2.74Å
89	L	41.8	Very low	39.1	Very low	75 Å²	75	124 Å²	124	39%	0.393	63%	0.628	S	S	.	*	P	Polyproline II helix	trans	-57.6	122	160.9	-71	165.2	0	0	0	107.5	R87 L91 L100 K101 D102	R87-L89 PolarHBondContact O-N 2.91Å; L89-L91 PolarHBondContact O-N 3.35Å; L89-L91 VanDerWaalsContact O-N 3.12Å; L89-L100 HydrophobicContact CB-CD2 4.07Å; L89-L100 HydrophobicContact CD1-CB 4.43Å; L89-L100 HydrophobicContact CD1-CD1 4.32Å; L89-L100 HydrophobicContact CD1-CD2 4.27Å; L89-L100 HydrophobicContact CD2-CB 4.42Å; L89-K101 WeakPolarHBondContact CD2-O 3.42Å; L89-D102 HydrophobicContact CD2-CB 4.21Å
90	Q	35.6	Very low	38.9	Very low	116 Å²	116	119.2 Å²	119.2	54%	0.542	61%	0.613	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-71.3	109.6	175.6	-71.5	-179.6	-4.9	0	0	108.3	C88 Y92	C88-Q90 PolarHBondContact O-N 2.74Å; Q90-Y92 HydrophobicContact CB-CD2 4.28Å; Q90-Y92 HydrophobicContact CB-CE2 3.67Å; Q90-Y92 PolarHBondContact O-N 3.24Å; Q90-Y92 PolarHBondContact OE1-OH 3.37Å
91	L	42.5	Very low	39	Very low	84 Å²	84	116.5 Å²	116.5	44%	0.44	60%	0.595	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-72.6	112.7	170.1	-89	154.8	0	0	0	108.5	V7 L89 V98 L100	V7-L91 HydrophobicContact CG1-CD1 3.8Å; V7-L91 HydrophobicContact CG2-CD1 4.35Å; L89-L91 PolarHBondContact O-N 3.35Å; L89-L91 VanDerWaalsContact O-N 3.12Å; L91-V98 HydrophobicContact CD2-CG1 3.55Å; L91-L100 HydrophobicContact CD2-CD2 4.08Å; L91-L100 HydrophobicContact CG-CD2 4.29Å
92	Y	43	Very low	39.5	Very low	134 Å²	134	114.9 Å²	114.9	53%	0.525	58%	0.582	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-96.9	105.4	163.9	-69.5	-88.7	0	0	0	107.4	Q90 D94	Q90-Y92 HydrophobicContact CB-CD2 4.28Å; Q90-Y92 HydrophobicContact CB-CE2 3.67Å; Q90-Y92 PolarHBondContact O-N 3.24Å; Q90-Y92 PolarHBondContact OE1-OH 3.37Å; Y92-D94 PolarHBondContact O-N 2.93Å
93	E	37.8	Very low	40	Very low	185 Å²	185	113.6 Å²	113.6	86%	0.864	58%	0.579	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-76	95	167	-72.7	-175	167.9	0	0	107.7
94	D	39.5	Very low	40.6	Very low	109 Å²	109	112.9 Å²	112.9	58%	0.583	57%	0.571	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-89.1	148.7	156.1	-165.9	2.7	0	0	0	107.7	Y92 F96 T97	Y92-D94 PolarHBondContact O-N 2.93Å; D94-F96 PolarHBondContact O-N 3.19Å; D94-T97 PolarHBondContact O-N 3.02Å
95	A	44.1	Very low	41.2	Very low	76 Å²	76	110.2 Å²	110.2	63%	0.628	56%	0.561	S	S	*	*	T	Hydrogen-bonded Turn	trans	-56.1	-13.9	-171.2	0	0	0	0	0	113.8
96	F	43.8	Very low	41.5	Very low	100 Å²	100	113.9 Å²	113.9	44%	0.439	56%	0.558	S	S	.	*	T	Hydrogen-bonded Turn	trans	-138	-2.4	-174.8	-52.8	-72.8	0	0	0	116	D94 S112	D94-F96 PolarHBondContact O-N 3.19Å; F96-S112 VanDerWaalsContact O-CB 3.3Å; F96-S112 WeakPolarHBondContact O-CB 3.4Å
97	T	42.7	Very low	41.7	Very low	35 Å²	35	110.7 Å²	110.7	22%	0.215	54%	0.542	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.8	146.2	174	43.7	0	0	0	0	113.3	D94	D94-T97 PolarHBondContact O-N 3.02Å
98	V	44.7	Very low	41.8	Very low	48 Å²	48	110.8 Å²	110.8	29%	0.291	54%	0.542	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105	106.2	171.9	-179.1	0	0	0	0	108.4	L91 L100	L91-V98 HydrophobicContact CD2-CG1 3.55Å; V98-L100 HydrophobicContact CG1-CD2 4.44Å
99	Q	43.3	Very low	42.2	Very low	99 Å²	99	110 Å²	110	46%	0.463	53%	0.534	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.1	122.4	176.1	-62.7	-175.4	8.6	0	0	109.7
100	L	43.3	Very low	42.2	Very low	46 Å²	46	111 Å²	111	24%	0.241	54%	0.539	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103	119.3	174	-63.3	172.4	0	0	0	108.5	L89 L91 V98 L110	L89-L100 HydrophobicContact CB-CD2 4.07Å; L89-L100 HydrophobicContact CD1-CB 4.43Å; L89-L100 HydrophobicContact CD1-CD1 4.32Å; L89-L100 HydrophobicContact CD1-CD2 4.27Å; L89-L100 HydrophobicContact CD2-CB 4.42Å; L91-L100 HydrophobicContact CD2-CD2 4.08Å; L91-L100 HydrophobicContact CG-CD2 4.29Å; V98-L100 HydrophobicContact CG1-CD2 4.44Å; L100-L110 HydrophobicContact CD1-CD1 4.11Å
101	K	40.1	Very low	43	Very low	105 Å²	105	106.7 Å²	106.7	46%	0.457	52%	0.521	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	118.4	-179.3	-154.2	175	-171.8	177.4	0	109.7	L89 L107	L89-K101 WeakPolarHBondContact CD2-O 3.42Å; K101-L107 HydrophobicContact CB-CD2 4.46Å; K101-L107 HydrophobicContact CG-CD2 4.08Å
102	D	44.4	Very low	43.6	Very low	98 Å²	98	103.3 Å²	103.3	52%	0.524	51%	0.505	S	S	.	.			trans	-96.5	161.9	173.3	-157.2	-6.1	0	0	0	111	L89 E104 Q105	L89-D102 HydrophobicContact CD2-CB 4.21Å; D102-E104 PolarHBondContact O-N 3.08Å; D102-E104 VanDerWaalsContact O-N 3.12Å; D102-Q105 PolarHBondContact O-N 3.36Å
103	E	41.5	Very low	44.3	Very low	171 Å²	171	100 Å²	100	80%	0.799	50%	0.496	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.9	-17.1	-176.8	-76.8	-172.7	172.9	0	0	113.1	Q105	E103-Q105 VanDerWaalsContact C-N 3.29Å; E103-Q105 PolarHBondContact O-N 3.29Å
104	E	44.6	Very low	45.4	Very low	139 Å²	139	98.1 Å²	98.1	65%	0.65	48%	0.481	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.8	2.5	170.3	-65.8	-167.7	179.4	0	0	114.5	D102 K106	D102-E104 PolarHBondContact O-N 3.08Å; D102-E104 VanDerWaalsContact O-N 3.12Å; E104-K106 PolarHBondContact O-N 3.11Å; E104-K106 IonicContact OE2-NZ 2.93Å; E104-K106 PolarHBondContact OE2-NZ 2.89Å
105	Q	43.6	Very low	46.4	Very low	145 Å²	145	94.7 Å²	94.7	68%	0.678	46%	0.464	S	S	*	.			trans	53	20.7	-172.8	-63.7	-157.3	-1.9	0	0	115.5	D102 E103 L107	D102-Q105 PolarHBondContact O-N 3.36Å; E103-Q105 VanDerWaalsContact C-N 3.29Å; E103-Q105 PolarHBondContact O-N 3.29Å; Q105-L107 PolarHBondContact O-N 3.43Å
106	K	40.6	Very low	47	Very low	146 Å²	146	95.3 Å²	95.3	64%	0.635	46%	0.464	S	S	*	.			trans	-81.3	102.5	169.3	-75.1	175.5	-175.9	154.8	0	109.5	E104 R108	E104-K106 PolarHBondContact O-N 3.11Å; E104-K106 IonicContact OE2-NZ 2.93Å; E104-K106 PolarHBondContact OE2-NZ 2.89Å; K106-R108 PolarHBondContact O-N 3.13Å
107	L	42.5	Very low	47.8	Very low	98 Å²	98	92 Å²	92	51%	0.513	46%	0.458	S	S	.	.			trans	-73.6	108	174.8	-66.2	164.7	0	0	0	109.2	K101 Q105	K101-L107 HydrophobicContact CB-CD2 4.46Å; K101-L107 HydrophobicContact CG-CD2 4.08Å; Q105-L107 PolarHBondContact O-N 3.43Å
108	R	40.8	Very low	49.1	Very low	213 Å²	213	100.6 Å²	100.6	80%	0.804	49%	0.486	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-87.9	110	162.7	-81.8	-169.9	-173.7	-172.2	2.4	108.4	K106	K106-R108 PolarHBondContact O-N 3.13Å
109	V	46	Very low	49.9	Very low	88 Å²	88	104.7 Å²	104.7	53%	0.533	51%	0.506	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.1	111.4	176.9	-177.5	0	0	0	0	108.1
110	L	41.8	Very low	50.9	Low	96 Å²	96	102.2 Å²	102.2	50%	0.503	49%	0.494	S	S	.	.	P	Polyproline II helix	trans	-77.3	144.3	168.8	-70.1	169.9	0	0	0	109	L100 S112	L100-L110 HydrophobicContact CD1-CD1 4.11Å; L110-S112 PolarHBondContact O-N 3.42Å
111	P	52.7	Low	52.1	Low	25 Å²	25	103.3 Å²	103.3	16%	0.162	50%	0.503	C	S	.	.	P	Polyproline II helix	trans	-64.2	137.2	-178.7	26.2	-29.5	0	0	0	109.7	L113 L124 M127 R173	P111-L113 PolarHBondContact O-N 2.78Å; P111-L124 HydrophobicContact CB-CD1 3.89Å; P111-M127 HydrophobicContact CB-CE 4.05Å; P111-M127 HydrophobicContact CB-SD 4.21Å; P111-M127 HydrophobicContact CG-CE 3.89Å; P111-M127 HydrophobicContact CG-SD 3.61Å; P111-R173 PolarHBondContact O-NH1 3.08Å; P111-R173 VanDerWaalsContact O-NH1 3.12Å; P111-R173 PolarHBondContact O-NH2 3.24Å
112	S	54.7	Low	53.6	Low	13 Å²	13	101 Å²	101	9%	0.091	50%	0.495	C	S	.	.	P	Polyproline II helix	trans	-57.9	141.4	-172.5	81.4	0	0	0	0	110.9	F96 L110 R114 P115 R173	F96-S112 VanDerWaalsContact O-CB 3.3Å; F96-S112 WeakPolarHBondContact O-CB 3.4Å; L110-S112 PolarHBondContact O-N 3.42Å; S112-R114 PolarHBondContact O-N 2.89Å; S112-P115 VanDerWaalsContact OG-CA 3.23Å; S112-P115 WeakPolarHBondContact OG-CA 3.33Å; S112-R173 PolarHBondContact O-NH2 3.2Å
113	L	58.6	Low	54.7	Low	64 Å²	64	101.9 Å²	101.9	34%	0.335	50%	0.496	S	S	.	.	S	Bend	trans	-71.3	-12.2	178.4	-78.4	167.1	0	0	0	111.9	P111 R173 V177	P111-L113 PolarHBondContact O-N 2.78Å; L113-R173 HydrophobicContact CD2-CG 3.9Å; L113-V177 HydrophobicContact CB-CB 4.42Å; L113-V177 HydrophobicContact CB-CG1 4.05Å; L113-V177 HydrophobicContact CB-CG2 3.72Å; L113-V177 HydrophobicContact CD1-CG2 4.45Å; L113-V177 HydrophobicContact CD2-CG2 3.66Å; L113-V177 HydrophobicContact CG-CG2 4.14Å
114	R	59.3	Low	56.2	Low	147 Å²	147	94.6 Å²	94.6	56%	0.555	46%	0.462	S	S	*	.	S	Bend	trans	-152.5	80.9	-178.2	-150	179.4	-166	-179.7	3.7	109.7	S112 S116 V177	S112-R114 PolarHBondContact O-N 2.89Å; R114-S116 PolarHBondContact O-N 3.41Å; R114-V177 HydrophobicContact CB-CG1 4.35Å
115	P	61.1	Low	57.6	Low	37 Å²	37	92.9 Å²	92.9	24%	0.24	46%	0.455	C	S	.	.			trans	-70.4	104.9	-177.9	29.9	-34.9	0	0	0	109.1	S112 E120 V121 L124	S112-P115 VanDerWaalsContact OG-CA 3.23Å; S112-P115 WeakPolarHBondContact OG-CA 3.33Å; P115-E120 WeakPolarHBondContact CA-OE2 3.4Å; P115-E120 HydrophobicContact CB-CB 4.01Å; P115-V121 HydrophobicContact CB-CG2 3.84Å; P115-V121 HydrophobicContact CG-CG2 4.4Å; P115-L124 HydrophobicContact CG-CD2 3.95Å
116	S	57.3	Low	59.1	Low	88 Å²	88	94.4 Å²	94.4	62%	0.615	46%	0.455	S	S	*	.			trans	-104.7	-21.2	-177.8	59.5	0	0	0	0	112	R114 E120	R114-S116 PolarHBondContact O-N 3.41Å; S116-E120 PolarHBondContact N-OE2 3.39Å; S116-E120 VanDerWaalsContact N-OE2 3.07Å
117	G	59.9	Low	60.5	Low	30 Å²	30	90.7 Å²	90.7	31%	0.309	44%	0.441	S	S	.	.	S	Bend	trans	-100.4	149.5	175.1	0	0	0	0	0	113.8	L119 E120 V121	G117-L119 VanDerWaalsContact C-N 3.27Å; G117-L119 PolarHBondContact O-N 2.94Å; G117-E120 PolarHBondContact O-N 3.06Å; G117-E120 VanDerWaalsContact O-N 3.14Å; G117-V121 WeakPolarHBondContact O-CG2 3.38Å; G117-V121 PolarHBondContact O-N 2.9Å; G117-V121 VanDerWaalsContact O-N 3.15Å
118	R	69.4	Low	62	Low	217 Å²	217	88.3 Å²	88.3	82%	0.819	43%	0.427	S	S	*	.	H	α-helix	trans	-56.2	-37.2	179.3	-173.5	176.2	178.4	172.9	0.1	113.3	I122	R118-I122 HydrophobicContact CG-CD1 4.08Å; R118-I122 WeakPolarHBondContact O-CD1 3.41Å; R118-I122 VanDerWaalsContact O-CG1 3.23Å; R118-I122 WeakPolarHBondContact O-CG1 3.48Å; R118-I122 PolarHBondContact O-N 3.38Å; R118-I122 VanDerWaalsContact O-N 3.09Å
119	L	62.9	Low	63.6	Low	133 Å²	133	82.1 Å²	82.1	70%	0.696	41%	0.41	S	S	*	.	H	α-helix	trans	-68.7	-38.1	178.9	-80.6	164.1	0	0	0	112.7	G117 I122 Q123	G117-L119 VanDerWaalsContact C-N 3.27Å; G117-L119 PolarHBondContact O-N 2.94Å; L119-I122 PolarHBondContact O-N 2.88Å; L119-Q123 WeakPolarHBondContact O-CG 3.34Å; L119-Q123 PolarHBondContact O-N 2.97Å
120	E	63	Low	65	Low	47 Å²	47	81.4 Å²	81.4	22%	0.22	40%	0.403	C	S	.	.	H	α-helix	trans	-68.1	-40.3	177.6	-61.5	176.5	166.4	0	0	111	P115 S116 G117 I122 Q123 L124	P115-E120 WeakPolarHBondContact CA-OE2 3.4Å; P115-E120 HydrophobicContact CB-CB 4.01Å; S116-E120 PolarHBondContact N-OE2 3.39Å; S116-E120 VanDerWaalsContact N-OE2 3.07Å; G117-E120 PolarHBondContact O-N 3.06Å; G117-E120 VanDerWaalsContact O-N 3.14Å; E120-I122 VanDerWaalsContact C-N 3.32Å; E120-I122 PolarHBondContact O-N 2.93Å; E120-Q123 PolarHBondContact O-N 3.33Å; E120-L124 WeakPolarHBondContact O-CB 3.35Å; E120-L124 PolarHBondContact O-N 2.9Å
121	V	69.8	Low	66.3	Low	69 Å²	69	78.8 Å²	78.8	42%	0.418	39%	0.389	S	S	.	.	H	α-helix	trans	-61.5	-41.8	173.4	178.4	0	0	0	0	110.6	P115 G117 Q123 L124 M125	P115-V121 HydrophobicContact CB-CG2 3.84Å; P115-V121 HydrophobicContact CG-CG2 4.4Å; G117-V121 WeakPolarHBondContact O-CG2 3.38Å; G117-V121 PolarHBondContact O-N 2.9Å; G117-V121 VanDerWaalsContact O-N 3.15Å; V121-Q123 PolarHBondContact O-N 2.99Å; V121-L124 PolarHBondContact O-N 2.91Å; V121-M125 VanDerWaalsContact O-CB 3.3Å; V121-M125 WeakPolarHBondContact O-CB 3.27Å; V121-M125 PolarHBondContact O-N 2.87Å
122	I	70.6	Confident	67.4	Low	56 Å²	56	79.3 Å²	79.3	29%	0.287	39%	0.39	S	S	.	.	H	α-helix	trans	-65.6	-38.4	177.3	-69.2	164.5	0	0	0	111.6	R118 L119 E120 M125 R126	R118-I122 HydrophobicContact CG-CD1 4.08Å; R118-I122 WeakPolarHBondContact O-CD1 3.41Å; R118-I122 VanDerWaalsContact O-CG1 3.23Å; R118-I122 WeakPolarHBondContact O-CG1 3.48Å; R118-I122 PolarHBondContact O-N 3.38Å; R118-I122 VanDerWaalsContact O-N 3.09Å; L119-I122 PolarHBondContact O-N 2.88Å; E120-I122 VanDerWaalsContact C-N 3.32Å; E120-I122 PolarHBondContact O-N 2.93Å; I122-M125 PolarHBondContact O-N 3.02Å; I122-R126 WeakPolarHBondContact O-CG 3.33Å; I122-R126 PolarHBondContact O-N 2.93Å
123	Q	68.6	Low	68.3	Low	117 Å²	117	84.7 Å²	84.7	55%	0.547	41%	0.414	S	S	.	.	H	α-helix	trans	-68.3	-40.8	176.3	-74.7	177.5	-6.1	0	0	112.2	L119 E120 V121 M127	L119-Q123 WeakPolarHBondContact O-CG 3.34Å; L119-Q123 PolarHBondContact O-N 2.97Å; E120-Q123 PolarHBondContact O-N 3.33Å; V121-Q123 PolarHBondContact O-N 2.99Å; Q123-M127 PolarHBondContact O-N 3.32Å
124	L	72.5	Confident	68.9	Low	18 Å²	18	88.9 Å²	88.9	9%	0.094	43%	0.43	C	S	.	.	H	α-helix	trans	-63.2	-43.7	173.6	174.1	68.3	0	0	0	111.3	P111 P115 E120 V121 M127 M128	P111-L124 HydrophobicContact CB-CD1 3.89Å; P115-L124 HydrophobicContact CG-CD2 3.95Å; E120-L124 WeakPolarHBondContact O-CB 3.35Å; E120-L124 PolarHBondContact O-N 2.9Å; V121-L124 PolarHBondContact O-N 2.91Å; L124-M127 PolarHBondContact O-N 2.88Å; L124-M128 WeakPolarHBondContact O-CB 3.35Å; L124-M128 PolarHBondContact O-N 2.95Å
125	M	74.3	Confident	69.2	Low	103 Å²	103	82.5 Å²	82.5	51%	0.507	41%	0.408	S	S	.	.	H	α-helix	trans	-59	-50.9	177.6	-167.1	174.7	79.2	0	0	110.4	V121 I122 M127 M128 D129	V121-M125 VanDerWaalsContact O-CB 3.3Å; V121-M125 WeakPolarHBondContact O-CB 3.27Å; V121-M125 PolarHBondContact O-N 2.87Å; I122-M125 PolarHBondContact O-N 3.02Å; M125-M127 VanDerWaalsContact C-N 3.3Å; M125-M127 PolarHBondContact O-N 3.49Å; M125-M128 PolarHBondContact O-N 3.37Å; M125-M128 VanDerWaalsContact O-N 3.1Å; M125-D129 PolarHBondContact O-N 2.78Å
126	R	74.6	Confident	69.4	Low	178 Å²	178	81.2 Å²	81.2	67%	0.672	40%	0.401	S	S	*	.	H	α-helix	trans	-57.9	-39	175.9	-73.3	178.5	-176.7	177.2	0.2	113.4	I122 D130	I122-R126 WeakPolarHBondContact O-CG 3.33Å; I122-R126 PolarHBondContact O-N 2.93Å; R126-D130 VanDerWaalsContact O-CB 3.27Å; R126-D130 WeakPolarHBondContact O-CB 3.47Å; R126-D130 PolarHBondContact O-N 3.12Å
127	M	71.1	Confident	69.7	Low	67 Å²	67	80.1 Å²	80.1	33%	0.33	39%	0.391	S	S	.	.	H	α-helix	trans	-73.9	-34.4	178.2	-165	-169.9	-63.8	0	0	112	P111 Q123 L124 M125 D130 M131	P111-M127 HydrophobicContact CB-CE 4.05Å; P111-M127 HydrophobicContact CB-SD 4.21Å; P111-M127 HydrophobicContact CG-CE 3.89Å; P111-M127 HydrophobicContact CG-SD 3.61Å; Q123-M127 PolarHBondContact O-N 3.32Å; L124-M127 PolarHBondContact O-N 2.88Å; M125-M127 VanDerWaalsContact C-N 3.3Å; M125-M127 PolarHBondContact O-N 3.49Å; M127-D130 PolarHBondContact O-N 3.48Å; M127-M131 WeakPolarHBondContact O-CB 3.25Å; M127-M131 VanDerWaalsContact O-CG 3.28Å; M127-M131 WeakPolarHBondContact O-CG 3.18Å; M127-M131 PolarHBondContact O-N 3.34Å
128	M	72.9	Confident	69.8	Low	48 Å²	48	84.6 Å²	84.6	24%	0.236	41%	0.408	C	S	.	.	H	α-helix	trans	-66.1	-44.4	173.6	-174.1	-173.7	-92.4	0	0	110.4	L124 M125 D130 M131 L132 E170	L124-M128 WeakPolarHBondContact O-CB 3.35Å; L124-M128 PolarHBondContact O-N 2.95Å; M125-M128 PolarHBondContact O-N 3.37Å; M125-M128 VanDerWaalsContact O-N 3.1Å; M128-D130 VanDerWaalsContact C-N 3.33Å; M128-D130 PolarHBondContact O-N 3.1Å; M128-M131 PolarHBondContact O-N 3.48Å; M128-M131 VanDerWaalsContact O-N 3.17Å; M128-L132 HydrophobicContact CG-CD1 3.98Å; M128-L132 HydrophobicContact CG-CG 4.32Å; M128-L132 WeakPolarHBondContact O-CB 3.45Å; M128-L132 VanDerWaalsContact O-CG 3.26Å; M128-L132 WeakPolarHBondContact O-CG 3.04Å; M128-L132 PolarHBondContact O-N 2.95Å; M128-E170 HydrophobicContact CE-CG 4.21Å
129	D	74.9	Confident	69.6	Low	83 Å²	83	81.3 Å²	81.3	44%	0.444	40%	0.402	S	S	.	.	H	α-helix	trans	-57.4	-47.7	174.5	-60.5	-24.2	0	0	0	110.1	M125 M131 L132 E133	M125-D129 PolarHBondContact O-N 2.78Å; D129-M131 VanDerWaalsContact C-N 3.31Å; D129-M131 PolarHBondContact O-N 3.48Å; D129-L132 PolarHBondContact O-N 3.17Å; D129-E133 WeakPolarHBondContact O-CB 3.35Å; D129-E133 PolarHBondContact O-N 3.32Å
130	D	74.4	Confident	69.2	Low	73 Å²	73	83.3 Å²	83.3	39%	0.39	41%	0.407	S	S	.	.	H	α-helix	trans	-65.9	-28.7	178.2	-161	64.9	0	0	0	113.2	R126 M127 M128 K134	R126-D130 VanDerWaalsContact O-CB 3.27Å; R126-D130 WeakPolarHBondContact O-CB 3.47Å; R126-D130 PolarHBondContact O-N 3.12Å; M127-D130 PolarHBondContact O-N 3.48Å; M128-D130 VanDerWaalsContact C-N 3.33Å; M128-D130 PolarHBondContact O-N 3.1Å; D130-K134 WeakPolarHBondContact O-CD 3.24Å; D130-K134 VanDerWaalsContact O-CG 3.26Å; D130-K134 WeakPolarHBondContact O-CG 3.21Å; D130-K134 PolarHBondContact O-N 3.47Å; D130-K134 IonicContact OD1-NZ 2.69Å; D130-K134 IonicContact OD2-NZ 3.18Å; D130-K134 PolarHBondContact OD2-NZ 2.83Å
131	M	70.7	Confident	68.8	Low	42 Å²	42	86.1 Å²	86.1	21%	0.207	42%	0.424	C	S	.	.	H	α-helix	trans	-78.5	-35	173.3	-76.6	-172.2	-60.9	0	0	112.6	M127 M128 D129 A135 I166	M127-M131 WeakPolarHBondContact O-CB 3.25Å; M127-M131 VanDerWaalsContact O-CG 3.28Å; M127-M131 WeakPolarHBondContact O-CG 3.18Å; M127-M131 PolarHBondContact O-N 3.34Å; M128-M131 PolarHBondContact O-N 3.48Å; M128-M131 VanDerWaalsContact O-N 3.17Å; D129-M131 VanDerWaalsContact C-N 3.31Å; D129-M131 PolarHBondContact O-N 3.48Å; M131-A135 WeakPolarHBondContact O-CB 3.29Å; M131-A135 PolarHBondContact O-N 3.22Å; M131-A135 VanDerWaalsContact O-N 3.07Å; M131-I166 HydrophobicContact CB-CG2 4.16Å; M131-I166 HydrophobicContact SD-CG2 4.48Å
132	L	75.4	Confident	68	Low	35 Å²	35	91.3 Å²	91.3	18%	0.183	44%	0.444	C	S	.	.	H	α-helix	trans	-72.3	-40.2	177.1	-75	175.8	0	0	0	111.2	M128 D129 K134 A135 G136 V137 I163 V167	M128-L132 HydrophobicContact CG-CD1 3.98Å; M128-L132 HydrophobicContact CG-CG 4.32Å; M128-L132 WeakPolarHBondContact O-CB 3.45Å; M128-L132 VanDerWaalsContact O-CG 3.26Å; M128-L132 WeakPolarHBondContact O-CG 3.04Å; M128-L132 PolarHBondContact O-N 2.95Å; D129-L132 PolarHBondContact O-N 3.17Å; L132-K134 VanDerWaalsContact C-N 3.33Å; L132-K134 PolarHBondContact O-N 3.36Å; L132-A135 WeakPolarHBondContact O-CB 3.27Å; L132-A135 PolarHBondContact O-N 3.41Å; L132-G136 PolarHBondContact O-N 3.4Å; L132-V137 HydrophobicContact CB-CG2 3.86Å; L132-V137 HydrophobicContact CD2-CG2 3.95Å; L132-V137 HydrophobicContact CG-CG2 4.45Å; L132-V137 VanDerWaalsContact O-CG2 3.29Å; L132-V137 WeakPolarHBondContact O-CG2 3.49Å; L132-V137 PolarHBondContact O-N 3.42Å; L132-I163 HydrophobicContact CD2-CG2 3.93Å; L132-V167 HydrophobicContact CD2-CG2 3.89Å
133	E	73.8	Confident	66.9	Low	127 Å²	127	97.5 Å²	97.5	59%	0.593	47%	0.471	S	S	*	.	H	α-helix	trans	-59.5	-44.5	172.9	-167.1	176.4	-178.8	0	0	110.7	D129 A135 G136	D129-E133 WeakPolarHBondContact O-CB 3.35Å; D129-E133 PolarHBondContact O-N 3.32Å; E133-A135 VanDerWaalsContact C-N 3.27Å; E133-A135 PolarHBondContact O-N 2.97Å; E133-G136 PolarHBondContact O-N 2.89Å
134	K	69.7	Low	65.9	Low	152 Å²	152	94 Å²	94	66%	0.661	46%	0.456	S	S	*	.	H	α-helix	trans	-68	-22.3	173.8	-72.8	170.3	-172.2	151.1	0	114.3	D130 L132 G136	D130-K134 WeakPolarHBondContact O-CD 3.24Å; D130-K134 VanDerWaalsContact O-CG 3.26Å; D130-K134 WeakPolarHBondContact O-CG 3.21Å; D130-K134 PolarHBondContact O-N 3.47Å; D130-K134 IonicContact OD1-NZ 2.69Å; D130-K134 IonicContact OD2-NZ 3.18Å; D130-K134 PolarHBondContact OD2-NZ 2.83Å; L132-K134 VanDerWaalsContact C-N 3.33Å; L132-K134 PolarHBondContact O-N 3.36Å; K134-G136 VanDerWaalsContact C-N 3.27Å
135	A	65.4	Low	64.6	Low	13 Å²	13	99.5 Å²	99.5	11%	0.107	49%	0.491	C	S	.	.	T	Hydrogen-bonded Turn	trans	-82.1	-6.4	176	0	0	0	0	0	113.2	M131 L132 E133 I163 I166	M131-A135 WeakPolarHBondContact O-CB 3.29Å; M131-A135 PolarHBondContact O-N 3.22Å; M131-A135 VanDerWaalsContact O-N 3.07Å; L132-A135 WeakPolarHBondContact O-CB 3.27Å; L132-A135 PolarHBondContact O-N 3.41Å; E133-A135 VanDerWaalsContact C-N 3.27Å; E133-A135 PolarHBondContact O-N 2.97Å; A135-I163 HydrophobicContact CB-CG1 4.08Å; A135-I166 HydrophobicContact CB-CD1 3.48Å; A135-I166 VanDerWaalsContact CB-CD1 3.48Å
136	G	66.6	Low	63.6	Low	9 Å²	9	101.7 Å²	101.7	9%	0.093	51%	0.505	C	S	.	.	T	Hydrogen-bonded Turn	trans	85.9	27	177.2	0	0	0	0	0	114.6	L132 E133 K134 D138 Q139	L132-G136 PolarHBondContact O-N 3.4Å; E133-G136 PolarHBondContact O-N 2.89Å; K134-G136 VanDerWaalsContact C-N 3.27Å; G136-D138 VanDerWaalsContact C-N 3.26Å; G136-D138 PolarHBondContact O-N 3.2Å; G136-Q139 PolarHBondContact O-N 3.41Å
137	V	64.1	Low	62.6	Low	65 Å²	65	96.6 Å²	96.6	39%	0.394	49%	0.491	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.4	-34.4	178.6	175.4	0	0	0	0	112.8	L132 I163	L132-V137 HydrophobicContact CB-CG2 3.86Å; L132-V137 HydrophobicContact CD2-CG2 3.95Å; L132-V137 HydrophobicContact CG-CG2 4.45Å; L132-V137 VanDerWaalsContact O-CG2 3.29Å; L132-V137 WeakPolarHBondContact O-CG2 3.49Å; L132-V137 PolarHBondContact O-N 3.42Å; V137-I163 HydrophobicContact CB-CD1 4.31Å; V137-I163 HydrophobicContact CG2-CD1 3.46Å; V137-I163 VanDerWaalsContact CG2-CD1 3.46Å; V137-I163 HydrophobicContact CG2-CG1 3.51Å; V137-I163 HydrophobicContact CG2-CG2 4.22Å
138	D	61.6	Low	62.1	Low	124 Å²	124	95.3 Å²	95.3	66%	0.663	49%	0.488	S	S	*	.	T	Hydrogen-bonded Turn	trans	-108	12.7	-175	-59.1	-42.8	0	0	0	113.4	G136 E140	G136-D138 VanDerWaalsContact C-N 3.26Å; G136-D138 PolarHBondContact O-N 3.2Å; D138-E140 VanDerWaalsContact C-N 3.32Å; D138-E140 PolarHBondContact O-N 3.09Å
139	Q	64.9	Low	61.7	Low	149 Å²	149	101.4 Å²	101.4	70%	0.696	52%	0.516	S	S	*	.			trans	-74.3	89.8	171.1	-76.3	177.5	1.2	0	0	108.4	G136 D141	G136-Q139 PolarHBondContact O-N 3.41Å; Q139-D141 PolarHBondContact O-N 3.01Å
140	E	54.8	Low	61.2	Low	174 Å²	174	99.3 Å²	99.3	81%	0.813	50%	0.504	S	S	*	.			trans	-60.2	133.4	163.6	-66.4	-174.1	79.5	0	0	108.2	D138 E142	D138-E140 VanDerWaalsContact C-N 3.32Å; D138-E140 PolarHBondContact O-N 3.09Å; E140-E142 PolarHBondContact O-N 2.78Å
141	D	54.9	Low	60.8	Low	107 Å²	107	97.8 Å²	97.8	57%	0.572	49%	0.494	S	S	*	.			trans	-62.3	55	-175.4	-66.7	-55.1	0	0	0	113.5	Q139 E143 L144	Q139-D141 PolarHBondContact O-N 3.01Å; D141-E143 PolarHBondContact O-N 2.74Å; D141-L144 HydrophobicContact CB-CD1 4.46Å
142	E	52.2	Low	60.6	Low	178 Å²	178	97.3 Å²	97.3	83%	0.832	50%	0.495	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80	110.3	171.6	-71.8	-169.1	155.4	0	0	108.4	E140	E140-E142 PolarHBondContact O-N 2.78Å
143	E	47.4	Very low	60.5	Low	185 Å²	185	99.8 Å²	99.8	86%	0.864	51%	0.508	S	S	*	.	T	Hydrogen-bonded Turn	trans	105.1	34.4	174	-54.2	-174.8	174	0	0	118.3	D141	D141-E143 PolarHBondContact O-N 2.74Å
144	L	48.1	Very low	60.5	Low	44 Å²	44	95.2 Å²	95.2	23%	0.23	49%	0.488	C	S	.	.			trans	-107.5	31.5	169	-67.5	176	0	0	0	114.5	D141 D146 L147	D141-L144 HydrophobicContact CB-CD1 4.46Å; L144-D146 PolarHBondContact O-N 2.87Å; L144-L147 HydrophobicContact CD2-CB 4.2Å; L144-L147 HydrophobicContact CD2-CD1 3.32Å; L144-L147 HydrophobicContact CD2-CG 4.24Å
145	T	45.6	Very low	60.6	Low	134 Å²	134	91.9 Å²	91.9	82%	0.822	48%	0.475	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.5	-22.1	-179.2	-39.7	0	0	0	0	113.3
146	D	52.9	Low	61.1	Low	148 Å²	148	95 Å²	95	79%	0.791	49%	0.489	S	S	*	.	T	Hydrogen-bonded Turn	trans	-109.1	-4.9	-172.9	-86.3	7.1	0	0	0	114.8	L144	L144-D146 PolarHBondContact O-N 2.87Å
147	L	53.6	Low	61.6	Low	72 Å²	72	96.2 Å²	96.2	38%	0.377	49%	0.494	S	S	.	.	S	Bend	trans	-96.1	140.7	177	-73.9	168.4	0	0	0	110.1	L144 E151	L144-L147 HydrophobicContact CD2-CB 4.2Å; L144-L147 HydrophobicContact CD2-CD1 3.32Å; L144-L147 HydrophobicContact CD2-CG 4.24Å; L147-E151 HydrophobicContact CB-CB 4.28Å; L147-E151 WeakPolarHBondContact CD2-OE2 3.45Å
148	C	60.9	Low	62	Low	40 Å²	40	95.5 Å²	95.5	27%	0.27	49%	0.486	S	S	.	.			trans	-59.8	145.3	-179.4	-96.1	0	0	0	0	110	L150 E151 S152 R215	C148-L150 PolarHBondContact O-N 2.94Å; C148-E151 HydrophobicContact CB-CG 4.42Å; C148-E151 PolarHBondContact N-OE2 2.94Å; C148-E151 WeakPolarHBondContact O-CA 3.28Å; C148-E151 WeakPolarHBondContact O-CB 3.2Å; C148-E151 PolarHBondContact O-N 2.99Å; C148-S152 PolarHBondContact O-N 3.36Å; C148-R215 PolarHBondContact SG-NH1 2.9Å
149	Q	62.9	Low	62.6	Low	176 Å²	176	91.4 Å²	91.4	82%	0.822	47%	0.466	S	S	*	.	H	α-helix	trans	-47.1	-28.8	176.5	-68.1	176	-13.3	0	0	113.3	L153	Q149-L153 VanDerWaalsContact O-CG 3.23Å; Q149-L153 WeakPolarHBondContact O-CG 3.03Å; Q149-L153 PolarHBondContact O-N 3.36Å; Q149-L153 VanDerWaalsContact O-N 3.14Å
150	L	66	Low	63.2	Low	39 Å²	39	89.4 Å²	89.4	20%	0.204	46%	0.457	C	S	.	.	H	α-helix	trans	-76.7	-29.8	178.3	-163.8	58.1	0	0	0	114.4	C148 L153 L154 L204 H208	C148-L150 PolarHBondContact O-N 2.94Å; L150-L153 HydrophobicContact CD1-CD1 4.46Å; L150-L154 PolarHBondContact O-N 2.85Å; L150-L204 HydrophobicContact CD1-CD1 3.31Å; L150-L204 HydrophobicContact CD1-CD2 4.08Å; L150-L204 HydrophobicContact CD1-CG 3.48Å; L150-L204 VanDerWaalsContact CD1-CG 3.48Å; L150-L204 HydrophobicContact CG-CD1 4.44Å; L150-L204 HydrophobicContact CG-CG 4.14Å; L150-H208 VanDerWaalsContact CD2-CA 3.45Å; L150-H208 HydrophobicContact CD2-CB 3.44Å; L150-H208 VanDerWaalsContact CD2-CB 3.44Å; L150-H208 HydrophobicContact CG-CB 4.21Å
151	E	65.7	Low	64.3	Low	40 Å²	40	82.3 Å²	82.3	19%	0.187	42%	0.423	C	S	.	.	H	α-helix	trans	-75.1	-42	174.5	-68.5	168.3	149.9	0	0	110.3	L147 C148 L153 L154 E155 H208	L147-E151 HydrophobicContact CB-CB 4.28Å; L147-E151 WeakPolarHBondContact CD2-OE2 3.45Å; C148-E151 HydrophobicContact CB-CG 4.42Å; C148-E151 PolarHBondContact N-OE2 2.94Å; C148-E151 WeakPolarHBondContact O-CA 3.28Å; C148-E151 WeakPolarHBondContact O-CB 3.2Å; C148-E151 PolarHBondContact O-N 2.99Å; E151-L153 VanDerWaalsContact C-N 3.33Å; E151-L153 PolarHBondContact O-N 2.97Å; E151-L154 WeakPolarHBondContact O-CA 3.34Å; E151-L154 WeakPolarHBondContact O-CB 3.39Å; E151-L154 PolarHBondContact O-N 3.36Å; E151-E155 PolarHBondContact O-N 3.11Å; E151-H208 IonicContact OE1-CE1 2.87Å; E151-H208 IonicContact OE1-NE2 3.34Å
152	S	66.7	Low	65.2	Low	32 Å²	32	80.3 Å²	80.3	22%	0.224	41%	0.412	C	S	.	.	H	α-helix	trans	-57.8	-43.9	170.5	166.8	0	0	0	0	111.7	C148 L154 E155 L156	C148-S152 PolarHBondContact O-N 3.36Å; S152-L154 VanDerWaalsContact C-N 3.26Å; S152-L154 PolarHBondContact O-N 2.88Å; S152-E155 PolarHBondContact O-N 3.11Å; S152-L156 WeakPolarHBondContact O-CB 3.44Å; S152-L156 PolarHBondContact O-N 2.94Å
153	L	72.8	Confident	66.4	Low	87 Å²	87	73 Å²	73	46%	0.455	38%	0.379	S	S	.	.	H	α-helix	trans	-62.6	-31.6	173.6	-74.6	170.3	0	0	0	113.2	Q149 L150 E151 V157 L204	Q149-L153 VanDerWaalsContact O-CG 3.23Å; Q149-L153 WeakPolarHBondContact O-CG 3.03Å; Q149-L153 PolarHBondContact O-N 3.36Å; Q149-L153 VanDerWaalsContact O-N 3.14Å; L150-L153 HydrophobicContact CD1-CD1 4.46Å; E151-L153 VanDerWaalsContact C-N 3.33Å; E151-L153 PolarHBondContact O-N 2.97Å; L153-V157 VanDerWaalsContact O-CG2 3.23Å; L153-V157 WeakPolarHBondContact O-CG2 3.43Å; L153-V157 PolarHBondContact O-N 3.48Å; L153-V157 VanDerWaalsContact O-N 3.12Å; L153-L204 HydrophobicContact CB-CD2 4.13Å
154	L	72.9	Confident	68.1	Low	32 Å²	32	65.9 Å²	65.9	17%	0.168	34%	0.344	C	S	.	.	H	α-helix	trans	-74.8	-36.3	178.9	-168.7	129.1	0	0	0	111.8	L150 E151 S152 K158 L204 T205	L150-L154 PolarHBondContact O-N 2.85Å; E151-L154 WeakPolarHBondContact O-CA 3.34Å; E151-L154 WeakPolarHBondContact O-CB 3.39Å; E151-L154 PolarHBondContact O-N 3.36Å; S152-L154 VanDerWaalsContact C-N 3.26Å; S152-L154 PolarHBondContact O-N 2.88Å; L154-K158 HydrophobicContact CD2-CD 4.28Å; L154-K158 VanDerWaalsContact CD2-CE 3.49Å; L154-K158 WeakPolarHBondContact O-CG 3.31Å; L154-K158 PolarHBondContact O-N 3.47Å; L154-L204 HydrophobicContact CB-CD2 3.97Å; L154-L204 HydrophobicContact CD1-CD2 4.27Å; L154-T205 HydrophobicContact CD1-CG2 3.6Å
155	E	72	Confident	69.5	Low	81 Å²	81	64.9 Å²	64.9	38%	0.379	34%	0.339	S	S	.	.	H	α-helix	trans	-68.1	-43.2	173.1	-72.3	-178.6	166.4	0	0	111.6	E151 S152 V157 K158 T159	E151-E155 PolarHBondContact O-N 3.11Å; S152-E155 PolarHBondContact O-N 3.11Å; E155-V157 VanDerWaalsContact C-N 3.34Å; E155-V157 PolarHBondContact O-N 2.99Å; E155-K158 WeakPolarHBondContact O-CB 3.31Å; E155-K158 PolarHBondContact O-N 3.5Å; E155-T159 PolarHBondContact O-N 3.49Å; E155-T159 PolarHBondContact O-OG1 3.28Å
156	L	76.1	Confident	70.8	Confident	80 Å²	80	60.7 Å²	60.7	42%	0.419	31%	0.312	S	S	.	.	H	α-helix	trans	-59	-42	174.3	-173.7	70.4	0	0	0	112.5	S152 K158 T159 E160	S152-L156 WeakPolarHBondContact O-CB 3.44Å; S152-L156 PolarHBondContact O-N 2.94Å; L156-K158 VanDerWaalsContact C-N 3.27Å; L156-K158 PolarHBondContact O-N 3.03Å; L156-T159 WeakPolarHBondContact CA-OG1 3.47Å; L156-T159 PolarHBondContact O-N 3.32Å; L156-T159 PolarHBondContact O-OG1 3.46Å; L156-E160 WeakPolarHBondContact O-CB 3.19Å; L156-E160 WeakPolarHBondContact O-CG 3.27Å; L156-E160 PolarHBondContact O-N 2.92Å
157	V	76.6	Confident	72	Confident	33 Å²	33	55.5 Å²	55.5	20%	0.2	29%	0.285	C	S	.	.	H	α-helix	trans	-66.3	-31.5	176.7	172.4	0	0	0	0	111.5	L153 E155 Q161 P201	L153-V157 VanDerWaalsContact O-CG2 3.23Å; L153-V157 WeakPolarHBondContact O-CG2 3.43Å; L153-V157 PolarHBondContact O-N 3.48Å; L153-V157 VanDerWaalsContact O-N 3.12Å; E155-V157 VanDerWaalsContact C-N 3.34Å; E155-V157 PolarHBondContact O-N 2.99Å; V157-Q161 VanDerWaalsContact O-CB 3.25Å; V157-Q161 WeakPolarHBondContact O-CB 3.43Å; V157-Q161 PolarHBondContact O-N 2.91Å; V157-P201 HydrophobicContact CG1-CG 3.8Å
158	K	74.2	Confident	73.3	Confident	50 Å²	50	54.8 Å²	54.8	22%	0.217	28%	0.279	C	S	.	.	H	α-helix	trans	-70.9	-44.2	176.2	-74.4	171	177.3	174.4	0	111.8	L154 E155 L156 Q161 N162	L154-K158 HydrophobicContact CD2-CD 4.28Å; L154-K158 VanDerWaalsContact CD2-CE 3.49Å; L154-K158 WeakPolarHBondContact O-CG 3.31Å; L154-K158 PolarHBondContact O-N 3.47Å; E155-K158 WeakPolarHBondContact O-CB 3.31Å; E155-K158 PolarHBondContact O-N 3.5Å; L156-K158 VanDerWaalsContact C-N 3.27Å; L156-K158 PolarHBondContact O-N 3.03Å; K158-Q161 PolarHBondContact O-N 3.33Å; K158-N162 VanDerWaalsContact O-CG 3.29Å; K158-N162 PolarHBondContact O-N 3.45Å; K158-N162 PolarHBondContact O-ND2 3.25Å
159	T	74.4	Confident	73.9	Confident	39 Å²	39	54.4 Å²	54.4	24%	0.239	27%	0.273	C	S	.	.	H	α-helix	trans	-63.6	-46.5	177.4	55	0	0	0	0	110.5	E155 L156 Q161 N162 I163	E155-T159 PolarHBondContact O-N 3.49Å; E155-T159 PolarHBondContact O-OG1 3.28Å; L156-T159 WeakPolarHBondContact CA-OG1 3.47Å; L156-T159 PolarHBondContact O-N 3.32Å; L156-T159 PolarHBondContact O-OG1 3.46Å; T159-Q161 VanDerWaalsContact C-N 3.33Å; T159-Q161 PolarHBondContact O-N 2.92Å; T159-N162 WeakPolarHBondContact O-CB 3.46Å; T159-N162 PolarHBondContact O-N 3.06Å; T159-I163 WeakPolarHBondContact O-CD1 3.47Å; T159-I163 WeakPolarHBondContact O-CG1 3.47Å; T159-I163 PolarHBondContact O-N 2.88Å
160	E	77.4	Confident	74.5	Confident	107 Å²	107	47 Å²	47	50%	0.5	24%	0.239	S	C	.	.	H	α-helix	trans	-59.8	-39.7	174.9	-76	-66.1	165.6	0	0	113	L156 N162 I163 Y164	L156-E160 WeakPolarHBondContact O-CB 3.19Å; L156-E160 WeakPolarHBondContact O-CG 3.27Å; L156-E160 PolarHBondContact O-N 2.92Å; E160-N162 VanDerWaalsContact C-N 3.31Å; E160-N162 PolarHBondContact O-N 3.34Å; E160-I163 PolarHBondContact O-N 3.45Å; E160-Y164 VanDerWaalsContact O-CB 3.25Å; E160-Y164 WeakPolarHBondContact O-CB 3.3Å; E160-Y164 PolarHBondContact O-N 3.37Å
161	Q	76.5	Confident	75.1	Confident	25 Å²	25	48.5 Å²	48.5	12%	0.117	25%	0.247	C	C	.	.	H	α-helix	trans	-64.4	-36.3	175.3	-174.6	173	1.4	0	0	112	V157 K158 T159 N165 L197	V157-Q161 VanDerWaalsContact O-CB 3.25Å; V157-Q161 WeakPolarHBondContact O-CB 3.43Å; V157-Q161 PolarHBondContact O-N 2.91Å; K158-Q161 PolarHBondContact O-N 3.33Å; T159-Q161 VanDerWaalsContact C-N 3.33Å; T159-Q161 PolarHBondContact O-N 2.92Å; Q161-N165 WeakPolarHBondContact O-CB 3.34Å; Q161-N165 PolarHBondContact O-N 3.48Å; Q161-N165 PolarHBondContact O-ND2 3.41Å; Q161-L197 HydrophobicContact CG-CB 4.48Å
162	N	74.6	Confident	75.3	Confident	64 Å²	64	47 Å²	47	34%	0.342	24%	0.239	S	C	.	.	H	α-helix	trans	-67.9	-45.3	176.5	-71	-21.4	0	0	0	111.7	K158 T159 E160 N165 I166	K158-N162 VanDerWaalsContact O-CG 3.29Å; K158-N162 PolarHBondContact O-N 3.45Å; K158-N162 PolarHBondContact O-ND2 3.25Å; T159-N162 WeakPolarHBondContact O-CB 3.46Å; T159-N162 PolarHBondContact O-N 3.06Å; E160-N162 VanDerWaalsContact C-N 3.31Å; E160-N162 PolarHBondContact O-N 3.34Å; N162-N165 PolarHBondContact O-N 3.3Å; N162-I166 WeakPolarHBondContact O-CG1 3.33Å; N162-I166 PolarHBondContact O-N 3.41Å
163	I	77.9	Confident	75.7	Confident	26 Å²	26	47.5 Å²	47.5	13%	0.133	24%	0.236	C	C	.	.	H	α-helix	trans	-59.8	-49.8	176.2	-64.1	159.8	0	0	0	110.2	L132 A135 V137 T159 E160 N165 I166 V167	L132-I163 HydrophobicContact CD2-CG2 3.93Å; A135-I163 HydrophobicContact CB-CG1 4.08Å; V137-I163 HydrophobicContact CB-CD1 4.31Å; V137-I163 HydrophobicContact CG2-CD1 3.46Å; V137-I163 VanDerWaalsContact CG2-CD1 3.46Å; V137-I163 HydrophobicContact CG2-CG1 3.51Å; V137-I163 HydrophobicContact CG2-CG2 4.22Å; T159-I163 WeakPolarHBondContact O-CD1 3.47Å; T159-I163 WeakPolarHBondContact O-CG1 3.47Å; T159-I163 PolarHBondContact O-N 2.88Å; E160-I163 PolarHBondContact O-N 3.45Å; I163-N165 VanDerWaalsContact C-N 3.28Å; I163-N165 PolarHBondContact O-N 3.33Å; I163-I166 PolarHBondContact O-N 3.13Å; I163-V167 HydrophobicContact CG2-CG2 4.4Å; I163-V167 WeakPolarHBondContact O-CG2 3.39Å; I163-V167 PolarHBondContact O-N 2.79Å
164	Y	82.4	Confident	75.7	Confident	34 Å²	34	45.6 Å²	45.6	13%	0.133	23%	0.225	C	C	.	.	H	α-helix	trans	-53.7	-45	175.1	173.5	-89.4	0	0	0	111.9	E160 F168 R190 Y193 L197	E160-Y164 VanDerWaalsContact O-CB 3.25Å; E160-Y164 WeakPolarHBondContact O-CB 3.3Å; E160-Y164 PolarHBondContact O-N 3.37Å; Y164-F168 HydrophobicContact CD1-CD2 4.43Å; Y164-F168 AromaticContact CD2-CD2 3.45Å; Y164-F168 HydrophobicContact CD2-CD2 3.45Å; Y164-F168 VanDerWaalsContact CD2-CD2 3.45Å; Y164-F168 AromaticContact CD2-CE2 3.44Å; Y164-F168 HydrophobicContact CD2-CE2 3.44Å; Y164-F168 VanDerWaalsContact CD2-CE2 3.44Å; Y164-F168 HydrophobicContact CE1-CD2 4.28Å; Y164-F168 AromaticContact CE2-CD2 3.25Å; Y164-F168 HydrophobicContact CE2-CD2 3.25Å; Y164-F168 AromaticContact CE2-CE2 3.1Å; Y164-F168 HydrophobicContact CE2-CE2 3.1Å; Y164-F168 HydrophobicContact CE2-CG 4.13Å; Y164-F168 AromaticContact CE2-CZ 3.87Å; Y164-F168 HydrophobicContact CE2-CZ 3.87Å; Y164-F168 HydrophobicContact CG-CD2 4.04Å; Y164-F168 HydrophobicContact CG-CE2 4.44Å; Y164-F168 AromaticContact CZ-CD2 3.69Å; Y164-F168 AromaticContact CZ-CE2 3.91Å; Y164-F168 WeakPolarHBondContact O-CB 3.43Å; Y164-F168 WeakPolarHBondContact O-CD2 3.48Å; Y164-F168 PolarHBondContact O-N 3.45Å; Y164-R190 HydrophobicContact CE1-CG 3.99Å; Y164-R190 WeakPolarHBondContact OH-CA 3.41Å; Y164-R190 PolarHBondContact OH-O 3.48Å; Y164-R190 VanDerWaalsContact OH-O 3.09Å; Y164-Y193 WeakPolarHBondContact OH-CB 3.37Å; Y164-L197 HydrophobicContact CD1-CD1 3.81Å; Y164-L197 HydrophobicContact CD2-CD1 4.25Å; Y164-L197 HydrophobicContact CE1-CD1 4.16Å; Y164-L197 HydrophobicContact CG-CD1 3.87Å
165	N	76.9	Confident	75.8	Confident	23 Å²	23	46.5 Å²	46.5	12%	0.123	23%	0.232	C	C	.	.	H	α-helix	trans	-65.1	-41.1	-179.1	-77.9	-31.2	0	0	0	112.8	Q161 N162 I163 H169 R190	Q161-N165 WeakPolarHBondContact O-CB 3.34Å; Q161-N165 PolarHBondContact O-N 3.48Å; Q161-N165 PolarHBondContact O-ND2 3.41Å; N162-N165 PolarHBondContact O-N 3.3Å; I163-N165 VanDerWaalsContact C-N 3.28Å; I163-N165 PolarHBondContact O-N 3.33Å; N165-H169 VanDerWaalsContact O-CB 3.27Å; N165-H169 WeakPolarHBondContact O-CB 3.48Å; N165-H169 PolarHBondContact O-CD2 3.26Å; N165-H169 PolarHBondContact O-N 3.06Å; N165-H169 VanDerWaalsContact O-N 3.16Å; N165-R190 PolarHBondContact O-NH1 2.96Å; N165-R190 PolarHBondContact OD1-NH2 3.1Å
166	I	74.5	Confident	75.8	Confident	47 Å²	47	42.7 Å²	42.7	24%	0.241	21%	0.214	C	C	.	.	H	α-helix	trans	-67.8	-51.2	179.8	-69.5	164.4	0	0	0	110.1	M131 A135 N162 I163 H169 E170	M131-I166 HydrophobicContact CB-CG2 4.16Å; M131-I166 HydrophobicContact SD-CG2 4.48Å; A135-I166 HydrophobicContact CB-CD1 3.48Å; A135-I166 VanDerWaalsContact CB-CD1 3.48Å; N162-I166 WeakPolarHBondContact O-CG1 3.33Å; N162-I166 PolarHBondContact O-N 3.41Å; I163-I166 PolarHBondContact O-N 3.13Å; I166-H169 PolarHBondContact O-N 3.23Å; I166-E170 PolarHBondContact O-N 3.46Å
167	V	78	Confident	75.5	Confident	39 Å²	39	40.1 Å²	40.1	24%	0.236	20%	0.202	C	C	.	.	H	α-helix	trans	-64.1	-48.9	-176.7	175.6	0	0	0	0	111.4	L132 I163 H169 E170 L171	L132-V167 HydrophobicContact CD2-CG2 3.89Å; I163-V167 HydrophobicContact CG2-CG2 4.4Å; I163-V167 WeakPolarHBondContact O-CG2 3.39Å; I163-V167 PolarHBondContact O-N 2.79Å; V167-H169 VanDerWaalsContact C-N 3.31Å; V167-H169 PolarHBondContact O-N 3.42Å; V167-E170 PolarHBondContact O-N 2.95Å; V167-L171 HydrophobicContact CG1-CD1 3.84Å; V167-L171 HydrophobicContact CG1-CG 4.27Å; V167-L171 WeakPolarHBondContact O-CB 3.24Å; V167-L171 WeakPolarHBondContact O-CG 3.45Å; V167-L171 PolarHBondContact O-N 3.03Å
168	F	79.6	Confident	74.9	Confident	56 Å²	56	40.8 Å²	40.8	25%	0.246	22%	0.216	C	C	.	.	H	α-helix	trans	-67.7	-31.7	-179.5	-87.2	-87.6	0	0	0	112.5	Y164 I172 R190	Y164-F168 HydrophobicContact CD1-CD2 4.43Å; Y164-F168 AromaticContact CD2-CD2 3.45Å; Y164-F168 HydrophobicContact CD2-CD2 3.45Å; Y164-F168 VanDerWaalsContact CD2-CD2 3.45Å; Y164-F168 AromaticContact CD2-CE2 3.44Å; Y164-F168 HydrophobicContact CD2-CE2 3.44Å; Y164-F168 VanDerWaalsContact CD2-CE2 3.44Å; Y164-F168 HydrophobicContact CE1-CD2 4.28Å; Y164-F168 AromaticContact CE2-CD2 3.25Å; Y164-F168 HydrophobicContact CE2-CD2 3.25Å; Y164-F168 AromaticContact CE2-CE2 3.1Å; Y164-F168 HydrophobicContact CE2-CE2 3.1Å; Y164-F168 HydrophobicContact CE2-CG 4.13Å; Y164-F168 AromaticContact CE2-CZ 3.87Å; Y164-F168 HydrophobicContact CE2-CZ 3.87Å; Y164-F168 HydrophobicContact CG-CD2 4.04Å; Y164-F168 HydrophobicContact CG-CE2 4.44Å; Y164-F168 AromaticContact CZ-CD2 3.69Å; Y164-F168 AromaticContact CZ-CE2 3.91Å; Y164-F168 WeakPolarHBondContact O-CB 3.43Å; Y164-F168 WeakPolarHBondContact O-CD2 3.48Å; Y164-F168 PolarHBondContact O-N 3.45Å; F168-I172 WeakPolarHBondContact O-CB 3.22Å; F168-I172 WeakPolarHBondContact O-CD1 3.33Å; F168-I172 WeakPolarHBondContact O-CG1 3.34Å; F168-I172 PolarHBondContact O-N 3.39Å; F168-R190 HydrophobicContact CB-CG 4.12Å; F168-R190 HydrophobicContact CD1-CB 4.47Å
169	H	74.2	Confident	75	Confident	32 Å²	32	40.3 Å²	40.3	15%	0.148	22%	0.218	C	C	.	.	H	α-helix	trans	-66.8	-42.4	175.6	-89.6	-28.9	0	0	0	110.9	T25 N165 I166 V167 R173 R190	T25-H169 HydrophobicContact CG2-CB 3.68Å; T25-H169 WeakPolarHBondContact CG2-CD2 3.46Å; N165-H169 VanDerWaalsContact O-CB 3.27Å; N165-H169 WeakPolarHBondContact O-CB 3.48Å; N165-H169 PolarHBondContact O-CD2 3.26Å; N165-H169 PolarHBondContact O-N 3.06Å; N165-H169 VanDerWaalsContact O-N 3.16Å; I166-H169 PolarHBondContact O-N 3.23Å; V167-H169 VanDerWaalsContact C-N 3.31Å; V167-H169 PolarHBondContact O-N 3.42Å; H169-R173 WeakPolarHBondContact O-CB 3.5Å; H169-R173 PolarHBondContact O-N 3.47Å; H169-R190 PolarHBondContact CD2-NH1 2.93Å; H169-R190 PolarHBondContact CD2-NH2 3.21Å; H169-R190 VanDerWaalsContact CD2-NH2 3.26Å; H169-R190 PolarHBondContact CE1-NH1 3.48Å; H169-R190 PolarHBondContact CE1-NH2 2.9Å; H169-R190 VanDerWaalsContact ND1-CZ 3.32Å; H169-R190 PolarHBondContact ND1-NH1 2.93Å; H169-R190 PolarHBondContact NE2-NH2 2.81Å
170	E	75.6	Confident	74.8	Confident	21 Å²	21	39.8 Å²	39.8	10%	0.098	22%	0.218	C	C	.	.	H	α-helix	trans	-69.4	-40	178.9	-173.6	51.6	-149.6	0	0	112.3	M128 I166 V167 R173 Q174	M128-E170 HydrophobicContact CE-CG 4.21Å; I166-E170 PolarHBondContact O-N 3.46Å; V167-E170 PolarHBondContact O-N 2.95Å; E170-R173 VanDerWaalsContact O-CB 3.32Å; E170-R173 WeakPolarHBondContact O-CB 3.49Å; E170-R173 PolarHBondContact O-N 3.29Å; E170-R173 VanDerWaalsContact O-N 3.14Å; E170-R173 IonicContact OE1-CZ 2.68Å; E170-R173 IonicContact OE1-NE 2.67Å; E170-R173 PolarHBondContact OE1-NE 2.95Å; E170-R173 IonicContact OE1-NH2 3.87Å; E170-R173 PolarHBondContact OE1-NH2 2.8Å; E170-R173 IonicContact OE2-CZ 2.68Å; E170-R173 IonicContact OE2-NE 3.96Å; E170-R173 PolarHBondContact OE2-NE 2.89Å; E170-R173 IonicContact OE2-NH2 3.17Å; E170-Q174 WeakPolarHBondContact O-CG 3.47Å; E170-Q174 PolarHBondContact O-N 3.17Å; E170-Q174 VanDerWaalsContact O-N 3.08Å; E170-Q174 PolarHBondContact OE1-NE2 2.82Å
171	L	77.5	Confident	74.6	Confident	71 Å²	71	41.1 Å²	41.1	37%	0.372	22%	0.224	S	C	.	.	H	α-helix	trans	-62.9	-46.2	174.6	-74.2	176	0	0	0	112.4	V167 R173 Q174 V175	V167-L171 HydrophobicContact CG1-CD1 3.84Å; V167-L171 HydrophobicContact CG1-CG 4.27Å; V167-L171 WeakPolarHBondContact O-CB 3.24Å; V167-L171 WeakPolarHBondContact O-CG 3.45Å; V167-L171 PolarHBondContact O-N 3.03Å; L171-R173 PolarHBondContact O-N 3.28Å; L171-Q174 PolarHBondContact O-N 3.17Å; L171-V175 WeakPolarHBondContact O-CB 3.3Å; L171-V175 VanDerWaalsContact O-CG2 3.26Å; L171-V175 WeakPolarHBondContact O-CG2 3.27Å; L171-V175 PolarHBondContact O-N 2.85Å
172	I	71.5	Confident	74.7	Confident	7 Å²	7	48.5 Å²	48.5	4%	0.036	25%	0.251	C	S	.	.	H	α-helix	trans	-60.9	-34.2	176.6	-65.4	162.9	0	0	0	109.4	F20 F168 T176 L186 A187 R190	F20-I172 HydrophobicContact CE2-CB 4.44Å; F20-I172 HydrophobicContact CE2-CG2 3.66Å; F20-I172 WeakPolarHBondContact CE2-O 3.34Å; F20-I172 HydrophobicContact CZ-CB 4.01Å; F20-I172 HydrophobicContact CZ-CG2 3.65Å; F168-I172 WeakPolarHBondContact O-CB 3.22Å; F168-I172 WeakPolarHBondContact O-CD1 3.33Å; F168-I172 WeakPolarHBondContact O-CG1 3.34Å; F168-I172 PolarHBondContact O-N 3.39Å; I172-T176 WeakPolarHBondContact O-CB 3.36Å; I172-T176 PolarHBondContact O-N 2.82Å; I172-T176 PolarHBondContact O-OG1 3.49Å; I172-L186 HydrophobicContact CD1-CB 4.44Å; I172-L186 HydrophobicContact CG1-CB 3.68Å; I172-A187 HydrophobicContact CD1-CB 4.25Å; I172-A187 HydrophobicContact CG2-CB 4.46Å; I172-R190 HydrophobicContact CD1-CB 4.09Å
173	R	74.3	Confident	74.8	Confident	43 Å²	43	45.5 Å²	45.5	16%	0.162	24%	0.235	C	C	.	.	H	α-helix	trans	-65.2	-50.2	-177.4	-168	-173.9	72.6	95.8	8.9	110.7	F20 P111 S112 L113 H169 E170 L171 V177	F20-R173 HydrophobicContact CE1-CB 3.65Å; F20-R173 HydrophobicContact CE1-CG 3.88Å; F20-R173 HydrophobicContact CE2-CB 4.36Å; F20-R173 HydrophobicContact CZ-CB 3.52Å; F20-R173 HydrophobicContact CZ-CG 4.09Å; P111-R173 PolarHBondContact O-NH1 3.08Å; P111-R173 VanDerWaalsContact O-NH1 3.12Å; P111-R173 PolarHBondContact O-NH2 3.24Å; S112-R173 PolarHBondContact O-NH2 3.2Å; L113-R173 HydrophobicContact CD2-CG 3.9Å; H169-R173 WeakPolarHBondContact O-CB 3.5Å; H169-R173 PolarHBondContact O-N 3.47Å; E170-R173 VanDerWaalsContact O-CB 3.32Å; E170-R173 WeakPolarHBondContact O-CB 3.49Å; E170-R173 PolarHBondContact O-N 3.29Å; E170-R173 VanDerWaalsContact O-N 3.14Å; E170-R173 IonicContact OE1-CZ 2.68Å; E170-R173 IonicContact OE1-NE 2.67Å; E170-R173 PolarHBondContact OE1-NE 2.95Å; E170-R173 IonicContact OE1-NH2 3.87Å; E170-R173 PolarHBondContact OE1-NH2 2.8Å; E170-R173 IonicContact OE2-CZ 2.68Å; E170-R173 IonicContact OE2-NE 3.96Å; E170-R173 PolarHBondContact OE2-NE 2.89Å; E170-R173 IonicContact OE2-NH2 3.17Å; L171-R173 PolarHBondContact O-N 3.28Å; R173-V177 VanDerWaalsContact O-CG2 3.28Å; R173-V177 WeakPolarHBondContact O-CG2 3.35Å
174	Q	73.5	Confident	74.7	Confident	48 Å²	48	48.9 Å²	48.9	22%	0.224	25%	0.25	C	C	.	.	H	α-helix	trans	-69	-43.5	-179.3	-64.5	174.8	20.1	0	0	112.2	E170 L171 T176 V177	E170-Q174 WeakPolarHBondContact O-CG 3.47Å; E170-Q174 PolarHBondContact O-N 3.17Å; E170-Q174 VanDerWaalsContact O-N 3.08Å; E170-Q174 PolarHBondContact OE1-NE2 2.82Å; L171-Q174 PolarHBondContact O-N 3.17Å; Q174-T176 VanDerWaalsContact C-N 3.33Å; Q174-T176 PolarHBondContact O-N 3.02Å; Q174-V177 PolarHBondContact O-N 3.03Å
175	V	74.8	Confident	74.8	Confident	50 Å²	50	52.4 Å²	52.4	30%	0.303	27%	0.27	S	S	.	.	H	α-helix	trans	-66.7	-37.5	-177	173.7	0	0	0	0	111.7	L171 V177 G178 C179 R182 L186	L171-V175 WeakPolarHBondContact O-CB 3.3Å; L171-V175 VanDerWaalsContact O-CG2 3.26Å; L171-V175 WeakPolarHBondContact O-CG2 3.27Å; L171-V175 PolarHBondContact O-N 2.85Å; V175-V177 VanDerWaalsContact C-N 3.31Å; V175-V177 PolarHBondContact O-N 3.46Å; V175-G178 PolarHBondContact O-N 3.19Å; V175-C179 PolarHBondContact O-N 3.02Å; V175-R182 HydrophobicContact CG1-CB 3.67Å; V175-L186 HydrophobicContact CB-CD1 4.07Å; V175-L186 HydrophobicContact CG1-CD1 4.05Å; V175-L186 HydrophobicContact CG2-CD1 3.9Å
176	T	71	Confident	75	Confident	1 Å²	1	53.5 Å²	53.5	1%	0.006	28%	0.276	C	S	.	.	H	α-helix	trans	-59.9	-38.7	178.9	-75.7	0	0	0	0	113.8	Y17 Y19 F20 I172 Q174 G178 C179 G183	Y17-T176 HydrophobicContact CD1-CG2 3.81Å; Y17-T176 HydrophobicContact CE1-CG2 3.98Å; Y19-T176 HydrophobicContact CE2-CG2 3.7Å; Y19-T176 VanDerWaalsContact CE2-OG1 3.22Å; Y19-T176 WeakPolarHBondContact CE2-OG1 3.43Å; Y19-T176 WeakPolarHBondContact OH-CB 3.31Å; Y19-T176 WeakPolarHBondContact OH-CG2 3.5Å; Y19-T176 PolarHBondContact OH-OG1 3.02Å; Y19-T176 VanDerWaalsContact OH-OG1 3.1Å; F20-T176 HydrophobicContact CD2-CG2 3.74Å; F20-T176 HydrophobicContact CE2-CG2 3.85Å; F20-T176 WeakPolarHBondContact CE2-OG1 3.25Å; I172-T176 WeakPolarHBondContact O-CB 3.36Å; I172-T176 PolarHBondContact O-N 2.82Å; I172-T176 PolarHBondContact O-OG1 3.49Å; Q174-T176 VanDerWaalsContact C-N 3.33Å; Q174-T176 PolarHBondContact O-N 3.02Å; T176-G178 PolarHBondContact O-N 3.42Å; T176-C179 CarbonylContact O-C 3.53Å; T176-C179 PolarHBondContact O-N 3.11Å; T176-G183 WeakPolarHBondContact OG1-CA 3.29Å
177	V	69.3	Low	75.1	Confident	26 Å²	26	52.2 Å²	52.2	16%	0.158	27%	0.272	C	S	.	.	H	α-helix	trans	-65.6	-32.4	-178.8	175.3	0	0	0	0	110.5	Y17 L113 R114 R173 Q174 V175	Y17-V177 HydrophobicContact CE1-CG2 4.45Å; L113-V177 HydrophobicContact CB-CB 4.42Å; L113-V177 HydrophobicContact CB-CG1 4.05Å; L113-V177 HydrophobicContact CB-CG2 3.72Å; L113-V177 HydrophobicContact CD1-CG2 4.45Å; L113-V177 HydrophobicContact CD2-CG2 3.66Å; L113-V177 HydrophobicContact CG-CG2 4.14Å; R114-V177 HydrophobicContact CB-CG1 4.35Å; R173-V177 VanDerWaalsContact O-CG2 3.28Å; R173-V177 WeakPolarHBondContact O-CG2 3.35Å; Q174-V177 PolarHBondContact O-N 3.03Å; V175-V177 VanDerWaalsContact C-N 3.31Å; V175-V177 PolarHBondContact O-N 3.46Å
178	G	65.9	Low	75.2	Confident	48 Å²	48	56.7 Å²	56.7	50%	0.495	29%	0.289	S	S	.	.	H	α-helix	trans	-82.2	-45	174.2	0	0	0	0	0	114.3	V175 T176	V175-G178 PolarHBondContact O-N 3.19Å; T176-G178 PolarHBondContact O-N 3.42Å
179	C	75.9	Confident	75.4	Confident	39 Å²	39	57.6 Å²	57.6	26%	0.264	30%	0.296	S	S	.	.			trans	-151.7	116.4	179.4	172	0	0	0	0	110.5	V175 T176 E181 R182 G183	V175-C179 PolarHBondContact O-N 3.02Å; T176-C179 CarbonylContact O-C 3.53Å; T176-C179 PolarHBondContact O-N 3.11Å; C179-E181 PolarHBondContact O-N 3.02Å; C179-E181 PolarHBondContact SG-OE2 2.87Å; C179-R182 HydrophobicContact CB-CB 4.25Å; C179-R182 HydrophobicContact CB-CG 4.3Å; C179-R182 PolarHBondContact O-N 2.92Å; C179-G183 PolarHBondContact O-N 3.16Å
180	A	69.2	Low	75.8	Confident	29 Å²	29	56.5 Å²	56.5	24%	0.24	29%	0.29	C	S	.	.	H	α-helix	trans	-67.4	-36.6	-173.7	0	0	0	0	0	112.4	Y19 G183 Q184	Y19-A180 VanDerWaalsContact OH-CA 3.29Å; Y19-A180 WeakPolarHBondContact OH-CA 3.45Å; Y19-A180 WeakPolarHBondContact OH-CB 3.44Å; Y19-A180 PolarHBondContact OH-O 3.28Å; A180-G183 PolarHBondContact O-N 2.84Å; A180-Q184 WeakPolarHBondContact O-CB 3.43Å; A180-Q184 PolarHBondContact O-N 3.33Å
181	E	73.3	Confident	76	Confident	135 Å²	135	61.1 Å²	61.1	63%	0.631	31%	0.312	S	S	*	.	H	α-helix	trans	-67.7	-38.1	-178.9	-56.9	81.7	179.3	0	0	111.9	C179 Q184 L185	C179-E181 PolarHBondContact O-N 3.02Å; C179-E181 PolarHBondContact SG-OE2 2.87Å; E181-Q184 PolarHBondContact O-N 3.37Å; E181-L185 PolarHBondContact O-N 3.49Å
182	R	78.2	Confident	76.1	Confident	180 Å²	180	67.3 Å²	67.3	68%	0.679	33%	0.33	S	S	*	.	H	α-helix	trans	-68	-39.9	174	-73	179.8	-176.9	-177.1	0.9	111.5	V175 C179 L185 L186	V175-R182 HydrophobicContact CG1-CB 3.67Å; C179-R182 HydrophobicContact CB-CB 4.25Å; C179-R182 HydrophobicContact CB-CG 4.3Å; C179-R182 PolarHBondContact O-N 2.92Å; R182-L185 PolarHBondContact O-N 3.07Å; R182-L186 PolarHBondContact O-N 2.63Å; R182-L186 VanDerWaalsContact O-N 3.09Å
183	G	78.6	Confident	76.6	Confident	0 Å²	0	73.1 Å²	73.1	0%	0	35%	0.353	C	S	.	.	H	α-helix	trans	-60.2	-44.4	172	0	0	0	0	0	112.3	T176 C179 A180 L185 L186 A187	T176-G183 WeakPolarHBondContact OG1-CA 3.29Å; C179-G183 PolarHBondContact O-N 3.16Å; A180-G183 PolarHBondContact O-N 2.84Å; G183-L185 VanDerWaalsContact C-N 3.34Å; G183-L185 PolarHBondContact O-N 3.07Å; G183-L186 PolarHBondContact O-N 2.9Å; G183-A187 PolarHBondContact O-N 3.45Å
184	Q	75.8	Confident	76.9	Confident	97 Å²	97	73.4 Å²	73.4	45%	0.453	36%	0.356	S	S	.	.	H	α-helix	trans	-64.3	-36.3	176.8	-167.9	-178.6	14.3	0	0	112.6	A180 E181 A187 K188	A180-Q184 WeakPolarHBondContact O-CB 3.43Å; A180-Q184 PolarHBondContact O-N 3.33Å; E181-Q184 PolarHBondContact O-N 3.37Å; Q184-A187 PolarHBondContact O-N 3.48Å; Q184-K188 PolarHBondContact O-N 3.1Å
185	L	83.2	Confident	77.1	Confident	108 Å²	108	73.5 Å²	73.5	57%	0.565	36%	0.362	S	S	*	.	H	α-helix	trans	-65.6	-42.7	175.4	-172.6	132.9	0	0	0	111.8	E181 R182 G183 A187 K188 L189	E181-L185 PolarHBondContact O-N 3.49Å; R182-L185 PolarHBondContact O-N 3.07Å; G183-L185 VanDerWaalsContact C-N 3.34Å; G183-L185 PolarHBondContact O-N 3.07Å; L185-A187 VanDerWaalsContact C-N 3.33Å; L185-A187 PolarHBondContact O-N 3.41Å; L185-K188 PolarHBondContact O-N 2.86Å; L185-L189 HydrophobicContact CD2-CD1 3.87Å; L185-L189 PolarHBondContact O-N 3.27Å
186	L	81.3	Confident	77.4	Confident	47 Å²	47	75.4 Å²	75.4	25%	0.246	37%	0.37	C	S	.	.	H	α-helix	trans	-64.1	-36.7	173.8	-73.1	173.5	0	0	0	112.3	I172 V175 R182 G183 L189 R190	I172-L186 HydrophobicContact CD1-CB 4.44Å; I172-L186 HydrophobicContact CG1-CB 3.68Å; V175-L186 HydrophobicContact CB-CD1 4.07Å; V175-L186 HydrophobicContact CG1-CD1 4.05Å; V175-L186 HydrophobicContact CG2-CD1 3.9Å; R182-L186 PolarHBondContact O-N 2.63Å; R182-L186 VanDerWaalsContact O-N 3.09Å; G183-L186 PolarHBondContact O-N 2.9Å; L186-L189 PolarHBondContact O-N 3.06Å; L186-R190 WeakPolarHBondContact O-CB 3.49Å; L186-R190 PolarHBondContact O-N 2.95Å
187	A	76.8	Confident	77.6	Confident	19 Å²	19	77 Å²	77	16%	0.157	38%	0.378	C	S	.	.	H	α-helix	trans	-63.4	-40.9	174.1	0	0	0	0	0	112.4	I172 G183 Q184 L185 R190 Q191	I172-A187 HydrophobicContact CD1-CB 4.25Å; I172-A187 HydrophobicContact CG2-CB 4.46Å; G183-A187 PolarHBondContact O-N 3.45Å; Q184-A187 PolarHBondContact O-N 3.48Å; L185-A187 VanDerWaalsContact C-N 3.33Å; L185-A187 PolarHBondContact O-N 3.41Å; A187-R190 PolarHBondContact O-N 3.49Å; A187-Q191 PolarHBondContact O-N 2.87Å
188	K	80.2	Confident	77.8	Confident	133 Å²	133	79.2 Å²	79.2	58%	0.578	39%	0.387	S	S	*	.	H	α-helix	trans	-65.5	-39.4	174.8	-74.2	-178	179	178.9	0	112.6	Q184 L185 R192	Q184-K188 PolarHBondContact O-N 3.1Å; L185-K188 PolarHBondContact O-N 2.86Å; K188-R192 PolarHBondContact O-N 2.98Å
189	L	83.3	Confident	78.5	Confident	76 Å²	76	84.8 Å²	84.8	40%	0.398	39%	0.393	S	S	.	.	H	α-helix	trans	-62.5	-45.9	173.1	-97.2	152.6	0	0	0	110.9	L185 L186 Q191 R192 Y193	L185-L189 HydrophobicContact CD2-CD1 3.87Å; L185-L189 PolarHBondContact O-N 3.27Å; L186-L189 PolarHBondContact O-N 3.06Å; L189-Q191 VanDerWaalsContact C-N 3.3Å; L189-Q191 PolarHBondContact O-N 3.35Å; L189-R192 PolarHBondContact O-N 3.05Å; L189-Y193 HydrophobicContact CD2-CD2 4.46Å; L189-Y193 HydrophobicContact CD2-CE2 3.99Å; L189-Y193 WeakPolarHBondContact O-CD2 3.39Å; L189-Y193 PolarHBondContact O-N 3.25Å
190	R	83.2	Confident	78.7	Confident	8 Å²	8	86.4 Å²	86.4	3%	0.03	40%	0.398	C	S	.	.	H	α-helix	trans	-56.2	-47	178.4	-178.6	-163.5	166.3	117.3	-5.3	111.5	Y164 N165 F168 H169 I172 L186 A187 R192 Y193 Q194	Y164-R190 HydrophobicContact CE1-CG 3.99Å; Y164-R190 WeakPolarHBondContact OH-CA 3.41Å; Y164-R190 PolarHBondContact OH-O 3.48Å; Y164-R190 VanDerWaalsContact OH-O 3.09Å; N165-R190 PolarHBondContact O-NH1 2.96Å; N165-R190 PolarHBondContact OD1-NH2 3.1Å; F168-R190 HydrophobicContact CB-CG 4.12Å; F168-R190 HydrophobicContact CD1-CB 4.47Å; H169-R190 PolarHBondContact CD2-NH1 2.93Å; H169-R190 PolarHBondContact CD2-NH2 3.21Å; H169-R190 VanDerWaalsContact CD2-NH2 3.26Å; H169-R190 PolarHBondContact CE1-NH1 3.48Å; H169-R190 PolarHBondContact CE1-NH2 2.9Å; H169-R190 VanDerWaalsContact ND1-CZ 3.32Å; H169-R190 PolarHBondContact ND1-NH1 2.93Å; H169-R190 PolarHBondContact NE2-NH2 2.81Å; I172-R190 HydrophobicContact CD1-CB 4.09Å; L186-R190 WeakPolarHBondContact O-CB 3.49Å; L186-R190 PolarHBondContact O-N 2.95Å; A187-R190 PolarHBondContact O-N 3.49Å; R190-R192 VanDerWaalsContact C-N 3.3Å; R190-R192 PolarHBondContact O-N 3.05Å; R190-Y193 PolarHBondContact O-N 3.03Å; R190-Q194 VanDerWaalsContact O-CB 3.29Å; R190-Q194 WeakPolarHBondContact O-CB 3.26Å; R190-Q194 PolarHBondContact O-N 2.76Å
191	Q	78.7	Confident	78.9	Confident	118 Å²	118	85.8 Å²	85.8	55%	0.551	39%	0.392	S	S	*	.	H	α-helix	trans	-61.1	-36.7	-178.7	-167.8	179.5	10.4	0	0	112.6	A187 L189 S195	A187-Q191 PolarHBondContact O-N 2.87Å; L189-Q191 VanDerWaalsContact C-N 3.3Å; L189-Q191 PolarHBondContact O-N 3.35Å; Q191-S195 PolarHBondContact O-N 3.48Å
192	R	81.2	Confident	79	Confident	201 Å²	201	87.7 Å²	87.7	76%	0.758	39%	0.393	S	S	*	.	H	α-helix	trans	-66.7	-48.6	176.5	-76.4	-165.4	176.2	-135.5	1.5	112	K188 L189 R190 Q194 S195 L196	K188-R192 PolarHBondContact O-N 2.98Å; L189-R192 PolarHBondContact O-N 3.05Å; R190-R192 VanDerWaalsContact C-N 3.3Å; R190-R192 PolarHBondContact O-N 3.05Å; R192-Q194 VanDerWaalsContact C-N 3.35Å; R192-S195 PolarHBondContact O-N 3.2Å; R192-S195 PolarHBondContact O-OG 3.46Å; R192-L196 PolarHBondContact O-N 3.39Å
193	Y	82.1	Confident	78.9	Confident	130 Å²	130	88.6 Å²	88.6	51%	0.51	40%	0.397	S	S	.	.	H	α-helix	trans	-68.4	-34.4	178.5	-80.5	-73.1	0	0	0	112.3	Y164 L189 R190 S195 L196 L197	Y164-Y193 WeakPolarHBondContact OH-CB 3.37Å; L189-Y193 HydrophobicContact CD2-CD2 4.46Å; L189-Y193 HydrophobicContact CD2-CE2 3.99Å; L189-Y193 WeakPolarHBondContact O-CD2 3.39Å; L189-Y193 PolarHBondContact O-N 3.25Å; R190-Y193 PolarHBondContact O-N 3.03Å; Y193-S195 VanDerWaalsContact C-N 3.34Å; Y193-S195 PolarHBondContact O-N 3.49Å; Y193-L196 WeakPolarHBondContact O-CB 3.48Å; Y193-L196 PolarHBondContact O-N 3.31Å; Y193-L196 VanDerWaalsContact O-N 3.11Å; Y193-L197 WeakPolarHBondContact O-CG 3.49Å; Y193-L197 PolarHBondContact O-N 3.02Å
194	Q	80.3	Confident	78.9	Confident	48 Å²	48	90 Å²	90	22%	0.224	40%	0.404	C	S	.	.	H	α-helix	trans	-59.8	-43.7	171.4	-178.1	177.3	-13.1	0	0	111.5	R190 R192 L196 L197 E198	R190-Q194 VanDerWaalsContact O-CB 3.29Å; R190-Q194 WeakPolarHBondContact O-CB 3.26Å; R190-Q194 PolarHBondContact O-N 2.76Å; R192-Q194 VanDerWaalsContact C-N 3.35Å; Q194-L196 PolarHBondContact O-N 2.94Å; Q194-L197 PolarHBondContact O-N 3.48Å; Q194-E198 PolarHBondContact NE2-OE1 2.95Å; Q194-E198 VanDerWaalsContact NE2-OE1 3.11Å; Q194-E198 WeakPolarHBondContact O-CB 3.39Å; Q194-E198 WeakPolarHBondContact O-CG 3.29Å; Q194-E198 PolarHBondContact O-N 3.28Å
195	S	78.1	Confident	78.7	Confident	50 Å²	50	87.5 Å²	87.5	35%	0.35	40%	0.396	S	S	.	.	H	α-helix	trans	-64.2	-26.1	176.5	78	0	0	0	0	113.6	Q191 R192 Y193 R199	Q191-S195 PolarHBondContact O-N 3.48Å; R192-S195 PolarHBondContact O-N 3.2Å; R192-S195 PolarHBondContact O-OG 3.46Å; Y193-S195 VanDerWaalsContact C-N 3.34Å; Y193-S195 PolarHBondContact O-N 3.49Å; S195-R199 WeakPolarHBondContact O-CD 3.25Å; S195-R199 VanDerWaalsContact O-CG 3.23Å; S195-R199 WeakPolarHBondContact O-CG 3.44Å
196	L	79.1	Confident	78.5	Confident	91 Å²	91	85.3 Å²	85.3	48%	0.476	39%	0.389	S	S	.	.	H	α-helix	trans	-76.6	-47.5	173.8	-177.4	68.3	0	0	0	110.6	R192 Y193 Q194 E198 R199 I200	R192-L196 PolarHBondContact O-N 3.39Å; Y193-L196 WeakPolarHBondContact O-CB 3.48Å; Y193-L196 PolarHBondContact O-N 3.31Å; Y193-L196 VanDerWaalsContact O-N 3.11Å; Q194-L196 PolarHBondContact O-N 2.94Å; L196-E198 PolarHBondContact O-N 3.26Å; L196-R199 PolarHBondContact O-N 3.46Å; L196-I200 HydrophobicContact CG-CD1 4.31Å; L196-I200 PolarHBondContact O-N 3.14Å
197	L	77.2	Confident	78.4	Confident	35 Å²	35	87.4 Å²	87.4	18%	0.183	40%	0.4	C	S	.	.	H	α-helix	trans	-62.3	-29.1	176.6	-69.9	172	0	0	0	112.4	Q161 Y164 Y193 Q194 P201	Q161-L197 HydrophobicContact CG-CB 4.48Å; Y164-L197 HydrophobicContact CD1-CD1 3.81Å; Y164-L197 HydrophobicContact CD2-CD1 4.25Å; Y164-L197 HydrophobicContact CE1-CD1 4.16Å; Y164-L197 HydrophobicContact CG-CD1 3.87Å; Y193-L197 WeakPolarHBondContact O-CG 3.49Å; Y193-L197 PolarHBondContact O-N 3.02Å; Q194-L197 PolarHBondContact O-N 3.48Å; L197-P201 WeakPolarHBondContact O-CD 3.42Å; L197-P201 WeakPolarHBondContact O-CG 3.3Å
198	E	73.3	Confident	78.6	Confident	72 Å²	72	88.5 Å²	88.5	34%	0.336	40%	0.402	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.1	-24.9	172.4	-75.7	176.3	-165.1	0	0	113.7	Q194 L196	Q194-E198 PolarHBondContact NE2-OE1 2.95Å; Q194-E198 VanDerWaalsContact NE2-OE1 3.11Å; Q194-E198 WeakPolarHBondContact O-CB 3.39Å; Q194-E198 WeakPolarHBondContact O-CG 3.29Å; Q194-E198 PolarHBondContact O-N 3.28Å; L196-E198 PolarHBondContact O-N 3.26Å
199	R	79.4	Confident	78.4	Confident	164 Å²	164	85 Å²	85	62%	0.619	40%	0.398	S	S	*	.	H	α-helix	trans	-84	-30.1	-178.3	-76.7	171.1	-177.4	-168	0.4	113	S195 L196 R202 R203	S195-R199 WeakPolarHBondContact O-CD 3.25Å; S195-R199 VanDerWaalsContact O-CG 3.23Å; S195-R199 WeakPolarHBondContact O-CG 3.44Å; L196-R199 PolarHBondContact O-N 3.46Å; R199-R202 PolarHBondContact O-N 3.12Å; R199-R203 PolarHBondContact O-N 3.34Å
200	I	79.8	Confident	78.4	Confident	74 Å²	74	86.7 Å²	86.7	38%	0.379	40%	0.404	S	S	.	.	H	α-helix	trans	-63.6	-52.3	-177.5	-68.5	165.2	0	0	0	111.3	L196 R202 R203 L204	L196-I200 HydrophobicContact CG-CD1 4.31Å; L196-I200 PolarHBondContact O-N 3.14Å; I200-R202 VanDerWaalsContact C-N 3.29Å; I200-R202 PolarHBondContact O-N 3.25Å; I200-R203 PolarHBondContact O-N 2.68Å; I200-R203 VanDerWaalsContact O-N 3.11Å; I200-L204 PolarHBondContact O-N 3.45Å
201	P	74	Confident	78.3	Confident	16 Å²	16	88.9 Å²	88.9	10%	0.104	42%	0.418	C	S	.	.	H	α-helix	trans	-57.2	-40.5	176.7	-25.9	34.1	0	0	0	112.8	V157 L197 R203 L204 T205	V157-P201 HydrophobicContact CG1-CG 3.8Å; L197-P201 WeakPolarHBondContact O-CD 3.42Å; L197-P201 WeakPolarHBondContact O-CG 3.3Å; P201-R203 VanDerWaalsContact C-N 3.3Å; P201-R203 PolarHBondContact O-N 2.99Å; P201-L204 WeakPolarHBondContact O-CB 3.46Å; P201-L204 PolarHBondContact O-N 3.07Å; P201-L204 VanDerWaalsContact O-N 3.17Å; P201-T205 WeakPolarHBondContact O-CG2 3.35Å; P201-T205 PolarHBondContact O-N 3.24Å; P201-T205 PolarHBondContact O-OG1 2.83Å
202	R	76.4	Confident	78.3	Confident	175 Å²	175	86.3 Å²	86.3	66%	0.66	41%	0.41	S	S	*	.	H	α-helix	trans	-63.8	-33.3	178.8	-66.7	-177	-174.3	173.1	7.3	113.5	R199 I200 T205 S206	R199-R202 PolarHBondContact O-N 3.12Å; I200-R202 VanDerWaalsContact C-N 3.29Å; I200-R202 PolarHBondContact O-N 3.25Å; R202-T205 PolarHBondContact O-OG1 3.21Å; R202-S206 PolarHBondContact O-N 3.13Å
203	R	75.6	Confident	78	Confident	198 Å²	198	79.2 Å²	79.2	75%	0.747	40%	0.395	S	S	*	.	H	α-helix	trans	-76.3	-38.6	173.7	-72.4	-170.4	177.1	-133.8	-0.6	111.2	R199 I200 P201 T205 S206 L207	R199-R203 PolarHBondContact O-N 3.34Å; I200-R203 PolarHBondContact O-N 2.68Å; I200-R203 VanDerWaalsContact O-N 3.11Å; P201-R203 VanDerWaalsContact C-N 3.3Å; P201-R203 PolarHBondContact O-N 2.99Å; R203-T205 VanDerWaalsContact C-N 3.33Å; R203-T205 PolarHBondContact O-N 2.65Å; R203-S206 PolarHBondContact O-N 3.41Å; R203-L207 WeakPolarHBondContact O-CG 3.46Å; R203-L207 PolarHBondContact O-N 2.85Å; R203-L207 VanDerWaalsContact O-N 3.11Å
204	L	78.6	Confident	77.9	Confident	29 Å²	29	78.8 Å²	78.8	15%	0.152	40%	0.397	C	S	.	.	H	α-helix	trans	-63.2	-38.9	178.1	-154.1	71.9	0	0	0	111.8	L150 L153 L154 I200 P201 L207 H208	L150-L204 HydrophobicContact CD1-CD1 3.31Å; L150-L204 HydrophobicContact CD1-CD2 4.08Å; L150-L204 HydrophobicContact CD1-CG 3.48Å; L150-L204 VanDerWaalsContact CD1-CG 3.48Å; L150-L204 HydrophobicContact CG-CD1 4.44Å; L150-L204 HydrophobicContact CG-CG 4.14Å; L153-L204 HydrophobicContact CB-CD2 4.13Å; L154-L204 HydrophobicContact CB-CD2 3.97Å; L154-L204 HydrophobicContact CD1-CD2 4.27Å; I200-L204 PolarHBondContact O-N 3.45Å; P201-L204 WeakPolarHBondContact O-CB 3.46Å; P201-L204 PolarHBondContact O-N 3.07Å; P201-L204 VanDerWaalsContact O-N 3.17Å; L204-L207 PolarHBondContact O-N 3.18Å; L204-H208 PolarHBondContact O-N 3.32Å
205	T	71.5	Confident	78	Confident	46 Å²	46	82.2 Å²	82.2	28%	0.282	41%	0.408	S	S	.	.	H	α-helix	trans	-68.8	-38.6	176.3	53.9	0	0	0	0	112.8	L37 L154 P201 R202 R203 L207 H208 A209	L37-T205 HydrophobicContact CD1-CG2 4.44Å; L154-T205 HydrophobicContact CD1-CG2 3.6Å; P201-T205 WeakPolarHBondContact O-CG2 3.35Å; P201-T205 PolarHBondContact O-N 3.24Å; P201-T205 PolarHBondContact O-OG1 2.83Å; R202-T205 PolarHBondContact O-OG1 3.21Å; R203-T205 VanDerWaalsContact C-N 3.33Å; R203-T205 PolarHBondContact O-N 2.65Å; T205-L207 VanDerWaalsContact C-N 3.34Å; T205-H208 PolarHBondContact O-N 2.97Å; T205-A209 WeakPolarHBondContact O-CB 3.5Å; T205-A209 PolarHBondContact O-N 3.31Å
206	S	78.5	Confident	78	Confident	62 Å²	62	82.1 Å²	82.1	43%	0.434	41%	0.411	S	S	.	.	H	α-helix	trans	-59.9	-46.6	173.7	-166.9	0	0	0	0	110.9	R202 R203 H208 A209 E210	R202-S206 PolarHBondContact O-N 3.13Å; R203-S206 PolarHBondContact O-N 3.41Å; S206-H208 VanDerWaalsContact C-N 3.34Å; S206-H208 PolarHBondContact O-N 3.02Å; S206-A209 PolarHBondContact O-N 3.13Å; S206-E210 WeakPolarHBondContact O-CG 3.44Å; S206-E210 PolarHBondContact O-N 2.8Å; S206-E210 PolarHBondContact OG-OE1 3Å
207	L	80.1	Confident	78.4	Confident	91 Å²	91	82.9 Å²	82.9	48%	0.476	42%	0.415	S	S	.	.	H	α-helix	trans	-63.7	-39.1	176.9	-71.1	171.6	0	0	0	112.1	R203 L204 T205 E210 V211	R203-L207 WeakPolarHBondContact O-CG 3.46Å; R203-L207 PolarHBondContact O-N 2.85Å; R203-L207 VanDerWaalsContact O-N 3.11Å; L204-L207 PolarHBondContact O-N 3.18Å; T205-L207 VanDerWaalsContact C-N 3.34Å; L207-E210 PolarHBondContact O-N 2.95Å; L207-V211 VanDerWaalsContact O-CG2 3.32Å; L207-V211 WeakPolarHBondContact O-CG2 3.44Å; L207-V211 PolarHBondContact O-N 3.38Å
208	H	79.4	Confident	78.7	Confident	41 Å²	41	85.2 Å²	85.2	19%	0.19	43%	0.427	C	S	.	.	H	α-helix	trans	-63	-46.4	175.7	-174.2	75.2	0	0	0	111.7	L150 E151 L204 T205 S206 E210 V211 V212	L150-H208 VanDerWaalsContact CD2-CA 3.45Å; L150-H208 HydrophobicContact CD2-CB 3.44Å; L150-H208 VanDerWaalsContact CD2-CB 3.44Å; L150-H208 HydrophobicContact CG-CB 4.21Å; E151-H208 IonicContact OE1-CE1 2.87Å; E151-H208 IonicContact OE1-NE2 3.34Å; L204-H208 PolarHBondContact O-N 3.32Å; T205-H208 PolarHBondContact O-N 2.97Å; S206-H208 VanDerWaalsContact C-N 3.34Å; S206-H208 PolarHBondContact O-N 3.02Å; H208-E210 VanDerWaalsContact C-N 3.31Å; H208-E210 PolarHBondContact O-N 2.77Å; H208-V211 PolarHBondContact O-N 3.42Å; H208-V212 VanDerWaalsContact O-CG2 3.31Å; H208-V212 WeakPolarHBondContact O-CG2 3.45Å; H208-V212 PolarHBondContact O-N 2.88Å
209	A	77.7	Confident	79.4	Confident	60 Å²	60	90 Å²	90	50%	0.496	44%	0.442	S	S	.	.	H	α-helix	trans	-60.5	-41.5	177.4	0	0	0	0	0	111.8	T205 S206 V212 A213	T205-A209 WeakPolarHBondContact O-CB 3.5Å; T205-A209 PolarHBondContact O-N 3.31Å; S206-A209 PolarHBondContact O-N 3.13Å; A209-V212 PolarHBondContact O-N 3.1Å; A209-A213 WeakPolarHBondContact O-CB 3.44Å; A209-A213 PolarHBondContact O-N 2.96Å
210	E	81.8	Confident	79.9	Confident	111 Å²	111	90.7 Å²	90.7	52%	0.519	45%	0.445	S	S	.	.	H	α-helix	trans	-61.3	-47.8	174.1	-74.7	168.5	-153.6	0	0	111.8	S206 L207 H208 V212 A213 Q214	S206-E210 WeakPolarHBondContact O-CG 3.44Å; S206-E210 PolarHBondContact O-N 2.8Å; S206-E210 PolarHBondContact OG-OE1 3Å; L207-E210 PolarHBondContact O-N 2.95Å; H208-E210 VanDerWaalsContact C-N 3.31Å; H208-E210 PolarHBondContact O-N 2.77Å; E210-V212 PolarHBondContact O-N 2.82Å; E210-A213 PolarHBondContact O-N 3.19Å; E210-Q214 WeakPolarHBondContact O-CB 3.48Å; E210-Q214 PolarHBondContact O-N 3.43Å
211	V	81.3	Confident	80.4	Confident	54 Å²	54	92 Å²	92	33%	0.327	45%	0.452	S	S	.	.	H	α-helix	trans	-64.2	-39	178.7	171.8	0	0	0	0	111.9	L207 H208 Q214 R215	L207-V211 VanDerWaalsContact O-CG2 3.32Å; L207-V211 WeakPolarHBondContact O-CG2 3.44Å; L207-V211 PolarHBondContact O-N 3.38Å; H208-V211 PolarHBondContact O-N 3.42Å; V211-Q214 PolarHBondContact O-N 3.39Å; V211-R215 WeakPolarHBondContact O-CG 3.31Å; V211-R215 PolarHBondContact O-N 3.36Å
212	V	78.8	Confident	81.4	Confident	65 Å²	65	96.7 Å²	96.7	39%	0.394	48%	0.475	S	S	.	.	H	α-helix	trans	-66.3	-43.9	176.8	170.8	0	0	0	0	111	H208 A209 E210 Q214 R215 A216	H208-V212 VanDerWaalsContact O-CG2 3.31Å; H208-V212 WeakPolarHBondContact O-CG2 3.45Å; H208-V212 PolarHBondContact O-N 2.88Å; A209-V212 PolarHBondContact O-N 3.1Å; E210-V212 PolarHBondContact O-N 2.82Å; V212-Q214 VanDerWaalsContact C-N 3.31Å; V212-Q214 PolarHBondContact O-N 3.17Å; V212-R215 PolarHBondContact O-N 2.9Å; V212-A216 PolarHBondContact O-N 3.4Å
213	A	74.9	Confident	82.1	Confident	52 Å²	52	93.8 Å²	93.8	43%	0.43	47%	0.469	S	S	.	.	H	α-helix	trans	-60.9	-42.3	175	0	0	0	0	0	111.3	A209 E210 A216 L217	A209-A213 WeakPolarHBondContact O-CB 3.44Å; A209-A213 PolarHBondContact O-N 2.96Å; E210-A213 PolarHBondContact O-N 3.19Å; A213-A216 PolarHBondContact O-N 2.9Å; A213-L217 WeakPolarHBondContact O-CG 3.43Å; A213-L217 PolarHBondContact O-N 3.44Å
214	Q	79.3	Confident	83	Confident	120 Å²	120	89.7 Å²	89.7	56%	0.561	46%	0.458	S	S	*	.	H	α-helix	trans	-61.9	-45.9	177.2	-159.1	170.7	8.6	0	0	111.5	E210 V211 V212 A216 L217 D218	E210-Q214 WeakPolarHBondContact O-CB 3.48Å; E210-Q214 PolarHBondContact O-N 3.43Å; V211-Q214 PolarHBondContact O-N 3.39Å; V212-Q214 VanDerWaalsContact C-N 3.31Å; V212-Q214 PolarHBondContact O-N 3.17Å; Q214-A216 VanDerWaalsContact C-N 3.31Å; Q214-A216 PolarHBondContact O-N 3.15Å; Q214-L217 PolarHBondContact O-N 3.14Å; Q214-D218 PolarHBondContact O-N 3.4Å
215	R	83.6	Confident	83.8	Confident	120 Å²	120	93.5 Å²	93.5	45%	0.453	48%	0.478	S	S	.	.	H	α-helix	trans	-62.1	-34.9	174.4	-72.2	175.2	-178.5	174.3	0.9	113.1	C148 V211 V212 R219	C148-R215 PolarHBondContact SG-NH1 2.9Å; V211-R215 WeakPolarHBondContact O-CG 3.31Å; V211-R215 PolarHBondContact O-N 3.36Å; V212-R215 PolarHBondContact O-N 2.9Å; R215-R219 WeakPolarHBondContact O-CG 3.41Å; R215-R219 PolarHBondContact O-N 3.42Å; R215-R219 VanDerWaalsContact O-N 3.1Å
216	A	77.7	Confident	84.8	Confident	49 Å²	49	99.2 Å²	99.2	41%	0.405	50%	0.495	S	S	.	.	H	α-helix	trans	-69.3	-39.5	176.9	0	0	0	0	0	111.9	V212 A213 Q214 R219 R220	V212-A216 PolarHBondContact O-N 3.4Å; A213-A216 PolarHBondContact O-N 2.9Å; Q214-A216 VanDerWaalsContact C-N 3.31Å; Q214-A216 PolarHBondContact O-N 3.15Å; A216-R219 PolarHBondContact O-N 3.03Å; A216-R220 PolarHBondContact O-N 3.45Å
217	L	87.6	Confident	85.5	Confident	107 Å²	107	101.8 Å²	101.8	56%	0.56	50%	0.5	S	S	*	.	H	α-helix	trans	-64	-46.3	172.9	-70.3	174.4	0	0	0	111.4	A213 Q214 R219 R220 L221	A213-L217 WeakPolarHBondContact O-CG 3.43Å; A213-L217 PolarHBondContact O-N 3.44Å; Q214-L217 PolarHBondContact O-N 3.14Å; L217-R219 VanDerWaalsContact C-N 3.28Å; L217-R219 PolarHBondContact O-N 3.09Å; L217-R220 PolarHBondContact O-N 3.21Å; L217-R220 VanDerWaalsContact O-N 3.16Å; L217-L221 WeakPolarHBondContact O-CG 3.24Å; L217-L221 PolarHBondContact O-N 3.43Å
218	D	84.3	Confident	86.2	Confident	83 Å²	83	101.8 Å²	101.8	44%	0.444	50%	0.5	S	S	.	.	H	α-helix	trans	-59	-39.8	178.2	-70.2	-24.3	0	0	0	111.8	Q214 L221 I222	Q214-D218 PolarHBondContact O-N 3.4Å; D218-L221 PolarHBondContact O-N 3.03Å; D218-I222 VanDerWaalsContact O-CG1 3.26Å; D218-I222 WeakPolarHBondContact O-CG1 3.32Å; D218-I222 PolarHBondContact O-N 3.39Å
219	R	87.4	Confident	87	Confident	174 Å²	174	105.5 Å²	105.5	66%	0.657	52%	0.515	S	S	*	.	H	α-helix	trans	-61.6	-47.5	174.7	-76	174.8	-178.1	171.1	1	112.3	R215 A216 L217 L221 I222 E223	R215-R219 WeakPolarHBondContact O-CG 3.41Å; R215-R219 PolarHBondContact O-N 3.42Å; R215-R219 VanDerWaalsContact O-N 3.1Å; A216-R219 PolarHBondContact O-N 3.03Å; L217-R219 VanDerWaalsContact C-N 3.28Å; L217-R219 PolarHBondContact O-N 3.09Å; R219-L221 VanDerWaalsContact C-N 3.33Å; R219-L221 PolarHBondContact O-N 3.5Å; R219-I222 PolarHBondContact O-N 2.87Å; R219-E223 WeakPolarHBondContact O-CG 3.49Å; R219-E223 PolarHBondContact O-N 2.96Å
220	R	89.3	Confident	87.8	Confident	177 Å²	177	104.1 Å²	104.1	67%	0.668	50%	0.504	S	S	*	.	H	α-helix	trans	-61.7	-41.7	176.5	-74.4	-171.8	176.6	-175.2	-0.8	111.8	A216 L217 I222 E223 E224	A216-R220 PolarHBondContact O-N 3.45Å; L217-R220 PolarHBondContact O-N 3.21Å; L217-R220 VanDerWaalsContact O-N 3.16Å; R220-I222 VanDerWaalsContact C-N 3.31Å; R220-I222 PolarHBondContact O-N 3.39Å; R220-E223 PolarHBondContact O-N 2.82Å; R220-E224 WeakPolarHBondContact O-CG 3.26Å; R220-E224 PolarHBondContact O-N 3.42Å
221	L	91.4	Very high	88.4	Confident	103 Å²	103	102 Å²	102	54%	0.539	50%	0.499	S	S	.	.	H	α-helix	trans	-61.1	-41.1	175.8	-72.4	174.2	0	0	0	111.8	L217 D218 R219 E224 I225	L217-L221 WeakPolarHBondContact O-CG 3.24Å; L217-L221 PolarHBondContact O-N 3.43Å; D218-L221 PolarHBondContact O-N 3.03Å; R219-L221 VanDerWaalsContact C-N 3.33Å; R219-L221 PolarHBondContact O-N 3.5Å; L221-E224 PolarHBondContact O-N 2.99Å; L221-I225 WeakPolarHBondContact O-CB 3.44Å; L221-I225 WeakPolarHBondContact O-CD1 3.38Å; L221-I225 WeakPolarHBondContact O-CG1 3.3Å; L221-I225 PolarHBondContact O-N 3.03Å
222	I	93.6	Very high	89	Confident	113 Å²	113	103.6 Å²	103.6	58%	0.579	50%	0.504	S	S	*	.	H	α-helix	trans	-64.6	-41.5	176	-69.1	165.2	0	0	0	111.3	D218 R219 R220 I225 Y226	D218-I222 VanDerWaalsContact O-CG1 3.26Å; D218-I222 WeakPolarHBondContact O-CG1 3.32Å; D218-I222 PolarHBondContact O-N 3.39Å; R219-I222 PolarHBondContact O-N 2.87Å; R220-I222 VanDerWaalsContact C-N 3.31Å; R220-I222 PolarHBondContact O-N 3.39Å; I222-I225 PolarHBondContact O-N 3.14Å; I222-Y226 PolarHBondContact O-N 2.75Å
223	E	92.4	Very high	89.8	Confident	114 Å²	114	105.7 Å²	105.7	53%	0.533	51%	0.51	S	S	.	.	H	α-helix	trans	-61.3	-47.6	175.7	-72.9	168.8	-177.6	0	0	111.5	R219 R220 I225 Y226 H227	R219-E223 WeakPolarHBondContact O-CG 3.49Å; R219-E223 PolarHBondContact O-N 2.96Å; R220-E223 PolarHBondContact O-N 2.82Å; E223-I225 PolarHBondContact O-N 2.84Å; E223-Y226 WeakPolarHBondContact O-CB 3.4Å; E223-Y226 PolarHBondContact O-N 3.34Å; E223-Y226 VanDerWaalsContact O-N 3.13Å; E223-H227 PolarHBondContact O-CD2 3.27Å; E223-H227 VanDerWaalsContact O-CD2 3.31Å; E223-H227 PolarHBondContact O-N 3.01Å
224	E	93.9	Very high	90.7	Very high	112 Å²	112	109.2 Å²	109.2	52%	0.523	52%	0.517	S	S	.	.	H	α-helix	trans	-62.5	-41.6	176.2	-70	-59	152.7	0	0	112	R220 L221 Y226 H227 I228	R220-E224 WeakPolarHBondContact O-CG 3.26Å; R220-E224 PolarHBondContact O-N 3.42Å; L221-E224 PolarHBondContact O-N 2.99Å; E224-Y226 VanDerWaalsContact C-N 3.27Å; E224-Y226 PolarHBondContact O-N 3.04Å; E224-H227 PolarHBondContact O-N 3.33Å; E224-I228 WeakPolarHBondContact O-CB 3.33Å; E224-I228 VanDerWaalsContact O-CG1 3.26Å; E224-I228 WeakPolarHBondContact O-CG1 3.28Å; E224-I228 PolarHBondContact O-N 2.8Å
225	I	94.4	Very high	91.5	Very high	110 Å²	110	108.5 Å²	108.5	56%	0.564	52%	0.517	S	S	*	.	H	α-helix	trans	-61.1	-39.2	174.4	-71.8	165.2	0	0	0	110.8	L221 I222 E223 I228 K229	L221-I225 WeakPolarHBondContact O-CB 3.44Å; L221-I225 WeakPolarHBondContact O-CD1 3.38Å; L221-I225 WeakPolarHBondContact O-CG1 3.3Å; L221-I225 PolarHBondContact O-N 3.03Å; I222-I225 PolarHBondContact O-N 3.14Å; E223-I225 PolarHBondContact O-N 2.84Å; I225-I228 PolarHBondContact O-N 3.38Å; I225-K229 VanDerWaalsContact O-CB 3.31Å; I225-K229 WeakPolarHBondContact O-CB 3.17Å; I225-K229 PolarHBondContact O-N 3.45Å
226	Y	92.8	Very high	92	Very high	165 Å²	165	107.1 Å²	107.1	65%	0.647	52%	0.518	S	S	*	.	H	α-helix	trans	-67.6	-42	177	-165.2	-90.7	0	0	0	111.5	I222 E223 E224 K229 A230	I222-Y226 PolarHBondContact O-N 2.75Å; E223-Y226 WeakPolarHBondContact O-CB 3.4Å; E223-Y226 PolarHBondContact O-N 3.34Å; E223-Y226 VanDerWaalsContact O-N 3.13Å; E224-Y226 VanDerWaalsContact C-N 3.27Å; E224-Y226 PolarHBondContact O-N 3.04Å; Y226-K229 PolarHBondContact O-N 2.77Å; Y226-A230 WeakPolarHBondContact O-CB 3.28Å; Y226-A230 PolarHBondContact O-N 2.88Å
227	H	94.2	Very high	92.8	Very high	116 Å²	116	110.5 Å²	110.5	54%	0.537	53%	0.527	S	S	.	.	H	α-helix	trans	-60.1	-47.2	173.1	-80	-56.9	0	0	0	112	E223 E224 K229 A230 T231	E223-H227 PolarHBondContact O-CD2 3.27Å; E223-H227 VanDerWaalsContact O-CD2 3.31Å; E223-H227 PolarHBondContact O-N 3.01Å; E224-H227 PolarHBondContact O-N 3.33Å; H227-K229 VanDerWaalsContact C-N 3.31Å; H227-K229 PolarHBondContact O-N 3.11Å; H227-A230 PolarHBondContact O-N 3.46Å; H227-T231 WeakPolarHBondContact O-CG2 3.42Å; H227-T231 PolarHBondContact O-N 2.99Å; H227-T231 PolarHBondContact O-OG1 3.46Å
228	I	94.5	Very high	93.2	Very high	92 Å²	92	110.1 Å²	110.1	47%	0.472	52%	0.522	S	S	.	.	H	α-helix	trans	-60.6	-41.7	175.9	-68.5	165.3	0	0	0	110.9	E224 I225 A230 T231 I232	E224-I228 WeakPolarHBondContact O-CB 3.33Å; E224-I228 VanDerWaalsContact O-CG1 3.26Å; E224-I228 WeakPolarHBondContact O-CG1 3.28Å; E224-I228 PolarHBondContact O-N 2.8Å; I225-I228 PolarHBondContact O-N 3.38Å; I228-A230 VanDerWaalsContact C-N 3.34Å; I228-A230 PolarHBondContact O-N 3.49Å; I228-T231 WeakPolarHBondContact CA-OG1 3.36Å; I228-T231 PolarHBondContact O-N 2.7Å; I228-T231 PolarHBondContact O-OG1 2.62Å; I228-I232 HydrophobicContact CG2-CD1 3.69Å; I228-I232 HydrophobicContact CG2-CG1 4.36Å; I228-I232 WeakPolarHBondContact O-CB 3.39Å; I228-I232 WeakPolarHBondContact O-CG1 3.4Å; I228-I232 PolarHBondContact O-N 3.01Å
229	K	96.4	Very high	93.7	Very high	118 Å²	118	109.4 Å²	109.4	51%	0.513	52%	0.518	S	S	.	.	H	α-helix	trans	-63.5	-41.2	176.8	-176.2	-180	177.3	-176.5	0	111.6	I225 Y226 H227 I232 Q233	I225-K229 VanDerWaalsContact O-CB 3.31Å; I225-K229 WeakPolarHBondContact O-CB 3.17Å; I225-K229 PolarHBondContact O-N 3.45Å; Y226-K229 PolarHBondContact O-N 2.77Å; H227-K229 VanDerWaalsContact C-N 3.31Å; H227-K229 PolarHBondContact O-N 3.11Å; K229-I232 PolarHBondContact O-N 2.86Å; K229-Q233 WeakPolarHBondContact O-CG 3.27Å; K229-Q233 PolarHBondContact O-N 2.9Å
230	A	93.3	Very high	94	Very high	31 Å²	31	103.4 Å²	103.4	26%	0.256	51%	0.506	S	S	.	.	H	α-helix	trans	-64.4	-45.6	177.6	0	0	0	0	0	111.5	Y226 H227 I228 I232 Q233 E234	Y226-A230 WeakPolarHBondContact O-CB 3.28Å; Y226-A230 PolarHBondContact O-N 2.88Å; H227-A230 PolarHBondContact O-N 3.46Å; I228-A230 VanDerWaalsContact C-N 3.34Å; I228-A230 PolarHBondContact O-N 3.49Å; A230-I232 PolarHBondContact O-N 2.87Å; A230-Q233 WeakPolarHBondContact O-CB 3.38Å; A230-Q233 PolarHBondContact O-N 3.07Å; A230-Q233 VanDerWaalsContact O-N 3.13Å; A230-E234 PolarHBondContact O-N 3.07Å
231	T	94.4	Very high	94.2	Very high	67 Å²	67	100.3 Å²	100.3	41%	0.411	50%	0.497	S	S	.	.	H	α-helix	trans	-65.2	-38.9	177.2	57.4	0	0	0	0	112.1	H227 I228 Q233 E234 I235	H227-T231 WeakPolarHBondContact O-CG2 3.42Å; H227-T231 PolarHBondContact O-N 2.99Å; H227-T231 PolarHBondContact O-OG1 3.46Å; I228-T231 WeakPolarHBondContact CA-OG1 3.36Å; I228-T231 PolarHBondContact O-N 2.7Å; I228-T231 PolarHBondContact O-OG1 2.62Å; T231-Q233 VanDerWaalsContact C-N 3.29Å; T231-Q233 PolarHBondContact O-N 3.27Å; T231-E234 PolarHBondContact O-N 3.49Å; T231-I235 VanDerWaalsContact O-CG1 3.25Å; T231-I235 WeakPolarHBondContact O-CG1 3.24Å; T231-I235 PolarHBondContact O-N 3.22Å
232	I	95	Very high	94.3	Very high	87 Å²	87	100 Å²	100	45%	0.446	50%	0.499	S	S	.	.	H	α-helix	trans	-61.5	-38.5	173	-71.5	169.1	0	0	0	111.2	I228 K229 A230 N236	I228-I232 HydrophobicContact CG2-CD1 3.69Å; I228-I232 HydrophobicContact CG2-CG1 4.36Å; I228-I232 WeakPolarHBondContact O-CB 3.39Å; I228-I232 WeakPolarHBondContact O-CG1 3.4Å; I228-I232 PolarHBondContact O-N 3.01Å; K229-I232 PolarHBondContact O-N 2.86Å; A230-I232 PolarHBondContact O-N 2.87Å; I232-N236 WeakPolarHBondContact CG2-ND2 3.32Å; I232-N236 WeakPolarHBondContact O-CB 3.33Å; I232-N236 VanDerWaalsContact O-CG 3.29Å; I232-N236 PolarHBondContact O-N 3.32Å; I232-N236 PolarHBondContact O-ND2 3.01Å
233	Q	94.8	Very high	94.4	Very high	109 Å²	109	102.8 Å²	102.8	51%	0.509	50%	0.502	S	S	.	.	H	α-helix	trans	-65.9	-43.9	176	-75.5	177	-20.3	0	0	111.8	K229 A230 T231 N236 M237	K229-Q233 WeakPolarHBondContact O-CG 3.27Å; K229-Q233 PolarHBondContact O-N 2.9Å; A230-Q233 WeakPolarHBondContact O-CB 3.38Å; A230-Q233 PolarHBondContact O-N 3.07Å; A230-Q233 VanDerWaalsContact O-N 3.13Å; T231-Q233 VanDerWaalsContact C-N 3.29Å; T231-Q233 PolarHBondContact O-N 3.27Å; Q233-N236 PolarHBondContact O-N 2.95Å; Q233-M237 WeakPolarHBondContact O-CG 3.49Å; Q233-M237 PolarHBondContact O-N 3.45Å
234	E	94.9	Very high	94.5	Very high	126 Å²	126	103 Å²	103	59%	0.589	51%	0.507	S	S	*	.	H	α-helix	trans	-59.8	-47.6	174.7	-72.4	175.5	179.3	0	0	111.6	A230 T231 N236 M237 E238	A230-E234 PolarHBondContact O-N 3.07Å; T231-E234 PolarHBondContact O-N 3.49Å; E234-N236 VanDerWaalsContact C-N 3.31Å; E234-N236 PolarHBondContact O-N 3.39Å; E234-M237 WeakPolarHBondContact O-CB 3.49Å; E234-M237 PolarHBondContact O-N 3.18Å; E234-M237 VanDerWaalsContact O-N 3.12Å; E234-E238 PolarHBondContact O-N 3.42Å
235	I	95.4	Very high	94.5	Very high	106 Å²	106	103.4 Å²	103.4	54%	0.544	51%	0.509	S	S	.	.	H	α-helix	trans	-59.5	-42.7	177	-68.1	165.3	0	0	0	111	T231 M237 E238 L239	T231-I235 VanDerWaalsContact O-CG1 3.25Å; T231-I235 WeakPolarHBondContact O-CG1 3.24Å; T231-I235 PolarHBondContact O-N 3.22Å; I235-M237 VanDerWaalsContact C-N 3.32Å; I235-M237 PolarHBondContact O-N 3.01Å; I235-E238 PolarHBondContact O-N 3.31Å; I235-L239 VanDerWaalsContact O-CB 3.31Å; I235-L239 WeakPolarHBondContact O-CB 3.29Å; I235-L239 PolarHBondContact O-N 3.29Å
236	N	94.8	Very high	94.3	Very high	91 Å²	91	103 Å²	103	49%	0.487	51%	0.508	S	S	.	.	H	α-helix	trans	-65.4	-35.5	177.7	-78.1	-44.8	0	0	0	112.5	I232 Q233 E234 L239 A240	I232-N236 WeakPolarHBondContact CG2-ND2 3.32Å; I232-N236 WeakPolarHBondContact O-CB 3.33Å; I232-N236 VanDerWaalsContact O-CG 3.29Å; I232-N236 PolarHBondContact O-N 3.32Å; I232-N236 PolarHBondContact O-ND2 3.01Å; Q233-N236 PolarHBondContact O-N 2.95Å; E234-N236 VanDerWaalsContact C-N 3.31Å; E234-N236 PolarHBondContact O-N 3.39Å; N236-L239 PolarHBondContact O-N 3.48Å; N236-A240 PolarHBondContact O-N 3.26Å
237	M	94.6	Very high	94.4	Very high	120 Å²	120	98 Å²	98	59%	0.591	50%	0.501	S	S	*	.	H	α-helix	trans	-66.7	-43.7	173.9	-72.3	177.6	64.5	0	0	111.5	Q233 E234 I235 L239 A240 K241	Q233-M237 WeakPolarHBondContact O-CG 3.49Å; Q233-M237 PolarHBondContact O-N 3.45Å; E234-M237 WeakPolarHBondContact O-CB 3.49Å; E234-M237 PolarHBondContact O-N 3.18Å; E234-M237 VanDerWaalsContact O-N 3.12Å; I235-M237 VanDerWaalsContact C-N 3.32Å; I235-M237 PolarHBondContact O-N 3.01Å; M237-L239 VanDerWaalsContact C-N 3.34Å; M237-A240 PolarHBondContact O-N 3.46Å; M237-K241 WeakPolarHBondContact O-CG 3.31Å; M237-K241 PolarHBondContact O-N 3.44Å
238	E	94.5	Very high	94.4	Very high	98 Å²	98	97.6 Å²	97.6	46%	0.458	50%	0.497	S	S	.	.	H	α-helix	trans	-64.2	-39.3	175	-67.8	-52.5	131.7	0	0	111.6	E234 I235 A240 K241 V242	E234-E238 PolarHBondContact O-N 3.42Å; I235-E238 PolarHBondContact O-N 3.31Å; E238-A240 VanDerWaalsContact C-N 3.34Å; E238-A240 PolarHBondContact O-N 3.13Å; E238-K241 PolarHBondContact O-N 2.92Å; E238-K241 IonicContact OE1-NZ 3.7Å; E238-K241 PolarHBondContact OE1-NZ 2.97Å; E238-K241 IonicContact OE2-NZ 3.88Å; E238-V242 WeakPolarHBondContact O-CG2 3.49Å; E238-V242 PolarHBondContact O-N 2.98Å
239	L	94.8	Very high	94.4	Very high	69 Å²	69	95.8 Å²	95.8	36%	0.361	49%	0.491	S	S	.	.	H	α-helix	trans	-62.9	-40.3	175.2	-161.2	162	0	0	0	111.4	I235 N236 M237 V242 R243	I235-L239 VanDerWaalsContact O-CB 3.31Å; I235-L239 WeakPolarHBondContact O-CB 3.29Å; I235-L239 PolarHBondContact O-N 3.29Å; N236-L239 PolarHBondContact O-N 3.48Å; M237-L239 VanDerWaalsContact C-N 3.34Å; L239-V242 PolarHBondContact O-N 2.95Å; L239-R243 HydrophobicContact CD2-CG 3.99Å; L239-R243 VanDerWaalsContact CD2-CZ 3.43Å; L239-R243 WeakPolarHBondContact O-CG 3.31Å; L239-R243 PolarHBondContact O-N 3.36Å
240	A	93.7	Very high	94.2	Very high	47 Å²	47	93.1 Å²	93.1	39%	0.388	49%	0.487	S	S	.	.	H	α-helix	trans	-61.1	-45.6	173.9	0	0	0	0	0	111.7	N236 M237 E238 V242 R243 D244	N236-A240 PolarHBondContact O-N 3.26Å; M237-A240 PolarHBondContact O-N 3.46Å; E238-A240 VanDerWaalsContact C-N 3.34Å; E238-A240 PolarHBondContact O-N 3.13Å; A240-V242 VanDerWaalsContact C-N 3.33Å; A240-V242 PolarHBondContact O-N 3.39Å; A240-R243 PolarHBondContact O-N 2.67Å; A240-D244 PolarHBondContact O-N 3.11Å
241	K	94.4	Very high	94.3	Very high	113 Å²	113	96.6 Å²	96.6	49%	0.491	50%	0.501	S	S	.	.	H	α-helix	trans	-60.7	-41.3	175.4	-67.2	173.2	-172.6	169	0	112.4	M237 E238 D244 H245	M237-K241 WeakPolarHBondContact O-CG 3.31Å; M237-K241 PolarHBondContact O-N 3.44Å; E238-K241 PolarHBondContact O-N 2.92Å; E238-K241 IonicContact OE1-NZ 3.7Å; E238-K241 PolarHBondContact OE1-NZ 2.97Å; E238-K241 IonicContact OE2-NZ 3.88Å; K241-D244 PolarHBondContact O-N 3.47Å; K241-H245 WeakPolarHBondContact O-CB 3.39Å; K241-H245 PolarHBondContact O-N 3.19Å
242	V	94.4	Very high	94.2	Very high	96 Å²	96	99.2 Å²	99.2	58%	0.582	51%	0.507	S	S	*	.	H	α-helix	trans	-64.1	-41.7	176.8	171.1	0	0	0	0	110.8	E238 L239 A240 H245 D246	E238-V242 WeakPolarHBondContact O-CG2 3.49Å; E238-V242 PolarHBondContact O-N 2.98Å; L239-V242 PolarHBondContact O-N 2.95Å; A240-V242 VanDerWaalsContact C-N 3.33Å; A240-V242 PolarHBondContact O-N 3.39Å; V242-H245 PolarHBondContact O-N 2.89Å; V242-D246 WeakPolarHBondContact O-CB 3.36Å; V242-D246 PolarHBondContact O-N 3.04Å
243	R	94.3	Very high	94	Very high	172 Å²	172	99.1 Å²	99.1	65%	0.649	51%	0.51	S	S	*	.	H	α-helix	trans	-63	-42.4	175.4	-76.8	179.1	175.4	170.4	4.1	112.7	L239 A240 H245 D246 A247	L239-R243 HydrophobicContact CD2-CG 3.99Å; L239-R243 VanDerWaalsContact CD2-CZ 3.43Å; L239-R243 WeakPolarHBondContact O-CG 3.31Å; L239-R243 PolarHBondContact O-N 3.36Å; A240-R243 PolarHBondContact O-N 2.67Å; R243-H245 VanDerWaalsContact C-N 3.32Å; R243-D246 PolarHBondContact O-N 2.9Å; R243-A247 PolarHBondContact O-N 2.92Å
244	D	94.1	Very high	93.9	Very high	119 Å²	119	99 Å²	99	64%	0.636	51%	0.509	S	S	*	.	H	α-helix	trans	-64.8	-40.3	176.9	-69.3	-16.9	0	0	0	111.1	A240 K241 A247 F248	A240-D244 PolarHBondContact O-N 3.11Å; K241-D244 PolarHBondContact O-N 3.47Å; D244-A247 PolarHBondContact O-N 3.23Å; D244-F248 WeakPolarHBondContact O-CB 3.47Å; D244-F248 PolarHBondContact O-N 3.42Å
245	H	93.9	Very high	93.8	Very high	120 Å²	120	97.7 Å²	97.7	56%	0.556	50%	0.503	S	S	*	.	H	α-helix	trans	-64.4	-42.7	174.2	-172.6	67.2	0	0	0	112.1	K241 V242 R243 F248 V249	K241-H245 WeakPolarHBondContact O-CB 3.39Å; K241-H245 PolarHBondContact O-N 3.19Å; V242-H245 PolarHBondContact O-N 2.89Å; R243-H245 VanDerWaalsContact C-N 3.32Å; H245-F248 WeakPolarHBondContact O-CB 3.5Å; H245-F248 PolarHBondContact O-N 3.47Å; H245-V249 WeakPolarHBondContact O-CB 3.38Å; H245-V249 VanDerWaalsContact O-CG2 3.3Å; H245-V249 WeakPolarHBondContact O-CG2 3.26Å; H245-V249 PolarHBondContact O-N 3.02Å
246	D	91.3	Very high	93.5	Very high	102 Å²	102	94.7 Å²	94.7	55%	0.545	50%	0.495	S	S	.	.	H	α-helix	trans	-63.7	-40.1	178	-170.1	44.3	0	0	0	112	V242 R243 V249 S250	V242-D246 WeakPolarHBondContact O-CB 3.36Å; V242-D246 PolarHBondContact O-N 3.04Å; R243-D246 PolarHBondContact O-N 2.9Å; D246-V249 PolarHBondContact O-N 3.44Å; D246-S250 VanDerWaalsContact O-CB 3.28Å; D246-S250 WeakPolarHBondContact O-CB 3.44Å; D246-S250 PolarHBondContact O-N 2.95Å; D246-S250 PolarHBondContact O-OG 3.4Å
247	A	94.4	Very high	93.3	Very high	60 Å²	60	96.8 Å²	96.8	50%	0.496	50%	0.501	S	S	.	.	H	α-helix	trans	-62.6	-43.4	172.8	0	0	0	0	0	111.9	R243 D244 S250 D251	R243-A247 PolarHBondContact O-N 2.92Å; D244-A247 PolarHBondContact O-N 3.23Å; A247-S250 PolarHBondContact O-N 3.03Å; A247-D251 PolarHBondContact O-N 3.09Å
248	F	94.8	Very high	93.3	Very high	106 Å²	106	95.3 Å²	95.3	47%	0.465	49%	0.493	S	S	.	.	H	α-helix	trans	-65.9	-41.2	176.4	174.1	-102.6	0	0	0	113	D244 H245 S250 D251 K252	D244-F248 WeakPolarHBondContact O-CB 3.47Å; D244-F248 PolarHBondContact O-N 3.42Å; H245-F248 WeakPolarHBondContact O-CB 3.5Å; H245-F248 PolarHBondContact O-N 3.47Å; F248-S250 VanDerWaalsContact C-N 3.34Å; F248-D251 PolarHBondContact O-N 3.41Å; F248-K252 HydrophobicContact CD1-CD 4.31Å; F248-K252 HydrophobicContact CE1-CD 3.73Å; F248-K252 VanDerWaalsContact CE1-CE 3.46Å; F248-K252 HydrophobicContact CZ-CD 3.89Å; F248-K252 VanDerWaalsContact CZ-NZ 3.28Å; F248-K252 PolarHBondContact O-N 3.02Å; F248-K252 VanDerWaalsContact O-N 3.09Å
249	V	93.4	Very high	93.2	Very high	55 Å²	55	95.9 Å²	95.9	33%	0.333	50%	0.496	S	S	.	.	H	α-helix	trans	-65.1	-42.2	175.2	170.6	0	0	0	0	110	H245 D246 D251 K252 V253	H245-V249 WeakPolarHBondContact O-CB 3.38Å; H245-V249 VanDerWaalsContact O-CG2 3.3Å; H245-V249 WeakPolarHBondContact O-CG2 3.26Å; H245-V249 PolarHBondContact O-N 3.02Å; D246-V249 PolarHBondContact O-N 3.44Å; V249-D251 PolarHBondContact O-N 3.36Å; V249-K252 WeakPolarHBondContact O-CB 3.44Å; V249-K252 PolarHBondContact O-N 2.93Å; V249-V253 HydrophobicContact CG1-CG2 4.2Å; V249-V253 WeakPolarHBondContact O-CB 3.23Å; V249-V253 VanDerWaalsContact O-CG2 3.27Å; V249-V253 WeakPolarHBondContact O-CG2 3.39Å; V249-V253 PolarHBondContact O-N 3.39Å
250	S	93.4	Very high	92.9	Very high	62 Å²	62	98.5 Å²	98.5	43%	0.434	51%	0.509	S	S	.	.	H	α-helix	trans	-60	-43.6	176.8	-64.5	0	0	0	0	112.3	D246 A247 F248 V253 Q254	D246-S250 VanDerWaalsContact O-CB 3.28Å; D246-S250 WeakPolarHBondContact O-CB 3.44Å; D246-S250 PolarHBondContact O-N 2.95Å; D246-S250 PolarHBondContact O-OG 3.4Å; A247-S250 PolarHBondContact O-N 3.03Å; F248-S250 VanDerWaalsContact C-N 3.34Å; S250-V253 PolarHBondContact O-N 2.83Å; S250-Q254 PolarHBondContact O-N 3.31Å
251	D	94.5	Very high	92.8	Very high	104 Å²	104	99.1 Å²	99.1	56%	0.556	51%	0.514	S	S	*	.	H	α-helix	trans	-62.1	-43.7	175.5	-173.5	61.8	0	0	0	111.7	A247 F248 V249 V253 Q254 H255	A247-D251 PolarHBondContact O-N 3.09Å; F248-D251 PolarHBondContact O-N 3.41Å; V249-D251 PolarHBondContact O-N 3.36Å; D251-V253 PolarHBondContact O-N 2.97Å; D251-Q254 PolarHBondContact O-N 3.04Å; D251-H255 WeakPolarHBondContact O-CB 3.38Å; D251-H255 PolarHBondContact O-N 2.76Å
252	K	92	Very high	92.7	Very high	122 Å²	122	100 Å²	100	53%	0.53	52%	0.518	S	S	.	.	H	α-helix	trans	-62.5	-40.9	173.9	-79.4	-173.9	164.4	-179.3	0	113.2	F248 V249 H255 A256	F248-K252 HydrophobicContact CD1-CD 4.31Å; F248-K252 HydrophobicContact CE1-CD 3.73Å; F248-K252 VanDerWaalsContact CE1-CE 3.46Å; F248-K252 HydrophobicContact CZ-CD 3.89Å; F248-K252 VanDerWaalsContact CZ-NZ 3.28Å; F248-K252 PolarHBondContact O-N 3.02Å; F248-K252 VanDerWaalsContact O-N 3.09Å; V249-K252 WeakPolarHBondContact O-CB 3.44Å; V249-K252 PolarHBondContact O-N 2.93Å; K252-H255 PolarHBondContact O-N 2.98Å; K252-A256 WeakPolarHBondContact O-CB 3.41Å; K252-A256 PolarHBondContact O-N 2.75Å
253	V	91.8	Very high	92.4	Very high	85 Å²	85	98.5 Å²	98.5	52%	0.515	51%	0.512	S	S	.	.	H	α-helix	trans	-64.2	-44	177.1	168.1	0	0	0	0	110	V249 S250 D251 A256 Q257	V249-V253 HydrophobicContact CG1-CG2 4.2Å; V249-V253 WeakPolarHBondContact O-CB 3.23Å; V249-V253 VanDerWaalsContact O-CG2 3.27Å; V249-V253 WeakPolarHBondContact O-CG2 3.39Å; V249-V253 PolarHBondContact O-N 3.39Å; S250-V253 PolarHBondContact O-N 2.83Å; D251-V253 PolarHBondContact O-N 2.97Å; V253-A256 PolarHBondContact O-N 3.48Å; V253-Q257 WeakPolarHBondContact O-CB 3.32Å; V253-Q257 PolarHBondContact O-N 3Å
254	Q	92.7	Very high	92	Very high	105 Å²	105	97.4 Å²	97.4	49%	0.491	51%	0.509	S	S	.	.	H	α-helix	trans	-62.3	-45.9	176	-176.2	-179.9	-21.5	0	0	111.2	S250 D251 A256 Q257 E258	S250-Q254 PolarHBondContact O-N 3.31Å; D251-Q254 PolarHBondContact O-N 3.04Å; Q254-A256 PolarHBondContact O-N 3.13Å; Q254-Q257 WeakPolarHBondContact O-CB 3.33Å; Q254-Q257 PolarHBondContact O-N 2.93Å; Q254-Q257 VanDerWaalsContact O-N 3.14Å; Q254-E258 PolarHBondContact NE2-OE1 3.38Å; Q254-E258 WeakPolarHBondContact O-CG 3.23Å; Q254-E258 PolarHBondContact O-N 2.61Å
255	H	93.6	Very high	91.7	Very high	99 Å²	99	99 Å²	99	46%	0.458	51%	0.511	S	S	.	.	H	α-helix	trans	-60.9	-45.4	178.1	-169.8	48.9	0	0	0	111.8	D251 K252 Q257 E258 E259	D251-H255 WeakPolarHBondContact O-CB 3.38Å; D251-H255 PolarHBondContact O-N 2.76Å; K252-H255 PolarHBondContact O-N 2.98Å; H255-Q257 VanDerWaalsContact C-N 3.3Å; H255-Q257 PolarHBondContact O-N 2.88Å; H255-E258 PolarHBondContact O-N 3.07Å; H255-E259 IonicContact CE1-OE1 2.68Å; H255-E259 IonicContact NE2-OE1 2.73Å; H255-E259 PolarHBondContact NE2-OE1 3.38Å; H255-E259 WeakPolarHBondContact O-CG 3.3Å; H255-E259 PolarHBondContact O-N 2.95Å
256	A	89.1	Confident	91.3	Very high	44 Å²	44	98.3 Å²	98.3	36%	0.364	51%	0.511	S	S	.	.	H	α-helix	trans	-61	-39	174.5	0	0	0	0	0	111.8	K252 V253 Q254 E259 L260	K252-A256 WeakPolarHBondContact O-CB 3.41Å; K252-A256 PolarHBondContact O-N 2.75Å; V253-A256 PolarHBondContact O-N 3.48Å; Q254-A256 PolarHBondContact O-N 3.13Å; A256-E259 PolarHBondContact O-N 3.38Å; A256-L260 WeakPolarHBondContact O-CB 3.23Å; A256-L260 VanDerWaalsContact O-CG 3.23Å; A256-L260 WeakPolarHBondContact O-CG 3.48Å; A256-L260 PolarHBondContact O-N 3.46Å
257	Q	90.2	Very high	90.8	Very high	135 Å²	135	97 Å²	97	63%	0.631	51%	0.506	S	S	*	.	H	α-helix	trans	-65.7	-39.4	176.2	-172.5	177.9	-3	0	0	112.1	V253 Q254 H255 L260 A261	V253-Q257 WeakPolarHBondContact O-CB 3.32Å; V253-Q257 PolarHBondContact O-N 3Å; Q254-Q257 WeakPolarHBondContact O-CB 3.33Å; Q254-Q257 PolarHBondContact O-N 2.93Å; Q254-Q257 VanDerWaalsContact O-N 3.14Å; H255-Q257 VanDerWaalsContact C-N 3.3Å; H255-Q257 PolarHBondContact O-N 2.88Å; Q257-L260 PolarHBondContact O-N 3.44Å; Q257-A261 WeakPolarHBondContact O-CB 3.47Å; Q257-A261 PolarHBondContact O-N 3.04Å
258	E	93.4	Very high	90.2	Very high	88 Å²	88	97.8 Å²	97.8	41%	0.411	50%	0.502	S	S	.	.	H	α-helix	trans	-67.2	-40.5	175.3	-72.3	175.7	-168.3	0	0	112.2	Q254 H255 A261 K262	Q254-E258 PolarHBondContact NE2-OE1 3.38Å; Q254-E258 WeakPolarHBondContact O-CG 3.23Å; Q254-E258 PolarHBondContact O-N 2.61Å; H255-E258 PolarHBondContact O-N 3.07Å; E258-A261 PolarHBondContact O-N 3.24Å; E258-K262 WeakPolarHBondContact O-CG 3.27Å; E258-K262 PolarHBondContact O-N 2.89Å
259	E	92	Very high	89.7	Confident	110 Å²	110	96.1 Å²	96.1	51%	0.514	50%	0.504	S	S	.	.	H	α-helix	trans	-63.9	-44.3	173.2	-73.1	-172	155.9	0	0	111.6	H255 A256 A261 K262 S263	H255-E259 IonicContact CE1-OE1 2.68Å; H255-E259 IonicContact NE2-OE1 2.73Å; H255-E259 PolarHBondContact NE2-OE1 3.38Å; H255-E259 WeakPolarHBondContact O-CG 3.3Å; H255-E259 PolarHBondContact O-N 2.95Å; A256-E259 PolarHBondContact O-N 3.38Å; E259-A261 VanDerWaalsContact C-N 3.32Å; E259-A261 PolarHBondContact O-N 3.48Å; E259-K262 PolarHBondContact O-N 2.73Å; E259-S263 WeakPolarHBondContact O-CB 3.45Å; E259-S263 PolarHBondContact O-N 3.2Å
260	L	89.8	Confident	89.2	Confident	124 Å²	124	97.4 Å²	97.4	65%	0.649	51%	0.514	S	S	*	.	H	α-helix	trans	-60.9	-40.8	173.8	-75.9	171.1	0	0	0	111.5	A256 Q257 K262 S263 Y264	A256-L260 WeakPolarHBondContact O-CB 3.23Å; A256-L260 VanDerWaalsContact O-CG 3.23Å; A256-L260 WeakPolarHBondContact O-CG 3.48Å; A256-L260 PolarHBondContact O-N 3.46Å; Q257-L260 PolarHBondContact O-N 3.44Å; L260-K262 PolarHBondContact O-N 3.29Å; L260-S263 PolarHBondContact O-N 2.87Å; L260-Y264 WeakPolarHBondContact O-CB 3.44Å; L260-Y264 PolarHBondContact O-N 3.35Å
261	A	91.8	Very high	88.9	Confident	60 Å²	60	97.6 Å²	97.6	50%	0.496	52%	0.516	S	S	.	.	H	α-helix	trans	-65.3	-38	177.3	0	0	0	0	0	112.5	Q257 E258 E259 K265	Q257-A261 WeakPolarHBondContact O-CB 3.47Å; Q257-A261 PolarHBondContact O-N 3.04Å; E258-A261 PolarHBondContact O-N 3.24Å; E259-A261 VanDerWaalsContact C-N 3.32Å; E259-A261 PolarHBondContact O-N 3.48Å; A261-K265 PolarHBondContact O-N 3.32Å; A261-K265 VanDerWaalsContact O-N 3.08Å
262	K	91.5	Very high	88.5	Confident	132 Å²	132	97.5 Å²	97.5	57%	0.574	52%	0.515	S	S	*	.	H	α-helix	trans	-65.8	-51.8	173.7	-72.7	171	-174	167.5	0	111.1	E258 E259 L260 Y264 K265 D266	E258-K262 WeakPolarHBondContact O-CG 3.27Å; E258-K262 PolarHBondContact O-N 2.89Å; E259-K262 PolarHBondContact O-N 2.73Å; L260-K262 PolarHBondContact O-N 3.29Å; K262-Y264 VanDerWaalsContact C-N 3.26Å; K262-Y264 PolarHBondContact O-N 2.79Å; K262-K265 WeakPolarHBondContact O-CB 3.4Å; K262-K265 PolarHBondContact O-N 2.99Å; K262-D266 PolarHBondContact O-N 3.31Å
263	S	87.8	Confident	88.4	Confident	65 Å²	65	95.5 Å²	95.5	46%	0.455	51%	0.513	S	S	.	.	H	α-helix	trans	-57.7	-40.9	176.6	-179.9	0	0	0	0	111.3	E259 L260 K265 D266 T267	E259-S263 WeakPolarHBondContact O-CB 3.45Å; E259-S263 PolarHBondContact O-N 3.2Å; L260-S263 PolarHBondContact O-N 2.87Å; S263-K265 PolarHBondContact O-N 2.9Å; S263-D266 PolarHBondContact O-N 2.89Å; S263-D266 VanDerWaalsContact O-N 3.16Å; S263-T267 WeakPolarHBondContact O-CG2 3.39Å; S263-T267 PolarHBondContact O-N 2.88Å; S263-T267 PolarHBondContact O-OG1 3.05Å
264	Y	86.8	Confident	88.2	Confident	148 Å²	148	96 Å²	96	58%	0.58	52%	0.516	S	S	*	.	H	α-helix	trans	-59.5	-45.1	175.4	-179.4	-106	0	0	0	112	L260 K262 D266 T267 L268	L260-Y264 WeakPolarHBondContact O-CB 3.44Å; L260-Y264 PolarHBondContact O-N 3.35Å; K262-Y264 VanDerWaalsContact C-N 3.26Å; K262-Y264 PolarHBondContact O-N 2.79Å; Y264-D266 VanDerWaalsContact C-N 3.31Å; Y264-D266 PolarHBondContact O-N 3.18Å; Y264-T267 WeakPolarHBondContact CA-OG1 3.49Å; Y264-T267 PolarHBondContact O-N 3.45Å; Y264-T267 PolarHBondContact O-OG1 2.89Å; Y264-L268 HydrophobicContact CD1-CD1 3.75Å; Y264-L268 HydrophobicContact CE1-CD1 3.29Å; Y264-L268 HydrophobicContact CE1-CG 4.16Å; Y264-L268 PolarHBondContact O-N 3.37Å
265	K	87.6	Confident	88	Confident	154 Å²	154	97.2 Å²	97.2	67%	0.67	52%	0.521	S	S	*	.	H	α-helix	trans	-62.1	-39.6	175.4	-168.7	-178.6	179.3	-175.6	0	112.2	A261 K262 S263 L268 S269	A261-K265 PolarHBondContact O-N 3.32Å; A261-K265 VanDerWaalsContact O-N 3.08Å; K262-K265 WeakPolarHBondContact O-CB 3.4Å; K262-K265 PolarHBondContact O-N 2.99Å; S263-K265 PolarHBondContact O-N 2.9Å; K265-L268 PolarHBondContact O-N 2.94Å; K265-S269 PolarHBondContact O-N 3.5Å; K265-S269 VanDerWaalsContact O-N 3.1Å
266	D	85.3	Confident	87.9	Confident	105 Å²	105	94.3 Å²	94.3	56%	0.561	52%	0.518	S	S	*	.	H	α-helix	trans	-67.2	-41.3	176.7	-63.8	-20.7	0	0	0	111	K262 S263 Y264 L268 S269 C270	K262-D266 PolarHBondContact O-N 3.31Å; S263-D266 PolarHBondContact O-N 2.89Å; S263-D266 VanDerWaalsContact O-N 3.16Å; Y264-D266 VanDerWaalsContact C-N 3.31Å; Y264-D266 PolarHBondContact O-N 3.18Å; D266-L268 PolarHBondContact O-N 3.25Å; D266-S269 WeakPolarHBondContact O-CB 3.39Å; D266-S269 PolarHBondContact O-N 2.9Å; D266-C270 PolarHBondContact O-N 2.9Å
267	T	81.8	Confident	87.8	Confident	73 Å²	73	99.1 Å²	99.1	45%	0.448	53%	0.528	S	S	.	.	H	α-helix	trans	-64.4	-36.9	175	60.3	0	0	0	0	112.8	S263 Y264 C270 S271	S263-T267 WeakPolarHBondContact O-CG2 3.39Å; S263-T267 PolarHBondContact O-N 2.88Å; S263-T267 PolarHBondContact O-OG1 3.05Å; Y264-T267 WeakPolarHBondContact CA-OG1 3.49Å; Y264-T267 PolarHBondContact O-N 3.45Å; Y264-T267 PolarHBondContact O-OG1 2.89Å; T267-C270 PolarHBondContact O-N 3.04Å; T267-S271 VanDerWaalsContact O-CB 3.29Å; T267-S271 WeakPolarHBondContact O-CB 3.33Å; T267-S271 PolarHBondContact O-N 3.4Å
268	L	80.4	Confident	87.9	Confident	77 Å²	77	98 Å²	98	40%	0.403	52%	0.522	S	S	.	.	H	α-helix	trans	-61.3	-45.7	172.5	-83.4	164.2	0	0	0	110.8	Y264 K265 D266 C270 S271 D272	Y264-L268 HydrophobicContact CD1-CD1 3.75Å; Y264-L268 HydrophobicContact CE1-CD1 3.29Å; Y264-L268 HydrophobicContact CE1-CG 4.16Å; Y264-L268 PolarHBondContact O-N 3.37Å; K265-L268 PolarHBondContact O-N 2.94Å; D266-L268 PolarHBondContact O-N 3.25Å; L268-C270 PolarHBondContact O-N 2.99Å; L268-S271 WeakPolarHBondContact O-CB 3.49Å; L268-S271 PolarHBondContact O-N 3.45Å; L268-D272 PolarHBondContact O-N 3.38Å
269	S	84.9	Confident	87.8	Confident	72 Å²	72	102.2 Å²	102.2	50%	0.503	54%	0.535	S	S	.	.	H	α-helix	trans	-63.4	-40.5	176.2	-172.7	0	0	0	0	112.4	K265 D266 S271 D272 V273	K265-S269 PolarHBondContact O-N 3.5Å; K265-S269 VanDerWaalsContact O-N 3.1Å; D266-S269 WeakPolarHBondContact O-CB 3.39Å; D266-S269 PolarHBondContact O-N 2.9Å; S269-S271 VanDerWaalsContact C-N 3.34Å; S269-D272 PolarHBondContact O-N 3.47Å; S269-V273 WeakPolarHBondContact O-CG2 3.48Å; S269-V273 PolarHBondContact O-N 2.91Å
270	C	83.2	Confident	87.8	Confident	81 Å²	81	101.8 Å²	101.8	55%	0.547	53%	0.534	S	S	.	.	H	α-helix	trans	-65.5	-38.6	174.2	-74.1	0	0	0	0	111.5	D266 T267 L268 V273 V274	D266-C270 PolarHBondContact O-N 2.9Å; T267-C270 PolarHBondContact O-N 3.04Å; L268-C270 PolarHBondContact O-N 2.99Å; C270-V273 PolarHBondContact O-N 3.33Å; C270-V274 WeakPolarHBondContact O-CB 3.33Å; C270-V274 VanDerWaalsContact O-CG2 3.27Å; C270-V274 WeakPolarHBondContact O-CG2 3.3Å; C270-V274 PolarHBondContact O-N 3.44Å
271	S	86.2	Confident	87.9	Confident	67 Å²	67	103.6 Å²	103.6	47%	0.469	53%	0.533	S	S	.	.	H	α-helix	trans	-61.2	-43.5	175.2	179.8	0	0	0	0	111.5	T267 L268 S269 V273 V274 Q275	T267-S271 VanDerWaalsContact O-CB 3.29Å; T267-S271 WeakPolarHBondContact O-CB 3.33Å; T267-S271 PolarHBondContact O-N 3.4Å; L268-S271 WeakPolarHBondContact O-CB 3.49Å; L268-S271 PolarHBondContact O-N 3.45Å; S269-S271 VanDerWaalsContact C-N 3.34Å; S271-V273 VanDerWaalsContact C-N 3.32Å; S271-V273 PolarHBondContact O-N 2.99Å; S271-V274 PolarHBondContact O-N 3.33Å; S271-Q275 VanDerWaalsContact O-CB 3.26Å; S271-Q275 WeakPolarHBondContact O-CB 3.41Å; S271-Q275 PolarHBondContact O-N 3.34Å
272	D	86.6	Confident	87.9	Confident	101 Å²	101	105.5 Å²	105.5	54%	0.54	53%	0.532	S	S	.	.	H	α-helix	trans	-62.4	-40.4	176.9	-70.4	-17.7	0	0	0	111.6	L268 S269 Q275 G276	L268-D272 PolarHBondContact O-N 3.38Å; S269-D272 PolarHBondContact O-N 3.47Å; D272-Q275 PolarHBondContact O-N 3.33Å; D272-G276 PolarHBondContact O-N 2.68Å
273	V	89.1	Confident	88	Confident	81 Å²	81	104 Å²	104	49%	0.491	53%	0.53	S	S	.	.	H	α-helix	trans	-66	-46.8	175.6	172.3	0	0	0	0	111.1	S269 C270 S271 Q275 G276 Y277	S269-V273 WeakPolarHBondContact O-CG2 3.48Å; S269-V273 PolarHBondContact O-N 2.91Å; C270-V273 PolarHBondContact O-N 3.33Å; S271-V273 VanDerWaalsContact C-N 3.32Å; S271-V273 PolarHBondContact O-N 2.99Å; V273-Q275 VanDerWaalsContact C-N 3.32Å; V273-Q275 PolarHBondContact O-N 2.88Å; V273-G276 WeakPolarHBondContact O-CA 3.38Å; V273-G276 PolarHBondContact O-N 3.05Å; V273-G276 VanDerWaalsContact O-N 3.14Å; V273-Y277 HydrophobicContact CG1-CD2 3.79Å; V273-Y277 HydrophobicContact CG1-CE2 3.54Å; V273-Y277 VanDerWaalsContact O-CD2 3.25Å; V273-Y277 WeakPolarHBondContact O-CD2 3.24Å; V273-Y277 PolarHBondContact O-N 3.16Å
274	V	87.9	Confident	88.1	Confident	96 Å²	96	105.9 Å²	105.9	58%	0.582	53%	0.531	S	S	*	.	H	α-helix	trans	-62.1	-40.2	176.7	170.7	0	0	0	0	111	C270 S271 G276 Y277 H278	C270-V274 WeakPolarHBondContact O-CB 3.33Å; C270-V274 VanDerWaalsContact O-CG2 3.27Å; C270-V274 WeakPolarHBondContact O-CG2 3.3Å; C270-V274 PolarHBondContact O-N 3.44Å; S271-V274 PolarHBondContact O-N 3.33Å; V274-G276 VanDerWaalsContact C-N 3.32Å; V274-G276 PolarHBondContact O-N 2.91Å; V274-Y277 PolarHBondContact O-N 3.48Å; V274-H278 WeakPolarHBondContact O-CB 3.37Å; V274-H278 PolarHBondContact O-N 2.68Å
275	Q	89.4	Confident	88.3	Confident	129 Å²	129	106.6 Å²	106.6	60%	0.603	53%	0.533	S	S	*	.	H	α-helix	trans	-63.2	-39.8	174.5	-171.6	-179.9	32.1	0	0	111.3	S271 D272 V273 H278 R279	S271-Q275 VanDerWaalsContact O-CB 3.26Å; S271-Q275 WeakPolarHBondContact O-CB 3.41Å; S271-Q275 PolarHBondContact O-N 3.34Å; D272-Q275 PolarHBondContact O-N 3.33Å; V273-Q275 VanDerWaalsContact C-N 3.32Å; V273-Q275 PolarHBondContact O-N 2.88Å; Q275-H278 PolarHBondContact O-N 2.87Å; Q275-R279 WeakPolarHBondContact O-CB 3.39Å; Q275-R279 PolarHBondContact O-N 3.13Å
276	G	90.9	Very high	88.6	Confident	38 Å²	38	102.5 Å²	102.5	39%	0.392	52%	0.521	S	S	.	.	H	α-helix	trans	-59.4	-47.5	172.2	0	0	0	0	0	112.6	D272 V273 V274 R279 M280	D272-G276 PolarHBondContact O-N 2.68Å; V273-G276 WeakPolarHBondContact O-CA 3.38Å; V273-G276 PolarHBondContact O-N 3.05Å; V273-G276 VanDerWaalsContact O-N 3.14Å; V274-G276 VanDerWaalsContact C-N 3.32Å; V274-G276 PolarHBondContact O-N 2.91Å; G276-R279 PolarHBondContact O-N 3.23Å; G276-M280 WeakPolarHBondContact O-CG 3.36Å; G276-M280 PolarHBondContact O-N 3.15Å
277	Y	87.9	Confident	89	Confident	146 Å²	146	105.1 Å²	105.1	57%	0.573	52%	0.523	S	S	*	.	H	α-helix	trans	-61.8	-45.6	173.4	-79.5	-68.1	0	0	0	111.8	V273 V274 R279 M280 Y281	V273-Y277 HydrophobicContact CG1-CD2 3.79Å; V273-Y277 HydrophobicContact CG1-CE2 3.54Å; V273-Y277 VanDerWaalsContact O-CD2 3.25Å; V273-Y277 WeakPolarHBondContact O-CD2 3.24Å; V273-Y277 PolarHBondContact O-N 3.16Å; V274-Y277 PolarHBondContact O-N 3.48Å; Y277-R279 VanDerWaalsContact C-N 3.31Å; Y277-R279 PolarHBondContact O-N 3.42Å; Y277-M280 CarbonylContact O-C 3.56Å; Y277-M280 WeakPolarHBondContact O-CB 3.29Å; Y277-M280 PolarHBondContact O-N 3.4Å; Y277-M280 VanDerWaalsContact O-N 3.1Å; Y277-Y281 WeakPolarHBondContact O-CD2 3.38Å; Y277-Y281 PolarHBondContact O-N 3.2Å
278	H	91.8	Very high	89.5	Confident	110 Å²	110	106.7 Å²	106.7	51%	0.509	53%	0.528	S	S	.	.	H	α-helix	trans	-57.3	-46.5	178.8	-168.2	69.2	0	0	0	111	V274 Q275 M280 Y281 E282	V274-H278 WeakPolarHBondContact O-CB 3.37Å; V274-H278 PolarHBondContact O-N 2.68Å; Q275-H278 PolarHBondContact O-N 2.87Å; H278-M280 VanDerWaalsContact C-N 3.31Å; H278-M280 PolarHBondContact O-N 3.46Å; H278-Y281 CarbonylContact O-C 3.58Å; H278-Y281 PolarHBondContact O-N 3.21Å; H278-Y281 VanDerWaalsContact O-N 3.15Å; H278-E282 IonicContact CD2-OE1 3.9Å; H278-E282 IonicContact CD2-OE2 3.45Å; H278-E282 IonicContact NE2-OE1 2.88Å; H278-E282 PolarHBondContact NE2-OE1 3.01Å; H278-E282 WeakPolarHBondContact O-CB 3.41Å; H278-E282 WeakPolarHBondContact O-CG 3.37Å; H278-E282 PolarHBondContact O-N 3.03Å
279	R	91.4	Very high	90.1	Very high	177 Å²	177	106.6 Å²	106.6	67%	0.668	53%	0.525	S	S	*	.	H	α-helix	trans	-61.7	-39	176.7	-168.3	169.8	-172.8	171.5	2	112.5	Q275 G276 Y277 L283	Q275-R279 WeakPolarHBondContact O-CB 3.39Å; Q275-R279 PolarHBondContact O-N 3.13Å; G276-R279 PolarHBondContact O-N 3.23Å; Y277-R279 VanDerWaalsContact C-N 3.31Å; Y277-R279 PolarHBondContact O-N 3.42Å; R279-L283 WeakPolarHBondContact O-CB 3.29Å; R279-L283 VanDerWaalsContact O-CG 3.27Å; R279-L283 WeakPolarHBondContact O-CG 3.27Å; R279-L283 PolarHBondContact O-N 3.36Å
280	M	92.3	Very high	90.5	Very high	101 Å²	101	107.6 Å²	107.6	50%	0.498	53%	0.525	S	S	.	.	H	α-helix	trans	-65.6	-44.5	173.6	-75.3	-61.5	-61.6	0	0	111.7	G276 Y277 H278 L283 H284	G276-M280 WeakPolarHBondContact O-CG 3.36Å; G276-M280 PolarHBondContact O-N 3.15Å; Y277-M280 CarbonylContact O-C 3.56Å; Y277-M280 WeakPolarHBondContact O-CB 3.29Å; Y277-M280 PolarHBondContact O-N 3.4Å; Y277-M280 VanDerWaalsContact O-N 3.1Å; H278-M280 VanDerWaalsContact C-N 3.31Å; H278-M280 PolarHBondContact O-N 3.46Å; M280-L283 PolarHBondContact O-N 3.38Å; M280-L283 HydrophobicContact SD-CD1 4.5Å; M280-H284 PolarHBondContact O-CD2 3.01Å; M280-H284 VanDerWaalsContact O-CD2 3.26Å; M280-H284 PolarHBondContact O-N 3.37Å
281	Y	91.8	Very high	91	Very high	163 Å²	163	108.1 Å²	108.1	64%	0.639	52%	0.519	S	S	*	.	H	α-helix	trans	-62.3	-41.9	175.3	-81.7	-68.7	0	0	0	112	Y277 H278 H284 R285	Y277-Y281 WeakPolarHBondContact O-CD2 3.38Å; Y277-Y281 PolarHBondContact O-N 3.2Å; H278-Y281 CarbonylContact O-C 3.58Å; H278-Y281 PolarHBondContact O-N 3.21Å; H278-Y281 VanDerWaalsContact O-N 3.15Å; Y281-H284 PolarHBondContact O-N 3.2Å; Y281-R285 WeakPolarHBondContact O-CB 3.49Å; Y281-R285 PolarHBondContact O-N 3.19Å
282	E	91.4	Very high	91.3	Very high	99 Å²	99	110.1 Å²	110.1	46%	0.463	52%	0.524	S	S	.	.	H	α-helix	trans	-61.9	-42.3	174.6	-74.8	-177.8	146.9	0	0	111.6	H278 R285 T286	H278-E282 IonicContact CD2-OE1 3.9Å; H278-E282 IonicContact CD2-OE2 3.45Å; H278-E282 IonicContact NE2-OE1 2.88Å; H278-E282 PolarHBondContact NE2-OE1 3.01Å; H278-E282 WeakPolarHBondContact O-CB 3.41Å; H278-E282 WeakPolarHBondContact O-CG 3.37Å; H278-E282 PolarHBondContact O-N 3.03Å; E282-R285 PolarHBondContact O-N 3.5Å; E282-T286 WeakPolarHBondContact O-CB 3.27Å; E282-T286 VanDerWaalsContact O-CG2 3.29Å; E282-T286 WeakPolarHBondContact O-CG2 3.37Å; E282-T286 PolarHBondContact O-N 3.46Å; E282-T286 PolarHBondContact O-OG1 2.67Å
283	L	93.6	Very high	91.6	Very high	102 Å²	102	110.7 Å²	110.7	53%	0.534	53%	0.527	S	S	.	.	H	α-helix	trans	-64.7	-42.1	175.2	-75.6	169.4	0	0	0	112.1	R279 M280 T286 R287	R279-L283 WeakPolarHBondContact O-CB 3.29Å; R279-L283 VanDerWaalsContact O-CG 3.27Å; R279-L283 WeakPolarHBondContact O-CG 3.27Å; R279-L283 PolarHBondContact O-N 3.36Å; M280-L283 PolarHBondContact O-N 3.38Å; M280-L283 HydrophobicContact SD-CD1 4.5Å; L283-T286 WeakPolarHBondContact CA-OG1 3.14Å; L283-T286 PolarHBondContact O-OG1 2.93Å; L283-R287 WeakPolarHBondContact O-CB 3.33Å; L283-R287 PolarHBondContact O-N 3.42Å; L283-R287 VanDerWaalsContact O-N 3.08Å
284	H	89.8	Confident	91.7	Very high	103 Å²	103	113.8 Å²	113.8	48%	0.477	53%	0.534	S	S	.	.	H	α-helix	trans	-65.7	-42.6	174.8	-88.3	-82.7	0	0	0	111.8	M280 Y281 R287 L288	M280-H284 PolarHBondContact O-CD2 3.01Å; M280-H284 VanDerWaalsContact O-CD2 3.26Å; M280-H284 PolarHBondContact O-N 3.37Å; Y281-H284 PolarHBondContact O-N 3.2Å; H284-R287 PolarHBondContact O-N 2.51Å; H284-L288 WeakPolarHBondContact O-CB 3.42Å; H284-L288 VanDerWaalsContact O-CG 3.31Å; H284-L288 WeakPolarHBondContact O-CG 3.35Å; H284-L288 PolarHBondContact O-N 2.86Å
285	R	91.7	Very high	91.7	Very high	164 Å²	164	115.5 Å²	115.5	62%	0.619	54%	0.537	S	S	*	.	H	α-helix	trans	-62.3	-51.8	177.9	178.2	179.3	176.1	121.9	12.2	111	Y281 E282 R287 L288 E289	Y281-R285 WeakPolarHBondContact O-CB 3.49Å; Y281-R285 PolarHBondContact O-N 3.19Å; E282-R285 PolarHBondContact O-N 3.5Å; R285-R287 VanDerWaalsContact C-N 3.31Å; R285-R287 PolarHBondContact O-N 2.72Å; R285-L288 CarbonylContact O-C 3.12Å; R285-L288 PolarHBondContact O-N 2.84Å; R285-L288 VanDerWaalsContact O-N 3.07Å; R285-E289 HydrophobicContact CG-CG 4.2Å; R285-E289 IonicContact CZ-OE1 2.79Å; R285-E289 VanDerWaalsContact CZ-OE1 3.24Å; R285-E289 IonicContact NE-OE1 3.28Å; R285-E289 PolarHBondContact NE-OE1 3.39Å; R285-E289 IonicContact NH2-OE1 2.77Å; R285-E289 PolarHBondContact NH2-OE1 2.89Å; R285-E289 WeakPolarHBondContact O-CB 3.45Å; R285-E289 WeakPolarHBondContact O-CG 3.39Å; R285-E289 PolarHBondContact O-N 2.99Å
286	T	92.6	Very high	91.6	Very high	68 Å²	68	111 Å²	111	42%	0.417	52%	0.518	S	S	.	.	H	α-helix	trans	-59.1	-42.6	178.3	46.5	0	0	0	0	111.5	E282 L283 L288 E289 D290	E282-T286 WeakPolarHBondContact O-CB 3.27Å; E282-T286 VanDerWaalsContact O-CG2 3.29Å; E282-T286 WeakPolarHBondContact O-CG2 3.37Å; E282-T286 PolarHBondContact O-N 3.46Å; E282-T286 PolarHBondContact O-OG1 2.67Å; L283-T286 WeakPolarHBondContact CA-OG1 3.14Å; L283-T286 PolarHBondContact O-OG1 2.93Å; T286-L288 VanDerWaalsContact C-N 3.35Å; T286-L288 PolarHBondContact O-N 3.17Å; T286-E289 PolarHBondContact O-N 3.29Å; T286-D290 WeakPolarHBondContact O-CB 3.14Å; T286-D290 PolarHBondContact O-N 3.32Å
287	R	94	Very high	91.5	Very high	160 Å²	160	110.4 Å²	110.4	60%	0.604	51%	0.512	S	S	*	.	H	α-helix	trans	-60.1	-43.3	173.4	178.7	-179.7	172.7	173.7	-0.1	112.5	L283 H284 R285 Q291	L283-R287 WeakPolarHBondContact O-CB 3.33Å; L283-R287 PolarHBondContact O-N 3.42Å; L283-R287 VanDerWaalsContact O-N 3.08Å; H284-R287 PolarHBondContact O-N 2.51Å; R285-R287 VanDerWaalsContact C-N 3.31Å; R285-R287 PolarHBondContact O-N 2.72Å; R287-Q291 WeakPolarHBondContact O-CG 3.09Å; R287-Q291 PolarHBondContact O-N 2.76Å
288	L	92.4	Very high	91.5	Very high	105 Å²	105	107.6 Å²	107.6	55%	0.55	51%	0.507	S	S	.	.	H	α-helix	trans	-70.1	-40.3	178.9	-75.7	169.3	0	0	0	111.7	H284 R285 T286 D290 Q291 L292	H284-L288 WeakPolarHBondContact O-CB 3.42Å; H284-L288 VanDerWaalsContact O-CG 3.31Å; H284-L288 WeakPolarHBondContact O-CG 3.35Å; H284-L288 PolarHBondContact O-N 2.86Å; R285-L288 CarbonylContact O-C 3.12Å; R285-L288 PolarHBondContact O-N 2.84Å; R285-L288 VanDerWaalsContact O-N 3.07Å; T286-L288 VanDerWaalsContact C-N 3.35Å; T286-L288 PolarHBondContact O-N 3.17Å; L288-D290 VanDerWaalsContact C-N 3.33Å; L288-Q291 PolarHBondContact O-N 3.15Å; L288-L292 VanDerWaalsContact O-CB 3.29Å; L288-L292 WeakPolarHBondContact O-CB 3.5Å; L288-L292 PolarHBondContact O-N 3.43Å
289	E	92.9	Very high	91.4	Very high	76 Å²	76	109.6 Å²	109.6	36%	0.355	51%	0.51	S	S	.	.	H	α-helix	trans	-60.3	-43.3	173.8	-75	174.4	164.4	0	0	110.6	R285 T286 Q291 L292 L293	R285-E289 HydrophobicContact CG-CG 4.2Å; R285-E289 IonicContact CZ-OE1 2.79Å; R285-E289 VanDerWaalsContact CZ-OE1 3.24Å; R285-E289 IonicContact NE-OE1 3.28Å; R285-E289 PolarHBondContact NE-OE1 3.39Å; R285-E289 IonicContact NH2-OE1 2.77Å; R285-E289 PolarHBondContact NH2-OE1 2.89Å; R285-E289 WeakPolarHBondContact O-CB 3.45Å; R285-E289 WeakPolarHBondContact O-CG 3.39Å; R285-E289 PolarHBondContact O-N 2.99Å; T286-E289 PolarHBondContact O-N 3.29Å; E289-Q291 PolarHBondContact O-N 3.43Å; E289-L292 PolarHBondContact O-N 2.82Å; E289-L293 WeakPolarHBondContact O-CB 3.25Å; E289-L293 VanDerWaalsContact O-CG 3.27Å; E289-L293 WeakPolarHBondContact O-CG 3.43Å; E289-L293 PolarHBondContact O-N 3.02Å
290	D	93.2	Very high	90.9	Very high	93 Å²	93	104.7 Å²	104.7	50%	0.497	50%	0.497	S	S	.	.	H	α-helix	trans	-62.9	-40.6	174.3	-84.9	-6	0	0	0	112.7	T286 L288 K294	T286-D290 WeakPolarHBondContact O-CB 3.14Å; T286-D290 PolarHBondContact O-N 3.32Å; L288-D290 VanDerWaalsContact C-N 3.33Å; D290-K294 WeakPolarHBondContact O-CG 3.29Å; D290-K294 PolarHBondContact O-N 3.08Å; D290-K294 VanDerWaalsContact O-N 3.13Å
291	Q	94.2	Very high	90.5	Very high	91 Å²	91	107.9 Å²	107.9	43%	0.425	50%	0.504	S	S	.	.	H	α-helix	trans	-67.1	-42.5	175.1	-75.8	-179	-12.2	0	0	111.4	R287 L288 E289 K294 M295	R287-Q291 WeakPolarHBondContact O-CG 3.09Å; R287-Q291 PolarHBondContact O-N 2.76Å; L288-Q291 PolarHBondContact O-N 3.15Å; E289-Q291 PolarHBondContact O-N 3.43Å; Q291-K294 PolarHBondContact O-N 3.49Å; Q291-M295 WeakPolarHBondContact O-CB 3.49Å; Q291-M295 VanDerWaalsContact O-CG 3.29Å; Q291-M295 WeakPolarHBondContact O-CG 3.26Å; Q291-M295 PolarHBondContact O-N 2.94Å
292	L	92.3	Very high	90.2	Very high	109 Å²	109	108.5 Å²	108.5	57%	0.571	51%	0.506	S	S	*	.	H	α-helix	trans	-62.9	-45.7	177.9	-164.5	161.4	0	0	0	109.9	L288 E289 K294 M295 T296	L288-L292 VanDerWaalsContact O-CB 3.29Å; L288-L292 WeakPolarHBondContact O-CB 3.5Å; L288-L292 PolarHBondContact O-N 3.43Å; E289-L292 PolarHBondContact O-N 2.82Å; L292-K294 VanDerWaalsContact C-N 3.32Å; L292-K294 PolarHBondContact O-N 3.45Å; L292-M295 PolarHBondContact O-N 2.82Å; L292-T296 HydrophobicContact CD2-CG2 3.57Å; L292-T296 WeakPolarHBondContact O-CG2 3.35Å; L292-T296 PolarHBondContact O-N 2.9Å; L292-T296 PolarHBondContact O-OG1 3.33Å
293	L	92.8	Very high	89.6	Confident	113 Å²	113	106.5 Å²	106.5	59%	0.592	50%	0.503	S	S	*	.	H	α-helix	trans	-57.8	-40.8	176	-79.6	167.1	0	0	0	112.7	E289 T296 G297	E289-L293 WeakPolarHBondContact O-CB 3.25Å; E289-L293 VanDerWaalsContact O-CG 3.27Å; E289-L293 WeakPolarHBondContact O-CG 3.43Å; E289-L293 PolarHBondContact O-N 3.02Å; L293-T296 WeakPolarHBondContact CA-OG1 3.39Å; L293-T296 PolarHBondContact O-OG1 3.41Å; L293-G297 PolarHBondContact O-N 3.46Å
294	K	90.8	Very high	89	Confident	147 Å²	147	107.4 Å²	107.4	64%	0.639	50%	0.504	S	S	*	.	H	α-helix	trans	-66.3	-47.7	174.6	-73.1	172.6	-174.6	173.6	0	111.4	D290 Q291 L292 T296 G297 D298	D290-K294 WeakPolarHBondContact O-CG 3.29Å; D290-K294 PolarHBondContact O-N 3.08Å; D290-K294 VanDerWaalsContact O-N 3.13Å; Q291-K294 PolarHBondContact O-N 3.49Å; L292-K294 VanDerWaalsContact C-N 3.32Å; L292-K294 PolarHBondContact O-N 3.45Å; K294-T296 PolarHBondContact O-N 2.66Å; K294-G297 PolarHBondContact O-N 2.84Å; K294-D298 PolarHBondContact O-N 2.87Å
295	M	87.8	Confident	88.5	Confident	131 Å²	131	108.2 Å²	108.2	65%	0.645	51%	0.507	S	S	*	.	H	α-helix	trans	-64.7	-36.9	179.6	-70	-64.5	-63.8	0	0	112.6	Q291 L292 R299	Q291-M295 WeakPolarHBondContact O-CB 3.49Å; Q291-M295 VanDerWaalsContact O-CG 3.29Å; Q291-M295 WeakPolarHBondContact O-CG 3.26Å; Q291-M295 PolarHBondContact O-N 2.94Å; L292-M295 PolarHBondContact O-N 2.82Å; M295-R299 VanDerWaalsContact O-CB 3.31Å; M295-R299 WeakPolarHBondContact O-CB 3.29Å; M295-R299 PolarHBondContact O-N 3.49Å
296	T	87.9	Confident	88	Confident	36 Å²	36	104.1 Å²	104.1	22%	0.221	50%	0.5	C	S	.	.	H	α-helix	trans	-69.8	-41.6	173.9	48.3	0	0	0	0	111.3	L292 L293 K294 D298 R299 D300	L292-T296 HydrophobicContact CD2-CG2 3.57Å; L292-T296 WeakPolarHBondContact O-CG2 3.35Å; L292-T296 PolarHBondContact O-N 2.9Å; L292-T296 PolarHBondContact O-OG1 3.33Å; L293-T296 WeakPolarHBondContact CA-OG1 3.39Å; L293-T296 PolarHBondContact O-OG1 3.41Å; K294-T296 PolarHBondContact O-N 2.66Å; T296-D298 PolarHBondContact O-N 3.35Å; T296-R299 WeakPolarHBondContact O-CB 3.45Å; T296-R299 PolarHBondContact O-N 3.34Å; T296-D300 WeakPolarHBondContact O-CB 3.39Å; T296-D300 PolarHBondContact O-N 3.35Å
297	G	87.9	Confident	87.1	Confident	24 Å²	24	104.4 Å²	104.4	25%	0.247	50%	0.496	C	S	.	.	H	α-helix	trans	-56.7	-49.5	172.5	0	0	0	0	0	112.1	L293 K294 R299 D300 Y301	L293-G297 PolarHBondContact O-N 3.46Å; K294-G297 PolarHBondContact O-N 2.84Å; G297-R299 PolarHBondContact O-N 2.91Å; G297-D300 PolarHBondContact O-N 3.42Å; G297-Y301 WeakPolarHBondContact O-CD2 3.23Å; G297-Y301 PolarHBondContact O-N 3.46Å
298	D	89	Confident	86.4	Confident	88 Å²	88	101 Å²	101	47%	0.471	49%	0.49	S	S	.	.	H	α-helix	trans	-60.9	-44.9	176.8	-73.6	-13	0	0	0	111.6	K294 T296 D300 Y301 W302	K294-D298 PolarHBondContact O-N 2.87Å; T296-D298 PolarHBondContact O-N 3.35Å; D298-D300 VanDerWaalsContact C-N 3.29Å; D298-D300 PolarHBondContact O-N 2.86Å; D298-Y301 PolarHBondContact O-N 2.9Å; D298-W302 WeakPolarHBondContact O-CB 3.14Å; D298-W302 PolarHBondContact O-N 2.96Å
299	R	89.1	Confident	85.9	Confident	152 Å²	152	100.2 Å²	100.2	57%	0.574	49%	0.485	S	S	*	.	H	α-helix	trans	-57.8	-42.6	174.6	-177.8	-159.7	68.7	-174.2	-1.9	111.5	M295 T296 G297 W302 S303	M295-R299 VanDerWaalsContact O-CB 3.31Å; M295-R299 WeakPolarHBondContact O-CB 3.29Å; M295-R299 PolarHBondContact O-N 3.49Å; T296-R299 WeakPolarHBondContact O-CB 3.45Å; T296-R299 PolarHBondContact O-N 3.34Å; G297-R299 PolarHBondContact O-N 2.91Å; R299-W302 PolarHBondContact O-N 2.97Å; R299-S303 VanDerWaalsContact O-CB 3.29Å; R299-S303 WeakPolarHBondContact O-CB 3.44Å; R299-S303 PolarHBondContact O-N 2.74Å; R299-S303 PolarHBondContact O-OG 2.83Å
300	D	81.3	Confident	85.2	Confident	74 Å²	74	97.4 Å²	97.4	40%	0.396	48%	0.475	S	S	.	.	H	α-helix	trans	-71.2	-37.5	-178.2	-64.7	-11.4	0	0	0	111.2	T296 G297 D298 S303 Q304	T296-D300 WeakPolarHBondContact O-CB 3.39Å; T296-D300 PolarHBondContact O-N 3.35Å; G297-D300 PolarHBondContact O-N 3.42Å; D298-D300 VanDerWaalsContact C-N 3.29Å; D298-D300 PolarHBondContact O-N 2.86Å; D300-S303 WeakPolarHBondContact CA-OG 3.27Å; D300-S303 PolarHBondContact O-OG 3.35Å; D300-Q304 WeakPolarHBondContact O-CB 3.44Å; D300-Q304 PolarHBondContact O-N 3.07Å
301	Y	83.1	Confident	84.4	Confident	167 Å²	167	95.1 Å²	95.1	66%	0.655	46%	0.463	S	S	*	.	H	α-helix	trans	-62.7	-45	170.2	-73.7	-58.9	0	0	0	112	G297 D298 F305	G297-Y301 WeakPolarHBondContact O-CD2 3.23Å; G297-Y301 PolarHBondContact O-N 3.46Å; D298-Y301 PolarHBondContact O-N 2.9Å; Y301-F305 VanDerWaalsContact O-CB 3.24Å; Y301-F305 WeakPolarHBondContact O-CB 3.38Å; Y301-F305 PolarHBondContact O-N 2.69Å
302	W	86.6	Confident	83.7	Confident	176 Å²	176	97.7 Å²	97.7	67%	0.667	47%	0.472	S	S	*	.	H	α-helix	trans	-66.8	-41	177.7	-78.9	114.3	0	0	0	112.2	D298 R299 F305 T306	D298-W302 WeakPolarHBondContact O-CB 3.14Å; D298-W302 PolarHBondContact O-N 2.96Å; R299-W302 PolarHBondContact O-N 2.97Å; W302-F305 HydrophobicContact CE3-CD1 4.31Å; W302-F305 HydrophobicContact CZ3-CD1 4.28Å; W302-F305 PolarHBondContact O-N 2.72Å; W302-T306 WeakPolarHBondContact O-CB 3.23Å; W302-T306 VanDerWaalsContact O-CG2 3.28Å; W302-T306 WeakPolarHBondContact O-CG2 3.32Å; W302-T306 PolarHBondContact O-N 3.23Å; W302-T306 PolarHBondContact O-OG1 3.17Å
303	S	79.7	Confident	83.1	Confident	58 Å²	58	94.4 Å²	94.4	41%	0.406	46%	0.457	S	S	.	.	H	α-helix	trans	-66.5	-41	177.5	71.3	0	0	0	0	111.5	R299 D300 T306 F307	R299-S303 VanDerWaalsContact O-CB 3.29Å; R299-S303 WeakPolarHBondContact O-CB 3.44Å; R299-S303 PolarHBondContact O-N 2.74Å; R299-S303 PolarHBondContact O-OG 2.83Å; D300-S303 WeakPolarHBondContact CA-OG 3.27Å; D300-S303 PolarHBondContact O-OG 3.35Å; S303-T306 WeakPolarHBondContact CA-OG1 3.34Å; S303-T306 PolarHBondContact O-OG1 3.35Å; S303-F307 WeakPolarHBondContact O-CB 3.27Å; S303-F307 PolarHBondContact O-N 2.96Å
304	Q	79.1	Confident	82.4	Confident	120 Å²	120	89.6 Å²	89.6	56%	0.561	43%	0.431	S	S	*	.	H	α-helix	trans	-67.9	-38.5	175.5	-166.2	175.2	27	0	0	111.6	D300 N308	D300-Q304 WeakPolarHBondContact O-CB 3.44Å; D300-Q304 PolarHBondContact O-N 3.07Å; Q304-N308 VanDerWaalsContact O-CB 3.29Å; Q304-N308 WeakPolarHBondContact O-CB 3.35Å; Q304-N308 PolarHBondContact O-N 2.92Å; Q304-N308 PolarHBondContact O-ND2 3.44Å
305	F	80.9	Confident	81.8	Confident	121 Å²	121	90.4 Å²	90.4	53%	0.531	44%	0.435	S	S	.	.	H	α-helix	trans	-64.8	-47	175	179.9	-98.6	0	0	0	112	Y301 W302 N308 L309	Y301-F305 VanDerWaalsContact O-CB 3.24Å; Y301-F305 WeakPolarHBondContact O-CB 3.38Å; Y301-F305 PolarHBondContact O-N 2.69Å; W302-F305 HydrophobicContact CE3-CD1 4.31Å; W302-F305 HydrophobicContact CZ3-CD1 4.28Å; W302-F305 PolarHBondContact O-N 2.72Å; F305-N308 PolarHBondContact O-N 3.47Å; F305-L309 VanDerWaalsContact O-CB 3.31Å; F305-L309 WeakPolarHBondContact O-CB 3.02Å; F305-L309 PolarHBondContact O-N 2.94Å
306	T	80.3	Confident	81.2	Confident	78 Å²	78	89.1 Å²	89.1	48%	0.479	43%	0.434	S	S	.	.	H	α-helix	trans	-65.4	-39	178.2	54.2	0	0	0	0	111.7	W302 S303 L309 A310	W302-T306 WeakPolarHBondContact O-CB 3.23Å; W302-T306 VanDerWaalsContact O-CG2 3.28Å; W302-T306 WeakPolarHBondContact O-CG2 3.32Å; W302-T306 PolarHBondContact O-N 3.23Å; W302-T306 PolarHBondContact O-OG1 3.17Å; S303-T306 WeakPolarHBondContact CA-OG1 3.34Å; S303-T306 PolarHBondContact O-OG1 3.35Å; T306-L309 WeakPolarHBondContact O-CB 3.48Å; T306-L309 PolarHBondContact O-N 2.99Å; T306-A310 WeakPolarHBondContact O-CB 3.29Å; T306-A310 PolarHBondContact O-N 3.23Å
307	F	73.3	Confident	80.6	Confident	74 Å²	74	92.9 Å²	92.9	33%	0.325	45%	0.448	S	S	.	.	H	α-helix	trans	-62.2	-47.7	173.3	-177.8	-98.9	0	0	0	112.2	S303 L309 A310 L311 Y326	S303-F307 WeakPolarHBondContact O-CB 3.27Å; S303-F307 PolarHBondContact O-N 2.96Å; F307-L309 VanDerWaalsContact C-N 3.28Å; F307-L309 PolarHBondContact O-N 3.49Å; F307-A310 WeakPolarHBondContact O-CB 3.36Å; F307-A310 PolarHBondContact O-N 3.08Å; F307-L311 HydrophobicContact CD1-CD1 3.99Å; F307-L311 HydrophobicContact CD1-CG 4.47Å; F307-L311 HydrophobicContact CE1-CD1 3.42Å; F307-L311 VanDerWaalsContact CE1-CD1 3.42Å; F307-L311 HydrophobicContact CE1-CG 4.08Å; F307-L311 HydrophobicContact CZ-CD1 3.92Å; F307-L311 HydrophobicContact CZ-CD2 4.47Å; F307-L311 HydrophobicContact CZ-CG 4.23Å; F307-L311 PolarHBondContact O-N 3.34Å; F307-Y326 AromaticContact CE2-CE2 3.92Å; F307-Y326 HydrophobicContact CE2-CE2 3.92Å; F307-Y326 HydrophobicContact CZ-CE1 4.44Å; F307-Y326 AromaticContact CZ-CE2 3.72Å; F307-Y326 HydrophobicContact CZ-CE2 3.72Å; F307-Y326 AromaticContact CZ-CZ 3.62Å; F307-Y326 WeakPolarHBondContact CZ-OH 3.29Å
308	N	79.2	Confident	80	Confident	89 Å²	89	100.6 Å²	100.6	48%	0.476	47%	0.474	S	S	.	.	H	α-helix	trans	-62.3	-36.8	175.6	-77.3	-34.6	0	0	0	112.3	Q304 F305 K312	Q304-N308 VanDerWaalsContact O-CB 3.29Å; Q304-N308 WeakPolarHBondContact O-CB 3.35Å; Q304-N308 PolarHBondContact O-N 2.92Å; Q304-N308 PolarHBondContact O-ND2 3.44Å; F305-N308 PolarHBondContact O-N 3.47Å; N308-K312 WeakPolarHBondContact O-CB 3.43Å; N308-K312 PolarHBondContact O-N 2.99Å
309	L	82.8	Confident	79.5	Confident	87 Å²	87	98.1 Å²	98.1	46%	0.455	46%	0.461	S	S	.	.	H	α-helix	trans	-64.7	-46.7	174.5	-175	65.6	0	0	0	110.9	F305 T306 F307 L311 K312 V313	F305-L309 VanDerWaalsContact O-CB 3.31Å; F305-L309 WeakPolarHBondContact O-CB 3.02Å; F305-L309 PolarHBondContact O-N 2.94Å; T306-L309 WeakPolarHBondContact O-CB 3.48Å; T306-L309 PolarHBondContact O-N 2.99Å; F307-L309 VanDerWaalsContact C-N 3.28Å; F307-L309 PolarHBondContact O-N 3.49Å; L309-L311 PolarHBondContact O-N 3.01Å; L309-K312 WeakPolarHBondContact O-CB 3.34Å; L309-K312 PolarHBondContact O-N 3.32Å; L309-K312 VanDerWaalsContact O-N 3.11Å; L309-V313 VanDerWaalsContact O-CG2 3.32Å; L309-V313 WeakPolarHBondContact O-CG2 3.45Å; L309-V313 PolarHBondContact O-N 3.35Å
310	A	78.8	Confident	79	Confident	18 Å²	18	99.7 Å²	99.7	15%	0.149	47%	0.467	C	S	.	.	H	α-helix	trans	-58	-45.8	176.2	0	0	0	0	0	111.7	T306 F307 K312 V313 I314 L619 L622	T306-A310 WeakPolarHBondContact O-CB 3.29Å; T306-A310 PolarHBondContact O-N 3.23Å; F307-A310 WeakPolarHBondContact O-CB 3.36Å; F307-A310 PolarHBondContact O-N 3.08Å; A310-K312 VanDerWaalsContact C-N 3.32Å; A310-K312 PolarHBondContact O-N 3.18Å; A310-V313 PolarHBondContact O-N 2.91Å; A310-I314 VanDerWaalsContact O-CG1 3.31Å; A310-I314 WeakPolarHBondContact O-CG1 3.14Å; A310-I314 PolarHBondContact O-N 3.31Å; A310-L619 HydrophobicContact CB-CD2 4.32Å; A310-L622 HydrophobicContact CB-CD1 4.25Å
311	L	75.3	Confident	78.8	Confident	45 Å²	45	98.9 Å²	98.9	24%	0.236	46%	0.462	C	S	.	.	H	α-helix	trans	-60.7	-39.5	174.1	-71.9	-179.5	0	0	0	112.7	F307 L309 I314 K315 Y326	F307-L311 HydrophobicContact CD1-CD1 3.99Å; F307-L311 HydrophobicContact CD1-CG 4.47Å; F307-L311 HydrophobicContact CE1-CD1 3.42Å; F307-L311 VanDerWaalsContact CE1-CD1 3.42Å; F307-L311 HydrophobicContact CE1-CG 4.08Å; F307-L311 HydrophobicContact CZ-CD1 3.92Å; F307-L311 HydrophobicContact CZ-CD2 4.47Å; F307-L311 HydrophobicContact CZ-CG 4.23Å; F307-L311 PolarHBondContact O-N 3.34Å; L309-L311 PolarHBondContact O-N 3.01Å; L311-I314 HydrophobicContact CD2-CD1 4.45Å; L311-K315 WeakPolarHBondContact O-CG 3.34Å; L311-K315 PolarHBondContact O-N 3.36Å; L311-K315 VanDerWaalsContact O-N 3.12Å; L311-Y326 HydrophobicContact CD2-CD1 4.17Å; L311-Y326 HydrophobicContact CD2-CE1 4.2Å
312	K	80.2	Confident	78.6	Confident	144 Å²	144	91 Å²	91	63%	0.626	43%	0.432	S	S	*	.	H	α-helix	trans	-66.3	-40.4	176.3	-164.4	174.1	-175.2	178.8	0	111.1	N308 L309 A310 K315 V316	N308-K312 WeakPolarHBondContact O-CB 3.43Å; N308-K312 PolarHBondContact O-N 2.99Å; L309-K312 WeakPolarHBondContact O-CB 3.34Å; L309-K312 PolarHBondContact O-N 3.32Å; L309-K312 VanDerWaalsContact O-N 3.11Å; A310-K312 VanDerWaalsContact C-N 3.32Å; A310-K312 PolarHBondContact O-N 3.18Å; K312-K315 PolarHBondContact O-N 3.3Å; K312-V316 WeakPolarHBondContact O-CB 3.31Å; K312-V316 VanDerWaalsContact O-CG2 3.25Å; K312-V316 WeakPolarHBondContact O-CG2 2.94Å; K312-V316 PolarHBondContact O-N 2.91Å
313	V	80.4	Confident	78.4	Confident	40 Å²	40	85.2 Å²	85.2	24%	0.242	42%	0.418	C	S	.	.	H	α-helix	trans	-64.2	-45.8	176.3	172	0	0	0	0	111.3	L309 A310 K315 V316 K317 L626	L309-V313 VanDerWaalsContact O-CG2 3.32Å; L309-V313 WeakPolarHBondContact O-CG2 3.45Å; L309-V313 PolarHBondContact O-N 3.35Å; A310-V313 PolarHBondContact O-N 2.91Å; V313-K315 VanDerWaalsContact C-N 3.3Å; V313-K315 PolarHBondContact O-N 3.21Å; V313-V316 PolarHBondContact O-N 2.88Å; V313-K317 HydrophobicContact CG1-CG 4.34Å; V313-K317 WeakPolarHBondContact O-CB 3.34Å; V313-K317 PolarHBondContact O-N 3.06Å; V313-L626 HydrophobicContact CG1-CD1 3.78Å; V313-L626 HydrophobicContact CG1-CD2 3.58Å; V313-L626 HydrophobicContact CG1-CG 4.26Å
314	I	77.6	Confident	78.5	Confident	12 Å²	12	86.2 Å²	86.2	6%	0.062	42%	0.416	C	S	.	.	H	α-helix	trans	-54.4	-46.6	174.5	-70.6	164	0	0	0	110.8	A310 L311 K318 L319 V322 L622	A310-I314 VanDerWaalsContact O-CG1 3.31Å; A310-I314 WeakPolarHBondContact O-CG1 3.14Å; A310-I314 PolarHBondContact O-N 3.31Å; L311-I314 HydrophobicContact CD2-CD1 4.45Å; I314-K318 PolarHBondContact O-N 3.15Å; I314-K318 VanDerWaalsContact O-N 3.12Å; I314-L319 HydrophobicContact CG2-CB 4.27Å; I314-L319 PolarHBondContact O-N 2.85Å; I314-V322 HydrophobicContact CD1-CG1 3.89Å; I314-V322 HydrophobicContact CG1-CG1 4.15Å; I314-L622 HydrophobicContact CD1-CD1 4.01Å; I314-L622 HydrophobicContact CD1-CD2 4.35Å; I314-L622 HydrophobicContact CG1-CD1 4.23Å; I314-L622 HydrophobicContact CG1-CD2 3.76Å
315	K	77.1	Confident	78.8	Confident	165 Å²	165	80.5 Å²	80.5	72%	0.717	39%	0.389	S	S	*	.	H	α-helix	trans	-65.8	-46.6	179.2	-73.5	177.2	-178.7	178.4	0	112.6	L311 K312 V313 K318	L311-K315 WeakPolarHBondContact O-CG 3.34Å; L311-K315 PolarHBondContact O-N 3.36Å; L311-K315 VanDerWaalsContact O-N 3.12Å; K312-K315 PolarHBondContact O-N 3.3Å; V313-K315 VanDerWaalsContact C-N 3.3Å; V313-K315 PolarHBondContact O-N 3.21Å; K315-K318 PolarHBondContact O-N 2.99Å
316	V	76.3	Confident	79	Confident	104 Å²	104	77.4 Å²	77.4	63%	0.63	37%	0.374	S	S	*	.	H	α-helix	trans	-67.2	-41.3	-177.6	170.9	0	0	0	0	111.6	K312 V313 K318	K312-V316 WeakPolarHBondContact O-CB 3.31Å; K312-V316 VanDerWaalsContact O-CG2 3.25Å; K312-V316 WeakPolarHBondContact O-CG2 2.94Å; K312-V316 PolarHBondContact O-N 2.91Å; V313-V316 PolarHBondContact O-N 2.88Å; V316-K318 VanDerWaalsContact C-N 3.27Å; V316-K318 PolarHBondContact O-N 3.15Å
317	K	74.1	Confident	79.3	Confident	114 Å²	114	78 Å²	78	50%	0.496	38%	0.378	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.9	3.2	179.4	-65.4	-68.6	-173.4	173.2	0	113.6	V313 L319 L626	V313-K317 HydrophobicContact CG1-CG 4.34Å; V313-K317 WeakPolarHBondContact O-CB 3.34Å; V313-K317 PolarHBondContact O-N 3.06Å; K317-L319 HydrophobicContact CB-CD1 4.24Å; K317-L319 HydrophobicContact CB-CD2 4.45Å; K317-L319 HydrophobicContact CB-CG 3.9Å; K317-L319 PolarHBondContact O-N 3.23Å; K317-L626 HydrophobicContact CG-CD2 4Å
318	K	76.7	Confident	79.9	Confident	186 Å²	186	74.6 Å²	74.6	81%	0.809	36%	0.363	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.7	39.9	-179.6	-58.6	-178.9	-179.9	177.8	0	112.9	I314 K315 V316 R320	I314-K318 PolarHBondContact O-N 3.15Å; I314-K318 VanDerWaalsContact O-N 3.12Å; K315-K318 PolarHBondContact O-N 2.99Å; V316-K318 VanDerWaalsContact C-N 3.27Å; V316-K318 PolarHBondContact O-N 3.15Å; K318-R320 PolarHBondContact O-N 3.08Å
319	L	77.8	Confident	80.4	Confident	36 Å²	36	70.4 Å²	70.4	19%	0.188	34%	0.341	C	S	.	.			trans	-76.8	72	179.7	-62.2	176.3	0	0	0	110.5	I314 K317 L321 V322 S323 L622 M625	I314-L319 HydrophobicContact CG2-CB 4.27Å; I314-L319 PolarHBondContact O-N 2.85Å; K317-L319 HydrophobicContact CB-CD1 4.24Å; K317-L319 HydrophobicContact CB-CD2 4.45Å; K317-L319 HydrophobicContact CB-CG 3.9Å; K317-L319 PolarHBondContact O-N 3.23Å; L319-L321 PolarHBondContact O-N 3.32Å; L319-V322 HydrophobicContact CB-CB 4.2Å; L319-V322 HydrophobicContact CB-CG2 4.17Å; L319-V322 PolarHBondContact O-N 3.37Å; L319-S323 PolarHBondContact O-N 3.42Å; L319-S323 VanDerWaalsContact O-N 3.09Å; L319-L622 HydrophobicContact CD1-CD2 3.71Å; L319-M625 HydrophobicContact CD1-CE 4.4Å; L319-M625 HydrophobicContact CD2-CE 4.17Å
320	R	77.5	Confident	80.7	Confident	186 Å²	186	68.3 Å²	68.3	70%	0.702	33%	0.329	S	S	*	.	H	α-helix	trans	-58.4	-43.4	-172.9	-173.5	177.4	176.8	164.4	4.4	112.8	K318 V322 S323 E324	K318-R320 PolarHBondContact O-N 3.08Å; R320-V322 PolarHBondContact O-N 2.95Å; R320-S323 WeakPolarHBondContact O-CB 3.47Å; R320-S323 PolarHBondContact O-N 3.15Å; R320-E324 WeakPolarHBondContact CG-OE1 3.23Å; R320-E324 IonicContact CZ-OE1 3.89Å; R320-E324 IonicContact NE-OE1 3.98Å; R320-E324 PolarHBondContact NE-OE1 3.39Å; R320-E324 IonicContact NH2-OE1 3.91Å; R320-E324 WeakPolarHBondContact O-CG 3.26Å; R320-E324 PolarHBondContact O-N 2.94Å
321	L	77.2	Confident	81.1	Confident	56 Å²	56	68 Å²	68	29%	0.293	33%	0.327	S	S	.	.	H	α-helix	trans	-64.6	-38.1	179.6	-70	172.4	0	0	0	112.7	L319 E324 L325 I712 L713	L319-L321 PolarHBondContact O-N 3.32Å; L321-E324 PolarHBondContact O-N 3.02Å; L321-L325 VanDerWaalsContact O-CB 3.27Å; L321-L325 WeakPolarHBondContact O-CB 3.39Å; L321-L325 PolarHBondContact O-N 3.34Å; L321-I712 HydrophobicContact CD1-CG2 3.7Å; L321-L713 HydrophobicContact CB-CD1 4.23Å; L321-L713 HydrophobicContact CB-CD2 3.99Å; L321-L713 HydrophobicContact CB-CG 4.21Å; L321-L713 HydrophobicContact CD1-CD2 3.98Å; L321-L713 HydrophobicContact CD1-CG 4.27Å
322	V	79.9	Confident	82	Confident	3 Å²	3	65.9 Å²	65.9	2%	0.018	32%	0.316	C	S	.	.	H	α-helix	trans	-70.3	-36.1	176.9	-175.1	0	0	0	0	111.1	I314 L319 R320 L325 Y326 L621 L622 M625	I314-V322 HydrophobicContact CD1-CG1 3.89Å; I314-V322 HydrophobicContact CG1-CG1 4.15Å; L319-V322 HydrophobicContact CB-CB 4.2Å; L319-V322 HydrophobicContact CB-CG2 4.17Å; L319-V322 PolarHBondContact O-N 3.37Å; R320-V322 PolarHBondContact O-N 2.95Å; V322-L325 PolarHBondContact O-N 2.66Å; V322-Y326 PolarHBondContact O-N 2.91Å; V322-L621 HydrophobicContact CG2-CD2 4.43Å; V322-L622 HydrophobicContact CB-CD2 4.48Å; V322-L622 HydrophobicContact CG1-CD1 4.39Å; V322-L622 HydrophobicContact CG1-CD2 3.85Å; V322-L622 HydrophobicContact CG1-CG 4.09Å; V322-L622 HydrophobicContact CG2-CD2 4.4Å; V322-M625 HydrophobicContact CG2-CE 3.24Å
323	S	81.2	Confident	82.5	Confident	53 Å²	53	60 Å²	60	37%	0.371	29%	0.291	S	S	.	.	H	α-helix	trans	-64	-39.8	172.6	-174.3	0	0	0	0	112.4	L319 R320 V327	L319-S323 PolarHBondContact O-N 3.42Å; L319-S323 VanDerWaalsContact O-N 3.09Å; R320-S323 WeakPolarHBondContact O-CB 3.47Å; R320-S323 PolarHBondContact O-N 3.15Å; S323-V327 VanDerWaalsContact O-CG2 3.28Å; S323-V327 WeakPolarHBondContact O-CG2 3.42Å; S323-V327 PolarHBondContact O-N 3.05Å; S323-V327 VanDerWaalsContact O-N 3.13Å
324	E	83	Confident	83	Confident	79 Å²	79	63.1 Å²	63.1	37%	0.369	30%	0.301	S	S	.	.	H	α-helix	trans	-69.7	-36.3	176.6	-74	170.9	-174.1	0	0	111.4	R320 L321 V327 S328	R320-E324 WeakPolarHBondContact CG-OE1 3.23Å; R320-E324 IonicContact CZ-OE1 3.89Å; R320-E324 IonicContact NE-OE1 3.98Å; R320-E324 PolarHBondContact NE-OE1 3.39Å; R320-E324 IonicContact NH2-OE1 3.91Å; R320-E324 WeakPolarHBondContact O-CG 3.26Å; R320-E324 PolarHBondContact O-N 2.94Å; L321-E324 PolarHBondContact O-N 3.02Å; E324-V327 PolarHBondContact O-N 3.3Å; E324-S328 WeakPolarHBondContact O-CB 3.31Å; E324-S328 PolarHBondContact O-N 3.15Å; E324-S328 PolarHBondContact O-OG 2.92Å
325	L	84.9	Confident	83.6	Confident	1 Å²	1	62.8 Å²	62.8	1%	0.005	30%	0.299	C	S	.	.	H	α-helix	trans	-67.3	-41.5	176.5	-158	153.1	0	0	0	111.8	L321 V322 S328 E329 W617 M618 W706 V710 L713	L321-L325 VanDerWaalsContact O-CB 3.27Å; L321-L325 WeakPolarHBondContact O-CB 3.39Å; L321-L325 PolarHBondContact O-N 3.34Å; V322-L325 PolarHBondContact O-N 2.66Å; L325-S328 WeakPolarHBondContact CA-OG 3.26Å; L325-S328 PolarHBondContact O-OG 2.8Å; L325-E329 WeakPolarHBondContact O-CB 3.4Å; L325-E329 PolarHBondContact O-N 3.37Å; L325-W617 HydrophobicContact CD1-CH2 4.37Å; L325-W617 HydrophobicContact CD1-CZ3 3.81Å; L325-W617 HydrophobicContact CD2-CZ3 4.12Å; L325-M618 HydrophobicContact CD2-CG 3.34Å; L325-M618 HydrophobicContact CD2-SD 3.3Å; L325-M618 WeakPolarHBondContact CD2-SD 3.48Å; L325-W706 HydrophobicContact CG-CG 4.41Å; L325-V710 HydrophobicContact CD1-CG2 3.67Å; L325-V710 HydrophobicContact CG-CG2 4.4Å; L325-L713 HydrophobicContact CD1-CD1 3.56Å
326	Y	84.8	Confident	84.3	Confident	55 Å²	55	54.9 Å²	54.9	22%	0.216	27%	0.265	C	S	.	.	H	α-helix	trans	-63.4	-47	172.4	170.6	-109.2	0	0	0	112.5	F307 L311 V322 S328 E329 E330 M618	F307-Y326 AromaticContact CE2-CE2 3.92Å; F307-Y326 HydrophobicContact CE2-CE2 3.92Å; F307-Y326 HydrophobicContact CZ-CE1 4.44Å; F307-Y326 AromaticContact CZ-CE2 3.72Å; F307-Y326 HydrophobicContact CZ-CE2 3.72Å; F307-Y326 AromaticContact CZ-CZ 3.62Å; F307-Y326 WeakPolarHBondContact CZ-OH 3.29Å; L311-Y326 HydrophobicContact CD2-CD1 4.17Å; L311-Y326 HydrophobicContact CD2-CE1 4.2Å; V322-Y326 PolarHBondContact O-N 2.91Å; Y326-S328 VanDerWaalsContact C-N 3.31Å; Y326-S328 PolarHBondContact O-N 3.06Å; Y326-E329 PolarHBondContact O-N 3.43Å; Y326-E330 HydrophobicContact CE2-CB 4.3Å; Y326-E330 VanDerWaalsContact O-CB 3.31Å; Y326-E330 WeakPolarHBondContact O-CB 3.39Å; Y326-E330 PolarHBondContact O-N 3.38Å; Y326-M618 HydrophobicContact CD2-CE 4.35Å
327	V	86.7	Confident	85	Confident	92 Å²	92	52.7 Å²	52.7	56%	0.558	25%	0.248	S	C	*	.	H	α-helix	trans	-65.4	-36.5	-179.3	170.8	0	0	0	0	111.8	S323 E324 G331	S323-V327 VanDerWaalsContact O-CG2 3.28Å; S323-V327 WeakPolarHBondContact O-CG2 3.42Å; S323-V327 PolarHBondContact O-N 3.05Å; S323-V327 VanDerWaalsContact O-N 3.13Å; E324-V327 PolarHBondContact O-N 3.3Å; V327-G331 PolarHBondContact O-N 2.78Å
328	S	86.5	Confident	85.7	Confident	2 Å²	2	50.8 Å²	50.8	1%	0.014	24%	0.243	C	C	.	.	H	α-helix	trans	-72.9	-37.8	176.8	51.5	0	0	0	0	112.7	E324 L325 Y326 W332 D702	E324-S328 WeakPolarHBondContact O-CB 3.31Å; E324-S328 PolarHBondContact O-N 3.15Å; E324-S328 PolarHBondContact O-OG 2.92Å; L325-S328 WeakPolarHBondContact CA-OG 3.26Å; L325-S328 PolarHBondContact O-OG 2.8Å; Y326-S328 VanDerWaalsContact C-N 3.31Å; Y326-S328 PolarHBondContact O-N 3.06Å; S328-W332 WeakPolarHBondContact O-CB 3.43Å; S328-W332 PolarHBondContact O-N 2.92Å; S328-D702 WeakPolarHBondContact CB-O 3.44Å
329	E	89.9	Confident	86.3	Confident	0 Å²	0	42.1 Å²	42.1	0%	0	21%	0.206	C	C	.	.	H	α-helix	trans	-63.6	-54	174.2	-172.8	-76.8	140	0	0	111.5	L325 Y326 G331 W332 F333 H611 Q614 M618	L325-E329 WeakPolarHBondContact O-CB 3.4Å; L325-E329 PolarHBondContact O-N 3.37Å; Y326-E329 PolarHBondContact O-N 3.43Å; E329-G331 VanDerWaalsContact C-N 3.28Å; E329-G331 PolarHBondContact O-N 3.26Å; E329-W332 PolarHBondContact O-N 3.1Å; E329-F333 WeakPolarHBondContact O-CB 3.26Å; E329-F333 PolarHBondContact O-N 2.73Å; E329-H611 IonicContact OE1-CE1 2.64Å; E329-H611 IonicContact OE1-CG 3.78Å; E329-H611 IonicContact OE1-ND1 3.72Å; E329-H611 PolarHBondContact OE1-ND1 3.26Å; E329-H611 IonicContact OE2-CE1 2.83Å; E329-H611 IonicContact OE2-ND1 3.17Å; E329-Q614 HydrophobicContact CG-CB 3.66Å; E329-Q614 HydrophobicContact CG-CG 4.42Å; E329-M618 HydrophobicContact CB-CE 4.11Å; E329-M618 HydrophobicContact CG-CE 3.82Å
330	E	87.8	Confident	86.9	Confident	44 Å²	44	40.8 Å²	40.8	21%	0.206	20%	0.199	C	C	.	.	H	α-helix	trans	-61.6	-38	178.3	-179.8	72.7	-158	0	0	111.7	Y326 K334	Y326-E330 HydrophobicContact CE2-CB 4.3Å; Y326-E330 VanDerWaalsContact O-CB 3.31Å; Y326-E330 WeakPolarHBondContact O-CB 3.39Å; Y326-E330 PolarHBondContact O-N 3.38Å; E330-K334 HydrophobicContact CG-CD 4.37Å; E330-K334 WeakPolarHBondContact O-CB 3.45Å; E330-K334 WeakPolarHBondContact O-CG 3.24Å; E330-K334 PolarHBondContact O-N 3.38Å; E330-K334 VanDerWaalsContact O-N 3.1Å; E330-K334 WeakPolarHBondContact OE1-CE 3.31Å; E330-K334 IonicContact OE1-NZ 2.77Å; E330-K334 PolarHBondContact OE1-NZ 2.97Å
331	G	88.1	Confident	87.5	Confident	11 Å²	11	36.6 Å²	36.6	11%	0.113	19%	0.189	C	C	.	.	H	α-helix	trans	-65.4	-44.6	175.2	0	0	0	0	0	112.5	V327 E329 T335	V327-G331 PolarHBondContact O-N 2.78Å; E329-G331 VanDerWaalsContact C-N 3.28Å; E329-G331 PolarHBondContact O-N 3.26Å; G331-T335 WeakPolarHBondContact O-CB 3.44Å; G331-T335 WeakPolarHBondContact O-CG2 3.27Å; G331-T335 PolarHBondContact O-N 3.5Å; G331-T335 VanDerWaalsContact O-N 3.12Å; G331-T335 PolarHBondContact O-OG1 3.14Å
332	W	93.4	Very high	88.1	Confident	1 Å²	1	35.1 Å²	35.1	0%	0.004	18%	0.18	C	C	.	.	H	α-helix	trans	-63.5	-47.9	175.1	-179.7	89.8	0	0	0	111.3	S328 E329 K334 T335 A336 V607 L610 L661 S665 L699 D702	S328-W332 WeakPolarHBondContact O-CB 3.43Å; S328-W332 PolarHBondContact O-N 2.92Å; E329-W332 PolarHBondContact O-N 3.1Å; W332-K334 PolarHBondContact O-N 2.9Å; W332-T335 WeakPolarHBondContact CA-OG1 3.41Å; W332-T335 PolarHBondContact O-N 3.35Å; W332-T335 PolarHBondContact O-OG1 3.4Å; W332-A336 HydrophobicContact CD2-CB 4.49Å; W332-A336 HydrophobicContact CE3-CB 4.48Å; W332-A336 HydrophobicContact CH2-CB 4.31Å; W332-A336 HydrophobicContact CZ2-CB 4.33Å; W332-A336 HydrophobicContact CZ3-CB 4.39Å; W332-A336 VanDerWaalsContact O-CB 3.24Å; W332-A336 WeakPolarHBondContact O-CB 3.23Å; W332-A336 PolarHBondContact O-N 2.86Å; W332-V607 HydrophobicContact CH2-CG1 4.23Å; W332-V607 HydrophobicContact CH2-CG2 4.31Å; W332-V607 HydrophobicContact CZ3-CG1 4.18Å; W332-L610 HydrophobicContact CH2-CB 4.46Å; W332-L610 HydrophobicContact CH2-CD1 3.75Å; W332-L610 HydrophobicContact CZ3-CB 4.33Å; W332-L610 HydrophobicContact CZ3-CD1 4.38Å; W332-L661 HydrophobicContact CD2-CD1 3.5Å; W332-L661 HydrophobicContact CE3-CD1 3.89Å; W332-L661 HydrophobicContact CG-CD1 4.02Å; W332-L661 HydrophobicContact CH2-CD1 3.98Å; W332-L661 HydrophobicContact CZ2-CD1 3.58Å; W332-L661 HydrophobicContact CZ3-CD1 4.11Å; W332-S665 PolarHBondContact NE1-OG 3.38Å; W332-L699 VanDerWaalsContact CD1-CD1 3.47Å; W332-L699 HydrophobicContact CD2-CD1 4.32Å; W332-L699 HydrophobicContact CG-CD1 4Å; W332-L699 WeakPolarHBondContact O-CD1 3.29Å; W332-D702 HydrophobicContact CB-CB 4.24Å
333	F	91.3	Very high	88.6	Confident	21 Å²	21	35 Å²	35	9%	0.092	18%	0.179	C	C	.	.	H	α-helix	trans	-61.7	-47.6	-178.3	177	-116.6	0	0	0	112.3	E329 T335 A336 Q337 V607 T608 H611	E329-F333 WeakPolarHBondContact O-CB 3.26Å; E329-F333 PolarHBondContact O-N 2.73Å; F333-T335 PolarHBondContact O-N 2.96Å; F333-A336 PolarHBondContact O-N 3.25Å; F333-Q337 HydrophobicContact CD2-CG 4.3Å; F333-Q337 HydrophobicContact CE1-CG 4.37Å; F333-Q337 HydrophobicContact CE2-CG 3.99Å; F333-Q337 VanDerWaalsContact CZ-CD 3.46Å; F333-Q337 HydrophobicContact CZ-CG 4.06Å; F333-Q337 WeakPolarHBondContact O-CG 3.45Å; F333-Q337 PolarHBondContact O-N 3.03Å; F333-V607 HydrophobicContact CD2-CG1 3.9Å; F333-V607 HydrophobicContact CE2-CG1 4.04Å; F333-T608 HydrophobicContact CE2-CG2 4.26Å; F333-T608 HydrophobicContact CZ-CG2 4.41Å; F333-H611 HydrophobicContact CD1-CB 4.49Å; F333-H611 AromaticContact CD1-CG 3.94Å; F333-H611 AromaticContact CD1-ND1 3.75Å; F333-H611 HydrophobicContact CD2-CB 3.46Å; F333-H611 VanDerWaalsContact CD2-CB 3.46Å; F333-H611 AromaticContact CD2-CG 3.81Å; F333-H611 AromaticContact CE1-CD2 3.96Å; F333-H611 HydrophobicContact CE2-CB 3.58Å; F333-H611 AromaticContact CE2-CG 3.87Å; F333-H611 HydrophobicContact CG-CB 3.92Å; F333-H611 AromaticContact CG-CG 3.81Å; F333-H611 AromaticContact CG-ND1 3.71Å; F333-H611 HydrophobicContact CZ-CB 4.14Å; F333-H611 AromaticContact CZ-CD2 3.91Å; F333-H611 AromaticContact CZ-CG 3.93Å
334	K	91.8	Very high	89	Confident	105 Å²	105	34.2 Å²	34.2	46%	0.457	17%	0.174	S	C	.	.	H	α-helix	trans	-60.1	-46.5	176.2	-79.4	172.3	165.3	148.3	0	112.2	E330 W332 A336 Q337 D338	E330-K334 HydrophobicContact CG-CD 4.37Å; E330-K334 WeakPolarHBondContact O-CB 3.45Å; E330-K334 WeakPolarHBondContact O-CG 3.24Å; E330-K334 PolarHBondContact O-N 3.38Å; E330-K334 VanDerWaalsContact O-N 3.1Å; E330-K334 WeakPolarHBondContact OE1-CE 3.31Å; E330-K334 IonicContact OE1-NZ 2.77Å; E330-K334 PolarHBondContact OE1-NZ 2.97Å; W332-K334 PolarHBondContact O-N 2.9Å; K334-A336 VanDerWaalsContact C-N 3.32Å; K334-A336 PolarHBondContact O-N 3.45Å; K334-Q337 PolarHBondContact O-N 3.26Å; K334-D338 VanDerWaalsContact O-CG 3.25Å; K334-D338 PolarHBondContact O-N 3.38Å
335	T	90	Very high	89.3	Confident	4 Å²	4	33.6 Å²	33.6	3%	0.025	18%	0.175	C	C	.	.	H	α-helix	trans	-67.5	-34.1	178.4	47.9	0	0	0	0	112.4	G331 W332 F333 C339 K698 L699	G331-T335 WeakPolarHBondContact O-CB 3.44Å; G331-T335 WeakPolarHBondContact O-CG2 3.27Å; G331-T335 PolarHBondContact O-N 3.5Å; G331-T335 VanDerWaalsContact O-N 3.12Å; G331-T335 PolarHBondContact O-OG1 3.14Å; W332-T335 WeakPolarHBondContact CA-OG1 3.41Å; W332-T335 PolarHBondContact O-N 3.35Å; W332-T335 PolarHBondContact O-OG1 3.4Å; F333-T335 PolarHBondContact O-N 2.96Å; T335-C339 WeakPolarHBondContact O-CB 3.44Å; T335-C339 PolarHBondContact O-N 2.73Å; T335-C339 PolarHBondContact O-SG 3.22Å; T335-K698 HydrophobicContact CG2-CB 4.39Å; T335-K698 HydrophobicContact CG2-CD 3.67Å; T335-K698 HydrophobicContact CG2-CG 4.02Å; T335-L699 WeakPolarHBondContact OG1-CD1 3.36Å
336	A	90.4	Very high	89.5	Confident	0 Å²	0	36 Å²	36	0%	0	19%	0.187	C	C	.	.	H	α-helix	trans	-63.9	-50.1	173.2	0	0	0	0	0	110.3	W332 F333 K334 D338 C339 L340 V607 I668 L699	W332-A336 HydrophobicContact CD2-CB 4.49Å; W332-A336 HydrophobicContact CE3-CB 4.48Å; W332-A336 HydrophobicContact CH2-CB 4.31Å; W332-A336 HydrophobicContact CZ2-CB 4.33Å; W332-A336 HydrophobicContact CZ3-CB 4.39Å; W332-A336 VanDerWaalsContact O-CB 3.24Å; W332-A336 WeakPolarHBondContact O-CB 3.23Å; W332-A336 PolarHBondContact O-N 2.86Å; F333-A336 PolarHBondContact O-N 3.25Å; K334-A336 VanDerWaalsContact C-N 3.32Å; K334-A336 PolarHBondContact O-N 3.45Å; A336-D338 PolarHBondContact O-N 3.44Å; A336-C339 CarbonylContact O-C 3.57Å; A336-C339 WeakPolarHBondContact O-CA 3.48Å; A336-C339 WeakPolarHBondContact O-CB 3.21Å; A336-C339 PolarHBondContact O-N 3.3Å; A336-C339 VanDerWaalsContact O-N 3.07Å; A336-L340 VanDerWaalsContact O-CG 3.31Å; A336-L340 WeakPolarHBondContact O-CG 3.37Å; A336-L340 PolarHBondContact O-N 2.8Å; A336-V607 HydrophobicContact CB-CG1 3.95Å; A336-I668 HydrophobicContact CB-CD1 4.05Å; A336-L699 HydrophobicContact CB-CD1 3.84Å
337	Q	91.4	Very high	89.7	Confident	57 Å²	57	33.5 Å²	33.5	27%	0.266	18%	0.177	S	C	.	.	H	α-helix	trans	-56.5	-46.5	175.9	-75.2	-170.9	-31.9	0	0	112.5	F333 K334 C339 L340 I341	F333-Q337 HydrophobicContact CD2-CG 4.3Å; F333-Q337 HydrophobicContact CE1-CG 4.37Å; F333-Q337 HydrophobicContact CE2-CG 3.99Å; F333-Q337 VanDerWaalsContact CZ-CD 3.46Å; F333-Q337 HydrophobicContact CZ-CG 4.06Å; F333-Q337 WeakPolarHBondContact O-CG 3.45Å; F333-Q337 PolarHBondContact O-N 3.03Å; K334-Q337 PolarHBondContact O-N 3.26Å; Q337-C339 PolarHBondContact O-N 2.94Å; Q337-L340 PolarHBondContact O-N 2.81Å; Q337-L340 VanDerWaalsContact O-N 3.16Å; Q337-I341 WeakPolarHBondContact O-CG1 3.21Å; Q337-I341 PolarHBondContact O-N 3.34Å
338	D	89.6	Confident	89.8	Confident	75 Å²	75	33.5 Å²	33.5	40%	0.401	17%	0.173	S	C	.	.	H	α-helix	trans	-59.9	-36.8	176.7	-69.6	-22.9	0	0	0	111.9	K334 A336 Y342	K334-D338 VanDerWaalsContact O-CG 3.25Å; K334-D338 PolarHBondContact O-N 3.38Å; A336-D338 PolarHBondContact O-N 3.44Å; D338-Y342 WeakPolarHBondContact O-CB 3.41Å; D338-Y342 PolarHBondContact O-N 3.27Å; D338-Y342 VanDerWaalsContact O-N 3.11Å
339	C	89.8	Confident	90	Very high	4 Å²	4	36.6 Å²	36.6	3%	0.027	19%	0.194	C	C	.	.	H	α-helix	trans	-72.5	-36.9	175.5	-67	0	0	0	0	112.5	T335 A336 Q337 Y342 I343 I668	T335-C339 WeakPolarHBondContact O-CB 3.44Å; T335-C339 PolarHBondContact O-N 2.73Å; T335-C339 PolarHBondContact O-SG 3.22Å; A336-C339 CarbonylContact O-C 3.57Å; A336-C339 WeakPolarHBondContact O-CA 3.48Å; A336-C339 WeakPolarHBondContact O-CB 3.21Å; A336-C339 PolarHBondContact O-N 3.3Å; A336-C339 VanDerWaalsContact O-N 3.07Å; Q337-C339 PolarHBondContact O-N 2.94Å; C339-Y342 WeakPolarHBondContact O-CB 3.43Å; C339-Y342 PolarHBondContact O-N 3.34Å; C339-I343 VanDerWaalsContact O-CG1 3.3Å; C339-I343 WeakPolarHBondContact O-CG1 3.38Å; C339-I343 PolarHBondContact O-N 3.34Å; C339-I668 HydrophobicContact CB-CG2 3.4Å; C339-I668 VanDerWaalsContact CB-CG2 3.4Å
340	L	90.7	Very high	90	Very high	8 Å²	8	37.6 Å²	37.6	4%	0.042	20%	0.199	C	C	.	.	H	α-helix	trans	-66.8	-40.7	176	-67.2	-170.9	0	0	0	112.2	A336 Q337 Y342 I343 S344 L603 Q604 V607 I668	A336-L340 VanDerWaalsContact O-CG 3.31Å; A336-L340 WeakPolarHBondContact O-CG 3.37Å; A336-L340 PolarHBondContact O-N 2.8Å; Q337-L340 PolarHBondContact O-N 2.81Å; Q337-L340 VanDerWaalsContact O-N 3.16Å; L340-Y342 VanDerWaalsContact C-N 3.3Å; L340-I343 HydrophobicContact CD2-CD1 4.45Å; L340-I343 PolarHBondContact O-N 3.4Å; L340-S344 PolarHBondContact O-N 3.24Å; L340-S344 PolarHBondContact O-OG 3.37Å; L340-S344 VanDerWaalsContact O-OG 3.09Å; L340-L603 HydrophobicContact CD1-CG 4.38Å; L340-L603 HydrophobicContact CD2-CD1 4.35Å; L340-L603 HydrophobicContact CD2-CD2 3.2Å; L340-L603 HydrophobicContact CD2-CG 3.46Å; L340-L603 VanDerWaalsContact CD2-CG 3.46Å; L340-Q604 HydrophobicContact CD1-CB 4.49Å; L340-V607 HydrophobicContact CD1-CB 4Å; L340-V607 HydrophobicContact CD1-CG1 4.3Å; L340-V607 HydrophobicContact CD1-CG2 3.87Å; L340-I668 HydrophobicContact CD2-CD1 4.11Å; L340-I668 HydrophobicContact CD2-CG1 4.02Å
341	I	90.1	Very high	90.1	Very high	97 Å²	97	36 Å²	36	50%	0.497	19%	0.192	S	C	.	.	H	α-helix	trans	-61.6	-44.1	172.2	-66.3	166.2	0	0	0	109.4	Q337 I343 S344 T345	Q337-I341 WeakPolarHBondContact O-CG1 3.21Å; Q337-I341 PolarHBondContact O-N 3.34Å; I341-I343 PolarHBondContact O-N 2.9Å; I341-S344 PolarHBondContact O-N 2.82Å; I341-S344 PolarHBondContact O-OG 2.87Å; I341-T345 HydrophobicContact CG2-CG2 4.16Å; I341-T345 WeakPolarHBondContact O-CB 3.49Å; I341-T345 VanDerWaalsContact O-CG2 3.25Å; I341-T345 WeakPolarHBondContact O-CG2 3.43Å; I341-T345 PolarHBondContact O-N 2.87Å; I341-T345 PolarHBondContact O-OG1 3.47Å
342	Y	89.6	Confident	90.1	Very high	26 Å²	26	40.4 Å²	40.4	10%	0.102	21%	0.213	C	C	.	.	H	α-helix	trans	-59.9	-47.6	177.3	178.9	-109.4	0	0	0	112.6	D338 C339 L340 T345 Q346 I675	D338-Y342 WeakPolarHBondContact O-CB 3.41Å; D338-Y342 PolarHBondContact O-N 3.27Å; D338-Y342 VanDerWaalsContact O-N 3.11Å; C339-Y342 WeakPolarHBondContact O-CB 3.43Å; C339-Y342 PolarHBondContact O-N 3.34Å; L340-Y342 VanDerWaalsContact C-N 3.3Å; Y342-T345 WeakPolarHBondContact CA-OG1 3.42Å; Y342-T345 PolarHBondContact O-N 3.04Å; Y342-T345 PolarHBondContact O-OG1 3.43Å; Y342-Q346 WeakPolarHBondContact O-CB 3.39Å; Y342-Q346 PolarHBondContact O-N 3.03Å; Y342-I675 HydrophobicContact CD1-CD1 4.24Å; Y342-I675 HydrophobicContact CE1-CB 4.05Å; Y342-I675 HydrophobicContact CE1-CD1 4.04Å; Y342-I675 HydrophobicContact CE1-CG2 3.66Å; Y342-I675 VanDerWaalsContact OH-CG2 3.26Å; Y342-I675 WeakPolarHBondContact OH-CG2 3.37Å
343	I	88.8	Confident	90	Very high	0 Å²	0	43 Å²	43	0%	0	23%	0.229	C	C	.	.	H	α-helix	trans	-58.1	-51.2	176.4	-68.1	161.8	0	0	0	110.4	C339 L340 I341 T345 Q346 D347 I675	C339-I343 VanDerWaalsContact O-CG1 3.3Å; C339-I343 WeakPolarHBondContact O-CG1 3.38Å; C339-I343 PolarHBondContact O-N 3.34Å; L340-I343 HydrophobicContact CD2-CD1 4.45Å; L340-I343 PolarHBondContact O-N 3.4Å; I341-I343 PolarHBondContact O-N 2.9Å; I343-T345 PolarHBondContact O-N 3.21Å; I343-Q346 PolarHBondContact O-N 2.88Å; I343-D347 PolarHBondContact O-N 3.36Å; I343-I675 HydrophobicContact CB-CD1 4.34Å; I343-I675 HydrophobicContact CG1-CD1 3.92Å
344	S	89.8	Confident	90	Very high	36 Å²	36	42 Å²	42	25%	0.252	22%	0.224	S	C	.	.	H	α-helix	trans	-64.7	-39.2	-178.3	61.3	0	0	0	0	113	L340 I341 Q346 D347 I348	L340-S344 PolarHBondContact O-N 3.24Å; L340-S344 PolarHBondContact O-OG 3.37Å; L340-S344 VanDerWaalsContact O-OG 3.09Å; I341-S344 PolarHBondContact O-N 2.82Å; I341-S344 PolarHBondContact O-OG 2.87Å; S344-Q346 VanDerWaalsContact C-N 3.32Å; S344-Q346 PolarHBondContact O-N 3.33Å; S344-D347 PolarHBondContact O-N 2.9Å; S344-I348 WeakPolarHBondContact O-CD1 3.42Å; S344-I348 VanDerWaalsContact O-CG1 3.27Å; S344-I348 WeakPolarHBondContact O-CG1 3.37Å; S344-I348 PolarHBondContact O-N 2.91Å
345	T	89.8	Confident	89.9	Confident	66 Å²	66	40.1 Å²	40.1	41%	0.405	22%	0.221	S	C	.	.	H	α-helix	trans	-62.9	-39.8	175.2	54.1	0	0	0	0	112.3	I341 Y342 I343 C349	I341-T345 HydrophobicContact CG2-CG2 4.16Å; I341-T345 WeakPolarHBondContact O-CB 3.49Å; I341-T345 VanDerWaalsContact O-CG2 3.25Å; I341-T345 WeakPolarHBondContact O-CG2 3.43Å; I341-T345 PolarHBondContact O-N 2.87Å; I341-T345 PolarHBondContact O-OG1 3.47Å; Y342-T345 WeakPolarHBondContact CA-OG1 3.42Å; Y342-T345 PolarHBondContact O-N 3.04Å; Y342-T345 PolarHBondContact O-OG1 3.43Å; I343-T345 PolarHBondContact O-N 3.21Å; T345-C349 PolarHBondContact O-N 2.96Å; T345-C349 VanDerWaalsContact O-N 3.14Å; T345-C349 PolarHBondContact O-SG 3.03Å
346	Q	89	Confident	89.9	Confident	53 Å²	53	46.2 Å²	46.2	25%	0.248	25%	0.25	C	C	.	.	H	α-helix	trans	-69.8	-41.7	177.8	-176	63.1	36.8	0	0	111.2	Y342 I343 S344 I348 C349 D350 I675	Y342-Q346 WeakPolarHBondContact O-CB 3.39Å; Y342-Q346 PolarHBondContact O-N 3.03Å; I343-Q346 PolarHBondContact O-N 2.88Å; S344-Q346 VanDerWaalsContact C-N 3.32Å; S344-Q346 PolarHBondContact O-N 3.33Å; Q346-I348 VanDerWaalsContact C-N 3.3Å; Q346-I348 PolarHBondContact O-N 3.49Å; Q346-C349 WeakPolarHBondContact O-CB 3.47Å; Q346-C349 PolarHBondContact O-N 3.31Å; Q346-C349 VanDerWaalsContact O-N 3.15Å; Q346-D350 WeakPolarHBondContact CG-OD2 3.38Å; Q346-D350 PolarHBondContact NE2-OD1 3.23Å; Q346-D350 VanDerWaalsContact NE2-OD1 3.11Å; Q346-D350 PolarHBondContact NE2-OD2 3.43Å; Q346-D350 PolarHBondContact O-N 3.12Å; Q346-D350 VanDerWaalsContact O-OD2 3.09Å; Q346-I675 HydrophobicContact CB-CD1 4.03Å; Q346-I675 HydrophobicContact CB-CG2 4.29Å; Q346-I675 HydrophobicContact CG-CD1 4.18Å; Q346-I675 HydrophobicContact CG-CG1 4.11Å; Q346-I675 HydrophobicContact CG-CG2 3.69Å
347	D	89.1	Confident	89.8	Confident	1 Å²	1	47.2 Å²	47.2	1%	0.005	26%	0.255	C	S	.	.	H	α-helix	trans	-60.1	-41.3	176.9	-64.7	-25.6	0	0	0	111.6	I343 S344 D350 L351 R466 H467 N600	I343-D347 PolarHBondContact O-N 3.36Å; S344-D347 PolarHBondContact O-N 2.9Å; D347-D350 PolarHBondContact O-N 2.71Å; D347-L351 WeakPolarHBondContact O-CB 3.13Å; D347-L351 WeakPolarHBondContact O-CD1 3.41Å; D347-L351 WeakPolarHBondContact O-CG 3.49Å; D347-L351 PolarHBondContact O-N 3.44Å; D347-R466 IonicContact OD1-CZ 3.56Å; D347-R466 IonicContact OD1-NH1 3.92Å; D347-R466 PolarHBondContact OD1-NH1 3.03Å; D347-H467 IonicContact OD1-NE2 2.85Å; D347-H467 IonicContact OD2-CD2 2.86Å; D347-H467 IonicContact OD2-CE1 3.87Å; D347-H467 PolarHBondContact OD2-CE1 3.45Å; D347-H467 IonicContact OD2-NE2 2.67Å; D347-H467 PolarHBondContact OD2-NE2 3.03Å; D347-N600 PolarHBondContact OD2-ND2 3.27Å
348	I	89.9	Confident	89.6	Confident	93 Å²	93	44.7 Å²	44.7	48%	0.477	24%	0.243	S	C	.	.	H	α-helix	trans	-60.6	-46.5	174.3	-66.8	163.5	0	0	0	110.6	S344 Q346 D350 L351 D352	S344-I348 WeakPolarHBondContact O-CD1 3.42Å; S344-I348 VanDerWaalsContact O-CG1 3.27Å; S344-I348 WeakPolarHBondContact O-CG1 3.37Å; S344-I348 PolarHBondContact O-N 2.91Å; Q346-I348 VanDerWaalsContact C-N 3.3Å; Q346-I348 PolarHBondContact O-N 3.49Å; I348-D350 PolarHBondContact O-N 3.08Å; I348-L351 PolarHBondContact O-N 2.92Å; I348-D352 PolarHBondContact O-N 3.01Å
349	C	90.1	Very high	89.4	Confident	67 Å²	67	44 Å²	44	45%	0.453	24%	0.24	S	C	.	.	H	α-helix	trans	-62	-42.5	179.3	-66.6	0	0	0	0	112	T345 Q346 D352 V353	T345-C349 PolarHBondContact O-N 2.96Å; T345-C349 VanDerWaalsContact O-N 3.14Å; T345-C349 PolarHBondContact O-SG 3.03Å; Q346-C349 WeakPolarHBondContact O-CB 3.47Å; Q346-C349 PolarHBondContact O-N 3.31Å; Q346-C349 VanDerWaalsContact O-N 3.15Å; C349-D352 PolarHBondContact O-N 3.49Å; C349-V353 WeakPolarHBondContact O-CG2 3.44Å; C349-V353 PolarHBondContact O-N 2.7Å; C349-V353 VanDerWaalsContact O-N 3.1Å
350	D	89.1	Confident	89.4	Confident	20 Å²	20	50.4 Å²	50.4	11%	0.107	26%	0.263	C	S	.	.	H	α-helix	trans	-70.9	-34.3	179.1	-67	-43.1	0	0	0	112.3	Q346 D347 I348 V353 I354 I459 I463 R466	Q346-D350 WeakPolarHBondContact CG-OD2 3.38Å; Q346-D350 PolarHBondContact NE2-OD1 3.23Å; Q346-D350 VanDerWaalsContact NE2-OD1 3.11Å; Q346-D350 PolarHBondContact NE2-OD2 3.43Å; Q346-D350 PolarHBondContact O-N 3.12Å; Q346-D350 VanDerWaalsContact O-OD2 3.09Å; D347-D350 PolarHBondContact O-N 2.71Å; I348-D350 PolarHBondContact O-N 3.08Å; D350-V353 PolarHBondContact O-N 3.09Å; D350-I354 VanDerWaalsContact O-CG1 3.29Å; D350-I354 WeakPolarHBondContact O-CG1 3.38Å; D350-I354 PolarHBondContact O-N 3.14Å; D350-I459 HydrophobicContact CB-CG2 3.71Å; D350-I463 HydrophobicContact CB-CD1 3.76Å; D350-I463 HydrophobicContact CB-CG1 4.02Å; D350-R466 IonicContact OD2-CZ 3.9Å; D350-R466 IonicContact OD2-NH1 3.08Å; D350-R466 PolarHBondContact OD2-NH1 3.23Å; D350-R466 IonicContact OD2-NH2 3.95Å; D350-R466 PolarHBondContact OD2-NH2 3.17Å
351	L	89.8	Confident	89.3	Confident	10 Å²	10	50.2 Å²	50.2	5%	0.052	26%	0.262	C	S	.	.	H	α-helix	trans	-64	-42.4	172	-73.6	166.7	0	0	0	111.5	D347 I348 V353 I354 V355 I463 L592 F593 T596	D347-L351 WeakPolarHBondContact O-CB 3.13Å; D347-L351 WeakPolarHBondContact O-CD1 3.41Å; D347-L351 WeakPolarHBondContact O-CG 3.49Å; D347-L351 PolarHBondContact O-N 3.44Å; I348-L351 PolarHBondContact O-N 2.92Å; L351-V353 VanDerWaalsContact C-N 3.31Å; L351-V353 PolarHBondContact O-N 3.22Å; L351-I354 PolarHBondContact O-N 3.48Å; L351-V355 WeakPolarHBondContact O-CG2 3.45Å; L351-V355 PolarHBondContact O-N 3.28Å; L351-I463 HydrophobicContact CD2-CD1 3.99Å; L351-I463 HydrophobicContact CG-CD1 4.04Å; L351-L592 HydrophobicContact CD2-CB 3.77Å; L351-F593 HydrophobicContact CD1-CD2 4.04Å; L351-T596 HydrophobicContact CD1-CG2 4.47Å; L351-T596 WeakPolarHBondContact CD1-OG1 3.32Å
352	D	89.7	Confident	89	Confident	104 Å²	104	49 Å²	49	56%	0.556	25%	0.251	S	S	*	.	H	α-helix	trans	-59.5	-44.1	174.8	-74.5	-21.6	0	0	0	110.9	I348 C349 V355 E356	I348-D352 PolarHBondContact O-N 3.01Å; C349-D352 PolarHBondContact O-N 3.49Å; D352-V355 PolarHBondContact O-N 3.45Å; D352-E356 PolarHBondContact O-N 2.91Å
353	V	91.3	Very high	88.8	Confident	56 Å²	56	52 Å²	52	34%	0.339	27%	0.269	S	S	.	.	H	α-helix	trans	-64	-41.2	175.4	174.7	0	0	0	0	111.6	C349 D350 L351 E356 L357 I459	C349-V353 WeakPolarHBondContact O-CG2 3.44Å; C349-V353 PolarHBondContact O-N 2.7Å; C349-V353 VanDerWaalsContact O-N 3.1Å; D350-V353 PolarHBondContact O-N 3.09Å; L351-V353 VanDerWaalsContact C-N 3.31Å; L351-V353 PolarHBondContact O-N 3.22Å; V353-E356 PolarHBondContact O-N 2.93Å; V353-L357 HydrophobicContact CG1-CD1 3.76Å; V353-L357 HydrophobicContact CG1-CG 4.15Å; V353-L357 WeakPolarHBondContact O-CB 3.33Å; V353-L357 VanDerWaalsContact O-CG 3.27Å; V353-L357 WeakPolarHBondContact O-CG 3.18Å; V353-L357 PolarHBondContact O-N 3.48Å; V353-I459 HydrophobicContact CG1-CD1 3.6Å
354	I	89.8	Confident	88.6	Confident	0 Å²	0	53.5 Å²	53.5	0%	0	28%	0.276	C	S	.	.	H	α-helix	trans	-61.3	-44.6	175.6	-74.2	166.8	0	0	0	110.6	D350 L351 E356 L357 T358 I459 I463 P589 L592	D350-I354 VanDerWaalsContact O-CG1 3.29Å; D350-I354 WeakPolarHBondContact O-CG1 3.38Å; D350-I354 PolarHBondContact O-N 3.14Å; L351-I354 PolarHBondContact O-N 3.48Å; I354-E356 PolarHBondContact O-N 3.44Å; I354-L357 PolarHBondContact O-N 3.28Å; I354-T358 VanDerWaalsContact O-CB 3.26Å; I354-T358 WeakPolarHBondContact O-CB 3.44Å; I354-T358 PolarHBondContact O-N 2.78Å; I354-T358 PolarHBondContact O-OG1 3.45Å; I354-I459 HydrophobicContact CD1-CB 4.23Å; I354-I459 HydrophobicContact CD1-CG2 3.78Å; I354-I459 HydrophobicContact CG1-CB 3.99Å; I354-I459 HydrophobicContact CG1-CG2 3.74Å; I354-I463 HydrophobicContact CD1-CD1 3.42Å; I354-I463 VanDerWaalsContact CD1-CD1 3.42Å; I354-P589 HydrophobicContact CG2-CB 4.23Å; I354-P589 HydrophobicContact CG2-CG 3.98Å; I354-L592 HydrophobicContact CD1-CD1 4.09Å
355	V	89.4	Confident	88.3	Confident	65 Å²	65	52.5 Å²	52.5	39%	0.394	27%	0.268	S	S	.	.	H	α-helix	trans	-61.5	-45.3	178	170.8	0	0	0	0	110.5	L351 D352 T358 N359 P589	L351-V355 WeakPolarHBondContact O-CG2 3.45Å; L351-V355 PolarHBondContact O-N 3.28Å; D352-V355 PolarHBondContact O-N 3.45Å; V355-T358 PolarHBondContact O-N 3.33Å; V355-N359 WeakPolarHBondContact O-CB 3.34Å; V355-N359 VanDerWaalsContact O-CG 3.25Å; V355-N359 PolarHBondContact O-N 3Å; V355-N359 PolarHBondContact O-ND2 3.27Å; V355-N359 VanDerWaalsContact O-ND2 3.15Å; V355-P589 HydrophobicContact CG2-CB 3.88Å
356	E	90.6	Very high	87.9	Confident	132 Å²	132	53.7 Å²	53.7	62%	0.617	27%	0.271	S	S	*	.	H	α-helix	trans	-61	-49.7	176.9	-169.4	-170.5	156.5	0	0	111.8	D352 V353 I354 T358 N359 R360	D352-E356 PolarHBondContact O-N 2.91Å; V353-E356 PolarHBondContact O-N 2.93Å; I354-E356 PolarHBondContact O-N 3.44Å; E356-T358 PolarHBondContact O-N 2.93Å; E356-N359 PolarHBondContact O-N 2.85Å; E356-R360 WeakPolarHBondContact O-CB 3.38Å; E356-R360 PolarHBondContact O-N 3.05Å
357	L	89.1	Confident	87.6	Confident	22 Å²	22	56 Å²	56	12%	0.115	29%	0.285	C	S	.	.	H	α-helix	trans	-64.8	-37.2	179.9	-70.1	174.6	0	0	0	112.4	V353 I354 R360 W361 T452 K455 F456 I459	V353-L357 HydrophobicContact CG1-CD1 3.76Å; V353-L357 HydrophobicContact CG1-CG 4.15Å; V353-L357 WeakPolarHBondContact O-CB 3.33Å; V353-L357 VanDerWaalsContact O-CG 3.27Å; V353-L357 WeakPolarHBondContact O-CG 3.18Å; V353-L357 PolarHBondContact O-N 3.48Å; I354-L357 PolarHBondContact O-N 3.28Å; L357-R360 PolarHBondContact O-N 3.21Å; L357-W361 VanDerWaalsContact O-CB 3.29Å; L357-W361 WeakPolarHBondContact O-CB 3.33Å; L357-W361 PolarHBondContact O-N 3.08Å; L357-T452 HydrophobicContact CB-CG2 4.39Å; L357-T452 HydrophobicContact CD2-CG2 4.23Å; L357-T452 WeakPolarHBondContact O-CG2 3.48Å; L357-K455 HydrophobicContact CD1-CB 4.05Å; L357-F456 HydrophobicContact CB-CB 3.77Å; L357-F456 HydrophobicContact CD1-CB 3.96Å; L357-I459 HydrophobicContact CD1-CD1 3.83Å
358	T	86.7	Confident	87.2	Confident	3 Å²	3	56 Å²	56	2%	0.018	29%	0.285	C	S	.	.	H	α-helix	trans	-66.2	-42.2	177.1	-55.5	0	0	0	0	110.8	I354 V355 E356 W361 R362 L586 P589	I354-T358 VanDerWaalsContact O-CB 3.26Å; I354-T358 WeakPolarHBondContact O-CB 3.44Å; I354-T358 PolarHBondContact O-N 2.78Å; I354-T358 PolarHBondContact O-OG1 3.45Å; V355-T358 PolarHBondContact O-N 3.33Å; E356-T358 PolarHBondContact O-N 2.93Å; T358-W361 PolarHBondContact O-N 2.78Å; T358-R362 PolarHBondContact O-N 2.91Å; T358-L586 HydrophobicContact CG2-CD2 3.81Å; T358-P589 HydrophobicContact CG2-CG 4.3Å
359	N	85.7	Confident	86.7	Confident	62 Å²	62	53.2 Å²	53.2	33%	0.332	27%	0.27	S	S	.	.	H	α-helix	trans	-64.9	-46.1	175	-70.7	-30	0	0	0	111.3	V355 E356 W361 R362 D363	V355-N359 WeakPolarHBondContact O-CB 3.34Å; V355-N359 VanDerWaalsContact O-CG 3.25Å; V355-N359 PolarHBondContact O-N 3Å; V355-N359 PolarHBondContact O-ND2 3.27Å; V355-N359 VanDerWaalsContact O-ND2 3.15Å; E356-N359 PolarHBondContact O-N 2.85Å; N359-W361 VanDerWaalsContact C-N 3.32Å; N359-W361 PolarHBondContact O-N 3.21Å; N359-R362 WeakPolarHBondContact O-CB 3.39Å; N359-R362 PolarHBondContact O-N 2.68Å; N359-R362 VanDerWaalsContact O-N 3.14Å; N359-R362 PolarHBondContact OD1-NH1 3.42Å; N359-R362 PolarHBondContact OD1-NH2 2.87Å; N359-D363 PolarHBondContact O-N 3.4Å
360	R	88.6	Confident	86.1	Confident	137 Å²	137	56.7 Å²	56.7	52%	0.517	28%	0.278	S	S	.	.	H	α-helix	trans	-59.5	-42.2	175.8	-178.5	178.6	177.1	172.5	2.5	112.3	E356 L357 R362 D363 Q364	E356-R360 WeakPolarHBondContact O-CB 3.38Å; E356-R360 PolarHBondContact O-N 3.05Å; L357-R360 PolarHBondContact O-N 3.21Å; R360-R362 VanDerWaalsContact C-N 3.32Å; R360-D363 PolarHBondContact O-N 2.92Å; R360-Q364 HydrophobicContact CG-CG 4.48Å; R360-Q364 WeakPolarHBondContact O-CB 3.42Å; R360-Q364 VanDerWaalsContact O-CG 3.26Å; R360-Q364 WeakPolarHBondContact O-CG 3.25Å; R360-Q364 PolarHBondContact O-N 3.27Å
361	W	88.8	Confident	85.8	Confident	4 Å²	4	57.1 Å²	57.1	2%	0.015	28%	0.279	C	S	.	.	H	α-helix	trans	-61.1	-43	176.1	-179.9	88.5	0	0	0	111.2	L357 T358 N359 D363 Q364 L365 L449 T452 F456 V488 V580 V585	L357-W361 VanDerWaalsContact O-CB 3.29Å; L357-W361 WeakPolarHBondContact O-CB 3.33Å; L357-W361 PolarHBondContact O-N 3.08Å; T358-W361 PolarHBondContact O-N 2.78Å; N359-W361 VanDerWaalsContact C-N 3.32Å; N359-W361 PolarHBondContact O-N 3.21Å; W361-D363 PolarHBondContact O-N 2.96Å; W361-Q364 PolarHBondContact O-N 2.79Å; W361-L365 HydrophobicContact CH2-CD2 3.73Å; W361-L365 HydrophobicContact CZ2-CD2 4.34Å; W361-L365 HydrophobicContact CZ3-CD2 3.92Å; W361-L365 WeakPolarHBondContact O-CB 3.42Å; W361-L365 PolarHBondContact O-N 3.28Å; W361-L449 VanDerWaalsContact CD1-O 3.31Å; W361-L449 HydrophobicContact CZ2-CD2 4.13Å; W361-T452 HydrophobicContact CB-CG2 3.82Å; W361-F456 HydrophobicContact CB-CE1 4.22Å; W361-F456 HydrophobicContact CG-CE1 4.07Å; W361-V488 HydrophobicContact CH2-CG1 4.22Å; W361-V488 HydrophobicContact CZ2-CG1 3.68Å; W361-V580 HydrophobicContact CH2-CG1 4.39Å; W361-V580 HydrophobicContact CZ3-CG1 4.07Å; W361-V585 HydrophobicContact CZ3-CG1 4.38Å
362	R	84.4	Confident	85.1	Confident	72 Å²	72	56.9 Å²	56.9	27%	0.272	28%	0.278	S	S	.	.	H	α-helix	trans	-59.3	-47.7	175.3	-169.6	-166.9	-60.1	109.5	-4.4	111.4	T358 N359 R360 L365 I366	T358-R362 PolarHBondContact O-N 2.91Å; N359-R362 WeakPolarHBondContact O-CB 3.39Å; N359-R362 PolarHBondContact O-N 2.68Å; N359-R362 VanDerWaalsContact O-N 3.14Å; N359-R362 PolarHBondContact OD1-NH1 3.42Å; N359-R362 PolarHBondContact OD1-NH2 2.87Å; R360-R362 VanDerWaalsContact C-N 3.32Å; R362-L365 WeakPolarHBondContact O-CB 3.48Å; R362-L365 PolarHBondContact O-N 3.42Å; R362-I366 HydrophobicContact CG-CD1 4.05Å; R362-I366 WeakPolarHBondContact O-CG1 3.27Å; R362-I366 PolarHBondContact O-N 3.35Å
363	D	84.5	Confident	84.4	Confident	90 Å²	90	55.5 Å²	55.5	48%	0.481	27%	0.267	S	S	.	.	H	α-helix	trans	-64.5	-42.7	-179.7	-63.7	-20.1	0	0	0	111.1	N359 R360 W361 L365 I366 D367	N359-D363 PolarHBondContact O-N 3.4Å; R360-D363 PolarHBondContact O-N 2.92Å; W361-D363 PolarHBondContact O-N 2.96Å; D363-L365 VanDerWaalsContact C-N 3.3Å; D363-L365 PolarHBondContact O-N 2.9Å; D363-I366 PolarHBondContact O-N 2.59Å; D363-D367 WeakPolarHBondContact O-CB 3.18Å; D363-D367 PolarHBondContact O-N 3.44Å
364	Q	85.9	Confident	83.7	Confident	31 Å²	31	59 Å²	59	15%	0.145	28%	0.277	C	S	.	.	H	α-helix	trans	-59.7	-39.3	173.9	-74.3	177.7	-43.2	0	0	112.4	R360 W361 L368 L449 T452	R360-Q364 HydrophobicContact CG-CG 4.48Å; R360-Q364 WeakPolarHBondContact O-CB 3.42Å; R360-Q364 VanDerWaalsContact O-CG 3.26Å; R360-Q364 WeakPolarHBondContact O-CG 3.25Å; R360-Q364 PolarHBondContact O-N 3.27Å; W361-Q364 PolarHBondContact O-N 2.79Å; Q364-L368 VanDerWaalsContact O-CB 3.26Å; Q364-L368 WeakPolarHBondContact O-CB 3.44Å; Q364-L368 PolarHBondContact O-N 3.18Å; Q364-L449 HydrophobicContact CB-CD1 4.48Å; Q364-T452 PolarHBondContact OE1-OG1 2.77Å
365	L	83.1	Confident	83	Confident	15 Å²	15	60.2 Å²	60.2	8%	0.079	28%	0.284	C	S	.	.	H	α-helix	trans	-65.3	-47.4	176.2	-176.9	65.1	0	0	0	111	W361 R362 D363 D367 L368 M369 L449 L492 L576	W361-L365 HydrophobicContact CH2-CD2 3.73Å; W361-L365 HydrophobicContact CZ2-CD2 4.34Å; W361-L365 HydrophobicContact CZ3-CD2 3.92Å; W361-L365 WeakPolarHBondContact O-CB 3.42Å; W361-L365 PolarHBondContact O-N 3.28Å; R362-L365 WeakPolarHBondContact O-CB 3.48Å; R362-L365 PolarHBondContact O-N 3.42Å; D363-L365 VanDerWaalsContact C-N 3.3Å; D363-L365 PolarHBondContact O-N 2.9Å; L365-D367 VanDerWaalsContact C-N 3.35Å; L365-D367 PolarHBondContact O-N 3.47Å; L365-L368 PolarHBondContact O-N 2.92Å; L365-M369 HydrophobicContact CG-SD 4.19Å; L365-M369 VanDerWaalsContact O-CG 3.27Å; L365-M369 WeakPolarHBondContact O-CG 3.35Å; L365-M369 PolarHBondContact O-N 3.38Å; L365-L449 HydrophobicContact CB-CD1 3.79Å; L365-L449 HydrophobicContact CD1-CD1 3.77Å; L365-L449 HydrophobicContact CG-CD1 4.4Å; L365-L492 HydrophobicContact CD1-CD2 4.36Å; L365-L576 HydrophobicContact CD2-CD2 4.36Å
366	I	80.3	Confident	82.3	Confident	91 Å²	91	58.5 Å²	58.5	47%	0.467	27%	0.272	S	S	.	.	H	α-helix	trans	-59.7	-45.9	177.9	-68.4	166.3	0	0	0	110.7	R362 D363 L368 M369 F370	R362-I366 HydrophobicContact CG-CD1 4.05Å; R362-I366 WeakPolarHBondContact O-CG1 3.27Å; R362-I366 PolarHBondContact O-N 3.35Å; D363-I366 PolarHBondContact O-N 2.59Å; I366-L368 VanDerWaalsContact C-N 3.32Å; I366-L368 PolarHBondContact O-N 3.48Å; I366-M369 PolarHBondContact O-N 3.47Å; I366-F370 WeakPolarHBondContact O-CB 3.46Å; I366-F370 PolarHBondContact O-N 2.98Å
367	D	82.6	Confident	81.5	Confident	100 Å²	100	55.9 Å²	55.9	54%	0.535	26%	0.261	S	S	.	.	H	α-helix	trans	-62.8	-37.8	178.6	-81.3	-14.5	0	0	0	112.6	D363 L365 F371 R445	D363-D367 WeakPolarHBondContact O-CB 3.18Å; D363-D367 PolarHBondContact O-N 3.44Å; L365-D367 VanDerWaalsContact C-N 3.35Å; L365-D367 PolarHBondContact O-N 3.47Å; D367-F371 VanDerWaalsContact O-CB 3.25Å; D367-F371 WeakPolarHBondContact O-CB 3.26Å; D367-F371 PolarHBondContact O-N 3.21Å; D367-R445 PolarHBondContact O-NH1 3.35Å
368	L	82.6	Confident	80.8	Confident	3 Å²	3	57.1 Å²	57.1	2%	0.016	27%	0.27	C	S	.	.	H	α-helix	trans	-68.9	-42.6	176.4	-173.4	154.8	0	0	0	110.8	Q364 L365 I366 F371 V372 F442 R445 L446 L449 Y495	Q364-L368 VanDerWaalsContact O-CB 3.26Å; Q364-L368 WeakPolarHBondContact O-CB 3.44Å; Q364-L368 PolarHBondContact O-N 3.18Å; L365-L368 PolarHBondContact O-N 2.92Å; I366-L368 VanDerWaalsContact C-N 3.32Å; I366-L368 PolarHBondContact O-N 3.48Å; L368-F371 WeakPolarHBondContact O-CB 3.38Å; L368-F371 PolarHBondContact O-N 3.17Å; L368-V372 WeakPolarHBondContact O-CG2 3.3Å; L368-V372 PolarHBondContact O-N 3.27Å; L368-V372 VanDerWaalsContact O-N 3.08Å; L368-F442 HydrophobicContact CD2-CD2 4.46Å; L368-F442 HydrophobicContact CD2-CE2 3.79Å; L368-F442 HydrophobicContact CG-CE2 4.27Å; L368-R445 HydrophobicContact CD1-CB 3.89Å; L368-R445 HydrophobicContact CG-CB 4.45Å; L368-L446 HydrophobicContact CD1-CB 3.99Å; L368-L449 HydrophobicContact CD1-CD1 4.44Å; L368-Y495 HydrophobicContact CD2-CD1 3.92Å; L368-Y495 HydrophobicContact CD2-CE1 3.26Å
369	M	78.8	Confident	80.2	Confident	34 Å²	34	58 Å²	58	17%	0.167	27%	0.274	C	S	.	.	H	α-helix	trans	-63.8	-45.4	175.6	-69.7	176.8	79.3	0	0	112.2	L365 I366 F371 V372 K373 I573 L576	L365-M369 HydrophobicContact CG-SD 4.19Å; L365-M369 VanDerWaalsContact O-CG 3.27Å; L365-M369 WeakPolarHBondContact O-CG 3.35Å; L365-M369 PolarHBondContact O-N 3.38Å; I366-M369 PolarHBondContact O-N 3.47Å; M369-F371 VanDerWaalsContact C-N 3.29Å; M369-F371 PolarHBondContact O-N 3.3Å; M369-V372 PolarHBondContact O-N 3.3Å; M369-K373 PolarHBondContact O-N 2.89Å; M369-I573 HydrophobicContact CE-CB 4.48Å; M369-I573 HydrophobicContact CE-CG1 3.71Å; M369-L576 HydrophobicContact CE-CB 4.21Å; M369-L576 HydrophobicContact CE-CD2 4.15Å; M369-L576 HydrophobicContact SD-CD2 4.04Å
370	F	77.9	Confident	79.8	Confident	139 Å²	139	58.5 Å²	58.5	61%	0.61	27%	0.273	S	S	*	.	H	α-helix	trans	-62.6	-39	177	-176	-97.9	0	0	0	111.6	I366 K373 K374	I366-F370 WeakPolarHBondContact O-CB 3.46Å; I366-F370 PolarHBondContact O-N 2.98Å; F370-K373 PolarHBondContact O-N 3.41Å; F370-K374 WeakPolarHBondContact O-CB 3.5Å; F370-K374 PolarHBondContact O-N 2.8Å
371	F	81.3	Confident	79.3	Confident	30 Å²	30	58.2 Å²	58.2	13%	0.132	28%	0.277	C	S	.	.	H	α-helix	trans	-60.3	-45.1	175.1	175.1	-102.9	0	0	0	112.5	D367 L368 M369 I375 R438 L441 F442 R445	D367-F371 VanDerWaalsContact O-CB 3.25Å; D367-F371 WeakPolarHBondContact O-CB 3.26Å; D367-F371 PolarHBondContact O-N 3.21Å; L368-F371 WeakPolarHBondContact O-CB 3.38Å; L368-F371 PolarHBondContact O-N 3.17Å; M369-F371 VanDerWaalsContact C-N 3.29Å; M369-F371 PolarHBondContact O-N 3.3Å; F371-I375 HydrophobicContact CD1-CD1 3.98Å; F371-I375 HydrophobicContact CD2-CD1 4.35Å; F371-I375 HydrophobicContact CE1-CD1 3.48Å; F371-I375 VanDerWaalsContact CE1-CD1 3.48Å; F371-I375 HydrophobicContact CE2-CD1 3.89Å; F371-I375 HydrophobicContact CG-CD1 4.39Å; F371-I375 HydrophobicContact CZ-CD1 3.45Å; F371-I375 VanDerWaalsContact CZ-CD1 3.45Å; F371-I375 WeakPolarHBondContact O-CG1 3.44Å; F371-I375 PolarHBondContact O-N 3.26Å; F371-R438 HydrophobicContact CZ-CB 4.14Å; F371-L441 HydrophobicContact CD2-CD2 4.23Å; F371-L441 HydrophobicContact CE1-CD2 4.38Å; F371-L441 HydrophobicContact CE2-CD2 3.47Å; F371-L441 VanDerWaalsContact CE2-CD2 3.47Å; F371-L441 HydrophobicContact CZ-CB 4.22Å; F371-L441 HydrophobicContact CZ-CD2 3.55Å; F371-L441 HydrophobicContact CZ-CG 4.4Å; F371-F442 HydrophobicContact CE1-CB 4.18Å; F371-R445 VanDerWaalsContact CB-NH1 3.33Å
372	V	76.4	Confident	78.8	Confident	5 Å²	5	61 Å²	61	3%	0.03	29%	0.291	C	S	.	.	H	α-helix	trans	-65.7	-44.8	176.7	173.8	0	0	0	0	111.3	L368 M369 K374 I375 Q376 F442 Y495 V499	L368-V372 WeakPolarHBondContact O-CG2 3.3Å; L368-V372 PolarHBondContact O-N 3.27Å; L368-V372 VanDerWaalsContact O-N 3.08Å; M369-V372 PolarHBondContact O-N 3.3Å; V372-K374 VanDerWaalsContact C-N 3.34Å; V372-K374 PolarHBondContact O-N 3.24Å; V372-I375 PolarHBondContact O-N 2.93Å; V372-I375 VanDerWaalsContact O-N 3.16Å; V372-Q376 HydrophobicContact CG1-CG 4.5Å; V372-Q376 WeakPolarHBondContact O-CG 3.42Å; V372-Q376 PolarHBondContact O-N 3.46Å; V372-F442 HydrophobicContact CG2-CD2 3.84Å; V372-F442 HydrophobicContact CG2-CE2 3.62Å; V372-Y495 WeakPolarHBondContact CB-OH 3.5Å; V372-Y495 HydrophobicContact CG2-CE1 4.15Å; V372-Y495 WeakPolarHBondContact CG2-OH 3.47Å; V372-V499 HydrophobicContact CG1-CG2 4.11Å; V372-V499 HydrophobicContact CG2-CG1 4.3Å; V372-V499 HydrophobicContact CG2-CG2 4.33Å
373	K	75.2	Confident	78.6	Confident	74 Å²	74	57.8 Å²	57.8	32%	0.322	28%	0.279	S	S	.	.	H	α-helix	trans	-59.4	-43.6	178	-174.1	172.8	-175.6	170.8	0	112	M369 F370 I375 Q376 L377	M369-K373 PolarHBondContact O-N 2.89Å; F370-K373 PolarHBondContact O-N 3.41Å; K373-I375 VanDerWaalsContact C-N 3.31Å; K373-I375 PolarHBondContact O-N 3.49Å; K373-Q376 PolarHBondContact O-N 3.19Å; K373-L377 HydrophobicContact CG-CD1 4.17Å; K373-L377 HydrophobicContact CG-CG 4.47Å; K373-L377 WeakPolarHBondContact O-CG 3.48Å; K373-L377 PolarHBondContact O-N 2.92Å
374	K	77.1	Confident	78.5	Confident	129 Å²	129	55.6 Å²	55.6	56%	0.561	27%	0.271	S	S	*	.	H	α-helix	trans	-60.7	-41.4	177.3	-175.3	177.5	178.8	179	0	111.7	F370 V372 V378	F370-K374 WeakPolarHBondContact O-CB 3.5Å; F370-K374 PolarHBondContact O-N 2.8Å; V372-K374 VanDerWaalsContact C-N 3.34Å; V372-K374 PolarHBondContact O-N 3.24Å; K374-V378 WeakPolarHBondContact O-CG2 3.35Å; K374-V378 PolarHBondContact O-N 3.42Å
375	I	74.3	Confident	78.4	Confident	27 Å²	27	57 Å²	57	14%	0.138	28%	0.283	C	S	.	.	H	α-helix	trans	-64.9	-44.1	177.8	-69.7	169.4	0	0	0	110.8	F371 V372 K373 V378 Q379 R438	F371-I375 HydrophobicContact CD1-CD1 3.98Å; F371-I375 HydrophobicContact CD2-CD1 4.35Å; F371-I375 HydrophobicContact CE1-CD1 3.48Å; F371-I375 VanDerWaalsContact CE1-CD1 3.48Å; F371-I375 HydrophobicContact CE2-CD1 3.89Å; F371-I375 HydrophobicContact CG-CD1 4.39Å; F371-I375 HydrophobicContact CZ-CD1 3.45Å; F371-I375 VanDerWaalsContact CZ-CD1 3.45Å; F371-I375 WeakPolarHBondContact O-CG1 3.44Å; F371-I375 PolarHBondContact O-N 3.26Å; V372-I375 PolarHBondContact O-N 2.93Å; V372-I375 VanDerWaalsContact O-N 3.16Å; K373-I375 VanDerWaalsContact C-N 3.31Å; K373-I375 PolarHBondContact O-N 3.49Å; I375-V378 PolarHBondContact O-N 3.44Å; I375-Q379 VanDerWaalsContact CG2-NE2 3.32Å; I375-Q379 WeakPolarHBondContact O-CG 3.39Å; I375-Q379 PolarHBondContact O-N 2.99Å; I375-Q379 VanDerWaalsContact O-N 3.09Å; I375-R438 HydrophobicContact CD1-CB 4.04Å; I375-R438 HydrophobicContact CD1-CG 4.38Å
376	Q	73.6	Confident	78.5	Confident	29 Å²	29	56.4 Å²	56.4	14%	0.136	28%	0.28	C	S	.	.	H	α-helix	trans	-68.1	-37.1	-179.4	-72.2	170.6	-37.1	0	0	113	V372 K373 Q379 F380 F562 Q569	V372-Q376 HydrophobicContact CG1-CG 4.5Å; V372-Q376 WeakPolarHBondContact O-CG 3.42Å; V372-Q376 PolarHBondContact O-N 3.46Å; K373-Q376 PolarHBondContact O-N 3.19Å; Q376-Q379 PolarHBondContact O-N 2.82Å; Q376-F380 WeakPolarHBondContact O-CB 3.2Å; Q376-F380 PolarHBondContact O-N 2.93Å; Q376-F562 HydrophobicContact CB-CE1 4.02Å; Q376-F562 HydrophobicContact CG-CE1 4.26Å; Q376-Q569 VanDerWaalsContact CD-NE2 3.34Å; Q376-Q569 VanDerWaalsContact NE2-NE2 3.17Å; Q376-Q569 VanDerWaalsContact OE1-OE1 3.1Å
377	L	74	Confident	78.8	Confident	76 Å²	76	54 Å²	54	40%	0.398	27%	0.268	S	S	.	.	H	α-helix	trans	-62.9	-44.2	174.8	-74.6	171.8	0	0	0	111.9	K373 Q379 F380 E381	K373-L377 HydrophobicContact CG-CD1 4.17Å; K373-L377 HydrophobicContact CG-CG 4.47Å; K373-L377 WeakPolarHBondContact O-CG 3.48Å; K373-L377 PolarHBondContact O-N 2.92Å; L377-Q379 VanDerWaalsContact C-N 3.3Å; L377-Q379 PolarHBondContact O-N 3.37Å; L377-F380 PolarHBondContact O-N 3.43Å; L377-E381 WeakPolarHBondContact O-CG 3.47Å; L377-E381 PolarHBondContact O-N 3.42Å
378	V	75.7	Confident	78.8	Confident	49 Å²	49	51 Å²	51	30%	0.297	26%	0.26	S	S	.	.	H	α-helix	trans	-61.9	-40.6	176.5	172.7	0	0	0	0	110.9	K374 I375 Q382	K374-V378 WeakPolarHBondContact O-CG2 3.35Å; K374-V378 PolarHBondContact O-N 3.42Å; I375-V378 PolarHBondContact O-N 3.44Å; V378-Q382 WeakPolarHBondContact O-CB 3.5Å; V378-Q382 VanDerWaalsContact O-CG 3.27Å; V378-Q382 WeakPolarHBondContact O-CG 3.41Å; V378-Q382 PolarHBondContact O-N 3.39Å; V378-Q382 VanDerWaalsContact O-N 3.11Å
379	Q	73.4	Confident	78.9	Confident	21 Å²	21	53.7 Å²	53.7	10%	0.098	28%	0.275	C	S	.	.	H	α-helix	trans	-65.4	-42.4	175.9	-71.5	167.3	1.8	0	0	112.3	I375 Q376 L377 Q382 L383 C434 F562	I375-Q379 VanDerWaalsContact CG2-NE2 3.32Å; I375-Q379 WeakPolarHBondContact O-CG 3.39Å; I375-Q379 PolarHBondContact O-N 2.99Å; I375-Q379 VanDerWaalsContact O-N 3.09Å; Q376-Q379 PolarHBondContact O-N 2.82Å; L377-Q379 VanDerWaalsContact C-N 3.3Å; L377-Q379 PolarHBondContact O-N 3.37Å; Q379-Q382 PolarHBondContact O-N 2.77Å; Q379-L383 WeakPolarHBondContact O-CB 3.31Å; Q379-L383 WeakPolarHBondContact O-CD1 3.48Å; Q379-L383 VanDerWaalsContact O-CG 3.29Å; Q379-L383 WeakPolarHBondContact O-CG 3.26Å; Q379-L383 PolarHBondContact O-N 3.2Å; Q379-C434 PolarHBondContact NE2-SG 3.31Å; Q379-F562 HydrophobicContact CB-CZ 3.92Å
380	F	77.5	Confident	79.3	Confident	72 Å²	72	52.1 Å²	52.1	32%	0.316	27%	0.267	S	S	.	.	H	α-helix	trans	-60.9	-49.7	177.8	179.1	-89.7	0	0	0	111.3	Q376 L377 Q382 L383 S384 F559 F562	Q376-F380 WeakPolarHBondContact O-CB 3.2Å; Q376-F380 PolarHBondContact O-N 2.93Å; L377-F380 PolarHBondContact O-N 3.43Å; F380-Q382 PolarHBondContact O-N 2.69Å; F380-L383 PolarHBondContact O-N 2.91Å; F380-S384 PolarHBondContact O-N 3.19Å; F380-S384 PolarHBondContact O-OG 2.94Å; F380-S384 VanDerWaalsContact O-OG 3.09Å; F380-F559 AromaticContact CD2-CD1 3.74Å; F380-F559 HydrophobicContact CD2-CD1 3.74Å; F380-F559 AromaticContact CD2-CE1 3.78Å; F380-F559 HydrophobicContact CD2-CE1 3.78Å; F380-F559 AromaticContact CE2-CD1 3.42Å; F380-F559 HydrophobicContact CE2-CD1 3.42Å; F380-F559 VanDerWaalsContact CE2-CD1 3.42Å; F380-F559 AromaticContact CE2-CE1 3.73Å; F380-F559 HydrophobicContact CE2-CE1 3.73Å; F380-F559 HydrophobicContact CG-CE1 4.45Å; F380-F559 HydrophobicContact CZ-CD1 4.23Å; F380-F559 HydrophobicContact CZ-CE1 4.3Å; F380-F562 HydrophobicContact CB-CG 4.5Å; F380-F562 HydrophobicContact CD2-CB 3.64Å; F380-F562 AromaticContact CD2-CD2 3.99Å; F380-F562 HydrophobicContact CD2-CD2 3.99Å; F380-F562 AromaticContact CD2-CG 3.85Å; F380-F562 HydrophobicContact CD2-CG 3.85Å; F380-F562 HydrophobicContact CE2-CB 4.11Å
381	E	77.9	Confident	79.6	Confident	131 Å²	131	49.7 Å²	49.7	61%	0.612	26%	0.257	S	S	*	.	H	α-helix	trans	-60.1	-44.1	178.6	-72.8	175.4	-177	0	0	112.2	L377 L383 S384 S385	L377-E381 WeakPolarHBondContact O-CG 3.47Å; L377-E381 PolarHBondContact O-N 3.42Å; E381-L383 VanDerWaalsContact C-N 3.34Å; E381-L383 PolarHBondContact O-N 3.33Å; E381-S384 PolarHBondContact O-N 2.84Å; E381-S385 PolarHBondContact O-N 3.06Å; E381-S385 VanDerWaalsContact O-N 3.13Å
382	Q	77.7	Confident	79.9	Confident	63 Å²	63	54.6 Å²	54.6	29%	0.294	28%	0.279	S	S	.	.	H	α-helix	trans	-62.3	-41.2	176.8	-74.2	177.4	-5.6	0	0	111.8	V378 Q379 F380 I386	V378-Q382 WeakPolarHBondContact O-CB 3.5Å; V378-Q382 VanDerWaalsContact O-CG 3.27Å; V378-Q382 WeakPolarHBondContact O-CG 3.41Å; V378-Q382 PolarHBondContact O-N 3.39Å; V378-Q382 VanDerWaalsContact O-N 3.11Å; Q379-Q382 PolarHBondContact O-N 2.77Å; F380-Q382 PolarHBondContact O-N 2.69Å; Q382-I386 WeakPolarHBondContact O-CG1 3.48Å; Q382-I386 PolarHBondContact O-N 3.1Å
383	L	81.5	Confident	80.3	Confident	5 Å²	5	55.1 Å²	55.1	3%	0.026	28%	0.28	C	S	.	.	H	α-helix	trans	-71.6	-38.5	178.6	-75.7	162.5	0	0	0	112.8	Q379 F380 E381 S385 I386 Q387 L427 L509 I558 F559 F562	Q379-L383 WeakPolarHBondContact O-CB 3.31Å; Q379-L383 WeakPolarHBondContact O-CD1 3.48Å; Q379-L383 VanDerWaalsContact O-CG 3.29Å; Q379-L383 WeakPolarHBondContact O-CG 3.26Å; Q379-L383 PolarHBondContact O-N 3.2Å; F380-L383 PolarHBondContact O-N 2.91Å; E381-L383 VanDerWaalsContact C-N 3.34Å; E381-L383 PolarHBondContact O-N 3.33Å; L383-S385 VanDerWaalsContact C-N 3.3Å; L383-S385 PolarHBondContact O-N 2.95Å; L383-I386 PolarHBondContact O-N 2.85Å; L383-Q387 WeakPolarHBondContact O-CB 3.47Å; L383-Q387 PolarHBondContact O-N 3.2Å; L383-L427 HydrophobicContact CD2-CD2 3.7Å; L383-L509 HydrophobicContact CD1-CD2 3.55Å; L383-L509 HydrophobicContact CD1-CG 4.42Å; L383-L509 HydrophobicContact CD2-CD2 3.33Å; L383-L509 HydrophobicContact CG-CD2 3.87Å; L383-I558 HydrophobicContact CD1-CG2 3.77Å; L383-F559 HydrophobicContact CB-CE1 4.18Å; L383-F559 HydrophobicContact CB-CZ 3.74Å; L383-F562 HydrophobicContact CD1-CE2 3.65Å; L383-F562 HydrophobicContact CD1-CZ 4.35Å
384	S	82.1	Confident	80.9	Confident	44 Å²	44	53.3 Å²	53.3	31%	0.308	27%	0.272	S	S	.	.	H	α-helix	trans	-65.2	-37.8	178.6	-63.9	0	0	0	0	111.3	F380 E381 Q387 G388 F559	F380-S384 PolarHBondContact O-N 3.19Å; F380-S384 PolarHBondContact O-OG 2.94Å; F380-S384 VanDerWaalsContact O-OG 3.09Å; E381-S384 PolarHBondContact O-N 2.84Å; S384-Q387 PolarHBondContact O-N 3.2Å; S384-G388 PolarHBondContact O-N 2.79Å; S384-G388 VanDerWaalsContact O-N 3.1Å; S384-F559 VanDerWaalsContact OG-CE1 3.25Å; S384-F559 WeakPolarHBondContact OG-CE1 3.25Å
385	S	84.3	Confident	81.2	Confident	59 Å²	59	55.1 Å²	55.1	41%	0.413	28%	0.277	S	S	.	.	H	α-helix	trans	-61	-47.2	172.2	177.5	0	0	0	0	111.6	E381 L383 G388 D389	E381-S385 PolarHBondContact O-N 3.06Å; E381-S385 VanDerWaalsContact O-N 3.13Å; L383-S385 VanDerWaalsContact C-N 3.3Å; L383-S385 PolarHBondContact O-N 2.95Å; S385-G388 PolarHBondContact O-N 3.47Å; S385-D389 PolarHBondContact O-N 3.35Å
386	I	85.4	Confident	81.6	Confident	3 Å²	3	56.9 Å²	56.9	2%	0.015	28%	0.283	C	S	.	.	H	α-helix	trans	-66.7	-38.5	-179.6	-66.8	169.6	0	0	0	111	Q382 L383 D389 I390 W423 K426 L427	Q382-I386 WeakPolarHBondContact O-CG1 3.48Å; Q382-I386 PolarHBondContact O-N 3.1Å; L383-I386 PolarHBondContact O-N 2.85Å; I386-D389 PolarHBondContact O-N 2.92Å; I386-I390 HydrophobicContact CG2-CD1 3.62Å; I386-I390 HydrophobicContact CG2-CG1 4.23Å; I386-I390 WeakPolarHBondContact O-CB 3.41Å; I386-I390 VanDerWaalsContact O-CG1 3.26Å; I386-I390 WeakPolarHBondContact O-CG1 3.43Å; I386-I390 PolarHBondContact O-N 3.3Å; I386-W423 HydrophobicContact CG1-CB 4.48Å; I386-W423 HydrophobicContact CG1-CG 4.4Å; I386-W423 HydrophobicContact CG2-CB 4.06Å; I386-W423 HydrophobicContact CG2-CD2 4.36Å; I386-W423 HydrophobicContact CG2-CG 3.99Å; I386-K426 HydrophobicContact CD1-CB 4.15Å; I386-L427 HydrophobicContact CD1-CD1 4.44Å; I386-L427 HydrophobicContact CD1-CD2 3.77Å; I386-L427 HydrophobicContact CD1-CG 3.77Å
387	Q	84.5	Confident	81.9	Confident	42 Å²	42	55.5 Å²	55.5	20%	0.196	28%	0.276	C	S	.	.	H	α-helix	trans	-62.9	-46.3	177.6	-174.4	-169.5	-0.1	0	0	111.9	L383 S384 D389 I390 E391 F559	L383-Q387 WeakPolarHBondContact O-CB 3.47Å; L383-Q387 PolarHBondContact O-N 3.2Å; S384-Q387 PolarHBondContact O-N 3.2Å; Q387-D389 VanDerWaalsContact C-N 3.26Å; Q387-D389 PolarHBondContact O-N 3.32Å; Q387-I390 PolarHBondContact O-N 3Å; Q387-E391 HydrophobicContact CG-CG 4.44Å; Q387-E391 PolarHBondContact NE2-OE1 3.45Å; Q387-E391 WeakPolarHBondContact O-CG 2.98Å; Q387-E391 PolarHBondContact O-N 3.18Å; Q387-F559 HydrophobicContact CB-CE2 4.07Å; Q387-F559 HydrophobicContact CB-CZ 4.48Å; Q387-F559 HydrophobicContact CG-CE2 4.3Å
388	G	83.2	Confident	82.2	Confident	37 Å²	37	53.1 Å²	53.1	38%	0.381	27%	0.266	S	S	.	.	H	α-helix	trans	-59.9	-38.4	178.4	0	0	0	0	0	112.4	S384 S385 K392	S384-G388 PolarHBondContact O-N 2.79Å; S384-G388 VanDerWaalsContact O-N 3.1Å; S385-G388 PolarHBondContact O-N 3.47Å; G388-K392 PolarHBondContact O-N 2.88Å
389	D	85.1	Confident	82.3	Confident	59 Å²	59	52.8 Å²	52.8	32%	0.316	26%	0.264	S	S	.	.	H	α-helix	trans	-70.3	-39.9	176.1	-62	-24.6	0	0	0	112	S385 I386 Q387 K392 W393 W423	S385-D389 PolarHBondContact O-N 3.35Å; I386-D389 PolarHBondContact O-N 2.92Å; Q387-D389 VanDerWaalsContact C-N 3.26Å; Q387-D389 PolarHBondContact O-N 3.32Å; D389-K392 WeakPolarHBondContact O-CB 3.36Å; D389-K392 PolarHBondContact O-N 3.09Å; D389-W393 PolarHBondContact O-N 3.24Å; D389-W423 HydrophobicContact CB-CH2 4.38Å; D389-W423 HydrophobicContact CB-CZ2 3.38Å; D389-W423 PolarHBondContact OD2-NE1 3.22Å
390	I	86.4	Confident	82.2	Confident	1 Å²	1	53.9 Å²	53.9	1%	0.005	27%	0.269	C	S	.	.	H	α-helix	trans	-63.4	-40.5	174.9	-72.9	170.7	0	0	0	111.3	I386 Q387 W393 H394 W423 L516 L548 C551 Q552	I386-I390 HydrophobicContact CG2-CD1 3.62Å; I386-I390 HydrophobicContact CG2-CG1 4.23Å; I386-I390 WeakPolarHBondContact O-CB 3.41Å; I386-I390 VanDerWaalsContact O-CG1 3.26Å; I386-I390 WeakPolarHBondContact O-CG1 3.43Å; I386-I390 PolarHBondContact O-N 3.3Å; Q387-I390 PolarHBondContact O-N 3Å; I390-W393 PolarHBondContact O-N 2.7Å; I390-H394 WeakPolarHBondContact O-CB 3.05Å; I390-H394 PolarHBondContact O-N 2.95Å; I390-W423 HydrophobicContact CD1-CE3 4.31Å; I390-W423 HydrophobicContact CD1-CZ3 4.5Å; I390-W423 HydrophobicContact CG1-CD2 4.34Å; I390-W423 HydrophobicContact CG1-CE3 3.72Å; I390-W423 HydrophobicContact CG1-CH2 3.98Å; I390-W423 HydrophobicContact CG1-CZ3 3.51Å; I390-L516 HydrophobicContact CD1-CD1 4.4Å; I390-L548 HydrophobicContact CG2-CB 4.37Å; I390-L548 HydrophobicContact CG2-CD2 4.15Å; I390-C551 HydrophobicContact CD1-CB 4.11Å; I390-Q552 HydrophobicContact CG2-CG 3.74Å
391	E	84.9	Confident	81.8	Confident	88 Å²	88	52.6 Å²	52.6	41%	0.411	27%	0.265	S	S	.	.	H	α-helix	trans	-62.8	-41.2	177.2	-76.9	174.6	-171.4	0	0	112.5	Q387 Y395 Q552	Q387-E391 HydrophobicContact CG-CG 4.44Å; Q387-E391 PolarHBondContact NE2-OE1 3.45Å; Q387-E391 WeakPolarHBondContact O-CG 2.98Å; Q387-E391 PolarHBondContact O-N 3.18Å; E391-Y395 WeakPolarHBondContact O-CB 3.37Å; E391-Y395 PolarHBondContact O-N 2.93Å; E391-Q552 HydrophobicContact CG-CG 4.46Å
392	K	87.7	Confident	81.2	Confident	133 Å²	133	53.4 Å²	53.4	58%	0.578	27%	0.273	S	S	*	.	H	α-helix	trans	-58.7	-51	174.4	179.8	-169.8	171.1	-163.3	0	111.5	G388 D389 Y395 Y396	G388-K392 PolarHBondContact O-N 2.88Å; D389-K392 WeakPolarHBondContact O-CB 3.36Å; D389-K392 PolarHBondContact O-N 3.09Å; K392-Y395 PolarHBondContact O-N 3.23Å; K392-Y396 PolarHBondContact O-N 3.09Å; K392-Y396 VanDerWaalsContact O-N 3.08Å
393	W	85.6	Confident	80.5	Confident	16 Å²	16	57.8 Å²	57.8	6%	0.061	29%	0.288	C	S	.	.	H	α-helix	trans	-73.5	-34.7	-177.2	-75.8	115.2	0	0	0	113.1	D389 I390 Y396 I397 E415 I416 D419 W423	D389-W393 PolarHBondContact O-N 3.24Å; I390-W393 PolarHBondContact O-N 2.7Å; W393-Y396 AromaticContact CE3-CD1 3.96Å; W393-Y396 HydrophobicContact CE3-CD1 3.96Å; W393-Y396 HydrophobicContact CE3-CG 4.3Å; W393-Y396 AromaticContact CZ3-CD1 3.93Å; W393-Y396 HydrophobicContact CZ3-CD1 3.93Å; W393-Y396 HydrophobicContact CZ3-CE1 4.27Å; W393-Y396 HydrophobicContact CZ3-CG 4.35Å; W393-Y396 PolarHBondContact O-N 3.23Å; W393-I397 WeakPolarHBondContact O-CG1 3.32Å; W393-I397 PolarHBondContact O-N 3.01Å; W393-E415 HydrophobicContact CH2-CB 4.04Å; W393-E415 HydrophobicContact CZ2-CB 4.09Å; W393-I416 HydrophobicContact CD2-CG1 3.76Å; W393-I416 HydrophobicContact CE3-CD1 3.86Å; W393-I416 HydrophobicContact CE3-CG1 3.45Å; W393-I416 VanDerWaalsContact CE3-CG1 3.45Å; W393-I416 HydrophobicContact CH2-CG1 3.86Å; W393-I416 HydrophobicContact CZ2-CG1 4.14Å; W393-I416 HydrophobicContact CZ3-CD1 3.9Å; W393-I416 HydrophobicContact CZ3-CG1 3.51Å; W393-D419 PolarHBondContact NE1-OD2 2.85Å; W393-W423 HydrophobicContact CB-CH2 4.44Å; W393-W423 AromaticContact CD1-CH2 3.47Å; W393-W423 VanDerWaalsContact CD1-CH2 3.47Å; W393-W423 AromaticContact CD1-CZ2 3.69Å; W393-W423 HydrophobicContact CG-CH2 4.25Å
394	H	86.1	Confident	79.1	Confident	35 Å²	35	67.2 Å²	67.2	16%	0.162	33%	0.332	C	S	.	.	H	α-helix	trans	-60.5	-48.4	171.1	-178.3	-72.5	0	0	0	110.9	I390 Y396 I397 S398 L548 S549 Q552	I390-H394 WeakPolarHBondContact O-CB 3.05Å; I390-H394 PolarHBondContact O-N 2.95Å; H394-Y396 VanDerWaalsContact C-N 3.33Å; H394-Y396 PolarHBondContact O-N 3.42Å; H394-I397 PolarHBondContact O-N 3.42Å; H394-S398 PolarHBondContact CE1-OG 3.16Å; H394-S398 VanDerWaalsContact CE1-OG 3.28Å; H394-S398 PolarHBondContact ND1-OG 3.1Å; H394-S398 WeakPolarHBondContact O-CB 3.45Å; H394-S398 PolarHBondContact O-N 2.95Å; H394-S398 PolarHBondContact O-OG 2.68Å; H394-L548 HydrophobicContact CB-CB 4.32Å; H394-S549 VanDerWaalsContact NE2-CB 3.31Å; H394-S549 WeakPolarHBondContact NE2-CB 3.47Å; H394-Q552 VanDerWaalsContact CB-NE2 3.31Å
395	Y	84	Confident	77.7	Confident	168 Å²	168	70.9 Å²	70.9	66%	0.659	35%	0.352	S	S	*	.	H	α-helix	trans	-58	-46.2	176.5	179.4	-99.9	0	0	0	111.5	E391 K392 I397 S398 T399	E391-Y395 WeakPolarHBondContact O-CB 3.37Å; E391-Y395 PolarHBondContact O-N 2.93Å; K392-Y395 PolarHBondContact O-N 3.23Å; Y395-I397 PolarHBondContact O-N 3.11Å; Y395-S398 PolarHBondContact O-N 3.42Å; Y395-T399 HydrophobicContact CD1-CG2 4.34Å; Y395-T399 HydrophobicContact CD2-CG2 4.39Å; Y395-T399 HydrophobicContact CE1-CG2 3.97Å; Y395-T399 HydrophobicContact CE2-CG2 4.02Å; Y395-T399 WeakPolarHBondContact O-CG2 3.37Å; Y395-T399 PolarHBondContact O-N 3.32Å; Y395-T399 PolarHBondContact O-OG1 2.78Å
396	Y	82.5	Confident	76.4	Confident	64 Å²	64	69.7 Å²	69.7	25%	0.251	34%	0.343	S	S	.	.	H	α-helix	trans	-57.2	-51.8	177.2	-179.2	-101.2	0	0	0	112.1	K392 W393 H394 T399 Q400	K392-Y396 PolarHBondContact O-N 3.09Å; K392-Y396 VanDerWaalsContact O-N 3.08Å; W393-Y396 AromaticContact CE3-CD1 3.96Å; W393-Y396 HydrophobicContact CE3-CD1 3.96Å; W393-Y396 HydrophobicContact CE3-CG 4.3Å; W393-Y396 AromaticContact CZ3-CD1 3.93Å; W393-Y396 HydrophobicContact CZ3-CD1 3.93Å; W393-Y396 HydrophobicContact CZ3-CE1 4.27Å; W393-Y396 HydrophobicContact CZ3-CG 4.35Å; W393-Y396 PolarHBondContact O-N 3.23Å; H394-Y396 VanDerWaalsContact C-N 3.33Å; H394-Y396 PolarHBondContact O-N 3.42Å; Y396-T399 PolarHBondContact O-N 2.94Å; Y396-T399 PolarHBondContact O-OG1 2.7Å; Y396-Q400 HydrophobicContact CE1-CG 4.27Å; Y396-Q400 HydrophobicContact CE2-CG 4.39Å; Y396-Q400 WeakPolarHBondContact O-CG 3.27Å; Y396-Q400 PolarHBondContact O-N 3.29Å; Y396-Q400 VanDerWaalsContact O-N 3.1Å
397	I	80.8	Confident	75	Confident	0 Å²	0	77.6 Å²	77.6	0%	0	38%	0.38	C	S	.	.	H	α-helix	trans	-65.1	-43.2	-179.1	-65.4	165.7	0	0	0	111.2	W393 H394 Y395 T399 Q400 N401 I416 W541 L544 E545 L548	W393-I397 WeakPolarHBondContact O-CG1 3.32Å; W393-I397 PolarHBondContact O-N 3.01Å; H394-I397 PolarHBondContact O-N 3.42Å; Y395-I397 PolarHBondContact O-N 3.11Å; I397-T399 VanDerWaalsContact C-N 3.32Å; I397-T399 PolarHBondContact O-N 3.39Å; I397-Q400 PolarHBondContact O-N 2.91Å; I397-N401 WeakPolarHBondContact O-CB 3.41Å; I397-N401 PolarHBondContact O-N 3.3Å; I397-I416 HydrophobicContact CD1-CD1 4.39Å; I397-W541 HydrophobicContact CD1-CE3 4.44Å; I397-W541 HydrophobicContact CD1-CZ3 4.17Å; I397-W541 HydrophobicContact CG1-CE3 4.37Å; I397-W541 HydrophobicContact CG1-CZ3 4.18Å; I397-W541 HydrophobicContact CG2-CE3 4.28Å; I397-L544 HydrophobicContact CD1-CD2 3.99Å; I397-L544 HydrophobicContact CD1-CG 4.31Å; I397-E545 HydrophobicContact CG2-CB 3.9Å; I397-E545 HydrophobicContact CG2-CG 4.31Å; I397-L548 HydrophobicContact CD1-CD1 3.68Å
398	S	79.8	Confident	74	Confident	26 Å²	26	77.7 Å²	77.7	18%	0.182	38%	0.379	C	S	.	.	H	α-helix	trans	-59.9	-40.2	176.1	-63.3	0	0	0	0	112.4	H394 Y395 L402 E545	H394-S398 PolarHBondContact CE1-OG 3.16Å; H394-S398 VanDerWaalsContact CE1-OG 3.28Å; H394-S398 PolarHBondContact ND1-OG 3.1Å; H394-S398 WeakPolarHBondContact O-CB 3.45Å; H394-S398 PolarHBondContact O-N 2.95Å; H394-S398 PolarHBondContact O-OG 2.68Å; Y395-S398 PolarHBondContact O-N 3.42Å; S398-L402 WeakPolarHBondContact O-CG 3.44Å; S398-E545 WeakPolarHBondContact CA-OE1 3.3Å; S398-E545 VanDerWaalsContact CB-OE1 3.26Å; S398-E545 WeakPolarHBondContact CB-OE1 3.48Å; S398-E545 PolarHBondContact OG-OE1 3.3Å
399	T	78.6	Confident	73.1	Confident	41 Å²	41	80.1 Å²	80.1	25%	0.252	38%	0.383	S	S	.	.	H	α-helix	trans	-68.9	-34.5	177	58.5	0	0	0	0	113	Y395 Y396 I397 Y403	Y395-T399 HydrophobicContact CD1-CG2 4.34Å; Y395-T399 HydrophobicContact CD2-CG2 4.39Å; Y395-T399 HydrophobicContact CE1-CG2 3.97Å; Y395-T399 HydrophobicContact CE2-CG2 4.02Å; Y395-T399 WeakPolarHBondContact O-CG2 3.37Å; Y395-T399 PolarHBondContact O-N 3.32Å; Y395-T399 PolarHBondContact O-OG1 2.78Å; Y396-T399 PolarHBondContact O-N 2.94Å; Y396-T399 PolarHBondContact O-OG1 2.7Å; I397-T399 VanDerWaalsContact C-N 3.32Å; I397-T399 PolarHBondContact O-N 3.39Å; T399-Y403 VanDerWaalsContact O-CD2 3.25Å; T399-Y403 WeakPolarHBondContact O-CD2 3.27Å; T399-Y403 WeakPolarHBondContact O-CE2 3.25Å
400	Q	71.2	Confident	72.2	Confident	44 Å²	44	80.8 Å²	80.8	21%	0.206	39%	0.389	C	S	.	.	H	α-helix	trans	-75	-34.9	178.8	-67.7	-65.5	-12.2	0	0	112.5	Y396 I397 L402 Y403 Y408	Y396-Q400 HydrophobicContact CE1-CG 4.27Å; Y396-Q400 HydrophobicContact CE2-CG 4.39Å; Y396-Q400 WeakPolarHBondContact O-CG 3.27Å; Y396-Q400 PolarHBondContact O-N 3.29Å; Y396-Q400 VanDerWaalsContact O-N 3.1Å; I397-Q400 PolarHBondContact O-N 2.91Å; Q400-L402 PolarHBondContact O-N 3.46Å; Q400-Y403 PolarHBondContact O-N 3.48Å; Q400-Y408 HydrophobicContact CB-CE1 3.75Å; Q400-Y408 HydrophobicContact CG-CE1 4.32Å
401	N	68.4	Low	71.6	Confident	46 Å²	46	84.3 Å²	84.3	25%	0.246	41%	0.411	C	S	.	.	T	Hydrogen-bonded Turn	trans	-70.3	-11.5	176.7	-80.1	-24.7	0	0	0	114.3	I397 Y403 Y408 E545	I397-N401 WeakPolarHBondContact O-CB 3.41Å; I397-N401 PolarHBondContact O-N 3.3Å; N401-Y403 VanDerWaalsContact C-N 3.34Å; N401-Y408 PolarHBondContact OD1-OH 2.97Å; N401-E545 PolarHBondContact ND2-OE2 2.99Å
402	L	65.4	Low	71.1	Confident	148 Å²	148	81 Å²	81	78%	0.775	40%	0.397	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.3	-13.9	175.2	-72.2	167.9	0	0	0	113.6	S398 Q400	S398-L402 WeakPolarHBondContact O-CG 3.44Å; Q400-L402 PolarHBondContact O-N 3.46Å
403	Y	62.4	Low	70.6	Confident	154 Å²	154	75.3 Å²	75.3	60%	0.604	37%	0.373	S	S	*	.	S	Bend	trans	-90.4	141.2	178.3	-62.6	-80	0	0	0	111.3	T399 Q400 N401 V405	T399-Y403 VanDerWaalsContact O-CD2 3.25Å; T399-Y403 WeakPolarHBondContact O-CD2 3.27Å; T399-Y403 WeakPolarHBondContact O-CE2 3.25Å; Q400-Y403 PolarHBondContact O-N 3.48Å; N401-Y403 VanDerWaalsContact C-N 3.34Å; Y403-V405 PolarHBondContact O-N 3.01Å; Y403-V405 VanDerWaalsContact O-N 3.15Å
404	E	52.8	Low	70.3	Confident	204 Å²	204	76.5 Å²	76.5	95%	0.953	39%	0.386	S	S	*	.	S	Bend	trans	-63	-20.5	-177.1	-71.4	-176.5	162.4	0	0	114.1
405	V	52.2	Low	70.1	Confident	120 Å²	120	79.8 Å²	79.8	73%	0.727	40%	0.401	S	S	*	.	S	Bend	trans	-137.2	99.2	171.2	-174.9	0	0	0	0	108.7	Y403 E407	Y403-V405 PolarHBondContact O-N 3.01Å; Y403-V405 VanDerWaalsContact O-N 3.15Å; V405-E407 PolarHBondContact O-N 3.44Å
406	P	57.2	Low	70.1	Confident	35 Å²	35	71.9 Å²	71.9	23%	0.227	37%	0.37	C	S	.	.			trans	-69.6	123.2	176.8	-20	32.7	0	0	0	111.4	Y408	P406-Y408 HydrophobicContact CB-CD2 3.62Å; P406-Y408 HydrophobicContact CB-CE2 3.11Å; P406-Y408 HydrophobicContact CG-CE2 3.91Å; P406-Y408 PolarHBondContact O-N 2.87Å
407	E	56.4	Low	70.2	Confident	169 Å²	169	70.2 Å²	70.2	79%	0.79	37%	0.365	S	S	*	.			trans	-90.3	90	169.7	-82.4	-173.8	164.1	0	0	109.4	V405	V405-E407 PolarHBondContact O-N 3.44Å
408	Y	62.6	Low	70.4	Confident	43 Å²	43	75.1 Å²	75.1	17%	0.169	39%	0.388	C	S	.	.			trans	-87.3	109.9	174	-66.8	-68	0	0	0	110.3	Q400 N401 P406 W541	Q400-Y408 HydrophobicContact CB-CE1 3.75Å; Q400-Y408 HydrophobicContact CG-CE1 4.32Å; N401-Y408 PolarHBondContact OD1-OH 2.97Å; P406-Y408 HydrophobicContact CB-CD2 3.62Å; P406-Y408 HydrophobicContact CB-CE2 3.11Å; P406-Y408 HydrophobicContact CG-CE2 3.91Å; P406-Y408 PolarHBondContact O-N 2.87Å; Y408-W541 HydrophobicContact CD1-CD2 4.2Å; Y408-W541 AromaticContact CD1-CE2 3.8Å; Y408-W541 HydrophobicContact CD1-CE3 4.43Å; Y408-W541 AromaticContact CD1-CH2 3.95Å; Y408-W541 HydrophobicContact CD1-CH2 3.95Å; Y408-W541 AromaticContact CD1-CZ2 3.67Å; Y408-W541 HydrophobicContact CD1-CZ2 3.67Å; Y408-W541 HydrophobicContact CD1-CZ3 4.32Å; Y408-W541 AromaticContact CD2-CD1 3.66Å; Y408-W541 HydrophobicContact CD2-CD2 4.15Å; Y408-W541 AromaticContact CD2-CE2 3.61Å; Y408-W541 HydrophobicContact CD2-CG 4.17Å; Y408-W541 HydrophobicContact CD2-CZ2 4.15Å; Y408-W541 AromaticContact CD2-NE1 3.24Å; Y408-W541 AromaticContact CE1-CD2 3.96Å; Y408-W541 HydrophobicContact CE1-CD2 3.96Å; Y408-W541 HydrophobicContact CE1-CE3 4.06Å; Y408-W541 HydrophobicContact CE1-CG 4.5Å; Y408-W541 HydrophobicContact CE1-CH2 4.33Å; Y408-W541 HydrophobicContact CE1-CZ2 4.24Å; Y408-W541 HydrophobicContact CE1-CZ3 4.25Å; Y408-W541 HydrophobicContact CE2-CB 4.3Å; Y408-W541 AromaticContact CE2-CD1 3.42Å; Y408-W541 VanDerWaalsContact CE2-CD1 3.42Å; Y408-W541 AromaticContact CE2-CD2 3.83Å; Y408-W541 HydrophobicContact CE2-CD2 3.83Å; Y408-W541 AromaticContact CE2-CE2 3.8Å; Y408-W541 AromaticContact CE2-CG 3.6Å; Y408-W541 HydrophobicContact CE2-CG 3.6Å; Y408-W541 AromaticContact CE2-NE1 3.5Å; Y408-W541 HydrophobicContact CG-CD2 4.31Å; Y408-W541 AromaticContact CG-CE2 3.59Å; Y408-W541 HydrophobicContact CG-CH2 4.37Å; Y408-W541 AromaticContact CG-CZ2 3.64Å; Y408-W541 HydrophobicContact CG-CZ2 3.64Å; Y408-W541 AromaticContact CG-NE1 3.67Å; Y408-W541 AromaticContact CZ-CD2 3.78Å; Y408-W541 AromaticContact CZ-CG 3.84Å
409	D	64.6	Low	70.8	Confident	89 Å²	89	75.7 Å²	75.7	48%	0.476	39%	0.389	S	S	.	.			trans	-73.4	137.7	173.7	-170.2	8.6	0	0	0	110.4	T411 T412 L413	D409-T411 PolarHBondContact O-N 3.15Å; D409-T411 PolarHBondContact OD2-OG1 2.9Å; D409-T412 HydrophobicContact CB-CG2 4.22Å; D409-T412 PolarHBondContact O-N 3.43Å; D409-T412 PolarHBondContact O-OG1 3.28Å; D409-L413 PolarHBondContact O-N 3.02Å
410	V	67.5	Low	71.1	Confident	72 Å²	72	73.8 Å²	73.8	44%	0.436	38%	0.377	S	S	.	.	H	α-helix	trans	-59.5	-30.8	179.1	176.7	0	0	0	0	111.1	L413 A414 L530	V410-L413 PolarHBondContact O-N 3.28Å; V410-A414 PolarHBondContact O-N 2.9Å; V410-A414 VanDerWaalsContact O-N 3.14Å; V410-L530 HydrophobicContact CG1-CD1 3.55Å; V410-L530 HydrophobicContact CG1-CD2 4.32Å; V410-L530 HydrophobicContact CG2-CD2 4.22Å
411	T	72.1	Confident	71.8	Confident	76 Å²	76	78.2 Å²	78.2	47%	0.466	39%	0.392	S	S	.	.	H	α-helix	trans	-63.1	-43.4	175.1	64.9	0	0	0	0	111.8	D409 L413 A414 E415	D409-T411 PolarHBondContact O-N 3.15Å; D409-T411 PolarHBondContact OD2-OG1 2.9Å; T411-L413 PolarHBondContact O-N 3.44Å; T411-A414 WeakPolarHBondContact O-CB 3.25Å; T411-A414 PolarHBondContact O-N 3.1Å; T411-E415 PolarHBondContact O-N 3.23Å; T411-E415 VanDerWaalsContact O-N 3.09Å
412	T	75.3	Confident	72.7	Confident	19 Å²	19	79.9 Å²	79.9	12%	0.117	40%	0.397	C	S	.	.	H	α-helix	trans	-69.1	-33.5	179.4	64.8	0	0	0	0	112.4	D409 A414 E415 I416	D409-T412 HydrophobicContact CB-CG2 4.22Å; D409-T412 PolarHBondContact O-N 3.43Å; D409-T412 PolarHBondContact O-OG1 3.28Å; T412-A414 VanDerWaalsContact C-N 3.34Å; T412-E415 PolarHBondContact O-N 3.44Å; T412-I416 VanDerWaalsContact O-CG1 3.28Å; T412-I416 WeakPolarHBondContact O-CG1 3.46Å; T412-I416 PolarHBondContact O-N 2.93Å
413	L	78.1	Confident	73.9	Confident	13 Å²	13	73.1 Å²	73.1	7%	0.068	36%	0.361	C	S	.	.	H	α-helix	trans	-67	-35.9	172.8	-177.9	65	0	0	0	111.8	D409 V410 T411 H417 T523 V526 L527 W541	D409-L413 PolarHBondContact O-N 3.02Å; V410-L413 PolarHBondContact O-N 3.28Å; T411-L413 PolarHBondContact O-N 3.44Å; L413-H417 WeakPolarHBondContact O-CB 3.43Å; L413-H417 PolarHBondContact O-N 3.04Å; L413-T523 HydrophobicContact CD1-CG2 4.2Å; L413-V526 HydrophobicContact CD2-CG1 3.88Å; L413-L527 HydrophobicContact CB-CD2 4.44Å; L413-L527 HydrophobicContact CD2-CD2 4.04Å; L413-L527 HydrophobicContact CD2-CG 4.32Å; L413-L527 HydrophobicContact CG-CD2 4.07Å; L413-L527 HydrophobicContact CG-CG 4.32Å; L413-W541 HydrophobicContact CD1-CH2 3.7Å; L413-W541 HydrophobicContact CD1-CZ2 3.96Å
414	A	78.4	Confident	75	Confident	41 Å²	41	65.8 Å²	65.8	34%	0.339	33%	0.332	S	S	.	.	H	α-helix	trans	-66.5	-39.9	175.2	0	0	0	0	0	112	V410 T411 T412 H417 E418 L527	V410-A414 PolarHBondContact O-N 2.9Å; V410-A414 VanDerWaalsContact O-N 3.14Å; T411-A414 WeakPolarHBondContact O-CB 3.25Å; T411-A414 PolarHBondContact O-N 3.1Å; T412-A414 VanDerWaalsContact C-N 3.34Å; A414-H417 PolarHBondContact O-N 3.47Å; A414-E418 PolarHBondContact O-N 3.39Å; A414-L527 HydrophobicContact CB-CD2 4.24Å
415	E	82.6	Confident	76.5	Confident	103 Å²	103	59 Å²	59	48%	0.481	30%	0.303	S	S	.	.	H	α-helix	trans	-64.4	-45.3	174.2	-68.8	177.7	179.5	0	0	112	W393 T411 T412 H417 E418 D419	W393-E415 HydrophobicContact CH2-CB 4.04Å; W393-E415 HydrophobicContact CZ2-CB 4.09Å; T411-E415 PolarHBondContact O-N 3.23Å; T411-E415 VanDerWaalsContact O-N 3.09Å; T412-E415 PolarHBondContact O-N 3.44Å; E415-H417 VanDerWaalsContact C-N 3.33Å; E415-H417 PolarHBondContact O-N 3.13Å; E415-E418 PolarHBondContact O-N 3.38Å; E415-D419 PolarHBondContact O-N 2.97Å
416	I	82.9	Confident	78	Confident	3 Å²	3	58.3 Å²	58.3	2%	0.015	29%	0.29	C	S	.	.	H	α-helix	trans	-60.5	-43.2	175.7	-69.2	165.4	0	0	0	110.9	W393 I397 T412 D419 L420 W541 L544	W393-I416 HydrophobicContact CD2-CG1 3.76Å; W393-I416 HydrophobicContact CE3-CD1 3.86Å; W393-I416 HydrophobicContact CE3-CG1 3.45Å; W393-I416 VanDerWaalsContact CE3-CG1 3.45Å; W393-I416 HydrophobicContact CH2-CG1 3.86Å; W393-I416 HydrophobicContact CZ2-CG1 4.14Å; W393-I416 HydrophobicContact CZ3-CD1 3.9Å; W393-I416 HydrophobicContact CZ3-CG1 3.51Å; I397-I416 HydrophobicContact CD1-CD1 4.39Å; T412-I416 VanDerWaalsContact O-CG1 3.28Å; T412-I416 WeakPolarHBondContact O-CG1 3.46Å; T412-I416 PolarHBondContact O-N 2.93Å; I416-D419 PolarHBondContact O-N 2.95Å; I416-L420 HydrophobicContact CG2-CD1 3.78Å; I416-L420 HydrophobicContact CG2-CG 4.2Å; I416-L420 WeakPolarHBondContact O-CB 3.39Å; I416-L420 VanDerWaalsContact O-CG 3.25Å; I416-L420 WeakPolarHBondContact O-CG 3.5Å; I416-L420 PolarHBondContact O-N 3.31Å; I416-W541 HydrophobicContact CD1-CH2 4.12Å; I416-W541 HydrophobicContact CD1-CZ3 4.06Å; I416-L544 HydrophobicContact CG2-CD2 4.5Å
417	H	84.7	Confident	79.2	Confident	29 Å²	29	56.9 Å²	56.9	13%	0.134	28%	0.281	C	S	.	.	H	α-helix	trans	-62.1	-45.1	177.1	172.2	62.5	0	0	0	112.1	L413 A414 E415 D419 L420 W421 A520 T523 H524 L527	L413-H417 WeakPolarHBondContact O-CB 3.43Å; L413-H417 PolarHBondContact O-N 3.04Å; A414-H417 PolarHBondContact O-N 3.47Å; E415-H417 VanDerWaalsContact C-N 3.33Å; E415-H417 PolarHBondContact O-N 3.13Å; H417-D419 VanDerWaalsContact C-N 3.31Å; H417-D419 PolarHBondContact O-N 2.91Å; H417-L420 PolarHBondContact O-N 3.01Å; H417-W421 WeakPolarHBondContact O-CB 3.48Å; H417-W421 PolarHBondContact O-N 3.21Å; H417-A520 PolarHBondContact CE1-O 3.06Å; H417-A520 PolarHBondContact ND1-O 3.44Å; H417-A520 VanDerWaalsContact ND1-O 3.11Å; H417-T523 PolarHBondContact ND1-OG1 2.75Å; H417-H524 VanDerWaalsContact CE1-CB 3.44Å; H417-H524 WeakPolarHBondContact CE1-CB 3.37Å; H417-H524 AromaticContact CE1-CG 3.84Å; H417-H524 AromaticContact CE1-ND1 3.49Å; H417-H524 PolarHBondContact CE1-ND1 3.41Å; H417-H524 AromaticContact NE2-CG 3.93Å; H417-H524 AromaticContact NE2-ND1 3.13Å; H417-H524 PolarHBondContact NE2-ND1 2.9Å; H417-H524 VanDerWaalsContact NE2-ND1 3.13Å; H417-L527 HydrophobicContact CB-CD1 3.43Å; H417-L527 VanDerWaalsContact CB-CD1 3.43Å
418	E	86.3	Confident	80.5	Confident	102 Å²	102	50.3 Å²	50.3	48%	0.477	25%	0.253	S	S	.	.	H	α-helix	trans	-61.6	-41.4	179.6	-164.1	-173.4	153.5	0	0	111.4	A414 E415 K422	A414-E418 PolarHBondContact O-N 3.39Å; E415-E418 PolarHBondContact O-N 3.38Å; E418-K422 VanDerWaalsContact CD-NZ 3.33Å; E418-K422 HydrophobicContact CG-CD 4.47Å; E418-K422 WeakPolarHBondContact O-CB 3.38Å; E418-K422 WeakPolarHBondContact O-CG 3.01Å; E418-K422 PolarHBondContact O-N 3.49Å; E418-K422 WeakPolarHBondContact OE1-CE 3.28Å; E418-K422 IonicContact OE1-NZ 3.59Å; E418-K422 PolarHBondContact OE1-NZ 3.29Å
419	D	86.4	Confident	81.2	Confident	38 Å²	38	52.7 Å²	52.7	20%	0.203	27%	0.268	C	S	.	.	H	α-helix	trans	-71.2	-43.3	177.8	-77.1	-11.3	0	0	0	112.5	W393 E415 I416 H417 W421 K422 W423	W393-D419 PolarHBondContact NE1-OD2 2.85Å; E415-D419 PolarHBondContact O-N 2.97Å; I416-D419 PolarHBondContact O-N 2.95Å; H417-D419 VanDerWaalsContact C-N 3.31Å; H417-D419 PolarHBondContact O-N 2.91Å; D419-W421 VanDerWaalsContact C-N 3.31Å; D419-W421 PolarHBondContact O-N 3.49Å; D419-K422 PolarHBondContact O-N 3.07Å; D419-K422 IonicContact OD1-NZ 2.93Å; D419-W423 HydrophobicContact CB-CH2 4.22Å; D419-W423 HydrophobicContact CB-CZ2 3.66Å; D419-W423 VanDerWaalsContact O-CD2 3.25Å; D419-W423 PolarHBondContact O-N 3.08Å
420	L	86	Confident	81.6	Confident	2 Å²	2	48.7 Å²	48.7	1%	0.01	25%	0.248	C	C	.	.	H	α-helix	trans	-57.4	-44	173.4	-76.7	172.5	0	0	0	111.7	I416 H417 W423 S424 L516 W519 A520 T523 L544 L548	I416-L420 HydrophobicContact CG2-CD1 3.78Å; I416-L420 HydrophobicContact CG2-CG 4.2Å; I416-L420 WeakPolarHBondContact O-CB 3.39Å; I416-L420 VanDerWaalsContact O-CG 3.25Å; I416-L420 WeakPolarHBondContact O-CG 3.5Å; I416-L420 PolarHBondContact O-N 3.31Å; H417-L420 PolarHBondContact O-N 3.01Å; L420-W423 HydrophobicContact CD2-CE3 3.97Å; L420-W423 HydrophobicContact CD2-CZ3 3.78Å; L420-W423 HydrophobicContact CG-CZ3 4.39Å; L420-W423 PolarHBondContact O-N 3.43Å; L420-S424 WeakPolarHBondContact O-CB 3.31Å; L420-S424 PolarHBondContact O-N 2.98Å; L420-L516 HydrophobicContact CD2-CD2 3.61Å; L420-W519 HydrophobicContact CD1-CB 4.2Å; L420-A520 HydrophobicContact CB-CB 4.18Å; L420-T523 HydrophobicContact CD1-CG2 4.12Å; L420-L544 HydrophobicContact CD1-CD1 4.31Å; L420-L548 HydrophobicContact CD2-CD2 4.35Å
421	W	86.4	Confident	81.9	Confident	137 Å²	137	46.1 Å²	46.1	52%	0.519	23%	0.233	S	C	.	.	H	α-helix	trans	-67	-41.8	178	-171.7	78.7	0	0	0	111.9	H417 D419 S424 N425 A520	H417-W421 WeakPolarHBondContact O-CB 3.48Å; H417-W421 PolarHBondContact O-N 3.21Å; D419-W421 VanDerWaalsContact C-N 3.31Å; D419-W421 PolarHBondContact O-N 3.49Å; W421-S424 PolarHBondContact O-N 3.43Å; W421-N425 VanDerWaalsContact CE3-ND2 3.26Å; W421-N425 WeakPolarHBondContact CH2-ND2 3.37Å; W421-N425 WeakPolarHBondContact CZ2-ND2 3.36Å; W421-N425 WeakPolarHBondContact CZ3-ND2 3.47Å; W421-N425 WeakPolarHBondContact O-CB 3.47Å; W421-N425 PolarHBondContact O-N 3.41Å; W421-N425 PolarHBondContact O-ND2 3.38Å; W421-A520 HydrophobicContact CB-CB 4.38Å
422	K	87.1	Confident	82	Confident	81 Å²	81	48.8 Å²	48.8	35%	0.352	24%	0.24	S	C	.	.	H	α-helix	trans	-60.6	-44.1	173.6	-77.9	168.8	-174.6	160.8	0	112.1	E418 D419 K426	E418-K422 VanDerWaalsContact CD-NZ 3.33Å; E418-K422 HydrophobicContact CG-CD 4.47Å; E418-K422 WeakPolarHBondContact O-CB 3.38Å; E418-K422 WeakPolarHBondContact O-CG 3.01Å; E418-K422 PolarHBondContact O-N 3.49Å; E418-K422 WeakPolarHBondContact OE1-CE 3.28Å; E418-K422 IonicContact OE1-NZ 3.59Å; E418-K422 PolarHBondContact OE1-NZ 3.29Å; D419-K422 PolarHBondContact O-N 3.07Å; D419-K422 IonicContact OD1-NZ 2.93Å; K422-K426 WeakPolarHBondContact O-CB 3.4Å; K422-K426 WeakPolarHBondContact O-CG 3.32Å; K422-K426 PolarHBondContact O-N 2.93Å
423	W	89.3	Confident	81.6	Confident	5 Å²	5	50.6 Å²	50.6	2%	0.019	25%	0.247	C	C	.	.	H	α-helix	trans	-68.4	-41.9	178.6	-54.2	-28	0	0	0	111.6	I386 D389 I390 W393 D419 L420 N425 K426 L427 L516 L548	I386-W423 HydrophobicContact CG1-CB 4.48Å; I386-W423 HydrophobicContact CG1-CG 4.4Å; I386-W423 HydrophobicContact CG2-CB 4.06Å; I386-W423 HydrophobicContact CG2-CD2 4.36Å; I386-W423 HydrophobicContact CG2-CG 3.99Å; D389-W423 HydrophobicContact CB-CH2 4.38Å; D389-W423 HydrophobicContact CB-CZ2 3.38Å; D389-W423 PolarHBondContact OD2-NE1 3.22Å; I390-W423 HydrophobicContact CD1-CE3 4.31Å; I390-W423 HydrophobicContact CD1-CZ3 4.5Å; I390-W423 HydrophobicContact CG1-CD2 4.34Å; I390-W423 HydrophobicContact CG1-CE3 3.72Å; I390-W423 HydrophobicContact CG1-CH2 3.98Å; I390-W423 HydrophobicContact CG1-CZ3 3.51Å; W393-W423 HydrophobicContact CB-CH2 4.44Å; W393-W423 AromaticContact CD1-CH2 3.47Å; W393-W423 VanDerWaalsContact CD1-CH2 3.47Å; W393-W423 AromaticContact CD1-CZ2 3.69Å; W393-W423 HydrophobicContact CG-CH2 4.25Å; D419-W423 HydrophobicContact CB-CH2 4.22Å; D419-W423 HydrophobicContact CB-CZ2 3.66Å; D419-W423 VanDerWaalsContact O-CD2 3.25Å; D419-W423 PolarHBondContact O-N 3.08Å; L420-W423 HydrophobicContact CD2-CE3 3.97Å; L420-W423 HydrophobicContact CD2-CZ3 3.78Å; L420-W423 HydrophobicContact CG-CZ3 4.39Å; L420-W423 PolarHBondContact O-N 3.43Å; W423-N425 PolarHBondContact O-N 2.72Å; W423-K426 PolarHBondContact O-N 3.28Å; W423-L427 WeakPolarHBondContact O-CB 3.16Å; W423-L427 WeakPolarHBondContact O-CG 2.88Å; W423-L427 PolarHBondContact O-N 2.73Å; W423-L516 HydrophobicContact CB-CD1 4.25Å; W423-L516 HydrophobicContact CE3-CD2 4.13Å; W423-L548 HydrophobicContact CZ3-CD2 4.33Å
424	S	86.1	Confident	81	Confident	0 Å²	0	51.5 Å²	51.5	0%	0	25%	0.254	C	S	.	.	H	α-helix	trans	-55.2	-50.6	174.2	-177.8	0	0	0	0	111	L420 W421 K426 L427 S428 F513 D517	L420-S424 WeakPolarHBondContact O-CB 3.31Å; L420-S424 PolarHBondContact O-N 2.98Å; W421-S424 PolarHBondContact O-N 3.43Å; S424-K426 PolarHBondContact O-N 2.8Å; S424-L427 PolarHBondContact O-N 3.16Å; S424-S428 WeakPolarHBondContact O-CB 3.07Å; S424-S428 PolarHBondContact O-N 3.34Å; S424-F513 WeakPolarHBondContact O-CD2 3.37Å; S424-F513 WeakPolarHBondContact O-CE2 3.29Å; S424-F513 WeakPolarHBondContact OG-CE2 3.34Å; S424-D517 WeakPolarHBondContact OG-CA 3.29Å; S424-D517 VanDerWaalsContact OG-CB 3.31Å; S424-D517 WeakPolarHBondContact OG-CB 3.27Å; S424-D517 PolarHBondContact OG-OD1 3.29Å
425	N	84.1	Confident	80.3	Confident	63 Å²	63	54.8 Å²	54.8	34%	0.337	26%	0.262	S	S	.	.	H	α-helix	trans	-63.6	-40.3	178.6	-73.6	-28.5	0	0	0	113.4	W421 W423 S428 L429	W421-N425 VanDerWaalsContact CE3-ND2 3.26Å; W421-N425 WeakPolarHBondContact CH2-ND2 3.37Å; W421-N425 WeakPolarHBondContact CZ2-ND2 3.36Å; W421-N425 WeakPolarHBondContact CZ3-ND2 3.47Å; W421-N425 WeakPolarHBondContact O-CB 3.47Å; W421-N425 PolarHBondContact O-N 3.41Å; W421-N425 PolarHBondContact O-ND2 3.38Å; W423-N425 PolarHBondContact O-N 2.72Å; N425-S428 PolarHBondContact O-N 3.23Å; N425-L429 WeakPolarHBondContact O-CB 2.78Å; N425-L429 PolarHBondContact O-N 3.35Å
426	K	84	Confident	79.8	Confident	105 Å²	105	51.3 Å²	51.3	46%	0.457	25%	0.254	S	S	.	.	H	α-helix	trans	-64.5	-41.2	176.5	-76.9	177.2	178.8	180	0	111.8	I386 K422 W423 S424 L429 A430	I386-K426 HydrophobicContact CD1-CB 4.15Å; K422-K426 WeakPolarHBondContact O-CB 3.4Å; K422-K426 WeakPolarHBondContact O-CG 3.32Å; K422-K426 PolarHBondContact O-N 2.93Å; W423-K426 PolarHBondContact O-N 3.28Å; S424-K426 PolarHBondContact O-N 2.8Å; K426-L429 PolarHBondContact O-N 2.86Å; K426-A430 WeakPolarHBondContact O-CB 3.39Å; K426-A430 PolarHBondContact O-N 3.45Å
427	L	82.9	Confident	79.3	Confident	5 Å²	5	59.3 Å²	59.3	3%	0.026	29%	0.292	C	S	.	.	H	α-helix	trans	-71.2	-34.6	177.2	-69.4	171.6	0	0	0	112.5	L383 I386 W423 S424 S431 L509 M512 F513 L516	L383-L427 HydrophobicContact CD2-CD2 3.7Å; I386-L427 HydrophobicContact CD1-CD1 4.44Å; I386-L427 HydrophobicContact CD1-CD2 3.77Å; I386-L427 HydrophobicContact CD1-CG 3.77Å; W423-L427 WeakPolarHBondContact O-CB 3.16Å; W423-L427 WeakPolarHBondContact O-CG 2.88Å; W423-L427 PolarHBondContact O-N 2.73Å; S424-L427 PolarHBondContact O-N 3.16Å; L427-S431 WeakPolarHBondContact O-CB 2.89Å; L427-S431 PolarHBondContact O-N 3.31Å; L427-L509 HydrophobicContact CD2-CD2 4.03Å; L427-M512 HydrophobicContact CD1-CB 4.36Å; L427-F513 HydrophobicContact CB-CB 4.07Å; L427-F513 HydrophobicContact CB-CD2 4.29Å; L427-L516 HydrophobicContact CD1-CD1 3.45Å; L427-L516 VanDerWaalsContact CD1-CD1 3.45Å
428	S	82	Confident	78.8	Confident	30 Å²	30	61.5 Å²	61.5	21%	0.21	30%	0.299	C	S	.	.	H	α-helix	trans	-58.9	-51.9	170.9	171.3	0	0	0	0	110.8	S424 N425 A430 S431 E432 F513	S424-S428 WeakPolarHBondContact O-CB 3.07Å; S424-S428 PolarHBondContact O-N 3.34Å; N425-S428 PolarHBondContact O-N 3.23Å; S428-A430 PolarHBondContact O-N 2.92Å; S428-S431 WeakPolarHBondContact O-CB 3.25Å; S428-S431 PolarHBondContact O-N 3.49Å; S428-S431 VanDerWaalsContact O-N 3.15Å; S428-E432 WeakPolarHBondContact O-CG 2.81Å; S428-E432 PolarHBondContact O-N 2.63Å; S428-F513 VanDerWaalsContact CB-CE2 3.49Å
429	L	79.4	Confident	78.3	Confident	93 Å²	93	59.5 Å²	59.5	49%	0.487	29%	0.288	S	S	.	.	H	α-helix	trans	-62.4	-43.4	179.5	-164.3	116.4	0	0	0	111.6	N425 K426 S431 E432 E433	N425-L429 WeakPolarHBondContact O-CB 2.78Å; N425-L429 PolarHBondContact O-N 3.35Å; K426-L429 PolarHBondContact O-N 2.86Å; L429-S431 VanDerWaalsContact C-N 3.31Å; L429-S431 PolarHBondContact O-N 3.01Å; L429-E432 PolarHBondContact O-N 3.46Å; L429-E433 WeakPolarHBondContact O-CB 3.27Å; L429-E433 VanDerWaalsContact O-CG 3.32Å; L429-E433 WeakPolarHBondContact O-CG 3.46Å; L429-E433 PolarHBondContact O-N 3.43Å
430	A	72.2	Confident	78	Confident	6 Å²	6	63.6 Å²	63.6	5%	0.05	31%	0.309	C	S	.	.	H	α-helix	trans	-61.5	-39	175.5	0	0	0	0	0	112.1	K426 S428 C434	K426-A430 WeakPolarHBondContact O-CB 3.39Å; K426-A430 PolarHBondContact O-N 3.45Å; S428-A430 PolarHBondContact O-N 2.92Å; A430-C434 PolarHBondContact O-N 3.31Å; A430-C434 PolarHBondContact O-SG 3.26Å
431	S	74.2	Confident	77.8	Confident	17 Å²	17	66.8 Å²	66.8	12%	0.119	33%	0.326	C	S	.	.	H	α-helix	trans	-69	-42	177.5	-172.2	0	0	0	0	112.5	L427 S428 L429 C434 Q435 H506	L427-S431 WeakPolarHBondContact O-CB 2.89Å; L427-S431 PolarHBondContact O-N 3.31Å; S428-S431 WeakPolarHBondContact O-CB 3.25Å; S428-S431 PolarHBondContact O-N 3.49Å; S428-S431 VanDerWaalsContact O-N 3.15Å; L429-S431 VanDerWaalsContact C-N 3.31Å; L429-S431 PolarHBondContact O-N 3.01Å; S431-C434 WeakPolarHBondContact O-CB 3.19Å; S431-C434 PolarHBondContact O-N 3.43Å; S431-Q435 PolarHBondContact O-N 2.96Å; S431-H506 PolarHBondContact OG-CE1 3.26Å
432	E	73.3	Confident	77.7	Confident	132 Å²	132	60.5 Å²	60.5	62%	0.617	30%	0.302	S	S	*	.	H	α-helix	trans	-66.6	-40.6	175.9	-73.9	-176.1	176	0	0	112.1	S428 L429 C434 Q435 G436	S428-E432 WeakPolarHBondContact O-CG 2.81Å; S428-E432 PolarHBondContact O-N 2.63Å; L429-E432 PolarHBondContact O-N 3.46Å; E432-C434 PolarHBondContact O-N 3.05Å; E432-Q435 PolarHBondContact O-N 2.85Å; E432-Q435 VanDerWaalsContact O-N 3.17Å; E432-G436 WeakPolarHBondContact O-CA 3.34Å; E432-G436 PolarHBondContact O-N 3.27Å
433	E	68	Low	77.5	Confident	58 Å²	58	61.7 Å²	61.7	27%	0.271	31%	0.307	S	S	.	.	H	α-helix	trans	-61.4	-29.2	174.6	-76.6	-172.3	165.9	0	0	112.8	L429 R438	L429-E433 WeakPolarHBondContact O-CB 3.27Å; L429-E433 VanDerWaalsContact O-CG 3.32Å; L429-E433 WeakPolarHBondContact O-CG 3.46Å; L429-E433 PolarHBondContact O-N 3.43Å; E433-R438 WeakPolarHBondContact O-CB 3.48Å; E433-R438 IonicContact OE1-NH2 3.81Å; E433-R438 PolarHBondContact OE1-NH2 2.98Å; E433-R438 IonicContact OE2-CZ 2.7Å; E433-R438 IonicContact OE2-NH1 3.81Å; E433-R438 PolarHBondContact OE2-NH1 2.86Å; E433-R438 IonicContact OE2-NH2 3.83Å; E433-R438 PolarHBondContact OE2-NH2 3.06Å
434	C	63.7	Low	77.4	Confident	31 Å²	31	67.2 Å²	67.2	21%	0.209	33%	0.331	C	S	.	.	H	α-helix	trans	-72.9	-36.7	175.2	-64.2	0	0	0	0	113.1	Q379 A430 S431 E432	Q379-C434 PolarHBondContact NE2-SG 3.31Å; A430-C434 PolarHBondContact O-N 3.31Å; A430-C434 PolarHBondContact O-SG 3.26Å; S431-C434 WeakPolarHBondContact O-CB 3.19Å; S431-C434 PolarHBondContact O-N 3.43Å; E432-C434 PolarHBondContact O-N 3.05Å
435	Q	64.8	Low	77.4	Confident	111 Å²	111	71.2 Å²	71.2	52%	0.519	35%	0.346	S	S	.	.	H	α-helix	trans	-96.2	-21.3	-174.7	-69.7	-160.7	-8.3	0	0	113.8	S431 E432 H506	S431-Q435 PolarHBondContact O-N 2.96Å; E432-Q435 PolarHBondContact O-N 2.85Å; E432-Q435 VanDerWaalsContact O-N 3.17Å; Q435-H506 PolarHBondContact NE2-CE1 3.34Å; Q435-H506 PolarHBondContact NE2-NE2 3.17Å
436	G	72	Confident	77.5	Confident	30 Å²	30	68.7 Å²	68.7	31%	0.309	33%	0.333	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.4	-128.6	-175.2	0	0	0	0	0	114.1	E432 R438 K439 I440	E432-G436 WeakPolarHBondContact O-CA 3.34Å; E432-G436 PolarHBondContact O-N 3.27Å; G436-R438 VanDerWaalsContact C-N 3.3Å; G436-R438 PolarHBondContact O-N 2.69Å; G436-K439 PolarHBondContact O-N 3.35Å; G436-I440 PolarHBondContact O-N 2.76Å
437	E	73	Confident	77.7	Confident	171 Å²	171	66.7 Å²	66.7	80%	0.799	33%	0.332	S	S	*	.	H	α-helix	trans	-60.3	-34.6	-170.2	-63.4	-176	167	0	0	113.9	K439 I440 L441	E437-K439 PolarHBondContact O-N 3.29Å; E437-I440 PolarHBondContact O-N 3.13Å; E437-L441 PolarHBondContact O-N 3.47Å
438	R	73.4	Confident	78	Confident	75 Å²	75	70.1 Å²	70.1	28%	0.283	35%	0.348	S	S	.	.	H	α-helix	trans	-67.5	-34.7	-178.5	-61.3	-175.3	-178.5	155.5	10.7	112.4	F371 I375 E433 G436 L441 F442	F371-R438 HydrophobicContact CZ-CB 4.14Å; I375-R438 HydrophobicContact CD1-CB 4.04Å; I375-R438 HydrophobicContact CD1-CG 4.38Å; E433-R438 WeakPolarHBondContact O-CB 3.48Å; E433-R438 IonicContact OE1-NH2 3.81Å; E433-R438 PolarHBondContact OE1-NH2 2.98Å; E433-R438 IonicContact OE2-CZ 2.7Å; E433-R438 IonicContact OE2-NH1 3.81Å; E433-R438 PolarHBondContact OE2-NH1 2.86Å; E433-R438 IonicContact OE2-NH2 3.83Å; E433-R438 PolarHBondContact OE2-NH2 3.06Å; G436-R438 VanDerWaalsContact C-N 3.3Å; G436-R438 PolarHBondContact O-N 2.69Å; R438-L441 PolarHBondContact O-N 2.95Å; R438-F442 WeakPolarHBondContact O-CB 3.32Å; R438-F442 PolarHBondContact O-N 2.85Å
439	K	75.6	Confident	78.2	Confident	60 Å²	60	68.8 Å²	68.8	26%	0.261	34%	0.338	S	S	.	.	H	α-helix	trans	-67.7	-39.7	174.3	-176.2	175	179.6	169.2	0	111.9	G436 E437 F442 K443 S500	G436-K439 PolarHBondContact O-N 3.35Å; E437-K439 PolarHBondContact O-N 3.29Å; K439-F442 WeakPolarHBondContact O-CB 3.04Å; K439-F442 PolarHBondContact O-N 3.2Å; K439-K443 WeakPolarHBondContact O-CG 3.31Å; K439-K443 PolarHBondContact O-N 3.47Å; K439-S500 WeakPolarHBondContact CE-O 3.15Å; K439-S500 PolarHBondContact NZ-O 3.43Å
440	I	80.9	Confident	78.6	Confident	123 Å²	123	67.2 Å²	67.2	63%	0.631	33%	0.327	S	S	*	.	H	α-helix	trans	-64.8	-45.1	175.4	-62.1	171	0	0	0	109.8	G436 E437 F442 K443 K444	G436-I440 PolarHBondContact O-N 2.76Å; E437-I440 PolarHBondContact O-N 3.13Å; I440-F442 VanDerWaalsContact C-N 3.34Å; I440-F442 PolarHBondContact O-N 3.25Å; I440-K443 PolarHBondContact O-N 3.43Å; I440-K444 WeakPolarHBondContact O-CB 3.3Å; I440-K444 PolarHBondContact O-N 2.87Å
441	L	82.2	Confident	79.4	Confident	70 Å²	70	71.7 Å²	71.7	37%	0.366	35%	0.346	S	S	.	.	H	α-helix	trans	-62.2	-41.8	176.8	-162.7	83.5	0	0	0	111.8	F371 E437 R438 K444 R445	F371-L441 HydrophobicContact CD2-CD2 4.23Å; F371-L441 HydrophobicContact CE1-CD2 4.38Å; F371-L441 HydrophobicContact CE2-CD2 3.47Å; F371-L441 VanDerWaalsContact CE2-CD2 3.47Å; F371-L441 HydrophobicContact CZ-CB 4.22Å; F371-L441 HydrophobicContact CZ-CD2 3.55Å; F371-L441 HydrophobicContact CZ-CG 4.4Å; E437-L441 PolarHBondContact O-N 3.47Å; R438-L441 PolarHBondContact O-N 2.95Å; L441-K444 PolarHBondContact O-N 3.09Å; L441-R445 WeakPolarHBondContact O-CG 3.33Å; L441-R445 PolarHBondContact O-N 2.69Å
442	F	82.8	Confident	80.1	Confident	4 Å²	4	71.1 Å²	71.1	2%	0.018	34%	0.342	C	S	.	.	H	α-helix	trans	-57.4	-53.7	174.9	177.5	-101.2	0	0	0	111.5	L368 F371 V372 R438 K439 I440 K444 R445 L446 Y495 V499	L368-F442 HydrophobicContact CD2-CD2 4.46Å; L368-F442 HydrophobicContact CD2-CE2 3.79Å; L368-F442 HydrophobicContact CG-CE2 4.27Å; F371-F442 HydrophobicContact CE1-CB 4.18Å; V372-F442 HydrophobicContact CG2-CD2 3.84Å; V372-F442 HydrophobicContact CG2-CE2 3.62Å; R438-F442 WeakPolarHBondContact O-CB 3.32Å; R438-F442 PolarHBondContact O-N 2.85Å; K439-F442 WeakPolarHBondContact O-CB 3.04Å; K439-F442 PolarHBondContact O-N 3.2Å; I440-F442 VanDerWaalsContact C-N 3.34Å; I440-F442 PolarHBondContact O-N 3.25Å; F442-K444 VanDerWaalsContact C-N 3.27Å; F442-K444 PolarHBondContact O-N 3.18Å; F442-R445 PolarHBondContact O-N 2.59Å; F442-L446 HydrophobicContact CE1-CD1 3.69Å; F442-L446 HydrophobicContact CZ-CD1 3.65Å; F442-L446 VanDerWaalsContact O-CB 3.31Å; F442-L446 WeakPolarHBondContact O-CB 2.96Å; F442-L446 PolarHBondContact O-N 2.73Å; F442-Y495 HydrophobicContact CE2-CD1 4.19Å; F442-Y495 AromaticContact CE2-CE1 3.77Å; F442-Y495 HydrophobicContact CE2-CE1 3.77Å; F442-Y495 AromaticContact CZ-CD1 3.93Å; F442-Y495 HydrophobicContact CZ-CD1 3.93Å; F442-Y495 AromaticContact CZ-CE1 3.96Å; F442-Y495 HydrophobicContact CZ-CE1 3.96Å; F442-V499 HydrophobicContact CD1-CG1 3.98Å; F442-V499 HydrophobicContact CD2-CG1 3.88Å; F442-V499 HydrophobicContact CE1-CB 3.82Å; F442-V499 HydrophobicContact CE1-CG1 3.77Å; F442-V499 HydrophobicContact CE2-CB 4.03Å; F442-V499 HydrophobicContact CE2-CG1 3.65Å; F442-V499 HydrophobicContact CE2-CG2 4.19Å; F442-V499 HydrophobicContact CG-CG1 4.03Å; F442-V499 HydrophobicContact CZ-CB 3.54Å; F442-V499 HydrophobicContact CZ-CG1 3.6Å; F442-V499 HydrophobicContact CZ-CG2 3.95Å
443	K	83.9	Confident	80.7	Confident	106 Å²	106	65 Å²	65	46%	0.461	31%	0.313	S	S	.	.	H	α-helix	trans	-59.6	-38.2	177.9	-73.6	-169.4	173.1	-163.8	0	112.5	K439 I440 L446 S447	K439-K443 WeakPolarHBondContact O-CG 3.31Å; K439-K443 PolarHBondContact O-N 3.47Å; I440-K443 PolarHBondContact O-N 3.43Å; K443-L446 PolarHBondContact O-N 3.01Å; K443-S447 WeakPolarHBondContact O-CB 3.32Å; K443-S447 PolarHBondContact O-N 2.68Å; K443-S447 PolarHBondContact O-OG 2.69Å
444	K	87.8	Confident	81.7	Confident	121 Å²	121	64.9 Å²	64.9	53%	0.526	31%	0.314	S	S	.	.	H	α-helix	trans	-62.2	-52.3	175.6	-173.8	-176.7	176.7	-171.6	0	111.3	I440 L441 F442 L446 S447 E448	I440-K444 WeakPolarHBondContact O-CB 3.3Å; I440-K444 PolarHBondContact O-N 2.87Å; L441-K444 PolarHBondContact O-N 3.09Å; F442-K444 VanDerWaalsContact C-N 3.27Å; F442-K444 PolarHBondContact O-N 3.18Å; K444-L446 VanDerWaalsContact C-N 3.28Å; K444-L446 PolarHBondContact O-N 2.51Å; K444-S447 PolarHBondContact O-N 3.38Å; K444-S447 VanDerWaalsContact O-N 3.15Å; K444-S447 PolarHBondContact O-OG 2.56Å; K444-E448 VanDerWaalsContact CE-OE1 3.23Å; K444-E448 WeakPolarHBondContact CE-OE1 3.48Å; K444-E448 WeakPolarHBondContact O-CG 3.33Å; K444-E448 PolarHBondContact O-N 2.67Å
445	R	86.3	Confident	82.9	Confident	84 Å²	84	67.8 Å²	67.8	32%	0.317	32%	0.324	S	S	.	.	H	α-helix	trans	-60.5	-39.1	178.5	-70.1	178.7	-179.8	-152.9	-1.9	111.9	D367 L368 F371 L441 F442 E448 L449	D367-R445 PolarHBondContact O-NH1 3.35Å; L368-R445 HydrophobicContact CD1-CB 3.89Å; L368-R445 HydrophobicContact CG-CB 4.45Å; F371-R445 VanDerWaalsContact CB-NH1 3.33Å; L441-R445 WeakPolarHBondContact O-CG 3.33Å; L441-R445 PolarHBondContact O-N 2.69Å; F442-R445 PolarHBondContact O-N 2.59Å; R445-E448 PolarHBondContact O-N 2.97Å; R445-L449 WeakPolarHBondContact O-CB 3.19Å; R445-L449 PolarHBondContact O-N 2.6Å
446	L	86.1	Confident	84	Confident	11 Å²	11	62.7 Å²	62.7	6%	0.058	30%	0.3	C	S	.	.	H	α-helix	trans	-66.1	-39.3	177	-165.4	147.3	0	0	0	111.5	L368 F442 K443 K444 L449 Y450 D496	L368-L446 HydrophobicContact CD1-CB 3.99Å; F442-L446 HydrophobicContact CE1-CD1 3.69Å; F442-L446 HydrophobicContact CZ-CD1 3.65Å; F442-L446 VanDerWaalsContact O-CB 3.31Å; F442-L446 WeakPolarHBondContact O-CB 2.96Å; F442-L446 PolarHBondContact O-N 2.73Å; K443-L446 PolarHBondContact O-N 3.01Å; K444-L446 VanDerWaalsContact C-N 3.28Å; K444-L446 PolarHBondContact O-N 2.51Å; L446-L449 WeakPolarHBondContact O-CB 3.3Å; L446-L449 PolarHBondContact O-N 2.97Å; L446-Y450 HydrophobicContact CD2-CD2 3.57Å; L446-Y450 HydrophobicContact CD2-CE2 3.14Å; L446-Y450 HydrophobicContact CG-CE2 4.3Å; L446-Y450 WeakPolarHBondContact O-CD2 3.47Å; L446-Y450 PolarHBondContact O-N 3.42Å; L446-D496 HydrophobicContact CD1-CB 3.85Å
447	S	87.3	Confident	84.7	Confident	63 Å²	63	61.5 Å²	61.5	44%	0.441	29%	0.286	S	S	.	.	H	α-helix	trans	-67.4	-37.1	174.1	72.3	0	0	0	0	113.3	K443 K444 L449 Y450 H451	K443-S447 WeakPolarHBondContact O-CB 3.32Å; K443-S447 PolarHBondContact O-N 2.68Å; K443-S447 PolarHBondContact O-OG 2.69Å; K444-S447 PolarHBondContact O-N 3.38Å; K444-S447 VanDerWaalsContact O-N 3.15Å; K444-S447 PolarHBondContact O-OG 2.56Å; S447-L449 VanDerWaalsContact C-N 3.29Å; S447-L449 PolarHBondContact O-N 3.43Å; S447-Y450 PolarHBondContact O-N 2.91Å; S447-H451 WeakPolarHBondContact O-CB 3.08Å; S447-H451 PolarHBondContact O-N 3.43Å
448	E	88.6	Confident	85.4	Confident	77 Å²	77	58.3 Å²	58.3	36%	0.36	27%	0.27	S	S	.	.	H	α-helix	trans	-63.2	-39.3	173.8	-71.1	171.2	-171.6	0	0	110.9	K444 R445 H451 T452	K444-E448 VanDerWaalsContact CE-OE1 3.23Å; K444-E448 WeakPolarHBondContact CE-OE1 3.48Å; K444-E448 WeakPolarHBondContact O-CG 3.33Å; K444-E448 PolarHBondContact O-N 2.67Å; R445-E448 PolarHBondContact O-N 2.97Å; E448-H451 PolarHBondContact O-N 3.24Å; E448-T452 PolarHBondContact O-N 3.22Å; E448-T452 PolarHBondContact O-OG1 3.32Å; E448-T452 VanDerWaalsContact O-OG1 3.08Å
449	L	87.5	Confident	86.1	Confident	1 Å²	1	56.3 Å²	56.3	1%	0.005	26%	0.264	C	S	.	.	H	α-helix	trans	-66.1	-44.5	177.7	-170.6	151.2	0	0	0	111.9	W361 Q364 L365 L368 R445 L446 S447 H451 T452 L453 L492	W361-L449 VanDerWaalsContact CD1-O 3.31Å; W361-L449 HydrophobicContact CZ2-CD2 4.13Å; Q364-L449 HydrophobicContact CB-CD1 4.48Å; L365-L449 HydrophobicContact CB-CD1 3.79Å; L365-L449 HydrophobicContact CD1-CD1 3.77Å; L365-L449 HydrophobicContact CG-CD1 4.4Å; L368-L449 HydrophobicContact CD1-CD1 4.44Å; R445-L449 WeakPolarHBondContact O-CB 3.19Å; R445-L449 PolarHBondContact O-N 2.6Å; L446-L449 WeakPolarHBondContact O-CB 3.3Å; L446-L449 PolarHBondContact O-N 2.97Å; S447-L449 VanDerWaalsContact C-N 3.29Å; S447-L449 PolarHBondContact O-N 3.43Å; L449-H451 VanDerWaalsContact C-N 3.32Å; L449-H451 PolarHBondContact O-N 3.41Å; L449-T452 PolarHBondContact O-N 3.38Å; L449-L453 WeakPolarHBondContact O-CB 3.24Å; L449-L453 PolarHBondContact O-N 2.94Å; L449-L492 HydrophobicContact CD2-CD1 3.32Å; L449-L492 HydrophobicContact CD2-CD2 3.53Å; L449-L492 HydrophobicContact CD2-CG 4.07Å
450	Y	87.1	Confident	86.7	Confident	61 Å²	61	53.5 Å²	53.5	24%	0.239	25%	0.252	C	S	.	.	H	α-helix	trans	-60.5	-40.9	172.5	-82.5	-55.1	0	0	0	112.8	L446 S447 L453 D454 I489 L492 K493	L446-Y450 HydrophobicContact CD2-CD2 3.57Å; L446-Y450 HydrophobicContact CD2-CE2 3.14Å; L446-Y450 HydrophobicContact CG-CE2 4.3Å; L446-Y450 WeakPolarHBondContact O-CD2 3.47Å; L446-Y450 PolarHBondContact O-N 3.42Å; S447-Y450 PolarHBondContact O-N 2.91Å; Y450-L453 HydrophobicContact CD1-CD2 4.44Å; Y450-L453 WeakPolarHBondContact O-CB 3.37Å; Y450-L453 PolarHBondContact O-N 2.86Å; Y450-D454 WeakPolarHBondContact O-CB 3.44Å; Y450-D454 PolarHBondContact O-N 3.18Å; Y450-I489 HydrophobicContact CE1-CG1 4.18Å; Y450-I489 HydrophobicContact CE1-CG2 4.37Å; Y450-L492 HydrophobicContact CD1-CD1 3.86Å; Y450-L492 HydrophobicContact CE1-CB 3.78Å; Y450-L492 HydrophobicContact CE1-CD1 3.53Å; Y450-L492 HydrophobicContact CE1-CG 4.33Å; Y450-L492 VanDerWaalsContact OH-CB 3.28Å; Y450-L492 WeakPolarHBondContact OH-CB 2.85Å; Y450-K493 PolarHBondContact OH-N 3.32Å
451	H	89.1	Confident	86.9	Confident	100 Å²	100	49 Å²	49	46%	0.463	23%	0.228	S	C	.	.	H	α-helix	trans	-67.8	-37.2	179.7	169	-91	0	0	0	112.1	S447 E448 L449 K455	S447-H451 WeakPolarHBondContact O-CB 3.08Å; S447-H451 PolarHBondContact O-N 3.43Å; E448-H451 PolarHBondContact O-N 3.24Å; L449-H451 VanDerWaalsContact C-N 3.32Å; L449-H451 PolarHBondContact O-N 3.41Å; H451-K455 WeakPolarHBondContact CE1-CE 3.15Å; H451-K455 PolarHBondContact CE1-NZ 2.87Å; H451-K455 WeakPolarHBondContact NE2-CE 3.48Å; H451-K455 WeakPolarHBondContact O-CG 3.49Å; H451-K455 PolarHBondContact O-N 3.49Å
452	T	88.1	Confident	87.1	Confident	4 Å²	4	48.8 Å²	48.8	3%	0.025	23%	0.225	C	C	.	.	H	α-helix	trans	-66	-40.7	172.7	-53.3	0	0	0	0	111.1	L357 W361 Q364 E448 L449 K455 F456	L357-T452 HydrophobicContact CB-CG2 4.39Å; L357-T452 HydrophobicContact CD2-CG2 4.23Å; L357-T452 WeakPolarHBondContact O-CG2 3.48Å; W361-T452 HydrophobicContact CB-CG2 3.82Å; Q364-T452 PolarHBondContact OE1-OG1 2.77Å; E448-T452 PolarHBondContact O-N 3.22Å; E448-T452 PolarHBondContact O-OG1 3.32Å; E448-T452 VanDerWaalsContact O-OG1 3.08Å; L449-T452 PolarHBondContact O-N 3.38Å; T452-K455 PolarHBondContact O-N 3.12Å; T452-F456 VanDerWaalsContact O-CD1 3.23Å; T452-F456 WeakPolarHBondContact O-CD1 3.37Å; T452-F456 PolarHBondContact O-N 2.92Å
453	L	87.1	Confident	87.3	Confident	4 Å²	4	48.6 Å²	48.6	2%	0.021	22%	0.224	C	C	.	.	H	α-helix	trans	-57.6	-56.1	175.7	-178.8	63.6	0	0	0	112.1	L449 Y450 K455 F456 I457 V488 I489 L492	L449-L453 WeakPolarHBondContact O-CB 3.24Å; L449-L453 PolarHBondContact O-N 2.94Å; Y450-L453 HydrophobicContact CD1-CD2 4.44Å; Y450-L453 WeakPolarHBondContact O-CB 3.37Å; Y450-L453 PolarHBondContact O-N 2.86Å; L453-K455 PolarHBondContact O-N 3.11Å; L453-F456 VanDerWaalsContact CA-CE1 3.5Å; L453-F456 HydrophobicContact CB-CE1 4.29Å; L453-F456 HydrophobicContact CD1-CE1 3.54Å; L453-F456 HydrophobicContact CD1-CE2 4.22Å; L453-F456 HydrophobicContact CD1-CZ 3.29Å; L453-F456 HydrophobicContact CG-CE1 4.47Å; L453-F456 PolarHBondContact O-N 3.46Å; L453-I457 HydrophobicContact CD1-CD1 3.55Å; L453-I457 HydrophobicContact CD1-CG1 4.24Å; L453-I457 HydrophobicContact CG-CD1 3.69Å; L453-I457 WeakPolarHBondContact O-CB 3.2Å; L453-I457 VanDerWaalsContact O-CG1 3.27Å; L453-I457 WeakPolarHBondContact O-CG1 3.32Å; L453-I457 PolarHBondContact O-N 3.04Å; L453-V488 HydrophobicContact CD1-CG1 3.98Å; L453-V488 HydrophobicContact CD2-CB 4.29Å; L453-V488 HydrophobicContact CD2-CG1 3.59Å; L453-V488 HydrophobicContact CG-CG1 4.46Å; L453-I489 HydrophobicContact CD2-CG1 4.09Å; L453-L492 HydrophobicContact CD2-CD1 4.08Å
454	D	87.9	Confident	87.4	Confident	55 Å²	55	43.6 Å²	43.6	29%	0.294	20%	0.203	S	C	.	.	H	α-helix	trans	-55.5	-38.6	178.3	171.2	77.7	0	0	0	112.1	Y450 K458	Y450-D454 WeakPolarHBondContact O-CB 3.44Å; Y450-D454 PolarHBondContact O-N 3.18Å; D454-K458 WeakPolarHBondContact O-CB 3.46Å; D454-K458 WeakPolarHBondContact O-CD 3.21Å; D454-K458 WeakPolarHBondContact O-CG 3.48Å; D454-K458 PolarHBondContact O-N 2.88Å; D454-K458 WeakPolarHBondContact OD1-CE 3.2Å; D454-K458 IonicContact OD1-NZ 3.15Å; D454-K458 PolarHBondContact OD1-NZ 3.46Å; D454-K458 WeakPolarHBondContact OD2-CE 3.39Å; D454-K458 IonicContact OD2-NZ 3.05Å; D454-K458 PolarHBondContact OD2-NZ 3.13Å
455	K	89	Confident	87.3	Confident	93 Å²	93	41.1 Å²	41.1	40%	0.404	19%	0.193	S	C	.	.	H	α-helix	trans	-64.8	-52.7	178.3	-81.4	-177.7	169.7	-172.5	0	113.4	L357 H451 T452 L453 I457 K458 I459	L357-K455 HydrophobicContact CD1-CB 4.05Å; H451-K455 WeakPolarHBondContact CE1-CE 3.15Å; H451-K455 PolarHBondContact CE1-NZ 2.87Å; H451-K455 WeakPolarHBondContact NE2-CE 3.48Å; H451-K455 WeakPolarHBondContact O-CG 3.49Å; H451-K455 PolarHBondContact O-N 3.49Å; T452-K455 PolarHBondContact O-N 3.12Å; L453-K455 PolarHBondContact O-N 3.11Å; K455-I457 VanDerWaalsContact C-N 3.29Å; K455-I457 PolarHBondContact O-N 3.1Å; K455-K458 PolarHBondContact O-N 3.1Å; K455-I459 WeakPolarHBondContact O-CG1 3.43Å; K455-I459 PolarHBondContact O-N 3.42Å; K455-I459 VanDerWaalsContact O-N 3.16Å
456	F	88.4	Confident	87.2	Confident	3 Å²	3	37.2 Å²	37.2	1%	0.013	18%	0.178	C	C	.	.	H	α-helix	trans	-71.3	-29.7	-177.1	77.1	-108.7	0	0	0	111.7	L357 W361 T452 L453 I459 S460 V585	L357-F456 HydrophobicContact CB-CB 3.77Å; L357-F456 HydrophobicContact CD1-CB 3.96Å; W361-F456 HydrophobicContact CB-CE1 4.22Å; W361-F456 HydrophobicContact CG-CE1 4.07Å; T452-F456 VanDerWaalsContact O-CD1 3.23Å; T452-F456 WeakPolarHBondContact O-CD1 3.37Å; T452-F456 PolarHBondContact O-N 2.92Å; L453-F456 VanDerWaalsContact CA-CE1 3.5Å; L453-F456 HydrophobicContact CB-CE1 4.29Å; L453-F456 HydrophobicContact CD1-CE1 3.54Å; L453-F456 HydrophobicContact CD1-CE2 4.22Å; L453-F456 HydrophobicContact CD1-CZ 3.29Å; L453-F456 HydrophobicContact CG-CE1 4.47Å; L453-F456 PolarHBondContact O-N 3.46Å; F456-I459 PolarHBondContact O-N 3.07Å; F456-S460 WeakPolarHBondContact O-CB 3.5Å; F456-S460 PolarHBondContact O-N 2.97Å; F456-S460 PolarHBondContact O-OG 3.38Å; F456-V585 HydrophobicContact CZ-CG1 4.11Å
457	I	87.1	Confident	87.1	Confident	6 Å²	6	37.2 Å²	37.2	3%	0.031	18%	0.178	C	C	.	.	H	α-helix	trans	-65.1	-45.8	173.5	-71.1	176.3	0	0	0	111.1	L453 K455 I459 S460 F461 I481 E485	L453-I457 HydrophobicContact CD1-CD1 3.55Å; L453-I457 HydrophobicContact CD1-CG1 4.24Å; L453-I457 HydrophobicContact CG-CD1 3.69Å; L453-I457 WeakPolarHBondContact O-CB 3.2Å; L453-I457 VanDerWaalsContact O-CG1 3.27Å; L453-I457 WeakPolarHBondContact O-CG1 3.32Å; L453-I457 PolarHBondContact O-N 3.04Å; K455-I457 VanDerWaalsContact C-N 3.29Å; K455-I457 PolarHBondContact O-N 3.1Å; I457-I459 VanDerWaalsContact C-N 3.35Å; I457-I459 PolarHBondContact O-N 3.24Å; I457-S460 WeakPolarHBondContact O-CB 3.41Å; I457-S460 PolarHBondContact O-N 3.34Å; I457-S460 VanDerWaalsContact O-N 3.15Å; I457-F461 HydrophobicContact CG2-CD2 3.61Å; I457-F461 HydrophobicContact CG2-CE2 3.24Å; I457-F461 HydrophobicContact CG2-CZ 4.24Å; I457-F461 WeakPolarHBondContact O-CD2 3.46Å; I457-F461 PolarHBondContact O-N 2.8Å; I457-I481 HydrophobicContact CG2-CG2 4.25Å; I457-E485 HydrophobicContact CD1-CB 3.72Å; I457-E485 HydrophobicContact CD1-CG 3.58Å
458	K	88.1	Confident	86.7	Confident	104 Å²	104	35 Å²	35	45%	0.452	16%	0.162	S	C	.	.	H	α-helix	trans	-58	-44.7	174.9	-78.6	170.2	176.6	164.4	0	112.7	D454 K455 S460 F461 H462	D454-K458 WeakPolarHBondContact O-CB 3.46Å; D454-K458 WeakPolarHBondContact O-CD 3.21Å; D454-K458 WeakPolarHBondContact O-CG 3.48Å; D454-K458 PolarHBondContact O-N 2.88Å; D454-K458 WeakPolarHBondContact OD1-CE 3.2Å; D454-K458 IonicContact OD1-NZ 3.15Å; D454-K458 PolarHBondContact OD1-NZ 3.46Å; D454-K458 WeakPolarHBondContact OD2-CE 3.39Å; D454-K458 IonicContact OD2-NZ 3.05Å; D454-K458 PolarHBondContact OD2-NZ 3.13Å; K455-K458 PolarHBondContact O-N 3.1Å; K458-S460 VanDerWaalsContact C-N 3.32Å; K458-F461 PolarHBondContact O-N 2.85Å; K458-H462 PolarHBondContact O-CD2 3.25Å; K458-H462 PolarHBondContact O-N 3.38Å
459	I	87.9	Confident	85.6	Confident	33 Å²	33	32.5 Å²	32.5	17%	0.169	15%	0.15	C	C	.	.	H	α-helix	trans	-65.2	-40.2	177.2	-59.6	169	0	0	0	110.1	D350 V353 I354 L357 K455 F456 I457 F461 H462 I463	D350-I459 HydrophobicContact CB-CG2 3.71Å; V353-I459 HydrophobicContact CG1-CD1 3.6Å; I354-I459 HydrophobicContact CD1-CB 4.23Å; I354-I459 HydrophobicContact CD1-CG2 3.78Å; I354-I459 HydrophobicContact CG1-CB 3.99Å; I354-I459 HydrophobicContact CG1-CG2 3.74Å; L357-I459 HydrophobicContact CD1-CD1 3.83Å; K455-I459 WeakPolarHBondContact O-CG1 3.43Å; K455-I459 PolarHBondContact O-N 3.42Å; K455-I459 VanDerWaalsContact O-N 3.16Å; F456-I459 PolarHBondContact O-N 3.07Å; I457-I459 VanDerWaalsContact C-N 3.35Å; I457-I459 PolarHBondContact O-N 3.24Å; I459-F461 PolarHBondContact O-N 3.31Å; I459-H462 WeakPolarHBondContact O-CB 3.34Å; I459-H462 PolarHBondContact O-N 2.95Å; I459-I463 HydrophobicContact CG2-CD1 4.45Å; I459-I463 WeakPolarHBondContact O-CG1 3.41Å; I459-I463 PolarHBondContact O-N 2.89Å
460	S	87.7	Confident	84	Confident	1 Å²	1	36.8 Å²	36.8	1%	0.007	18%	0.178	C	C	.	.	H	α-helix	trans	-60.8	-43.5	175.9	-57.7	0	0	0	0	112.2	F456 I457 K458 H462 I463 V464 L592	F456-S460 WeakPolarHBondContact O-CB 3.5Å; F456-S460 PolarHBondContact O-N 2.97Å; F456-S460 PolarHBondContact O-OG 3.38Å; I457-S460 WeakPolarHBondContact O-CB 3.41Å; I457-S460 PolarHBondContact O-N 3.34Å; I457-S460 VanDerWaalsContact O-N 3.15Å; K458-S460 VanDerWaalsContact C-N 3.32Å; S460-H462 PolarHBondContact O-N 3.49Å; S460-I463 PolarHBondContact O-N 3.4Å; S460-V464 WeakPolarHBondContact O-CG2 3.49Å; S460-V464 PolarHBondContact O-N 2.97Å; S460-V464 VanDerWaalsContact O-N 3.15Å; S460-L592 WeakPolarHBondContact OG-CD1 3.46Å
461	F	85.8	Confident	82.1	Confident	29 Å²	29	39.1 Å²	39.1	13%	0.127	19%	0.194	C	C	.	.	H	α-helix	trans	-61	-44	173.8	-79.7	-58.7	0	0	0	112.2	I457 K458 I459 I463 V464 E465 L478 I481 K482	I457-F461 HydrophobicContact CG2-CD2 3.61Å; I457-F461 HydrophobicContact CG2-CE2 3.24Å; I457-F461 HydrophobicContact CG2-CZ 4.24Å; I457-F461 WeakPolarHBondContact O-CD2 3.46Å; I457-F461 PolarHBondContact O-N 2.8Å; K458-F461 PolarHBondContact O-N 2.85Å; I459-F461 PolarHBondContact O-N 3.31Å; F461-I463 VanDerWaalsContact C-N 3.32Å; F461-I463 PolarHBondContact O-N 3.19Å; F461-V464 PolarHBondContact O-N 3.25Å; F461-E465 WeakPolarHBondContact O-CB 3.37Å; F461-E465 WeakPolarHBondContact O-CG 3.15Å; F461-E465 PolarHBondContact O-N 3.3Å; F461-L478 HydrophobicContact CD1-CB 4.45Å; F461-L478 HydrophobicContact CD1-CD2 3.81Å; F461-L478 HydrophobicContact CD1-CG 4.24Å; F461-L478 HydrophobicContact CE1-CB 4.22Å; F461-L478 HydrophobicContact CE1-CD2 4.3Å; F461-I481 HydrophobicContact CD1-CG2 4.32Å; F461-I481 HydrophobicContact CD2-CG2 4.41Å; F461-I481 HydrophobicContact CE1-CB 3.81Å; F461-I481 HydrophobicContact CE1-CG2 3.8Å; F461-I481 HydrophobicContact CE2-CG2 3.93Å; F461-I481 HydrophobicContact CZ-CB 3.94Å; F461-I481 HydrophobicContact CZ-CG2 3.55Å; F461-K482 HydrophobicContact CE1-CG 3.87Å; F461-K482 HydrophobicContact CZ-CB 4.44Å; F461-K482 HydrophobicContact CZ-CD 4.48Å; F461-K482 HydrophobicContact CZ-CG 3.42Å; F461-K482 VanDerWaalsContact CZ-CG 3.42Å
462	H	86.1	Confident	80.5	Confident	65 Å²	65	37.6 Å²	37.6	30%	0.301	19%	0.192	S	C	.	.	H	α-helix	trans	-61	-40.1	178.3	-76.5	-33.7	0	0	0	113	K458 I459 S460 E465 R466 Q678	K458-H462 PolarHBondContact O-CD2 3.25Å; K458-H462 PolarHBondContact O-N 3.38Å; I459-H462 WeakPolarHBondContact O-CB 3.34Å; I459-H462 PolarHBondContact O-N 2.95Å; S460-H462 PolarHBondContact O-N 3.49Å; H462-E465 IonicContact ND1-OE2 2.77Å; H462-R466 VanDerWaalsContact O-CG 3.27Å; H462-R466 WeakPolarHBondContact O-CG 3.46Å; H462-R466 PolarHBondContact O-N 3.47Å; H462-Q678 VanDerWaalsContact CB-NE2 3.26Å; H462-Q678 PolarHBondContact ND1-NE2 3.43Å; H462-Q678 VanDerWaalsContact ND1-NE2 3.18Å
463	I	86.9	Confident	78.7	Confident	0 Å²	0	46.9 Å²	46.9	0%	0	24%	0.235	C	C	.	.	H	α-helix	trans	-62.8	-46.4	175.2	-69.5	176	0	0	0	110.5	D350 L351 I354 I459 S460 F461 R466 H467 T596	D350-I463 HydrophobicContact CB-CD1 3.76Å; D350-I463 HydrophobicContact CB-CG1 4.02Å; L351-I463 HydrophobicContact CD2-CD1 3.99Å; L351-I463 HydrophobicContact CG-CD1 4.04Å; I354-I463 HydrophobicContact CD1-CD1 3.42Å; I354-I463 VanDerWaalsContact CD1-CD1 3.42Å; I459-I463 HydrophobicContact CG2-CD1 4.45Å; I459-I463 WeakPolarHBondContact O-CG1 3.41Å; I459-I463 PolarHBondContact O-N 2.89Å; S460-I463 PolarHBondContact O-N 3.4Å; F461-I463 VanDerWaalsContact C-N 3.32Å; F461-I463 PolarHBondContact O-N 3.19Å; I463-R466 PolarHBondContact O-N 2.94Å; I463-H467 PolarHBondContact O-CD2 3.49Å; I463-T596 HydrophobicContact CG2-CG2 3.17Å
464	V	85.2	Confident	77.1	Confident	0 Å²	0	48.4 Å²	48.4	0%	0	25%	0.246	C	C	.	.	H	α-helix	trans	-64.2	-46.2	179.2	177.1	0	0	0	0	111	S460 F461 R466 H467 T468 L476 L478 I481 L592 F595	S460-V464 WeakPolarHBondContact O-CG2 3.49Å; S460-V464 PolarHBondContact O-N 2.97Å; S460-V464 VanDerWaalsContact O-N 3.15Å; F461-V464 PolarHBondContact O-N 3.25Å; V464-R466 PolarHBondContact O-N 2.89Å; V464-H467 PolarHBondContact O-N 2.94Å; V464-T468 HydrophobicContact CG1-CG2 3.66Å; V464-T468 WeakPolarHBondContact O-CG2 3.47Å; V464-T468 PolarHBondContact O-N 2.68Å; V464-T468 PolarHBondContact O-OG1 3.11Å; V464-T468 VanDerWaalsContact O-OG1 3.08Å; V464-L476 HydrophobicContact CG2-CD2 3.84Å; V464-L478 HydrophobicContact CG1-CD1 3.82Å; V464-L478 HydrophobicContact CG1-CG 4Å; V464-I481 HydrophobicContact CG2-CD1 3.73Å; V464-L592 HydrophobicContact CG2-CD2 3.78Å; V464-F595 HydrophobicContact CG2-CE1 4.36Å
465	E	85.3	Confident	75.5	Confident	70 Å²	70	51 Å²	51	33%	0.327	28%	0.275	S	S	.	.	H	α-helix	trans	-58.8	-30.6	179.2	-79.6	-174.2	157.2	0	0	114	F461 H462 H467 L478 L674	F461-E465 WeakPolarHBondContact O-CB 3.37Å; F461-E465 WeakPolarHBondContact O-CG 3.15Å; F461-E465 PolarHBondContact O-N 3.3Å; H462-E465 IonicContact ND1-OE2 2.77Å; E465-H467 VanDerWaalsContact C-N 3.31Å; E465-L478 HydrophobicContact CG-CD2 4.08Å; E465-L674 HydrophobicContact CB-CD1 4.47Å
466	R	85.9	Confident	74.1	Confident	1 Å²	1	47.3 Å²	47.3	0%	0.004	26%	0.26	C	S	.	.	H	α-helix	trans	-67.5	-31.5	176	-73.2	170.3	-157.4	169.4	4.8	112.8	D347 D350 H462 I463 V464 S671 L674 I675	D347-R466 IonicContact OD1-CZ 3.56Å; D347-R466 IonicContact OD1-NH1 3.92Å; D347-R466 PolarHBondContact OD1-NH1 3.03Å; D350-R466 IonicContact OD2-CZ 3.9Å; D350-R466 IonicContact OD2-NH1 3.08Å; D350-R466 PolarHBondContact OD2-NH1 3.23Å; D350-R466 IonicContact OD2-NH2 3.95Å; D350-R466 PolarHBondContact OD2-NH2 3.17Å; H462-R466 VanDerWaalsContact O-CG 3.27Å; H462-R466 WeakPolarHBondContact O-CG 3.46Å; H462-R466 PolarHBondContact O-N 3.47Å; I463-R466 PolarHBondContact O-N 2.94Å; V464-R466 PolarHBondContact O-N 2.89Å; R466-S671 WeakPolarHBondContact O-CB 3.46Å; R466-S671 PolarHBondContact O-OG 3.16Å; R466-L674 HydrophobicContact CG-CB 4.29Å; R466-L674 HydrophobicContact CG-CD1 4.43Å; R466-I675 HydrophobicContact CG-CG1 4.39Å
467	H	84.1	Confident	72.9	Confident	11 Å²	11	49.2 Å²	49.2	5%	0.051	27%	0.273	C	S	.	.	H	α-helix	trans	-102.3	-15.9	-174.6	-69.2	-64.2	0	0	0	113.5	D347 I463 V464 E465 F595 E599 N600	D347-H467 IonicContact OD1-NE2 2.85Å; D347-H467 IonicContact OD2-CD2 2.86Å; D347-H467 IonicContact OD2-CE1 3.87Å; D347-H467 PolarHBondContact OD2-CE1 3.45Å; D347-H467 IonicContact OD2-NE2 2.67Å; D347-H467 PolarHBondContact OD2-NE2 3.03Å; I463-H467 PolarHBondContact O-CD2 3.49Å; V464-H467 PolarHBondContact O-N 2.94Å; E465-H467 VanDerWaalsContact C-N 3.31Å; H467-F595 HydrophobicContact CB-CE1 3.8Å; H467-F595 HydrophobicContact CB-CZ 3.82Å; H467-E599 HydrophobicContact CB-CB 4.18Å; H467-E599 HydrophobicContact CB-CG 4.36Å; H467-N600 PolarHBondContact CE1-OD1 3Å
468	T	77.3	Confident	72.2	Confident	17 Å²	17	51.2 Å²	51.2	10%	0.104	28%	0.284	C	S	.	.			trans	-92.3	127.9	178.3	56.1	0	0	0	0	113.2	V464 S474 F595	V464-T468 HydrophobicContact CG1-CG2 3.66Å; V464-T468 WeakPolarHBondContact O-CG2 3.47Å; V464-T468 PolarHBondContact O-N 2.68Å; V464-T468 PolarHBondContact O-OG1 3.11Å; V464-T468 VanDerWaalsContact O-OG1 3.08Å; T468-S474 WeakPolarHBondContact CG2-OG 3.49Å; T468-F595 HydrophobicContact CG2-CZ 4.41Å
469	F	66.3	Low	71.6	Confident	25 Å²	25	51.8 Å²	51.8	11%	0.11	29%	0.288	C	S	.	.			trans	-84.8	143.6	162.4	-131.7	-90.2	0	0	0	109.6	D471 V472 Y663 F667	F469-D471 PolarHBondContact O-N 3.36Å; F469-V472 PolarHBondContact O-N 2.88Å; F469-Y663 HydrophobicContact CD1-CE2 4.42Å; F469-Y663 HydrophobicContact CD2-CE2 4.19Å; F469-Y663 HydrophobicContact CE1-CE2 4.37Å; F469-Y663 HydrophobicContact CE2-CE2 4.14Å; F469-Y663 HydrophobicContact CG-CE2 4.37Å; F469-Y663 HydrophobicContact CZ-CE2 4.24Å; F469-F667 HydrophobicContact CD2-CB 4.41Å; F469-F667 AromaticContact CD2-CD2 3.41Å; F469-F667 HydrophobicContact CD2-CD2 3.41Å; F469-F667 VanDerWaalsContact CD2-CD2 3.41Å; F469-F667 HydrophobicContact CD2-CE2 4.05Å; F469-F667 HydrophobicContact CD2-CG 4.3Å; F469-F667 HydrophobicContact CE2-CB 3.91Å; F469-F667 AromaticContact CE2-CD2 3.68Å; F469-F667 HydrophobicContact CE2-CD2 3.68Å; F469-F667 HydrophobicContact CE2-CG 4.27Å
470	P	53	Low	70.9	Confident	91 Å²	91	52.8 Å²	52.8	59%	0.591	30%	0.295	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.6	-15.2	-174.6	-28.1	34.9	0	0	0	117.5
471	D	48.1	Very low	70.5	Confident	109 Å²	109	52.7 Å²	52.7	58%	0.583	30%	0.295	S	S	*	.	T	Hydrogen-bonded Turn	trans	-116.6	4.3	-171	-71.1	-22.6	0	0	0	114.7	F469 S735	F469-D471 PolarHBondContact O-N 3.36Å; D471-S735 VanDerWaalsContact OD2-CB 3.29Å; D471-S735 WeakPolarHBondContact OD2-CB 3.34Å; D471-S735 PolarHBondContact OD2-OG 3.01Å
472	V	54.9	Low	70.2	Confident	68 Å²	68	56 Å²	56	41%	0.412	31%	0.309	S	S	.	.	S	Bend	trans	-118.6	120.4	179.7	-177.2	0	0	0	0	109.6	F469 S474 P738	F469-V472 PolarHBondContact O-N 2.88Å; V472-S474 PolarHBondContact O-N 3.44Å; V472-S474 VanDerWaalsContact O-N 3.08Å; V472-P738 HydrophobicContact CG2-CG 3.95Å
473	E	50.6	Low	69.9	Low	200 Å²	200	58 Å²	58	94%	0.935	32%	0.319	S	S	*	.			trans	-60.2	110.4	172.6	-83.6	179.7	160.8	0	0	109.7
474	S	54.1	Low	69.5	Low	35 Å²	35	59 Å²	59	25%	0.245	32%	0.324	C	S	.	.			trans	-80.1	149.3	174.9	55.9	0	0	0	0	111.3	T468 V472 L476	T468-S474 WeakPolarHBondContact CG2-OG 3.49Å; V472-S474 PolarHBondContact O-N 3.44Å; V472-S474 VanDerWaalsContact O-N 3.08Å; S474-L476 PolarHBondContact O-N 3.48Å; S474-L476 PolarHBondContact OG-O 3.32Å
475	A	53.1	Low	69.3	Low	109 Å²	109	61.1 Å²	61.1	90%	0.901	33%	0.334	S	S	*	.	S	Bend	trans	-61	-25	177.1	0	0	0	0	0	113.5
476	L	59.5	Low	69.2	Low	17 Å²	17	62.4 Å²	62.4	9%	0.089	34%	0.343	C	S	.	.	S	Bend	trans	-113.1	103.8	167.5	-158.4	93	0	0	0	107.3	V464 S474 I481 R591 L592 F595	V464-L476 HydrophobicContact CG2-CD2 3.84Å; S474-L476 PolarHBondContact O-N 3.48Å; S474-L476 PolarHBondContact OG-O 3.32Å; L476-I481 HydrophobicContact CD2-CD1 4.1Å; L476-I481 HydrophobicContact CD2-CG1 4.49Å; L476-R591 HydrophobicContact CD1-CB 4.03Å; L476-L592 HydrophobicContact CD2-CD2 3.58Å; L476-L592 HydrophobicContact CD2-CG 4.29Å; L476-F595 HydrophobicContact CB-CD2 4.07Å; L476-F595 HydrophobicContact CB-CG 4.27Å
477	S	64.5	Low	68.8	Low	42 Å²	42	66.4 Å²	66.4	29%	0.294	37%	0.365	S	S	.	.			trans	-80.7	147	-179.8	69	0	0	0	0	110.2	E479 T480	S477-E479 PolarHBondContact O-N 3.02Å; S477-E479 VanDerWaalsContact O-N 3.12Å; S477-E479 WeakPolarHBondContact OG-CB 3.37Å; S477-T480 PolarHBondContact O-N 3.49Å; S477-T480 PolarHBondContact O-OG1 3.26Å; S477-T480 VanDerWaalsContact OG-CG2 3.25Å; S477-T480 WeakPolarHBondContact OG-CG2 3.46Å; S477-T480 PolarHBondContact OG-N 2.86Å
478	L	72.7	Confident	68.5	Low	49 Å²	49	66.6 Å²	66.6	26%	0.257	37%	0.366	S	S	.	.	H	α-helix	trans	-56.1	-25.7	168.3	-74.6	97.1	0	0	0	111.5	F461 V464 E465 I481 K482	F461-L478 HydrophobicContact CD1-CB 4.45Å; F461-L478 HydrophobicContact CD1-CD2 3.81Å; F461-L478 HydrophobicContact CD1-CG 4.24Å; F461-L478 HydrophobicContact CE1-CB 4.22Å; F461-L478 HydrophobicContact CE1-CD2 4.3Å; V464-L478 HydrophobicContact CG1-CD1 3.82Å; V464-L478 HydrophobicContact CG1-CG 4Å; E465-L478 HydrophobicContact CG-CD2 4.08Å; L478-I481 PolarHBondContact O-N 2.78Å; L478-K482 WeakPolarHBondContact O-CG 3.25Å; L478-K482 PolarHBondContact O-N 2.89Å
479	E	73.9	Confident	68.8	Low	116 Å²	116	67.5 Å²	67.5	54%	0.542	37%	0.37	S	S	.	.	H	α-helix	trans	-59.5	-45.6	173.8	-146	76.5	-165.7	0	0	111.4	S477 I481 K482 E483	S477-E479 PolarHBondContact O-N 3.02Å; S477-E479 VanDerWaalsContact O-N 3.12Å; S477-E479 WeakPolarHBondContact OG-CB 3.37Å; E479-I481 VanDerWaalsContact C-N 3.32Å; E479-I481 PolarHBondContact O-N 3.46Å; E479-K482 WeakPolarHBondContact O-CB 3.36Å; E479-K482 PolarHBondContact O-N 3.25Å; E479-K482 VanDerWaalsContact O-N 3.09Å; E479-E483 WeakPolarHBondContact O-CG 3.43Å; E479-E483 PolarHBondContact O-N 3.35Å
480	T	74	Confident	69.4	Low	53 Å²	53	71.5 Å²	71.5	33%	0.325	39%	0.389	S	S	.	.	H	α-helix	trans	-62.7	-35.4	-178.6	62	0	0	0	0	113.7	S477 L484	S477-T480 PolarHBondContact O-N 3.49Å; S477-T480 PolarHBondContact O-OG1 3.26Å; S477-T480 VanDerWaalsContact OG-CG2 3.25Å; S477-T480 WeakPolarHBondContact OG-CG2 3.46Å; S477-T480 PolarHBondContact OG-N 2.86Å; T480-L484 PolarHBondContact O-N 3.04Å
481	I	78.2	Confident	70.4	Confident	0 Å²	0	70.5 Å²	70.5	0%	0	38%	0.379	C	S	.	.	H	α-helix	trans	-71.9	-37.1	176.4	-61.1	176.5	0	0	0	110.2	I457 F461 V464 L476 L478 E479 E485 L588 L592	I457-I481 HydrophobicContact CG2-CG2 4.25Å; F461-I481 HydrophobicContact CD1-CG2 4.32Å; F461-I481 HydrophobicContact CD2-CG2 4.41Å; F461-I481 HydrophobicContact CE1-CB 3.81Å; F461-I481 HydrophobicContact CE1-CG2 3.8Å; F461-I481 HydrophobicContact CE2-CG2 3.93Å; F461-I481 HydrophobicContact CZ-CB 3.94Å; F461-I481 HydrophobicContact CZ-CG2 3.55Å; V464-I481 HydrophobicContact CG2-CD1 3.73Å; L476-I481 HydrophobicContact CD2-CD1 4.1Å; L476-I481 HydrophobicContact CD2-CG1 4.49Å; L478-I481 PolarHBondContact O-N 2.78Å; E479-I481 VanDerWaalsContact C-N 3.32Å; E479-I481 PolarHBondContact O-N 3.46Å; I481-E485 WeakPolarHBondContact O-CB 3.49Å; I481-E485 PolarHBondContact O-N 2.87Å; I481-L588 HydrophobicContact CG1-CD2 4.34Å; I481-L592 HydrophobicContact CD1-CD2 4.38Å
482	K	81.4	Confident	71.7	Confident	98 Å²	98	65.9 Å²	65.9	43%	0.426	35%	0.354	S	S	.	.	H	α-helix	trans	-69.4	-39.7	176.2	-71.9	179.7	-177.6	171.7	0	112.7	F461 L478 E479 L484 E485 N486	F461-K482 HydrophobicContact CE1-CG 3.87Å; F461-K482 HydrophobicContact CZ-CB 4.44Å; F461-K482 HydrophobicContact CZ-CD 4.48Å; F461-K482 HydrophobicContact CZ-CG 3.42Å; F461-K482 VanDerWaalsContact CZ-CG 3.42Å; L478-K482 WeakPolarHBondContact O-CG 3.25Å; L478-K482 PolarHBondContact O-N 2.89Å; E479-K482 WeakPolarHBondContact O-CB 3.36Å; E479-K482 PolarHBondContact O-N 3.25Å; E479-K482 VanDerWaalsContact O-N 3.09Å; K482-L484 VanDerWaalsContact C-N 3.33Å; K482-E485 WeakPolarHBondContact O-CB 3.37Å; K482-E485 PolarHBondContact O-N 3.06Å; K482-N486 WeakPolarHBondContact O-CB 3.26Å; K482-N486 VanDerWaalsContact O-CG 3.24Å; K482-N486 PolarHBondContact O-N 2.8Å; K482-N486 PolarHBondContact O-ND2 3.5Å
483	E	79.8	Confident	72.9	Confident	108 Å²	108	68.5 Å²	68.5	51%	0.505	36%	0.36	S	S	.	.	H	α-helix	trans	-59	-48.6	174.9	-74.4	173.1	173.3	0	0	109.9	E479 E485 N486 D487	E479-E483 WeakPolarHBondContact O-CG 3.43Å; E479-E483 PolarHBondContact O-N 3.35Å; E483-E485 PolarHBondContact O-N 2.73Å; E483-N486 PolarHBondContact O-N 3.42Å; E483-D487 VanDerWaalsContact O-CG 3.27Å; E483-D487 PolarHBondContact O-N 3.42Å
484	L	77.2	Confident	73.9	Confident	21 Å²	21	63.5 Å²	63.5	11%	0.11	34%	0.336	C	S	.	.	H	α-helix	trans	-62.2	-41.4	176	-168.1	78.2	0	0	0	112.9	T480 K482 N486 D487 V488 E584 V585 L588	T480-L484 PolarHBondContact O-N 3.04Å; K482-L484 VanDerWaalsContact C-N 3.33Å; L484-N486 VanDerWaalsContact C-N 3.32Å; L484-N486 PolarHBondContact O-N 3.5Å; L484-D487 PolarHBondContact O-N 3.23Å; L484-V488 HydrophobicContact CG-CG2 4.44Å; L484-V488 WeakPolarHBondContact O-CB 3.24Å; L484-V488 VanDerWaalsContact O-CG2 3.25Å; L484-V488 WeakPolarHBondContact O-CG2 3.05Å; L484-V488 PolarHBondContact O-N 3.08Å; L484-E584 HydrophobicContact CD1-CB 3.81Å; L484-V585 HydrophobicContact CD1-CG2 3.81Å; L484-V585 HydrophobicContact CD2-CB 4.4Å; L484-V585 HydrophobicContact CD2-CG2 3.88Å; L484-V585 HydrophobicContact CG-CG2 4Å; L484-L588 HydrophobicContact CD2-CD1 3.11Å; L484-L588 HydrophobicContact CD2-CD2 4.37Å; L484-L588 HydrophobicContact CD2-CG 3.53Å
485	E	81.8	Confident	74.7	Confident	43 Å²	43	62.9 Å²	62.9	20%	0.201	33%	0.329	C	S	.	.	H	α-helix	trans	-56.5	-48.3	174.4	-178.3	172.8	-164.9	0	0	111.2	I457 I481 K482 E483 V488 I489	I457-E485 HydrophobicContact CD1-CB 3.72Å; I457-E485 HydrophobicContact CD1-CG 3.58Å; I481-E485 WeakPolarHBondContact O-CB 3.49Å; I481-E485 PolarHBondContact O-N 2.87Å; K482-E485 WeakPolarHBondContact O-CB 3.37Å; K482-E485 PolarHBondContact O-N 3.06Å; E483-E485 PolarHBondContact O-N 2.73Å; E485-V488 PolarHBondContact O-N 3.21Å; E485-I489 HydrophobicContact CG-CD1 3.68Å; E485-I489 HydrophobicContact CG-CG1 4.47Å; E485-I489 WeakPolarHBondContact O-CB 3.39Å; E485-I489 WeakPolarHBondContact O-CG1 3.32Å; E485-I489 PolarHBondContact O-N 3.32Å
486	N	83.3	Confident	75.6	Confident	98 Å²	98	59.8 Å²	59.8	52%	0.524	30%	0.297	S	S	.	.	H	α-helix	trans	-64.6	-44.8	-179.2	-71.6	-36.9	0	0	0	111.7	K482 E483 L484 V488 I489 E490	K482-N486 WeakPolarHBondContact O-CB 3.26Å; K482-N486 VanDerWaalsContact O-CG 3.24Å; K482-N486 PolarHBondContact O-N 2.8Å; K482-N486 PolarHBondContact O-ND2 3.5Å; E483-N486 PolarHBondContact O-N 3.42Å; L484-N486 VanDerWaalsContact C-N 3.32Å; L484-N486 PolarHBondContact O-N 3.5Å; N486-V488 PolarHBondContact O-N 2.8Å; N486-I489 PolarHBondContact O-N 3.48Å; N486-E490 WeakPolarHBondContact O-CB 2.89Å; N486-E490 PolarHBondContact O-N 3.08Å
487	D	77.6	Confident	76.1	Confident	85 Å²	85	63.3 Å²	63.3	46%	0.455	32%	0.319	S	S	.	.	H	α-helix	trans	-61.3	-45.4	179	-70.6	-14.4	0	0	0	111.1	E483 L484 E490 L491	E483-D487 VanDerWaalsContact O-CG 3.27Å; E483-D487 PolarHBondContact O-N 3.42Å; L484-D487 PolarHBondContact O-N 3.23Å; D487-E490 PolarHBondContact O-N 2.83Å; D487-L491 VanDerWaalsContact O-CG 3.3Å; D487-L491 WeakPolarHBondContact O-CG 2.86Å; D487-L491 PolarHBondContact O-N 2.97Å
488	V	77.4	Confident	76.1	Confident	14 Å²	14	64.9 Å²	64.9	9%	0.085	32%	0.322	C	S	.	.	H	α-helix	trans	-66.7	-41.9	178.1	176.2	0	0	0	0	111.1	W361 L453 L484 E485 N486 E490 L491 L492 V585	W361-V488 HydrophobicContact CH2-CG1 4.22Å; W361-V488 HydrophobicContact CZ2-CG1 3.68Å; L453-V488 HydrophobicContact CD1-CG1 3.98Å; L453-V488 HydrophobicContact CD2-CB 4.29Å; L453-V488 HydrophobicContact CD2-CG1 3.59Å; L453-V488 HydrophobicContact CG-CG1 4.46Å; L484-V488 HydrophobicContact CG-CG2 4.44Å; L484-V488 WeakPolarHBondContact O-CB 3.24Å; L484-V488 VanDerWaalsContact O-CG2 3.25Å; L484-V488 WeakPolarHBondContact O-CG2 3.05Å; L484-V488 PolarHBondContact O-N 3.08Å; E485-V488 PolarHBondContact O-N 3.21Å; N486-V488 PolarHBondContact O-N 2.8Å; V488-E490 VanDerWaalsContact C-N 3.34Å; V488-L491 PolarHBondContact O-N 3.44Å; V488-L492 HydrophobicContact CG1-CD1 4.03Å; V488-L492 HydrophobicContact CG1-CG 4.47Å; V488-L492 VanDerWaalsContact O-CG 3.27Å; V488-L492 WeakPolarHBondContact O-CG 3.26Å; V488-L492 PolarHBondContact O-N 2.85Å; V488-V585 HydrophobicContact CG2-CG2 3.78Å
489	I	82.7	Confident	75.6	Confident	37 Å²	37	64.6 Å²	64.6	19%	0.19	32%	0.322	C	S	.	.	H	α-helix	trans	-64.4	-39.9	176.5	-71.5	171.1	0	0	0	111	Y450 L453 E485 N486 L492 K493	Y450-I489 HydrophobicContact CE1-CG1 4.18Å; Y450-I489 HydrophobicContact CE1-CG2 4.37Å; L453-I489 HydrophobicContact CD2-CG1 4.09Å; E485-I489 HydrophobicContact CG-CD1 3.68Å; E485-I489 HydrophobicContact CG-CG1 4.47Å; E485-I489 WeakPolarHBondContact O-CB 3.39Å; E485-I489 WeakPolarHBondContact O-CG1 3.32Å; E485-I489 PolarHBondContact O-N 3.32Å; N486-I489 PolarHBondContact O-N 3.48Å; I489-L492 PolarHBondContact O-N 3.3Å; I489-K493 HydrophobicContact CG2-CD 4.09Å; I489-K493 HydrophobicContact CG2-CG 4.45Å; I489-K493 WeakPolarHBondContact O-CB 2.88Å; I489-K493 VanDerWaalsContact O-CG 3.31Å; I489-K493 WeakPolarHBondContact O-CG 2.87Å; I489-K493 PolarHBondContact O-N 2.86Å
490	E	80.2	Confident	74.8	Confident	109 Å²	109	60.4 Å²	60.4	51%	0.509	31%	0.306	S	S	.	.	H	α-helix	trans	-63.9	-45.1	177.7	-173.1	172.2	172.3	0	0	111.3	N486 D487 V488 L492 K493 Q494	N486-E490 WeakPolarHBondContact O-CB 2.89Å; N486-E490 PolarHBondContact O-N 3.08Å; D487-E490 PolarHBondContact O-N 2.83Å; V488-E490 VanDerWaalsContact C-N 3.34Å; E490-L492 VanDerWaalsContact C-N 3.35Å; E490-L492 PolarHBondContact O-N 3.02Å; E490-K493 WeakPolarHBondContact O-CB 3.35Å; E490-K493 PolarHBondContact O-N 3.28Å; E490-Q494 WeakPolarHBondContact O-CG 2.79Å; E490-Q494 PolarHBondContact O-N 3.28Å
491	L	73.1	Confident	73.7	Confident	70 Å²	70	59.1 Å²	59.1	37%	0.366	30%	0.303	S	S	.	.	H	α-helix	trans	-60.3	-43.1	175	-71.1	172.1	0	0	0	112.1	D487 V488 K493 Q494 Y495	D487-L491 VanDerWaalsContact O-CG 3.3Å; D487-L491 WeakPolarHBondContact O-CG 2.86Å; D487-L491 PolarHBondContact O-N 2.97Å; V488-L491 PolarHBondContact O-N 3.44Å; L491-K493 VanDerWaalsContact C-N 3.33Å; L491-K493 PolarHBondContact O-N 3.33Å; L491-Q494 PolarHBondContact O-N 3.48Å; L491-Y495 WeakPolarHBondContact O-CB 3.33Å; L491-Y495 PolarHBondContact O-N 3.1Å
492	L	75.6	Confident	72.6	Confident	12 Å²	12	67.8 Å²	67.8	6%	0.063	34%	0.344	C	S	.	.	H	α-helix	trans	-66.7	-33.3	176.9	-69.9	171.7	0	0	0	112.5	L365 L449 Y450 L453 V488 I489 E490 Y495 D496	L365-L492 HydrophobicContact CD1-CD2 4.36Å; L449-L492 HydrophobicContact CD2-CD1 3.32Å; L449-L492 HydrophobicContact CD2-CD2 3.53Å; L449-L492 HydrophobicContact CD2-CG 4.07Å; Y450-L492 HydrophobicContact CD1-CD1 3.86Å; Y450-L492 HydrophobicContact CE1-CB 3.78Å; Y450-L492 HydrophobicContact CE1-CD1 3.53Å; Y450-L492 HydrophobicContact CE1-CG 4.33Å; Y450-L492 VanDerWaalsContact OH-CB 3.28Å; Y450-L492 WeakPolarHBondContact OH-CB 2.85Å; L453-L492 HydrophobicContact CD2-CD1 4.08Å; V488-L492 HydrophobicContact CG1-CD1 4.03Å; V488-L492 HydrophobicContact CG1-CG 4.47Å; V488-L492 VanDerWaalsContact O-CG 3.27Å; V488-L492 WeakPolarHBondContact O-CG 3.26Å; V488-L492 PolarHBondContact O-N 2.85Å; I489-L492 PolarHBondContact O-N 3.3Å; E490-L492 VanDerWaalsContact C-N 3.35Å; E490-L492 PolarHBondContact O-N 3.02Å; L492-Y495 PolarHBondContact O-N 3.17Å; L492-D496 PolarHBondContact O-N 2.74Å
493	K	79.9	Confident	71.6	Confident	123 Å²	123	64.5 Å²	64.5	54%	0.535	33%	0.333	S	S	.	.	H	α-helix	trans	-67.6	-43.3	172.3	-76.6	171.9	-179.1	168.5	0	111.9	Y450 I489 E490 L491 Y495 D496 T497	Y450-K493 PolarHBondContact OH-N 3.32Å; I489-K493 HydrophobicContact CG2-CD 4.09Å; I489-K493 HydrophobicContact CG2-CG 4.45Å; I489-K493 WeakPolarHBondContact O-CB 2.88Å; I489-K493 VanDerWaalsContact O-CG 3.31Å; I489-K493 WeakPolarHBondContact O-CG 2.87Å; I489-K493 PolarHBondContact O-N 2.86Å; E490-K493 WeakPolarHBondContact O-CB 3.35Å; E490-K493 PolarHBondContact O-N 3.28Å; L491-K493 VanDerWaalsContact C-N 3.33Å; L491-K493 PolarHBondContact O-N 3.33Å; K493-Y495 PolarHBondContact O-N 3.47Å; K493-D496 PolarHBondContact O-N 3.42Å; K493-T497 WeakPolarHBondContact O-CG2 3.17Å; K493-T497 PolarHBondContact O-N 3.45Å; K493-T497 PolarHBondContact O-OG1 2.69Å
494	Q	71.1	Confident	70.9	Confident	94 Å²	94	61.2 Å²	61.2	44%	0.439	32%	0.32	S	S	.	.	H	α-helix	trans	-60.4	-37.1	174.5	-69.4	176.8	11	0	0	111.2	E490 L491 T497 Q498	E490-Q494 WeakPolarHBondContact O-CG 2.79Å; E490-Q494 PolarHBondContact O-N 3.28Å; L491-Q494 PolarHBondContact O-N 3.48Å; Q494-T497 PolarHBondContact O-OG1 3.47Å; Q494-Q498 WeakPolarHBondContact O-CB 2.85Å; Q494-Q498 PolarHBondContact O-N 2.8Å; Q494-Q498 VanDerWaalsContact O-N 3.13Å
495	Y	71.3	Confident	70.7	Confident	22 Å²	22	61 Å²	61	9%	0.086	32%	0.319	C	S	.	.	H	α-helix	trans	-70.4	-39.4	175.9	-162.2	-101.7	0	0	0	112.9	L368 V372 F442 L491 L492 K493 Q498 V499 F572	L368-Y495 HydrophobicContact CD2-CD1 3.92Å; L368-Y495 HydrophobicContact CD2-CE1 3.26Å; V372-Y495 WeakPolarHBondContact CB-OH 3.5Å; V372-Y495 HydrophobicContact CG2-CE1 4.15Å; V372-Y495 WeakPolarHBondContact CG2-OH 3.47Å; F442-Y495 HydrophobicContact CE2-CD1 4.19Å; F442-Y495 AromaticContact CE2-CE1 3.77Å; F442-Y495 HydrophobicContact CE2-CE1 3.77Å; F442-Y495 AromaticContact CZ-CD1 3.93Å; F442-Y495 HydrophobicContact CZ-CD1 3.93Å; F442-Y495 AromaticContact CZ-CE1 3.96Å; F442-Y495 HydrophobicContact CZ-CE1 3.96Å; L491-Y495 WeakPolarHBondContact O-CB 3.33Å; L491-Y495 PolarHBondContact O-N 3.1Å; L492-Y495 PolarHBondContact O-N 3.17Å; K493-Y495 PolarHBondContact O-N 3.47Å; Y495-Q498 PolarHBondContact O-N 3.44Å; Y495-V499 HydrophobicContact CD1-CG2 4.48Å; Y495-V499 HydrophobicContact CE1-CG2 4.17Å; Y495-V499 WeakPolarHBondContact O-CG2 2.89Å; Y495-V499 PolarHBondContact O-N 2.76Å; Y495-F572 HydrophobicContact CD2-CE1 4.44Å
496	D	73.1	Confident	70.3	Confident	45 Å²	45	59.8 Å²	59.8	24%	0.241	31%	0.313	C	S	.	.	H	α-helix	trans	-64.6	-40.9	174.5	-170.3	38.8	0	0	0	111.8	L446 L492 K493 V499 S500	L446-D496 HydrophobicContact CD1-CB 3.85Å; L492-D496 PolarHBondContact O-N 2.74Å; K493-D496 PolarHBondContact O-N 3.42Å; D496-V499 PolarHBondContact O-N 2.64Å; D496-S500 WeakPolarHBondContact O-CB 3.17Å; D496-S500 PolarHBondContact O-N 3.28Å; D496-S500 PolarHBondContact O-OG 3.44Å
497	T	69.4	Low	70.1	Confident	90 Å²	90	63.4 Å²	63.4	55%	0.552	32%	0.32	S	S	*	.	H	α-helix	trans	-67.7	-35.7	177.6	56	0	0	0	0	112.3	K493 Q494 V499	K493-T497 WeakPolarHBondContact O-CG2 3.17Å; K493-T497 PolarHBondContact O-N 3.45Å; K493-T497 PolarHBondContact O-OG1 2.69Å; Q494-T497 PolarHBondContact O-OG1 3.47Å; T497-V499 VanDerWaalsContact C-N 3.35Å; T497-V499 PolarHBondContact O-N 2.85Å
498	Q	64.9	Low	70.2	Confident	75 Å²	75	60 Å²	60	35%	0.35	30%	0.301	S	S	.	.	H	α-helix	trans	-66.4	-34.4	176.7	-167.4	177.6	16.5	0	0	112.8	Q494 Y495 S503	Q494-Q498 WeakPolarHBondContact O-CB 2.85Å; Q494-Q498 PolarHBondContact O-N 2.8Å; Q494-Q498 VanDerWaalsContact O-N 3.13Å; Y495-Q498 PolarHBondContact O-N 3.44Å; Q498-S503 WeakPolarHBondContact O-CB 3.25Å
499	V	61.7	Low	70.3	Confident	44 Å²	44	59.6 Å²	59.6	27%	0.267	30%	0.299	S	S	.	.	H	α-helix	trans	-99.4	-30.8	-172.1	179.4	0	0	0	0	113.5	V372 F442 Y495 D496 T497 G501	V372-V499 HydrophobicContact CG1-CG2 4.11Å; V372-V499 HydrophobicContact CG2-CG1 4.3Å; V372-V499 HydrophobicContact CG2-CG2 4.33Å; F442-V499 HydrophobicContact CD1-CG1 3.98Å; F442-V499 HydrophobicContact CD2-CG1 3.88Å; F442-V499 HydrophobicContact CE1-CB 3.82Å; F442-V499 HydrophobicContact CE1-CG1 3.77Å; F442-V499 HydrophobicContact CE2-CB 4.03Å; F442-V499 HydrophobicContact CE2-CG1 3.65Å; F442-V499 HydrophobicContact CE2-CG2 4.19Å; F442-V499 HydrophobicContact CG-CG1 4.03Å; F442-V499 HydrophobicContact CZ-CB 3.54Å; F442-V499 HydrophobicContact CZ-CG1 3.6Å; F442-V499 HydrophobicContact CZ-CG2 3.95Å; Y495-V499 HydrophobicContact CD1-CG2 4.48Å; Y495-V499 HydrophobicContact CE1-CG2 4.17Å; Y495-V499 WeakPolarHBondContact O-CG2 2.89Å; Y495-V499 PolarHBondContact O-N 2.76Å; D496-V499 PolarHBondContact O-N 2.64Å; T497-V499 VanDerWaalsContact C-N 3.35Å; T497-V499 PolarHBondContact O-N 2.85Å; V499-G501 VanDerWaalsContact C-N 3.3Å; V499-G501 PolarHBondContact O-N 3.05Å; V499-G501 VanDerWaalsContact O-N 3.1Å
500	S	56.3	Low	70.3	Confident	27 Å²	27	59.3 Å²	59.3	19%	0.189	30%	0.299	C	S	.	.	T	Hydrogen-bonded Turn	trans	-78.6	9.2	-164.7	66.5	0	0	0	0	117.3	K439 D496	K439-S500 WeakPolarHBondContact CE-O 3.15Å; K439-S500 PolarHBondContact NZ-O 3.43Å; D496-S500 WeakPolarHBondContact O-CB 3.17Å; D496-S500 PolarHBondContact O-N 3.28Å; D496-S500 PolarHBondContact O-OG 3.44Å
501	G	52.8	Low	70.5	Confident	27 Å²	27	55.9 Å²	55.9	28%	0.278	29%	0.287	S	S	.	.	T	Hydrogen-bonded Turn	trans	110.4	7.3	162.6	0	0	0	0	0	117.1	V499	V499-G501 VanDerWaalsContact C-N 3.3Å; V499-G501 PolarHBondContact O-N 3.05Å; V499-G501 VanDerWaalsContact O-N 3.1Å
502	E	53.4	Low	71.1	Confident	182 Å²	182	52.6 Å²	52.6	85%	0.85	27%	0.27	S	S	*	.			trans	-88.4	12.5	155.4	-66.8	-174.3	174.1	0	0	111.4	T504	E502-T504 PolarHBondContact O-N 2.92Å
503	S	61	Low	71.6	Confident	28 Å²	28	54.1 Å²	54.1	20%	0.196	28%	0.276	C	S	.	.			trans	-62	128.6	179.3	76.8	0	0	0	0	109	Q498 I505 H506 R507	Q498-S503 WeakPolarHBondContact O-CB 3.25Å; S503-I505 PolarHBondContact O-N 3.23Å; S503-H506 PolarHBondContact O-N 2.78Å; S503-H506 WeakPolarHBondContact OG-CB 3.21Å; S503-H506 PolarHBondContact OG-N 2.84Å; S503-R507 PolarHBondContact O-N 2.89Å
504	T	65	Low	71.9	Confident	39 Å²	39	54.9 Å²	54.9	24%	0.239	28%	0.279	C	S	.	.	H	α-helix	trans	-49.9	-34.4	175.3	-41.9	0	0	0	0	110.9	E502 R507 L508 Y561	E502-T504 PolarHBondContact O-N 2.92Å; T504-R507 PolarHBondContact O-N 2.71Å; T504-L508 HydrophobicContact CG2-CD1 4.01Å; T504-L508 HydrophobicContact CG2-CG 4.44Å; T504-L508 WeakPolarHBondContact O-CB 3.41Å; T504-L508 WeakPolarHBondContact O-CG 3.34Å; T504-L508 PolarHBondContact O-N 3.4Å; T504-Y561 HydrophobicContact CG2-CE1 4.49Å; T504-Y561 HydrophobicContact CG2-CE2 3.69Å
505	I	72.6	Confident	72.7	Confident	16 Å²	16	53 Å²	53	8%	0.082	27%	0.272	C	S	.	.	H	α-helix	trans	-59.1	-50.3	175.3	-58.5	173.9	0	0	0	111.8	S503 R507 L508 L509 I558 Y561 F562	S503-I505 PolarHBondContact O-N 3.23Å; I505-R507 VanDerWaalsContact C-N 3.34Å; I505-R507 PolarHBondContact O-N 3.38Å; I505-L508 PolarHBondContact O-N 2.75Å; I505-L509 HydrophobicContact CG2-CD1 3.88Å; I505-L509 HydrophobicContact CG2-CG 4.44Å; I505-L509 WeakPolarHBondContact O-CB 3.29Å; I505-L509 VanDerWaalsContact O-CG 3.29Å; I505-L509 WeakPolarHBondContact O-CG 3.38Å; I505-L509 PolarHBondContact O-N 3.43Å; I505-I558 HydrophobicContact CG2-CG2 4.25Å; I505-Y561 HydrophobicContact CG1-CG 4.23Å; I505-F562 HydrophobicContact CD1-CE1 4.32Å; I505-F562 HydrophobicContact CG2-CE2 4.2Å; I505-F562 HydrophobicContact CG2-CZ 3.92Å
506	H	74.9	Confident	73.4	Confident	18 Å²	18	52 Å²	52	8%	0.083	27%	0.268	C	S	.	.	H	α-helix	trans	-66.7	-37	-179.5	-179.6	70.9	0	0	0	112.2	S431 Q435 S503 L509 T510	S431-H506 PolarHBondContact OG-CE1 3.26Å; Q435-H506 PolarHBondContact NE2-CE1 3.34Å; Q435-H506 PolarHBondContact NE2-NE2 3.17Å; S503-H506 PolarHBondContact O-N 2.78Å; S503-H506 WeakPolarHBondContact OG-CB 3.21Å; S503-H506 PolarHBondContact OG-N 2.84Å; H506-L509 PolarHBondContact O-N 3.09Å; H506-T510 WeakPolarHBondContact O-CB 3.38Å; H506-T510 PolarHBondContact O-N 3.43Å; H506-T510 PolarHBondContact O-OG1 2.96Å
507	R	79.3	Confident	74.1	Confident	174 Å²	174	53.2 Å²	53.2	66%	0.657	28%	0.275	S	S	*	.	H	α-helix	trans	-62.6	-45.4	174.1	-175.7	177.9	65.7	176.2	-0.3	111.5	S503 T504 I505 T510 S511	S503-R507 PolarHBondContact O-N 2.89Å; T504-R507 PolarHBondContact O-N 2.71Å; I505-R507 VanDerWaalsContact C-N 3.34Å; I505-R507 PolarHBondContact O-N 3.38Å; R507-T510 PolarHBondContact O-N 3.19Å; R507-S511 PolarHBondContact O-N 3.43Å; R507-S511 PolarHBondContact O-OG 2.74Å
508	L	78.8	Confident	75	Confident	14 Å²	14	54 Å²	54	7%	0.073	27%	0.27	C	S	.	.	H	α-helix	trans	-67.1	-39.6	178.4	-70.6	169	0	0	0	111.9	T504 I505 T510 S511 M512 M554 E557 I558 Y561	T504-L508 HydrophobicContact CG2-CD1 4.01Å; T504-L508 HydrophobicContact CG2-CG 4.44Å; T504-L508 WeakPolarHBondContact O-CB 3.41Å; T504-L508 WeakPolarHBondContact O-CG 3.34Å; T504-L508 PolarHBondContact O-N 3.4Å; I505-L508 PolarHBondContact O-N 2.75Å; L508-T510 VanDerWaalsContact C-N 3.35Å; L508-T510 PolarHBondContact O-N 3.14Å; L508-S511 WeakPolarHBondContact CA-OG 3.21Å; L508-S511 PolarHBondContact O-N 2.89Å; L508-S511 PolarHBondContact O-OG 3.38Å; L508-M512 WeakPolarHBondContact O-CG 3.33Å; L508-M512 PolarHBondContact O-N 3.3Å; L508-M554 HydrophobicContact CD2-CG 4.39Å; L508-E557 HydrophobicContact CD1-CB 4.3Å; L508-E557 HydrophobicContact CD1-CG 3.88Å; L508-I558 HydrophobicContact CB-CD1 3.69Å; L508-I558 HydrophobicContact CB-CG1 3.55Å; L508-I558 HydrophobicContact CD1-CG1 3.86Å; L508-I558 HydrophobicContact CG-CG1 4.35Å; L508-Y561 HydrophobicContact CD1-CD2 4.21Å; L508-Y561 HydrophobicContact CD1-CE2 4.18Å
509	L	79.4	Confident	76	Confident	6 Å²	6	51.5 Å²	51.5	3%	0.031	26%	0.258	C	S	.	.	H	α-helix	trans	-61.3	-43.8	173.2	-78.7	169.7	0	0	0	112	L383 L427 I505 H506 M512 F513 I558	L383-L509 HydrophobicContact CD1-CD2 3.55Å; L383-L509 HydrophobicContact CD1-CG 4.42Å; L383-L509 HydrophobicContact CD2-CD2 3.33Å; L383-L509 HydrophobicContact CG-CD2 3.87Å; L427-L509 HydrophobicContact CD2-CD2 4.03Å; I505-L509 HydrophobicContact CG2-CD1 3.88Å; I505-L509 HydrophobicContact CG2-CG 4.44Å; I505-L509 WeakPolarHBondContact O-CB 3.29Å; I505-L509 VanDerWaalsContact O-CG 3.29Å; I505-L509 WeakPolarHBondContact O-CG 3.38Å; I505-L509 PolarHBondContact O-N 3.43Å; H506-L509 PolarHBondContact O-N 3.09Å; L509-M512 PolarHBondContact O-N 3Å; L509-F513 WeakPolarHBondContact O-CB 3.37Å; L509-F513 PolarHBondContact O-N 3.46Å; L509-I558 HydrophobicContact CD2-CD1 4.15Å; L509-I558 HydrophobicContact CG-CD1 4.21Å
510	T	82.3	Confident	77.1	Confident	31 Å²	31	49.5 Å²	49.5	19%	0.19	25%	0.246	C	C	.	.	H	α-helix	trans	-68.3	-35.5	178.9	-57.1	0	0	0	0	111.7	H506 R507 L508 K514	H506-T510 WeakPolarHBondContact O-CB 3.38Å; H506-T510 PolarHBondContact O-N 3.43Å; H506-T510 PolarHBondContact O-OG1 2.96Å; R507-T510 PolarHBondContact O-N 3.19Å; L508-T510 VanDerWaalsContact C-N 3.35Å; L508-T510 PolarHBondContact O-N 3.14Å; T510-K514 HydrophobicContact CG2-CD 4.43Å; T510-K514 VanDerWaalsContact O-CG 3.3Å; T510-K514 WeakPolarHBondContact O-CG 3.28Å; T510-K514 PolarHBondContact O-N 3.47Å
511	S	85.4	Confident	78.4	Confident	36 Å²	36	51 Å²	51	25%	0.252	26%	0.256	S	S	.	.	H	α-helix	trans	-70	-39.2	174.1	54.1	0	0	0	0	112.4	R507 L508 K514 L515 M554	R507-S511 PolarHBondContact O-N 3.43Å; R507-S511 PolarHBondContact O-OG 2.74Å; L508-S511 WeakPolarHBondContact CA-OG 3.21Å; L508-S511 PolarHBondContact O-N 2.89Å; L508-S511 PolarHBondContact O-OG 3.38Å; S511-K514 PolarHBondContact O-N 3.48Å; S511-L515 WeakPolarHBondContact O-CG 3.26Å; S511-L515 PolarHBondContact O-N 3Å; S511-L515 VanDerWaalsContact O-N 3.08Å; S511-M554 PolarHBondContact OG-SD 3.47Å
512	M	85.4	Confident	79.7	Confident	2 Å²	2	53.5 Å²	53.5	1%	0.01	26%	0.261	C	S	.	.	H	α-helix	trans	-62.4	-45.9	173.2	-75.3	-177	68.4	0	0	111.5	L427 L508 L509 K514 L515 L516 C551 M554 I558	L427-M512 HydrophobicContact CD1-CB 4.36Å; L508-M512 WeakPolarHBondContact O-CG 3.33Å; L508-M512 PolarHBondContact O-N 3.3Å; L509-M512 PolarHBondContact O-N 3Å; M512-K514 PolarHBondContact O-N 2.82Å; M512-L515 PolarHBondContact O-N 2.97Å; M512-L516 WeakPolarHBondContact O-CG 3.47Å; M512-L516 PolarHBondContact O-N 3.41Å; M512-C551 HydrophobicContact CE-CB 4.22Å; M512-M554 HydrophobicContact CG-CB 3.54Å; M512-M554 HydrophobicContact CG-CG 4.24Å; M512-M554 HydrophobicContact CG-SD 3.69Å; M512-M554 HydrophobicContact SD-CB 3.71Å; M512-I558 HydrophobicContact SD-CD1 3.53Å; M512-I558 VanDerWaalsContact SD-CD1 3.53Å
513	F	85.8	Confident	80.9	Confident	44 Å²	44	44.8 Å²	44.8	19%	0.193	22%	0.22	C	C	.	.	H	α-helix	trans	-54.6	-52.1	174.6	167.4	-112.7	0	0	0	111.4	S424 L427 S428 L509 L515 L516 D517	S424-F513 WeakPolarHBondContact O-CD2 3.37Å; S424-F513 WeakPolarHBondContact O-CE2 3.29Å; S424-F513 WeakPolarHBondContact OG-CE2 3.34Å; L427-F513 HydrophobicContact CB-CB 4.07Å; L427-F513 HydrophobicContact CB-CD2 4.29Å; S428-F513 VanDerWaalsContact CB-CE2 3.49Å; L509-F513 WeakPolarHBondContact O-CB 3.37Å; L509-F513 PolarHBondContact O-N 3.46Å; F513-L515 VanDerWaalsContact C-N 3.3Å; F513-L515 PolarHBondContact O-N 2.7Å; F513-L516 PolarHBondContact O-N 2.94Å; F513-D517 HydrophobicContact CE2-CB 4.19Å; F513-D517 HydrophobicContact CZ-CB 4.35Å; F513-D517 VanDerWaalsContact O-CB 3.28Å; F513-D517 WeakPolarHBondContact O-CB 3.39Å; F513-D517 PolarHBondContact O-N 3.22Å
514	K	86.6	Confident	81.9	Confident	139 Å²	139	47.1 Å²	47.1	60%	0.604	23%	0.228	S	C	*	.	H	α-helix	trans	-59.9	-37.8	-179.6	-73.9	173	179.9	178.8	0	113.3	T510 S511 M512 F518	T510-K514 HydrophobicContact CG2-CD 4.43Å; T510-K514 VanDerWaalsContact O-CG 3.3Å; T510-K514 WeakPolarHBondContact O-CG 3.28Å; T510-K514 PolarHBondContact O-N 3.47Å; S511-K514 PolarHBondContact O-N 3.48Å; M512-K514 PolarHBondContact O-N 2.82Å; K514-F518 WeakPolarHBondContact O-CB 3.37Å; K514-F518 PolarHBondContact O-N 3.43Å; K514-F518 VanDerWaalsContact O-N 3.11Å
515	L	86.6	Confident	82.5	Confident	53 Å²	53	48.6 Å²	48.6	28%	0.277	24%	0.237	S	C	.	.	H	α-helix	trans	-68.7	-44.3	177.8	-77.8	168.3	0	0	0	111.8	S511 M512 F513 W519 M554	S511-L515 WeakPolarHBondContact O-CG 3.26Å; S511-L515 PolarHBondContact O-N 3Å; S511-L515 VanDerWaalsContact O-N 3.08Å; M512-L515 PolarHBondContact O-N 2.97Å; F513-L515 VanDerWaalsContact C-N 3.3Å; F513-L515 PolarHBondContact O-N 2.7Å; L515-W519 VanDerWaalsContact O-CD1 3.29Å; L515-W519 PolarHBondContact O-N 3.36Å; L515-M554 HydrophobicContact CD1-CE 3.56Å; L515-M554 HydrophobicContact CD1-SD 3.95Å
516	L	86.3	Confident	82.5	Confident	3 Å²	3	49 Å²	49	2%	0.016	24%	0.24	C	C	.	.	H	α-helix	trans	-70.8	-36.5	179.4	-69.3	170.8	0	0	0	112	I390 L420 W423 L427 M512 F513 W519 A520	I390-L516 HydrophobicContact CD1-CD1 4.4Å; L420-L516 HydrophobicContact CD2-CD2 3.61Å; W423-L516 HydrophobicContact CB-CD1 4.25Å; W423-L516 HydrophobicContact CE3-CD2 4.13Å; L427-L516 HydrophobicContact CD1-CD1 3.45Å; L427-L516 VanDerWaalsContact CD1-CD1 3.45Å; M512-L516 WeakPolarHBondContact O-CG 3.47Å; M512-L516 PolarHBondContact O-N 3.41Å; F513-L516 PolarHBondContact O-N 2.94Å; L516-W519 PolarHBondContact O-N 3Å; L516-A520 VanDerWaalsContact O-CB 3.27Å; L516-A520 WeakPolarHBondContact O-CB 3.44Å; L516-A520 PolarHBondContact O-N 2.94Å
517	D	87.7	Confident	82.4	Confident	70 Å²	70	50 Å²	50	37%	0.374	25%	0.245	S	C	.	.	H	α-helix	trans	-66.2	-41.1	176.3	-161.1	52.3	0	0	0	112	S424 F513 A520 S521	S424-D517 WeakPolarHBondContact OG-CA 3.29Å; S424-D517 VanDerWaalsContact OG-CB 3.31Å; S424-D517 WeakPolarHBondContact OG-CB 3.27Å; S424-D517 PolarHBondContact OG-OD1 3.29Å; F513-D517 HydrophobicContact CE2-CB 4.19Å; F513-D517 HydrophobicContact CZ-CB 4.35Å; F513-D517 VanDerWaalsContact O-CB 3.28Å; F513-D517 WeakPolarHBondContact O-CB 3.39Å; F513-D517 PolarHBondContact O-N 3.22Å; D517-A520 PolarHBondContact O-N 2.79Å; D517-S521 PolarHBondContact O-N 3.22Å; D517-S521 PolarHBondContact O-OG 3.14Å
518	F	88.2	Confident	81.9	Confident	105 Å²	105	48.5 Å²	48.5	46%	0.461	25%	0.246	S	C	.	.	H	α-helix	trans	-57.5	-51.3	173	175.6	-99.3	0	0	0	111.2	K514 S521 E522	K514-F518 WeakPolarHBondContact O-CB 3.37Å; K514-F518 PolarHBondContact O-N 3.43Å; K514-F518 VanDerWaalsContact O-N 3.11Å; F518-S521 PolarHBondContact O-N 2.94Å; F518-S521 PolarHBondContact O-OG 3.46Å; F518-E522 HydrophobicContact CD1-CG 4.39Å; F518-E522 HydrophobicContact CE1-CG 3.89Å; F518-E522 HydrophobicContact CE2-CG 4.1Å; F518-E522 HydrophobicContact CZ-CG 3.72Å; F518-E522 PolarHBondContact O-N 2.89Å
519	W	85.7	Confident	81.3	Confident	23 Å²	23	53.4 Å²	53.4	9%	0.087	27%	0.272	C	S	.	.	H	α-helix	trans	-70.5	-31.4	179.4	-78.1	107.7	0	0	0	113.8	L420 L515 L516 S521 E522 T523 M536 K543 L544	L420-W519 HydrophobicContact CD1-CB 4.2Å; L515-W519 VanDerWaalsContact O-CD1 3.29Å; L515-W519 PolarHBondContact O-N 3.36Å; L516-W519 PolarHBondContact O-N 3Å; W519-S521 VanDerWaalsContact C-N 3.29Å; W519-S521 PolarHBondContact O-N 2.93Å; W519-E522 HydrophobicContact CE3-CB 4.21Å; W519-E522 PolarHBondContact O-N 3.08Å; W519-T523 WeakPolarHBondContact O-CB 3.28Å; W519-T523 VanDerWaalsContact O-CG2 3.3Å; W519-T523 WeakPolarHBondContact O-CG2 3.43Å; W519-T523 PolarHBondContact O-N 2.83Å; W519-T523 PolarHBondContact O-OG1 2.93Å; W519-M536 HydrophobicContact CZ3-CE 4.47Å; W519-M536 HydrophobicContact CZ3-SD 4.49Å; W519-K543 HydrophobicContact CH2-CB 3.66Å; W519-K543 VanDerWaalsContact CZ2-C 3.44Å; W519-K543 HydrophobicContact CZ2-CB 3.65Å; W519-K543 WeakPolarHBondContact CZ2-O 3.32Å; W519-L544 HydrophobicContact CB-CD1 3.98Å; W519-L544 HydrophobicContact CD2-CB 4.39Å; W519-L544 HydrophobicContact CD2-CD1 3.58Å; W519-L544 HydrophobicContact CE3-CB 4.12Å; W519-L544 HydrophobicContact CE3-CD1 3.7Å; W519-L544 HydrophobicContact CE3-CG 4.42Å; W519-L544 HydrophobicContact CG-CD1 3.71Å; W519-L544 HydrophobicContact CH2-CB 4.02Å; W519-L544 HydrophobicContact CZ2-CB 4.31Å; W519-L544 HydrophobicContact CZ3-CB 3.93Å; W519-L544 HydrophobicContact CZ3-CD1 4.38Å
520	A	85.1	Confident	79.9	Confident	3 Å²	3	56.9 Å²	56.9	3%	0.025	29%	0.29	C	S	.	.	H	α-helix	trans	-61.2	-40.3	170.1	0	0	0	0	0	110.8	H417 L420 W421 L516 D517 T523 H524	H417-A520 PolarHBondContact CE1-O 3.06Å; H417-A520 PolarHBondContact ND1-O 3.44Å; H417-A520 VanDerWaalsContact ND1-O 3.11Å; L420-A520 HydrophobicContact CB-CB 4.18Å; W421-A520 HydrophobicContact CB-CB 4.38Å; L516-A520 VanDerWaalsContact O-CB 3.27Å; L516-A520 WeakPolarHBondContact O-CB 3.44Å; L516-A520 PolarHBondContact O-N 2.94Å; D517-A520 PolarHBondContact O-N 2.79Å; A520-T523 PolarHBondContact O-OG1 3.35Å; A520-T523 VanDerWaalsContact O-OG1 3.1Å; A520-H524 WeakPolarHBondContact O-CB 3.27Å; A520-H524 PolarHBondContact O-N 3.05Å; A520-H524 VanDerWaalsContact O-N 3.1Å
521	S	83.1	Confident	78	Confident	58 Å²	58	59.7 Å²	59.7	41%	0.406	31%	0.31	S	S	.	.	H	α-helix	trans	-71.1	-41.4	176.7	75.5	0	0	0	0	113.3	D517 F518 W519 H524 V525	D517-S521 PolarHBondContact O-N 3.22Å; D517-S521 PolarHBondContact O-OG 3.14Å; F518-S521 PolarHBondContact O-N 2.94Å; F518-S521 PolarHBondContact O-OG 3.46Å; W519-S521 VanDerWaalsContact C-N 3.29Å; W519-S521 PolarHBondContact O-N 2.93Å; S521-H524 WeakPolarHBondContact O-CB 3.3Å; S521-H524 PolarHBondContact O-N 3.43Å; S521-V525 WeakPolarHBondContact O-CG2 3.47Å; S521-V525 PolarHBondContact O-N 3.03Å
522	E	81.6	Confident	76.3	Confident	79 Å²	79	64 Å²	64	37%	0.369	34%	0.337	S	S	.	.	H	α-helix	trans	-65.4	-46	177.6	-76.7	-66.2	155.9	0	0	111.9	F518 W519 H524 V525 V526	F518-E522 HydrophobicContact CD1-CG 4.39Å; F518-E522 HydrophobicContact CE1-CG 3.89Å; F518-E522 HydrophobicContact CE2-CG 4.1Å; F518-E522 HydrophobicContact CZ-CG 3.72Å; F518-E522 PolarHBondContact O-N 2.89Å; W519-E522 HydrophobicContact CE3-CB 4.21Å; W519-E522 PolarHBondContact O-N 3.08Å; E522-H524 VanDerWaalsContact C-N 3.28Å; E522-H524 PolarHBondContact O-N 3.22Å; E522-V525 PolarHBondContact O-N 3.19Å; E522-V526 WeakPolarHBondContact O-CG2 3.31Å; E522-V526 PolarHBondContact O-N 2.83Å
523	T	78.9	Confident	74.4	Confident	0 Å²	0	72 Å²	72	0%	0	38%	0.379	C	S	.	.	H	α-helix	trans	-63.9	-34.1	175.3	52.7	0	0	0	0	112	L413 H417 L420 W519 A520 V526 L527	L413-T523 HydrophobicContact CD1-CG2 4.2Å; H417-T523 PolarHBondContact ND1-OG1 2.75Å; L420-T523 HydrophobicContact CD1-CG2 4.12Å; W519-T523 WeakPolarHBondContact O-CB 3.28Å; W519-T523 VanDerWaalsContact O-CG2 3.3Å; W519-T523 WeakPolarHBondContact O-CG2 3.43Å; W519-T523 PolarHBondContact O-N 2.83Å; W519-T523 PolarHBondContact O-OG1 2.93Å; A520-T523 PolarHBondContact O-OG1 3.35Å; A520-T523 VanDerWaalsContact O-OG1 3.1Å; T523-V526 PolarHBondContact O-N 3.32Å; T523-L527 WeakPolarHBondContact O-CB 3.34Å; T523-L527 VanDerWaalsContact O-CG 3.25Å; T523-L527 WeakPolarHBondContact O-CG 3.38Å; T523-L527 PolarHBondContact O-N 2.89Å
524	H	80.4	Confident	72.7	Confident	76 Å²	76	72.9 Å²	72.9	35%	0.352	39%	0.39	S	S	.	.	H	α-helix	trans	-62.7	-45	173.2	-164.1	68.9	0	0	0	112.5	H417 A520 S521 E522 V526 L527 Q528	H417-H524 VanDerWaalsContact CE1-CB 3.44Å; H417-H524 WeakPolarHBondContact CE1-CB 3.37Å; H417-H524 AromaticContact CE1-CG 3.84Å; H417-H524 AromaticContact CE1-ND1 3.49Å; H417-H524 PolarHBondContact CE1-ND1 3.41Å; H417-H524 AromaticContact NE2-CG 3.93Å; H417-H524 AromaticContact NE2-ND1 3.13Å; H417-H524 PolarHBondContact NE2-ND1 2.9Å; H417-H524 VanDerWaalsContact NE2-ND1 3.13Å; A520-H524 WeakPolarHBondContact O-CB 3.27Å; A520-H524 PolarHBondContact O-N 3.05Å; A520-H524 VanDerWaalsContact O-N 3.1Å; S521-H524 WeakPolarHBondContact O-CB 3.3Å; S521-H524 PolarHBondContact O-N 3.43Å; E522-H524 VanDerWaalsContact C-N 3.28Å; E522-H524 PolarHBondContact O-N 3.22Å; H524-V526 VanDerWaalsContact C-N 3.34Å; H524-L527 PolarHBondContact O-N 3.4Å; H524-Q528 PolarHBondContact CD2-NE2 2.91Å; H524-Q528 PolarHBondContact NE2-NE2 2.81Å; H524-Q528 WeakPolarHBondContact O-CG 3.4Å; H524-Q528 PolarHBondContact O-N 2.86Å
525	V	79.1	Confident	71.3	Confident	70 Å²	70	70.2 Å²	70.2	42%	0.424	39%	0.394	S	S	.	.	H	α-helix	trans	-63.1	-42.9	179	169.4	0	0	0	0	110.4	S521 E522 Q528 L529	S521-V525 WeakPolarHBondContact O-CG2 3.47Å; S521-V525 PolarHBondContact O-N 3.03Å; E522-V525 PolarHBondContact O-N 3.19Å; V525-Q528 PolarHBondContact O-N 3.3Å; V525-L529 HydrophobicContact CG1-CD1 3.61Å; V525-L529 WeakPolarHBondContact O-CB 3.37Å; V525-L529 WeakPolarHBondContact O-CD1 3.34Å; V525-L529 VanDerWaalsContact O-CG 3.31Å; V525-L529 WeakPolarHBondContact O-CG 3.49Å; V525-L529 PolarHBondContact O-N 3.47Å
526	V	72.3	Confident	70.1	Confident	26 Å²	26	68.5 Å²	68.5	16%	0.158	39%	0.385	C	S	.	.	H	α-helix	trans	-63.6	-41.2	176	175.1	0	0	0	0	111.6	L413 E522 T523 H524 L529 M536	L413-V526 HydrophobicContact CD2-CG1 3.88Å; E522-V526 WeakPolarHBondContact O-CG2 3.31Å; E522-V526 PolarHBondContact O-N 2.83Å; T523-V526 PolarHBondContact O-N 3.32Å; H524-V526 VanDerWaalsContact C-N 3.34Å; V526-L529 PolarHBondContact O-N 3.24Å; V526-M536 HydrophobicContact CB-CG 4.42Å; V526-M536 HydrophobicContact CG1-CG 3.89Å; V526-M536 HydrophobicContact CG2-CG 3.96Å; V526-M536 HydrophobicContact CG2-SD 4.39Å
527	L	72.4	Confident	69.3	Low	37 Å²	37	70.5 Å²	70.5	19%	0.194	40%	0.399	C	S	.	.	H	α-helix	trans	-69	-34.2	176.6	-72.9	167.5	0	0	0	113	L413 A414 H417 T523 H524 L530	L413-L527 HydrophobicContact CB-CD2 4.44Å; L413-L527 HydrophobicContact CD2-CD2 4.04Å; L413-L527 HydrophobicContact CD2-CG 4.32Å; L413-L527 HydrophobicContact CG-CD2 4.07Å; L413-L527 HydrophobicContact CG-CG 4.32Å; A414-L527 HydrophobicContact CB-CD2 4.24Å; H417-L527 HydrophobicContact CB-CD1 3.43Å; H417-L527 VanDerWaalsContact CB-CD1 3.43Å; T523-L527 WeakPolarHBondContact O-CB 3.34Å; T523-L527 VanDerWaalsContact O-CG 3.25Å; T523-L527 WeakPolarHBondContact O-CG 3.38Å; T523-L527 PolarHBondContact O-N 2.89Å; H524-L527 PolarHBondContact O-N 3.4Å; L527-L530 HydrophobicContact CD2-CD1 4.06Å; L527-L530 WeakPolarHBondContact O-CD1 3.23Å
528	Q	69.3	Low	68.3	Low	144 Å²	144	71.7 Å²	71.7	67%	0.673	41%	0.411	S	S	*	.	H	α-helix	trans	-73	-28.3	175.4	-78.9	-169.2	-5.1	0	0	113.4	H524 V525	H524-Q528 PolarHBondContact CD2-NE2 2.91Å; H524-Q528 PolarHBondContact NE2-NE2 2.81Å; H524-Q528 WeakPolarHBondContact O-CG 3.4Å; H524-Q528 PolarHBondContact O-N 2.86Å; V525-Q528 PolarHBondContact O-N 3.3Å
529	L	66.5	Low	67.7	Low	117 Å²	117	69.9 Å²	69.9	61%	0.613	41%	0.411	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.5	1.3	-176.8	-78.5	165.3	0	0	0	114.7	V525 V526 C531	V525-L529 HydrophobicContact CG1-CD1 3.61Å; V525-L529 WeakPolarHBondContact O-CB 3.37Å; V525-L529 WeakPolarHBondContact O-CD1 3.34Å; V525-L529 VanDerWaalsContact O-CG 3.31Å; V525-L529 WeakPolarHBondContact O-CG 3.49Å; V525-L529 PolarHBondContact O-N 3.47Å; V526-L529 PolarHBondContact O-N 3.24Å; L529-C531 PolarHBondContact O-N 2.87Å
530	L	49.9	Very low	67.2	Low	78 Å²	78	71 Å²	71	41%	0.408	42%	0.419	S	S	.	.			trans	-58.4	92.5	-169.5	-84.9	162.9	0	0	0	114.8	V410 L527	V410-L530 HydrophobicContact CG1-CD1 3.55Å; V410-L530 HydrophobicContact CG1-CD2 4.32Å; V410-L530 HydrophobicContact CG2-CD2 4.22Å; L527-L530 HydrophobicContact CD2-CD1 4.06Å; L527-L530 WeakPolarHBondContact O-CD1 3.23Å
531	C	42.4	Very low	66.9	Low	91 Å²	91	71.1 Å²	71.1	62%	0.615	42%	0.419	S	S	*	.			trans	-93.2	150.3	136.5	-128.9	0	0	0	0	107.6	L529 L533	L529-C531 PolarHBondContact O-N 2.87Å; C531-L533 PolarHBondContact O-N 3.17Å
532	P	49.1	Very low	66.6	Low	125 Å²	125	70.6 Å²	70.6	81%	0.812	42%	0.418	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67	11.4	-167.2	-17.4	30.4	0	0	0	117.2
533	L	45.1	Very low	66.7	Low	172 Å²	172	71.4 Å²	71.4	90%	0.901	42%	0.42	S	S	*	.	T	Hydrogen-bonded Turn	trans	-119	-2.3	-171.3	-113.7	78.9	0	0	0	115.3	C531	C531-L533 PolarHBondContact O-N 3.17Å
534	S	50.5	Low	66.9	Low	61 Å²	61	71.5 Å²	71.5	43%	0.427	42%	0.42	S	S	.	.			trans	-113.7	66.9	171.6	65.1	0	0	0	0	110.3
535	A	56.5	Low	66.9	Low	83 Å²	83	70 Å²	70	69%	0.686	41%	0.414	S	S	*	.			trans	-57.5	140.3	156	0	0	0	0	0	107.8	S537	A535-S537 PolarHBondContact O-N 2.91Å
536	M	61.9	Low	67.2	Low	18 Å²	18	72.4 Å²	72.4	9%	0.089	42%	0.42	C	S	.	.			trans	-44.5	132.6	168.4	-89.2	-124.3	-68.6	0	0	108.9	W519 V526 D540 W541 L544	W519-M536 HydrophobicContact CZ3-CE 4.47Å; W519-M536 HydrophobicContact CZ3-SD 4.49Å; V526-M536 HydrophobicContact CB-CG 4.42Å; V526-M536 HydrophobicContact CG1-CG 3.89Å; V526-M536 HydrophobicContact CG2-CG 3.96Å; V526-M536 HydrophobicContact CG2-SD 4.39Å; M536-D540 HydrophobicContact CB-CB 4.48Å; M536-D540 HydrophobicContact SD-CB 3.73Å; M536-W541 HydrophobicContact CB-CG 4.46Å; M536-W541 HydrophobicContact CB-CZ2 4.5Å; M536-W541 VanDerWaalsContact CB-NE1 3.34Å; M536-W541 HydrophobicContact CE-CD2 3.94Å; M536-W541 HydrophobicContact CE-CE3 4.14Å; M536-W541 HydrophobicContact CE-CG 4.37Å; M536-W541 HydrophobicContact CE-CZ2 4.35Å; M536-W541 HydrophobicContact CE-CZ3 4.43Å; M536-L544 HydrophobicContact CE-CD2 4.07Å
537	S	68.9	Low	67.8	Low	44 Å²	44	71.7 Å²	71.7	31%	0.308	42%	0.417	S	S	.	.			trans	-63.5	154.1	-176.6	77.5	0	0	0	0	109.6	A535 S539 D540 W541	A535-S537 PolarHBondContact O-N 2.91Å; S537-S539 PolarHBondContact O-N 3.24Å; S537-S539 PolarHBondContact OG-N 2.85Å; S537-D540 WeakPolarHBondContact CB-OD2 3.34Å; S537-D540 PolarHBondContact N-OD2 3.4Å; S537-D540 PolarHBondContact O-N 3.41Å; S537-D540 PolarHBondContact OG-N 3.25Å; S537-D540 PolarHBondContact OG-OD2 2.9Å; S537-W541 PolarHBondContact O-N 3.46Å; S537-W541 VanDerWaalsContact O-N 3.14Å
538	P	67.6	Low	68.5	Low	96 Å²	96	70.1 Å²	70.1	62%	0.623	41%	0.409	S	S	*	.	H	α-helix	trans	-53.5	-29.1	172.6	-24.7	33	0	0	0	112.4	A542	P538-A542 PolarHBondContact O-N 2.98Å
539	S	74.6	Confident	69.2	Low	66 Å²	66	64.4 Å²	64.4	46%	0.462	39%	0.385	S	S	.	.	H	α-helix	trans	-69.9	-30.2	173.8	-178.6	0	0	0	0	113.6	S537 K543	S537-S539 PolarHBondContact O-N 3.24Å; S537-S539 PolarHBondContact OG-N 2.85Å; S539-K543 VanDerWaalsContact O-CG 3.27Å; S539-K543 WeakPolarHBondContact O-CG 3.45Å; S539-K543 PolarHBondContact O-N 3.33Å
540	D	75.8	Confident	70.1	Confident	48 Å²	48	61.2 Å²	61.2	26%	0.257	37%	0.368	S	S	.	.	H	α-helix	trans	-83.9	-32.3	-178.6	-57.6	-42	0	0	0	111.4	M536 S537 K543 L544	M536-D540 HydrophobicContact CB-CB 4.48Å; M536-D540 HydrophobicContact SD-CB 3.73Å; S537-D540 WeakPolarHBondContact CB-OD2 3.34Å; S537-D540 PolarHBondContact N-OD2 3.4Å; S537-D540 PolarHBondContact O-N 3.41Å; S537-D540 PolarHBondContact OG-N 3.25Å; S537-D540 PolarHBondContact OG-OD2 2.9Å; D540-K543 PolarHBondContact O-N 3.08Å; D540-K543 IonicContact OD1-NZ 2.79Å; D540-K543 PolarHBondContact OD1-NZ 3.45Å; D540-L544 PolarHBondContact O-N 3.02Å
541	W	77.8	Confident	71.9	Confident	5 Å²	5	57.5 Å²	57.5	2%	0.019	35%	0.349	C	S	.	.	H	α-helix	trans	-62.6	-40.9	167.4	-76.8	108.9	0	0	0	112.7	I397 Y408 L413 I416 M536 S537 K543 L544 E545	I397-W541 HydrophobicContact CD1-CE3 4.44Å; I397-W541 HydrophobicContact CD1-CZ3 4.17Å; I397-W541 HydrophobicContact CG1-CE3 4.37Å; I397-W541 HydrophobicContact CG1-CZ3 4.18Å; I397-W541 HydrophobicContact CG2-CE3 4.28Å; Y408-W541 HydrophobicContact CD1-CD2 4.2Å; Y408-W541 AromaticContact CD1-CE2 3.8Å; Y408-W541 HydrophobicContact CD1-CE3 4.43Å; Y408-W541 AromaticContact CD1-CH2 3.95Å; Y408-W541 HydrophobicContact CD1-CH2 3.95Å; Y408-W541 AromaticContact CD1-CZ2 3.67Å; Y408-W541 HydrophobicContact CD1-CZ2 3.67Å; Y408-W541 HydrophobicContact CD1-CZ3 4.32Å; Y408-W541 AromaticContact CD2-CD1 3.66Å; Y408-W541 HydrophobicContact CD2-CD2 4.15Å; Y408-W541 AromaticContact CD2-CE2 3.61Å; Y408-W541 HydrophobicContact CD2-CG 4.17Å; Y408-W541 HydrophobicContact CD2-CZ2 4.15Å; Y408-W541 AromaticContact CD2-NE1 3.24Å; Y408-W541 AromaticContact CE1-CD2 3.96Å; Y408-W541 HydrophobicContact CE1-CD2 3.96Å; Y408-W541 HydrophobicContact CE1-CE3 4.06Å; Y408-W541 HydrophobicContact CE1-CG 4.5Å; Y408-W541 HydrophobicContact CE1-CH2 4.33Å; Y408-W541 HydrophobicContact CE1-CZ2 4.24Å; Y408-W541 HydrophobicContact CE1-CZ3 4.25Å; Y408-W541 HydrophobicContact CE2-CB 4.3Å; Y408-W541 AromaticContact CE2-CD1 3.42Å; Y408-W541 VanDerWaalsContact CE2-CD1 3.42Å; Y408-W541 AromaticContact CE2-CD2 3.83Å; Y408-W541 HydrophobicContact CE2-CD2 3.83Å; Y408-W541 AromaticContact CE2-CE2 3.8Å; Y408-W541 AromaticContact CE2-CG 3.6Å; Y408-W541 HydrophobicContact CE2-CG 3.6Å; Y408-W541 AromaticContact CE2-NE1 3.5Å; Y408-W541 HydrophobicContact CG-CD2 4.31Å; Y408-W541 AromaticContact CG-CE2 3.59Å; Y408-W541 HydrophobicContact CG-CH2 4.37Å; Y408-W541 AromaticContact CG-CZ2 3.64Å; Y408-W541 HydrophobicContact CG-CZ2 3.64Å; Y408-W541 AromaticContact CG-NE1 3.67Å; Y408-W541 AromaticContact CZ-CD2 3.78Å; Y408-W541 AromaticContact CZ-CG 3.84Å; L413-W541 HydrophobicContact CD1-CH2 3.7Å; L413-W541 HydrophobicContact CD1-CZ2 3.96Å; I416-W541 HydrophobicContact CD1-CH2 4.12Å; I416-W541 HydrophobicContact CD1-CZ3 4.06Å; M536-W541 HydrophobicContact CB-CG 4.46Å; M536-W541 HydrophobicContact CB-CZ2 4.5Å; M536-W541 VanDerWaalsContact CB-NE1 3.34Å; M536-W541 HydrophobicContact CE-CD2 3.94Å; M536-W541 HydrophobicContact CE-CE3 4.14Å; M536-W541 HydrophobicContact CE-CG 4.37Å; M536-W541 HydrophobicContact CE-CZ2 4.35Å; M536-W541 HydrophobicContact CE-CZ3 4.43Å; S537-W541 PolarHBondContact O-N 3.46Å; S537-W541 VanDerWaalsContact O-N 3.14Å; W541-K543 VanDerWaalsContact C-N 3.35Å; W541-K543 PolarHBondContact O-N 3.2Å; W541-L544 HydrophobicContact CE3-CD2 3.97Å; W541-L544 HydrophobicContact CZ3-CD2 3.84Å; W541-L544 PolarHBondContact O-N 2.85Å; W541-E545 WeakPolarHBondContact O-CB 3.49Å; W541-E545 PolarHBondContact O-N 3.49Å
542	A	78.3	Confident	73.8	Confident	47 Å²	47	55.1 Å²	55.1	39%	0.388	33%	0.329	S	S	.	.	H	α-helix	trans	-64.3	-37.8	174.6	0	0	0	0	0	112.6	P538 E545 E546	P538-A542 PolarHBondContact O-N 2.98Å; A542-E545 PolarHBondContact O-N 3.13Å; A542-E546 WeakPolarHBondContact O-CB 3.32Å; A542-E546 PolarHBondContact O-N 2.88Å
543	K	82.7	Confident	75.5	Confident	96 Å²	96	55.4 Å²	55.4	42%	0.417	32%	0.317	S	S	.	.	H	α-helix	trans	-69.6	-35.5	175.1	-69.6	169.1	-162.7	155.8	0	112.4	W519 S539 D540 W541 E546 A547	W519-K543 HydrophobicContact CH2-CB 3.66Å; W519-K543 VanDerWaalsContact CZ2-C 3.44Å; W519-K543 HydrophobicContact CZ2-CB 3.65Å; W519-K543 WeakPolarHBondContact CZ2-O 3.32Å; S539-K543 VanDerWaalsContact O-CG 3.27Å; S539-K543 WeakPolarHBondContact O-CG 3.45Å; S539-K543 PolarHBondContact O-N 3.33Å; D540-K543 PolarHBondContact O-N 3.08Å; D540-K543 IonicContact OD1-NZ 2.79Å; D540-K543 PolarHBondContact OD1-NZ 3.45Å; W541-K543 VanDerWaalsContact C-N 3.35Å; W541-K543 PolarHBondContact O-N 3.2Å; K543-E546 PolarHBondContact O-N 3.24Å; K543-A547 WeakPolarHBondContact O-CB 3.37Å; K543-A547 PolarHBondContact O-N 2.94Å
544	L	82.7	Confident	77.3	Confident	1 Å²	1	49.1 Å²	49.1	1%	0.005	28%	0.284	C	S	.	.	H	α-helix	trans	-66.5	-43.3	174.5	178.3	63.5	0	0	0	110.8	I397 I416 L420 W519 M536 D540 W541 A547 L548	I397-L544 HydrophobicContact CD1-CD2 3.99Å; I397-L544 HydrophobicContact CD1-CG 4.31Å; I416-L544 HydrophobicContact CG2-CD2 4.5Å; L420-L544 HydrophobicContact CD1-CD1 4.31Å; W519-L544 HydrophobicContact CB-CD1 3.98Å; W519-L544 HydrophobicContact CD2-CB 4.39Å; W519-L544 HydrophobicContact CD2-CD1 3.58Å; W519-L544 HydrophobicContact CE3-CB 4.12Å; W519-L544 HydrophobicContact CE3-CD1 3.7Å; W519-L544 HydrophobicContact CE3-CG 4.42Å; W519-L544 HydrophobicContact CG-CD1 3.71Å; W519-L544 HydrophobicContact CH2-CB 4.02Å; W519-L544 HydrophobicContact CZ2-CB 4.31Å; W519-L544 HydrophobicContact CZ3-CB 3.93Å; W519-L544 HydrophobicContact CZ3-CD1 4.38Å; M536-L544 HydrophobicContact CE-CD2 4.07Å; D540-L544 PolarHBondContact O-N 3.02Å; W541-L544 HydrophobicContact CE3-CD2 3.97Å; W541-L544 HydrophobicContact CZ3-CD2 3.84Å; W541-L544 PolarHBondContact O-N 2.85Å; L544-A547 PolarHBondContact O-N 2.77Å; L544-L548 HydrophobicContact CG-CD1 4.49Å; L544-L548 WeakPolarHBondContact O-CG 3.29Å; L544-L548 PolarHBondContact O-N 3.08Å
545	E	82.2	Confident	78.8	Confident	46 Å²	46	46.3 Å²	46.3	22%	0.215	26%	0.264	C	S	.	.	H	α-helix	trans	-58.2	-47.3	173	-173	-179.2	179.3	0	0	111.4	I397 S398 N401 W541 A542 A547 L548 S549	I397-E545 HydrophobicContact CG2-CB 3.9Å; I397-E545 HydrophobicContact CG2-CG 4.31Å; S398-E545 WeakPolarHBondContact CA-OE1 3.3Å; S398-E545 VanDerWaalsContact CB-OE1 3.26Å; S398-E545 WeakPolarHBondContact CB-OE1 3.48Å; S398-E545 PolarHBondContact OG-OE1 3.3Å; N401-E545 PolarHBondContact ND2-OE2 2.99Å; W541-E545 WeakPolarHBondContact O-CB 3.49Å; W541-E545 PolarHBondContact O-N 3.49Å; A542-E545 PolarHBondContact O-N 3.13Å; E545-A547 VanDerWaalsContact C-N 3.3Å; E545-A547 PolarHBondContact O-N 3.45Å; E545-L548 PolarHBondContact O-N 3.19Å; E545-S549 PolarHBondContact O-N 3.09Å
546	E	85.5	Confident	79.9	Confident	120 Å²	120	44.4 Å²	44.4	56%	0.561	25%	0.249	S	C	*	.	H	α-helix	trans	-59.5	-41.5	176.3	-173.2	-179.1	176.4	0	0	111.8	A542 K543 S549 N550	A542-E546 WeakPolarHBondContact O-CB 3.32Å; A542-E546 PolarHBondContact O-N 2.88Å; K543-E546 PolarHBondContact O-N 3.24Å; E546-S549 PolarHBondContact O-N 2.99Å; E546-N550 WeakPolarHBondContact O-CB 3.46Å; E546-N550 PolarHBondContact O-N 2.89Å; E546-N550 PolarHBondContact O-ND2 3.4Å
547	A	84.9	Confident	80.8	Confident	10 Å²	10	47.3 Å²	47.3	8%	0.083	26%	0.262	C	S	.	.	H	α-helix	trans	-66.3	-39.2	177.7	0	0	0	0	0	112.9	K543 L544 E545 N550 C551	K543-A547 WeakPolarHBondContact O-CB 3.37Å; K543-A547 PolarHBondContact O-N 2.94Å; L544-A547 PolarHBondContact O-N 2.77Å; E545-A547 VanDerWaalsContact C-N 3.3Å; E545-A547 PolarHBondContact O-N 3.45Å; A547-N550 PolarHBondContact O-N 3.03Å; A547-C551 PolarHBondContact O-N 2.87Å; A547-C551 PolarHBondContact O-SG 2.98Å
548	L	85.8	Confident	81.1	Confident	5 Å²	5	45.2 Å²	45.2	3%	0.026	25%	0.247	C	C	.	.	H	α-helix	trans	-66.3	-40.3	173.3	-68.4	174.4	0	0	0	111.3	I390 H394 I397 L420 W423 L544 E545 N550 C551 Q552	I390-L548 HydrophobicContact CG2-CB 4.37Å; I390-L548 HydrophobicContact CG2-CD2 4.15Å; H394-L548 HydrophobicContact CB-CB 4.32Å; I397-L548 HydrophobicContact CD1-CD1 3.68Å; L420-L548 HydrophobicContact CD2-CD2 4.35Å; W423-L548 HydrophobicContact CZ3-CD2 4.33Å; L544-L548 HydrophobicContact CG-CD1 4.49Å; L544-L548 WeakPolarHBondContact O-CG 3.29Å; L544-L548 PolarHBondContact O-N 3.08Å; E545-L548 PolarHBondContact O-N 3.19Å; L548-N550 VanDerWaalsContact C-N 3.31Å; L548-N550 PolarHBondContact O-N 3.36Å; L548-C551 WeakPolarHBondContact O-CB 3.18Å; L548-C551 PolarHBondContact O-N 3.03Å; L548-Q552 WeakPolarHBondContact O-CG 3.26Å; L548-Q552 PolarHBondContact O-N 2.97Å
549	S	84.8	Confident	81.5	Confident	24 Å²	24	41.7 Å²	41.7	17%	0.168	22%	0.222	C	C	.	.	H	α-helix	trans	-66	-34.8	174.8	118.3	0	0	0	0	111.6	H394 E545 E546 Q552 K553	H394-S549 VanDerWaalsContact NE2-CB 3.31Å; H394-S549 WeakPolarHBondContact NE2-CB 3.47Å; E545-S549 PolarHBondContact O-N 3.09Å; E546-S549 PolarHBondContact O-N 2.99Å; S549-Q552 WeakPolarHBondContact O-CB 3.29Å; S549-Q552 PolarHBondContact O-N 3.49Å; S549-K553 WeakPolarHBondContact O-CG 3.1Å; S549-K553 PolarHBondContact O-N 3.19Å
550	N	86.1	Confident	81.4	Confident	49 Å²	49	44.4 Å²	44.4	26%	0.262	23%	0.231	S	C	.	.	H	α-helix	trans	-68.9	-36.9	173.5	-71	-23.9	0	0	0	111.8	E546 A547 L548 Q552 K553 M554	E546-N550 WeakPolarHBondContact O-CB 3.46Å; E546-N550 PolarHBondContact O-N 2.89Å; E546-N550 PolarHBondContact O-ND2 3.4Å; A547-N550 PolarHBondContact O-N 3.03Å; L548-N550 VanDerWaalsContact C-N 3.31Å; L548-N550 PolarHBondContact O-N 3.36Å; N550-Q552 VanDerWaalsContact C-N 3.34Å; N550-K553 PolarHBondContact O-N 2.81Å; N550-K553 PolarHBondContact OD1-NZ 2.86Å; N550-M554 VanDerWaalsContact O-CG 3.31Å; N550-M554 WeakPolarHBondContact O-CG 3.41Å; N550-M554 PolarHBondContact O-N 3.39Å
551	C	86.1	Confident	81.1	Confident	1 Å²	1	45.9 Å²	45.9	1%	0.007	23%	0.233	C	C	.	.	H	α-helix	trans	-63.8	-39	170.8	-67.8	0	0	0	0	111.7	I390 M512 A547 L548 M554 S555	I390-C551 HydrophobicContact CD1-CB 4.11Å; M512-C551 HydrophobicContact CE-CB 4.22Å; A547-C551 PolarHBondContact O-N 2.87Å; A547-C551 PolarHBondContact O-SG 2.98Å; L548-C551 WeakPolarHBondContact O-CB 3.18Å; L548-C551 PolarHBondContact O-N 3.03Å; C551-M554 PolarHBondContact O-N 3.22Å; C551-S555 VanDerWaalsContact O-CB 3.29Å; C551-S555 WeakPolarHBondContact O-CB 3.44Å; C551-S555 PolarHBondContact O-N 3.46Å; C551-S555 PolarHBondContact O-OG 3.02Å
552	Q	83.1	Confident	80.6	Confident	41 Å²	41	45.8 Å²	45.8	19%	0.192	23%	0.233	C	C	.	.	H	α-helix	trans	-62.4	-45.6	173.4	-72.7	173.3	-10.7	0	0	111.7	I390 E391 H394 L548 S549 N550 M554 S555 A556	I390-Q552 HydrophobicContact CG2-CG 3.74Å; E391-Q552 HydrophobicContact CG-CG 4.46Å; H394-Q552 VanDerWaalsContact CB-NE2 3.31Å; L548-Q552 WeakPolarHBondContact O-CG 3.26Å; L548-Q552 PolarHBondContact O-N 2.97Å; S549-Q552 WeakPolarHBondContact O-CB 3.29Å; S549-Q552 PolarHBondContact O-N 3.49Å; N550-Q552 VanDerWaalsContact C-N 3.34Å; Q552-M554 PolarHBondContact O-N 3.39Å; Q552-S555 WeakPolarHBondContact CA-OG 3.13Å; Q552-S555 PolarHBondContact O-N 3.28Å; Q552-S555 PolarHBondContact O-OG 3.05Å; Q552-A556 WeakPolarHBondContact O-CB 3.16Å; Q552-A556 PolarHBondContact O-N 3.49Å
553	K	84.5	Confident	79.5	Confident	130 Å²	130	46.2 Å²	46.2	57%	0.565	23%	0.233	S	C	*	.	H	α-helix	trans	-60.6	-46	176	-69.8	169	-165.8	163	0	112.1	S549 N550 S555 A556 E557	S549-K553 WeakPolarHBondContact O-CG 3.1Å; S549-K553 PolarHBondContact O-N 3.19Å; N550-K553 PolarHBondContact O-N 2.81Å; N550-K553 PolarHBondContact OD1-NZ 2.86Å; K553-S555 VanDerWaalsContact C-N 3.34Å; K553-A556 PolarHBondContact O-N 3.35Å; K553-E557 WeakPolarHBondContact O-CB 3.25Å; K553-E557 PolarHBondContact O-N 3.21Å
554	M	83.2	Confident	78	Confident	41 Å²	41	47.3 Å²	47.3	20%	0.202	24%	0.238	C	C	.	.	H	α-helix	trans	-63.3	-41.1	176.3	-69.9	179.8	-167.5	0	0	111.3	L508 S511 M512 L515 N550 C551 Q552 E557 I558	L508-M554 HydrophobicContact CD2-CG 4.39Å; S511-M554 PolarHBondContact OG-SD 3.47Å; M512-M554 HydrophobicContact CG-CB 3.54Å; M512-M554 HydrophobicContact CG-CG 4.24Å; M512-M554 HydrophobicContact CG-SD 3.69Å; M512-M554 HydrophobicContact SD-CB 3.71Å; L515-M554 HydrophobicContact CD1-CE 3.56Å; L515-M554 HydrophobicContact CD1-SD 3.95Å; N550-M554 VanDerWaalsContact O-CG 3.31Å; N550-M554 WeakPolarHBondContact O-CG 3.41Å; N550-M554 PolarHBondContact O-N 3.39Å; C551-M554 PolarHBondContact O-N 3.22Å; Q552-M554 PolarHBondContact O-N 3.39Å; M554-E557 PolarHBondContact O-N 2.71Å; M554-I558 WeakPolarHBondContact O-CB 3.08Å; M554-I558 WeakPolarHBondContact O-CD1 3.26Å; M554-I558 WeakPolarHBondContact O-CG1 3.46Å; M554-I558 PolarHBondContact O-N 2.61Å
555	S	82.4	Confident	76.4	Confident	1 Å²	1	47.7 Å²	47.7	1%	0.007	24%	0.24	C	C	.	.	H	α-helix	trans	-64.8	-44.5	176.3	76.7	0	0	0	0	111.5	C551 Q552 K553 E557 I558 F559	C551-S555 VanDerWaalsContact O-CB 3.29Å; C551-S555 WeakPolarHBondContact O-CB 3.44Å; C551-S555 PolarHBondContact O-N 3.46Å; C551-S555 PolarHBondContact O-OG 3.02Å; Q552-S555 WeakPolarHBondContact CA-OG 3.13Å; Q552-S555 PolarHBondContact O-N 3.28Å; Q552-S555 PolarHBondContact O-OG 3.05Å; K553-S555 VanDerWaalsContact C-N 3.34Å; S555-E557 VanDerWaalsContact C-N 3.31Å; S555-E557 PolarHBondContact O-N 2.92Å; S555-I558 CarbonylContact O-C 3.5Å; S555-I558 WeakPolarHBondContact O-CA 3.18Å; S555-I558 WeakPolarHBondContact O-CB 3.39Å; S555-I558 PolarHBondContact O-N 3.28Å; S555-I558 VanDerWaalsContact O-N 3.1Å; S555-F559 VanDerWaalsContact C-CD2 3.44Å; S555-F559 WeakPolarHBondContact O-CD2 3.22Å; S555-F559 WeakPolarHBondContact O-CG 3.46Å; S555-F559 PolarHBondContact O-N 3.2Å
556	A	80.3	Confident	74.6	Confident	44 Å²	44	47.9 Å²	47.9	36%	0.364	25%	0.246	S	C	.	.	H	α-helix	trans	-62.5	-38.2	176.4	0	0	0	0	0	111.8	Q552 K553 F559 L560	Q552-A556 WeakPolarHBondContact O-CB 3.16Å; Q552-A556 PolarHBondContact O-N 3.49Å; K553-A556 PolarHBondContact O-N 3.35Å; A556-F559 PolarHBondContact O-N 3.4Å; A556-L560 WeakPolarHBondContact O-CB 3.47Å; A556-L560 WeakPolarHBondContact O-CG 3.25Å; A556-L560 PolarHBondContact O-N 3.38Å
557	E	79.8	Confident	72.7	Confident	78 Å²	78	46.4 Å²	46.4	36%	0.364	24%	0.241	S	C	.	.	H	α-helix	trans	-64.3	-45.2	171.8	-169.1	179.1	173	0	0	111	L508 K553 M554 S555 F559 L560 Y561	L508-E557 HydrophobicContact CD1-CB 4.3Å; L508-E557 HydrophobicContact CD1-CG 3.88Å; K553-E557 WeakPolarHBondContact O-CB 3.25Å; K553-E557 PolarHBondContact O-N 3.21Å; M554-E557 PolarHBondContact O-N 2.71Å; S555-E557 VanDerWaalsContact C-N 3.31Å; S555-E557 PolarHBondContact O-N 2.92Å; E557-F559 VanDerWaalsContact C-N 3.32Å; E557-F559 PolarHBondContact O-N 3.4Å; E557-L560 WeakPolarHBondContact O-CB 3.47Å; E557-L560 PolarHBondContact O-N 2.87Å; E557-Y561 HydrophobicContact CG-CD2 4.13Å; E557-Y561 HydrophobicContact CG-CE2 3.86Å; E557-Y561 WeakPolarHBondContact O-CD2 3.46Å; E557-Y561 PolarHBondContact O-N 2.84Å
558	I	75.8	Confident	70.7	Confident	0 Å²	0	49.5 Å²	49.5	0%	0	25%	0.254	C	S	.	.	H	α-helix	trans	-61.4	-39.4	174.4	-67.8	162.4	0	0	0	111.3	L383 I505 L508 L509 M512 M554 S555 Y561 F562	L383-I558 HydrophobicContact CD1-CG2 3.77Å; I505-I558 HydrophobicContact CG2-CG2 4.25Å; L508-I558 HydrophobicContact CB-CD1 3.69Å; L508-I558 HydrophobicContact CB-CG1 3.55Å; L508-I558 HydrophobicContact CD1-CG1 3.86Å; L508-I558 HydrophobicContact CG-CG1 4.35Å; L509-I558 HydrophobicContact CD2-CD1 4.15Å; L509-I558 HydrophobicContact CG-CD1 4.21Å; M512-I558 HydrophobicContact SD-CD1 3.53Å; M512-I558 VanDerWaalsContact SD-CD1 3.53Å; M554-I558 WeakPolarHBondContact O-CB 3.08Å; M554-I558 WeakPolarHBondContact O-CD1 3.26Å; M554-I558 WeakPolarHBondContact O-CG1 3.46Å; M554-I558 PolarHBondContact O-N 2.61Å; S555-I558 CarbonylContact O-C 3.5Å; S555-I558 WeakPolarHBondContact O-CA 3.18Å; S555-I558 WeakPolarHBondContact O-CB 3.39Å; S555-I558 PolarHBondContact O-N 3.28Å; S555-I558 VanDerWaalsContact O-N 3.1Å; I558-Y561 CarbonylContact O-C 3.48Å; I558-Y561 WeakPolarHBondContact O-CA 3.4Å; I558-Y561 WeakPolarHBondContact O-CB 2.85Å; I558-Y561 PolarHBondContact O-N 3.18Å; I558-F562 HydrophobicContact CG2-CD2 3.47Å; I558-F562 VanDerWaalsContact CG2-CD2 3.47Å; I558-F562 HydrophobicContact CG2-CE2 3.24Å; I558-F562 HydrophobicContact CG2-CZ 4.37Å; I558-F562 WeakPolarHBondContact O-CD2 3.46Å; I558-F562 PolarHBondContact O-N 2.76Å
559	F	75.5	Confident	68.6	Low	22 Å²	22	50.4 Å²	50.4	10%	0.096	26%	0.258	C	S	.	.	H	α-helix	trans	-71.4	-32.4	176.3	-71.4	-58.2	0	0	0	112.8	F380 L383 S384 Q387 S555 A556 E557 Y561 F562 S563	F380-F559 AromaticContact CD2-CD1 3.74Å; F380-F559 HydrophobicContact CD2-CD1 3.74Å; F380-F559 AromaticContact CD2-CE1 3.78Å; F380-F559 HydrophobicContact CD2-CE1 3.78Å; F380-F559 AromaticContact CE2-CD1 3.42Å; F380-F559 HydrophobicContact CE2-CD1 3.42Å; F380-F559 VanDerWaalsContact CE2-CD1 3.42Å; F380-F559 AromaticContact CE2-CE1 3.73Å; F380-F559 HydrophobicContact CE2-CE1 3.73Å; F380-F559 HydrophobicContact CG-CE1 4.45Å; F380-F559 HydrophobicContact CZ-CD1 4.23Å; F380-F559 HydrophobicContact CZ-CE1 4.3Å; L383-F559 HydrophobicContact CB-CE1 4.18Å; L383-F559 HydrophobicContact CB-CZ 3.74Å; S384-F559 VanDerWaalsContact OG-CE1 3.25Å; S384-F559 WeakPolarHBondContact OG-CE1 3.25Å; Q387-F559 HydrophobicContact CB-CE2 4.07Å; Q387-F559 HydrophobicContact CB-CZ 4.48Å; Q387-F559 HydrophobicContact CG-CE2 4.3Å; S555-F559 VanDerWaalsContact C-CD2 3.44Å; S555-F559 WeakPolarHBondContact O-CD2 3.22Å; S555-F559 WeakPolarHBondContact O-CG 3.46Å; S555-F559 PolarHBondContact O-N 3.2Å; A556-F559 PolarHBondContact O-N 3.4Å; E557-F559 VanDerWaalsContact C-N 3.32Å; E557-F559 PolarHBondContact O-N 3.4Å; F559-Y561 VanDerWaalsContact C-N 3.32Å; F559-F562 PolarHBondContact O-N 3.35Å; F559-S563 WeakPolarHBondContact O-CB 3.06Å; F559-S563 PolarHBondContact O-N 3.1Å; F559-S563 PolarHBondContact O-OG 3.23Å
560	L	73.4	Confident	66.7	Low	123 Å²	123	55.4 Å²	55.4	64%	0.644	28%	0.279	S	S	*	.	H	α-helix	trans	-63.7	-41.2	167.2	-76.9	166.3	0	0	0	110.1	A556 E557 S563 F564	A556-L560 WeakPolarHBondContact O-CB 3.47Å; A556-L560 WeakPolarHBondContact O-CG 3.25Å; A556-L560 PolarHBondContact O-N 3.38Å; E557-L560 WeakPolarHBondContact O-CB 3.47Å; E557-L560 PolarHBondContact O-N 2.87Å; L560-S563 PolarHBondContact O-N 3.39Å; L560-F564 WeakPolarHBondContact O-CA 3.09Å; L560-F564 WeakPolarHBondContact O-CB 3.37Å; L560-F564 PolarHBondContact O-N 3.21Å
561	Y	69	Low	64.6	Low	80 Å²	80	61.1 Å²	61.1	31%	0.314	30%	0.297	S	S	.	.	H	α-helix	trans	-65.5	-37.4	172.1	-82.2	-73.4	0	0	0	113	T504 I505 L508 E557 I558 F559 T565	T504-Y561 HydrophobicContact CG2-CE1 4.49Å; T504-Y561 HydrophobicContact CG2-CE2 3.69Å; I505-Y561 HydrophobicContact CG1-CG 4.23Å; L508-Y561 HydrophobicContact CD1-CD2 4.21Å; L508-Y561 HydrophobicContact CD1-CE2 4.18Å; E557-Y561 HydrophobicContact CG-CD2 4.13Å; E557-Y561 HydrophobicContact CG-CE2 3.86Å; E557-Y561 WeakPolarHBondContact O-CD2 3.46Å; E557-Y561 PolarHBondContact O-N 2.84Å; I558-Y561 CarbonylContact O-C 3.48Å; I558-Y561 WeakPolarHBondContact O-CA 3.4Å; I558-Y561 WeakPolarHBondContact O-CB 2.85Å; I558-Y561 PolarHBondContact O-N 3.18Å; F559-Y561 VanDerWaalsContact C-N 3.32Å; Y561-T565 WeakPolarHBondContact O-CA 3.36Å; Y561-T565 WeakPolarHBondContact O-CB 3.44Å; Y561-T565 VanDerWaalsContact O-CG2 3.26Å; Y561-T565 WeakPolarHBondContact O-CG2 3.46Å; Y561-T565 PolarHBondContact O-N 3.45Å; Y561-T565 PolarHBondContact O-OG1 3.25Å
562	F	66.9	Low	62.4	Low	2 Å²	2	64 Å²	64	1%	0.009	31%	0.309	C	S	.	.	H	α-helix	trans	-73.3	-33	174.8	-78.1	-61.8	0	0	0	113	Q376 Q379 F380 L383 I505 I558 F559 T565 C566	Q376-F562 HydrophobicContact CB-CE1 4.02Å; Q376-F562 HydrophobicContact CG-CE1 4.26Å; Q379-F562 HydrophobicContact CB-CZ 3.92Å; F380-F562 HydrophobicContact CB-CG 4.5Å; F380-F562 HydrophobicContact CD2-CB 3.64Å; F380-F562 AromaticContact CD2-CD2 3.99Å; F380-F562 HydrophobicContact CD2-CD2 3.99Å; F380-F562 AromaticContact CD2-CG 3.85Å; F380-F562 HydrophobicContact CD2-CG 3.85Å; F380-F562 HydrophobicContact CE2-CB 4.11Å; L383-F562 HydrophobicContact CD1-CE2 3.65Å; L383-F562 HydrophobicContact CD1-CZ 4.35Å; I505-F562 HydrophobicContact CD1-CE1 4.32Å; I505-F562 HydrophobicContact CG2-CE2 4.2Å; I505-F562 HydrophobicContact CG2-CZ 3.92Å; I558-F562 HydrophobicContact CG2-CD2 3.47Å; I558-F562 VanDerWaalsContact CG2-CD2 3.47Å; I558-F562 HydrophobicContact CG2-CE2 3.24Å; I558-F562 HydrophobicContact CG2-CZ 4.37Å; I558-F562 WeakPolarHBondContact O-CD2 3.46Å; I558-F562 PolarHBondContact O-N 2.76Å; F559-F562 PolarHBondContact O-N 3.35Å; F562-T565 VanDerWaalsContact CA-OG1 3.28Å; F562-T565 WeakPolarHBondContact CA-OG1 3.16Å; F562-T565 CarbonylContact O-C 3.51Å; F562-T565 PolarHBondContact O-OG1 2.79Å; F562-C566 WeakPolarHBondContact O-CA 3.16Å; F562-C566 WeakPolarHBondContact O-CB 2.95Å; F562-C566 PolarHBondContact O-N 2.84Å; F562-C566 PolarHBondContact O-SG 3.48Å
563	S	55.6	Low	60.6	Low	56 Å²	56	64.8 Å²	64.8	39%	0.392	31%	0.314	S	S	.	.	H	α-helix	trans	-73.8	-40.6	174.8	-58.2	0	0	0	0	110.3	F559 L560 C566 I567	F559-S563 WeakPolarHBondContact O-CB 3.06Å; F559-S563 PolarHBondContact O-N 3.1Å; F559-S563 PolarHBondContact O-OG 3.23Å; L560-S563 PolarHBondContact O-N 3.39Å; S563-C566 PolarHBondContact O-N 3.05Å; S563-I567 WeakPolarHBondContact O-CB 3.43Å; S563-I567 WeakPolarHBondContact O-CD1 2.89Å; S563-I567 WeakPolarHBondContact O-CG1 3.16Å; S563-I567 PolarHBondContact O-N 3.44Å
564	F	50.3	Low	58.5	Low	120 Å²	120	61.2 Å²	61.2	53%	0.526	31%	0.305	S	S	.	.	H	α-helix	trans	-68.9	-41.8	173.2	-161.7	-104	0	0	0	110.1	L560 E568	L560-F564 WeakPolarHBondContact O-CA 3.09Å; L560-F564 WeakPolarHBondContact O-CB 3.37Å; L560-F564 PolarHBondContact O-N 3.21Å; F564-E568 HydrophobicContact CD1-CG 3.9Å; F564-E568 WeakPolarHBondContact CD1-OE2 3.42Å; F564-E568 HydrophobicContact CE1-CG 3.85Å; F564-E568 WeakPolarHBondContact CE1-OE1 3.42Å; F564-E568 WeakPolarHBondContact CE1-OE2 3.32Å; F564-E568 HydrophobicContact CE2-CG 4.5Å; F564-E568 HydrophobicContact CG-CG 4.3Å; F564-E568 HydrophobicContact CZ-CG 4.13Å; F564-E568 WeakPolarHBondContact CZ-OE1 3.37Å; F564-E568 VanDerWaalsContact O-CA 3.25Å; F564-E568 WeakPolarHBondContact O-CA 3.42Å; F564-E568 WeakPolarHBondContact O-CB 3.43Å; F564-E568 WeakPolarHBondContact O-CG 3.25Å; F564-E568 PolarHBondContact O-N 3.2Å
565	T	49.2	Very low	56.4	Low	8 Å²	8	62.6 Å²	62.6	5%	0.049	32%	0.316	C	S	.	.	H	α-helix	trans	-75.6	-20.6	172.7	53.2	0	0	0	0	113.5	Y561 F562 Q569	Y561-T565 WeakPolarHBondContact O-CA 3.36Å; Y561-T565 WeakPolarHBondContact O-CB 3.44Å; Y561-T565 VanDerWaalsContact O-CG2 3.26Å; Y561-T565 WeakPolarHBondContact O-CG2 3.46Å; Y561-T565 PolarHBondContact O-N 3.45Å; Y561-T565 PolarHBondContact O-OG1 3.25Å; F562-T565 VanDerWaalsContact CA-OG1 3.28Å; F562-T565 WeakPolarHBondContact CA-OG1 3.16Å; F562-T565 CarbonylContact O-C 3.51Å; F562-T565 PolarHBondContact O-OG1 2.79Å; T565-Q569 VanDerWaalsContact O-CA 3.26Å; T565-Q569 WeakPolarHBondContact O-CA 3.18Å; T565-Q569 WeakPolarHBondContact O-CB 3.19Å; T565-Q569 WeakPolarHBondContact O-CG 3.39Å; T565-Q569 PolarHBondContact O-N 2.67Å; T565-Q569 PolarHBondContact O-OE1 3.26Å
566	C	44.4	Very low	54.4	Low	50 Å²	50	63.5 Å²	63.5	34%	0.338	32%	0.321	S	S	.	.	H	α-helix	trans	-82.1	-38.2	170.3	-78.8	0	0	0	0	111.4	F562 S563 E570	F562-C566 WeakPolarHBondContact O-CA 3.16Å; F562-C566 WeakPolarHBondContact O-CB 2.95Å; F562-C566 PolarHBondContact O-N 2.84Å; F562-C566 PolarHBondContact O-SG 3.48Å; S563-C566 PolarHBondContact O-N 3.05Å; C566-E570 WeakPolarHBondContact O-CB 3.42Å; C566-E570 VanDerWaalsContact O-CG 3.26Å; C566-E570 WeakPolarHBondContact O-CG 3.37Å; C566-E570 PolarHBondContact O-N 3.5Å
567	I	46.5	Very low	52.5	Low	89 Å²	89	64.4 Å²	64.4	46%	0.456	32%	0.324	S	S	.	.	H	α-helix	trans	-74.5	-40.3	174.7	-66.9	165.2	0	0	0	110.1	S563 R571	S563-I567 WeakPolarHBondContact O-CB 3.43Å; S563-I567 WeakPolarHBondContact O-CD1 2.89Å; S563-I567 WeakPolarHBondContact O-CG1 3.16Å; S563-I567 PolarHBondContact O-N 3.44Å; I567-R571 WeakPolarHBondContact O-CA 3.36Å; I567-R571 WeakPolarHBondContact O-CB 3.25Å; I567-R571 WeakPolarHBondContact O-CG 3.46Å; I567-R571 PolarHBondContact O-N 2.87Å
568	E	41.7	Very low	50.5	Low	76 Å²	76	64.7 Å²	64.7	36%	0.355	33%	0.33	S	S	.	.	H	α-helix	trans	-70.1	-46.2	169.6	-71.7	-169.3	145.2	0	0	109.9	F564 E570 R571 F572	F564-E568 HydrophobicContact CD1-CG 3.9Å; F564-E568 WeakPolarHBondContact CD1-OE2 3.42Å; F564-E568 HydrophobicContact CE1-CG 3.85Å; F564-E568 WeakPolarHBondContact CE1-OE1 3.42Å; F564-E568 WeakPolarHBondContact CE1-OE2 3.32Å; F564-E568 HydrophobicContact CE2-CG 4.5Å; F564-E568 HydrophobicContact CG-CG 4.3Å; F564-E568 HydrophobicContact CZ-CG 4.13Å; F564-E568 WeakPolarHBondContact CZ-OE1 3.37Å; F564-E568 VanDerWaalsContact O-CA 3.25Å; F564-E568 WeakPolarHBondContact O-CA 3.42Å; F564-E568 WeakPolarHBondContact O-CB 3.43Å; F564-E568 WeakPolarHBondContact O-CG 3.25Å; F564-E568 PolarHBondContact O-N 3.2Å; E568-E570 VanDerWaalsContact C-N 3.3Å; E568-E570 PolarHBondContact O-N 3.31Å; E568-R571 CarbonylContact O-C 3.55Å; E568-R571 WeakPolarHBondContact O-CA 3.3Å; E568-R571 PolarHBondContact O-N 2.89Å; E568-F572 WeakPolarHBondContact O-CA 3.37Å; E568-F572 WeakPolarHBondContact O-CB 3.35Å; E568-F572 PolarHBondContact O-N 2.81Å
569	Q	42.9	Very low	48.9	Very low	23 Å²	23	66.9 Å²	66.9	11%	0.107	35%	0.346	C	S	.	.	H	α-helix	trans	-66.5	-27.9	173.3	-71.3	163.7	3	0	0	112.5	Q376 T565 F572 I573	Q376-Q569 VanDerWaalsContact CD-NE2 3.34Å; Q376-Q569 VanDerWaalsContact NE2-NE2 3.17Å; Q376-Q569 VanDerWaalsContact OE1-OE1 3.1Å; T565-Q569 VanDerWaalsContact O-CA 3.26Å; T565-Q569 WeakPolarHBondContact O-CA 3.18Å; T565-Q569 WeakPolarHBondContact O-CB 3.19Å; T565-Q569 WeakPolarHBondContact O-CG 3.39Å; T565-Q569 PolarHBondContact O-N 2.67Å; T565-Q569 PolarHBondContact O-OE1 3.26Å; Q569-F572 CarbonylContact O-C 3.59Å; Q569-I573 HydrophobicContact CB-CD1 4.26Å; Q569-I573 VanDerWaalsContact O-CA 3.24Å; Q569-I573 WeakPolarHBondContact O-CA 3.44Å; Q569-I573 WeakPolarHBondContact O-CB 3.46Å; Q569-I573 WeakPolarHBondContact O-CD1 3.49Å; Q569-I573 WeakPolarHBondContact O-CG1 3.27Å; Q569-I573 PolarHBondContact O-N 3.38Å
570	E	44.1	Very low	47.3	Very low	129 Å²	129	67 Å²	67	60%	0.603	35%	0.349	S	S	*	.	H	α-helix	trans	-73.5	-33.7	168	-79.3	-179.8	168.7	0	0	111	C566 E568 S574	C566-E570 WeakPolarHBondContact O-CB 3.42Å; C566-E570 VanDerWaalsContact O-CG 3.26Å; C566-E570 WeakPolarHBondContact O-CG 3.37Å; C566-E570 PolarHBondContact O-N 3.5Å; E568-E570 VanDerWaalsContact C-N 3.3Å; E568-E570 PolarHBondContact O-N 3.31Å; E570-S574 WeakPolarHBondContact O-CA 3.31Å; E570-S574 WeakPolarHBondContact O-CB 3.38Å; E570-S574 PolarHBondContact O-N 2.83Å; E570-S574 PolarHBondContact O-OG 3.44Å
571	R	41.3	Very low	45.8	Very low	169 Å²	169	66.7 Å²	66.7	64%	0.638	34%	0.344	S	S	*	.	H	α-helix	trans	-80.6	-7.7	170.8	-75.3	177.3	175.2	-180	-1.1	114.6	I567 E568 S574 V575	I567-R571 WeakPolarHBondContact O-CA 3.36Å; I567-R571 WeakPolarHBondContact O-CB 3.25Å; I567-R571 WeakPolarHBondContact O-CG 3.46Å; I567-R571 PolarHBondContact O-N 2.87Å; E568-R571 CarbonylContact O-C 3.55Å; E568-R571 WeakPolarHBondContact O-CA 3.3Å; E568-R571 PolarHBondContact O-N 2.89Å; R571-S574 VanDerWaalsContact CA-OG 3.29Å; R571-S574 WeakPolarHBondContact CA-OG 3.4Å; R571-S574 PolarHBondContact O-OG 3.37Å; R571-V575 VanDerWaalsContact O-CA 3.25Å; R571-V575 WeakPolarHBondContact O-CA 3.44Å; R571-V575 WeakPolarHBondContact O-CB 3.23Å; R571-V575 WeakPolarHBondContact O-CG2 3.26Å; R571-V575 PolarHBondContact O-N 2.94Å
572	F	39.9	Very low	44.6	Very low	63 Å²	63	69.4 Å²	69.4	28%	0.276	36%	0.357	S	S	.	.	H	α-helix	trans	-127	-12.6	-171.5	-164.8	-91	0	0	0	108.2	Y495 E568 Q569 L576	Y495-F572 HydrophobicContact CD2-CE1 4.44Å; E568-F572 WeakPolarHBondContact O-CA 3.37Å; E568-F572 WeakPolarHBondContact O-CB 3.35Å; E568-F572 PolarHBondContact O-N 2.81Å; Q569-F572 CarbonylContact O-C 3.59Å; F572-L576 VanDerWaalsContact C-N 3.33Å; F572-L576 HydrophobicContact CD1-CD1 3.2Å; F572-L576 HydrophobicContact CD2-CD1 4.39Å; F572-L576 HydrophobicContact CE1-CD1 3.02Å; F572-L576 HydrophobicContact CE1-CG 4.48Å; F572-L576 HydrophobicContact CE2-CD1 4.25Å; F572-L576 HydrophobicContact CG-CD1 3.9Å; F572-L576 HydrophobicContact CZ-CD1 3.6Å; F572-L576 VanDerWaalsContact O-CA 3.31Å; F572-L576 WeakPolarHBondContact O-CA 3.39Å; F572-L576 WeakPolarHBondContact O-CB 3.31Å; F572-L576 WeakPolarHBondContact O-CD1 3.39Å; F572-L576 PolarHBondContact O-N 3.2Å
573	I	46.3	Very low	43.9	Very low	56 Å²	56	74.1 Å²	74.1	29%	0.287	38%	0.383	S	S	.	.	H	α-helix	trans	-80.9	-41.4	146.9	-66.8	159.4	0	0	0	106.7	M369 Q569 C577	M369-I573 HydrophobicContact CE-CB 4.48Å; M369-I573 HydrophobicContact CE-CG1 3.71Å; Q569-I573 HydrophobicContact CB-CD1 4.26Å; Q569-I573 VanDerWaalsContact O-CA 3.24Å; Q569-I573 WeakPolarHBondContact O-CA 3.44Å; Q569-I573 WeakPolarHBondContact O-CB 3.46Å; Q569-I573 WeakPolarHBondContact O-CD1 3.49Å; Q569-I573 WeakPolarHBondContact O-CG1 3.27Å; Q569-I573 PolarHBondContact O-N 3.38Å; I573-C577 VanDerWaalsContact O-CA 3.25Å; I573-C577 WeakPolarHBondContact O-CA 3.36Å; I573-C577 WeakPolarHBondContact O-CB 3.44Å; I573-C577 PolarHBondContact O-N 3.24Å; I573-C577 PolarHBondContact O-SG 2.93Å
574	S	39.9	Very low	44.1	Very low	55 Å²	55	75.2 Å²	75.2	39%	0.385	38%	0.381	S	S	.	.	H	α-helix	trans	-69.8	-34.6	168	91.7	0	0	0	0	110.9	E570 R571 V578	E570-S574 WeakPolarHBondContact O-CA 3.31Å; E570-S574 WeakPolarHBondContact O-CB 3.38Å; E570-S574 PolarHBondContact O-N 2.83Å; E570-S574 PolarHBondContact O-OG 3.44Å; R571-S574 VanDerWaalsContact CA-OG 3.29Å; R571-S574 WeakPolarHBondContact CA-OG 3.4Å; R571-S574 PolarHBondContact O-OG 3.37Å; S574-V578 WeakPolarHBondContact O-CA 3.33Å; S574-V578 WeakPolarHBondContact O-CB 3.48Å; S574-V578 WeakPolarHBondContact O-CG2 3.45Å; S574-V578 PolarHBondContact O-N 2.92Å
575	V	39.3	Very low	44.7	Very low	71 Å²	71	70 Å²	70	43%	0.43	36%	0.359	S	S	.	.	H	α-helix	trans	-84.3	-38	175.1	168.6	0	0	0	0	112	R571 V578 S579	R571-V575 VanDerWaalsContact O-CA 3.25Å; R571-V575 WeakPolarHBondContact O-CA 3.44Å; R571-V575 WeakPolarHBondContact O-CB 3.23Å; R571-V575 WeakPolarHBondContact O-CG2 3.26Å; R571-V575 PolarHBondContact O-N 2.94Å; V575-V578 CarbonylContact O-C 3.58Å; V575-V578 PolarHBondContact O-N 3.34Å; V575-S579 WeakPolarHBondContact O-CA 3.46Å; V575-S579 WeakPolarHBondContact O-CB 3.47Å; V575-S579 PolarHBondContact O-N 2.9Å; V575-S579 PolarHBondContact O-OG 2.78Å
576	L	41.1	Very low	45.6	Very low	20 Å²	20	71.8 Å²	71.8	11%	0.105	37%	0.368	C	S	.	.	H	α-helix	trans	-67.4	-39.1	166.3	-99.7	81.4	0	0	0	110.8	L365 M369 F572 V580	L365-L576 HydrophobicContact CD2-CD2 4.36Å; M369-L576 HydrophobicContact CE-CB 4.21Å; M369-L576 HydrophobicContact CE-CD2 4.15Å; M369-L576 HydrophobicContact SD-CD2 4.04Å; F572-L576 VanDerWaalsContact C-N 3.33Å; F572-L576 HydrophobicContact CD1-CD1 3.2Å; F572-L576 HydrophobicContact CD2-CD1 4.39Å; F572-L576 HydrophobicContact CE1-CD1 3.02Å; F572-L576 HydrophobicContact CE1-CG 4.48Å; F572-L576 HydrophobicContact CE2-CD1 4.25Å; F572-L576 HydrophobicContact CG-CD1 3.9Å; F572-L576 HydrophobicContact CZ-CD1 3.6Å; F572-L576 VanDerWaalsContact O-CA 3.31Å; F572-L576 WeakPolarHBondContact O-CA 3.39Å; F572-L576 WeakPolarHBondContact O-CB 3.31Å; F572-L576 WeakPolarHBondContact O-CD1 3.39Å; F572-L576 PolarHBondContact O-N 3.2Å; L576-V580 HydrophobicContact CB-CG2 4.21Å; L576-V580 HydrophobicContact CD2-CG2 4.35Å; L576-V580 HydrophobicContact CG-CG2 4.06Å; L576-V580 VanDerWaalsContact O-CA 3.3Å; L576-V580 WeakPolarHBondContact O-CA 3.42Å; L576-V580 WeakPolarHBondContact O-CB 3.37Å; L576-V580 WeakPolarHBondContact O-CG2 3.46Å; L576-V580 PolarHBondContact O-N 3.01Å
577	C	40.3	Very low	47	Very low	62 Å²	62	71.7 Å²	71.7	42%	0.419	36%	0.363	S	S	.	.	H	α-helix	trans	-62.2	-45.6	170.5	-72.9	0	0	0	0	109.3	I573 Q581	I573-C577 VanDerWaalsContact O-CA 3.25Å; I573-C577 WeakPolarHBondContact O-CA 3.36Å; I573-C577 WeakPolarHBondContact O-CB 3.44Å; I573-C577 PolarHBondContact O-N 3.24Å; I573-C577 PolarHBondContact O-SG 2.93Å; C577-Q581 VanDerWaalsContact C-OE1 3.24Å; C577-Q581 WeakPolarHBondContact O-CA 3.3Å; C577-Q581 WeakPolarHBondContact O-CB 3.48Å; C577-Q581 WeakPolarHBondContact O-CG 3.35Å; C577-Q581 PolarHBondContact O-N 3.47Å; C577-Q581 PolarHBondContact O-OE1 3.45Å
578	V	37.5	Very low	48.6	Very low	84 Å²	84	67.9 Å²	67.9	51%	0.509	34%	0.343	S	S	.	.	H	α-helix	trans	-80.9	-16.8	-177.2	174.6	0	0	0	0	114.2	S574 V575 Q581 K582	S574-V578 WeakPolarHBondContact O-CA 3.33Å; S574-V578 WeakPolarHBondContact O-CB 3.48Å; S574-V578 WeakPolarHBondContact O-CG2 3.45Å; S574-V578 PolarHBondContact O-N 2.92Å; V575-V578 CarbonylContact O-C 3.58Å; V575-V578 PolarHBondContact O-N 3.34Å; V578-Q581 CarbonylContact O-C 3.57Å; V578-K582 PolarHBondContact O-N 2.81Å
579	S	40.8	Very low	50.6	Low	46 Å²	46	64.9 Å²	64.9	32%	0.322	33%	0.331	S	S	.	.	H	α-helix	trans	-105.2	-29.3	-179.2	79.7	0	0	0	0	111.9	V575 Q581 K582	V575-S579 WeakPolarHBondContact O-CA 3.46Å; V575-S579 WeakPolarHBondContact O-CB 3.47Å; V575-S579 PolarHBondContact O-N 2.9Å; V575-S579 PolarHBondContact O-OG 2.78Å; S579-Q581 VanDerWaalsContact C-N 3.34Å; S579-K582 WeakPolarHBondContact O-CB 3.41Å; S579-K582 PolarHBondContact O-N 3.27Å
580	V	41.9	Very low	52.5	Low	26 Å²	26	69.7 Å²	69.7	16%	0.158	35%	0.351	C	S	.	.	H	α-helix	trans	-79.6	-20	157.9	-170.9	0	0	0	0	110.3	W361 L576	W361-V580 HydrophobicContact CH2-CG1 4.39Å; W361-V580 HydrophobicContact CZ3-CG1 4.07Å; L576-V580 HydrophobicContact CB-CG2 4.21Å; L576-V580 HydrophobicContact CD2-CG2 4.35Å; L576-V580 HydrophobicContact CG-CG2 4.06Å; L576-V580 VanDerWaalsContact O-CA 3.3Å; L576-V580 WeakPolarHBondContact O-CA 3.42Å; L576-V580 WeakPolarHBondContact O-CB 3.37Å; L576-V580 WeakPolarHBondContact O-CG2 3.46Å; L576-V580 PolarHBondContact O-N 3.01Å
581	Q	42.8	Very low	54.4	Low	116 Å²	116	68.5 Å²	68.5	54%	0.542	34%	0.341	S	S	.	.	S	Bend	trans	-92.2	19.5	157.5	-63	161.7	-40.4	0	0	112.4	C577 V578 S579 D583	C577-Q581 VanDerWaalsContact C-OE1 3.24Å; C577-Q581 WeakPolarHBondContact O-CA 3.3Å; C577-Q581 WeakPolarHBondContact O-CB 3.48Å; C577-Q581 WeakPolarHBondContact O-CG 3.35Å; C577-Q581 PolarHBondContact O-N 3.47Å; C577-Q581 PolarHBondContact O-OE1 3.45Å; V578-Q581 CarbonylContact O-C 3.57Å; S579-Q581 VanDerWaalsContact C-N 3.34Å; Q581-D583 PolarHBondContact O-N 3.42Å; Q581-D583 VanDerWaalsContact O-N 3.1Å
582	K	43.4	Very low	56.5	Low	137 Å²	137	60.5 Å²	60.5	60%	0.596	31%	0.311	S	S	*	.	S	Bend	trans	-76.8	89.6	140.4	-83.5	-169	173.5	-174.1	0	103.7	V578 S579 E584	V578-K582 PolarHBondContact O-N 2.81Å; S579-K582 WeakPolarHBondContact O-CB 3.41Å; S579-K582 PolarHBondContact O-N 3.27Å; K582-E584 WeakPolarHBondContact O-CB 3.39Å; K582-E584 PolarHBondContact O-N 2.88Å
583	D	52.1	Low	58.7	Low	101 Å²	101	62.7 Å²	62.7	54%	0.54	32%	0.321	S	S	.	.	T	Hydrogen-bonded Turn	trans	11.5	39.7	141	-71	-18.2	0	0	0	118.5	Q581 E587 R591	Q581-D583 PolarHBondContact O-N 3.42Å; Q581-D583 VanDerWaalsContact O-N 3.1Å; D583-E587 HydrophobicContact CB-CG 3.63Å; D583-E587 WeakPolarHBondContact O-CB 3.3Å; D583-E587 WeakPolarHBondContact O-CG 3.19Å; D583-R591 PolarHBondContact O-NH2 2.84Å
584	E	60.3	Low	60.5	Low	79 Å²	79	63 Å²	63	37%	0.369	33%	0.327	S	S	.	.	T	Hydrogen-bonded Turn	trans	-131.4	-58.1	-171.7	-68.2	-177.8	-174.5	0	0	109.7	L484 K582 L588	L484-E584 HydrophobicContact CD1-CB 3.81Å; K582-E584 WeakPolarHBondContact O-CB 3.39Å; K582-E584 PolarHBondContact O-N 2.88Å; E584-L588 WeakPolarHBondContact O-CA 3.43Å; E584-L588 WeakPolarHBondContact O-CB 3.43Å; E584-L588 VanDerWaalsContact O-CG 3.3Å; E584-L588 WeakPolarHBondContact O-CG 2.87Å; E584-L588 PolarHBondContact O-N 3.42Å
585	V	63.4	Low	62.8	Low	9 Å²	9	60.8 Å²	60.8	6%	0.055	31%	0.311	C	S	.	.	T	Hydrogen-bonded Turn	trans	-69.7	-36.2	172.7	-172.9	0	0	0	0	111.8	W361 F456 L484 V488 P589	W361-V585 HydrophobicContact CZ3-CG1 4.38Å; F456-V585 HydrophobicContact CZ-CG1 4.11Å; L484-V585 HydrophobicContact CD1-CG2 3.81Å; L484-V585 HydrophobicContact CD2-CB 4.4Å; L484-V585 HydrophobicContact CD2-CG2 3.88Å; L484-V585 HydrophobicContact CG-CG2 4Å; V488-V585 HydrophobicContact CG2-CG2 3.78Å; V585-P589 WeakPolarHBondContact O-CD 3.32Å
586	L	66.9	Low	65	Low	47 Å²	47	57.7 Å²	57.7	25%	0.246	29%	0.292	C	S	.	.	T	Hydrogen-bonded Turn	trans	-85.8	-23.3	178	-58.9	-171	0	0	0	113.5	T358	T358-L586 HydrophobicContact CG2-CD2 3.81Å
587	E	73.9	Confident	67.1	Low	47 Å²	47	62.2 Å²	62.2	22%	0.22	31%	0.313	C	S	.	.	T	Hydrogen-bonded Turn	trans	-84	-17.6	169.3	-68.3	-64.5	127.6	0	0	112	D583 K590 R591	D583-E587 HydrophobicContact CB-CG 3.63Å; D583-E587 WeakPolarHBondContact O-CB 3.3Å; D583-E587 WeakPolarHBondContact O-CG 3.19Å; E587-K590 CarbonylContact O-C 3.46Å; E587-K590 WeakPolarHBondContact O-CA 3.46Å; E587-K590 WeakPolarHBondContact O-CB 3.35Å; E587-K590 PolarHBondContact O-N 3.23Å; E587-K590 WeakPolarHBondContact OE1-CD 3.44Å; E587-K590 IonicContact OE1-NZ 3.91Å; E587-K590 PolarHBondContact OE1-NZ 3.45Å; E587-K590 WeakPolarHBondContact OE2-CD 3.47Å; E587-K590 IonicContact OE2-NZ 2.88Å; E587-R591 HydrophobicContact CB-CG 4.38Å; E587-R591 WeakPolarHBondContact O-CB 3.49Å; E587-R591 WeakPolarHBondContact O-CG 3.2Å; E587-R591 PolarHBondContact O-N 2.83Å
588	L	80.1	Confident	69.3	Low	9 Å²	9	62.5 Å²	62.5	5%	0.047	31%	0.313	C	S	.	.	H	α-helix	trans	-50.7	-49.7	177.7	-102.3	-165.5	0	0	0	112.2	I481 L484 E584 K590 R591 L592	I481-L588 HydrophobicContact CG1-CD2 4.34Å; L484-L588 HydrophobicContact CD2-CD1 3.11Å; L484-L588 HydrophobicContact CD2-CD2 4.37Å; L484-L588 HydrophobicContact CD2-CG 3.53Å; E584-L588 WeakPolarHBondContact O-CA 3.43Å; E584-L588 WeakPolarHBondContact O-CB 3.43Å; E584-L588 VanDerWaalsContact O-CG 3.3Å; E584-L588 WeakPolarHBondContact O-CG 2.87Å; E584-L588 PolarHBondContact O-N 3.42Å; L588-K590 VanDerWaalsContact C-N 3.29Å; L588-K590 PolarHBondContact O-N 3.47Å; L588-R591 PolarHBondContact O-N 3.39Å; L588-L592 VanDerWaalsContact O-CB 3.31Å; L588-L592 WeakPolarHBondContact O-CB 3.04Å; L588-L592 VanDerWaalsContact O-CG 3.24Å; L588-L592 WeakPolarHBondContact O-CG 3.4Å; L588-L592 PolarHBondContact O-N 3.38Å
589	P	84.1	Confident	71.6	Confident	14 Å²	14	60.7 Å²	60.7	9%	0.091	30%	0.299	C	S	.	.	H	α-helix	trans	-58.3	-38.8	175	-23.6	32.3	0	0	0	113.1	I354 V355 T358 V585 F593	I354-P589 HydrophobicContact CG2-CB 4.23Å; I354-P589 HydrophobicContact CG2-CG 3.98Å; V355-P589 HydrophobicContact CG2-CB 3.88Å; T358-P589 HydrophobicContact CG2-CG 4.3Å; V585-P589 WeakPolarHBondContact O-CD 3.32Å; P589-F593 VanDerWaalsContact O-CB 3.29Å; P589-F593 WeakPolarHBondContact O-CB 3.41Å; P589-F593 PolarHBondContact O-N 3.09Å
590	K	83.6	Confident	73.8	Confident	124 Å²	124	59.8 Å²	59.8	54%	0.539	29%	0.29	S	S	.	.	H	α-helix	trans	-71.1	-41	178.2	-66.2	171.5	178.9	176	0	112.3	E587 L588 F593 S594	E587-K590 CarbonylContact O-C 3.46Å; E587-K590 WeakPolarHBondContact O-CA 3.46Å; E587-K590 WeakPolarHBondContact O-CB 3.35Å; E587-K590 PolarHBondContact O-N 3.23Å; E587-K590 WeakPolarHBondContact OE1-CD 3.44Å; E587-K590 IonicContact OE1-NZ 3.91Å; E587-K590 PolarHBondContact OE1-NZ 3.45Å; E587-K590 WeakPolarHBondContact OE2-CD 3.47Å; E587-K590 IonicContact OE2-NZ 2.88Å; L588-K590 VanDerWaalsContact C-N 3.29Å; L588-K590 PolarHBondContact O-N 3.47Å; K590-F593 PolarHBondContact O-N 2.92Å; K590-S594 PolarHBondContact O-N 3.48Å; K590-S594 PolarHBondContact O-OG 3.22Å
591	R	83.6	Confident	76	Confident	104 Å²	104	64.9 Å²	64.9	39%	0.392	31%	0.31	S	S	.	.	H	α-helix	trans	-63.3	-46.6	174.6	-70	-178.4	-170.9	-177.7	7.2	109.9	L476 D583 E587 L588 F593 S594 F595	L476-R591 HydrophobicContact CD1-CB 4.03Å; D583-R591 PolarHBondContact O-NH2 2.84Å; E587-R591 HydrophobicContact CB-CG 4.38Å; E587-R591 WeakPolarHBondContact O-CB 3.49Å; E587-R591 WeakPolarHBondContact O-CG 3.2Å; E587-R591 PolarHBondContact O-N 2.83Å; L588-R591 PolarHBondContact O-N 3.39Å; R591-F593 PolarHBondContact O-N 3.27Å; R591-S594 PolarHBondContact O-N 2.83Å; R591-S594 PolarHBondContact O-OG 3.18Å; R591-F595 VanDerWaalsContact O-CB 3.27Å; R591-F595 WeakPolarHBondContact O-CB 3.44Å; R591-F595 PolarHBondContact O-N 3.19Å
592	L	84.7	Confident	78.2	Confident	0 Å²	0	64.3 Å²	64.3	0%	0	31%	0.306	C	S	.	.	H	α-helix	trans	-61.4	-41	174.2	-72.8	166.4	0	0	0	112	L351 I354 S460 V464 L476 I481 L588 F595 T596	L351-L592 HydrophobicContact CD2-CB 3.77Å; I354-L592 HydrophobicContact CD1-CD1 4.09Å; S460-L592 WeakPolarHBondContact OG-CD1 3.46Å; V464-L592 HydrophobicContact CG2-CD2 3.78Å; L476-L592 HydrophobicContact CD2-CD2 3.58Å; L476-L592 HydrophobicContact CD2-CG 4.29Å; I481-L592 HydrophobicContact CD1-CD2 4.38Å; L588-L592 VanDerWaalsContact O-CB 3.31Å; L588-L592 WeakPolarHBondContact O-CB 3.04Å; L588-L592 VanDerWaalsContact O-CG 3.24Å; L588-L592 WeakPolarHBondContact O-CG 3.4Å; L588-L592 PolarHBondContact O-N 3.38Å; L592-F595 PolarHBondContact O-N 3.07Å; L592-T596 WeakPolarHBondContact O-CB 3.43Å; L592-T596 VanDerWaalsContact O-CG2 3.31Å; L592-T596 WeakPolarHBondContact O-CG2 3.28Å; L592-T596 PolarHBondContact O-N 3.07Å; L592-T596 PolarHBondContact O-OG1 3.4Å
593	F	86.1	Confident	80.3	Confident	110 Å²	110	58.2 Å²	58.2	48%	0.482	28%	0.28	S	S	.	.	H	α-helix	trans	-61	-51.2	174.3	-177.6	-87.9	0	0	0	111.3	L351 P589 K590 R591 F595 T596 E597	L351-F593 HydrophobicContact CD1-CD2 4.04Å; P589-F593 VanDerWaalsContact O-CB 3.29Å; P589-F593 WeakPolarHBondContact O-CB 3.41Å; P589-F593 PolarHBondContact O-N 3.09Å; K590-F593 PolarHBondContact O-N 2.92Å; R591-F593 PolarHBondContact O-N 3.27Å; F593-F595 VanDerWaalsContact C-N 3.3Å; F593-F595 PolarHBondContact O-N 3.17Å; F593-T596 PolarHBondContact O-N 3.33Å; F593-T596 PolarHBondContact O-OG1 2.86Å; F593-E597 WeakPolarHBondContact CE1-OE2 3.43Å; F593-E597 WeakPolarHBondContact O-CB 3.39Å; F593-E597 PolarHBondContact O-N 2.89Å
594	S	85.4	Confident	82	Confident	61 Å²	61	56.7 Å²	56.7	43%	0.427	27%	0.269	S	S	.	.	H	α-helix	trans	-62	-37.7	178.1	69	0	0	0	0	112.7	K590 R591 T598	K590-S594 PolarHBondContact O-N 3.48Å; K590-S594 PolarHBondContact O-OG 3.22Å; R591-S594 PolarHBondContact O-N 2.83Å; R591-S594 PolarHBondContact O-OG 3.18Å; S594-T598 WeakPolarHBondContact O-CB 3.31Å; S594-T598 WeakPolarHBondContact O-CG2 3.43Å; S594-T598 PolarHBondContact O-N 3.27Å; S594-T598 VanDerWaalsContact O-N 3.07Å; S594-T598 PolarHBondContact O-OG1 2.94Å
595	F	86.6	Confident	83.4	Confident	10 Å²	10	57.3 Å²	57.3	4%	0.044	27%	0.272	C	S	.	.	H	α-helix	trans	-65.2	-51.8	176.4	170.4	-101.4	0	0	0	111.4	V464 H467 T468 L476 R591 L592 F593 E597 T598 E599	V464-F595 HydrophobicContact CG2-CE1 4.36Å; H467-F595 HydrophobicContact CB-CE1 3.8Å; H467-F595 HydrophobicContact CB-CZ 3.82Å; T468-F595 HydrophobicContact CG2-CZ 4.41Å; L476-F595 HydrophobicContact CB-CD2 4.07Å; L476-F595 HydrophobicContact CB-CG 4.27Å; R591-F595 VanDerWaalsContact O-CB 3.27Å; R591-F595 WeakPolarHBondContact O-CB 3.44Å; R591-F595 PolarHBondContact O-N 3.19Å; L592-F595 PolarHBondContact O-N 3.07Å; F593-F595 VanDerWaalsContact C-N 3.3Å; F593-F595 PolarHBondContact O-N 3.17Å; F595-E597 PolarHBondContact O-N 3.36Å; F595-T598 PolarHBondContact O-N 3.02Å; F595-T598 PolarHBondContact O-OG1 2.9Å; F595-E599 HydrophobicContact CD2-CG 4.11Å; F595-E599 HydrophobicContact CE2-CG 3.7Å; F595-E599 HydrophobicContact CZ-CG 3.92Å; F595-E599 WeakPolarHBondContact O-CG 3.29Å; F595-E599 PolarHBondContact O-N 3.36Å
596	T	86	Confident	84.6	Confident	5 Å²	5	58.4 Å²	58.4	3%	0.031	28%	0.277	C	S	.	.	H	α-helix	trans	-64.4	-39.9	179.8	49.9	0	0	0	0	112.5	L351 I463 L592 F593 N600	L351-T596 HydrophobicContact CD1-CG2 4.47Å; L351-T596 WeakPolarHBondContact CD1-OG1 3.32Å; I463-T596 HydrophobicContact CG2-CG2 3.17Å; L592-T596 WeakPolarHBondContact O-CB 3.43Å; L592-T596 VanDerWaalsContact O-CG2 3.31Å; L592-T596 WeakPolarHBondContact O-CG2 3.28Å; L592-T596 PolarHBondContact O-N 3.07Å; L592-T596 PolarHBondContact O-OG1 3.4Å; F593-T596 PolarHBondContact O-N 3.33Å; F593-T596 PolarHBondContact O-OG1 2.86Å; T596-N600 WeakPolarHBondContact O-CB 3.28Å; T596-N600 VanDerWaalsContact O-CG 3.29Å; T596-N600 PolarHBondContact O-N 3.37Å; T596-N600 PolarHBondContact O-ND2 3.21Å
597	E	86.2	Confident	85.8	Confident	115 Å²	115	56.2 Å²	56.2	54%	0.537	27%	0.265	S	S	.	.	H	α-helix	trans	-63.7	-44.7	177.1	-172.7	178.5	-166.1	0	0	111.2	F593 F595 K601	F593-E597 WeakPolarHBondContact CE1-OE2 3.43Å; F593-E597 WeakPolarHBondContact O-CB 3.39Å; F593-E597 PolarHBondContact O-N 2.89Å; F595-E597 PolarHBondContact O-N 3.36Å; E597-K601 VanDerWaalsContact O-CB 3.23Å; E597-K601 WeakPolarHBondContact O-CB 3.46Å; E597-K601 PolarHBondContact O-N 3.39Å
598	T	86.4	Confident	86.5	Confident	68 Å²	68	56.6 Å²	56.6	42%	0.417	27%	0.271	S	S	.	.	H	α-helix	trans	-66.5	-44.7	178.8	54.4	0	0	0	0	112.3	S594 F595 K601 K602	S594-T598 WeakPolarHBondContact O-CB 3.31Å; S594-T598 WeakPolarHBondContact O-CG2 3.43Å; S594-T598 PolarHBondContact O-N 3.27Å; S594-T598 VanDerWaalsContact O-N 3.07Å; S594-T598 PolarHBondContact O-OG1 2.94Å; F595-T598 PolarHBondContact O-N 3.02Å; F595-T598 PolarHBondContact O-OG1 2.9Å; T598-K601 PolarHBondContact O-N 2.92Å; T598-K602 VanDerWaalsContact O-CG 3.26Å; T598-K602 WeakPolarHBondContact O-CG 3.49Å; T598-K602 PolarHBondContact O-N 3.38Å
599	E	85.9	Confident	87	Confident	46 Å²	46	57.8 Å²	57.8	22%	0.215	28%	0.28	C	S	.	.	H	α-helix	trans	-69.4	-41.7	178.8	-67.9	-53.9	135	0	0	112.4	H467 F595 K601 K602 L603	H467-E599 HydrophobicContact CB-CB 4.18Å; H467-E599 HydrophobicContact CB-CG 4.36Å; F595-E599 HydrophobicContact CD2-CG 4.11Å; F595-E599 HydrophobicContact CE2-CG 3.7Å; F595-E599 HydrophobicContact CZ-CG 3.92Å; F595-E599 WeakPolarHBondContact O-CG 3.29Å; F595-E599 PolarHBondContact O-N 3.36Å; E599-K601 VanDerWaalsContact C-N 3.31Å; E599-K601 PolarHBondContact O-N 3.08Å; E599-K602 PolarHBondContact O-N 3.49Å; E599-K602 IonicContact OE1-NZ 3.83Å; E599-K602 PolarHBondContact OE1-NZ 2.98Å; E599-L603 VanDerWaalsContact O-CB 3.26Å; E599-L603 WeakPolarHBondContact O-CB 3.48Å; E599-L603 PolarHBondContact O-N 3.48Å
600	N	87.2	Confident	87.2	Confident	28 Å²	28	57.2 Å²	57.2	15%	0.15	28%	0.276	C	S	.	.	H	α-helix	trans	-61.3	-40.4	174.4	-81.2	-44.6	0	0	0	111.7	D347 H467 T596 L603 Q604	D347-N600 PolarHBondContact OD2-ND2 3.27Å; H467-N600 PolarHBondContact CE1-OD1 3Å; T596-N600 WeakPolarHBondContact O-CB 3.28Å; T596-N600 VanDerWaalsContact O-CG 3.29Å; T596-N600 PolarHBondContact O-N 3.37Å; T596-N600 PolarHBondContact O-ND2 3.21Å; N600-L603 PolarHBondContact O-N 2.95Å; N600-Q604 WeakPolarHBondContact O-CB 3.38Å; N600-Q604 PolarHBondContact O-N 3.34Å
601	K	87.9	Confident	87.5	Confident	132 Å²	132	53.6 Å²	53.6	57%	0.574	26%	0.261	S	S	*	.	H	α-helix	trans	-65	-48.1	175.9	-177	176.7	172.7	-178	0	111.9	E597 T598 E599 L603 Q604 E605	E597-K601 VanDerWaalsContact O-CB 3.23Å; E597-K601 WeakPolarHBondContact O-CB 3.46Å; E597-K601 PolarHBondContact O-N 3.39Å; T598-K601 PolarHBondContact O-N 2.92Å; E599-K601 VanDerWaalsContact C-N 3.31Å; E599-K601 PolarHBondContact O-N 3.08Å; K601-L603 VanDerWaalsContact C-N 3.3Å; K601-L603 PolarHBondContact O-N 3.41Å; K601-Q604 PolarHBondContact O-N 2.96Å; K601-E605 WeakPolarHBondContact CE-OE1 3.49Å; K601-E605 WeakPolarHBondContact O-CB 3.49Å; K601-E605 WeakPolarHBondContact O-CG 3.5Å; K601-E605 PolarHBondContact O-N 3.41Å
602	K	87.9	Confident	87.7	Confident	105 Å²	105	55.2 Å²	55.2	46%	0.457	27%	0.271	S	S	.	.	H	α-helix	trans	-57.1	-44.3	176.2	-74	172	-170.7	171.2	0	111.7	T598 E599 E605 E606	T598-K602 VanDerWaalsContact O-CG 3.26Å; T598-K602 WeakPolarHBondContact O-CG 3.49Å; T598-K602 PolarHBondContact O-N 3.38Å; E599-K602 PolarHBondContact O-N 3.49Å; E599-K602 IonicContact OE1-NZ 3.83Å; E599-K602 PolarHBondContact OE1-NZ 2.98Å; K602-E605 PolarHBondContact O-N 2.88Å; K602-E606 WeakPolarHBondContact O-CB 3.45Å; K602-E606 PolarHBondContact O-N 3.38Å
603	L	87.2	Confident	87.7	Confident	9 Å²	9	55.9 Å²	55.9	5%	0.047	28%	0.277	C	S	.	.	H	α-helix	trans	-64.9	-41.8	-180	-176.7	62.4	0	0	0	111.9	L340 E599 N600 K601 E606 V607 Y664 F667	L340-L603 HydrophobicContact CD1-CG 4.38Å; L340-L603 HydrophobicContact CD2-CD1 4.35Å; L340-L603 HydrophobicContact CD2-CD2 3.2Å; L340-L603 HydrophobicContact CD2-CG 3.46Å; L340-L603 VanDerWaalsContact CD2-CG 3.46Å; E599-L603 VanDerWaalsContact O-CB 3.26Å; E599-L603 WeakPolarHBondContact O-CB 3.48Å; E599-L603 PolarHBondContact O-N 3.48Å; N600-L603 PolarHBondContact O-N 2.95Å; K601-L603 VanDerWaalsContact C-N 3.3Å; K601-L603 PolarHBondContact O-N 3.41Å; L603-E606 PolarHBondContact O-N 2.94Å; L603-V607 WeakPolarHBondContact O-CG2 3.28Å; L603-V607 PolarHBondContact O-N 3.36Å; L603-Y664 HydrophobicContact CD1-CD1 3.8Å; L603-Y664 HydrophobicContact CD1-CE1 4.11Å; L603-F667 HydrophobicContact CD1-CD1 3.58Å; L603-F667 HydrophobicContact CD1-CE1 3.63Å; L603-F667 HydrophobicContact CD2-CD1 4.18Å; L603-F667 HydrophobicContact CD2-CE1 3.66Å; L603-F667 HydrophobicContact CG-CE1 4.23Å
604	Q	89.4	Confident	87.7	Confident	68 Å²	68	50.6 Å²	50.6	32%	0.318	26%	0.255	S	S	.	.	H	α-helix	trans	-62.6	-45.5	173.8	-175.7	68.8	18.1	0	0	111.5	L340 N600 K601 V607 T608	L340-Q604 HydrophobicContact CD1-CB 4.49Å; N600-Q604 WeakPolarHBondContact O-CB 3.38Å; N600-Q604 PolarHBondContact O-N 3.34Å; K601-Q604 PolarHBondContact O-N 2.96Å; Q604-V607 PolarHBondContact O-N 2.95Å; Q604-T608 VanDerWaalsContact O-CG2 3.31Å; Q604-T608 WeakPolarHBondContact O-CG2 3.33Å; Q604-T608 PolarHBondContact O-N 2.99Å; Q604-T608 PolarHBondContact O-OG1 3.34Å
605	E	89.3	Confident	87.7	Confident	92 Å²	92	49.3 Å²	49.3	43%	0.43	24%	0.244	S	C	.	.	H	α-helix	trans	-60.4	-45.4	177.2	-74.6	170.5	177.2	0	0	111.3	K601 K602 V607 T608 C609	K601-E605 WeakPolarHBondContact CE-OE1 3.49Å; K601-E605 WeakPolarHBondContact O-CB 3.49Å; K601-E605 WeakPolarHBondContact O-CG 3.5Å; K601-E605 PolarHBondContact O-N 3.41Å; K602-E605 PolarHBondContact O-N 2.88Å; E605-V607 PolarHBondContact O-N 3.49Å; E605-T608 PolarHBondContact O-N 3.24Å; E605-T608 PolarHBondContact O-OG1 2.92Å; E605-C609 VanDerWaalsContact O-CB 3.25Å; E605-C609 WeakPolarHBondContact O-CB 3.37Å; E605-C609 PolarHBondContact O-N 3.37Å
606	E	89.1	Confident	87.5	Confident	33 Å²	33	52.5 Å²	52.5	15%	0.154	26%	0.262	C	S	.	.	H	α-helix	trans	-68.5	-36.4	179.4	-76.7	-79.7	147.9	0	0	113.2	K602 L603 C609 L610 K660 Y664	K602-E606 WeakPolarHBondContact O-CB 3.45Å; K602-E606 PolarHBondContact O-N 3.38Å; L603-E606 PolarHBondContact O-N 2.94Å; E606-C609 PolarHBondContact O-N 2.97Å; E606-L610 WeakPolarHBondContact O-CB 3.26Å; E606-L610 PolarHBondContact O-N 3.28Å; E606-K660 IonicContact OE1-NZ 2.72Å; E606-K660 IonicContact OE2-NZ 2.63Å; E606-K660 PolarHBondContact OE2-NZ 3.38Å; E606-Y664 HydrophobicContact CB-CE1 3.96Å; E606-Y664 HydrophobicContact CB-CE2 3.92Å; E606-Y664 VanDerWaalsContact CB-CZ 3.48Å; E606-Y664 WeakPolarHBondContact CB-OH 3.44Å; E606-Y664 HydrophobicContact CG-CE1 4.48Å; E606-Y664 HydrophobicContact CG-CE2 4.44Å; E606-Y664 WeakPolarHBondContact CG-OH 3.48Å; E606-Y664 WeakPolarHBondContact OE2-CE2 3.31Å; E606-Y664 PolarHBondContact OE2-OH 3.18Å
607	V	90.4	Very high	87.5	Confident	0 Å²	0	52.6 Å²	52.6	0%	0	26%	0.261	C	S	.	.	H	α-helix	trans	-67	-40.4	173.7	169.4	0	0	0	0	111.5	W332 F333 A336 L340 L603 Q604 E605 L610 H611 I668	W332-V607 HydrophobicContact CH2-CG1 4.23Å; W332-V607 HydrophobicContact CH2-CG2 4.31Å; W332-V607 HydrophobicContact CZ3-CG1 4.18Å; F333-V607 HydrophobicContact CD2-CG1 3.9Å; F333-V607 HydrophobicContact CE2-CG1 4.04Å; A336-V607 HydrophobicContact CB-CG1 3.95Å; L340-V607 HydrophobicContact CD1-CB 4Å; L340-V607 HydrophobicContact CD1-CG1 4.3Å; L340-V607 HydrophobicContact CD1-CG2 3.87Å; L603-V607 WeakPolarHBondContact O-CG2 3.28Å; L603-V607 PolarHBondContact O-N 3.36Å; Q604-V607 PolarHBondContact O-N 2.95Å; E605-V607 PolarHBondContact O-N 3.49Å; V607-L610 PolarHBondContact O-N 2.88Å; V607-H611 PolarHBondContact O-N 3.48Å; V607-I668 HydrophobicContact CG2-CD1 3.95Å
608	T	89.5	Confident	87.4	Confident	56 Å²	56	47.7 Å²	47.7	34%	0.344	24%	0.239	S	C	.	.	H	α-helix	trans	-68.8	-35.2	174.6	61	0	0	0	0	112.4	F333 Q604 E605 H611 K612	F333-T608 HydrophobicContact CE2-CG2 4.26Å; F333-T608 HydrophobicContact CZ-CG2 4.41Å; Q604-T608 VanDerWaalsContact O-CG2 3.31Å; Q604-T608 WeakPolarHBondContact O-CG2 3.33Å; Q604-T608 PolarHBondContact O-N 2.99Å; Q604-T608 PolarHBondContact O-OG1 3.34Å; E605-T608 PolarHBondContact O-N 3.24Å; E605-T608 PolarHBondContact O-OG1 2.92Å; T608-H611 PolarHBondContact O-N 3.32Å; T608-K612 WeakPolarHBondContact O-CB 3.49Å; T608-K612 PolarHBondContact O-N 3.5Å
609	C	89.4	Confident	87.1	Confident	34 Å²	34	47.9 Å²	47.9	23%	0.23	24%	0.236	C	C	.	.	H	α-helix	trans	-64.6	-41.4	173.7	-168.8	0	0	0	0	111.4	E605 E606 K612 G613	E605-C609 VanDerWaalsContact O-CB 3.25Å; E605-C609 WeakPolarHBondContact O-CB 3.37Å; E605-C609 PolarHBondContact O-N 3.37Å; E606-C609 PolarHBondContact O-N 2.97Å; C609-K612 PolarHBondContact O-N 3.4Å; C609-G613 PolarHBondContact O-N 3.32Å
610	L	88.9	Confident	86.7	Confident	1 Å²	1	49.7 Å²	49.7	1%	0.005	25%	0.248	C	C	.	.	H	α-helix	trans	-60.3	-50.7	173	-88.2	177.5	0	0	0	111.9	W332 E606 V607 K612 G613 Q614 L657 K660 Y664	W332-L610 HydrophobicContact CH2-CB 4.46Å; W332-L610 HydrophobicContact CH2-CD1 3.75Å; W332-L610 HydrophobicContact CZ3-CB 4.33Å; W332-L610 HydrophobicContact CZ3-CD1 4.38Å; E606-L610 WeakPolarHBondContact O-CB 3.26Å; E606-L610 PolarHBondContact O-N 3.28Å; V607-L610 PolarHBondContact O-N 2.88Å; L610-K612 VanDerWaalsContact C-N 3.33Å; L610-K612 PolarHBondContact O-N 3.21Å; L610-G613 PolarHBondContact O-N 2.83Å; L610-G613 VanDerWaalsContact O-N 3.14Å; L610-Q614 WeakPolarHBondContact O-CB 3.31Å; L610-Q614 VanDerWaalsContact O-CG 3.26Å; L610-Q614 WeakPolarHBondContact O-CG 3.33Å; L610-Q614 PolarHBondContact O-N 3.23Å; L610-L657 HydrophobicContact CD2-CD2 3.95Å; L610-K660 HydrophobicContact CD1-CB 4.19Å; L610-K660 HydrophobicContact CD2-CB 3.38Å; L610-K660 HydrophobicContact CD2-CD 4.18Å; L610-K660 HydrophobicContact CD2-CG 4.36Å; L610-K660 HydrophobicContact CG-CB 4.14Å; L610-Y664 HydrophobicContact CD1-CD2 3.53Å; L610-Y664 HydrophobicContact CD1-CE2 4.27Å; L610-Y664 HydrophobicContact CD1-CG 4.24Å; L610-Y664 HydrophobicContact CG-CD2 4.48Å
611	H	90.2	Very high	86.4	Confident	48 Å²	48	48.4 Å²	48.4	22%	0.222	24%	0.241	C	C	.	.	H	α-helix	trans	-54	-48.8	176.5	170.5	65.3	0	0	0	111.9	E329 F333 V607 T608 G613 Q614 T615	E329-H611 IonicContact OE1-CE1 2.64Å; E329-H611 IonicContact OE1-CG 3.78Å; E329-H611 IonicContact OE1-ND1 3.72Å; E329-H611 PolarHBondContact OE1-ND1 3.26Å; E329-H611 IonicContact OE2-CE1 2.83Å; E329-H611 IonicContact OE2-ND1 3.17Å; F333-H611 HydrophobicContact CD1-CB 4.49Å; F333-H611 AromaticContact CD1-CG 3.94Å; F333-H611 AromaticContact CD1-ND1 3.75Å; F333-H611 HydrophobicContact CD2-CB 3.46Å; F333-H611 VanDerWaalsContact CD2-CB 3.46Å; F333-H611 AromaticContact CD2-CG 3.81Å; F333-H611 AromaticContact CE1-CD2 3.96Å; F333-H611 HydrophobicContact CE2-CB 3.58Å; F333-H611 AromaticContact CE2-CG 3.87Å; F333-H611 HydrophobicContact CG-CB 3.92Å; F333-H611 AromaticContact CG-CG 3.81Å; F333-H611 AromaticContact CG-ND1 3.71Å; F333-H611 HydrophobicContact CZ-CB 4.14Å; F333-H611 AromaticContact CZ-CD2 3.91Å; F333-H611 AromaticContact CZ-CG 3.93Å; V607-H611 PolarHBondContact O-N 3.48Å; T608-H611 PolarHBondContact O-N 3.32Å; H611-G613 PolarHBondContact O-N 2.98Å; H611-Q614 PolarHBondContact O-N 3.42Å; H611-T615 VanDerWaalsContact O-CB 3.3Å; H611-T615 WeakPolarHBondContact O-CB 3.34Å; H611-T615 PolarHBondContact O-N 3.26Å; H611-T615 PolarHBondContact O-OG1 3.05Å
612	K	87.4	Confident	85.8	Confident	138 Å²	138	42.8 Å²	42.8	60%	0.6	22%	0.217	S	C	*	.	H	α-helix	trans	-62.7	-43.2	177.3	-173.6	177.7	179.3	-177.5	0	112	T608 C609 L610 T615 N616	T608-K612 WeakPolarHBondContact O-CB 3.49Å; T608-K612 PolarHBondContact O-N 3.5Å; C609-K612 PolarHBondContact O-N 3.4Å; L610-K612 VanDerWaalsContact C-N 3.33Å; L610-K612 PolarHBondContact O-N 3.21Å; K612-T615 PolarHBondContact O-N 3.14Å; K612-N616 WeakPolarHBondContact O-CB 3.36Å; K612-N616 VanDerWaalsContact O-CG 3.25Å; K612-N616 PolarHBondContact O-N 2.94Å
613	G	85.3	Confident	85.2	Confident	14 Å²	14	43.8 Å²	43.8	14%	0.144	23%	0.227	C	C	.	.	H	α-helix	trans	-64.2	-44.9	178.3	0	0	0	0	0	112.8	C609 L610 H611 W617	C609-G613 PolarHBondContact O-N 3.32Å; L610-G613 PolarHBondContact O-N 2.83Å; L610-G613 VanDerWaalsContact O-N 3.14Å; H611-G613 PolarHBondContact O-N 2.98Å; G613-W617 VanDerWaalsContact O-CB 3.24Å; G613-W617 WeakPolarHBondContact O-CB 3.46Å; G613-W617 PolarHBondContact O-N 2.88Å
614	Q	86.6	Confident	84.5	Confident	0 Å²	0	45.1 Å²	45.1	0%	0	23%	0.233	C	C	.	.	H	α-helix	trans	-64.3	-41.3	175.5	-67	176.4	-62.1	0	0	111.1	E329 L610 H611 W617 M618 L657 W706	E329-Q614 HydrophobicContact CG-CB 3.66Å; E329-Q614 HydrophobicContact CG-CG 4.42Å; L610-Q614 WeakPolarHBondContact O-CB 3.31Å; L610-Q614 VanDerWaalsContact O-CG 3.26Å; L610-Q614 WeakPolarHBondContact O-CG 3.33Å; L610-Q614 PolarHBondContact O-N 3.23Å; H611-Q614 PolarHBondContact O-N 3.42Å; Q614-W617 PolarHBondContact O-N 2.95Å; Q614-M618 VanDerWaalsContact O-CG 3.27Å; Q614-M618 WeakPolarHBondContact O-CG 3.27Å; Q614-M618 PolarHBondContact O-N 3.05Å; Q614-L657 HydrophobicContact CG-CD1 4.46Å; Q614-L657 HydrophobicContact CG-CD2 4.4Å; Q614-W706 HydrophobicContact CB-CZ2 4.07Å; Q614-W706 HydrophobicContact CG-CH2 4.15Å; Q614-W706 HydrophobicContact CG-CZ2 3.6Å; Q614-W706 VanDerWaalsContact NE2-CE2 3.26Å
615	T	84.4	Confident	83.4	Confident	33 Å²	33	44.8 Å²	44.8	20%	0.202	23%	0.232	C	C	.	.	H	α-helix	trans	-64.7	-47	176.9	-59.2	0	0	0	0	112.5	H611 K612 W617 M618 L619	H611-T615 VanDerWaalsContact O-CB 3.3Å; H611-T615 WeakPolarHBondContact O-CB 3.34Å; H611-T615 PolarHBondContact O-N 3.26Å; H611-T615 PolarHBondContact O-OG1 3.05Å; K612-T615 PolarHBondContact O-N 3.14Å; T615-W617 PolarHBondContact O-N 3.5Å; T615-M618 WeakPolarHBondContact O-CB 3.5Å; T615-M618 PolarHBondContact O-N 3.23Å; T615-L619 HydrophobicContact CG2-CD1 4.48Å; T615-L619 WeakPolarHBondContact O-CG 3.34Å; T615-L619 PolarHBondContact O-N 2.84Å
616	N	82.9	Confident	82.4	Confident	78 Å²	78	42.9 Å²	42.9	42%	0.417	22%	0.224	S	C	.	.	H	α-helix	trans	-62.3	-44.6	176.6	-73.3	-12.3	0	0	0	111.4	K612 M618 L619 D620	K612-N616 WeakPolarHBondContact O-CB 3.36Å; K612-N616 VanDerWaalsContact O-CG 3.25Å; K612-N616 PolarHBondContact O-N 2.94Å; N616-M618 VanDerWaalsContact C-N 3.29Å; N616-M618 PolarHBondContact O-N 3.39Å; N616-L619 WeakPolarHBondContact O-CB 3.37Å; N616-L619 PolarHBondContact O-N 3.33Å; N616-L619 VanDerWaalsContact O-N 3.1Å; N616-D620 PolarHBondContact O-N 2.6Å
617	W	86.6	Confident	81	Confident	7 Å²	7	46 Å²	46	3%	0.027	25%	0.247	C	C	.	.	H	α-helix	trans	-59.9	-39	176.3	-177.7	87.7	0	0	0	112.4	L325 G613 Q614 T615 D620 L621 L650 A654 L657 W706 V710 L714	L325-W617 HydrophobicContact CD1-CH2 4.37Å; L325-W617 HydrophobicContact CD1-CZ3 3.81Å; L325-W617 HydrophobicContact CD2-CZ3 4.12Å; G613-W617 VanDerWaalsContact O-CB 3.24Å; G613-W617 WeakPolarHBondContact O-CB 3.46Å; G613-W617 PolarHBondContact O-N 2.88Å; Q614-W617 PolarHBondContact O-N 2.95Å; T615-W617 PolarHBondContact O-N 3.5Å; W617-D620 PolarHBondContact O-N 3.31Å; W617-L621 HydrophobicContact CH2-CD2 3.9Å; W617-L621 HydrophobicContact CZ3-CD2 3.94Å; W617-L621 VanDerWaalsContact O-CB 3.32Å; W617-L621 WeakPolarHBondContact O-CB 3.43Å; W617-L621 PolarHBondContact O-N 2.72Å; W617-L650 HydrophobicContact CZ2-CD2 3.85Å; W617-L650 PolarHBondContact NE1-O 3.32Å; W617-A654 HydrophobicContact CZ2-CB 3.79Å; W617-L657 HydrophobicContact CB-CD1 3.82Å; W617-L657 HydrophobicContact CG-CD1 4.11Å; W617-W706 HydrophobicContact CE3-CZ2 4.47Å; W617-V710 HydrophobicContact CH2-CB 4.36Å; W617-V710 HydrophobicContact CH2-CG1 4.04Å; W617-V710 HydrophobicContact CH2-CG2 3.83Å; W617-V710 HydrophobicContact CZ2-CG1 4.22Å; W617-V710 HydrophobicContact CZ3-CG2 3.9Å; W617-L714 HydrophobicContact CZ2-CD2 4.29Å
618	M	83.5	Confident	79.3	Confident	12 Å²	12	51.9 Å²	51.9	6%	0.059	28%	0.279	C	S	.	.	H	α-helix	trans	-62.7	-41.1	173.6	-77.7	-171.6	-71.6	0	0	112.7	L325 Y326 E329 Q614 T615 N616 L621 L622	L325-M618 HydrophobicContact CD2-CG 3.34Å; L325-M618 HydrophobicContact CD2-SD 3.3Å; L325-M618 WeakPolarHBondContact CD2-SD 3.48Å; Y326-M618 HydrophobicContact CD2-CE 4.35Å; E329-M618 HydrophobicContact CB-CE 4.11Å; E329-M618 HydrophobicContact CG-CE 3.82Å; Q614-M618 VanDerWaalsContact O-CG 3.27Å; Q614-M618 WeakPolarHBondContact O-CG 3.27Å; Q614-M618 PolarHBondContact O-N 3.05Å; T615-M618 WeakPolarHBondContact O-CB 3.5Å; T615-M618 PolarHBondContact O-N 3.23Å; N616-M618 VanDerWaalsContact C-N 3.29Å; N616-M618 PolarHBondContact O-N 3.39Å; M618-L621 PolarHBondContact O-N 2.93Å; M618-L622 WeakPolarHBondContact O-CG 3.5Å; M618-L622 PolarHBondContact O-N 3.22Å
619	L	79.3	Confident	77.3	Confident	71 Å²	71	58 Å²	58	37%	0.372	30%	0.303	S	S	.	.	H	α-helix	trans	-67	-43.6	177.9	-68.8	170.9	0	0	0	111.4	A310 T615 N616 L621 L622 L623	A310-L619 HydrophobicContact CB-CD2 4.32Å; T615-L619 HydrophobicContact CG2-CD1 4.48Å; T615-L619 WeakPolarHBondContact O-CG 3.34Å; T615-L619 PolarHBondContact O-N 2.84Å; N616-L619 WeakPolarHBondContact O-CB 3.37Å; N616-L619 PolarHBondContact O-N 3.33Å; N616-L619 VanDerWaalsContact O-N 3.1Å; L619-L621 VanDerWaalsContact C-N 3.32Å; L619-L621 PolarHBondContact O-N 2.82Å; L619-L622 WeakPolarHBondContact O-CB 3.45Å; L619-L622 PolarHBondContact O-N 3.28Å; L619-L623 WeakPolarHBondContact O-CG 3.47Å; L619-L623 PolarHBondContact O-N 3.32Å
620	D	78.8	Confident	75	Confident	85 Å²	85	62.3 Å²	62.3	46%	0.455	33%	0.329	S	S	.	.	H	α-helix	trans	-64	-38.7	176.2	-68.1	-27.2	0	0	0	111.6	N616 W617 L623 H624 L650	N616-D620 PolarHBondContact O-N 2.6Å; W617-D620 PolarHBondContact O-N 3.31Å; D620-L623 PolarHBondContact O-N 3.29Å; D620-H624 PolarHBondContact O-N 3.43Å; D620-H624 VanDerWaalsContact O-N 3.1Å; D620-L650 HydrophobicContact CB-CD1 3.81Å
621	L	79.6	Confident	72.8	Confident	0 Å²	0	70.5 Å²	70.5	0%	0	37%	0.367	C	S	.	.	H	α-helix	trans	-63.5	-42.1	173.4	179.7	71.2	0	0	0	111.6	V322 W617 M618 L619 L623 H624 M625 L650 L713 L717	V322-L621 HydrophobicContact CG2-CD2 4.43Å; W617-L621 HydrophobicContact CH2-CD2 3.9Å; W617-L621 HydrophobicContact CZ3-CD2 3.94Å; W617-L621 VanDerWaalsContact O-CB 3.32Å; W617-L621 WeakPolarHBondContact O-CB 3.43Å; W617-L621 PolarHBondContact O-N 2.72Å; M618-L621 PolarHBondContact O-N 2.93Å; L619-L621 VanDerWaalsContact C-N 3.32Å; L619-L621 PolarHBondContact O-N 2.82Å; L621-L623 VanDerWaalsContact C-N 3.35Å; L621-H624 PolarHBondContact O-N 2.8Å; L621-M625 HydrophobicContact CD1-CG 4.07Å; L621-M625 HydrophobicContact CD1-SD 4.44Å; L621-M625 HydrophobicContact CD2-CE 4.44Å; L621-M625 HydrophobicContact CG-CE 4.39Å; L621-M625 HydrophobicContact CG-CG 4.23Å; L621-M625 WeakPolarHBondContact O-CB 3.41Å; L621-M625 WeakPolarHBondContact O-CG 3.3Å; L621-M625 PolarHBondContact O-N 2.95Å; L621-L650 HydrophobicContact CB-CD1 4.34Å; L621-L650 HydrophobicContact CD1-CD2 3.93Å; L621-L713 HydrophobicContact CD2-CD1 3.89Å; L621-L717 HydrophobicContact CD1-CD1 3.73Å
622	L	76.3	Confident	70.7	Confident	14 Å²	14	78 Å²	78	7%	0.073	40%	0.403	C	S	.	.	H	α-helix	trans	-62.6	-41.7	177.5	-79.9	170.1	0	0	0	112.1	A310 I314 L319 V322 M618 L619 H624 M625 L626	A310-L622 HydrophobicContact CB-CD1 4.25Å; I314-L622 HydrophobicContact CD1-CD1 4.01Å; I314-L622 HydrophobicContact CD1-CD2 4.35Å; I314-L622 HydrophobicContact CG1-CD1 4.23Å; I314-L622 HydrophobicContact CG1-CD2 3.76Å; L319-L622 HydrophobicContact CD1-CD2 3.71Å; V322-L622 HydrophobicContact CB-CD2 4.48Å; V322-L622 HydrophobicContact CG1-CD1 4.39Å; V322-L622 HydrophobicContact CG1-CD2 3.85Å; V322-L622 HydrophobicContact CG1-CG 4.09Å; V322-L622 HydrophobicContact CG2-CD2 4.4Å; M618-L622 WeakPolarHBondContact O-CG 3.5Å; M618-L622 PolarHBondContact O-N 3.22Å; L619-L622 WeakPolarHBondContact O-CB 3.45Å; L619-L622 PolarHBondContact O-N 3.28Å; L622-H624 VanDerWaalsContact C-N 3.26Å; L622-H624 PolarHBondContact O-N 3.1Å; L622-M625 PolarHBondContact O-N 3.49Å; L622-L626 WeakPolarHBondContact O-CD1 3.35Å; L622-L626 WeakPolarHBondContact O-CG 3.34Å; L622-L626 PolarHBondContact O-N 3.39Å
623	L	75.4	Confident	68.7	Low	126 Å²	126	74.5 Å²	74.5	66%	0.66	41%	0.405	S	S	*	.	H	α-helix	trans	-60.7	-38.5	174.6	-70.2	173.6	0	0	0	111.4	L619 D620 L621	L619-L623 WeakPolarHBondContact O-CG 3.47Å; L619-L623 PolarHBondContact O-N 3.32Å; D620-L623 PolarHBondContact O-N 3.29Å; L621-L623 VanDerWaalsContact C-N 3.35Å
624	H	71.8	Confident	66.6	Low	38 Å²	38	79.5 Å²	79.5	18%	0.176	43%	0.429	C	S	.	.	H	α-helix	trans	-77.4	-29.1	-179.7	-169.3	70	0	0	0	114.2	D620 L621 L622 R647	D620-H624 PolarHBondContact O-N 3.43Å; D620-H624 VanDerWaalsContact O-N 3.1Å; L621-H624 PolarHBondContact O-N 2.8Å; L622-H624 VanDerWaalsContact C-N 3.26Å; L622-H624 PolarHBondContact O-N 3.1Å; H624-R647 PolarHBondContact CE1-NE 3.34Å; H624-R647 PolarHBondContact NE2-NE 3.28Å
625	M	67.6	Low	64.7	Low	60 Å²	60	88.9 Å²	88.9	30%	0.296	47%	0.469	S	S	.	.	H	α-helix	trans	-85.9	-11.4	179.6	-70.1	-143.8	-59.3	0	0	114.3	L319 V322 L621 L622 L713	L319-M625 HydrophobicContact CD1-CE 4.4Å; L319-M625 HydrophobicContact CD2-CE 4.17Å; V322-M625 HydrophobicContact CG2-CE 3.24Å; L621-M625 HydrophobicContact CD1-CG 4.07Å; L621-M625 HydrophobicContact CD1-SD 4.44Å; L621-M625 HydrophobicContact CD2-CE 4.44Å; L621-M625 HydrophobicContact CG-CE 4.39Å; L621-M625 HydrophobicContact CG-CG 4.23Å; L621-M625 WeakPolarHBondContact O-CB 3.41Å; L621-M625 WeakPolarHBondContact O-CG 3.3Å; L621-M625 PolarHBondContact O-N 2.95Å; L622-M625 PolarHBondContact O-N 3.49Å; M625-L713 HydrophobicContact CE-CD2 4.16Å; M625-L713 HydrophobicContact SD-CD2 4.12Å
626	L	66.7	Low	63	Low	52 Å²	52	97.5 Å²	97.5	27%	0.272	50%	0.5	S	S	.	.	S	Bend	trans	-87.6	125.6	175.1	-70	164.7	0	0	0	109.4	V313 K317 L622 D628	V313-L626 HydrophobicContact CG1-CD1 3.78Å; V313-L626 HydrophobicContact CG1-CD2 3.58Å; V313-L626 HydrophobicContact CG1-CG 4.26Å; K317-L626 HydrophobicContact CG-CD2 4Å; L622-L626 WeakPolarHBondContact O-CD1 3.35Å; L622-L626 WeakPolarHBondContact O-CG 3.34Å; L622-L626 PolarHBondContact O-N 3.39Å; L626-D628 PolarHBondContact O-N 3.19Å
627	P	59.5	Low	61.1	Low	99 Å²	99	100.2 Å²	100.2	64%	0.643	51%	0.514	S	S	*	.	P	Polyproline II helix	trans	-67.1	126.5	171.4	26.4	-31	0	0	0	109	Q629	P627-Q629 PolarHBondContact O-N 2.93Å
628	D	55.3	Low	59.1	Low	123 Å²	123	108.1 Å²	108.1	66%	0.658	55%	0.548	S	S	*	.	P	Polyproline II helix	trans	-54.5	125.7	168.4	-72.7	-27.5	0	0	0	108.3	L626 T630	L626-D628 PolarHBondContact O-N 3.19Å; D628-T630 PolarHBondContact O-N 2.57Å
629	Q	48.2	Very low	57.4	Low	184 Å²	184	114 Å²	114	86%	0.86	57%	0.57	S	S	*	*			trans	-68	103.5	166.7	-67.3	-135.4	11.3	0	0	106.7	P627 E631	P627-Q629 PolarHBondContact O-N 2.93Å; Q629-E631 VanDerWaalsContact C-N 3.26Å; Q629-E631 PolarHBondContact O-N 3.38Å
630	T	40.3	Very low	55.9	Low	125 Å²	125	118.8 Å²	118.8	77%	0.767	59%	0.59	S	S	*	*			trans	-67.9	90.6	170.9	51.6	0	0	0	0	107.8	D628 E632	D628-T630 PolarHBondContact O-N 2.57Å; T630-E632 PolarHBondContact O-N 2.64Å
631	E	42.7	Very low	54.4	Low	174 Å²	174	119.9 Å²	119.9	81%	0.813	60%	0.596	S	S	*	*			trans	-64.9	127.7	148.1	-68.3	-160.1	169.3	0	0	106.8	Q629 G633	Q629-E631 VanDerWaalsContact C-N 3.26Å; Q629-E631 PolarHBondContact O-N 3.38Å; E631-G633 VanDerWaalsContact C-N 3.3Å; E631-G633 PolarHBondContact O-N 3.28Å
632	E	46.7	Very low	53.2	Low	206 Å²	206	125.9 Å²	125.9	96%	0.963	62%	0.622	S	S	*	*	T	Hydrogen-bonded Turn	trans	-61	86.8	-177.5	-67	176.5	148.6	0	0	110.2	T630	T630-E632 PolarHBondContact O-N 2.64Å
633	G	44.4	Very low	52.2	Low	64 Å²	64	128.8 Å²	128.8	66%	0.66	64%	0.637	S	S	*	*	T	Hydrogen-bonded Turn	trans	-165.9	-20.9	-177.6	0	0	0	0	0	117.6	E631	E631-G633 VanDerWaalsContact C-N 3.3Å; E631-G633 PolarHBondContact O-N 3.28Å
634	D	42.4	Very low	51.2	Low	118 Å²	118	126.2 Å²	126.2	63%	0.631	62%	0.622	S	S	*	*			trans	-112.5	76	-173.3	-87.4	-1.3	0	0	0	112.7	R639	D634-R639 IonicContact OD2-NH1 2.68Å; D634-R639 IonicContact OD2-NH2 2.72Å; D634-R639 PolarHBondContact OD2-NH2 2.74Å
635	K	47.3	Very low	50.6	Low	197 Å²	197	129.5 Å²	129.5	86%	0.857	64%	0.641	S	S	*	*			trans	-95.4	8.5	173.7	-82	-174.4	178.8	176	0	115
636	Y	47.3	Very low	50.5	Low	215 Å²	215	129.1 Å²	129.1	84%	0.843	64%	0.644	S	S	*	*			trans	-129.2	85.5	-179.4	-66.7	-77.8	0	0	0	112.2
637	L	43.2	Very low	50.6	Low	135 Å²	135	130.4 Å²	130.4	71%	0.707	65%	0.645	S	S	*	*	S	Bend	trans	-169.4	148.2	140.4	-119.9	112.8	0	0	0	109.3	R639	L637-R639 PolarHBondContact O-N 3.41Å
638	K	44.7	Very low	51	Low	172 Å²	172	130.3 Å²	130.3	75%	0.748	64%	0.636	S	S	*	*			trans	-54.7	78.8	168	-65	175.1	175.7	-178.2	0	110.7
639	R	48.6	Very low	52	Low	137 Å²	137	126.6 Å²	126.6	52%	0.517	62%	0.623	S	S	.	*			trans	-89.8	-32.2	-175.6	-109.4	-178.9	-166.4	153	9.5	112.1	D634 L637 D641 K642 L643	D634-R639 IonicContact OD2-NH1 2.68Å; D634-R639 IonicContact OD2-NH2 2.72Å; D634-R639 PolarHBondContact OD2-NH2 2.74Å; L637-R639 PolarHBondContact O-N 3.41Å; R639-D641 PolarHBondContact O-N 3.48Å; R639-K642 PolarHBondContact O-N 2.98Å; R639-L643 PolarHBondContact O-N 2.97Å
640	E	47.6	Very low	53.5	Low	170 Å²	170	118.5 Å²	118.5	79%	0.794	59%	0.585	S	S	*	*	H	α-helix	trans	-63.9	-41.3	-178.7	-70.2	177.5	165	0	0	112.3	K642 L643 E644	E640-K642 PolarHBondContact O-N 3.42Å; E640-L643 PolarHBondContact O-N 3.3Å; E640-E644 WeakPolarHBondContact O-CB 3.47Å; E640-E644 PolarHBondContact O-N 3.44Å
641	D	47.6	Very low	55.3	Low	108 Å²	108	113.2 Å²	113.2	58%	0.578	55%	0.553	S	S	*	*	H	α-helix	trans	-67.2	-31.5	176.1	-66.2	-26.3	0	0	0	113.5	R639 N645	R639-D641 PolarHBondContact O-N 3.48Å; D641-N645 WeakPolarHBondContact O-CB 3.34Å; D641-N645 VanDerWaalsContact O-CG 3.25Å; D641-N645 PolarHBondContact O-N 3.4Å; D641-N645 PolarHBondContact O-ND2 2.84Å
642	K	54.4	Low	57.1	Low	127 Å²	127	112 Å²	112	55%	0.552	55%	0.545	S	S	*	.	H	α-helix	trans	-73.3	-39	175.6	-83.5	-175.7	175.7	-177.4	0	111.5	R639 E640 S646	R639-K642 PolarHBondContact O-N 2.98Å; E640-K642 PolarHBondContact O-N 3.42Å; K642-S646 WeakPolarHBondContact O-CB 3.4Å; K642-S646 PolarHBondContact O-N 3.21Å
643	L	54	Low	58.7	Low	74 Å²	74	104.6 Å²	104.6	39%	0.387	51%	0.512	S	S	.	.	H	α-helix	trans	-69.3	-41.3	-179.8	-158.5	76.3	0	0	0	111	R639 E640 S646 R647	R639-L643 PolarHBondContact O-N 2.97Å; E640-L643 PolarHBondContact O-N 3.3Å; L643-S646 PolarHBondContact O-N 3.33Å; L643-S646 PolarHBondContact O-OG 2.9Å; L643-R647 WeakPolarHBondContact O-CG 3.33Å; L643-R647 PolarHBondContact O-N 3.23Å
644	E	54.7	Low	60.6	Low	73 Å²	73	101.6 Å²	101.6	34%	0.341	48%	0.481	S	S	.	.	H	α-helix	trans	-68.4	-39.9	178.1	-164.3	58.9	-155.6	0	0	112.7	E640 S646 R647 Q648	E640-E644 WeakPolarHBondContact O-CB 3.47Å; E640-E644 PolarHBondContact O-N 3.44Å; E644-S646 VanDerWaalsContact C-N 3.33Å; E644-S646 PolarHBondContact O-N 3.46Å; E644-R647 PolarHBondContact O-N 3.07Å; E644-R647 IonicContact OE2-CZ 2.79Å; E644-R647 IonicContact OE2-NH1 3.17Å; E644-R647 PolarHBondContact OE2-NH1 3.15Å; E644-Q648 WeakPolarHBondContact O-CG 3.26Å; E644-Q648 PolarHBondContact O-N 2.92Å
645	N	59.4	Low	62.5	Low	106 Å²	106	98.8 Å²	98.8	57%	0.567	46%	0.463	S	S	*	.	H	α-helix	trans	-64.3	-36.7	171.4	-75.7	-35	0	0	0	112.2	D641 A649	D641-N645 WeakPolarHBondContact O-CB 3.34Å; D641-N645 VanDerWaalsContact O-CG 3.25Å; D641-N645 PolarHBondContact O-N 3.4Å; D641-N645 PolarHBondContact O-ND2 2.84Å; N645-A649 WeakPolarHBondContact O-CB 3.17Å; N645-A649 PolarHBondContact O-N 3.48Å
646	S	65.9	Low	64.2	Low	53 Å²	53	94 Å²	94	37%	0.371	44%	0.44	S	S	.	.	H	α-helix	trans	-67.6	-36.4	174.8	83.9	0	0	0	0	112.5	K642 L643 E644 A649 L650	K642-S646 WeakPolarHBondContact O-CB 3.4Å; K642-S646 PolarHBondContact O-N 3.21Å; L643-S646 PolarHBondContact O-N 3.33Å; L643-S646 PolarHBondContact O-OG 2.9Å; E644-S646 VanDerWaalsContact C-N 3.33Å; E644-S646 PolarHBondContact O-N 3.46Å; S646-A649 PolarHBondContact O-N 3.33Å; S646-L650 WeakPolarHBondContact O-CB 3.25Å; S646-L650 PolarHBondContact O-N 2.94Å
647	R	67.6	Low	66.1	Low	79 Å²	79	84 Å²	84	30%	0.298	40%	0.401	S	S	.	.	H	α-helix	trans	-64.6	-45.4	174.9	-74.2	171.9	-180	158.3	-2.1	111.9	H624 L643 E644 A649 L650 V651	H624-R647 PolarHBondContact CE1-NE 3.34Å; H624-R647 PolarHBondContact NE2-NE 3.28Å; L643-R647 WeakPolarHBondContact O-CG 3.33Å; L643-R647 PolarHBondContact O-N 3.23Å; E644-R647 PolarHBondContact O-N 3.07Å; E644-R647 IonicContact OE2-CZ 2.79Å; E644-R647 IonicContact OE2-NH1 3.17Å; E644-R647 PolarHBondContact OE2-NH1 3.15Å; R647-A649 VanDerWaalsContact C-N 3.33Å; R647-A649 PolarHBondContact O-N 2.95Å; R647-L650 PolarHBondContact O-N 3.29Å; R647-V651 VanDerWaalsContact O-CG2 3.23Å; R647-V651 WeakPolarHBondContact O-CG2 3.31Å; R647-V651 PolarHBondContact O-N 3.03Å
648	Q	69.1	Low	68.2	Low	97 Å²	97	78.3 Å²	78.3	45%	0.453	37%	0.372	S	S	.	.	H	α-helix	trans	-65.7	-35.9	177.4	-69.1	-178.9	12.6	0	0	112.2	E644 K652	E644-Q648 WeakPolarHBondContact O-CG 3.26Å; E644-Q648 PolarHBondContact O-N 2.92Å; Q648-K652 WeakPolarHBondContact O-CG 3.26Å; Q648-K652 PolarHBondContact O-N 2.97Å; Q648-K652 VanDerWaalsContact O-N 3.13Å
649	A	76.4	Confident	70.2	Confident	45 Å²	45	77.3 Å²	77.3	37%	0.372	37%	0.368	S	S	.	.	H	α-helix	trans	-63.9	-48.1	172	0	0	0	0	0	111.4	N645 S646 R647 V651 K652 D653	N645-A649 WeakPolarHBondContact O-CB 3.17Å; N645-A649 PolarHBondContact O-N 3.48Å; S646-A649 PolarHBondContact O-N 3.33Å; R647-A649 VanDerWaalsContact C-N 3.33Å; R647-A649 PolarHBondContact O-N 2.95Å; A649-V651 VanDerWaalsContact C-N 3.28Å; A649-V651 PolarHBondContact O-N 2.93Å; A649-K652 PolarHBondContact O-N 3.45Å; A649-D653 PolarHBondContact O-N 3.4Å
650	L	79.3	Confident	72	Confident	14 Å²	14	70.8 Å²	70.8	7%	0.073	34%	0.343	C	S	.	.	H	α-helix	trans	-60.2	-36.5	179.8	-161	124.4	0	0	0	112.6	W617 D620 L621 S646 R647 A654 L714 L717	W617-L650 HydrophobicContact CZ2-CD2 3.85Å; W617-L650 PolarHBondContact NE1-O 3.32Å; D620-L650 HydrophobicContact CB-CD1 3.81Å; L621-L650 HydrophobicContact CB-CD1 4.34Å; L621-L650 HydrophobicContact CD1-CD2 3.93Å; S646-L650 WeakPolarHBondContact O-CB 3.25Å; S646-L650 PolarHBondContact O-N 2.94Å; R647-L650 PolarHBondContact O-N 3.29Å; L650-A654 WeakPolarHBondContact O-CB 3.43Å; L650-A654 PolarHBondContact O-N 3.46Å; L650-L714 HydrophobicContact CD2-CD2 4.45Å; L650-L717 HydrophobicContact CD2-CD1 4.22Å
651	V	77.6	Confident	73.9	Confident	14 Å²	14	62.8 Å²	62.8	9%	0.085	31%	0.306	C	S	.	.	H	α-helix	trans	-67.6	-44.6	173.8	167.4	0	0	0	0	112.1	R647 A649 A654 K655 L714 F721	R647-V651 VanDerWaalsContact O-CG2 3.23Å; R647-V651 WeakPolarHBondContact O-CG2 3.31Å; R647-V651 PolarHBondContact O-N 3.03Å; A649-V651 VanDerWaalsContact C-N 3.28Å; A649-V651 PolarHBondContact O-N 2.93Å; V651-A654 PolarHBondContact O-N 3.49Å; V651-K655 WeakPolarHBondContact O-CG 3.39Å; V651-K655 PolarHBondContact O-N 2.89Å; V651-L714 HydrophobicContact CG2-CD2 3.98Å; V651-F721 HydrophobicContact CG1-CE1 4.32Å; V651-F721 HydrophobicContact CG1-CE2 3.77Å; V651-F721 HydrophobicContact CG1-CZ 3.28Å; V651-F721 HydrophobicContact CG2-CE2 4.31Å; V651-F721 HydrophobicContact CG2-CZ 4.44Å
652	K	80.4	Confident	75.8	Confident	147 Å²	147	60.3 Å²	60.3	64%	0.639	30%	0.295	S	S	*	.	H	α-helix	trans	-64	-42.9	177.6	-75.3	176.1	179.2	-179.9	0	111.1	Q648 A649 K655 R656	Q648-K652 WeakPolarHBondContact O-CG 3.26Å; Q648-K652 PolarHBondContact O-N 2.97Å; Q648-K652 VanDerWaalsContact O-N 3.13Å; A649-K652 PolarHBondContact O-N 3.45Å; K652-K655 PolarHBondContact O-N 2.93Å; K652-R656 PolarHBondContact O-N 2.97Å
653	D	81.5	Confident	77.4	Confident	51 Å²	51	55.6 Å²	55.6	27%	0.273	27%	0.273	S	S	.	.	H	α-helix	trans	-64.8	-42.2	177.5	-72.1	-31	0	0	0	111.9	A649 K655 R656 L657	A649-D653 PolarHBondContact O-N 3.4Å; D653-K655 PolarHBondContact O-N 3.13Å; D653-R656 PolarHBondContact O-N 3.02Å; D653-R656 IonicContact OD1-CZ 3.98Å; D653-R656 IonicContact OD1-NE 2.62Å; D653-R656 IonicContact OD1-NH2 2.98Å; D653-R656 PolarHBondContact OD1-NH2 3.29Å; D653-L657 WeakPolarHBondContact O-CB 3.21Å; D653-L657 VanDerWaalsContact O-CG 3.3Å; D653-L657 WeakPolarHBondContact O-CG 3.4Å; D653-L657 PolarHBondContact O-N 2.97Å
654	A	84.2	Confident	79	Confident	1 Å²	1	53.3 Å²	53.3	1%	0.008	26%	0.26	C	S	.	.	H	α-helix	trans	-60.6	-43.6	174	0	0	0	0	0	112.6	W617 L650 V651 R656 S658 V710 L714	W617-A654 HydrophobicContact CZ2-CB 3.79Å; L650-A654 WeakPolarHBondContact O-CB 3.43Å; L650-A654 PolarHBondContact O-N 3.46Å; V651-A654 PolarHBondContact O-N 3.49Å; A654-R656 VanDerWaalsContact C-N 3.32Å; A654-R656 PolarHBondContact O-N 3.37Å; A654-S658 VanDerWaalsContact O-CB 3.3Å; A654-S658 WeakPolarHBondContact O-CB 3.47Å; A654-S658 PolarHBondContact O-N 3.34Å; A654-S658 PolarHBondContact O-OG 2.7Å; A654-V710 HydrophobicContact CB-CG1 4.01Å; A654-L714 HydrophobicContact CB-CD1 3.73Å; A654-L714 HydrophobicContact CB-CD2 4.29Å; A654-L714 HydrophobicContact CB-CG 4.49Å
655	K	80.6	Confident	80.7	Confident	60 Å²	60	50.5 Å²	50.5	26%	0.261	25%	0.248	S	C	.	.	H	α-helix	trans	-63.3	-36.2	176.2	-76.7	-171.9	177	-168.3	0	112	V651 K652 D653 S658 K659 E724	V651-K655 WeakPolarHBondContact O-CG 3.39Å; V651-K655 PolarHBondContact O-N 2.89Å; K652-K655 PolarHBondContact O-N 2.93Å; D653-K655 PolarHBondContact O-N 3.13Å; K655-S658 WeakPolarHBondContact CA-OG 3.39Å; K655-S658 PolarHBondContact O-OG 3.46Å; K655-K659 WeakPolarHBondContact O-CG 3.47Å; K655-K659 PolarHBondContact O-N 2.91Å; K655-E724 IonicContact NZ-OE2 3.54Å; K655-E724 PolarHBondContact NZ-OE2 3.12Å
656	R	84.4	Confident	82	Confident	97 Å²	97	51.5 Å²	51.5	37%	0.366	24%	0.244	S	C	.	.	H	α-helix	trans	-72.1	-47.2	177.3	-179.6	177.1	60.1	-178.1	-1.3	111.8	K652 D653 A654 K659 K660	K652-R656 PolarHBondContact O-N 2.97Å; D653-R656 PolarHBondContact O-N 3.02Å; D653-R656 IonicContact OD1-CZ 3.98Å; D653-R656 IonicContact OD1-NE 2.62Å; D653-R656 IonicContact OD1-NH2 2.98Å; D653-R656 PolarHBondContact OD1-NH2 3.29Å; A654-R656 VanDerWaalsContact C-N 3.32Å; A654-R656 PolarHBondContact O-N 3.37Å; R656-K659 PolarHBondContact O-N 3.46Å; R656-K660 PolarHBondContact O-N 3.38Å; R656-K660 VanDerWaalsContact O-N 3.09Å
657	L	87.3	Confident	83	Confident	4 Å²	4	49.8 Å²	49.8	2%	0.021	23%	0.23	C	C	.	.	H	α-helix	trans	-63.9	-39.6	178.7	-71	170.6	0	0	0	111.8	L610 Q614 W617 D653 K660 L661 W706 M742	L610-L657 HydrophobicContact CD2-CD2 3.95Å; Q614-L657 HydrophobicContact CG-CD1 4.46Å; Q614-L657 HydrophobicContact CG-CD2 4.4Å; W617-L657 HydrophobicContact CB-CD1 3.82Å; W617-L657 HydrophobicContact CG-CD1 4.11Å; D653-L657 WeakPolarHBondContact O-CB 3.21Å; D653-L657 VanDerWaalsContact O-CG 3.3Å; D653-L657 WeakPolarHBondContact O-CG 3.4Å; D653-L657 PolarHBondContact O-N 2.97Å; L657-K660 PolarHBondContact O-N 2.9Å; L657-L661 VanDerWaalsContact O-CB 3.24Å; L657-L661 WeakPolarHBondContact O-CB 3.45Å; L657-L661 PolarHBondContact O-N 3.13Å; L657-W706 HydrophobicContact CB-CH2 3.92Å; L657-M742 HydrophobicContact CD2-CE 3.8Å
658	S	86.1	Confident	84.1	Confident	16 Å²	16	46 Å²	46	11%	0.112	22%	0.216	C	C	.	.	H	α-helix	trans	-64.3	-43	177	61.9	0	0	0	0	112.7	A654 K655 L661 V662	A654-S658 VanDerWaalsContact O-CB 3.3Å; A654-S658 WeakPolarHBondContact O-CB 3.47Å; A654-S658 PolarHBondContact O-N 3.34Å; A654-S658 PolarHBondContact O-OG 2.7Å; K655-S658 WeakPolarHBondContact CA-OG 3.39Å; K655-S658 PolarHBondContact O-OG 3.46Å; S658-L661 PolarHBondContact O-N 2.89Å; S658-V662 WeakPolarHBondContact O-CG2 3.25Å; S658-V662 PolarHBondContact O-N 3.49Å
659	K	86.8	Confident	85	Confident	150 Å²	150	41.9 Å²	41.9	65%	0.652	20%	0.197	S	C	*	.	H	α-helix	trans	-60.2	-47.8	174.3	-74.5	179.1	179.7	-170.9	0	111.7	K655 R656 V662 Y663	K655-K659 WeakPolarHBondContact O-CG 3.47Å; K655-K659 PolarHBondContact O-N 2.91Å; R656-K659 PolarHBondContact O-N 3.46Å; K659-V662 PolarHBondContact O-N 3.4Å; K659-Y663 WeakPolarHBondContact O-CB 3.46Å; K659-Y663 PolarHBondContact O-N 2.83Å
660	K	86.1	Confident	85.6	Confident	1 Å²	1	44.7 Å²	44.7	0%	0.004	20%	0.198	C	C	.	.	H	α-helix	trans	-60.9	-46.1	176.1	-81.1	-167.4	171.5	-146.7	0	111.9	E606 L610 R656 L657 V662 Y663 Y664 P739 E740	E606-K660 IonicContact OE1-NZ 2.72Å; E606-K660 IonicContact OE2-NZ 2.63Å; E606-K660 PolarHBondContact OE2-NZ 3.38Å; L610-K660 HydrophobicContact CD1-CB 4.19Å; L610-K660 HydrophobicContact CD2-CB 3.38Å; L610-K660 HydrophobicContact CD2-CD 4.18Å; L610-K660 HydrophobicContact CD2-CG 4.36Å; L610-K660 HydrophobicContact CG-CB 4.14Å; R656-K660 PolarHBondContact O-N 3.38Å; R656-K660 VanDerWaalsContact O-N 3.09Å; L657-K660 PolarHBondContact O-N 2.9Å; K660-V662 PolarHBondContact O-N 3.47Å; K660-Y663 PolarHBondContact O-N 3.24Å; K660-Y664 HydrophobicContact CB-CD2 4.37Å; K660-Y664 HydrophobicContact CB-CE2 4.42Å; K660-Y664 HydrophobicContact CG-CE2 4.44Å; K660-Y664 VanDerWaalsContact O-CD2 3.23Å; K660-Y664 WeakPolarHBondContact O-CD2 3.43Å; K660-Y664 PolarHBondContact O-N 2.91Å; K660-P739 HydrophobicContact CB-CG 4.42Å; K660-P739 HydrophobicContact CD-CG 4.25Å; K660-P739 HydrophobicContact CG-CB 3.86Å; K660-P739 HydrophobicContact CG-CG 3.36Å; K660-E740 VanDerWaalsContact CE-O 3.29Å; K660-E740 WeakPolarHBondContact CE-O 3.44Å; K660-E740 PolarHBondContact NZ-O 2.95Å; K660-E740 VanDerWaalsContact NZ-O 3.13Å
661	L	88.8	Confident	86	Confident	1 Å²	1	44 Å²	44	1%	0.005	20%	0.195	C	C	.	.	H	α-helix	trans	-58.8	-46.3	179.7	-176.2	69.2	0	0	0	111.8	W332 L657 S658 S665 W706 L707	W332-L661 HydrophobicContact CD2-CD1 3.5Å; W332-L661 HydrophobicContact CE3-CD1 3.89Å; W332-L661 HydrophobicContact CG-CD1 4.02Å; W332-L661 HydrophobicContact CH2-CD1 3.98Å; W332-L661 HydrophobicContact CZ2-CD1 3.58Å; W332-L661 HydrophobicContact CZ3-CD1 4.11Å; L657-L661 VanDerWaalsContact O-CB 3.24Å; L657-L661 WeakPolarHBondContact O-CB 3.45Å; L657-L661 PolarHBondContact O-N 3.13Å; S658-L661 PolarHBondContact O-N 2.89Å; L661-S665 WeakPolarHBondContact O-CB 3.34Å; L661-S665 PolarHBondContact O-N 3.29Å; L661-S665 PolarHBondContact O-OG 2.89Å; L661-W706 HydrophobicContact CD2-CB 4.24Å; L661-W706 HydrophobicContact CD2-CD2 3.87Å; L661-W706 HydrophobicContact CD2-CE3 3.31Å; L661-W706 HydrophobicContact CD2-CG 4.27Å; L661-W706 HydrophobicContact CD2-CZ3 3.94Å; L661-L707 HydrophobicContact CD2-CD2 4.31Å; L661-L707 HydrophobicContact CD2-CG 4.2Å
662	V	87.6	Confident	86.4	Confident	57 Å²	57	43.5 Å²	43.5	35%	0.345	19%	0.192	S	C	.	.	H	α-helix	trans	-63.5	-44.7	177.4	172.1	0	0	0	0	111	S658 K659 K660 R666 L707	S658-V662 WeakPolarHBondContact O-CG2 3.25Å; S658-V662 PolarHBondContact O-N 3.49Å; K659-V662 PolarHBondContact O-N 3.4Å; K660-V662 PolarHBondContact O-N 3.47Å; V662-R666 WeakPolarHBondContact O-CB 3.44Å; V662-R666 PolarHBondContact O-N 2.95Å; V662-L707 HydrophobicContact CG2-CD1 3.55Å; V662-L707 HydrophobicContact CG2-CD2 4.41Å
663	Y	87.3	Confident	86.7	Confident	27 Å²	27	39.4 Å²	39.4	11%	0.106	18%	0.176	C	C	.	.	H	α-helix	trans	-58.9	-57.4	179.4	179.3	-93.6	0	0	0	111.6	F469 K659 K660 S665 R666 F667 P736	F469-Y663 HydrophobicContact CD1-CE2 4.42Å; F469-Y663 HydrophobicContact CD2-CE2 4.19Å; F469-Y663 HydrophobicContact CE1-CE2 4.37Å; F469-Y663 HydrophobicContact CE2-CE2 4.14Å; F469-Y663 HydrophobicContact CG-CE2 4.37Å; F469-Y663 HydrophobicContact CZ-CE2 4.24Å; K659-Y663 WeakPolarHBondContact O-CB 3.46Å; K659-Y663 PolarHBondContact O-N 2.83Å; K660-Y663 PolarHBondContact O-N 3.24Å; Y663-S665 PolarHBondContact O-N 3.41Å; Y663-R666 PolarHBondContact O-N 2.91Å; Y663-F667 PolarHBondContact O-N 3.44Å; Y663-P736 HydrophobicContact CD2-CG 4.4Å
664	Y	88.6	Confident	86.9	Confident	27 Å²	27	38.3 Å²	38.3	11%	0.106	17%	0.171	C	C	.	.	H	α-helix	trans	-70.1	-31.6	-177.1	-70.7	-67.8	0	0	0	112.8	L603 E606 L610 K660 R666 F667 I668	L603-Y664 HydrophobicContact CD1-CD1 3.8Å; L603-Y664 HydrophobicContact CD1-CE1 4.11Å; E606-Y664 HydrophobicContact CB-CE1 3.96Å; E606-Y664 HydrophobicContact CB-CE2 3.92Å; E606-Y664 VanDerWaalsContact CB-CZ 3.48Å; E606-Y664 WeakPolarHBondContact CB-OH 3.44Å; E606-Y664 HydrophobicContact CG-CE1 4.48Å; E606-Y664 HydrophobicContact CG-CE2 4.44Å; E606-Y664 WeakPolarHBondContact CG-OH 3.48Å; E606-Y664 WeakPolarHBondContact OE2-CE2 3.31Å; E606-Y664 PolarHBondContact OE2-OH 3.18Å; L610-Y664 HydrophobicContact CD1-CD2 3.53Å; L610-Y664 HydrophobicContact CD1-CE2 4.27Å; L610-Y664 HydrophobicContact CD1-CG 4.24Å; L610-Y664 HydrophobicContact CG-CD2 4.48Å; K660-Y664 HydrophobicContact CB-CD2 4.37Å; K660-Y664 HydrophobicContact CB-CE2 4.42Å; K660-Y664 HydrophobicContact CG-CE2 4.44Å; K660-Y664 VanDerWaalsContact O-CD2 3.23Å; K660-Y664 WeakPolarHBondContact O-CD2 3.43Å; K660-Y664 PolarHBondContact O-N 2.91Å; Y664-R666 VanDerWaalsContact C-N 3.33Å; Y664-R666 PolarHBondContact O-N 3.31Å; Y664-F667 PolarHBondContact O-N 3.32Å; Y664-I668 WeakPolarHBondContact O-CB 3.48Å; Y664-I668 VanDerWaalsContact O-CG1 3.23Å; Y664-I668 WeakPolarHBondContact O-CG1 3.43Å; Y664-I668 PolarHBondContact O-N 2.89Å
665	S	89.2	Confident	87	Confident	13 Å²	13	38.4 Å²	38.4	9%	0.091	17%	0.171	C	C	.	.	H	α-helix	trans	-61.6	-42.9	171.7	-61.4	0	0	0	0	111.8	W332 L661 Y663 T669	W332-S665 PolarHBondContact NE1-OG 3.38Å; L661-S665 WeakPolarHBondContact O-CB 3.34Å; L661-S665 PolarHBondContact O-N 3.29Å; L661-S665 PolarHBondContact O-OG 2.89Å; Y663-S665 PolarHBondContact O-N 3.41Å; S665-T669 VanDerWaalsContact O-CB 3.28Å; S665-T669 WeakPolarHBondContact O-CB 3.38Å; S665-T669 PolarHBondContact O-N 3.33Å; S665-T669 VanDerWaalsContact O-N 3.13Å; S665-T669 PolarHBondContact O-OG1 2.92Å
666	R	87.9	Confident	87.1	Confident	128 Å²	128	35.8 Å²	35.8	48%	0.483	16%	0.16	S	C	.	.	H	α-helix	trans	-68.7	-41.2	177.5	-178.5	176.4	-93.5	134.1	-9.8	111.1	V662 Y663 Y664 R670	V662-R666 WeakPolarHBondContact O-CB 3.44Å; V662-R666 PolarHBondContact O-N 2.95Å; Y663-R666 PolarHBondContact O-N 2.91Å; Y664-R666 VanDerWaalsContact C-N 3.33Å; Y664-R666 PolarHBondContact O-N 3.31Å; R666-R670 WeakPolarHBondContact O-CB 3.37Å; R666-R670 PolarHBondContact O-N 3.4Å
667	F	87.1	Confident	87	Confident	16 Å²	16	37 Å²	37	7%	0.07	17%	0.169	C	C	.	.	H	α-helix	trans	-60.8	-58	177.1	-177	-111.2	0	0	0	112.1	F469 L603 Y663 Y664 T669 R670 S671	F469-F667 HydrophobicContact CD2-CB 4.41Å; F469-F667 AromaticContact CD2-CD2 3.41Å; F469-F667 HydrophobicContact CD2-CD2 3.41Å; F469-F667 VanDerWaalsContact CD2-CD2 3.41Å; F469-F667 HydrophobicContact CD2-CE2 4.05Å; F469-F667 HydrophobicContact CD2-CG 4.3Å; F469-F667 HydrophobicContact CE2-CB 3.91Å; F469-F667 AromaticContact CE2-CD2 3.68Å; F469-F667 HydrophobicContact CE2-CD2 3.68Å; F469-F667 HydrophobicContact CE2-CG 4.27Å; L603-F667 HydrophobicContact CD1-CD1 3.58Å; L603-F667 HydrophobicContact CD1-CE1 3.63Å; L603-F667 HydrophobicContact CD2-CD1 4.18Å; L603-F667 HydrophobicContact CD2-CE1 3.66Å; L603-F667 HydrophobicContact CG-CE1 4.23Å; Y663-F667 PolarHBondContact O-N 3.44Å; Y664-F667 PolarHBondContact O-N 3.32Å; F667-T669 PolarHBondContact O-N 3.35Å; F667-R670 WeakPolarHBondContact O-CA 3.17Å; F667-R670 WeakPolarHBondContact O-CB 3.42Å; F667-R670 PolarHBondContact O-N 3.46Å; F667-S671 PolarHBondContact O-N 3.1Å; F667-S671 PolarHBondContact O-OG 3.21Å; F667-S671 VanDerWaalsContact O-OG 3.11Å
668	I	89.4	Confident	86.6	Confident	0 Å²	0	38.5 Å²	38.5	0%	0	18%	0.177	C	C	.	.	H	α-helix	trans	-56.9	-41	-179.6	-65.8	168.1	0	0	0	110.7	A336 C339 L340 V607 Y664 C672 L699	A336-I668 HydrophobicContact CB-CD1 4.05Å; C339-I668 HydrophobicContact CB-CG2 3.4Å; C339-I668 VanDerWaalsContact CB-CG2 3.4Å; L340-I668 HydrophobicContact CD2-CD1 4.11Å; L340-I668 HydrophobicContact CD2-CG1 4.02Å; V607-I668 HydrophobicContact CG2-CD1 3.95Å; Y664-I668 WeakPolarHBondContact O-CB 3.48Å; Y664-I668 VanDerWaalsContact O-CG1 3.23Å; Y664-I668 WeakPolarHBondContact O-CG1 3.43Å; Y664-I668 PolarHBondContact O-N 2.89Å; I668-C672 WeakPolarHBondContact O-CB 3.39Å; I668-C672 PolarHBondContact O-N 2.95Å; I668-C672 PolarHBondContact O-SG 2.98Å; I668-L699 HydrophobicContact CB-CD2 4.21Å; I668-L699 HydrophobicContact CG2-CD2 3.9Å
669	T	88.4	Confident	86	Confident	10 Å²	10	39.1 Å²	39.1	6%	0.061	18%	0.181	C	C	.	.	H	α-helix	trans	-63.5	-43.6	176.6	-56.7	0	0	0	0	112.2	S665 F667 N673	S665-T669 VanDerWaalsContact O-CB 3.28Å; S665-T669 WeakPolarHBondContact O-CB 3.38Å; S665-T669 PolarHBondContact O-N 3.33Å; S665-T669 VanDerWaalsContact O-N 3.13Å; S665-T669 PolarHBondContact O-OG1 2.92Å; F667-T669 PolarHBondContact O-N 3.35Å; T669-N673 WeakPolarHBondContact O-CB 3.26Å; T669-N673 PolarHBondContact O-N 3.24Å; T669-N673 PolarHBondContact O-ND2 3.23Å
670	R	88.8	Confident	85.4	Confident	104 Å²	104	34.8 Å²	34.8	39%	0.392	16%	0.164	S	C	.	.	H	α-helix	trans	-61.6	-52.2	177.1	176.2	-174.5	169.6	104.3	1	110.6	R666 F667 C672 N673 L674	R666-R670 WeakPolarHBondContact O-CB 3.37Å; R666-R670 PolarHBondContact O-N 3.4Å; F667-R670 WeakPolarHBondContact O-CA 3.17Å; F667-R670 WeakPolarHBondContact O-CB 3.42Å; F667-R670 PolarHBondContact O-N 3.46Å; R670-C672 VanDerWaalsContact C-N 3.33Å; R670-C672 PolarHBondContact O-N 2.97Å; R670-N673 PolarHBondContact O-N 3.46Å; R670-N673 VanDerWaalsContact O-N 3.12Å; R670-L674 HydrophobicContact CG-CD1 4.29Å; R670-L674 WeakPolarHBondContact O-CG 3.44Å; R670-L674 PolarHBondContact O-N 3.32Å
671	S	87.2	Confident	84.5	Confident	1 Å²	1	40.8 Å²	40.8	1%	0.007	20%	0.201	C	C	.	.	H	α-helix	trans	-60.2	-42.5	-177.8	-49.6	0	0	0	0	111.5	R466 F667 L674 I675	R466-S671 WeakPolarHBondContact O-CB 3.46Å; R466-S671 PolarHBondContact O-OG 3.16Å; F667-S671 PolarHBondContact O-N 3.1Å; F667-S671 PolarHBondContact O-OG 3.21Å; F667-S671 VanDerWaalsContact O-OG 3.11Å; S671-L674 PolarHBondContact O-N 3.48Å; S671-I675 WeakPolarHBondContact O-CG1 3.44Å; S671-I675 PolarHBondContact O-N 3.19Å
672	C	87.6	Confident	83.4	Confident	3 Å²	3	46.8 Å²	46.8	2%	0.02	24%	0.237	C	C	.	.	H	α-helix	trans	-67.2	-38.2	174.8	-68.4	0	0	0	0	113.1	I668 R670 I675 L676 L696	I668-C672 WeakPolarHBondContact O-CB 3.39Å; I668-C672 PolarHBondContact O-N 2.95Å; I668-C672 PolarHBondContact O-SG 2.98Å; R670-C672 VanDerWaalsContact C-N 3.33Å; R670-C672 PolarHBondContact O-N 2.97Å; C672-I675 PolarHBondContact O-N 3.43Å; C672-L676 WeakPolarHBondContact O-CG 3.32Å; C672-L676 PolarHBondContact O-N 2.93Å; C672-L696 HydrophobicContact CB-CD1 3.83Å; C672-L696 HydrophobicContact CB-CD2 3.7Å; C672-L696 HydrophobicContact CB-CG 4.29Å
673	N	86.8	Confident	82.4	Confident	60 Å²	60	47.3 Å²	47.3	32%	0.321	24%	0.238	S	C	.	.	H	α-helix	trans	-64.9	-39.1	176.8	-78.6	-25.2	0	0	0	111.8	T669 R670 I675 L676 E677 L696	T669-N673 WeakPolarHBondContact O-CB 3.26Å; T669-N673 PolarHBondContact O-N 3.24Å; T669-N673 PolarHBondContact O-ND2 3.23Å; R670-N673 PolarHBondContact O-N 3.46Å; R670-N673 VanDerWaalsContact O-N 3.12Å; N673-I675 VanDerWaalsContact C-N 3.3Å; N673-I675 PolarHBondContact O-N 3.47Å; N673-L676 PolarHBondContact O-N 3.46Å; N673-L676 VanDerWaalsContact O-N 3.14Å; N673-E677 WeakPolarHBondContact O-CG 3.31Å; N673-E677 PolarHBondContact O-N 3.41Å; N673-L696 WeakPolarHBondContact OD1-CD1 3.16Å
674	L	85.6	Confident	81.2	Confident	29 Å²	29	50.5 Å²	50.5	15%	0.152	26%	0.262	C	S	.	.	H	α-helix	trans	-59.5	-41.7	175.1	-71	170.7	0	0	0	111.7	E465 R466 R670 S671 E677 Q678	E465-L674 HydrophobicContact CB-CD1 4.47Å; R466-L674 HydrophobicContact CG-CB 4.29Å; R466-L674 HydrophobicContact CG-CD1 4.43Å; R670-L674 HydrophobicContact CG-CD1 4.29Å; R670-L674 WeakPolarHBondContact O-CG 3.44Å; R670-L674 PolarHBondContact O-N 3.32Å; S671-L674 PolarHBondContact O-N 3.48Å; L674-E677 PolarHBondContact O-N 3.2Å; L674-Q678 VanDerWaalsContact O-CG 3.27Å; L674-Q678 WeakPolarHBondContact O-CG 3.34Å; L674-Q678 PolarHBondContact O-N 2.98Å; L674-Q678 VanDerWaalsContact O-N 3.13Å; L674-Q678 PolarHBondContact O-NE2 2.89Å
675	I	85.4	Confident	79.7	Confident	2 Å²	2	59 Å²	59	1%	0.01	30%	0.295	C	S	.	.	H	α-helix	trans	-63.3	-44.7	174.5	-63.4	165.9	0	0	0	110.8	Y342 I343 Q346 R466 S671 C672 N673 E677 Q678 S679	Y342-I675 HydrophobicContact CD1-CD1 4.24Å; Y342-I675 HydrophobicContact CE1-CB 4.05Å; Y342-I675 HydrophobicContact CE1-CD1 4.04Å; Y342-I675 HydrophobicContact CE1-CG2 3.66Å; Y342-I675 VanDerWaalsContact OH-CG2 3.26Å; Y342-I675 WeakPolarHBondContact OH-CG2 3.37Å; I343-I675 HydrophobicContact CB-CD1 4.34Å; I343-I675 HydrophobicContact CG1-CD1 3.92Å; Q346-I675 HydrophobicContact CB-CD1 4.03Å; Q346-I675 HydrophobicContact CB-CG2 4.29Å; Q346-I675 HydrophobicContact CG-CD1 4.18Å; Q346-I675 HydrophobicContact CG-CG1 4.11Å; Q346-I675 HydrophobicContact CG-CG2 3.69Å; R466-I675 HydrophobicContact CG-CG1 4.39Å; S671-I675 WeakPolarHBondContact O-CG1 3.44Å; S671-I675 PolarHBondContact O-N 3.19Å; C672-I675 PolarHBondContact O-N 3.43Å; N673-I675 VanDerWaalsContact C-N 3.3Å; N673-I675 PolarHBondContact O-N 3.47Å; I675-E677 PolarHBondContact O-N 3.34Å; I675-Q678 PolarHBondContact O-N 3.11Å; I675-S679 PolarHBondContact O-N 3.46Å; I675-S679 PolarHBondContact O-OG 3.36Å
676	L	83.9	Confident	78.5	Confident	6 Å²	6	62.4 Å²	62.4	3%	0.031	31%	0.309	C	S	.	.	H	α-helix	trans	-64	-40.9	179.7	-68.9	174.1	0	0	0	111.9	C672 N673 Q678 S679 L680 V689 R692 R693 L696	C672-L676 WeakPolarHBondContact O-CG 3.32Å; C672-L676 PolarHBondContact O-N 2.93Å; N673-L676 PolarHBondContact O-N 3.46Å; N673-L676 VanDerWaalsContact O-N 3.14Å; L676-Q678 VanDerWaalsContact C-N 3.31Å; L676-Q678 PolarHBondContact O-N 3.3Å; L676-S679 WeakPolarHBondContact CA-OG 3.34Å; L676-S679 PolarHBondContact O-N 3.24Å; L676-S679 PolarHBondContact O-OG 2.98Å; L676-L680 VanDerWaalsContact O-CG 3.28Å; L676-L680 WeakPolarHBondContact O-CG 3.47Å; L676-L680 PolarHBondContact O-N 3.46Å; L676-V689 HydrophobicContact CD2-CB 4.33Å; L676-V689 HydrophobicContact CD2-CG1 4.23Å; L676-V689 HydrophobicContact CD2-CG2 4.06Å; L676-R692 HydrophobicContact CD1-CB 4.3Å; L676-R692 HydrophobicContact CD2-CB 4.06Å; L676-R693 HydrophobicContact CD1-CG 4.09Å; L676-L696 HydrophobicContact CD1-CD1 4.04Å
677	E	82.2	Confident	77.1	Confident	121 Å²	121	60.5 Å²	60.5	57%	0.565	32%	0.32	S	S	*	.	H	α-helix	trans	-60.4	-41.3	175.4	-74.8	174.4	-174.7	0	0	111.7	N673 L674 I675 L680 V681	N673-E677 WeakPolarHBondContact O-CG 3.31Å; N673-E677 PolarHBondContact O-N 3.41Å; L674-E677 PolarHBondContact O-N 3.2Å; I675-E677 PolarHBondContact O-N 3.34Å; E677-L680 PolarHBondContact O-N 2.99Å; E677-V681 WeakPolarHBondContact O-CG2 3.37Å; E677-V681 PolarHBondContact O-N 2.94Å
678	Q	77.1	Confident	76	Confident	37 Å²	37	64.1 Å²	64.1	17%	0.173	34%	0.338	C	S	.	.	H	α-helix	trans	-66.5	-43.1	175.6	-68.4	164.3	23.4	0	0	112.2	H462 L674 I675 L676 L680 V681	H462-Q678 VanDerWaalsContact CB-NE2 3.26Å; H462-Q678 PolarHBondContact ND1-NE2 3.43Å; H462-Q678 VanDerWaalsContact ND1-NE2 3.18Å; L674-Q678 VanDerWaalsContact O-CG 3.27Å; L674-Q678 WeakPolarHBondContact O-CG 3.34Å; L674-Q678 PolarHBondContact O-N 2.98Å; L674-Q678 VanDerWaalsContact O-N 3.13Å; L674-Q678 PolarHBondContact O-NE2 2.89Å; I675-Q678 PolarHBondContact O-N 3.11Å; L676-Q678 VanDerWaalsContact C-N 3.31Å; L676-Q678 PolarHBondContact O-N 3.3Å; Q678-L680 VanDerWaalsContact C-N 3.32Å; Q678-L680 PolarHBondContact O-N 3.32Å; Q678-V681 PolarHBondContact O-N 2.95Å
679	S	73.9	Confident	74.9	Confident	29 Å²	29	64.5 Å²	64.5	20%	0.203	34%	0.34	C	S	.	.	H	α-helix	trans	-63.9	-34.4	178.3	69	0	0	0	0	113.2	I675 L676 V681 V682 D683	I675-S679 PolarHBondContact O-N 3.46Å; I675-S679 PolarHBondContact O-OG 3.36Å; L676-S679 WeakPolarHBondContact CA-OG 3.34Å; L676-S679 PolarHBondContact O-N 3.24Å; L676-S679 PolarHBondContact O-OG 2.98Å; S679-V681 VanDerWaalsContact C-N 3.32Å; S679-V681 PolarHBondContact O-N 3.42Å; S679-V682 PolarHBondContact O-N 2.95Å; S679-D683 PolarHBondContact O-N 2.97Å
680	L	73.8	Confident	74	Confident	58 Å²	58	65.7 Å²	65.7	30%	0.304	35%	0.354	S	S	.	.	H	α-helix	trans	-71.5	-25.2	178.6	-74.7	167.1	0	0	0	113.5	L676 E677 Q678 V682 V689	L676-L680 VanDerWaalsContact O-CG 3.28Å; L676-L680 WeakPolarHBondContact O-CG 3.47Å; L676-L680 PolarHBondContact O-N 3.46Å; E677-L680 PolarHBondContact O-N 2.99Å; Q678-L680 VanDerWaalsContact C-N 3.32Å; Q678-L680 PolarHBondContact O-N 3.32Å; L680-V682 VanDerWaalsContact C-N 3.29Å; L680-V689 HydrophobicContact CD1-CG1 4.41Å; L680-V689 HydrophobicContact CD2-CG1 4.25Å; L680-V689 HydrophobicContact CD2-CG2 4.21Å; L680-V689 HydrophobicContact CG-CG1 4.48Å; L680-V689 HydrophobicContact CG-CG2 4.44Å
681	V	68.8	Low	73.5	Confident	127 Å²	127	65 Å²	65	77%	0.77	36%	0.358	S	S	*	.	H	α-helix	trans	-70.8	-30	173.1	173.4	0	0	0	0	110.8	E677 Q678 S679	E677-V681 WeakPolarHBondContact O-CG2 3.37Å; E677-V681 PolarHBondContact O-N 2.94Å; Q678-V681 PolarHBondContact O-N 2.95Å; S679-V681 VanDerWaalsContact C-N 3.32Å; S679-V681 PolarHBondContact O-N 3.42Å
682	V	65.1	Low	73.1	Confident	127 Å²	127	67.4 Å²	67.4	77%	0.77	37%	0.367	S	S	*	.	H	α-helix	trans	-89.7	-42.2	-179.2	-177.2	0	0	0	0	112	S679 L680	S679-V682 PolarHBondContact O-N 2.95Å; L680-V682 VanDerWaalsContact C-N 3.29Å
683	D	66.4	Low	72.8	Confident	68 Å²	68	73.1 Å²	73.1	36%	0.364	39%	0.389	S	S	.	.			trans	-142.1	108.8	176.5	-174.5	-1.3	0	0	0	112.2	S679 Y685 F686	S679-D683 PolarHBondContact O-N 2.97Å; D683-Y685 PolarHBondContact O-N 2.84Å; D683-Y685 PolarHBondContact OD1-N 3.21Å; D683-F686 HydrophobicContact CB-CB 4.48Å
684	P	61.3	Low	72.6	Confident	94 Å²	94	76.7 Å²	76.7	61%	0.61	40%	0.401	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.1	-17.1	178.7	-20.3	31.7	0	0	0	114.9
685	Y	57.8	Low	72.5	Confident	205 Å²	205	78 Å²	78	80%	0.804	41%	0.406	S	S	*	.	T	Hydrogen-bonded Turn	trans	-110	14.7	-172.8	-67.5	-79.9	0	0	0	113.8	D683 A687	D683-Y685 PolarHBondContact O-N 2.84Å; D683-Y685 PolarHBondContact OD1-N 3.21Å; Y685-A687 PolarHBondContact O-N 2.68Å
686	F	64.1	Low	72.6	Confident	85 Å²	85	78.2 Å²	78.2	37%	0.373	41%	0.408	S	S	.	.			trans	-61.2	103.7	-179.2	-160.1	-104.6	0	0	0	111.5	D683 E688 V689	D683-F686 HydrophobicContact CB-CB 4.48Å; F686-E688 HydrophobicContact CD1-CB 3.68Å; F686-E688 HydrophobicContact CE1-CB 3.39Å; F686-E688 HydrophobicContact CE1-CG 4.37Å; F686-E688 VanDerWaalsContact CE1-OE2 3.31Å; F686-E688 WeakPolarHBondContact CE1-OE2 3.49Å; F686-E688 HydrophobicContact CZ-CB 4.29Å; F686-E688 WeakPolarHBondContact CZ-OE2 3.23Å; F686-E688 PolarHBondContact O-N 3.01Å; F686-E688 VanDerWaalsContact O-N 3.15Å; F686-V689 HydrophobicContact CB-CG2 3.94Å; F686-V689 HydrophobicContact CD1-CG2 4.01Å; F686-V689 HydrophobicContact CG-CG2 4.46Å; F686-V689 WeakPolarHBondContact O-CB 3.48Å; F686-V689 WeakPolarHBondContact O-CG2 3.39Å; F686-V689 PolarHBondContact O-N 3.26Å
687	A	58.6	Low	72.7	Confident	88 Å²	88	84.7 Å²	84.7	73%	0.727	44%	0.436	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.3	-28.5	-170.6	0	0	0	0	0	113.4	Y685 V689 G690	Y685-A687 PolarHBondContact O-N 2.68Å; A687-V689 PolarHBondContact O-N 3.25Å; A687-G690 PolarHBondContact O-N 3.33Å
688	E	64.1	Low	73	Confident	93 Å²	93	83.7 Å²	83.7	44%	0.435	43%	0.429	S	S	.	.	H	α-helix	trans	-64.9	-24.3	176.6	-109.1	-177	139.2	0	0	113.2	F686 G690 D691 R692	F686-E688 HydrophobicContact CD1-CB 3.68Å; F686-E688 HydrophobicContact CE1-CB 3.39Å; F686-E688 HydrophobicContact CE1-CG 4.37Å; F686-E688 VanDerWaalsContact CE1-OE2 3.31Å; F686-E688 WeakPolarHBondContact CE1-OE2 3.49Å; F686-E688 HydrophobicContact CZ-CB 4.29Å; F686-E688 WeakPolarHBondContact CZ-OE2 3.23Å; F686-E688 PolarHBondContact O-N 3.01Å; F686-E688 VanDerWaalsContact O-N 3.15Å; E688-G690 PolarHBondContact O-N 3.22Å; E688-D691 PolarHBondContact O-N 3.11Å; E688-R692 VanDerWaalsContact O-CG 3.3Å; E688-R692 WeakPolarHBondContact O-CG 2.86Å; E688-R692 PolarHBondContact O-N 3.26Å; E688-R692 IonicContact OE1-NH2 3.02Å
689	V	67.1	Low	73.6	Confident	7 Å²	7	82 Å²	82	4%	0.042	42%	0.421	C	S	.	.	H	α-helix	trans	-61	-35.6	178.5	174.7	0	0	0	0	111.6	L676 L680 F686 A687 R693	L676-V689 HydrophobicContact CD2-CB 4.33Å; L676-V689 HydrophobicContact CD2-CG1 4.23Å; L676-V689 HydrophobicContact CD2-CG2 4.06Å; L680-V689 HydrophobicContact CD1-CG1 4.41Å; L680-V689 HydrophobicContact CD2-CG1 4.25Å; L680-V689 HydrophobicContact CD2-CG2 4.21Å; L680-V689 HydrophobicContact CG-CG1 4.48Å; L680-V689 HydrophobicContact CG-CG2 4.44Å; F686-V689 HydrophobicContact CB-CG2 3.94Å; F686-V689 HydrophobicContact CD1-CG2 4.01Å; F686-V689 HydrophobicContact CG-CG2 4.46Å; F686-V689 WeakPolarHBondContact O-CB 3.48Å; F686-V689 WeakPolarHBondContact O-CG2 3.39Å; F686-V689 PolarHBondContact O-N 3.26Å; A687-V689 PolarHBondContact O-N 3.25Å; V689-R693 WeakPolarHBondContact O-CB 3.34Å; V689-R693 PolarHBondContact O-N 3.47Å; V689-R693 VanDerWaalsContact O-N 3.08Å
690	G	68.7	Low	74.3	Confident	36 Å²	36	84.8 Å²	84.8	37%	0.371	43%	0.431	S	S	.	.	H	α-helix	trans	-67.3	-40.8	179.1	0	0	0	0	0	112.4	A687 E688 K694	A687-G690 PolarHBondContact O-N 3.33Å; E688-G690 PolarHBondContact O-N 3.22Å; G690-K694 WeakPolarHBondContact O-CG 3.23Å; G690-K694 PolarHBondContact O-N 3.21Å
691	D	77.4	Confident	74.9	Confident	88 Å²	88	85.1 Å²	85.1	47%	0.471	44%	0.436	S	S	.	.	H	α-helix	trans	-78.3	-35.3	-179.4	-74.3	-18	0	0	0	112.2	E688 K694 Q695	E688-D691 PolarHBondContact O-N 3.11Å; D691-K694 WeakPolarHBondContact O-CB 3.47Å; D691-K694 PolarHBondContact O-N 3.2Å; D691-K694 IonicContact OD1-NZ 3.75Å; D691-K694 PolarHBondContact OD1-NZ 3.17Å; D691-Q695 PolarHBondContact O-N 2.96Å
692	R	79.7	Confident	75.9	Confident	52 Å²	52	79.7 Å²	79.7	20%	0.196	40%	0.402	C	S	.	.	H	α-helix	trans	-65.3	-41.5	172.9	-64.6	-58	179.1	174.4	4.8	112.6	L676 E688 K694 Q695 L696	L676-R692 HydrophobicContact CD1-CB 4.3Å; L676-R692 HydrophobicContact CD2-CB 4.06Å; E688-R692 VanDerWaalsContact O-CG 3.3Å; E688-R692 WeakPolarHBondContact O-CG 2.86Å; E688-R692 PolarHBondContact O-N 3.26Å; E688-R692 IonicContact OE1-NH2 3.02Å; R692-K694 PolarHBondContact O-N 2.87Å; R692-Q695 VanDerWaalsContact CD-OE1 3.29Å; R692-Q695 WeakPolarHBondContact O-CB 3.43Å; R692-Q695 PolarHBondContact O-N 3.14Å; R692-Q695 VanDerWaalsContact O-N 3.08Å; R692-L696 WeakPolarHBondContact O-CG 3.22Å; R692-L696 PolarHBondContact O-N 3.29Å
693	R	80.9	Confident	76.9	Confident	124 Å²	124	73.8 Å²	73.8	47%	0.468	37%	0.367	S	S	.	.	H	α-helix	trans	-61.1	-32.7	172.7	-83.8	-168.4	-110.6	-147.5	-2	113.1	L676 V689 K697	L676-R693 HydrophobicContact CD1-CG 4.09Å; V689-R693 WeakPolarHBondContact O-CB 3.34Å; V689-R693 PolarHBondContact O-N 3.47Å; V689-R693 VanDerWaalsContact O-N 3.08Å; R693-K697 WeakPolarHBondContact O-CG 3.23Å; R693-K697 PolarHBondContact O-N 3.11Å; R693-K697 VanDerWaalsContact O-N 3.11Å
694	K	83.4	Confident	77.8	Confident	135 Å²	135	75.2 Å²	75.2	59%	0.587	38%	0.375	S	S	*	.	H	α-helix	trans	-68.7	-40.7	173.2	-67.4	168.9	-162.5	159.4	0	111.3	G690 D691 R692 K697 K698	G690-K694 WeakPolarHBondContact O-CG 3.23Å; G690-K694 PolarHBondContact O-N 3.21Å; D691-K694 WeakPolarHBondContact O-CB 3.47Å; D691-K694 PolarHBondContact O-N 3.2Å; D691-K694 IonicContact OD1-NZ 3.75Å; D691-K694 PolarHBondContact OD1-NZ 3.17Å; R692-K694 PolarHBondContact O-N 2.87Å; K694-K697 PolarHBondContact O-N 3.12Å; K694-K698 WeakPolarHBondContact O-CB 3.46Å; K694-K698 PolarHBondContact O-N 3.29Å
695	Q	83.6	Confident	79	Confident	55 Å²	55	76 Å²	76	26%	0.257	37%	0.369	S	S	.	.	H	α-helix	trans	-63.2	-41.9	175.9	-70.8	176.4	-9.9	0	0	112.2	D691 R692 K698 L699	D691-Q695 PolarHBondContact O-N 2.96Å; R692-Q695 VanDerWaalsContact CD-OE1 3.29Å; R692-Q695 WeakPolarHBondContact O-CB 3.43Å; R692-Q695 PolarHBondContact O-N 3.14Å; R692-Q695 VanDerWaalsContact O-N 3.08Å; Q695-K698 WeakPolarHBondContact O-CA 3.41Å; Q695-K698 WeakPolarHBondContact O-CB 3.36Å; Q695-K698 PolarHBondContact O-N 3.03Å; Q695-K698 VanDerWaalsContact O-N 3.13Å; Q695-L699 PolarHBondContact O-N 3.43Å
696	L	86.6	Confident	80.5	Confident	8 Å²	8	66.3 Å²	66.3	4%	0.042	33%	0.331	C	S	.	.	H	α-helix	trans	-64.6	-42.2	175.7	-68.3	177.9	0	0	0	112.7	C672 N673 L676 R692 K698 L699 Q700	C672-L696 HydrophobicContact CB-CD1 3.83Å; C672-L696 HydrophobicContact CB-CD2 3.7Å; C672-L696 HydrophobicContact CB-CG 4.29Å; N673-L696 WeakPolarHBondContact OD1-CD1 3.16Å; L676-L696 HydrophobicContact CD1-CD1 4.04Å; R692-L696 WeakPolarHBondContact O-CG 3.22Å; R692-L696 PolarHBondContact O-N 3.29Å; L696-K698 VanDerWaalsContact C-N 3.27Å; L696-K698 PolarHBondContact O-N 3.18Å; L696-L699 WeakPolarHBondContact O-CB 3.49Å; L696-L699 PolarHBondContact O-N 3.22Å; L696-Q700 PolarHBondContact O-N 2.78Å; L696-Q700 VanDerWaalsContact O-N 3.11Å
697	K	85.4	Confident	81.6	Confident	142 Å²	142	63.3 Å²	63.3	62%	0.617	32%	0.318	S	S	*	.	H	α-helix	trans	-61	-39.6	171.5	-74.4	179.4	-179.6	-175.5	0	111.2	R693 K694 Q700 T701	R693-K697 WeakPolarHBondContact O-CG 3.23Å; R693-K697 PolarHBondContact O-N 3.11Å; R693-K697 VanDerWaalsContact O-N 3.11Å; K694-K697 PolarHBondContact O-N 3.12Å; K697-Q700 PolarHBondContact O-N 2.84Å; K697-T701 VanDerWaalsContact O-CG2 3.25Å; K697-T701 WeakPolarHBondContact O-CG2 3.29Å; K697-T701 PolarHBondContact O-N 3.49Å; K697-T701 PolarHBondContact O-OG1 2.83Å
698	K	89.1	Confident	82.8	Confident	100 Å²	100	63.4 Å²	63.4	44%	0.435	30%	0.304	S	S	.	.	H	α-helix	trans	-61.8	-48.5	176.8	-174.6	179.5	167.9	-161.5	0	111.3	T335 K694 Q695 L696 Q700 T701 D702	T335-K698 HydrophobicContact CG2-CB 4.39Å; T335-K698 HydrophobicContact CG2-CD 3.67Å; T335-K698 HydrophobicContact CG2-CG 4.02Å; K694-K698 WeakPolarHBondContact O-CB 3.46Å; K694-K698 PolarHBondContact O-N 3.29Å; Q695-K698 WeakPolarHBondContact O-CA 3.41Å; Q695-K698 WeakPolarHBondContact O-CB 3.36Å; Q695-K698 PolarHBondContact O-N 3.03Å; Q695-K698 VanDerWaalsContact O-N 3.13Å; L696-K698 VanDerWaalsContact C-N 3.27Å; L696-K698 PolarHBondContact O-N 3.18Å; K698-Q700 VanDerWaalsContact C-N 3.33Å; K698-Q700 PolarHBondContact O-N 3.34Å; K698-T701 WeakPolarHBondContact CA-OG1 3.22Å; K698-T701 PolarHBondContact O-N 3.23Å; K698-T701 VanDerWaalsContact O-N 3.11Å; K698-T701 PolarHBondContact O-OG1 3.32Å; K698-D702 WeakPolarHBondContact CE-OD2 3.29Å; K698-D702 WeakPolarHBondContact CG-OD2 3.49Å; K698-D702 WeakPolarHBondContact O-CB 3.39Å; K698-D702 PolarHBondContact O-N 3.35Å
699	L	90.1	Very high	83.7	Confident	0 Å²	0	59.4 Å²	59.4	0%	0	29%	0.286	C	S	.	.	H	α-helix	trans	-52.4	-49.6	175.3	-175.5	74.8	0	0	0	111.4	W332 T335 A336 I668 Q695 L696 D702 G703	W332-L699 VanDerWaalsContact CD1-CD1 3.47Å; W332-L699 HydrophobicContact CD2-CD1 4.32Å; W332-L699 HydrophobicContact CG-CD1 4Å; W332-L699 WeakPolarHBondContact O-CD1 3.29Å; T335-L699 WeakPolarHBondContact OG1-CD1 3.36Å; A336-L699 HydrophobicContact CB-CD1 3.84Å; I668-L699 HydrophobicContact CB-CD2 4.21Å; I668-L699 HydrophobicContact CG2-CD2 3.9Å; Q695-L699 PolarHBondContact O-N 3.43Å; L696-L699 WeakPolarHBondContact O-CB 3.49Å; L696-L699 PolarHBondContact O-N 3.22Å; L699-D702 PolarHBondContact O-N 3.36Å; L699-G703 PolarHBondContact O-N 2.84Å
700	Q	87.7	Confident	84.5	Confident	89 Å²	89	59.4 Å²	59.4	42%	0.416	29%	0.286	S	S	.	.	H	α-helix	trans	-64	-43.6	177.1	-69.1	-178.9	-15.4	0	0	112.6	L696 K697 K698 D702 N704	L696-Q700 PolarHBondContact O-N 2.78Å; L696-Q700 VanDerWaalsContact O-N 3.11Å; K697-Q700 PolarHBondContact O-N 2.84Å; K698-Q700 VanDerWaalsContact C-N 3.33Å; K698-Q700 PolarHBondContact O-N 3.34Å; Q700-D702 PolarHBondContact O-N 3.09Å; Q700-N704 VanDerWaalsContact O-CB 3.3Å; Q700-N704 WeakPolarHBondContact O-CB 3.49Å; Q700-N704 PolarHBondContact O-N 3.01Å; Q700-N704 PolarHBondContact O-ND2 3.35Å
701	T	87.6	Confident	85.1	Confident	64 Å²	64	60.1 Å²	60.1	39%	0.393	28%	0.279	S	S	.	.	H	α-helix	trans	-65.6	-39.4	-180	57.1	0	0	0	0	112.3	K697 K698 K705	K697-T701 VanDerWaalsContact O-CG2 3.25Å; K697-T701 WeakPolarHBondContact O-CG2 3.29Å; K697-T701 PolarHBondContact O-N 3.49Å; K697-T701 PolarHBondContact O-OG1 2.83Å; K698-T701 WeakPolarHBondContact CA-OG1 3.22Å; K698-T701 PolarHBondContact O-N 3.23Å; K698-T701 VanDerWaalsContact O-N 3.11Å; K698-T701 PolarHBondContact O-OG1 3.32Å; T701-K705 WeakPolarHBondContact O-CB 3.4Å; T701-K705 WeakPolarHBondContact O-CG 3.25Å; T701-K705 PolarHBondContact O-N 3.34Å
702	D	88.6	Confident	85.3	Confident	14 Å²	14	60.2 Å²	60.2	8%	0.075	28%	0.278	C	S	.	.	H	α-helix	trans	-75.1	-39.2	-178.2	-69.5	-16.4	0	0	0	110.4	S328 W332 K698 L699 Q700 N704 K705 W706	S328-D702 WeakPolarHBondContact CB-O 3.44Å; W332-D702 HydrophobicContact CB-CB 4.24Å; K698-D702 WeakPolarHBondContact CE-OD2 3.29Å; K698-D702 WeakPolarHBondContact CG-OD2 3.49Å; K698-D702 WeakPolarHBondContact O-CB 3.39Å; K698-D702 PolarHBondContact O-N 3.35Å; L699-D702 PolarHBondContact O-N 3.36Å; Q700-D702 PolarHBondContact O-N 3.09Å; D702-N704 PolarHBondContact O-N 3.18Å; D702-K705 PolarHBondContact O-N 2.98Å; D702-K705 IonicContact OD1-NZ 3.53Å; D702-K705 PolarHBondContact OD1-NZ 3.24Å; D702-W706 PolarHBondContact O-N 2.88Å
703	G	86.4	Confident	85.2	Confident	3 Å²	3	58.4 Å²	58.4	3%	0.031	27%	0.273	C	S	.	.	H	α-helix	trans	-60.3	-43.9	170.1	0	0	0	0	0	113.1	L699 W706 L707	L699-G703 PolarHBondContact O-N 2.84Å; G703-W706 WeakPolarHBondContact O-CB 3.19Å; G703-W706 PolarHBondContact O-N 3.44Å; G703-L707 WeakPolarHBondContact O-CG 3.13Å; G703-L707 PolarHBondContact O-N 3.24Å
704	N	85.8	Confident	84.9	Confident	97 Å²	97	52.7 Å²	52.7	52%	0.519	25%	0.251	S	S	.	.	H	α-helix	trans	-67	-40.5	177.3	-73.1	-21.3	0	0	0	112.5	Q700 D702 W706 L707 E708	Q700-N704 VanDerWaalsContact O-CB 3.3Å; Q700-N704 WeakPolarHBondContact O-CB 3.49Å; Q700-N704 PolarHBondContact O-N 3.01Å; Q700-N704 PolarHBondContact O-ND2 3.35Å; D702-N704 PolarHBondContact O-N 3.18Å; N704-W706 VanDerWaalsContact C-N 3.3Å; N704-W706 PolarHBondContact O-N 3.07Å; N704-L707 PolarHBondContact O-N 2.93Å; N704-E708 WeakPolarHBondContact O-CG 3.49Å; N704-E708 PolarHBondContact O-N 3.02Å
705	K	86.3	Confident	84.4	Confident	112 Å²	112	52 Å²	52	49%	0.487	25%	0.248	S	C	.	.	H	α-helix	trans	-59.1	-44	173.6	-75.3	168.6	-158.7	157.9	0	110.9	T701 D702 L707 E708 S709	T701-K705 WeakPolarHBondContact O-CB 3.4Å; T701-K705 WeakPolarHBondContact O-CG 3.25Å; T701-K705 PolarHBondContact O-N 3.34Å; D702-K705 PolarHBondContact O-N 2.98Å; D702-K705 IonicContact OD1-NZ 3.53Å; D702-K705 PolarHBondContact OD1-NZ 3.24Å; K705-L707 PolarHBondContact O-N 3.02Å; K705-E708 PolarHBondContact O-N 3.06Å; K705-S709 WeakPolarHBondContact O-CB 3.43Å; K705-S709 PolarHBondContact O-N 3.03Å; K705-S709 PolarHBondContact O-OG 3.46Å; K705-S709 VanDerWaalsContact O-OG 3.06Å
706	W	89.2	Confident	83.5	Confident	0 Å²	0	52.8 Å²	52.8	0%	0	27%	0.271	C	S	.	.	H	α-helix	trans	-59.6	-47.2	176.9	-170.6	91.8	0	0	0	111.4	L325 Q614 W617 L657 L661 D702 G703 N704 E708 S709 V710	L325-W706 HydrophobicContact CG-CG 4.41Å; Q614-W706 HydrophobicContact CB-CZ2 4.07Å; Q614-W706 HydrophobicContact CG-CH2 4.15Å; Q614-W706 HydrophobicContact CG-CZ2 3.6Å; Q614-W706 VanDerWaalsContact NE2-CE2 3.26Å; W617-W706 HydrophobicContact CE3-CZ2 4.47Å; L657-W706 HydrophobicContact CB-CH2 3.92Å; L661-W706 HydrophobicContact CD2-CB 4.24Å; L661-W706 HydrophobicContact CD2-CD2 3.87Å; L661-W706 HydrophobicContact CD2-CE3 3.31Å; L661-W706 HydrophobicContact CD2-CG 4.27Å; L661-W706 HydrophobicContact CD2-CZ3 3.94Å; D702-W706 PolarHBondContact O-N 2.88Å; G703-W706 WeakPolarHBondContact O-CB 3.19Å; G703-W706 PolarHBondContact O-N 3.44Å; N704-W706 VanDerWaalsContact C-N 3.3Å; N704-W706 PolarHBondContact O-N 3.07Å; W706-E708 PolarHBondContact O-N 3.11Å; W706-S709 PolarHBondContact O-N 2.86Å; W706-V710 HydrophobicContact CD2-CG2 3.86Å; W706-V710 HydrophobicContact CE3-CG2 3.8Å; W706-V710 HydrophobicContact CH2-CG2 3.74Å; W706-V710 HydrophobicContact CZ2-CG2 3.77Å; W706-V710 HydrophobicContact CZ3-CG2 3.76Å; W706-V710 VanDerWaalsContact O-CG2 3.27Å; W706-V710 WeakPolarHBondContact O-CG2 3.35Å; W706-V710 PolarHBondContact O-N 3.22Å
707	L	86.4	Confident	82.5	Confident	22 Å²	22	54.4 Å²	54.4	12%	0.115	28%	0.28	C	S	.	.	H	α-helix	trans	-60.2	-44.9	177.5	-69.3	169.8	0	0	0	112.8	L661 V662 G703 N704 K705 V710 K711	L661-L707 HydrophobicContact CD2-CD2 4.31Å; L661-L707 HydrophobicContact CD2-CG 4.2Å; V662-L707 HydrophobicContact CG2-CD1 3.55Å; V662-L707 HydrophobicContact CG2-CD2 4.41Å; G703-L707 WeakPolarHBondContact O-CG 3.13Å; G703-L707 PolarHBondContact O-N 3.24Å; N704-L707 PolarHBondContact O-N 2.93Å; K705-L707 PolarHBondContact O-N 3.02Å; L707-V710 PolarHBondContact O-N 3.27Å; L707-K711 WeakPolarHBondContact O-CB 3.25Å; L707-K711 VanDerWaalsContact O-CG 3.26Å; L707-K711 WeakPolarHBondContact O-CG 3.37Å; L707-K711 PolarHBondContact O-N 3.44Å
708	E	84.6	Confident	81.1	Confident	91 Å²	91	49.6 Å²	49.6	43%	0.425	26%	0.261	S	S	.	.	H	α-helix	trans	-66.8	-41.4	178.5	-68.7	-53.9	130.4	0	0	111.7	N704 K705 W706 V710 K711 I712	N704-E708 WeakPolarHBondContact O-CG 3.49Å; N704-E708 PolarHBondContact O-N 3.02Å; K705-E708 PolarHBondContact O-N 3.06Å; W706-E708 PolarHBondContact O-N 3.11Å; E708-V710 PolarHBondContact O-N 2.91Å; E708-K711 PolarHBondContact O-N 3.02Å; E708-K711 IonicContact OE1-NZ 3.64Å; E708-K711 PolarHBondContact OE1-NZ 3.35Å; E708-I712 VanDerWaalsContact O-CG1 3.27Å; E708-I712 WeakPolarHBondContact O-CG1 3.37Å; E708-I712 PolarHBondContact O-N 2.89Å
709	S	84.2	Confident	79	Confident	9 Å²	9	54.5 Å²	54.5	6%	0.063	29%	0.285	C	S	.	.	H	α-helix	trans	-61.4	-43.3	174	-62.9	0	0	0	0	112	K705 W706 I712 L713	K705-S709 WeakPolarHBondContact O-CB 3.43Å; K705-S709 PolarHBondContact O-N 3.03Å; K705-S709 PolarHBondContact O-OG 3.46Å; K705-S709 VanDerWaalsContact O-OG 3.06Å; W706-S709 PolarHBondContact O-N 2.86Å; S709-I712 PolarHBondContact O-N 3.14Å; S709-L713 WeakPolarHBondContact O-CB 3.46Å; S709-L713 WeakPolarHBondContact O-CD1 3.13Å; S709-L713 VanDerWaalsContact O-CG 3.25Å; S709-L713 WeakPolarHBondContact O-CG 3.39Å; S709-L713 PolarHBondContact O-N 3.22Å
710	V	83.8	Confident	77	Confident	7 Å²	7	64.1 Å²	64.1	4%	0.042	33%	0.327	C	S	.	.	H	α-helix	trans	-62.6	-45.7	175.3	171.5	0	0	0	0	111.2	L325 W617 A654 W706 L707 E708 I712 L713 L714	L325-V710 HydrophobicContact CD1-CG2 3.67Å; L325-V710 HydrophobicContact CG-CG2 4.4Å; W617-V710 HydrophobicContact CH2-CB 4.36Å; W617-V710 HydrophobicContact CH2-CG1 4.04Å; W617-V710 HydrophobicContact CH2-CG2 3.83Å; W617-V710 HydrophobicContact CZ2-CG1 4.22Å; W617-V710 HydrophobicContact CZ3-CG2 3.9Å; A654-V710 HydrophobicContact CB-CG1 4.01Å; W706-V710 HydrophobicContact CD2-CG2 3.86Å; W706-V710 HydrophobicContact CE3-CG2 3.8Å; W706-V710 HydrophobicContact CH2-CG2 3.74Å; W706-V710 HydrophobicContact CZ2-CG2 3.77Å; W706-V710 HydrophobicContact CZ3-CG2 3.76Å; W706-V710 VanDerWaalsContact O-CG2 3.27Å; W706-V710 WeakPolarHBondContact O-CG2 3.35Å; W706-V710 PolarHBondContact O-N 3.22Å; L707-V710 PolarHBondContact O-N 3.27Å; E708-V710 PolarHBondContact O-N 2.91Å; V710-I712 VanDerWaalsContact C-N 3.34Å; V710-I712 PolarHBondContact O-N 3.42Å; V710-L713 PolarHBondContact O-N 3.38Å; V710-L714 HydrophobicContact CG1-CD1 3.65Å; V710-L714 HydrophobicContact CG1-CG 4.08Å; V710-L714 WeakPolarHBondContact O-CB 3.2Å; V710-L714 VanDerWaalsContact O-CG 3.29Å; V710-L714 WeakPolarHBondContact O-CG 3.37Å; V710-L714 PolarHBondContact O-N 2.96Å
711	K	80.8	Confident	75	Confident	50 Å²	50	61.9 Å²	61.9	22%	0.217	32%	0.316	C	S	.	.	H	α-helix	trans	-57.9	-45.3	178	-75.9	172.2	-173.4	173.8	0	111.9	L707 E708 K715 L725	L707-K711 WeakPolarHBondContact O-CB 3.25Å; L707-K711 VanDerWaalsContact O-CG 3.26Å; L707-K711 WeakPolarHBondContact O-CG 3.37Å; L707-K711 PolarHBondContact O-N 3.44Å; E708-K711 PolarHBondContact O-N 3.02Å; E708-K711 IonicContact OE1-NZ 3.64Å; E708-K711 PolarHBondContact OE1-NZ 3.35Å; K711-K715 WeakPolarHBondContact O-CG 2.77Å; K711-K715 PolarHBondContact O-N 3.29Å; K711-L725 HydrophobicContact CG-CD1 4.4Å
712	I	80.6	Confident	72.7	Confident	90 Å²	90	66.9 Å²	66.9	46%	0.462	34%	0.335	S	S	.	.	H	α-helix	trans	-64.2	-44	179.1	-65.7	164.9	0	0	0	110.6	L321 E708 S709 V710 K715 G716	L321-I712 HydrophobicContact CD1-CG2 3.7Å; E708-I712 VanDerWaalsContact O-CG1 3.27Å; E708-I712 WeakPolarHBondContact O-CG1 3.37Å; E708-I712 PolarHBondContact O-N 2.89Å; S709-I712 PolarHBondContact O-N 3.14Å; V710-I712 VanDerWaalsContact C-N 3.34Å; V710-I712 PolarHBondContact O-N 3.42Å; I712-K715 PolarHBondContact O-N 3.31Å; I712-G716 PolarHBondContact O-N 3.46Å
713	L	77.8	Confident	70.6	Confident	15 Å²	15	75.1 Å²	75.1	8%	0.079	37%	0.373	C	S	.	.	H	α-helix	trans	-66.9	-39.5	-179.9	-72.2	163.4	0	0	0	112.4	L321 L325 L621 M625 S709 V710 G716 L717	L321-L713 HydrophobicContact CB-CD1 4.23Å; L321-L713 HydrophobicContact CB-CD2 3.99Å; L321-L713 HydrophobicContact CB-CG 4.21Å; L321-L713 HydrophobicContact CD1-CD2 3.98Å; L321-L713 HydrophobicContact CD1-CG 4.27Å; L325-L713 HydrophobicContact CD1-CD1 3.56Å; L621-L713 HydrophobicContact CD2-CD1 3.89Å; M625-L713 HydrophobicContact CE-CD2 4.16Å; M625-L713 HydrophobicContact SD-CD2 4.12Å; S709-L713 WeakPolarHBondContact O-CB 3.46Å; S709-L713 WeakPolarHBondContact O-CD1 3.13Å; S709-L713 VanDerWaalsContact O-CG 3.25Å; S709-L713 WeakPolarHBondContact O-CG 3.39Å; S709-L713 PolarHBondContact O-N 3.22Å; V710-L713 PolarHBondContact O-N 3.38Å; L713-G716 PolarHBondContact O-N 3.43Å; L713-L717 WeakPolarHBondContact O-CG 3.48Å; L713-L717 PolarHBondContact O-N 3.39Å
714	L	74.6	Confident	68.6	Low	3 Å²	3	82.5 Å²	82.5	2%	0.016	41%	0.407	C	S	.	.	H	α-helix	trans	-69.4	-35.9	176.8	-69.5	176.8	0	0	0	112.9	W617 L650 V651 A654 V710 G716 L717 N718	W617-L714 HydrophobicContact CZ2-CD2 4.29Å; L650-L714 HydrophobicContact CD2-CD2 4.45Å; V651-L714 HydrophobicContact CG2-CD2 3.98Å; A654-L714 HydrophobicContact CB-CD1 3.73Å; A654-L714 HydrophobicContact CB-CD2 4.29Å; A654-L714 HydrophobicContact CB-CG 4.49Å; V710-L714 HydrophobicContact CG1-CD1 3.65Å; V710-L714 HydrophobicContact CG1-CG 4.08Å; V710-L714 WeakPolarHBondContact O-CB 3.2Å; V710-L714 VanDerWaalsContact O-CG 3.29Å; V710-L714 WeakPolarHBondContact O-CG 3.37Å; V710-L714 PolarHBondContact O-N 2.96Å; L714-G716 VanDerWaalsContact C-N 3.26Å; L714-G716 PolarHBondContact O-N 3.22Å; L714-L717 PolarHBondContact O-N 3.45Å; L714-L717 VanDerWaalsContact O-N 3.13Å; L714-N718 PolarHBondContact O-N 3.4Å
715	K	72.7	Confident	66.4	Low	120 Å²	120	80.5 Å²	80.5	52%	0.522	40%	0.396	S	S	.	.	H	α-helix	trans	-62.5	-33.7	172.4	-77.8	-176.7	176.3	-167.5	0	112.3	K711 I712 L717	K711-K715 WeakPolarHBondContact O-CG 2.77Å; K711-K715 PolarHBondContact O-N 3.29Å; I712-K715 PolarHBondContact O-N 3.31Å; K715-L717 VanDerWaalsContact C-N 3.31Å
716	G	66.1	Low	64.3	Low	72 Å²	72	81.7 Å²	81.7	74%	0.742	41%	0.406	S	S	*	.	H	α-helix	trans	-72.7	-19.4	174.2	0	0	0	0	0	114.6	I712 L713 L714	I712-G716 PolarHBondContact O-N 3.46Å; L713-G716 PolarHBondContact O-N 3.43Å; L714-G716 VanDerWaalsContact C-N 3.26Å; L714-G716 PolarHBondContact O-N 3.22Å
717	L	64.8	Low	61.7	Low	42 Å²	42	90.2 Å²	90.2	22%	0.22	45%	0.446	C	S	.	.	H	α-helix	trans	-94.6	-19.2	-178.5	-72.3	168	0	0	0	113.7	L621 L650 L713 L714 K715	L621-L717 HydrophobicContact CD1-CD1 3.73Å; L650-L717 HydrophobicContact CD2-CD1 4.22Å; L713-L717 WeakPolarHBondContact O-CG 3.48Å; L713-L717 PolarHBondContact O-N 3.39Å; L714-L717 PolarHBondContact O-N 3.45Å; L714-L717 VanDerWaalsContact O-N 3.13Å; K715-L717 VanDerWaalsContact C-N 3.31Å
718	N	56.4	Low	59.4	Low	41 Å²	41	96.8 Å²	96.8	22%	0.219	48%	0.476	C	S	.	.			trans	-140.2	116.3	-179.9	-80.9	-35.9	0	0	0	111.5	L714 K720 F721	L714-N718 PolarHBondContact O-N 3.4Å; N718-K720 PolarHBondContact O-N 2.99Å; N718-F721 HydrophobicContact CB-CB 4.31Å; N718-F721 HydrophobicContact CB-CD2 3.41Å; N718-F721 VanDerWaalsContact CB-CD2 3.41Å; N718-F721 HydrophobicContact CB-CE2 4.16Å; N718-F721 HydrophobicContact CB-CG 4.25Å; N718-F721 WeakPolarHBondContact ND2-CD2 3.5Å; N718-F721 WeakPolarHBondContact ND2-CE2 3.26Å; N718-F721 PolarHBondContact O-N 2.97Å
719	E	45.7	Very low	56.7	Low	204 Å²	204	96.8 Å²	96.8	95%	0.953	48%	0.484	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.4	-4.5	173.9	-69.4	-178.7	161.2	0	0	114.1
720	K	46.3	Very low	54.1	Low	201 Å²	201	104 Å²	104	87%	0.874	52%	0.516	S	S	*	.	T	Hydrogen-bonded Turn	trans	-106.6	13.1	-178.6	-69.4	-176.1	177.9	178.2	0	114.9	N718 E722	N718-K720 PolarHBondContact O-N 2.99Å; K720-E722 PolarHBondContact O-N 3.37Å
721	F	45.7	Very low	51.7	Low	43 Å²	43	113.3 Å²	113.3	19%	0.189	56%	0.56	C	S	.	*			trans	-94.4	62.3	-173.6	-111.4	-94.3	0	0	0	112.7	V651 N718 L725	V651-F721 HydrophobicContact CG1-CE1 4.32Å; V651-F721 HydrophobicContact CG1-CE2 3.77Å; V651-F721 HydrophobicContact CG1-CZ 3.28Å; V651-F721 HydrophobicContact CG2-CE2 4.31Å; V651-F721 HydrophobicContact CG2-CZ 4.44Å; N718-F721 HydrophobicContact CB-CB 4.31Å; N718-F721 HydrophobicContact CB-CD2 3.41Å; N718-F721 VanDerWaalsContact CB-CD2 3.41Å; N718-F721 HydrophobicContact CB-CE2 4.16Å; N718-F721 HydrophobicContact CB-CG 4.25Å; N718-F721 WeakPolarHBondContact ND2-CD2 3.5Å; N718-F721 WeakPolarHBondContact ND2-CE2 3.26Å; N718-F721 PolarHBondContact O-N 2.97Å; F721-L725 HydrophobicContact CD1-CD1 4.14Å; F721-L725 HydrophobicContact CE1-CD1 4.05Å
722	E	40.8	Very low	49.1	Very low	168 Å²	168	115.4 Å²	115.4	79%	0.785	58%	0.577	S	S	*	*			trans	-100.2	-23.6	-179.5	-81.1	-138.2	134.8	0	0	117.8	K720	K720-E722 PolarHBondContact O-N 3.37Å
723	E	44.3	Very low	46.9	Very low	188 Å²	188	117.4 Å²	117.4	88%	0.879	60%	0.599	S	S	*	*	S	Bend	trans	-129.4	6.9	-162.5	-84.6	177.8	159.5	0	0	120.4
724	E	43.4	Very low	44.7	Very low	157 Å²	157	121.9 Å²	121.9	73%	0.734	63%	0.631	S	S	*	*	S	Bend	trans	-118.5	2.4	-176.9	-79.5	-174.3	170.5	0	0	117	K655	K655-E724 IonicContact NZ-OE2 3.54Å; K655-E724 PolarHBondContact NZ-OE2 3.12Å
725	L	40	Very low	42.7	Very low	56 Å²	56	124.2 Å²	124.2	29%	0.293	65%	0.648	S	S	.	*	S	Bend	trans	-109.2	4.5	-177.7	-83.6	162.5	0	0	0	114.1	K711 F721	K711-L725 HydrophobicContact CG-CD1 4.4Å; F721-L725 HydrophobicContact CD1-CD1 4.14Å; F721-L725 HydrophobicContact CE1-CD1 4.05Å
726	I	42.1	Very low	40.9	Very low	137 Å²	137	121.5 Å²	121.5	70%	0.703	64%	0.642	S	S	*	*			trans	-118.6	66.1	173.4	-46.4	176.8	0	0	0	108.4
727	E	34.9	Very low	39.6	Very low	178 Å²	178	126.2 Å²	126.2	83%	0.832	65%	0.645	S	S	*	*			trans	-117.9	98.4	132	-74.9	-174	177.2	0	0	104.9
728	Q	37.1	Very low	38.5	Very low	161 Å²	161	127.8 Å²	127.8	75%	0.752	66%	0.658	S	S	*	*			trans	-53.6	127	135	-70.2	-165.1	-5.7	0	0	103.9	E730	Q728-E730 VanDerWaalsContact C-N 3.31Å; Q728-E730 PolarHBondContact O-N 3.3Å
729	P	29.4	Very low	38.2	Very low	90 Å²	90	127.5 Å²	127.5	58%	0.584	66%	0.658	S	S	*	*			trans	-56	112	164.6	-11.8	24.9	0	0	0	104.4
730	E	27.9	Very low	38.1	Very low	160 Å²	160	125.6 Å²	125.6	75%	0.748	65%	0.649	S	S	*	*			trans	-48.3	151.5	157.6	-71.7	-166.5	157.7	0	0	107	Q728 T732	Q728-E730 VanDerWaalsContact C-N 3.31Å; Q728-E730 PolarHBondContact O-N 3.3Å; E730-T732 PolarHBondContact O-N 3.44Å; E730-T732 PolarHBondContact O-OG1 3.09Å
731	E	35.1	Very low	37.8	Very low	204 Å²	204	118.9 Å²	118.9	95%	0.953	63%	0.628	S	S	*	*	S	Bend	trans	-56.2	75.5	174.7	-64.2	177.8	154.2	0	0	111.1
732	T	25.9	Very low	37.7	Very low	94 Å²	94	119.4 Å²	119.4	58%	0.577	63%	0.631	S	S	*	*			trans	-151	92.8	174.8	39.7	0	0	0	0	109	E730 S734	E730-T732 PolarHBondContact O-N 3.44Å; E730-T732 PolarHBondContact O-OG1 3.09Å; T732-S734 VanDerWaalsContact C-N 3.27Å; T732-S734 PolarHBondContact O-N 3.33Å
733	S	33.1	Very low	37.3	Very low	132 Å²	132	119.3 Å²	119.3	92%	0.923	63%	0.631	S	S	*	*	S	Bend	trans	31.3	25.4	138.3	71.1	0	0	0	0	122.7
734	S	32	Very low	36.6	Very low	108 Å²	108	115.8 Å²	115.8	76%	0.755	62%	0.623	S	S	*	*			trans	-128.6	123.9	165	84	0	0	0	0	111	T732	T732-S734 VanDerWaalsContact C-N 3.27Å; T732-S734 PolarHBondContact O-N 3.33Å
735	S	32.5	Very low	36.1	Very low	53 Å²	53	114.3 Å²	114.3	37%	0.371	62%	0.616	S	S	.	*	P	Polyproline II helix	trans	-100.1	150.9	-166.3	120.6	0	0	0	0	111.2	D471	D471-S735 VanDerWaalsContact OD2-CB 3.29Å; D471-S735 WeakPolarHBondContact OD2-CB 3.34Å; D471-S735 PolarHBondContact OD2-OG 3.01Å
736	P	35.3	Very low	35.4	Very low	62 Å²	62	115.6 Å²	115.6	40%	0.403	63%	0.634	S	S	.	*	P	Polyproline II helix	trans	-81.2	129.3	-179.4	24.5	-18.5	0	0	0	112.1	Y663	Y663-P736 HydrophobicContact CD2-CG 4.4Å
737	Q	38.8	Very low	34.6	Very low	171 Å²	171	118.2 Å²	118.2	80%	0.799	64%	0.644	S	S	*	*	P	Polyproline II helix	trans	-58.6	151.8	170.1	-79.3	-168.5	-35.3	0	0	112.6	P739	Q737-P739 WeakPolarHBondContact O-CD 3.45Å
738	P	42.8	Very low	34.2	Very low	75 Å²	75	114.3 Å²	114.3	49%	0.487	64%	0.636	S	S	.	*	P	Polyproline II helix	trans	-59.8	124.8	177.3	23.2	-31.9	0	0	0	110.8	V472	V472-P738 HydrophobicContact CG2-CG 3.95Å
739	P	49.7	Very low	33.7	Very low	35 Å²	35	116.4 Å²	116.4	23%	0.227	64%	0.638	C	S	.	*	P	Polyproline II helix	trans	-72.3	136.6	177.1	26.3	-32.2	0	0	0	111.4	K660 Q737 S741	K660-P739 HydrophobicContact CB-CG 4.42Å; K660-P739 HydrophobicContact CD-CG 4.25Å; K660-P739 HydrophobicContact CG-CB 3.86Å; K660-P739 HydrophobicContact CG-CG 3.36Å; Q737-P739 WeakPolarHBondContact O-CD 3.45Å; P739-S741 PolarHBondContact O-N 3.06Å
740	E	42.9	Very low	33.5	Very low	164 Å²	164	118.4 Å²	118.4	77%	0.766	65%	0.653	S	S	*	*			trans	-44.2	134.1	-179.7	-68.7	175.6	168.4	0	0	113.2	K660	K660-E740 VanDerWaalsContact CE-O 3.29Å; K660-E740 WeakPolarHBondContact CE-O 3.44Å; K660-E740 PolarHBondContact NZ-O 2.95Å; K660-E740 VanDerWaalsContact NZ-O 3.13Å
741	S	40.5	Very low	33.4	Very low	61 Å²	61	118.8 Å²	118.8	43%	0.427	66%	0.655	S	S	.	*			trans	-57.6	139.3	175.7	49.6	0	0	0	0	111	P739 E743 T744	P739-S741 PolarHBondContact O-N 3.06Å; S741-E743 PolarHBondContact O-N 3.06Å; S741-T744 PolarHBondContact OG-OG1 3.36Å
742	M	43.1	Very low	33	Very low	53 Å²	53	119.5 Å²	119.5	26%	0.261	65%	0.65	S	S	.	*	G	3₁₀ helix	trans	-69.6	-10.7	-178	-71.2	-133.1	-134.2	0	0	113.8	L657	L657-M742 HydrophobicContact CD2-CE 3.8Å
743	E	33	Very low	33	Very low	166 Å²	166	125.8 Å²	125.8	78%	0.776	67%	0.665	S	S	*	*	G	3₁₀ helix	trans	-82.8	-19.7	-170.3	-67.5	-171.6	151	0	0	114.5	S741 Q745	S741-E743 PolarHBondContact O-N 3.06Å; E743-Q745 VanDerWaalsContact C-N 3.33Å; E743-Q745 PolarHBondContact O-N 3.06Å
744	T	30.1	Very low	32.7	Very low	115 Å²	115	124.3 Å²	124.3	71%	0.706	66%	0.655	S	S	*	*	G	3₁₀ helix	trans	-83.9	6.3	-171.2	6.1	0	0	0	0	115.8	S741	S741-T744 PolarHBondContact OG-OG1 3.36Å
745	Q	31	Very low	32.6	Very low	126 Å²	126	128.6 Å²	128.6	59%	0.589	66%	0.66	S	S	*	*	G	3₁₀ helix	trans	-131.3	6.3	179	-70.9	-174.7	-0.3	0	0	115.4	E743 E747	E743-Q745 VanDerWaalsContact C-N 3.33Å; E743-Q745 PolarHBondContact O-N 3.06Å; Q745-E747 VanDerWaalsContact C-N 3.26Å; Q745-E747 PolarHBondContact O-N 3Å
746	A	26.1	Very low	32.4	Very low	83 Å²	83	133.6 Å²	133.6	69%	0.686	68%	0.681	S	S	*	*	G	3₁₀ helix	trans	-71.9	-17.5	176.6	0	0	0	0	0	113.5
747	E	26.3	Very low	32	Very low	192 Å²	192	137.9 Å²	137.9	90%	0.897	70%	0.7	S	S	*	*	G	3₁₀ helix	trans	-82.2	-11.9	179.2	-67.7	-174.1	160.6	0	0	114.1	Q745	Q745-E747 VanDerWaalsContact C-N 3.26Å; Q745-E747 PolarHBondContact O-N 3Å
748	S	25.5	Very low	31.4	Very low	96 Å²	96	138.1 Å²	138.1	67%	0.671	71%	0.707	S	S	*	*	G	3₁₀ helix	trans	-92.3	-6.9	-174.2	-169.8	0	0	0	0	115
749	Y	25.8	Very low	30.7	Very low	204 Å²	204	139.1 Å²	139.1	80%	0.8	72%	0.721	S	S	*	*	G	3₁₀ helix	trans	-89.1	-3.6	-173.1	-88.5	-87.3	0	0	0	115.2	H751	Y749-H751 VanDerWaalsContact C-N 3.33Å; Y749-H751 PolarHBondContact O-N 3.36Å
750	C	25.6	Very low	30	Very low	133 Å²	133	144.3 Å²	144.3	90%	0.899	75%	0.752	S	S	*	*	G	3₁₀ helix	trans	-81.4	-2.6	178.7	-109.9	0	0	0	0	115
751	H	26.6	Very low	29.5	Very low	168 Å²	168	142.1 Å²	142.1	78%	0.778	75%	0.75	S	S	*	*	G	3₁₀ helix	trans	-104.6	4.7	-169	-134.8	-13.8	0	0	0	117.2	Y749	Y749-H751 VanDerWaalsContact C-N 3.33Å; Y749-H751 PolarHBondContact O-N 3.36Å
752	Y	25.9	Very low	29.2	Very low	218 Å²	218	147.7 Å²	147.7	86%	0.855	77%	0.774	S	S	*	*	S	Bend	trans	-103.8	10.2	-169.3	-136.2	-92.9	0	0	0	117.6
753	Y	26.4	Very low	28.9	Very low	226 Å²	226	153.2 Å²	153.2	89%	0.886	80%	0.799	S	S	*	*	S	Bend	trans	-109.8	21.3	177.2	-83.7	-76.1	0	0	0	115.9
754	S	26.3	Very low	29.3	Very low	102 Å²	102	154.2 Å²	154.2	71%	0.713	80%	0.796	S	S	*	*	S	Bend	trans	-115.4	21.8	-177.5	-176.2	0	0	0	0	115.9
755	K	29.6	Very low	29.8	Very low	197 Å²	197	152.3 Å²	152.3	86%	0.857	79%	0.785	S	S	*	*			trans	-138.2	92.6	173.4	-88.1	-178.9	177.8	172	0	110.7
756	I	29.2	Very low	30.3	Very low	158 Å²	158	148.7 Å²	148.7	81%	0.81	77%	0.772	S	S	*	*	S	Bend	trans	-178	101.7	139.6	-85.4	145.3	0	0	0	106
757	N	26.9	Very low	31.5	Very low	152 Å²	152	148.3 Å²	148.3	81%	0.813	76%	0.761	S	S	*	*			trans	161.1	86.4	142	-83.1	-16.4	0	0	0	110.2
758	N	25.9	Very low	32.4	Very low	176 Å²	176	145.8 Å²	145.8	94%	0.941	75%	0.747	S	S	*	*			trans	-94.3	104.4	155.2	-86.5	-12.3	0	0	0	107.7
759	A	27.3	Very low	33.5	Very low	96 Å²	96	146 Å²	146	79%	0.793	74%	0.74	S	S	*	*			trans	-134	122.9	154.9	0	0	0	0	0	107.4	V761	A759-V761 PolarHBondContact O-N 3.41Å
760	V	36.8	Very low	34.4	Very low	144 Å²	144	142.4 Å²	142.4	87%	0.873	73%	0.733	S	S	*	*			trans	-64.5	109	-170	174.3	0	0	0	0	111.3
761	V	31	Very low	35.1	Very low	119 Å²	119	139.2 Å²	139.2	72%	0.721	71%	0.707	S	S	*	*			trans	-137	119.4	146	178.4	0	0	0	0	105.8	A759 Q763	A759-V761 PolarHBondContact O-N 3.41Å; V761-Q763 VanDerWaalsContact C-N 3.3Å; V761-Q763 PolarHBondContact O-N 2.98Å
762	L	35.6	Very low	35.7	Very low	178 Å²	178	141.3 Å²	141.3	93%	0.932	71%	0.71	S	S	*	*			trans	-69.1	84	-178.3	-149.2	89.9	0	0	0	109.5
763	Q	35.1	Very low	36.6	Very low	169 Å²	169	135 Å²	135	79%	0.79	69%	0.691	S	S	*	*	P	Polyproline II helix	trans	-87.2	124.1	168.1	-78.1	-171.7	-8.7	0	0	109	V761	V761-Q763 VanDerWaalsContact C-N 3.3Å; V761-Q763 PolarHBondContact O-N 2.98Å
764	R	41.8	Very low	37.6	Very low	187 Å²	187	126.6 Å²	126.6	71%	0.706	67%	0.674	S	S	*	*	P	Polyproline II helix	trans	-58.2	136.8	172.1	-68.1	177.7	179.2	174.6	-2.9	109.3	T766 Y780	R764-T766 PolarHBondContact O-N 3.04Å; R764-Y780 HydrophobicContact CB-CD1 3.76Å; R764-Y780 HydrophobicContact CB-CE1 3.9Å
765	P	42	Very low	38.4	Very low	74 Å²	74	126.5 Å²	126.5	48%	0.481	67%	0.665	S	S	.	*	P	Polyproline II helix	trans	-61.4	122	177.4	24.9	-31.2	0	0	0	109.2	Q781	P765-Q781 HydrophobicContact CG-CB 4.27Å
766	T	40.7	Very low	39.5	Very low	51 Å²	51	122.4 Å²	122.4	31%	0.313	65%	0.651	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-119.3	128.3	-177.5	35.8	0	0	0	0	109.1	R764 Q778 Y780	R764-T766 PolarHBondContact O-N 3.04Å; T766-Q778 HydrophobicContact CG2-CB 4.46Å; T766-Y780 HydrophobicContact CG2-CD1 3.44Å; T766-Y780 VanDerWaalsContact CG2-CD1 3.44Å; T766-Y780 HydrophobicContact CG2-CE1 3.21Å; T766-Y780 HydrophobicContact CG2-CG 4.38Å
767	V	50.4	Low	40.5	Very low	74 Å²	74	119 Å²	119	45%	0.448	63%	0.634	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-93.5	125.3	172	-179	0	0	0	0	107.7	L769 Q778 V779	V767-L769 HydrophobicContact CG1-CD1 4.4Å; V767-L769 HydrophobicContact CG1-CG 4.27Å; V767-Q778 WeakPolarHBondContact O-CA 3.4Å; V767-V779 PolarHBondContact N-O 2.99Å; V767-V779 PolarHBondContact O-N 2.87Å
768	K	47.1	Very low	41.4	Very low	139 Å²	139	116.6 Å²	116.6	60%	0.604	62%	0.618	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-94.2	111.5	176.1	-72.5	-179.5	-171.6	-174.7	0	108.9	I776 I777 Q778	K768-I776 HydrophobicContact CB-CG2 3.77Å; K768-I776 HydrophobicContact CD-CG2 4.27Å; K768-I776 HydrophobicContact CG-CG2 4.09Å; K768-I777 WeakPolarHBondContact CA-O 3.44Å; K768-Q778 HydrophobicContact CD-CG 4.47Å; K768-Q778 HydrophobicContact CG-CG 3.65Å
769	L	48	Very low	42.6	Very low	101 Å²	101	111.3 Å²	111.3	53%	0.529	59%	0.591	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-103.9	138.8	177.2	-76.7	144.3	0	0	0	109.5	V767 I776 I777	V767-L769 HydrophobicContact CG1-CD1 4.4Å; V767-L769 HydrophobicContact CG1-CG 4.27Å; L769-I776 CarbonylContact O-C 3.52Å; L769-I776 VanDerWaalsContact O-CA 3.32Å; L769-I776 WeakPolarHBondContact O-CA 3.42Å; L769-I777 PolarHBondContact N-O 3.07Å; L769-I777 PolarHBondContact O-N 3.28Å
770	I	43.5	Very low	43.9	Very low	129 Å²	129	111.9 Å²	111.9	66%	0.662	57%	0.574	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-95.4	118.6	172.8	-55.4	176.2	0	0	0	106.8	N775 I776	I770-N775 WeakPolarHBondContact CA-O 3.49Å; I770-I776 HydrophobicContact CG1-CG1 4.27Å
771	D	40.2	Very low	44.4	Very low	65 Å²	65	109.6 Å²	109.6	35%	0.348	55%	0.554	S	S	.	*	P	Polyproline II helix	trans	-82.4	167.7	179.2	-160.8	9.2	0	0	0	111.3	D773 G774 N775 I777	D771-D773 WeakPolarHBondContact CB-OD1 3.33Å; D771-D773 PolarHBondContact O-N 3.23Å; D771-G774 PolarHBondContact O-N 2.99Å; D771-N775 PolarHBondContact N-O 2.93Å; D771-I777 HydrophobicContact CB-CD1 4.16Å
772	Y	40.5	Very low	45.2	Very low	212 Å²	212	111 Å²	111	83%	0.831	56%	0.557	S	S	*	*	T	Hydrogen-bonded Turn	trans	-60.5	-18.5	-173.7	60.6	-92.5	0	0	0	114.2
773	D	45.3	Very low	45.9	Very low	85 Å²	85	108.4 Å²	108.4	46%	0.455	54%	0.544	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92	-0.7	175.5	64.1	-12.8	0	0	0	113.3	D771 N775	D771-D773 WeakPolarHBondContact CB-OD1 3.33Å; D771-D773 PolarHBondContact O-N 3.23Å; D773-N775 PolarHBondContact OD1-N 3.26Å; D773-N775 PolarHBondContact OD2-ND2 3.18Å
774	G	46.7	Very low	46.7	Very low	51 Å²	51	104.5 Å²	104.5	53%	0.526	53%	0.529	S	S	.	.	S	Bend	trans	86.4	6	178.5	0	0	0	0	0	114.8	D771	D771-G774 PolarHBondContact O-N 2.99Å
775	N	43.4	Very low	47	Very low	99 Å²	99	99.8 Å²	99.8	53%	0.529	52%	0.516	S	S	.	.			trans	-83.1	142.6	178	-75.5	-42.8	0	0	0	112.4	I770 D771 D773	I770-N775 WeakPolarHBondContact CA-O 3.49Å; D771-N775 PolarHBondContact N-O 2.93Å; D773-N775 PolarHBondContact OD1-N 3.26Å; D773-N775 PolarHBondContact OD2-ND2 3.18Å
776	I	51.3	Low	47.7	Very low	112 Å²	112	99.5 Å²	99.5	57%	0.574	51%	0.513	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-97.4	111.9	-178.4	-55.2	179.3	0	0	0	110.2	K768 L769 I770	K768-I776 HydrophobicContact CB-CG2 3.77Å; K768-I776 HydrophobicContact CD-CG2 4.27Å; K768-I776 HydrophobicContact CG-CG2 4.09Å; L769-I776 CarbonylContact O-C 3.52Å; L769-I776 VanDerWaalsContact O-CA 3.32Å; L769-I776 WeakPolarHBondContact O-CA 3.42Å; I770-I776 HydrophobicContact CG1-CG1 4.27Å
777	I	50.5	Low	48.2	Very low	86 Å²	86	103.3 Å²	103.3	44%	0.441	53%	0.527	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	137.2	178.9	-45.6	175.7	0	0	0	109.5	K768 L769 D771 V779	K768-I777 WeakPolarHBondContact CA-O 3.44Å; L769-I777 PolarHBondContact N-O 3.07Å; L769-I777 PolarHBondContact O-N 3.28Å; D771-I777 HydrophobicContact CB-CD1 4.16Å; I777-V779 HydrophobicContact CG2-CG2 4.44Å
778	Q	46.8	Very low	48	Very low	102 Å²	102	101.7 Å²	101.7	48%	0.477	52%	0.516	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	122.8	176.7	-78.1	174.3	31.1	0	0	110.6	T766 V767 K768	T766-Q778 HydrophobicContact CG2-CB 4.46Å; V767-Q778 WeakPolarHBondContact O-CA 3.4Å; K768-Q778 HydrophobicContact CD-CG 4.47Å; K768-Q778 HydrophobicContact CG-CG 3.65Å
779	V	51.8	Low	47.8	Very low	64 Å²	64	99.2 Å²	99.2	39%	0.388	51%	0.514	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	140.4	178.2	-174.7	0	0	0	0	110.3	V767 I777	V767-V779 PolarHBondContact N-O 2.99Å; V767-V779 PolarHBondContact O-N 2.87Å; I777-V779 HydrophobicContact CG2-CG2 4.44Å
780	Y	54.5	Low	47.8	Very low	108 Å²	108	98.7 Å²	98.7	42%	0.424	53%	0.533	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.5	143.3	-178.6	-59.7	-75.4	0	0	0	111.4	R764 T766 D782	R764-Y780 HydrophobicContact CB-CD1 3.76Å; R764-Y780 HydrophobicContact CB-CE1 3.9Å; T766-Y780 HydrophobicContact CG2-CD1 3.44Å; T766-Y780 VanDerWaalsContact CG2-CD1 3.44Å; T766-Y780 HydrophobicContact CG2-CE1 3.21Å; T766-Y780 HydrophobicContact CG2-CG 4.38Å; Y780-D782 VanDerWaalsContact C-N 3.33Å; Y780-D782 PolarHBondContact O-N 2.84Å
781	Q	46.6	Very low	47.9	Very low	96 Å²	96	94.3 Å²	94.3	45%	0.449	52%	0.52	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.1	-14.2	-163.8	-151.4	170.9	6.7	0	0	115.8	P765	P765-Q781 HydrophobicContact CG-CB 4.27Å
782	D	48.6	Very low	48.1	Very low	150 Å²	150	99.2 Å²	99.2	80%	0.802	55%	0.546	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.2	-11.5	-169	-67.1	-28.5	0	0	0	115.1	Y780	Y780-D782 VanDerWaalsContact C-N 3.33Å; Y780-D782 PolarHBondContact O-N 2.84Å
783	D	48.8	Very low	48.3	Very low	123 Å²	123	96 Å²	96	66%	0.658	54%	0.539	S	S	*	.	S	Bend	trans	-91	-8.6	-163.2	-74.5	-25.9	0	0	0	115.8
784	N	52.6	Low	48.5	Very low	87 Å²	87	97.1 Å²	97.1	47%	0.465	54%	0.544	S	S	.	.			trans	-160.1	73.1	-176.1	-85.8	-36.1	0	0	0	115.6	M796 C797	N784-M796 HydrophobicContact CB-CE 4.05Å; N784-M796 CarbonylContact O-C 3.1Å; N784-M796 VanDerWaalsContact O-CA 3.25Å; N784-M796 WeakPolarHBondContact O-CA 3.11Å; N784-M796 VanDerWaalsContact O-SD 3.4Å; N784-C797 HydrophobicContact CB-CB 4.14Å; N784-C797 PolarHBondContact O-N 3.13Å
785	M	48.5	Very low	48.8	Very low	87 Å²	87	97.2 Å²	97.2	43%	0.429	53%	0.534	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	134	173.7	-72.7	-75.4	-160	0	0	112.5	L794 M796	M785-L794 HydrophobicContact CB-CD2 4.4Å; M785-L794 HydrophobicContact SD-CB 4.46Å; M785-M796 HydrophobicContact CE-CG 4Å; M785-M796 HydrophobicContact CE-SD 3.63Å; M785-M796 HydrophobicContact CG-SD 3.85Å; M785-M796 HydrophobicContact SD-CB 4.47Å; M785-M796 HydrophobicContact SD-CG 3.78Å; M785-M796 HydrophobicContact SD-SD 3.49Å
786	V	55.2	Low	49.2	Very low	69 Å²	69	96 Å²	96	42%	0.418	53%	0.526	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	143.6	176	-177.4	0	0	0	0	110.1	V795 C797	V786-V795 PolarHBondContact N-O 3.48Å; V786-V795 PolarHBondContact O-N 2.68Å; V786-C797 HydrophobicContact CG2-CB 4.04Å
787	Q	51.5	Low	49.1	Very low	130 Å²	130	93 Å²	93	61%	0.607	52%	0.515	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-81.4	136.7	177.7	-73.8	-176.7	-14.6	0	0	112	L794	Q787-L794 HydrophobicContact CG-CD2 3.55Å; Q787-L794 HydrophobicContact CG-CG 4.12Å
788	L	46.8	Very low	49.1	Very low	41 Å²	41	90.3 Å²	90.3	22%	0.215	50%	0.503	C	S	.	.			trans	-71.8	137.8	172.4	-82	163.6	0	0	0	111.1	G790 G791 V795 F807	L788-G790 PolarHBondContact O-N 3.5Å; L788-G790 VanDerWaalsContact O-N 3.13Å; L788-G791 PolarHBondContact O-N 2.68Å; L788-V795 HydrophobicContact CD1-CB 4.49Å; L788-V795 HydrophobicContact CD1-CG2 3.57Å; L788-V795 HydrophobicContact CG-CG2 4.1Å; L788-F807 HydrophobicContact CD2-CD2 4.49Å; L788-F807 HydrophobicContact CD2-CE1 4.31Å; L788-F807 HydrophobicContact CD2-CE2 3.56Å; L788-F807 HydrophobicContact CD2-CZ 3.44Å; L788-F807 VanDerWaalsContact CD2-CZ 3.44Å; L788-F807 HydrophobicContact CG-CE2 4.21Å; L788-F807 HydrophobicContact CG-CZ 4.14Å
789	P	42.5	Very low	49.5	Very low	86 Å²	86	91.7 Å²	91.7	56%	0.558	52%	0.517	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.4	110.9	176.3	8	4.2	0	0	0	110	T811	P789-T811 HydrophobicContact CG-CG2 4.3Å
790	G	48.6	Very low	49.7	Very low	91 Å²	91	92.7 Å²	92.7	94%	0.938	52%	0.524	S	S	*	.	T	Hydrogen-bonded Turn	trans	111.6	-2	177.1	0	0	0	0	0	115.7	L788	L788-G790 PolarHBondContact O-N 3.5Å; L788-G790 VanDerWaalsContact O-N 3.13Å
791	G	44.4	Very low	49.7	Very low	37 Å²	37	95.8 Å²	95.8	38%	0.381	54%	0.542	S	S	.	.	S	Bend	trans	-139.5	153.9	174.6	0	0	0	0	0	112.7	L788 E793	L788-G791 PolarHBondContact O-N 2.68Å; G791-E793 PolarHBondContact O-N 3.35Å
792	N	45.3	Very low	50.1	Low	167 Å²	167	99 Å²	99	89%	0.893	56%	0.557	S	S	*	*	S	Bend	trans	-81.5	8.5	-179.6	-75.5	-15.5	0	0	0	113.8
793	E	44.3	Very low	50.5	Low	146 Å²	146	93.5 Å²	93.5	68%	0.682	53%	0.533	S	S	*	.			trans	-89.2	129.9	-175.3	-67.9	180	170.8	0	0	111.6	G791	G791-E793 PolarHBondContact O-N 3.35Å
794	L	49.5	Very low	50.9	Low	108 Å²	108	92.6 Å²	92.6	57%	0.565	53%	0.525	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-87.1	120.3	175	-78.9	155.2	0	0	0	109	M785 Q787	M785-L794 HydrophobicContact CB-CD2 4.4Å; M785-L794 HydrophobicContact SD-CB 4.46Å; Q787-L794 HydrophobicContact CG-CD2 3.55Å; Q787-L794 HydrophobicContact CG-CG 4.12Å
795	V	52.6	Low	51.4	Low	52 Å²	52	95.1 Å²	95.1	32%	0.315	53%	0.532	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	144.4	-176.5	-172.6	0	0	0	0	110.2	V786 L788	V786-V795 PolarHBondContact N-O 3.48Å; V786-V795 PolarHBondContact O-N 2.68Å; L788-V795 HydrophobicContact CD1-CB 4.49Å; L788-V795 HydrophobicContact CD1-CG2 3.57Å; L788-V795 HydrophobicContact CG-CG2 4.1Å
796	M	51.8	Low	52	Low	74 Å²	74	93.4 Å²	93.4	37%	0.365	53%	0.531	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.4	136.1	-179	-71	-69.6	-60.2	0	0	111.6	N784 M785	N784-M796 HydrophobicContact CB-CE 4.05Å; N784-M796 CarbonylContact O-C 3.1Å; N784-M796 VanDerWaalsContact O-CA 3.25Å; N784-M796 WeakPolarHBondContact O-CA 3.11Å; N784-M796 VanDerWaalsContact O-SD 3.4Å; M785-M796 HydrophobicContact CE-CG 4Å; M785-M796 HydrophobicContact CE-SD 3.63Å; M785-M796 HydrophobicContact CG-SD 3.85Å; M785-M796 HydrophobicContact SD-CB 4.47Å; M785-M796 HydrophobicContact SD-CG 3.78Å; M785-M796 HydrophobicContact SD-SD 3.49Å
797	C	49.2	Very low	52.4	Low	50 Å²	50	92.7 Å²	92.7	34%	0.338	52%	0.522	S	S	.	.	P	Polyproline II helix	trans	-68.4	124.7	176.7	-149.9	0	0	0	0	109.8	N784 V786	N784-C797 HydrophobicContact CB-CB 4.14Å; N784-C797 PolarHBondContact O-N 3.13Å; V786-C797 HydrophobicContact CG2-CB 4.04Å
798	P	52.4	Low	53.1	Low	29 Å²	29	89.2 Å²	89.2	19%	0.188	51%	0.512	C	S	.	.	P	Polyproline II helix	trans	-72.2	133.3	-178.4	-2.6	15.7	0	0	0	111.2	A803 Q804 F807	P798-A803 HydrophobicContact CB-CB 3.42Å; P798-A803 VanDerWaalsContact CB-CB 3.42Å; P798-A803 HydrophobicContact CG-CB 4.42Å; P798-Q804 HydrophobicContact CB-CG 4.29Å; P798-Q804 HydrophobicContact CG-CG 4.4Å; P798-Q804 WeakPolarHBondContact O-CG 3.33Å; P798-Q804 PolarHBondContact O-NE2 2.72Å; P798-F807 HydrophobicContact CG-CB 3.96Å; P798-F807 HydrophobicContact CG-CD2 4.37Å; P798-F807 HydrophobicContact CG-CG 4.27Å
799	V	53.1	Low	54.2	Low	130 Å²	130	91.1 Å²	91.1	79%	0.788	52%	0.523	S	S	*	.			trans	-89	-17.9	-173.2	-170.9	0	0	0	0	112.6
800	T	56.3	Low	55.3	Low	86 Å²	86	91.9 Å²	91.9	53%	0.528	52%	0.522	S	S	.	.	S	Bend	trans	-104.2	145.1	-179.4	49.1	0	0	0	0	111.9	E802 A803 Q804	T800-E802 PolarHBondContact O-N 3.29Å; T800-A803 PolarHBondContact O-N 3.2Å; T800-A803 VanDerWaalsContact O-N 3.09Å; T800-A803 VanDerWaalsContact OG1-CB 3.32Å; T800-A803 WeakPolarHBondContact OG1-CB 3.35Å; T800-Q804 PolarHBondContact O-N 3.19Å
801	E	55.4	Low	56.1	Low	173 Å²	173	89.6 Å²	89.6	81%	0.808	49%	0.489	S	S	*	.	H	α-helix	trans	-56.4	-35.3	-178.7	-75.3	-169.7	159.9	0	0	112.8	Q804 K805	E801-Q804 PolarHBondContact O-N 3.39Å; E801-K805 WeakPolarHBondContact O-CB 3.4Å; E801-K805 PolarHBondContact O-N 3.03Å
802	E	55	Low	57.5	Low	163 Å²	163	91.1 Å²	91.1	76%	0.762	49%	0.491	S	S	*	.	H	α-helix	trans	-72	-35.1	178.6	-72.4	164.9	160	0	0	112.7	T800 K805 A806	T800-E802 PolarHBondContact O-N 3.29Å; E802-K805 WeakPolarHBondContact O-CB 3.05Å; E802-K805 PolarHBondContact O-N 3.45Å; E802-A806 PolarHBondContact O-N 2.89Å
803	A	55.8	Low	58.8	Low	35 Å²	35	86.8 Å²	86.8	29%	0.289	47%	0.471	S	S	.	.	H	α-helix	trans	-76.7	-29.6	176.4	0	0	0	0	0	111.7	P798 T800 K805 F807	P798-A803 HydrophobicContact CB-CB 3.42Å; P798-A803 VanDerWaalsContact CB-CB 3.42Å; P798-A803 HydrophobicContact CG-CB 4.42Å; T800-A803 PolarHBondContact O-N 3.2Å; T800-A803 VanDerWaalsContact O-N 3.09Å; T800-A803 VanDerWaalsContact OG1-CB 3.32Å; T800-A803 WeakPolarHBondContact OG1-CB 3.35Å; A803-K805 VanDerWaalsContact C-N 3.32Å; A803-F807 WeakPolarHBondContact O-CB 3.4Å; A803-F807 PolarHBondContact O-N 2.78Å
804	Q	57.9	Low	59.9	Low	104 Å²	104	83.7 Å²	83.7	49%	0.486	46%	0.459	S	S	.	.	H	α-helix	trans	-65	-38.1	166.9	-75.9	179.5	-4.2	0	0	111.6	P798 T800 E801 F807 S808	P798-Q804 HydrophobicContact CB-CG 4.29Å; P798-Q804 HydrophobicContact CG-CG 4.4Å; P798-Q804 WeakPolarHBondContact O-CG 3.33Å; P798-Q804 PolarHBondContact O-NE2 2.72Å; T800-Q804 PolarHBondContact O-N 3.19Å; E801-Q804 PolarHBondContact O-N 3.39Å; Q804-F807 PolarHBondContact O-N 3.06Å; Q804-S808 PolarHBondContact O-N 3.42Å; Q804-S808 PolarHBondContact O-OG 3.4Å
805	K	64.2	Low	61	Low	140 Å²	140	83.5 Å²	83.5	61%	0.609	46%	0.458	S	S	*	.	H	α-helix	trans	-64.7	-45.8	174.4	-150.8	175.3	-176	-178.9	0	111.8	E801 E802 A803 F807 S808 D809	E801-K805 WeakPolarHBondContact O-CB 3.4Å; E801-K805 PolarHBondContact O-N 3.03Å; E802-K805 WeakPolarHBondContact O-CB 3.05Å; E802-K805 PolarHBondContact O-N 3.45Å; A803-K805 VanDerWaalsContact C-N 3.32Å; K805-F807 VanDerWaalsContact C-N 3.28Å; K805-F807 PolarHBondContact O-N 3.43Å; K805-S808 WeakPolarHBondContact CA-OG 3.4Å; K805-S808 PolarHBondContact O-N 3.28Å; K805-S808 PolarHBondContact O-OG 3.39Å; K805-D809 WeakPolarHBondContact O-CB 3.27Å; K805-D809 PolarHBondContact O-N 3Å
806	A	60.8	Low	62.1	Low	50 Å²	50	86 Å²	86	41%	0.413	47%	0.469	S	S	.	.	H	α-helix	trans	-62.2	-34	173.8	0	0	0	0	0	112.9	E802 D809 L810	E802-A806 PolarHBondContact O-N 2.89Å; A806-D809 PolarHBondContact O-N 3.16Å; A806-L810 PolarHBondContact O-N 2.89Å
807	F	64.1	Low	63.2	Low	54 Å²	54	88.5 Å²	88.5	24%	0.237	48%	0.479	C	S	.	.	H	α-helix	trans	-70.7	-39.6	175	-169.3	-92.7	0	0	0	112.4	L788 P798 A803 Q804 K805 D809 L810 T811	L788-F807 HydrophobicContact CD2-CD2 4.49Å; L788-F807 HydrophobicContact CD2-CE1 4.31Å; L788-F807 HydrophobicContact CD2-CE2 3.56Å; L788-F807 HydrophobicContact CD2-CZ 3.44Å; L788-F807 VanDerWaalsContact CD2-CZ 3.44Å; L788-F807 HydrophobicContact CG-CE2 4.21Å; L788-F807 HydrophobicContact CG-CZ 4.14Å; P798-F807 HydrophobicContact CG-CB 3.96Å; P798-F807 HydrophobicContact CG-CD2 4.37Å; P798-F807 HydrophobicContact CG-CG 4.27Å; A803-F807 WeakPolarHBondContact O-CB 3.4Å; A803-F807 PolarHBondContact O-N 2.78Å; Q804-F807 PolarHBondContact O-N 3.06Å; K805-F807 VanDerWaalsContact C-N 3.28Å; K805-F807 PolarHBondContact O-N 3.43Å; F807-D809 VanDerWaalsContact C-N 3.32Å; F807-L810 PolarHBondContact O-N 3.01Å; F807-T811 PolarHBondContact O-N 3.41Å; F807-T811 PolarHBondContact O-OG1 3Å; F807-T811 VanDerWaalsContact O-OG1 3.05Å
808	S	64.9	Low	64.5	Low	57 Å²	57	92.6 Å²	92.6	40%	0.399	49%	0.491	S	S	.	.	H	α-helix	trans	-64.9	-38.1	170.5	56.1	0	0	0	0	111.8	Q804 K805 L810 T811 T812	Q804-S808 PolarHBondContact O-N 3.42Å; Q804-S808 PolarHBondContact O-OG 3.4Å; K805-S808 WeakPolarHBondContact CA-OG 3.4Å; K805-S808 PolarHBondContact O-N 3.28Å; K805-S808 PolarHBondContact O-OG 3.39Å; S808-L810 VanDerWaalsContact C-N 3.35Å; S808-L810 PolarHBondContact O-N 3.42Å; S808-T811 WeakPolarHBondContact O-CA 3.29Å; S808-T811 VanDerWaalsContact O-CB 3.3Å; S808-T811 WeakPolarHBondContact O-CB 2.84Å; S808-T811 PolarHBondContact O-N 3.23Å; S808-T812 PolarHBondContact O-N 3.19Å
809	D	70.1	Confident	65.8	Low	82 Å²	82	97.2 Å²	97.2	44%	0.439	51%	0.511	S	S	.	.	H	α-helix	trans	-64.4	-39.5	177.6	-65.4	-16.7	0	0	0	110.9	K805 A806 F807 T811 T812 V813	K805-D809 WeakPolarHBondContact O-CB 3.27Å; K805-D809 PolarHBondContact O-N 3Å; A806-D809 PolarHBondContact O-N 3.16Å; F807-D809 VanDerWaalsContact C-N 3.32Å; D809-T811 VanDerWaalsContact C-N 3.26Å; D809-T811 PolarHBondContact O-N 3.34Å; D809-T812 WeakPolarHBondContact CA-OG1 3.43Å; D809-T812 CarbonylContact O-C 3.57Å; D809-T812 WeakPolarHBondContact O-CA 3.48Å; D809-T812 PolarHBondContact O-N 3.01Å; D809-T812 PolarHBondContact O-OG1 3.43Å; D809-V813 WeakPolarHBondContact O-CG2 3.22Å; D809-V813 PolarHBondContact O-N 3.28Å
810	L	66.1	Low	67	Low	101 Å²	101	96.3 Å²	96.3	53%	0.529	50%	0.501	S	S	.	.	H	α-helix	trans	-58.3	-36.8	171.2	-99.4	162.3	0	0	0	113	A806 F807 S808 T812 V813 L814	A806-L810 PolarHBondContact O-N 2.89Å; F807-L810 PolarHBondContact O-N 3.01Å; S808-L810 VanDerWaalsContact C-N 3.35Å; S808-L810 PolarHBondContact O-N 3.42Å; L810-T812 VanDerWaalsContact C-N 3.34Å; L810-V813 PolarHBondContact O-N 3.37Å; L810-L814 PolarHBondContact O-N 3.41Å; L810-L814 VanDerWaalsContact O-N 3.08Å
811	T	65.3	Low	68.2	Low	43 Å²	43	94.1 Å²	94.1	26%	0.264	49%	0.489	S	S	.	.	H	α-helix	trans	-68.3	-37	175.8	-45.8	0	0	0	0	111	P789 F807 S808 D809 L814 L815	P789-T811 HydrophobicContact CG-CG2 4.3Å; F807-T811 PolarHBondContact O-N 3.41Å; F807-T811 PolarHBondContact O-OG1 3Å; F807-T811 VanDerWaalsContact O-OG1 3.05Å; S808-T811 WeakPolarHBondContact O-CA 3.29Å; S808-T811 VanDerWaalsContact O-CB 3.3Å; S808-T811 WeakPolarHBondContact O-CB 2.84Å; S808-T811 PolarHBondContact O-N 3.23Å; D809-T811 VanDerWaalsContact C-N 3.26Å; D809-T811 PolarHBondContact O-N 3.34Å; T811-L814 PolarHBondContact O-N 3.04Å; T811-L815 PolarHBondContact O-N 3.3Å
812	T	73.5	Confident	69.5	Low	69 Å²	69	89.1 Å²	89.1	42%	0.423	47%	0.468	S	S	.	.	H	α-helix	trans	-68.8	-35.8	173.2	67.8	0	0	0	0	112.5	S808 D809 L810 L814 L815 L816	S808-T812 PolarHBondContact O-N 3.19Å; D809-T812 WeakPolarHBondContact CA-OG1 3.43Å; D809-T812 CarbonylContact O-C 3.57Å; D809-T812 WeakPolarHBondContact O-CA 3.48Å; D809-T812 PolarHBondContact O-N 3.01Å; D809-T812 PolarHBondContact O-OG1 3.43Å; L810-T812 VanDerWaalsContact C-N 3.34Å; T812-L814 PolarHBondContact O-N 3Å; T812-L815 WeakPolarHBondContact O-CB 3.38Å; T812-L815 PolarHBondContact O-N 3.33Å; T812-L816 WeakPolarHBondContact O-CG 3.18Å; T812-L816 PolarHBondContact O-N 3.1Å
813	V	72.2	Confident	70.7	Confident	77 Å²	77	84.3 Å²	84.3	47%	0.467	45%	0.452	S	S	.	.	H	α-helix	trans	-64.6	-39.9	175.7	170.8	0	0	0	0	111.2	D809 L810 L815 L816 Q817	D809-V813 WeakPolarHBondContact O-CG2 3.22Å; D809-V813 PolarHBondContact O-N 3.28Å; L810-V813 PolarHBondContact O-N 3.37Å; V813-L815 VanDerWaalsContact C-N 3.34Å; V813-L815 PolarHBondContact O-N 3.36Å; V813-L816 PolarHBondContact O-N 3Å; V813-Q817 VanDerWaalsContact O-CB 3.29Å; V813-Q817 WeakPolarHBondContact O-CB 3.4Å; V813-Q817 PolarHBondContact O-N 2.97Å
814	L	67.3	Low	72.1	Confident	81 Å²	81	88.2 Å²	88.2	42%	0.424	47%	0.465	S	S	.	.	H	α-helix	trans	-65.6	-35.9	175.1	-75	172.5	0	0	0	112.7	L810 T811 T812 K818	L810-L814 PolarHBondContact O-N 3.41Å; L810-L814 VanDerWaalsContact O-N 3.08Å; T811-L814 PolarHBondContact O-N 3.04Å; T812-L814 PolarHBondContact O-N 3Å; L814-K818 PolarHBondContact O-N 3.16Å; L814-K818 VanDerWaalsContact O-N 3.08Å
815	L	72.6	Confident	73.4	Confident	104 Å²	104	88.7 Å²	88.7	55%	0.545	47%	0.465	S	S	.	.	H	α-helix	trans	-66	-45.8	172.7	-79.3	161.3	0	0	0	111.3	T811 T812 V813 Q817 K818 E819	T811-L815 PolarHBondContact O-N 3.3Å; T812-L815 WeakPolarHBondContact O-CB 3.38Å; T812-L815 PolarHBondContact O-N 3.33Å; V813-L815 VanDerWaalsContact C-N 3.34Å; V813-L815 PolarHBondContact O-N 3.36Å; L815-Q817 VanDerWaalsContact C-N 3.32Å; L815-Q817 PolarHBondContact O-N 3.2Å; L815-K818 WeakPolarHBondContact O-CB 3.25Å; L815-K818 PolarHBondContact O-N 3.13Å; L815-E819 PolarHBondContact O-N 3.16Å
816	L	76.4	Confident	74.3	Confident	105 Å²	105	87.7 Å²	87.7	55%	0.55	47%	0.466	S	S	.	.	H	α-helix	trans	-63.9	-36.3	176.3	-70.7	171.7	0	0	0	112.1	T812 V813 K818 E819 L820	T812-L816 WeakPolarHBondContact O-CG 3.18Å; T812-L816 PolarHBondContact O-N 3.1Å; V813-L816 PolarHBondContact O-N 3Å; L816-K818 VanDerWaalsContact C-N 3.33Å; L816-E819 PolarHBondContact O-N 3.29Å; L816-L820 VanDerWaalsContact O-CB 3.26Å; L816-L820 WeakPolarHBondContact O-CB 3.49Å; L816-L820 PolarHBondContact O-N 3.2Å
817	Q	75.9	Confident	75.2	Confident	125 Å²	125	88 Å²	88	58%	0.584	47%	0.469	S	S	*	.	H	α-helix	trans	-67.7	-35.4	176.3	-168.6	172.8	5.5	0	0	111.6	V813 L815 S821	V813-Q817 VanDerWaalsContact O-CB 3.29Å; V813-Q817 WeakPolarHBondContact O-CB 3.4Å; V813-Q817 PolarHBondContact O-N 2.97Å; L815-Q817 VanDerWaalsContact C-N 3.32Å; L815-Q817 PolarHBondContact O-N 3.2Å; Q817-S821 PolarHBondContact O-N 2.97Å
818	K	75.6	Confident	76.1	Confident	136 Å²	136	89.4 Å²	89.4	59%	0.591	48%	0.477	S	S	*	.	H	α-helix	trans	-68.8	-46.8	173.3	-169.8	179.2	178.8	-178.4	0	111.4	L814 L815 L816 L820 S821 D822	L814-K818 PolarHBondContact O-N 3.16Å; L814-K818 VanDerWaalsContact O-N 3.08Å; L815-K818 WeakPolarHBondContact O-CB 3.25Å; L815-K818 PolarHBondContact O-N 3.13Å; L816-K818 VanDerWaalsContact C-N 3.33Å; K818-L820 VanDerWaalsContact C-N 3.29Å; K818-L820 PolarHBondContact O-N 3.03Å; K818-S821 PolarHBondContact O-N 3.36Å; K818-S821 PolarHBondContact O-OG 3.19Å; K818-D822 PolarHBondContact O-N 2.85Å
819	E	78.8	Confident	77.1	Confident	126 Å²	126	91.8 Å²	91.8	59%	0.589	49%	0.485	S	S	*	.	H	α-helix	trans	-60.2	-39.2	174.7	-75.1	-177.9	171.1	0	0	111.9	L815 L816 D822 S823	L815-E819 PolarHBondContact O-N 3.16Å; L816-E819 PolarHBondContact O-N 3.29Å; E819-D822 PolarHBondContact O-N 2.54Å; E819-S823 WeakPolarHBondContact O-CB 3.32Å; E819-S823 PolarHBondContact O-N 3.28Å
820	L	79.9	Confident	77.7	Confident	112 Å²	112	90.7 Å²	90.7	59%	0.586	49%	0.487	S	S	*	.	H	α-helix	trans	-60.7	-48.5	173.6	-165.3	96	0	0	0	110.6	L816 K818 D822 S823 E824	L816-L820 VanDerWaalsContact O-CB 3.26Å; L816-L820 WeakPolarHBondContact O-CB 3.49Å; L816-L820 PolarHBondContact O-N 3.2Å; K818-L820 VanDerWaalsContact C-N 3.29Å; K818-L820 PolarHBondContact O-N 3.03Å; L820-D822 VanDerWaalsContact C-N 3.25Å; L820-D822 PolarHBondContact O-N 3.43Å; L820-S823 PolarHBondContact O-N 3.28Å; L820-S823 PolarHBondContact O-OG 3.18Å; L820-E824 WeakPolarHBondContact O-CB 3.41Å; L820-E824 PolarHBondContact O-N 3.45Å
821	S	80.7	Confident	78.7	Confident	39 Å²	39	91 Å²	91	27%	0.273	49%	0.485	S	S	.	.	H	α-helix	trans	-61.8	-33.4	178.6	83.8	0	0	0	0	112.9	Q817 K818 K825	Q817-S821 PolarHBondContact O-N 2.97Å; K818-S821 PolarHBondContact O-N 3.36Å; K818-S821 PolarHBondContact O-OG 3.19Å; S821-K825 VanDerWaalsContact O-CG 3.31Å; S821-K825 WeakPolarHBondContact O-CG 3.35Å; S821-K825 PolarHBondContact O-N 3.35Å
822	D	81.8	Confident	79.8	Confident	68 Å²	68	92.7 Å²	92.7	36%	0.364	49%	0.493	S	S	.	.	H	α-helix	trans	-78.9	-34.8	178.1	-70.1	-23.4	0	0	0	111.1	K818 E819 L820 K825 L826	K818-D822 PolarHBondContact O-N 2.85Å; E819-D822 PolarHBondContact O-N 2.54Å; L820-D822 VanDerWaalsContact C-N 3.25Å; L820-D822 PolarHBondContact O-N 3.43Å; D822-K825 PolarHBondContact O-N 3.49Å; D822-K825 IonicContact OD1-NZ 3.24Å; D822-K825 PolarHBondContact OD1-NZ 3.08Å; D822-L826 WeakPolarHBondContact O-CG 3.47Å; D822-L826 PolarHBondContact O-N 3.14Å; D822-L826 VanDerWaalsContact O-N 3.08Å
823	S	81.8	Confident	80.4	Confident	63 Å²	63	99 Å²	99	44%	0.441	51%	0.509	S	S	.	.	H	α-helix	trans	-65.3	-37.5	171.1	80.1	0	0	0	0	112.4	E819 L820 L826 A827	E819-S823 WeakPolarHBondContact O-CB 3.32Å; E819-S823 PolarHBondContact O-N 3.28Å; L820-S823 PolarHBondContact O-N 3.28Å; L820-S823 PolarHBondContact O-OG 3.18Å; S823-L826 PolarHBondContact O-N 3.04Å; S823-A827 WeakPolarHBondContact O-CB 3.29Å; S823-A827 PolarHBondContact O-N 3.07Å
824	E	85.3	Confident	81	Confident	117 Å²	117	97.8 Å²	97.8	55%	0.547	51%	0.507	S	S	.	.	H	α-helix	trans	-66.7	-42.6	177.4	-171.8	177.2	-167.1	0	0	110.8	L820 L826 A827 I828	L820-E824 WeakPolarHBondContact O-CB 3.41Å; L820-E824 PolarHBondContact O-N 3.45Å; E824-L826 VanDerWaalsContact C-N 3.32Å; E824-L826 PolarHBondContact O-N 2.79Å; E824-A827 PolarHBondContact O-N 3.12Å; E824-I828 HydrophobicContact CG-CD1 4.21Å; E824-I828 VanDerWaalsContact O-CG1 3.26Å; E824-I828 WeakPolarHBondContact O-CG1 3.37Å; E824-I828 PolarHBondContact O-N 3.05Å
825	K	84.5	Confident	81.8	Confident	113 Å²	113	99.1 Å²	99.1	49%	0.491	51%	0.506	S	S	.	.	H	α-helix	trans	-60	-42	171.9	-70.1	168.5	-157.5	153.6	0	111.9	S821 D822 I828 I829	S821-K825 VanDerWaalsContact O-CG 3.31Å; S821-K825 WeakPolarHBondContact O-CG 3.35Å; S821-K825 PolarHBondContact O-N 3.35Å; D822-K825 PolarHBondContact O-N 3.49Å; D822-K825 IonicContact OD1-NZ 3.24Å; D822-K825 PolarHBondContact OD1-NZ 3.08Å; K825-I828 PolarHBondContact O-N 3.36Å; K825-I829 WeakPolarHBondContact O-CD1 3.37Å; K825-I829 VanDerWaalsContact O-CG1 3.23Å; K825-I829 WeakPolarHBondContact O-CG1 3.26Å; K825-I829 PolarHBondContact O-N 3.39Å
826	L	82.1	Confident	82.6	Confident	120 Å²	120	96.8 Å²	96.8	63%	0.628	50%	0.502	S	S	*	.	H	α-helix	trans	-66.1	-39.1	177	-72.9	172.9	0	0	0	112	D822 S823 E824 I829 A830	D822-L826 WeakPolarHBondContact O-CG 3.47Å; D822-L826 PolarHBondContact O-N 3.14Å; D822-L826 VanDerWaalsContact O-N 3.08Å; S823-L826 PolarHBondContact O-N 3.04Å; E824-L826 VanDerWaalsContact C-N 3.32Å; E824-L826 PolarHBondContact O-N 2.79Å; L826-I829 PolarHBondContact O-N 3.06Å; L826-A830 WeakPolarHBondContact O-CB 3.28Å; L826-A830 PolarHBondContact O-N 3.42Å
827	A	80.9	Confident	83	Confident	57 Å²	57	94.6 Å²	94.6	47%	0.471	50%	0.499	S	S	.	.	H	α-helix	trans	-63.7	-44.3	174.9	0	0	0	0	0	111.6	S823 E824 I829 A830 E831	S823-A827 WeakPolarHBondContact O-CB 3.29Å; S823-A827 PolarHBondContact O-N 3.07Å; E824-A827 PolarHBondContact O-N 3.12Å; A827-I829 VanDerWaalsContact C-N 3.31Å; A827-I829 PolarHBondContact O-N 3.25Å; A827-A830 PolarHBondContact O-N 3.29Å; A827-A830 VanDerWaalsContact O-N 3.17Å; A827-E831 WeakPolarHBondContact O-CB 3.41Å; A827-E831 PolarHBondContact O-N 2.83Å
828	I	82.4	Confident	83.4	Confident	82 Å²	82	94.9 Å²	94.9	42%	0.421	50%	0.5	S	S	.	.	H	α-helix	trans	-60.6	-41	175.3	-68.2	163.9	0	0	0	111	E824 K825 E831 N832	E824-I828 HydrophobicContact CG-CD1 4.21Å; E824-I828 VanDerWaalsContact O-CG1 3.26Å; E824-I828 WeakPolarHBondContact O-CG1 3.37Å; E824-I828 PolarHBondContact O-N 3.05Å; K825-I828 PolarHBondContact O-N 3.36Å; I828-E831 PolarHBondContact O-N 3.27Å; I828-N832 WeakPolarHBondContact O-CB 3.32Å; I828-N832 VanDerWaalsContact O-CG 3.24Å; I828-N832 PolarHBondContact O-N 3.46Å; I828-N832 PolarHBondContact O-ND2 3.39Å; I828-N832 VanDerWaalsContact O-ND2 3.09Å
829	I	85.9	Confident	84.1	Confident	108 Å²	108	94.1 Å²	94.1	55%	0.554	50%	0.499	S	S	*	.	H	α-helix	trans	-65.6	-41.7	176.2	-68.5	164.1	0	0	0	110.9	K825 L826 A827 R833	K825-I829 WeakPolarHBondContact O-CD1 3.37Å; K825-I829 VanDerWaalsContact O-CG1 3.23Å; K825-I829 WeakPolarHBondContact O-CG1 3.26Å; K825-I829 PolarHBondContact O-N 3.39Å; L826-I829 PolarHBondContact O-N 3.06Å; A827-I829 VanDerWaalsContact C-N 3.31Å; A827-I829 PolarHBondContact O-N 3.25Å; I829-R833 WeakPolarHBondContact O-CB 3.41Å; I829-R833 PolarHBondContact O-N 3.02Å
830	A	83.4	Confident	84.6	Confident	58 Å²	58	90.8 Å²	90.8	48%	0.479	49%	0.492	S	S	.	.	H	α-helix	trans	-65.5	-41.4	176.9	0	0	0	0	0	112	L826 A827 R833 A834	L826-A830 WeakPolarHBondContact O-CB 3.28Å; L826-A830 PolarHBondContact O-N 3.42Å; A827-A830 PolarHBondContact O-N 3.29Å; A827-A830 VanDerWaalsContact O-N 3.17Å; A830-R833 PolarHBondContact O-N 2.77Å; A830-A834 PolarHBondContact O-N 3.1Å
831	E	87.1	Confident	85	Confident	107 Å²	107	90.6 Å²	90.6	50%	0.5	49%	0.492	S	S	.	.	H	α-helix	trans	-63.8	-44.9	176.6	-167.6	-170.4	157.9	0	0	111.4	A827 I828 R833 A834 R835	A827-E831 WeakPolarHBondContact O-CB 3.41Å; A827-E831 PolarHBondContact O-N 2.83Å; I828-E831 PolarHBondContact O-N 3.27Å; E831-R833 VanDerWaalsContact C-N 3.27Å; E831-R833 PolarHBondContact O-N 2.84Å; E831-A834 PolarHBondContact O-N 3.49Å; E831-R835 WeakPolarHBondContact O-CB 3.46Å; E831-R835 PolarHBondContact O-N 2.86Å; E831-R835 IonicContact OE1-NH2 3.63Å; E831-R835 PolarHBondContact OE1-NH2 3.25Å
832	N	87.6	Confident	85.4	Confident	79 Å²	79	92.5 Å²	92.5	42%	0.422	50%	0.502	S	S	.	.	H	α-helix	trans	-62.2	-36.1	175	-72.9	-33.1	0	0	0	112	I828 R835 A836	I828-N832 WeakPolarHBondContact O-CB 3.32Å; I828-N832 VanDerWaalsContact O-CG 3.24Å; I828-N832 PolarHBondContact O-N 3.46Å; I828-N832 PolarHBondContact O-ND2 3.39Å; I828-N832 VanDerWaalsContact O-ND2 3.09Å; N832-R835 PolarHBondContact OD1-NH1 3.17Å; N832-A836 WeakPolarHBondContact O-CB 3.36Å; N832-A836 PolarHBondContact O-N 3.3Å
833	R	87.2	Confident	85.8	Confident	202 Å²	202	94.2 Å²	94.2	76%	0.762	51%	0.507	S	S	*	.	H	α-helix	trans	-69.8	-37.6	175.2	-170.2	177.2	-178.5	163.3	0.8	112.3	I829 A830 E831 A837	I829-R833 WeakPolarHBondContact O-CB 3.41Å; I829-R833 PolarHBondContact O-N 3.02Å; A830-R833 PolarHBondContact O-N 2.77Å; E831-R833 VanDerWaalsContact C-N 3.27Å; E831-R833 PolarHBondContact O-N 2.84Å; R833-A837 WeakPolarHBondContact O-CB 3.31Å; R833-A837 PolarHBondContact O-N 2.68Å
834	A	83.4	Confident	86	Confident	51 Å²	51	93.3 Å²	93.3	42%	0.421	50%	0.504	S	S	.	.	H	α-helix	trans	-65.4	-44.7	174.4	0	0	0	0	0	111.1	A830 E831 A836 A837 E838	A830-A834 PolarHBondContact O-N 3.1Å; E831-A834 PolarHBondContact O-N 3.49Å; A834-A836 PolarHBondContact O-N 3.46Å; A834-A837 WeakPolarHBondContact O-CB 3.49Å; A834-A837 PolarHBondContact O-N 3.34Å; A834-A837 VanDerWaalsContact O-N 3.08Å; A834-E838 PolarHBondContact O-N 3.37Å
835	R	85.5	Confident	86.1	Confident	110 Å²	110	91.9 Å²	91.9	42%	0.415	50%	0.5	S	S	.	.	H	α-helix	trans	-59.6	-45	175.9	-164.7	179.4	-62.2	139.5	2.8	112	E831 N832 A837 E838 E839	E831-R835 WeakPolarHBondContact O-CB 3.46Å; E831-R835 PolarHBondContact O-N 2.86Å; E831-R835 IonicContact OE1-NH2 3.63Å; E831-R835 PolarHBondContact OE1-NH2 3.25Å; N832-R835 PolarHBondContact OD1-NH1 3.17Å; R835-A837 VanDerWaalsContact C-N 3.29Å; R835-A837 PolarHBondContact O-N 3.41Å; R835-E838 PolarHBondContact O-N 3.27Å; R835-E839 WeakPolarHBondContact O-CG 3.03Å; R835-E839 PolarHBondContact O-N 2.84Å
836	A	89	Confident	86.2	Confident	54 Å²	54	91.3 Å²	91.3	45%	0.446	50%	0.501	S	S	.	.	H	α-helix	trans	-63.1	-34.1	174.8	0	0	0	0	0	113	N832 A834 A840	N832-A836 WeakPolarHBondContact O-CB 3.36Å; N832-A836 PolarHBondContact O-N 3.3Å; A834-A836 PolarHBondContact O-N 3.46Å; A836-A840 WeakPolarHBondContact O-CB 3.43Å; A836-A840 PolarHBondContact O-N 3.39Å
837	A	84.3	Confident	86.6	Confident	59 Å²	59	91.1 Å²	91.1	49%	0.488	50%	0.495	S	S	.	.	H	α-helix	trans	-71.2	-38.1	175	0	0	0	0	0	112.2	R833 A834 R835 A840 L841	R833-A837 WeakPolarHBondContact O-CB 3.31Å; R833-A837 PolarHBondContact O-N 2.68Å; A834-A837 WeakPolarHBondContact O-CB 3.49Å; A834-A837 PolarHBondContact O-N 3.34Å; A834-A837 VanDerWaalsContact O-N 3.08Å; R835-A837 VanDerWaalsContact C-N 3.29Å; R835-A837 PolarHBondContact O-N 3.41Å; A837-A840 PolarHBondContact O-N 3.17Å; A837-L841 WeakPolarHBondContact O-CB 3.43Å; A837-L841 PolarHBondContact O-N 2.93Å
838	E	85.1	Confident	86.7	Confident	132 Å²	132	92.5 Å²	92.5	62%	0.617	49%	0.493	S	S	*	.	H	α-helix	trans	-64.5	-43	173.1	-75.3	-175.8	163.3	0	0	111.9	A834 R835 A840 L841 T842	A834-E838 PolarHBondContact O-N 3.37Å; R835-E838 PolarHBondContact O-N 3.27Å; E838-A840 PolarHBondContact O-N 3.36Å; E838-L841 PolarHBondContact O-N 3.24Å; E838-T842 WeakPolarHBondContact O-CG2 3.28Å; E838-T842 PolarHBondContact O-N 3.31Å; E838-T842 PolarHBondContact O-OG1 3.39Å
839	E	90.4	Very high	86.7	Confident	120 Å²	120	94.7 Å²	94.7	56%	0.561	50%	0.5	S	S	*	.	H	α-helix	trans	-58.6	-46.1	173.4	-73.7	172.2	-172.5	0	0	111.2	R835 L841 T842 E843	R835-E839 WeakPolarHBondContact O-CG 3.03Å; R835-E839 PolarHBondContact O-N 2.84Å; E839-L841 VanDerWaalsContact C-N 3.33Å; E839-L841 PolarHBondContact O-N 3.14Å; E839-T842 WeakPolarHBondContact CA-OG1 3.43Å; E839-T842 PolarHBondContact O-N 3.48Å; E839-T842 PolarHBondContact O-OG1 3.5Å; E839-E843 PolarHBondContact O-N 3.01Å
840	A	88.9	Confident	86.5	Confident	55 Å²	55	92.9 Å²	92.9	46%	0.455	49%	0.492	S	S	.	.	H	α-helix	trans	-63.9	-36	176	0	0	0	0	0	113	A836 A837 E838 E843 A844	A836-A840 WeakPolarHBondContact O-CB 3.43Å; A836-A840 PolarHBondContact O-N 3.39Å; A837-A840 PolarHBondContact O-N 3.17Å; E838-A840 PolarHBondContact O-N 3.36Å; A840-E843 PolarHBondContact O-N 3.48Å; A840-A844 WeakPolarHBondContact O-CB 3.35Å; A840-A844 PolarHBondContact O-N 3.07Å
841	L	87.7	Confident	86.4	Confident	109 Å²	109	95.1 Å²	95.1	57%	0.571	50%	0.495	S	S	*	.	H	α-helix	trans	-71	-41.2	179	-157.2	158.4	0	0	0	111	A837 E838 E839 A844 L845	A837-L841 WeakPolarHBondContact O-CB 3.43Å; A837-L841 PolarHBondContact O-N 2.93Å; E838-L841 PolarHBondContact O-N 3.24Å; E839-L841 VanDerWaalsContact C-N 3.33Å; E839-L841 PolarHBondContact O-N 3.14Å; L841-A844 PolarHBondContact O-N 3.15Å; L841-L845 HydrophobicContact CD2-CD1 3.61Å; L841-L845 HydrophobicContact CD2-CG 4Å; L841-L845 WeakPolarHBondContact O-CG 3.26Å; L841-L845 PolarHBondContact O-N 3.09Å
842	T	88.7	Confident	85.9	Confident	78 Å²	78	95.1 Å²	95.1	48%	0.479	50%	0.495	S	S	.	.	H	α-helix	trans	-63.8	-40.7	173.6	57	0	0	0	0	111.6	E838 E839 A844 L845 I846	E838-T842 WeakPolarHBondContact O-CG2 3.28Å; E838-T842 PolarHBondContact O-N 3.31Å; E838-T842 PolarHBondContact O-OG1 3.39Å; E839-T842 WeakPolarHBondContact CA-OG1 3.43Å; E839-T842 PolarHBondContact O-N 3.48Å; E839-T842 PolarHBondContact O-OG1 3.5Å; T842-A844 PolarHBondContact O-N 2.86Å; T842-L845 PolarHBondContact O-N 3.02Å; T842-I846 VanDerWaalsContact O-CG1 3.3Å; T842-I846 WeakPolarHBondContact O-CG1 3.38Å; T842-I846 PolarHBondContact O-N 3.29Å
843	E	90.3	Very high	85.5	Confident	104 Å²	104	98.6 Å²	98.6	49%	0.486	50%	0.502	S	S	.	.	H	α-helix	trans	-64.2	-39.9	174.5	-157.8	-167.6	150	0	0	112.1	E839 A840 I846 K847	E839-E843 PolarHBondContact O-N 3.01Å; A840-E843 PolarHBondContact O-N 3.48Å; E843-I846 PolarHBondContact O-N 3.06Å; E843-K847 WeakPolarHBondContact O-CG 3.23Å; E843-K847 PolarHBondContact O-N 2.78Å; E843-K847 WeakPolarHBondContact OE1-CE 3.3Å; E843-K847 IonicContact OE1-NZ 3.34Å; E843-K847 PolarHBondContact OE1-NZ 2.69Å
844	A	85.8	Confident	84.9	Confident	45 Å²	45	94 Å²	94	37%	0.372	49%	0.492	S	S	.	.	H	α-helix	trans	-64.6	-40.7	174.2	0	0	0	0	0	112.1	A840 L841 T842 I846 K847 I848	A840-A844 WeakPolarHBondContact O-CB 3.35Å; A840-A844 PolarHBondContact O-N 3.07Å; L841-A844 PolarHBondContact O-N 3.15Å; T842-A844 PolarHBondContact O-N 2.86Å; A844-I846 VanDerWaalsContact C-N 3.34Å; A844-I846 PolarHBondContact O-N 2.98Å; A844-K847 PolarHBondContact O-N 3.44Å; A844-I848 VanDerWaalsContact O-CG1 3.28Å; A844-I848 WeakPolarHBondContact O-CG1 3.44Å; A844-I848 PolarHBondContact O-N 3.02Å
845	L	87.8	Confident	84.1	Confident	87 Å²	87	97.1 Å²	97.1	46%	0.455	50%	0.501	S	S	.	.	H	α-helix	trans	-64.7	-37.3	175.8	-77.5	172.3	0	0	0	112.4	L841 T842 I848 K849	L841-L845 HydrophobicContact CD2-CD1 3.61Å; L841-L845 HydrophobicContact CD2-CG 4Å; L841-L845 WeakPolarHBondContact O-CG 3.26Å; L841-L845 PolarHBondContact O-N 3.09Å; T842-L845 PolarHBondContact O-N 3.02Å; L845-I848 PolarHBondContact O-N 2.91Å; L845-K849 WeakPolarHBondContact O-CG 3.39Å; L845-K849 PolarHBondContact O-N 3.3Å
846	I	87.3	Confident	83.3	Confident	101 Å²	101	99.8 Å²	99.8	52%	0.518	52%	0.518	S	S	.	.	H	α-helix	trans	-63.3	-47.3	173.4	-68.1	164.6	0	0	0	109.8	T842 E843 A844 I848 K849 D850	T842-I846 VanDerWaalsContact O-CG1 3.3Å; T842-I846 WeakPolarHBondContact O-CG1 3.38Å; T842-I846 PolarHBondContact O-N 3.29Å; E843-I846 PolarHBondContact O-N 3.06Å; A844-I846 VanDerWaalsContact C-N 3.34Å; A844-I846 PolarHBondContact O-N 2.98Å; I846-I848 VanDerWaalsContact C-N 3.34Å; I846-I848 PolarHBondContact O-N 3.34Å; I846-K849 PolarHBondContact O-N 3.17Å; I846-D850 PolarHBondContact O-N 3.18Å
847	K	89.2	Confident	81.9	Confident	115 Å²	115	107.5 Å²	107.5	50%	0.5	54%	0.536	S	S	.	.	H	α-helix	trans	-60.8	-40.3	176.6	-74.7	172.8	-174.1	158.9	0	112.7	E843 A844 D850 L851	E843-K847 WeakPolarHBondContact O-CG 3.23Å; E843-K847 PolarHBondContact O-N 2.78Å; E843-K847 WeakPolarHBondContact OE1-CE 3.3Å; E843-K847 IonicContact OE1-NZ 3.34Å; E843-K847 PolarHBondContact OE1-NZ 2.69Å; A844-K847 PolarHBondContact O-N 3.44Å; K847-D850 PolarHBondContact O-N 3.12Å; K847-L851 WeakPolarHBondContact O-CB 3.23Å; K847-L851 VanDerWaalsContact O-CG 3.26Å; K847-L851 WeakPolarHBondContact O-CG 3.49Å; K847-L851 PolarHBondContact O-N 3.37Å
848	I	83	Confident	80.1	Confident	86 Å²	86	111.4 Å²	111.4	44%	0.441	54%	0.544	S	S	.	.	H	α-helix	trans	-63	-47.1	175.8	-70.6	165.3	0	0	0	110.3	A844 L845 I846 D850 L851 E852	A844-I848 VanDerWaalsContact O-CG1 3.28Å; A844-I848 WeakPolarHBondContact O-CG1 3.44Å; A844-I848 PolarHBondContact O-N 3.02Å; L845-I848 PolarHBondContact O-N 2.91Å; I846-I848 VanDerWaalsContact C-N 3.34Å; I846-I848 PolarHBondContact O-N 3.34Å; I848-D850 VanDerWaalsContact C-N 3.29Å; I848-D850 PolarHBondContact O-N 2.88Å; I848-L851 PolarHBondContact O-N 3.3Å; I848-E852 HydrophobicContact CG2-CG 4.41Å; I848-E852 WeakPolarHBondContact O-CG 3.27Å; I848-E852 PolarHBondContact O-N 3.25Å
849	K	82.4	Confident	78.2	Confident	128 Å²	128	110.9 Å²	110.9	56%	0.557	55%	0.552	S	S	*	*	H	α-helix	trans	-61.9	-36.4	176.8	-78	-178.6	176.8	178.5	0	112.8	L845 I846 E852 R853	L845-K849 WeakPolarHBondContact O-CG 3.39Å; L845-K849 PolarHBondContact O-N 3.3Å; I846-K849 PolarHBondContact O-N 3.17Å; K849-E852 PolarHBondContact O-N 3.17Å; K849-R853 VanDerWaalsContact O-CG 3.3Å; K849-R853 WeakPolarHBondContact O-CG 3.3Å; K849-R853 PolarHBondContact O-N 3.37Å
850	D	82.8	Confident	75.9	Confident	71 Å²	71	109.2 Å²	109.2	38%	0.38	56%	0.559	S	S	.	*	H	α-helix	trans	-71.1	-36.8	176	-72.9	-22.9	0	0	0	112	I846 K847 I848 R853 L854	I846-D850 PolarHBondContact O-N 3.18Å; K847-D850 PolarHBondContact O-N 3.12Å; I848-D850 VanDerWaalsContact C-N 3.29Å; I848-D850 PolarHBondContact O-N 2.88Å; D850-R853 PolarHBondContact O-N 3.35Å; D850-R853 IonicContact OD1-NH1 2.89Å; D850-R853 PolarHBondContact OD1-NH1 3.06Å; D850-L854 WeakPolarHBondContact O-CG 3.4Å; D850-L854 PolarHBondContact O-N 3.12Å
851	L	80.3	Confident	74	Confident	104 Å²	104	112.6 Å²	112.6	55%	0.545	58%	0.576	S	S	.	*	H	α-helix	trans	-67	-37.8	171.8	-71.7	169.9	0	0	0	112.4	K847 I848 L854 L855	K847-L851 WeakPolarHBondContact O-CB 3.23Å; K847-L851 VanDerWaalsContact O-CG 3.26Å; K847-L851 WeakPolarHBondContact O-CG 3.49Å; K847-L851 PolarHBondContact O-N 3.37Å; I848-L851 PolarHBondContact O-N 3.3Å; L851-L854 HydrophobicContact CD2-CD1 4.35Å; L851-L854 PolarHBondContact O-N 3.12Å; L851-L855 PolarHBondContact O-N 2.99Å
852	E	77.8	Confident	71.8	Confident	107 Å²	107	116.1 Å²	116.1	50%	0.5	59%	0.59	S	S	.	*	H	α-helix	trans	-63.4	-40.2	173.4	-75.4	175.2	167.5	0	0	111.7	I848 K849 L854 L855 Q856	I848-E852 HydrophobicContact CG2-CG 4.41Å; I848-E852 WeakPolarHBondContact O-CG 3.27Å; I848-E852 PolarHBondContact O-N 3.25Å; K849-E852 PolarHBondContact O-N 3.17Å; E852-L854 VanDerWaalsContact C-N 3.33Å; E852-L855 PolarHBondContact O-N 2.84Å; E852-Q856 WeakPolarHBondContact O-CG 3.44Å; E852-Q856 PolarHBondContact O-N 3.46Å
853	R	78.8	Confident	69.6	Low	152 Å²	152	117.8 Å²	117.8	57%	0.574	60%	0.602	S	S	*	*	H	α-helix	trans	-65.6	-35.1	173	-73.2	169.3	-178.7	168.3	-6.1	112.5	K849 D850 R857	K849-R853 VanDerWaalsContact O-CG 3.3Å; K849-R853 WeakPolarHBondContact O-CG 3.3Å; K849-R853 PolarHBondContact O-N 3.37Å; D850-R853 PolarHBondContact O-N 3.35Å; D850-R853 IonicContact OD1-NH1 2.89Å; D850-R853 PolarHBondContact OD1-NH1 3.06Å; R853-R857 WeakPolarHBondContact O-CG 3.49Å; R853-R857 PolarHBondContact O-N 3.25Å
854	L	74.4	Confident	67.3	Low	105 Å²	105	118.6 Å²	118.6	55%	0.55	62%	0.616	S	S	.	*	H	α-helix	trans	-70	-37.3	174.7	-73.8	169.7	0	0	0	111.9	D850 L851 E852 R857 Q858	D850-L854 WeakPolarHBondContact O-CG 3.4Å; D850-L854 PolarHBondContact O-N 3.12Å; L851-L854 HydrophobicContact CD2-CD1 4.35Å; L851-L854 PolarHBondContact O-N 3.12Å; E852-L854 VanDerWaalsContact C-N 3.33Å; L854-R857 PolarHBondContact O-N 3.06Å; L854-Q858 PolarHBondContact O-N 3.18Å
855	L	67.1	Low	64.8	Low	117 Å²	117	121.5 Å²	121.5	61%	0.613	63%	0.634	S	S	*	*	H	α-helix	trans	-66.8	-40.5	173	-86.1	163.1	0	0	0	112.2	L851 E852 R857 Q858	L851-L855 PolarHBondContact O-N 2.99Å; E852-L855 PolarHBondContact O-N 2.84Å; L855-R857 PolarHBondContact O-N 3.23Å; L855-Q858 PolarHBondContact O-N 3.18Å
856	Q	69.2	Low	62.5	Low	167 Å²	167	127.2 Å²	127.2	78%	0.78	66%	0.655	S	S	*	*	H	α-helix	trans	-67.3	-17.7	174.3	-74.2	-179.7	0.8	0	0	113.5	E852	E852-Q856 WeakPolarHBondContact O-CG 3.44Å; E852-Q856 PolarHBondContact O-N 3.46Å
857	R	59.4	Low	60.2	Low	215 Å²	215	129.7 Å²	129.7	81%	0.811	67%	0.669	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.9	-6	174	-81.1	-176.8	174.6	-177	-0.6	114.1	R853 L854 L855	R853-R857 WeakPolarHBondContact O-CG 3.49Å; R853-R857 PolarHBondContact O-N 3.25Å; L854-R857 PolarHBondContact O-N 3.06Å; L855-R857 PolarHBondContact O-N 3.23Å
858	Q	45.2	Very low	57.6	Low	141 Å²	141	129 Å²	129	66%	0.659	69%	0.685	S	S	*	*	S	Bend	trans	-75.3	125.3	171.3	-83.8	-173.8	-22.7	0	0	109.9	L854 L855	L854-Q858 PolarHBondContact O-N 3.18Å; L855-Q858 PolarHBondContact O-N 3.18Å
859	P	45.7	Very low	55.4	Low	121 Å²	121	134.2 Å²	134.2	79%	0.786	71%	0.708	S	S	*	*	P	Polyproline II helix	trans	-65.9	138.9	172.4	17.7	-14.7	0	0	0	109.5
860	A	43.1	Very low	53.4	Low	86 Å²	86	136.8 Å²	136.8	71%	0.711	72%	0.721	S	S	*	*	P	Polyproline II helix	trans	-54.1	140.8	174.8	0	0	0	0	0	110.5	E862	A860-E862 PolarHBondContact O-N 2.82Å
861	P	47.8	Very low	51.3	Low	125 Å²	125	142.6 Å²	142.6	81%	0.812	74%	0.743	S	S	*	*	P	Polyproline II helix	trans	-61.9	129.1	172.4	25.4	-31	0	0	0	109.1
862	E	43	Very low	49.1	Very low	183 Å²	183	146.8 Å²	146.8	86%	0.855	76%	0.757	S	S	*	*	P	Polyproline II helix	trans	-54.9	135.1	179.2	-72.1	-178.5	156.2	0	0	110.9	A860	A860-E862 PolarHBondContact O-N 2.82Å
863	P	42.4	Very low	46.8	Very low	113 Å²	113	148 Å²	148	73%	0.734	77%	0.772	S	S	*	*	P	Polyproline II helix	trans	-67.3	144.3	172.2	28.8	-31.9	0	0	0	109.5	S865	P863-S865 PolarHBondContact O-N 3.12Å
864	P	40.1	Very low	45.3	Very low	122 Å²	122	150.3 Å²	150.3	79%	0.792	81%	0.807	S	S	*	*	P	Polyproline II helix	trans	-61.1	131.6	179.2	25	-32.3	0	0	0	110.2	K866	P864-K866 PolarHBondContact O-N 2.92Å
865	S	34.8	Very low	43.9	Very low	106 Å²	106	152.6 Å²	152.6	74%	0.741	82%	0.819	S	S	*	*	P	Polyproline II helix	trans	-55	122.4	177.5	46.5	0	0	0	0	111.1	P863 D867	P863-S865 PolarHBondContact O-N 3.12Å; S865-D867 PolarHBondContact O-N 3.45Å
866	K	38.5	Very low	42.6	Very low	207 Å²	207	154.4 Å²	154.4	90%	0.9	83%	0.83	S	S	*	*			trans	-76	75.3	166.4	-74.9	-178.6	173.4	-179.1	0	109.3	P864	P864-K866 PolarHBondContact O-N 2.92Å
867	D	38.7	Very low	41.2	Very low	153 Å²	153	153.7 Å²	153.7	82%	0.818	83%	0.833	S	S	*	*			trans	-140.3	63.8	168.8	-83.4	-38.9	0	0	0	110	S865	S865-D867 PolarHBondContact O-N 3.45Å
868	A	34.7	Very low	40.1	Very low	100 Å²	100	150.1 Å²	150.1	83%	0.826	83%	0.834	S	S	*	*	S	Bend	trans	-160	17.6	165.1	0	0	0	0	0	115.1
869	E	36.9	Very low	39.8	Very low	196 Å²	196	150.7 Å²	150.7	92%	0.916	85%	0.845	S	S	*	*			trans	-122.7	70.2	172.9	-81.6	-169.7	160.2	0	0	110.4
870	E	41.9	Very low	39.4	Very low	181 Å²	181	152.7 Å²	152.7	85%	0.846	85%	0.849	S	S	*	*			trans	-169.9	86.7	146.6	-110.7	178.9	-160.8	0	0	109.3
871	K	37.3	Very low	39.1	Very low	193 Å²	193	157.4 Å²	157.4	84%	0.839	86%	0.859	S	S	*	*	S	Bend	trans	177.1	117.3	133.3	-96.1	156	-170.6	171.8	0	112
872	K	34.3	Very low	38.5	Very low	192 Å²	192	159.9 Å²	159.9	84%	0.835	86%	0.863	S	S	*	*			trans	82.8	110.7	156	-56.1	175.2	178.8	-178.6	0	114.1
873	T	29.4	Very low	38.1	Very low	133 Å²	133	158 Å²	158	82%	0.816	86%	0.864	S	S	*	*				-171	168	60.2	35.4	0	0	0	0	110.3
874	P	48.1	Very low	37.7	Very low	200 Å²	200	162.1 Å²	162.1	100%	1.299	88%	0.875	S	S	*	*			cis	-105.6	0	1.9	25.9	-7.8	0	0	0	115.4

Retrieved 874 of 874 residues in 3233.8 ms (Link to these results)

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