A0A087YN33_POEFO Loading...

Transient receptor potential cation channel, subfamily M, member 5

AlphaFold DB , UniProt , Accession A0A087YN33, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 1,203 aa.

						>A0A087YN33_POEFO|A0A087YN33
MLEWSEEHSVLLGCSCCCKVDETIQNVARGLANKMKEKTHWAAGRVGDIDFVGSTKTKGKFVRVSSNTDPVLIYKMLTEDWGLSPPHLVVALVGGDELAQMKPWLRDTLRKGLVKAAQSTGAWILTNGLRFGITKHLGQAVRDHSLASTSSKVRVVAIGIAPWNMIHNRKALLTAKVDEPAAYTPQDLPHGAVYSLDSHHSHFVFVEEDPNRPGATSEMRVKLLKHISLQRTGYGGAGSFEIPVLCLLVHGEPRILKRMCKGIGNSTPWLILAGSGGVADILVTLMNRGCWDADSVHELLLDTFPNAHHSTDISNWVKLIQKILDHGHLLTVHDPEQESSELDTVILKALVKACKSQSQEAQDFLDELKLAVAWNRVDIAKSDIFNGDVEWKACDLEEVMMDALINDKPDFVRLFVDNGVNLGEFLTYGRLQELYWSVSEKSLLHNLLLKKYEEKQLLLGAARTPGPPGHHPSEQGKPRFTLFEVAKVLKDFLHDSCKGFYQKMPAEKPPKGRLFHSQKNLPELEERCEHPWRDLFLWAVLQNRQQMANYFWAMGPEAVAAALAGCKILKEMARLESEAESARSMKEAKYEQFALADVFGECYSNSEDRAYALLVRRTQCWSKSTVLNLATEADAKSFFAHDGVQALLTKLWWGAMTTDTAISKLVVSFFFPPLIWTNLIMFSDEELDNRDGKKEFVELDSLDTEKALLLTDDDDPLDTAPGGQTSQSCASVWWRFLLRRWRRFWSAPVTVFFGNVIMYFAFLCLFTYVLLLDFKSPPDGPKVPEIMLYFWVFTLVLEEIRQSFFTDEEINILKKFKLYVEDNWNKCDMVAILLFVVGVSCRMSEDTFEAGRTVLAIDFMVFTLRLIHIFAIHKQLGPKIIIVERMMKDVFFFLFFLSVWLIAYGVATQALLHPNDPRIDWVFRRALYRPYLHIFGQIPLDDIDAARMPNITCTENSTQILEGHLPPCPNKYANWLVILLLVIFLLVTNVLLLNLLIAMFSYTFQVVQGNTDIFWKFQRYNLIVEYHSRPALAPPFIIISHISQLILCMVKRPESKQEHLERELPVGLDQRLITWETVQKENYLAKVERQQWESSEEKLKTTSSKVQSLLKIVGGFKDQERRLVSVEAQVRYCGEVLSWMAECFAQSTLKCEKDAPKAPSSKADHTADTPQSHSEQEARQEEEEPKPGHPGYGANKKFPYIDE
					

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	39.1	Very low	25.5	Very low	239 Å²	239	160.2 Å²	160.2	100%	1.177	81%	0.809	S	S	*	*				0	129.2	0	-88	-177.3	-169.4	0	0	106.9
2	L	23.1	Very low	25.5	Very low	166 Å²	166	160.6 Å²	160.6	87%	0.869	81%	0.813	S	S	*	*			trans	131.2	103.6	167.9	-74	155.6	0	0	0	111.8
3	E	25.1	Very low	25.3	Very low	162 Å²	162	154.2 Å²	154.2	76%	0.757	81%	0.813	S	S	*	*				16	143.9	127.4	-89.1	-178.6	157.2	0	0	122.9
4	W	24.7	Very low	25.2	Very low	228 Å²	228	152.6 Å²	152.6	86%	0.864	82%	0.818	S	S	*	*			trans	109.2	128.3	139.5	-86.6	36.1	0	0	0	121.8
5	S	21.9	Very low	25.6	Very low	108 Å²	108	149.1 Å²	149.1	76%	0.755	81%	0.81	S	S	*	*			trans	88.8	131.2	137.9	-153.1	0	0	0	0	122.7
6	E	26	Very low	25.8	Very low	176 Å²	176	146.7 Å²	146.7	82%	0.822	81%	0.806	S	S	*	*			trans	-59.6	153.8	157.9	-64.7	174.9	132	0	0	112.5
7	E	23.5	Very low	26	Very low	171 Å²	171	145.4 Å²	145.4	80%	0.799	81%	0.808	S	S	*	*				161.1	139.8	120	-87.4	-165.8	158	0	0	114.1
8	H	23.8	Very low	26	Very low	157 Å²	157	144.2 Å²	144.2	73%	0.727	81%	0.81	S	S	*	*			trans	40.5	121	143.8	-76.9	-87.6	0	0	0	121.9
9	S	22.6	Very low	26.7	Very low	96 Å²	96	147.7 Å²	147.7	67%	0.671	82%	0.816	S	S	*	*				71.4	136.8	94.6	106.5	0	0	0	0	113.4
10	V	25.6	Very low	27.1	Very low	121 Å²	121	146 Å²	146	73%	0.733	81%	0.809	S	S	*	*			cis	-178.1	160.9	26	99.1	0	0	0	0	109
11	L	24.6	Very low	27.3	Very low	138 Å²	138	144.7 Å²	144.7	72%	0.723	80%	0.801	S	S	*	*			trans	83.7	128	150.6	-74.9	165	0	0	0	124.7
12	L	26.4	Very low	27.1	Very low	165 Å²	165	141.3 Å²	141.3	86%	0.864	78%	0.782	S	S	*	*			trans	79.2	123.6	136.7	-79.3	155.5	0	0	0	120.4
13	G	22.9	Very low	27.6	Very low	78 Å²	78	138.5 Å²	138.5	80%	0.804	77%	0.772	S	S	*	*			trans	161.9	121.1	155.6	0	0	0	0	0	114.8
14	C	23.3	Very low	28.5	Very low	132 Å²	132	137 Å²	137	89%	0.892	77%	0.768	S	S	*	*			trans	-77.4	157.5	-172.4	-131.1	0	0	0	0	115.6
15	S	31.2	Very low	29.2	Very low	100 Å²	100	131.9 Å²	131.9	70%	0.699	75%	0.754	S	S	*	*			trans	62	139.8	136.3	-151.9	0	0	0	0	123.8
16	C	28.8	Very low	29.7	Very low	110 Å²	110	132.2 Å²	132.2	74%	0.743	75%	0.747	S	S	*	*			trans	75.6	111.1	154.2	-69.3	0	0	0	0	119.5
17	C	28.8	Very low	30.4	Very low	124 Å²	124	128.6 Å²	128.6	84%	0.838	74%	0.737	S	S	*	*				167.6	142.1	109.8	-94.6	0	0	0	0	110
18	C	26	Very low	31.1	Very low	125 Å²	125	123.3 Å²	123.3	85%	0.845	72%	0.722	S	S	*	*			trans	-176.3	102.6	134.4	-96.8	0	0	0	0	109.9
19	K	40.3	Very low	31.7	Very low	210 Å²	210	123.4 Å²	123.4	91%	0.913	72%	0.716	S	S	*	*			trans	-81.5	129.5	147.8	-90.5	-178.8	170.3	-179.4	0	106.9
20	V	33.7	Very low	32.2	Very low	113 Å²	113	121.6 Å²	121.6	69%	0.685	71%	0.713	S	S	*	*			trans	-148.6	119.5	157.3	-177.9	0	0	0	0	111.4
21	D	32.5	Very low	32.7	Very low	120 Å²	120	122.3 Å²	122.3	64%	0.642	71%	0.711	S	S	*	*			trans	48.8	113.3	147.2	-62.9	-23.7	0	0	0	124.6	T23	D21-T23 PolarHBondContact O-N 3.39Å
22	E	34.1	Very low	33.1	Very low	168 Å²	168	118.8 Å²	118.8	79%	0.785	70%	0.702	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66.8	-5.2	165.8	-86.8	179.6	137.1	0	0	114.9
23	T	34.1	Very low	33.4	Very low	107 Å²	107	117 Å²	117	66%	0.656	69%	0.694	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.9	-18.7	-173.4	-1.8	0	0	0	0	113.7	D21	D21-T23 PolarHBondContact O-N 3.39Å
24	I	42.8	Very low	33.8	Very low	130 Å²	130	123 Å²	123	67%	0.667	70%	0.698	S	S	*	*	S	Bend	trans	-85.5	-22.2	178.7	-63.6	176.5	0	0	0	111.8	N26 V27 A28	I24-N26 VanDerWaalsContact C-N 3.33Å; I24-N26 PolarHBondContact O-N 3.4Å; I24-V27 PolarHBondContact O-N 2.9Å; I24-A28 PolarHBondContact O-N 3.16Å
25	Q	39.4	Very low	34.2	Very low	121 Å²	121	125.1 Å²	125.1	57%	0.565	70%	0.696	S	S	*	*	H	α-helix	trans	-73.6	-23.7	-173.1	-150.7	166.9	16.5	0	0	113.5
26	N	32.9	Very low	34.3	Very low	114 Å²	114	128.7 Å²	128.7	61%	0.61	70%	0.7	S	S	*	*	H	α-helix	trans	-85.8	-26.6	-179.9	-70.7	-24.3	0	0	0	113.3	I24	I24-N26 VanDerWaalsContact C-N 3.33Å; I24-N26 PolarHBondContact O-N 3.4Å
27	V	40.4	Very low	34.6	Very low	101 Å²	101	132.5 Å²	132.5	61%	0.612	71%	0.706	S	S	*	*	H	α-helix	trans	-77.9	-35.2	174.7	-177.9	0	0	0	0	111	I24 R29 G30	I24-V27 PolarHBondContact O-N 2.9Å; V27-R29 VanDerWaalsContact C-N 3.28Å; V27-R29 PolarHBondContact O-N 2.93Å; V27-G30 PolarHBondContact O-N 3.33Å
28	A	39.3	Very low	34.9	Very low	59 Å²	59	135.8 Å²	135.8	49%	0.488	71%	0.706	S	S	.	*	H	α-helix	trans	-65.1	-29.7	175.3	0	0	0	0	0	113.3	I24 G30 A32	I24-A28 PolarHBondContact O-N 3.16Å; A28-G30 VanDerWaalsContact C-N 3.34Å; A28-G30 PolarHBondContact O-N 3.16Å; A28-A32 PolarHBondContact O-N 2.57Å
29	R	35.9	Very low	35.6	Very low	160 Å²	160	136 Å²	136	60%	0.604	70%	0.704	S	S	*	*	H	α-helix	trans	-74.6	-23.3	-177.6	-143.8	177.2	-89.5	156.2	-7.9	112.9	V27	V27-R29 VanDerWaalsContact C-N 3.28Å; V27-R29 PolarHBondContact O-N 2.93Å
30	G	32.8	Very low	36	Very low	58 Å²	58	134.3 Å²	134.3	60%	0.598	70%	0.699	S	S	*	*	H	α-helix	trans	-82.1	-32.2	176.2	0	0	0	0	0	114.5	V27 A28	V27-G30 PolarHBondContact O-N 3.33Å; A28-G30 VanDerWaalsContact C-N 3.34Å; A28-G30 PolarHBondContact O-N 3.16Å
31	L	36	Very low	37.1	Very low	135 Å²	135	131.1 Å²	131.1	71%	0.707	68%	0.675	S	S	*	*	H	α-helix	trans	-81.5	-23	177.7	-84.2	155.5	0	0	0	113.2	N33	L31-N33 PolarHBondContact O-N 3.19Å
32	A	33.5	Very low	38.1	Very low	64 Å²	64	128.4 Å²	128.4	53%	0.529	67%	0.669	S	S	.	*	T	Hydrogen-bonded Turn	trans	-68.7	-15.9	178.5	0	0	0	0	0	114.6	A28	A28-A32 PolarHBondContact O-N 2.57Å
33	N	31.9	Very low	38.7	Very low	129 Å²	129	125.3 Å²	125.3	69%	0.69	67%	0.672	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91.5	-0.8	-176.5	-86.3	-11.7	0	0	0	115	L31	L31-N33 PolarHBondContact O-N 3.19Å
34	K	32.6	Very low	39.7	Very low	203 Å²	203	121.7 Å²	121.7	88%	0.883	66%	0.656	S	S	*	*	S	Bend	trans	-110.5	3.8	179.4	-112.7	-179.9	179	-179.2	0	115.3
35	M	30.3	Very low	41	Very low	176 Å²	176	121 Å²	121	87%	0.867	65%	0.645	S	S	*	*			trans	-121.9	30.5	178.4	-101.6	177.8	171.4	0	0	112.5	E37	M35-E37 PolarHBondContact O-N 3.01Å
36	K	33.6	Very low	42.9	Very low	176 Å²	176	117 Å²	117	77%	0.765	63%	0.629	S	S	*	*			trans	-92.6	86.6	165.6	-94.5	-178.1	172	177.9	0	108.4
37	E	34.9	Very low	45.3	Very low	189 Å²	189	111.8 Å²	111.8	88%	0.883	60%	0.602	S	S	*	*	S	Bend	trans	168.7	69.2	150.4	-96.7	173.3	-173.7	0	0	110.1	M35	M35-E37 PolarHBondContact O-N 3.01Å
38	K	36.3	Very low	47.5	Very low	193 Å²	193	110 Å²	110	84%	0.839	59%	0.589	S	S	*	*	S	Bend	trans	161.3	130	148.3	-92.4	169.6	179.1	-179.9	0	108
39	T	40.7	Very low	49.8	Very low	129 Å²	129	107.2 Å²	107.2	79%	0.791	57%	0.566	S	S	*	*			trans	73.4	104.8	-175.8	59.3	0	0	0	0	116.4	W41	T39-W41 PolarHBondContact O-N 3.33Å
40	H	47.7	Very low	52.3	Low	175 Å²	175	101.9 Å²	101.9	81%	0.81	55%	0.55	S	S	*	.	S	Bend	trans	-66.1	-6	169.3	-95	-86.8	0	0	0	113.5
41	W	57.6	Low	54.9	Low	47 Å²	47	99.2 Å²	99.2	18%	0.178	52%	0.521	C	S	.	.	S	Bend	trans	-109.2	111.4	-175.2	-56.3	113.8	0	0	0	110	T39 V46 V62 V64 T68 L72 M76	T39-W41 PolarHBondContact O-N 3.33Å; W41-V46 HydrophobicContact CB-CG2 3.88Å; W41-V46 HydrophobicContact CD2-CG2 4.37Å; W41-V46 HydrophobicContact CG-CG2 3.99Å; W41-V62 HydrophobicContact CE3-CG2 4.41Å; W41-V62 HydrophobicContact CZ3-CG2 4.31Å; W41-V64 HydrophobicContact CH2-CG1 4.43Å; W41-V64 HydrophobicContact CZ3-CG1 4.39Å; W41-T68 HydrophobicContact CH2-CG2 4.36Å; W41-L72 HydrophobicContact CH2-CB 4.2Å; W41-L72 HydrophobicContact CZ2-CB 4.12Å; W41-M76 HydrophobicContact CZ2-CB 4.29Å; W41-M76 HydrophobicContact CZ2-SD 4.11Å
42	A	52.3	Low	56.9	Low	62 Å²	62	96.1 Å²	96.1	51%	0.512	51%	0.508	S	S	.	.			trans	-62.7	148.1	175.5	0	0	0	0	0	111.9	G44 R45	A42-G44 PolarHBondContact O-N 2.89Å; A42-R45 PolarHBondContact O-N 3.39Å
43	A	46.9	Very low	58.7	Low	103 Å²	103	95.6 Å²	95.6	85%	0.851	51%	0.509	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.5	134.3	175.2	0	0	0	0	0	111.7
44	G	55.3	Low	59.9	Low	32 Å²	32	95.6 Å²	95.6	33%	0.33	52%	0.519	S	S	.	.	T	Hydrogen-bonded Turn	trans	89.9	5.2	-176.1	0	0	0	0	0	115.5	A42	A42-G44 PolarHBondContact O-N 2.89Å
45	R	70.3	Confident	61.3	Low	114 Å²	114	88.4 Å²	88.4	43%	0.43	49%	0.492	S	S	.	.	S	Bend	trans	-109.4	-15.7	173	-66.7	-171.7	177.2	-169	-2.6	114.8	A42 V62 R63	A42-R45 PolarHBondContact O-N 3.39Å; R45-V62 CarbonylContact O-C 3.58Å; R45-V62 WeakPolarHBondContact O-CA 3.36Å; R45-R63 PolarHBondContact O-N 2.91Å
46	V	79.4	Confident	63.1	Low	38 Å²	38	89.2 Å²	89.2	23%	0.23	49%	0.491	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	141.4	177.3	178.7	0	0	0	0	107.8	W41 F61 V62 M76 W81	W41-V46 HydrophobicContact CB-CG2 3.88Å; W41-V46 HydrophobicContact CD2-CG2 4.37Å; W41-V46 HydrophobicContact CG-CG2 3.99Å; V46-F61 WeakPolarHBondContact CA-O 3.15Å; V46-V62 HydrophobicContact CG2-CB 4.23Å; V46-V62 HydrophobicContact CG2-CG2 3.78Å; V46-M76 HydrophobicContact CG2-SD 4.34Å; V46-W81 HydrophobicContact CG1-CZ2 4.48Å
47	G	83.1	Confident	65.3	Low	5 Å²	5	82.7 Å²	82.7	5%	0.052	47%	0.466	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-173.9	175.5	175.5	0	0	0	0	0	113.2	F61	G47-F61 PolarHBondContact N-O 3.28Å; G47-F61 VanDerWaalsContact N-O 3.1Å; G47-F61 WeakPolarHBondContact O-CD1 3.49Å; G47-F61 PolarHBondContact O-N 2.91Å
48	D	86.9	Confident	67.7	Low	63 Å²	63	81 Å²	81	34%	0.337	46%	0.456	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99	147.5	175.5	-70.9	-5.5	0	0	0	110.3	G59 K60 P180 A181	D48-G59 CarbonylContact C-O 3.54Å; D48-G59 WeakPolarHBondContact CA-O 3.4Å; D48-K60 WeakPolarHBondContact OD1-CG 3.29Å; D48-P180 HydrophobicContact CB-CB 3.97Å; D48-P180 CarbonylContact O-C 3.36Å; D48-P180 WeakPolarHBondContact O-CA 3.34Å; D48-A181 PolarHBondContact O-N 3.5Å
49	I	88.3	Confident	70.1	Confident	0 Å²	0	72 Å²	72	0%	0	42%	0.417	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	129	176.1	-48.9	-177.8	0	0	0	107.7	F51 K58 G59 F61 L172 A181 Y183 L196 F203 F205	I49-F51 HydrophobicContact CB-CE2 4.39Å; I49-F51 HydrophobicContact CG2-CD1 4.4Å; I49-F51 HydrophobicContact CG2-CD2 4.31Å; I49-F51 HydrophobicContact CG2-CE1 4.15Å; I49-F51 HydrophobicContact CG2-CE2 4.06Å; I49-F51 HydrophobicContact CG2-CG 4.48Å; I49-F51 HydrophobicContact CG2-CZ 3.98Å; I49-K58 WeakPolarHBondContact O-CA 3.33Å; I49-G59 PolarHBondContact N-O 3.35Å; I49-G59 PolarHBondContact O-N 3.43Å; I49-F61 HydrophobicContact CD1-CB 4.02Å; I49-F61 HydrophobicContact CD1-CD1 3.78Å; I49-F61 HydrophobicContact CD1-CG 4.15Å; I49-F61 HydrophobicContact CG1-CB 4.45Å; I49-F61 HydrophobicContact CG1-CD1 3.42Å; I49-F61 VanDerWaalsContact CG1-CD1 3.42Å; I49-F61 HydrophobicContact CG1-CE1 4.04Å; I49-F61 HydrophobicContact CG1-CG 4.28Å; I49-L172 HydrophobicContact CD1-CD2 3.75Å; I49-L172 HydrophobicContact CG1-CD2 3.99Å; I49-L172 HydrophobicContact CG2-CD2 4.46Å; I49-A181 WeakPolarHBondContact CA-O 3.46Å; I49-Y183 HydrophobicContact CG2-CG 4.4Å; I49-L196 HydrophobicContact CD1-CD1 4.05Å; I49-F203 HydrophobicContact CD1-CD2 4.1Å; I49-F203 HydrophobicContact CD1-CE2 4.4Å; I49-F205 HydrophobicContact CD1-CZ 4.47Å
50	D	87.9	Confident	72.5	Confident	49 Å²	49	69 Å²	69	26%	0.262	39%	0.393	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	113.1	167.6	-158.6	4.9	0	0	0	108.7	V52 P180 A181 A182 Y183	D50-V52 PolarHBondContact O-N 3.26Å; D50-P180 HydrophobicContact CB-CB 4.13Å; D50-P180 HydrophobicContact CB-CG 4.34Å; D50-A181 PolarHBondContact N-O 2.96Å; D50-A182 WeakPolarHBondContact O-CA 3.04Å; D50-Y183 PolarHBondContact O-N 3.29Å
51	F	87.3	Confident	74.5	Confident	1 Å²	1	60.9 Å²	60.9	0%	0.004	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.4	108.6	-179.9	-70.8	-79.6	0	0	0	109.8	I49 T57 Y183 P185 L196 F203	I49-F51 HydrophobicContact CB-CE2 4.39Å; I49-F51 HydrophobicContact CG2-CD1 4.4Å; I49-F51 HydrophobicContact CG2-CD2 4.31Å; I49-F51 HydrophobicContact CG2-CE1 4.15Å; I49-F51 HydrophobicContact CG2-CE2 4.06Å; I49-F51 HydrophobicContact CG2-CG 4.48Å; I49-F51 HydrophobicContact CG2-CZ 3.98Å; F51-T57 WeakPolarHBondContact CD2-O 3.4Å; F51-T57 PolarHBondContact N-O 2.85Å; F51-Y183 CarbonylContact C-O 3.28Å; F51-Y183 VanDerWaalsContact CA-O 3.29Å; F51-Y183 WeakPolarHBondContact CA-O 3Å; F51-Y183 AromaticContact CD1-CD1 3.81Å; F51-Y183 HydrophobicContact CD1-CD1 3.81Å; F51-Y183 AromaticContact CE1-CD1 3.64Å; F51-Y183 HydrophobicContact CE1-CD1 3.64Å; F51-Y183 HydrophobicContact CE1-CE1 4.26Å; F51-Y183 HydrophobicContact CE1-CG 4.38Å; F51-P185 HydrophobicContact CD1-CG 4.38Å; F51-L196 HydrophobicContact CE1-CB 4.05Å; F51-L196 HydrophobicContact CZ-CB 4.3Å; F51-F203 HydrophobicContact CE2-CE2 4.06Å; F51-F203 HydrophobicContact CE2-CZ 4.37Å; F51-F203 AromaticContact CZ-CE2 3.86Å; F51-F203 HydrophobicContact CZ-CE2 3.86Å; F51-F203 AromaticContact CZ-CZ 3.88Å; F51-F203 HydrophobicContact CZ-CZ 3.88Å
52	V	79.1	Confident	76	Confident	71 Å²	71	58.6 Å²	58.6	43%	0.43	35%	0.347	S	S	.	.			trans	-87.3	117	-178.3	-173.2	0	0	0	0	109.2	D50 A182 Y183	D50-V52 PolarHBondContact O-N 3.26Å; V52-A182 HydrophobicContact CG2-CB 3.81Å; V52-Y183 PolarHBondContact N-O 3.43Å
53	G	70.4	Confident	77.8	Confident	52 Å²	52	58.5 Å²	58.5	54%	0.536	33%	0.333	S	S	.	.	S	Bend	trans	164.6	-151.4	-177.7	0	0	0	0	0	113.8	T55	G53-T55 VanDerWaalsContact C-N 3.27Å; G53-T55 PolarHBondContact O-N 3.12Å
54	S	57.7	Low	79.8	Confident	129 Å²	129	53.7 Å²	53.7	90%	0.902	29%	0.293	S	S	*	.	S	Bend	trans	-67.6	-19.6	-177.7	52.3	0	0	0	0	114.8
55	T	60.8	Low	81.3	Confident	52 Å²	52	54 Å²	54	32%	0.319	29%	0.29	S	S	.	.	S	Bend	trans	-129.8	119.1	173.8	53.8	0	0	0	0	109.3	G53 T57	G53-T55 VanDerWaalsContact C-N 3.27Å; G53-T55 PolarHBondContact O-N 3.12Å; T55-T57 PolarHBondContact O-N 3.4Å
56	K	69.2	Low	81.7	Confident	193 Å²	193	50.2 Å²	50.2	84%	0.839	28%	0.281	S	S	*	.			trans	-79	94.1	173	-68.2	-174.3	179.3	-176.7	0	109.5
57	T	79.1	Confident	81.8	Confident	39 Å²	39	55.1 Å²	55.1	24%	0.239	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	144.1	174.5	51.6	0	0	0	0	110.1	F51 T55 S198	F51-T57 WeakPolarHBondContact CD2-O 3.4Å; F51-T57 PolarHBondContact N-O 2.85Å; T55-T57 PolarHBondContact O-N 3.4Å; T57-S198 WeakPolarHBondContact CB-O 3.5Å; T57-S198 PolarHBondContact OG1-O 3.02Å
58	K	85.2	Confident	82	Confident	155 Å²	155	56 Å²	56	67%	0.674	31%	0.31	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-105.2	138.2	174	-65	-172	176.5	-170.2	0	109.5	I49	I49-K58 WeakPolarHBondContact O-CA 3.33Å
59	G	87.4	Confident	82	Confident	2 Å²	2	57.1 Å²	57.1	2%	0.021	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	156.5	171.7	0	0	0	0	0	111	D48 I49 S201	D48-G59 CarbonylContact C-O 3.54Å; D48-G59 WeakPolarHBondContact CA-O 3.4Å; I49-G59 PolarHBondContact N-O 3.35Å; I49-G59 PolarHBondContact O-N 3.43Å; G59-S201 WeakPolarHBondContact CA-O 3.46Å
60	K	89.8	Confident	82.1	Confident	67 Å²	67	57.8 Å²	57.8	29%	0.291	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	145.4	170.6	-57.5	-170	171.4	-179.2	0	110	D48 W81 S201 H202 F203	D48-K60 WeakPolarHBondContact OD1-CG 3.29Å; K60-W81 HydrophobicContact CB-CD2 4.13Å; K60-W81 HydrophobicContact CB-CE3 4.42Å; K60-W81 HydrophobicContact CB-CH2 4.17Å; K60-W81 HydrophobicContact CB-CZ2 3.87Å; K60-W81 HydrophobicContact CB-CZ3 4.45Å; K60-W81 HydrophobicContact CD-CB 4.28Å; K60-W81 HydrophobicContact CD-CD2 4Å; K60-W81 HydrophobicContact CD-CG 3.74Å; K60-S201 PolarHBondContact N-O 3.27Å; K60-S201 VanDerWaalsContact N-O 3.12Å; K60-H202 CarbonylContact O-C 3.56Å; K60-H202 WeakPolarHBondContact O-CA 3.37Å; K60-F203 PolarHBondContact O-N 2.97Å
61	F	90.6	Very high	82.2	Confident	4 Å²	4	57.8 Å²	57.8	2%	0.018	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.8	150	175.1	78.8	-83	0	0	0	113.5	V46 G47 I49 L172 A175 F203 F205	V46-F61 WeakPolarHBondContact CA-O 3.15Å; G47-F61 PolarHBondContact N-O 3.28Å; G47-F61 VanDerWaalsContact N-O 3.1Å; G47-F61 WeakPolarHBondContact O-CD1 3.49Å; G47-F61 PolarHBondContact O-N 2.91Å; I49-F61 HydrophobicContact CD1-CB 4.02Å; I49-F61 HydrophobicContact CD1-CD1 3.78Å; I49-F61 HydrophobicContact CD1-CG 4.15Å; I49-F61 HydrophobicContact CG1-CB 4.45Å; I49-F61 HydrophobicContact CG1-CD1 3.42Å; I49-F61 VanDerWaalsContact CG1-CD1 3.42Å; I49-F61 HydrophobicContact CG1-CE1 4.04Å; I49-F61 HydrophobicContact CG1-CG 4.28Å; F61-L172 HydrophobicContact CZ-CB 4.25Å; F61-L172 VanDerWaalsContact CZ-O 3.3Å; F61-L172 WeakPolarHBondContact CZ-O 3.26Å; F61-A175 HydrophobicContact CE1-CB 3.86Å; F61-A175 HydrophobicContact CZ-CB 3.88Å; F61-F203 CarbonylContact C-O 3.58Å; F61-F203 VanDerWaalsContact CA-O 3.27Å; F61-F203 WeakPolarHBondContact CA-O 3.47Å; F61-F203 HydrophobicContact CB-CB 3.88Å; F61-F205 HydrophobicContact CB-CD2 4.13Å; F61-F205 HydrophobicContact CB-CE2 3.52Å; F61-F205 HydrophobicContact CB-CZ 4.04Å; F61-F205 AromaticContact CD2-CD2 3.63Å; F61-F205 HydrophobicContact CD2-CD2 3.63Å; F61-F205 AromaticContact CD2-CE2 3.49Å; F61-F205 HydrophobicContact CD2-CE2 3.49Å; F61-F205 VanDerWaalsContact CD2-CE2 3.49Å; F61-F205 HydrophobicContact CE2-CD2 4.48Å; F61-F205 HydrophobicContact CE2-CE2 4.39Å; F61-F205 HydrophobicContact CG-CD2 4.21Å; F61-F205 AromaticContact CG-CE2 3.65Å; F61-F205 HydrophobicContact CG-CE2 3.65Å
62	V	90.2	Very high	82.3	Confident	0 Å²	0	61 Å²	61	0%	0	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	144.5	166.5	64.4	0	0	0	0	110.1	W41 R45 V46 V64 M76 W81 F203 V204 F205	W41-V62 HydrophobicContact CE3-CG2 4.41Å; W41-V62 HydrophobicContact CZ3-CG2 4.31Å; R45-V62 CarbonylContact O-C 3.58Å; R45-V62 WeakPolarHBondContact O-CA 3.36Å; V46-V62 HydrophobicContact CG2-CB 4.23Å; V46-V62 HydrophobicContact CG2-CG2 3.78Å; V62-V64 HydrophobicContact CG1-CG1 4.15Å; V62-V64 HydrophobicContact CG2-CG1 3.84Å; V62-M76 HydrophobicContact CB-CE 3.55Å; V62-M76 HydrophobicContact CB-SD 3.64Å; V62-M76 HydrophobicContact CG1-CE 3.31Å; V62-M76 HydrophobicContact CG1-SD 4.04Å; V62-M76 HydrophobicContact CG2-CE 4.05Å; V62-M76 HydrophobicContact CG2-SD 3.6Å; V62-M76 VanDerWaalsContact CG2-SD 3.6Å; V62-W81 HydrophobicContact CB-CH2 4.15Å; V62-W81 HydrophobicContact CB-CZ2 4.16Å; V62-W81 HydrophobicContact CG1-CH2 4.06Å; V62-F203 PolarHBondContact N-O 3.2Å; V62-V204 HydrophobicContact CG1-CB 4.19Å; V62-V204 HydrophobicContact CG1-CG1 4.03Å; V62-V204 HydrophobicContact CG1-CG2 3.96Å; V62-F205 PolarHBondContact O-N 2.92Å
63	R	88.6	Confident	82.9	Confident	59 Å²	59	57.7 Å²	57.7	22%	0.223	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	119.9	170.4	-178.8	176.4	166.4	-174.2	-2.3	109.7	R45 F205 E207	R45-R63 PolarHBondContact O-N 2.91Å; R63-F205 CarbonylContact C-O 3.51Å; R63-F205 WeakPolarHBondContact CA-O 3.31Å; R63-E207 HydrophobicContact CG-CG 4.35Å; R63-E207 IonicContact CZ-OE1 2.73Å; R63-E207 IonicContact NE-OE1 3.68Å; R63-E207 PolarHBondContact NE-OE1 3.05Å; R63-E207 IonicContact NH2-OE1 3.43Å; R63-E207 PolarHBondContact NH2-OE1 3.37Å
64	V	89.1	Confident	83.8	Confident	2 Å²	2	56.2 Å²	56.2	1%	0.012	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	148.4	-176.6	-59.9	0	0	0	0	111.4	W41 V62 T68 I73 V204 F205 V206 E207	W41-V64 HydrophobicContact CH2-CG1 4.43Å; W41-V64 HydrophobicContact CZ3-CG1 4.39Å; V62-V64 HydrophobicContact CG1-CG1 4.15Å; V62-V64 HydrophobicContact CG2-CG1 3.84Å; V64-T68 HydrophobicContact CB-CG2 4.43Å; V64-T68 HydrophobicContact CG1-CG2 4.47Å; V64-I73 HydrophobicContact CG1-CD1 4.28Å; V64-I73 HydrophobicContact CG1-CG1 4.27Å; V64-I73 HydrophobicContact CG2-CD1 4.33Å; V64-V204 HydrophobicContact CG1-CG1 4.43Å; V64-V204 HydrophobicContact CG2-CG1 3.81Å; V64-F205 WeakPolarHBondContact CG2-O 3.31Å; V64-F205 PolarHBondContact N-O 3.18Å; V64-V206 HydrophobicContact CG2-CB 4.49Å; V64-V206 HydrophobicContact CG2-CG2 3.99Å; V64-E207 PolarHBondContact O-N 3.33Å
65	S	86.4	Confident	85.3	Confident	40 Å²	40	54.9 Å²	54.9	28%	0.28	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.4	157.8	171.3	70.3	0	0	0	0	110.7	N67 T68 M219	S65-N67 PolarHBondContact O-N 2.86Å; S65-N67 VanDerWaalsContact O-N 3.07Å; S65-T68 PolarHBondContact N-OG1 3.43Å; S65-T68 VanDerWaalsContact N-OG1 3.12Å; S65-T68 WeakPolarHBondContact O-CB 3.47Å; S65-T68 PolarHBondContact O-N 3.41Å; S65-T68 PolarHBondContact O-OG1 3.46Å; S65-T68 PolarHBondContact OG-OG1 3.15Å; S65-M219 WeakPolarHBondContact O-CE 3.43Å
66	S	79.2	Confident	86.6	Confident	33 Å²	33	52.5 Å²	52.5	23%	0.231	26%	0.261	C	S	.	.	T	Hydrogen-bonded Turn	trans	-57.7	-20.5	178	54.4	0	0	0	0	115.1	M219	S66-M219 WeakPolarHBondContact O-CE 3.29Å
67	N	81.3	Confident	87.6	Confident	141 Å²	141	43.4 Å²	43.4	75%	0.754	22%	0.221	S	C	*	.	T	Hydrogen-bonded Turn	trans	-101.4	5.3	179.7	-68.1	-14.9	0	0	0	113.9	S65	S65-N67 PolarHBondContact O-N 2.86Å; S65-N67 VanDerWaalsContact O-N 3.07Å
68	T	86.5	Confident	88.1	Confident	23 Å²	23	42.8 Å²	42.8	14%	0.141	22%	0.217	C	C	.	.			trans	-64.7	137.7	179.3	-53.1	0	0	0	0	110.4	W41 V64 S65 L72 I73 M219	W41-T68 HydrophobicContact CH2-CG2 4.36Å; V64-T68 HydrophobicContact CB-CG2 4.43Å; V64-T68 HydrophobicContact CG1-CG2 4.47Å; S65-T68 PolarHBondContact N-OG1 3.43Å; S65-T68 VanDerWaalsContact N-OG1 3.12Å; S65-T68 WeakPolarHBondContact O-CB 3.47Å; S65-T68 PolarHBondContact O-N 3.41Å; S65-T68 PolarHBondContact O-OG1 3.46Å; S65-T68 PolarHBondContact OG-OG1 3.15Å; T68-L72 HydrophobicContact CG2-CD1 4.4Å; T68-I73 HydrophobicContact CG2-CG1 4.42Å; T68-M219 VanDerWaalsContact O-CE 3.32Å; T68-M219 WeakPolarHBondContact O-CE 3.36Å
69	D	88.3	Confident	88.2	Confident	87 Å²	87	41.8 Å²	41.8	47%	0.465	22%	0.215	S	C	.	.			trans	-69.7	128	177	-167.4	-29.1	0	0	0	110.6	V71 L72	D69-V71 PolarHBondContact O-N 3.06Å; D69-V71 VanDerWaalsContact O-N 3.1Å; D69-V71 VanDerWaalsContact OD1-CG2 3.29Å; D69-V71 WeakPolarHBondContact OD1-CG2 3.43Å; D69-V71 PolarHBondContact OD1-N 2.92Å; D69-L72 HydrophobicContact CB-CD1 4.42Å; D69-L72 PolarHBondContact O-N 3.43Å; D69-L72 VanDerWaalsContact O-N 3.1Å
70	P	89.5	Confident	88.1	Confident	15 Å²	15	46.5 Å²	46.5	10%	0.097	24%	0.24	C	C	.	.	H	α-helix	trans	-48.9	-30.5	173	-29.8	34.7	0	0	0	115.6	L72 I73 Y74 K222 L223 H226	P70-L72 VanDerWaalsContact C-N 3.28Å; P70-L72 PolarHBondContact O-N 3.09Å; P70-I73 PolarHBondContact O-N 3.35Å; P70-I73 VanDerWaalsContact O-N 3.17Å; P70-Y74 PolarHBondContact O-N 3Å; P70-K222 HydrophobicContact CG-CB 3.71Å; P70-L223 HydrophobicContact CB-CD1 4.13Å; P70-H226 HydrophobicContact CB-CB 3.72Å
71	V	90.4	Very high	88	Confident	49 Å²	49	44.7 Å²	44.7	30%	0.297	23%	0.231	S	C	.	.	H	α-helix	trans	-58.3	-41.8	179	179	0	0	0	0	111.3	D69 I73 Y74 K75 H226	D69-V71 PolarHBondContact O-N 3.06Å; D69-V71 VanDerWaalsContact O-N 3.1Å; D69-V71 VanDerWaalsContact OD1-CG2 3.29Å; D69-V71 WeakPolarHBondContact OD1-CG2 3.43Å; D69-V71 PolarHBondContact OD1-N 2.92Å; V71-I73 VanDerWaalsContact C-N 3.32Å; V71-I73 PolarHBondContact O-N 3.11Å; V71-Y74 PolarHBondContact O-N 3.16Å; V71-K75 HydrophobicContact CG1-CD 4.45Å; V71-K75 WeakPolarHBondContact O-CG 3.37Å; V71-K75 PolarHBondContact O-N 3.43Å; V71-H226 WeakPolarHBondContact CA-NE2 3.26Å; V71-H226 VanDerWaalsContact CG2-CE1 3.44Å; V71-H226 WeakPolarHBondContact CG2-CE1 3.4Å
72	L	89.9	Confident	87.8	Confident	69 Å²	69	47.3 Å²	47.3	36%	0.361	26%	0.26	S	S	.	.	H	α-helix	trans	-68	-35.7	-179.7	-67.6	169.3	0	0	0	111.5	W41 T68 D69 P70 M76	W41-L72 HydrophobicContact CH2-CB 4.2Å; W41-L72 HydrophobicContact CZ2-CB 4.12Å; T68-L72 HydrophobicContact CG2-CD1 4.4Å; D69-L72 HydrophobicContact CB-CD1 4.42Å; D69-L72 PolarHBondContact O-N 3.43Å; D69-L72 VanDerWaalsContact O-N 3.1Å; P70-L72 VanDerWaalsContact C-N 3.28Å; P70-L72 PolarHBondContact O-N 3.09Å; L72-M76 VanDerWaalsContact O-CB 3.3Å; L72-M76 WeakPolarHBondContact O-CB 3.4Å; L72-M76 PolarHBondContact O-N 3.01Å; L72-M76 VanDerWaalsContact O-N 3.08Å
73	I	90.2	Very high	87.7	Confident	1 Å²	1	48.4 Å²	48.4	1%	0.005	27%	0.265	C	S	.	.	H	α-helix	trans	-68.2	-45.7	177.5	-56.4	177.9	0	0	0	109.5	V64 T68 P70 V71 M76 L77 V204 M219 L223	V64-I73 HydrophobicContact CG1-CD1 4.28Å; V64-I73 HydrophobicContact CG1-CG1 4.27Å; V64-I73 HydrophobicContact CG2-CD1 4.33Å; T68-I73 HydrophobicContact CG2-CG1 4.42Å; P70-I73 PolarHBondContact O-N 3.35Å; P70-I73 VanDerWaalsContact O-N 3.17Å; V71-I73 VanDerWaalsContact C-N 3.32Å; V71-I73 PolarHBondContact O-N 3.11Å; I73-M76 PolarHBondContact O-N 3.02Å; I73-L77 HydrophobicContact CG2-CD1 4.39Å; I73-L77 WeakPolarHBondContact O-CG 3.37Å; I73-L77 PolarHBondContact O-N 3.12Å; I73-V204 HydrophobicContact CD1-CG1 4.5Å; I73-V204 HydrophobicContact CG2-CG1 4.47Å; I73-V204 HydrophobicContact CG2-CG2 4.25Å; I73-M219 HydrophobicContact CD1-CG 4.49Å; I73-M219 HydrophobicContact CD1-SD 3.81Å; I73-L223 HydrophobicContact CB-CD1 4.15Å; I73-L223 HydrophobicContact CG2-CD1 4.14Å; I73-L223 HydrophobicContact CG2-CD2 4.17Å
74	Y	90.9	Very high	87.5	Confident	20 Å²	20	49.8 Å²	49.8	8%	0.078	28%	0.284	C	S	.	.	H	α-helix	trans	-63.2	-47.8	179.3	-175.3	-106.9	0	0	0	112.2	P70 V71 M76 L77 T78 W123 I227 Q230	P70-Y74 PolarHBondContact O-N 3Å; V71-Y74 PolarHBondContact O-N 3.16Å; Y74-M76 VanDerWaalsContact C-N 3.28Å; Y74-M76 PolarHBondContact O-N 3.11Å; Y74-L77 WeakPolarHBondContact O-CB 3.49Å; Y74-L77 PolarHBondContact O-N 3.12Å; Y74-L77 VanDerWaalsContact O-N 3.08Å; Y74-T78 HydrophobicContact CD2-CG2 4.43Å; Y74-T78 HydrophobicContact CE1-CG2 4.1Å; Y74-T78 HydrophobicContact CE2-CG2 3.95Å; Y74-T78 PolarHBondContact O-N 3.2Å; Y74-T78 PolarHBondContact O-OG1 3.43Å; Y74-T78 VanDerWaalsContact O-OG1 3.13Å; Y74-W123 HydrophobicContact CD2-CH2 4.44Å; Y74-W123 HydrophobicContact CD2-CZ3 4.32Å; Y74-W123 HydrophobicContact CE2-CH2 4.06Å; Y74-W123 HydrophobicContact CE2-CZ3 4.12Å; Y74-I227 HydrophobicContact CD2-CG1 3.85Å; Y74-I227 HydrophobicContact CE2-CG1 4.2Å; Y74-I227 HydrophobicContact CE2-CG2 4.47Å; Y74-Q230 HydrophobicContact CD1-CG 4.19Å; Y74-Q230 HydrophobicContact CE1-CB 4.4Å; Y74-Q230 HydrophobicContact CE1-CG 3.72Å; Y74-Q230 HydrophobicContact CE2-CG 4.43Å
75	K	89.3	Confident	87.4	Confident	102 Å²	102	52.2 Å²	52.2	44%	0.443	30%	0.3	S	S	.	.	H	α-helix	trans	-57.3	-40.9	174.5	-75.7	-172.7	174.9	-170.3	0	112.6	V71 L77 T78 E79	V71-K75 HydrophobicContact CG1-CD 4.45Å; V71-K75 WeakPolarHBondContact O-CG 3.37Å; V71-K75 PolarHBondContact O-N 3.43Å; K75-L77 PolarHBondContact O-N 2.93Å; K75-T78 PolarHBondContact O-N 3.11Å; K75-E79 WeakPolarHBondContact O-CA 3.38Å; K75-E79 VanDerWaalsContact O-CB 3.27Å; K75-E79 WeakPolarHBondContact O-CB 3.31Å; K75-E79 PolarHBondContact O-N 2.99Å
76	M	88.3	Confident	87.5	Confident	2 Å²	2	50.3 Å²	50.3	1%	0.01	29%	0.287	C	S	.	.	I	π-helix	trans	-65.5	-38.7	176.9	-170.4	-160.1	66.9	0	0	112	W41 V46 V62 L72 I73 Y74 D80 W81	W41-M76 HydrophobicContact CZ2-CB 4.29Å; W41-M76 HydrophobicContact CZ2-SD 4.11Å; V46-M76 HydrophobicContact CG2-SD 4.34Å; V62-M76 HydrophobicContact CB-CE 3.55Å; V62-M76 HydrophobicContact CB-SD 3.64Å; V62-M76 HydrophobicContact CG1-CE 3.31Å; V62-M76 HydrophobicContact CG1-SD 4.04Å; V62-M76 HydrophobicContact CG2-CE 4.05Å; V62-M76 HydrophobicContact CG2-SD 3.6Å; V62-M76 VanDerWaalsContact CG2-SD 3.6Å; L72-M76 VanDerWaalsContact O-CB 3.3Å; L72-M76 WeakPolarHBondContact O-CB 3.4Å; L72-M76 PolarHBondContact O-N 3.01Å; L72-M76 VanDerWaalsContact O-N 3.08Å; I73-M76 PolarHBondContact O-N 3.02Å; Y74-M76 VanDerWaalsContact C-N 3.28Å; Y74-M76 PolarHBondContact O-N 3.11Å; M76-D80 HydrophobicContact CG-CB 4.14Å; M76-D80 WeakPolarHBondContact O-CB 3.44Å; M76-D80 PolarHBondContact O-N 3.26Å; M76-W81 HydrophobicContact CE-CD2 4.23Å; M76-W81 HydrophobicContact CE-CE3 4.13Å; M76-W81 HydrophobicContact CE-CH2 3.48Å; M76-W81 VanDerWaalsContact CE-CH2 3.48Å; M76-W81 HydrophobicContact CE-CZ2 3.56Å; M76-W81 HydrophobicContact CE-CZ3 3.76Å; M76-W81 WeakPolarHBondContact O-CB 3.39Å; M76-W81 PolarHBondContact O-N 2.9Å; M76-W81 HydrophobicContact SD-CZ2 4.11Å
77	L	90.1	Very high	87.8	Confident	2 Å²	2	50.7 Å²	50.7	1%	0.01	29%	0.285	C	S	.	.	I	π-helix	trans	-62.7	-45.8	174.9	-68.8	172.7	0	0	0	111.4	I73 Y74 K75 W81 L83 W123 I158	I73-L77 HydrophobicContact CG2-CD1 4.39Å; I73-L77 WeakPolarHBondContact O-CG 3.37Å; I73-L77 PolarHBondContact O-N 3.12Å; Y74-L77 WeakPolarHBondContact O-CB 3.49Å; Y74-L77 PolarHBondContact O-N 3.12Å; Y74-L77 VanDerWaalsContact O-N 3.08Å; K75-L77 PolarHBondContact O-N 2.93Å; L77-W81 HydrophobicContact CD2-CE3 3.51Å; L77-W81 HydrophobicContact CD2-CZ3 3.51Å; L77-W81 WeakPolarHBondContact O-CB 3.23Å; L77-L83 HydrophobicContact CB-CD1 4.23Å; L77-L83 HydrophobicContact CD2-CD1 4.1Å; L77-L83 WeakPolarHBondContact O-CB 3.41Å; L77-L83 PolarHBondContact O-N 3.14Å; L77-L83 VanDerWaalsContact O-N 3.13Å; L77-W123 HydrophobicContact CB-CH2 4.07Å; L77-W123 HydrophobicContact CD1-CH2 4.25Å; L77-W123 HydrophobicContact CD1-CZ3 3.88Å; L77-I158 HydrophobicContact CD1-CD1 4.27Å; L77-I158 HydrophobicContact CD2-CD1 4.34Å
78	T	88.7	Confident	88.1	Confident	25 Å²	25	44 Å²	44	15%	0.153	25%	0.249	C	C	.	.	I	π-helix	trans	-87.3	-50.9	-172.4	55.7	0	0	0	0	113.9	Y74 K75 G82 L83 W123	Y74-T78 HydrophobicContact CD2-CG2 4.43Å; Y74-T78 HydrophobicContact CE1-CG2 4.1Å; Y74-T78 HydrophobicContact CE2-CG2 3.95Å; Y74-T78 PolarHBondContact O-N 3.2Å; Y74-T78 PolarHBondContact O-OG1 3.43Å; Y74-T78 VanDerWaalsContact O-OG1 3.13Å; K75-T78 PolarHBondContact O-N 3.11Å; T78-G82 VanDerWaalsContact O-CA 3.3Å; T78-G82 WeakPolarHBondContact O-CA 3.23Å; T78-G82 PolarHBondContact O-N 3.38Å; T78-L83 WeakPolarHBondContact CA-O 3.39Å; T78-W123 HydrophobicContact CG2-CH2 4.08Å
79	E	88.1	Confident	88.4	Confident	134 Å²	134	43 Å²	43	63%	0.626	24%	0.243	S	C	*	.	I	π-helix	trans	-82.1	-52.6	-174.4	-58.7	175.1	-171.9	0	0	111.3	K75	K75-E79 WeakPolarHBondContact O-CA 3.38Å; K75-E79 VanDerWaalsContact O-CB 3.27Å; K75-E79 WeakPolarHBondContact O-CB 3.31Å; K75-E79 PolarHBondContact O-N 2.99Å
80	D	85.3	Confident	88.6	Confident	101 Å²	101	38.9 Å²	38.9	54%	0.54	22%	0.221	S	C	.	.	I	π-helix	trans	-78.3	-41.6	-174.1	-65.1	-32	0	0	0	112.6	M76	M76-D80 HydrophobicContact CG-CB 4.14Å; M76-D80 WeakPolarHBondContact O-CB 3.44Å; M76-D80 PolarHBondContact O-N 3.26Å
81	W	87.8	Confident	88.8	Confident	29 Å²	29	38.2 Å²	38.2	11%	0.11	22%	0.217	C	C	.	.	S	Bend	trans	-90.7	-10.4	-179.3	-70.3	-3.9	0	0	0	113.8	V46 K60 V62 M76 L77 H202	V46-W81 HydrophobicContact CG1-CZ2 4.48Å; K60-W81 HydrophobicContact CB-CD2 4.13Å; K60-W81 HydrophobicContact CB-CE3 4.42Å; K60-W81 HydrophobicContact CB-CH2 4.17Å; K60-W81 HydrophobicContact CB-CZ2 3.87Å; K60-W81 HydrophobicContact CB-CZ3 4.45Å; K60-W81 HydrophobicContact CD-CB 4.28Å; K60-W81 HydrophobicContact CD-CD2 4Å; K60-W81 HydrophobicContact CD-CG 3.74Å; V62-W81 HydrophobicContact CB-CH2 4.15Å; V62-W81 HydrophobicContact CB-CZ2 4.16Å; V62-W81 HydrophobicContact CG1-CH2 4.06Å; M76-W81 HydrophobicContact CE-CD2 4.23Å; M76-W81 HydrophobicContact CE-CE3 4.13Å; M76-W81 HydrophobicContact CE-CH2 3.48Å; M76-W81 VanDerWaalsContact CE-CH2 3.48Å; M76-W81 HydrophobicContact CE-CZ2 3.56Å; M76-W81 HydrophobicContact CE-CZ3 3.76Å; M76-W81 WeakPolarHBondContact O-CB 3.39Å; M76-W81 PolarHBondContact O-N 2.9Å; M76-W81 HydrophobicContact SD-CZ2 4.11Å; L77-W81 HydrophobicContact CD2-CE3 3.51Å; L77-W81 HydrophobicContact CD2-CZ3 3.51Å; L77-W81 WeakPolarHBondContact O-CB 3.23Å; W81-H202 AromaticContact CD2-CD2 3.88Å; W81-H202 HydrophobicContact CE3-CB 4.22Å; W81-H202 AromaticContact CE3-CD2 3.19Å; W81-H202 AromaticContact CE3-CG 3.97Å; W81-H202 HydrophobicContact CZ3-CB 3.83Å; W81-H202 AromaticContact CZ3-CD2 3.64Å
82	G	85.7	Confident	88.9	Confident	60 Å²	60	36.2 Å²	36.2	62%	0.619	20%	0.204	S	C	*	.			trans	71.9	25.2	175.9	0	0	0	0	0	114	T78	T78-G82 VanDerWaalsContact O-CA 3.3Å; T78-G82 WeakPolarHBondContact O-CA 3.23Å; T78-G82 PolarHBondContact O-N 3.38Å
83	L	87.9	Confident	88.8	Confident	22 Å²	22	33.1 Å²	33.1	12%	0.115	19%	0.188	C	C	.	.	P	Polyproline II helix	trans	-74	127.5	172.6	-68	173.4	0	0	0	110	L77 T78 W123 V156 I158 H202	L77-L83 HydrophobicContact CB-CD1 4.23Å; L77-L83 HydrophobicContact CD2-CD1 4.1Å; L77-L83 WeakPolarHBondContact O-CB 3.41Å; L77-L83 PolarHBondContact O-N 3.14Å; L77-L83 VanDerWaalsContact O-N 3.13Å; T78-L83 WeakPolarHBondContact CA-O 3.39Å; L83-W123 HydrophobicContact CB-CZ2 3.76Å; L83-W123 HydrophobicContact CD1-CZ2 4.14Å; L83-V156 HydrophobicContact CD1-CG1 4.28Å; L83-V156 HydrophobicContact CD2-CG1 3.99Å; L83-V156 HydrophobicContact CD2-CG2 4.24Å; L83-I158 HydrophobicContact CD1-CD1 4.41Å; L83-H202 VanDerWaalsContact CD2-CE1 3.49Å; L83-H202 WeakPolarHBondContact CD2-CE1 3.38Å
84	S	85.3	Confident	88.3	Confident	89 Å²	89	34 Å²	34	62%	0.622	20%	0.197	S	C	*	.	P	Polyproline II helix	trans	-60.6	137.6	168.6	54	0	0	0	0	109.9	W123	S84-W123 WeakPolarHBondContact O-CZ2 3.43Å
85	P	86.6	Confident	87.4	Confident	53 Å²	53	33.1 Å²	33.1	34%	0.344	20%	0.195	S	C	.	.	P	Polyproline II helix	trans	-51.7	134.7	173	-26.2	34.5	0	0	0	111
86	P	87.7	Confident	86.4	Confident	0 Å²	0	30.8 Å²	30.8	0%	0	19%	0.187	C	C	.	.	P	Polyproline II helix	trans	-75.3	147	-177.4	29.4	-31.9	0	0	0	111.4	L88 V89 W123 I242	P86-L88 VanDerWaalsContact C-N 3.32Å; P86-L88 WeakPolarHBondContact CB-O 3.46Å; P86-V89 HydrophobicContact CB-CG2 4.21Å; P86-V89 HydrophobicContact CG-CG2 3.73Å; P86-W123 HydrophobicContact CB-CB 4.2Å; P86-W123 HydrophobicContact CB-CD2 3.82Å; P86-W123 HydrophobicContact CB-CE3 4.47Å; P86-W123 HydrophobicContact CB-CG 3.66Å; P86-W123 HydrophobicContact CG-CD2 3.56Å; P86-W123 HydrophobicContact CG-CE3 3.74Å; P86-W123 HydrophobicContact CG-CG 3.93Å; P86-W123 HydrophobicContact CG-CH2 4.37Å; P86-W123 HydrophobicContact CG-CZ2 4.21Å; P86-W123 HydrophobicContact CG-CZ3 4.14Å; P86-I242 HydrophobicContact CG-CD1 4.2Å; P86-I242 HydrophobicContact CG-CG2 4.17Å; P86-I242 WeakPolarHBondContact O-CD1 3.24Å; P86-I242 WeakPolarHBondContact O-CG1 3.31Å
87	H	85	Confident	85	Confident	40 Å²	40	37.5 Å²	37.5	19%	0.185	22%	0.218	C	C	.	.	S	Bend	trans	-83.7	-11.9	168.4	-52.3	145.3	0	0	0	112.9	T120 Y234 F240 P243	H87-T120 PolarHBondContact ND1-O 3.42Å; H87-T120 VanDerWaalsContact ND1-O 3.12Å; H87-Y234 AromaticContact CE1-CD2 3.4Å; H87-Y234 VanDerWaalsContact CE1-CD2 3.4Å; H87-Y234 WeakPolarHBondContact CE1-CD2 3.24Å; H87-Y234 AromaticContact CE1-CE2 3.69Å; H87-Y234 AromaticContact ND1-CD2 3.87Å; H87-Y234 AromaticContact NE2-CD2 3.78Å; H87-F240 HydrophobicContact CB-CE2 4.49Å; H87-F240 HydrophobicContact CB-CZ 4.2Å; H87-P243 VanDerWaalsContact O-CD 3.3Å; H87-P243 WeakPolarHBondContact O-CD 3.33Å; H87-P243 WeakPolarHBondContact O-CG 3.32Å
88	L	88.8	Confident	83.5	Confident	2 Å²	2	39.1 Å²	39.1	1%	0.01	23%	0.227	C	C	.	.			trans	-156.6	144.5	178.2	174.2	68.5	0	0	0	109.2	P86 V90 A122 W123 P243 I346 L350 W374	P86-L88 VanDerWaalsContact C-N 3.32Å; P86-L88 WeakPolarHBondContact CB-O 3.46Å; L88-V90 HydrophobicContact CD2-CG2 3.7Å; L88-V90 HydrophobicContact CG-CG2 3.96Å; L88-A122 HydrophobicContact CB-CB 3.78Å; L88-A122 HydrophobicContact CD2-CB 3.96Å; L88-A122 HydrophobicContact CG-CB 4Å; L88-A122 CarbonylContact O-C 3.59Å; L88-A122 WeakPolarHBondContact O-CA 3.35Å; L88-A122 VanDerWaalsContact O-CB 3.28Å; L88-A122 WeakPolarHBondContact O-CB 3.23Å; L88-W123 PolarHBondContact O-N 3.44Å; L88-P243 HydrophobicContact CB-CG 4.48Å; L88-P243 HydrophobicContact CD1-CB 4.13Å; L88-P243 HydrophobicContact CD1-CG 3.8Å; L88-I346 HydrophobicContact CD1-CG2 4.43Å; L88-I346 HydrophobicContact CD2-CG2 3.78Å; L88-L350 HydrophobicContact CD1-CD1 3.98Å; L88-W374 HydrophobicContact CB-CH2 4.49Å; L88-W374 HydrophobicContact CB-CZ2 3.89Å; L88-W374 HydrophobicContact CD1-CH2 4.13Å; L88-W374 HydrophobicContact CD1-CZ2 4.24Å; L88-W374 HydrophobicContact CD2-CH2 3.69Å; L88-W374 HydrophobicContact CD2-CZ2 3.88Å; L88-W374 HydrophobicContact CG-CH2 4.31Å; L88-W374 HydrophobicContact CG-CZ2 4.2Å
89	V	92.4	Very high	81.6	Confident	0 Å²	0	43.1 Å²	43.1	0%	0	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119	121.9	169.9	177.6	0	0	0	0	110.2	P86 W123 L125 L224 I227 I242 P243 V244 L245	P86-V89 HydrophobicContact CB-CG2 4.21Å; P86-V89 HydrophobicContact CG-CG2 3.73Å; V89-W123 HydrophobicContact CG2-CB 4.43Å; V89-L125 HydrophobicContact CG1-CD1 3.38Å; V89-L224 HydrophobicContact CG1-CD2 3.88Å; V89-I227 HydrophobicContact CG2-CG2 3.78Å; V89-I242 HydrophobicContact CG2-CG2 3.91Å; V89-P243 PolarHBondContact N-O 3.28Å; V89-V244 HydrophobicContact CB-CG1 4.43Å; V89-V244 HydrophobicContact CB-CG2 4.12Å; V89-V244 HydrophobicContact CG1-CG1 4.36Å; V89-V244 WeakPolarHBondContact O-CA 3.23Å; V89-L245 PolarHBondContact O-N 3.28Å
90	V	93.1	Very high	80.2	Confident	2 Å²	2	45.6 Å²	45.6	1%	0.012	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	109.9	174.2	-172.4	0	0	0	0	109.6	L88 L113 W123 I124 L125 L245 L247	L88-V90 HydrophobicContact CD2-CG2 3.7Å; L88-V90 HydrophobicContact CG-CG2 3.96Å; V90-L113 HydrophobicContact CB-CD1 4.42Å; V90-L113 HydrophobicContact CG1-CD1 3.89Å; V90-W123 PolarHBondContact N-O 3.41Å; V90-I124 WeakPolarHBondContact O-CA 3.29Å; V90-L125 PolarHBondContact O-N 3.24Å; V90-L245 CarbonylContact C-O 3.53Å; V90-L245 WeakPolarHBondContact CA-O 3.43Å; V90-L247 HydrophobicContact CG1-CB 4.12Å
91	A	93.6	Very high	79.4	Confident	1 Å²	1	41.5 Å²	41.5	1%	0.008	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.6	107.7	175.1	0	0	0	0	0	110	V93 L224 L245 C246 L247	A91-V93 PolarHBondContact O-N 3.45Å; A91-L224 HydrophobicContact CB-CD1 3.92Å; A91-L224 HydrophobicContact CB-CD2 4.18Å; A91-L245 PolarHBondContact N-O 2.99Å; A91-C246 WeakPolarHBondContact O-CA 3.23Å; A91-L247 PolarHBondContact O-N 3.07Å
92	L	91.5	Very high	78.8	Confident	7 Å²	7	45 Å²	45	4%	0.037	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.8	122	176.5	-176.5	66.2	0	0	0	110	L109 L125 T126 I133 L137 L247 V249	L92-L109 HydrophobicContact CD1-CD2 4.42Å; L92-L125 PolarHBondContact N-O 2.93Å; L92-T126 HydrophobicContact CB-CG2 4.07Å; L92-T126 HydrophobicContact CD2-CG2 4.3Å; L92-I133 HydrophobicContact CD2-CG1 4.12Å; L92-I133 HydrophobicContact CD2-CG2 4.01Å; L92-I133 HydrophobicContact CG-CG2 4.35Å; L92-L137 HydrophobicContact CD2-CB 4.35Å; L92-L137 HydrophobicContact CD2-CD2 4Å; L92-L247 HydrophobicContact CD1-CB 4.37Å; L92-L247 HydrophobicContact CD1-CD2 3.9Å; L92-L247 HydrophobicContact CD1-CG 4.14Å; L92-V249 HydrophobicContact CD1-CB 4.46Å; L92-V249 HydrophobicContact CD1-CG2 3.71Å
93	V	88.1	Confident	78.5	Confident	4 Å²	4	47.1 Å²	47.1	2%	0.024	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123	117.8	178.7	-176.8	0	0	0	0	108.4	A91 L247 L248 V249 I255 W269	A91-V93 PolarHBondContact O-N 3.45Å; V93-L247 PolarHBondContact N-O 2.83Å; V93-L248 HydrophobicContact CG1-CD1 4.34Å; V93-L248 WeakPolarHBondContact O-CA 3.45Å; V93-V249 PolarHBondContact O-N 2.83Å; V93-I255 HydrophobicContact CG1-CD1 4.04Å; V93-I255 HydrophobicContact CG1-CG1 4.19Å; V93-I255 HydrophobicContact CG1-CG2 3.56Å; V93-W269 HydrophobicContact CB-CZ3 4.38Å; V93-W269 HydrophobicContact CG2-CH2 4.27Å; V93-W269 HydrophobicContact CG2-CZ3 4.33Å
94	G	81.1	Confident	78.2	Confident	18 Å²	18	48.4 Å²	48.4	19%	0.186	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.7	174.3	177.1	0	0	0	0	0	112.7	V249	G94-V249 WeakPolarHBondContact CA-O 3.38Å
95	G	71.6	Confident	77.9	Confident	3 Å²	3	44.3 Å²	44.3	3%	0.031	25%	0.245	C	C	.	.			trans	-86.5	168.2	-178.4	0	0	0	0	0	115
96	D	68	Low	77.6	Confident	53 Å²	53	47.2 Å²	47.2	28%	0.283	25%	0.249	S	C	.	.	S	Bend	trans	-90	-19.8	-171.9	-62.4	-5.9	0	0	0	112.8	F131 H190	D96-F131 HydrophobicContact CB-CE2 4.09Å; D96-F131 VanDerWaalsContact OD1-CE2 3.28Å; D96-F131 WeakPolarHBondContact OD1-CE2 3.38Å; D96-H190 PolarHBondContact O-NE2 3.08Å
97	E	58.9	Low	77.2	Confident	142 Å²	142	49.8 Å²	49.8	66%	0.664	26%	0.263	S	S	*	.			trans	-106.5	106	-179.7	-67.3	-170.8	173.6	0	0	112.6
98	L	57.9	Low	77.2	Confident	36 Å²	36	48.9 Å²	48.9	19%	0.188	26%	0.26	C	S	.	.			trans	-139.1	79.3	170.5	-95.6	141.4	0	0	0	108.5	Q100 M101 I133	L98-Q100 PolarHBondContact O-N 2.94Å; L98-M101 HydrophobicContact CD2-CB 3.86Å; L98-M101 HydrophobicContact CD2-CG 4.02Å; L98-I133 HydrophobicContact CD1-CD1 4.3Å
99	A	50.2	Low	76.9	Confident	109 Å²	109	48.8 Å²	48.8	90%	0.901	26%	0.26	S	S	*	.	S	Bend	trans	-62.1	-30.2	179.1	0	0	0	0	0	112.2
100	Q	58.3	Low	76.3	Confident	187 Å²	187	53.1 Å²	53.1	87%	0.874	28%	0.276	S	S	*	.	S	Bend	trans	-150.2	106.4	167.1	-83.2	179.7	-2.9	0	0	110.3	L98	L98-Q100 PolarHBondContact O-N 2.94Å
101	M	67.2	Low	75.6	Confident	15 Å²	15	59 Å²	59	7%	0.074	30%	0.302	C	S	.	.			trans	-67.2	131.2	173.2	-169.9	178.6	173.7	0	0	110.5	L98 L105 R106 L109 I133 H136	L98-M101 HydrophobicContact CD2-CB 3.86Å; L98-M101 HydrophobicContact CD2-CG 4.02Å; M101-L105 HydrophobicContact CE-CB 3.75Å; M101-L105 HydrophobicContact CE-CD2 3.57Å; M101-L105 HydrophobicContact CE-CG 3.31Å; M101-L105 WeakPolarHBondContact CE-O 3.34Å; M101-L105 HydrophobicContact CG-CB 4.33Å; M101-L105 HydrophobicContact CG-CD2 3.94Å; M101-L105 HydrophobicContact CG-CG 4.41Å; M101-R106 HydrophobicContact CB-CG 4.12Å; M101-R106 HydrophobicContact CE-CG 4.03Å; M101-R106 HydrophobicContact CG-CG 3.82Å; M101-R106 HydrophobicContact SD-CG 3.5Å; M101-R106 WeakPolarHBondContact SD-CG 2.86Å; M101-L109 HydrophobicContact CE-CD1 3.49Å; M101-L109 VanDerWaalsContact CE-CD1 3.49Å; M101-L109 HydrophobicContact CE-CG 4.05Å; M101-I133 HydrophobicContact CE-CD1 3.73Å; M101-I133 HydrophobicContact SD-CD1 4.21Å; M101-H136 HydrophobicContact SD-CB 3.82Å; M101-H136 PolarHBondContact SD-CD2 3.3Å
102	K	76.3	Confident	75	Confident	102 Å²	102	59.7 Å²	59.7	44%	0.443	31%	0.308	S	S	.	.			trans	-54	138.4	177.2	-67.9	-176.8	-178	173.2	0	110.8	W104 L105 R106 G274	K102-W104 VanDerWaalsContact C-N 3.35Å; K102-W104 HydrophobicContact CD-CZ2 4.1Å; K102-W104 PolarHBondContact O-N 3.49Å; K102-L105 HydrophobicContact CB-CB 4.39Å; K102-L105 PolarHBondContact O-N 2.98Å; K102-L105 VanDerWaalsContact O-N 3.12Å; K102-R106 PolarHBondContact O-N 3.16Å; K102-G274 PolarHBondContact NZ-O 3.49Å
103	P	79.6	Confident	74.8	Confident	105 Å²	105	59.4 Å²	59.4	68%	0.682	31%	0.307	S	S	*	.	H	α-helix	trans	-55.9	-41.8	-177.6	-28.2	35.2	0	0	0	114.5	L105 R106 D107	P103-L105 VanDerWaalsContact C-N 3.29Å; P103-L105 PolarHBondContact O-N 3.03Å; P103-R106 WeakPolarHBondContact O-CB 3.46Å; P103-R106 PolarHBondContact O-N 3.48Å; P103-D107 PolarHBondContact O-N 3.11Å; P103-D107 VanDerWaalsContact O-N 3.11Å
104	W	80.5	Confident	74.7	Confident	48 Å²	48	59.2 Å²	59.2	18%	0.182	31%	0.305	C	S	.	.	H	α-helix	trans	-64.8	-33.1	179	66.6	-108.8	0	0	0	112.8	K102 R106 D107 T108 A273 P335 E336	K102-W104 VanDerWaalsContact C-N 3.35Å; K102-W104 HydrophobicContact CD-CZ2 4.1Å; K102-W104 PolarHBondContact O-N 3.49Å; W104-R106 VanDerWaalsContact C-N 3.34Å; W104-D107 CarbonylContact O-C 3.58Å; W104-D107 WeakPolarHBondContact O-CB 3.46Å; W104-D107 PolarHBondContact O-N 3.02Å; W104-T108 PolarHBondContact O-N 2.9Å; W104-T108 PolarHBondContact O-OG1 2.97Å; W104-A273 WeakPolarHBondContact CH2-O 3.45Å; W104-P335 HydrophobicContact CD2-CG 4.48Å; W104-P335 HydrophobicContact CE3-CB 4.28Å; W104-P335 HydrophobicContact CE3-CG 3.48Å; W104-P335 VanDerWaalsContact CE3-CG 3.48Å; W104-P335 HydrophobicContact CH2-CG 3.87Å; W104-P335 HydrophobicContact CZ3-CB 4.33Å; W104-P335 HydrophobicContact CZ3-CG 3.15Å; W104-E336 PolarHBondContact NE1-OE1 3.44Å
105	L	79.8	Confident	74.8	Confident	3 Å²	3	62.3 Å²	62.3	2%	0.016	31%	0.314	C	S	.	.	H	α-helix	trans	-71.4	-36.1	-179.7	-171.4	68.6	0	0	0	110.1	M101 K102 P103 D107 T108 L109 V249 L272	M101-L105 HydrophobicContact CE-CB 3.75Å; M101-L105 HydrophobicContact CE-CD2 3.57Å; M101-L105 HydrophobicContact CE-CG 3.31Å; M101-L105 WeakPolarHBondContact CE-O 3.34Å; M101-L105 HydrophobicContact CG-CB 4.33Å; M101-L105 HydrophobicContact CG-CD2 3.94Å; M101-L105 HydrophobicContact CG-CG 4.41Å; K102-L105 HydrophobicContact CB-CB 4.39Å; K102-L105 PolarHBondContact O-N 2.98Å; K102-L105 VanDerWaalsContact O-N 3.12Å; P103-L105 VanDerWaalsContact C-N 3.29Å; P103-L105 PolarHBondContact O-N 3.03Å; L105-D107 VanDerWaalsContact C-N 3.3Å; L105-T108 PolarHBondContact O-N 3.19Å; L105-L109 PolarHBondContact O-N 3.07Å; L105-L109 VanDerWaalsContact O-N 3.07Å; L105-V249 HydrophobicContact CD1-CG1 3.73Å; L105-V249 HydrophobicContact CD2-CG1 3.67Å; L105-V249 HydrophobicContact CG-CG1 4.06Å; L105-L272 HydrophobicContact CD1-CD1 3.63Å
106	R	79.5	Confident	75.4	Confident	115 Å²	115	62.3 Å²	62.3	43%	0.434	31%	0.314	S	S	.	.	H	α-helix	trans	-62.1	-41.7	170.9	-68.1	178.1	62.8	-165.6	-1.8	110.8	M101 K102 P103 W104 L109 R110	M101-R106 HydrophobicContact CB-CG 4.12Å; M101-R106 HydrophobicContact CE-CG 4.03Å; M101-R106 HydrophobicContact CG-CG 3.82Å; M101-R106 HydrophobicContact SD-CG 3.5Å; M101-R106 WeakPolarHBondContact SD-CG 2.86Å; K102-R106 PolarHBondContact O-N 3.16Å; P103-R106 WeakPolarHBondContact O-CB 3.46Å; P103-R106 PolarHBondContact O-N 3.48Å; W104-R106 VanDerWaalsContact C-N 3.34Å; R106-L109 PolarHBondContact O-N 3.28Å; R106-R110 WeakPolarHBondContact O-CB 3.28Å; R106-R110 PolarHBondContact O-N 3.18Å
107	D	80.4	Confident	76.2	Confident	54 Å²	54	59.9 Å²	59.9	29%	0.289	30%	0.301	S	S	.	.	H	α-helix	trans	-65.9	-37	175.8	-91.9	26.6	0	0	0	112.3	P103 W104 L105 R110 K111	P103-D107 PolarHBondContact O-N 3.11Å; P103-D107 VanDerWaalsContact O-N 3.11Å; W104-D107 CarbonylContact O-C 3.58Å; W104-D107 WeakPolarHBondContact O-CB 3.46Å; W104-D107 PolarHBondContact O-N 3.02Å; L105-D107 VanDerWaalsContact C-N 3.3Å; D107-R110 PolarHBondContact O-N 3.06Å; D107-R110 IonicContact OD1-CZ 3.37Å; D107-R110 IonicContact OD1-NE 3.08Å; D107-R110 IonicContact OD1-NH2 3.96Å; D107-R110 PolarHBondContact OD1-NH2 3.19Å; D107-R110 IonicContact OD2-NH2 3.29Å; D107-K111 WeakPolarHBondContact O-CB 3.29Å; D107-K111 PolarHBondContact O-N 3.37Å; D107-K111 IonicContact OD2-NZ 2.7Å; D107-K111 PolarHBondContact OD2-NZ 3.17Å
108	T	83.7	Confident	77.3	Confident	20 Å²	20	55 Å²	55	12%	0.123	28%	0.278	C	S	.	.	I	π-helix	trans	-64	-43.4	176.3	-54.9	0	0	0	0	111.6	W104 L105 G112 L113 L272 L342	W104-T108 PolarHBondContact O-N 2.9Å; W104-T108 PolarHBondContact O-OG1 2.97Å; L105-T108 PolarHBondContact O-N 3.19Å; T108-G112 CarbonylContact O-C 3.59Å; T108-G112 WeakPolarHBondContact O-CA 3.34Å; T108-G112 PolarHBondContact O-N 2.64Å; T108-L113 PolarHBondContact O-N 3.41Å; T108-L272 HydrophobicContact CG2-CD1 4.29Å; T108-L342 HydrophobicContact CG2-CD2 4.39Å
109	L	82.4	Confident	78.2	Confident	1 Å²	1	56.9 Å²	56.9	1%	0.005	29%	0.294	C	S	.	.	I	π-helix	trans	-67.8	-43.6	173.7	-66.2	-175.7	0	0	0	112	L92 M101 L105 R106 L113 V114 I133	L92-L109 HydrophobicContact CD1-CD2 4.42Å; M101-L109 HydrophobicContact CE-CD1 3.49Å; M101-L109 VanDerWaalsContact CE-CD1 3.49Å; M101-L109 HydrophobicContact CE-CG 4.05Å; L105-L109 PolarHBondContact O-N 3.07Å; L105-L109 VanDerWaalsContact O-N 3.07Å; R106-L109 PolarHBondContact O-N 3.28Å; L109-L113 HydrophobicContact CD2-CD2 3.87Å; L109-V114 WeakPolarHBondContact O-CG2 3.01Å; L109-V114 PolarHBondContact O-N 2.77Å; L109-I133 HydrophobicContact CD1-CD1 3.82Å; L109-I133 HydrophobicContact CD1-CG1 3.84Å
110	R	80	Confident	79.5	Confident	91 Å²	91	51.9 Å²	51.9	34%	0.343	25%	0.253	S	S	.	.	I	π-helix	trans	-71.5	-50.7	-174.4	-177.7	177.1	59.8	168.6	2.3	113.6	R106 D107 A140	R106-R110 WeakPolarHBondContact O-CB 3.28Å; R106-R110 PolarHBondContact O-N 3.18Å; D107-R110 PolarHBondContact O-N 3.06Å; D107-R110 IonicContact OD1-CZ 3.37Å; D107-R110 IonicContact OD1-NE 3.08Å; D107-R110 IonicContact OD1-NH2 3.96Å; D107-R110 PolarHBondContact OD1-NH2 3.19Å; D107-R110 IonicContact OD2-NH2 3.29Å; R110-A140 HydrophobicContact CB-CB 3.95Å; R110-A140 HydrophobicContact CG-CB 4.27Å
111	K	78.3	Confident	80.6	Confident	126 Å²	126	44.6 Å²	44.6	55%	0.548	23%	0.227	S	C	.	.	I	π-helix	trans	-94.6	-31.9	-175.7	-64.4	175	179.4	160.5	0	112.4	D107 K115	D107-K111 WeakPolarHBondContact O-CB 3.29Å; D107-K111 PolarHBondContact O-N 3.37Å; D107-K111 IonicContact OD2-NZ 2.7Å; D107-K111 PolarHBondContact OD2-NZ 3.17Å; K111-K115 WeakPolarHBondContact O-CB 3.49Å
112	G	82.5	Confident	81.5	Confident	14 Å²	14	44 Å²	44	14%	0.144	23%	0.225	C	C	.	.	I	π-helix	trans	-84.5	-70.1	-179.6	0	0	0	0	0	111.9	T108 K115 A116	T108-G112 CarbonylContact O-C 3.59Å; T108-G112 WeakPolarHBondContact O-CA 3.34Å; T108-G112 PolarHBondContact O-N 2.64Å; G112-K115 PolarHBondContact O-N 2.92Å; G112-A116 VanDerWaalsContact O-CB 3.28Å; G112-A116 WeakPolarHBondContact O-CB 3.49Å; G112-A116 PolarHBondContact O-N 2.85Å
113	L	87	Confident	82.3	Confident	1 Å²	1	39.2 Å²	39.2	1%	0.005	20%	0.204	C	C	.	.	I	π-helix	trans	-65.7	-46	-169.4	-177.8	62.2	0	0	0	113.7	V90 T108 L109 A116 A117 I124 L137 L247 L342	V90-L113 HydrophobicContact CB-CD1 4.42Å; V90-L113 HydrophobicContact CG1-CD1 3.89Å; T108-L113 PolarHBondContact O-N 3.41Å; L109-L113 HydrophobicContact CD2-CD2 3.87Å; L113-A116 PolarHBondContact O-N 3.39Å; L113-A117 WeakPolarHBondContact O-CB 3.4Å; L113-A117 PolarHBondContact O-N 3.36Å; L113-I124 HydrophobicContact CG-CD1 4.38Å; L113-L137 HydrophobicContact CD2-CD1 3.96Å; L113-L247 HydrophobicContact CD1-CD2 4.26Å; L113-L247 HydrophobicContact CD2-CD2 4.03Å; L113-L342 HydrophobicContact CB-CD2 3.73Å; L113-L342 HydrophobicContact CD1-CD2 4.24Å
114	V	86.3	Confident	83	Confident	0 Å²	0	34.2 Å²	34.2	0%	0	17%	0.172	C	C	.	.	H	α-helix	trans	-68.1	-37.6	-179.3	177.8	0	0	0	0	111.4	L109 A117 Q118 L137 A140 V141 H144 V155	L109-V114 WeakPolarHBondContact O-CG2 3.01Å; L109-V114 PolarHBondContact O-N 2.77Å; V114-A117 PolarHBondContact O-N 2.04Å; V114-Q118 PolarHBondContact O-N 3.41Å; V114-L137 HydrophobicContact CG2-CD1 4.18Å; V114-A140 HydrophobicContact CG2-CB 3.79Å; V114-V141 HydrophobicContact CG2-CG2 4.02Å; V114-H144 HydrophobicContact CG1-CB 3.49Å; V114-H144 VanDerWaalsContact CG1-CB 3.49Å; V114-V155 HydrophobicContact CG1-CG1 4.5Å; V114-V155 HydrophobicContact CG1-CG2 3.93Å
115	K	82.4	Confident	83.6	Confident	83 Å²	83	32.1 Å²	32.1	36%	0.361	16%	0.164	S	C	.	.	H	α-helix	trans	-63.6	-46.7	173.2	-172.4	-168.5	-180	-159.7	0	111.2	K111 G112 A117 Q118 S119 E341	K111-K115 WeakPolarHBondContact O-CB 3.49Å; G112-K115 PolarHBondContact O-N 2.92Å; K115-A117 VanDerWaalsContact C-N 3.33Å; K115-A117 PolarHBondContact O-N 3.05Å; K115-Q118 PolarHBondContact O-N 3.45Å; K115-S119 PolarHBondContact O-N 2.86Å; K115-S119 PolarHBondContact O-OG 3.19Å; K115-E341 IonicContact NZ-OE1 3.9Å; K115-E341 PolarHBondContact NZ-OE1 3.28Å; K115-E341 IonicContact NZ-OE2 2.66Å; K115-E341 PolarHBondContact NZ-OE2 3.5Å
116	A	83.6	Confident	84.2	Confident	3 Å²	3	32 Å²	32	3%	0.025	16%	0.163	C	C	.	.	H	α-helix	trans	-58.9	-44.1	176.6	0	0	0	0	0	111.5	G112 L113 Q118 S119 T120 D343 I346	G112-A116 VanDerWaalsContact O-CB 3.28Å; G112-A116 WeakPolarHBondContact O-CB 3.49Å; G112-A116 PolarHBondContact O-N 2.85Å; L113-A116 PolarHBondContact O-N 3.39Å; A116-Q118 VanDerWaalsContact C-N 3.33Å; A116-Q118 PolarHBondContact O-N 2.83Å; A116-S119 PolarHBondContact O-N 3.04Å; A116-S119 PolarHBondContact O-OG 3.41Å; A116-T120 WeakPolarHBondContact O-CB 3.34Å; A116-T120 WeakPolarHBondContact O-CG2 3.23Å; A116-T120 PolarHBondContact O-N 3.29Å; A116-T120 VanDerWaalsContact O-N 3.14Å; A116-T120 PolarHBondContact O-OG1 2.87Å; A116-D343 HydrophobicContact CB-CB 3.7Å; A116-I346 HydrophobicContact CB-CD1 4.22Å
117	A	85.7	Confident	84.6	Confident	2 Å²	2	28 Å²	28	2%	0.017	15%	0.15	C	C	.	.	H	α-helix	trans	-65.9	-35.2	177.7	0	0	0	0	0	112.8	L113 V114 K115 G121 A122 I124 V155	L113-A117 WeakPolarHBondContact O-CB 3.4Å; L113-A117 PolarHBondContact O-N 3.36Å; V114-A117 PolarHBondContact O-N 2.04Å; K115-A117 VanDerWaalsContact C-N 3.33Å; K115-A117 PolarHBondContact O-N 3.05Å; A117-G121 CarbonylContact O-C 3.57Å; A117-G121 WeakPolarHBondContact O-CA 3.4Å; A117-G121 PolarHBondContact O-N 2.86Å; A117-A122 HydrophobicContact CB-CB 4.17Å; A117-A122 PolarHBondContact O-N 2.87Å; A117-I124 HydrophobicContact CB-CD1 3.65Å; A117-I124 HydrophobicContact CB-CG1 3.8Å; A117-V155 HydrophobicContact CB-CG1 4.14Å
118	Q	82.4	Confident	85	Confident	39 Å²	39	25.4 Å²	25.4	18%	0.182	14%	0.137	C	C	.	.	H	α-helix	trans	-70.2	-46.3	175.2	-166.5	-170.9	30.2	0	0	112.3	V114 K115 A116 T120 H144 S148 V153 V155	V114-Q118 PolarHBondContact O-N 3.41Å; K115-Q118 PolarHBondContact O-N 3.45Å; A116-Q118 VanDerWaalsContact C-N 3.33Å; A116-Q118 PolarHBondContact O-N 2.83Å; Q118-T120 VanDerWaalsContact C-N 3.29Å; Q118-T120 PolarHBondContact O-N 2.88Å; Q118-H144 PolarHBondContact OE1-CE1 3.05Å; Q118-H144 PolarHBondContact OE1-NE2 3.18Å; Q118-S148 PolarHBondContact NE2-OG 3.34Å; Q118-S148 VanDerWaalsContact NE2-OG 3.17Å; Q118-V153 HydrophobicContact CG-CB 4.24Å; Q118-V153 HydrophobicContact CG-CG1 3.84Å; Q118-V153 PolarHBondContact NE2-O 2.84Å; Q118-V153 VanDerWaalsContact O-CG1 3.3Å; Q118-V153 WeakPolarHBondContact O-CG1 3.32Å; Q118-V155 HydrophobicContact CB-CG2 3.93Å; Q118-V155 HydrophobicContact CG-CG2 4.45Å
119	S	76.5	Confident	85.2	Confident	76 Å²	76	24.6 Å²	24.6	53%	0.531	13%	0.131	S	C	.	.	H	α-helix	trans	-63.8	-36.8	-177.3	57.7	0	0	0	0	112.3	K115 A116	K115-S119 PolarHBondContact O-N 2.86Å; K115-S119 PolarHBondContact O-OG 3.19Å; A116-S119 PolarHBondContact O-N 3.04Å; A116-S119 PolarHBondContact O-OG 3.41Å
120	T	77	Confident	85.4	Confident	5 Å²	5	26.7 Å²	26.7	3%	0.031	14%	0.139	C	C	.	.	H	α-helix	trans	-90.9	-20.7	-177.2	57.3	0	0	0	0	114	H87 A116 Q118 A122 W374	H87-T120 PolarHBondContact ND1-O 3.42Å; H87-T120 VanDerWaalsContact ND1-O 3.12Å; A116-T120 WeakPolarHBondContact O-CB 3.34Å; A116-T120 WeakPolarHBondContact O-CG2 3.23Å; A116-T120 PolarHBondContact O-N 3.29Å; A116-T120 VanDerWaalsContact O-N 3.14Å; A116-T120 PolarHBondContact O-OG1 2.87Å; Q118-T120 VanDerWaalsContact C-N 3.29Å; Q118-T120 PolarHBondContact O-N 2.88Å; T120-A122 WeakPolarHBondContact OG1-CB 3.4Å; T120-A122 PolarHBondContact OG1-N 3.24Å; T120-W374 HydrophobicContact CG2-CD2 3.47Å; T120-W374 VanDerWaalsContact CG2-CD2 3.47Å; T120-W374 HydrophobicContact CG2-CE3 3.84Å; T120-W374 HydrophobicContact CG2-CG 3.85Å; T120-W374 HydrophobicContact CG2-CH2 4.36Å; T120-W374 HydrophobicContact CG2-CZ2 4.02Å; T120-W374 HydrophobicContact CG2-CZ3 4.23Å
121	G	80.7	Confident	85.6	Confident	33 Å²	33	23.1 Å²	23.1	34%	0.34	13%	0.126	S	C	.	.	T	Hydrogen-bonded Turn	trans	73.2	32.9	-168	0	0	0	0	0	112.8	A117	A117-G121 CarbonylContact O-C 3.57Å; A117-G121 WeakPolarHBondContact O-CA 3.4Å; A117-G121 PolarHBondContact O-N 2.86Å
122	A	88	Confident	85.8	Confident	2 Å²	2	17.9 Å²	17.9	2%	0.017	11%	0.108	C	C	.	.			trans	-75.4	149.1	-176.6	0	0	0	0	0	113.3	L88 A117 T120	L88-A122 HydrophobicContact CB-CB 3.78Å; L88-A122 HydrophobicContact CD2-CB 3.96Å; L88-A122 HydrophobicContact CG-CB 4Å; L88-A122 CarbonylContact O-C 3.59Å; L88-A122 WeakPolarHBondContact O-CA 3.35Å; L88-A122 VanDerWaalsContact O-CB 3.28Å; L88-A122 WeakPolarHBondContact O-CB 3.23Å; A117-A122 HydrophobicContact CB-CB 4.17Å; A117-A122 PolarHBondContact O-N 2.87Å; T120-A122 WeakPolarHBondContact OG1-CB 3.4Å; T120-A122 PolarHBondContact OG1-N 3.24Å
123	W	92.8	Very high	85.8	Confident	3 Å²	3	17.5 Å²	17.5	1%	0.011	10%	0.102	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.8	130.1	164.4	-70.2	1.2	0	0	0	110.3	Y74 L77 T78 L83 S84 P86 L88 V89 V90 L125 V156 I158 I227	Y74-W123 HydrophobicContact CD2-CH2 4.44Å; Y74-W123 HydrophobicContact CD2-CZ3 4.32Å; Y74-W123 HydrophobicContact CE2-CH2 4.06Å; Y74-W123 HydrophobicContact CE2-CZ3 4.12Å; L77-W123 HydrophobicContact CB-CH2 4.07Å; L77-W123 HydrophobicContact CD1-CH2 4.25Å; L77-W123 HydrophobicContact CD1-CZ3 3.88Å; T78-W123 HydrophobicContact CG2-CH2 4.08Å; L83-W123 HydrophobicContact CB-CZ2 3.76Å; L83-W123 HydrophobicContact CD1-CZ2 4.14Å; S84-W123 WeakPolarHBondContact O-CZ2 3.43Å; P86-W123 HydrophobicContact CB-CB 4.2Å; P86-W123 HydrophobicContact CB-CD2 3.82Å; P86-W123 HydrophobicContact CB-CE3 4.47Å; P86-W123 HydrophobicContact CB-CG 3.66Å; P86-W123 HydrophobicContact CG-CD2 3.56Å; P86-W123 HydrophobicContact CG-CE3 3.74Å; P86-W123 HydrophobicContact CG-CG 3.93Å; P86-W123 HydrophobicContact CG-CH2 4.37Å; P86-W123 HydrophobicContact CG-CZ2 4.21Å; P86-W123 HydrophobicContact CG-CZ3 4.14Å; L88-W123 PolarHBondContact O-N 3.44Å; V89-W123 HydrophobicContact CG2-CB 4.43Å; V90-W123 PolarHBondContact N-O 3.41Å; W123-L125 HydrophobicContact CB-CD1 4.05Å; W123-V156 HydrophobicContact CG-CG1 4.34Å; W123-I158 HydrophobicContact CB-CD1 4.48Å; W123-I158 HydrophobicContact CD2-CD1 3.79Å; W123-I158 HydrophobicContact CE3-CD1 3.66Å; W123-I158 HydrophobicContact CG-CD1 4.18Å; W123-I158 HydrophobicContact CZ3-CD1 4.2Å; W123-I227 HydrophobicContact CZ3-CD1 4.49Å
124	I	93.7	Very high	85.8	Confident	0 Å²	0	17.6 Å²	17.6	0%	0	10%	0.103	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.7	113.9	172	-52.3	174.8	0	0	0	108.5	V90 L113 A117 T126 L137 V155 V156 A157 I158	V90-I124 WeakPolarHBondContact O-CA 3.29Å; L113-I124 HydrophobicContact CG-CD1 4.38Å; A117-I124 HydrophobicContact CB-CD1 3.65Å; A117-I124 HydrophobicContact CB-CG1 3.8Å; I124-T126 HydrophobicContact CG2-CG2 3.94Å; I124-L137 HydrophobicContact CD1-CD1 4.45Å; I124-L137 HydrophobicContact CG2-CD2 3.81Å; I124-V155 HydrophobicContact CD1-CG1 3.8Å; I124-V156 PolarHBondContact N-O 3.36Å; I124-A157 WeakPolarHBondContact O-CA 3.2Å; I124-I158 PolarHBondContact O-N 2.95Å
125	L	93.6	Very high	85.8	Confident	4 Å²	4	20.3 Å²	20.3	2%	0.021	12%	0.115	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98	126	176.1	-80.9	83.4	0	0	0	110.9	V89 V90 L92 W123 I158 I160 L224	V89-L125 HydrophobicContact CG1-CD1 3.38Å; V90-L125 PolarHBondContact O-N 3.24Å; L92-L125 PolarHBondContact N-O 2.93Å; W123-L125 HydrophobicContact CB-CD1 4.05Å; L125-I158 WeakPolarHBondContact CA-O 3.41Å; L125-I158 HydrophobicContact CG-CB 4.42Å; L125-I160 HydrophobicContact CD2-CD1 3.74Å; L125-L224 HydrophobicContact CD2-CD2 3.97Å
126	T	92.3	Very high	85.9	Confident	1 Å²	1	18.3 Å²	18.3	1%	0.006	11%	0.107	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.7	-171.1	178.5	80.8	0	0	0	0	111.8	L92 I124 G128 L137 I158 I160 H200 R220	L92-T126 HydrophobicContact CB-CG2 4.07Å; L92-T126 HydrophobicContact CD2-CG2 4.3Å; I124-T126 HydrophobicContact CG2-CG2 3.94Å; T126-G128 VanDerWaalsContact C-N 3.34Å; T126-G128 PolarHBondContact OG1-N 3.33Å; T126-L137 HydrophobicContact CG2-CD2 3.32Å; T126-I158 PolarHBondContact N-O 3.19Å; T126-I160 PolarHBondContact O-N 2.93Å; T126-H200 PolarHBondContact OG1-CD2 3.42Å; T126-H200 PolarHBondContact OG1-NE2 3.32Å; T126-R220 PolarHBondContact O-NH2 3.1Å; T126-R220 VanDerWaalsContact O-NH2 3.13Å
127	N	87.4	Confident	86.2	Confident	30 Å²	30	18.1 Å²	18.1	16%	0.16	11%	0.105	C	C	.	.			trans	-79	-11.3	169.2	68	11.4	0	0	0	114	L129 F131 T134 I160 A161	N127-L129 PolarHBondContact O-N 2.7Å; N127-L129 VanDerWaalsContact O-N 3.1Å; N127-L129 PolarHBondContact OD1-N 3.04Å; N127-F131 WeakPolarHBondContact ND2-CZ 3.46Å; N127-T134 VanDerWaalsContact OD1-CB 3.26Å; N127-T134 WeakPolarHBondContact OD1-CB 3.36Å; N127-T134 WeakPolarHBondContact OD1-CG2 3.42Å; N127-T134 PolarHBondContact OD1-OG1 2.87Å; N127-I160 WeakPolarHBondContact CA-O 3.34Å; N127-A161 VanDerWaalsContact O-CB 3.23Å; N127-A161 WeakPolarHBondContact O-CB 3.43Å
128	G	88.1	Confident	86.3	Confident	0 Å²	0	18 Å²	18	0%	0	11%	0.105	C	C	.	.			trans	65.1	5.7	178.7	0	0	0	0	0	116.1	T126 D197	T126-G128 VanDerWaalsContact C-N 3.34Å; T126-G128 PolarHBondContact OG1-N 3.33Å; G128-D197 PolarHBondContact O-N 2.85Å; G128-D197 VanDerWaalsContact O-N 3.1Å
129	L	88.9	Confident	86.4	Confident	2 Å²	2	18.2 Å²	18.2	1%	0.01	11%	0.106	C	C	.	.	B	Isolated β-bridge	trans	-99.6	143.2	-177.9	-65	171	0	0	0	109.5	N127 F131 T134 A161 M165 I166 L196	N127-L129 PolarHBondContact O-N 2.7Å; N127-L129 VanDerWaalsContact O-N 3.1Å; N127-L129 PolarHBondContact OD1-N 3.04Å; L129-F131 HydrophobicContact CB-CD1 3.43Å; L129-F131 VanDerWaalsContact CB-CD1 3.43Å; L129-F131 HydrophobicContact CB-CE1 3.36Å; L129-F131 HydrophobicContact CD1-CD1 4.4Å; L129-F131 HydrophobicContact CD1-CE1 3.63Å; L129-F131 HydrophobicContact CG-CE1 4.11Å; L129-F131 PolarHBondContact O-N 2.89Å; L129-T134 VanDerWaalsContact O-CB 3.28Å; L129-T134 WeakPolarHBondContact O-CB 3.34Å; L129-T134 VanDerWaalsContact O-CG2 3.28Å; L129-T134 WeakPolarHBondContact O-CG2 3.44Å; L129-A161 HydrophobicContact CD1-CB 4.25Å; L129-A161 HydrophobicContact CD2-CB 4.13Å; L129-A161 HydrophobicContact CG-CB 4.01Å; L129-M165 HydrophobicContact CD1-CB 4.3Å; L129-I166 HydrophobicContact CD2-CG1 4.2Å; L129-L196 HydrophobicContact CD2-CD2 4.06Å
130	R	86.4	Confident	87	Confident	45 Å²	45	14.8 Å²	14.8	17%	0.17	8%	0.081	C	C	.	.	S	Bend	trans	-80.2	60.2	-175.6	-166.2	-173.3	167.1	111	-10.1	111.7	K135 D187 S195 D197	R130-K135 HydrophobicContact CG-CB 4.44Å; R130-K135 HydrophobicContact CG-CD 4.42Å; R130-K135 HydrophobicContact CG-CG 4.23Å; R130-D187 IonicContact CZ-OD1 3.66Å; R130-D187 IonicContact CZ-OD2 3.77Å; R130-D187 IonicContact NE-OD1 3.96Å; R130-D187 PolarHBondContact NE-OD1 3.49Å; R130-D187 IonicContact NE-OD2 3.17Å; R130-D187 IonicContact NH2-OD1 3.36Å; R130-D187 PolarHBondContact NH2-OD1 3.34Å; R130-D187 IonicContact NH2-OD2 3.86Å; R130-D187 PolarHBondContact NH2-OD2 2.93Å; R130-S195 WeakPolarHBondContact CB-O 3.44Å; R130-S195 PolarHBondContact N-O 3.49Å; R130-D197 HydrophobicContact CB-CB 4.22Å
131	F	84.1	Confident	87.5	Confident	17 Å²	17	15.2 Å²	15.2	8%	0.075	8%	0.084	C	C	.	.	S	Bend	trans	-144.1	163.6	173.7	73.7	-97.1	0	0	0	111.5	D96 N127 L129 I133 T134 K135 Y194	D96-F131 HydrophobicContact CB-CE2 4.09Å; D96-F131 VanDerWaalsContact OD1-CE2 3.28Å; D96-F131 WeakPolarHBondContact OD1-CE2 3.38Å; N127-F131 WeakPolarHBondContact ND2-CZ 3.46Å; L129-F131 HydrophobicContact CB-CD1 3.43Å; L129-F131 VanDerWaalsContact CB-CD1 3.43Å; L129-F131 HydrophobicContact CB-CE1 3.36Å; L129-F131 HydrophobicContact CD1-CD1 4.4Å; L129-F131 HydrophobicContact CD1-CE1 3.63Å; L129-F131 HydrophobicContact CG-CE1 4.11Å; L129-F131 PolarHBondContact O-N 2.89Å; F131-I133 PolarHBondContact O-N 3.06Å; F131-T134 PolarHBondContact O-N 3.18Å; F131-K135 PolarHBondContact O-N 3.16Å; F131-Y194 HydrophobicContact CB-CD1 3.74Å; F131-Y194 HydrophobicContact CB-CE1 3.92Å; F131-Y194 HydrophobicContact CB-CG 4.37Å; F131-Y194 AromaticContact CD1-CD1 3.71Å; F131-Y194 HydrophobicContact CD1-CD1 3.71Å; F131-Y194 AromaticContact CD1-CD2 3.66Å; F131-Y194 HydrophobicContact CD1-CD2 3.66Å; F131-Y194 HydrophobicContact CD1-CE1 4.12Å; F131-Y194 HydrophobicContact CD1-CE2 4.09Å; F131-Y194 AromaticContact CD1-CG 3.45Å; F131-Y194 HydrophobicContact CD1-CG 3.45Å; F131-Y194 VanDerWaalsContact CD1-CG 3.45Å; F131-Y194 AromaticContact CE1-CD2 3.7Å; F131-Y194 HydrophobicContact CE1-CD2 3.7Å; F131-Y194 HydrophobicContact CE1-CE2 4.02Å; F131-Y194 AromaticContact CE1-CG 3.98Å; F131-Y194 HydrophobicContact CE1-CG 3.98Å; F131-Y194 AromaticContact CG-CD1 3.92Å; F131-Y194 HydrophobicContact CG-CD1 3.92Å; F131-Y194 HydrophobicContact CG-CD2 4.46Å; F131-Y194 HydrophobicContact CG-CE1 4.02Å; F131-Y194 HydrophobicContact CG-CG 4.15Å; F131-Y194 HydrophobicContact CZ-CE2 4.47Å
132	G	81.8	Confident	87.7	Confident	15 Å²	15	16.1 Å²	16.1	16%	0.155	8%	0.077	C	C	.	.	H	α-helix	trans	51.1	-135.5	175.3	0	0	0	0	0	114.1	T134 K135	G132-T134 VanDerWaalsContact C-N 3.29Å; G132-T134 PolarHBondContact O-N 3.49Å; G132-K135 PolarHBondContact O-N 3.35Å
133	I	83.9	Confident	87.5	Confident	6 Å²	6	19.1 Å²	19.1	3%	0.031	9%	0.093	C	C	.	.	H	α-helix	trans	-61.7	-34.7	-179.8	-156.9	80.7	0	0	0	112.7	L92 L98 M101 L109 F131 K135 H136 L137 V249	L92-I133 HydrophobicContact CD2-CG1 4.12Å; L92-I133 HydrophobicContact CD2-CG2 4.01Å; L92-I133 HydrophobicContact CG-CG2 4.35Å; L98-I133 HydrophobicContact CD1-CD1 4.3Å; M101-I133 HydrophobicContact CE-CD1 3.73Å; M101-I133 HydrophobicContact SD-CD1 4.21Å; L109-I133 HydrophobicContact CD1-CD1 3.82Å; L109-I133 HydrophobicContact CD1-CG1 3.84Å; F131-I133 PolarHBondContact O-N 3.06Å; I133-K135 PolarHBondContact O-N 2.73Å; I133-H136 PolarHBondContact O-N 3.1Å; I133-L137 PolarHBondContact O-N 3.5Å; I133-V249 HydrophobicContact CD1-CB 4.04Å; I133-V249 HydrophobicContact CD1-CG1 3.49Å; I133-V249 VanDerWaalsContact CD1-CG1 3.49Å; I133-V249 HydrophobicContact CG1-CB 4.38Å; I133-V249 HydrophobicContact CG1-CG1 4.34Å
134	T	86.9	Confident	86.9	Confident	4 Å²	4	20.8 Å²	20.8	3%	0.025	10%	0.101	C	C	.	.	H	α-helix	trans	-68.8	-35.9	-175.6	-54.4	0	0	0	0	111.6	N127 L129 F131 G132 H136 L137 G138	N127-T134 VanDerWaalsContact OD1-CB 3.26Å; N127-T134 WeakPolarHBondContact OD1-CB 3.36Å; N127-T134 WeakPolarHBondContact OD1-CG2 3.42Å; N127-T134 PolarHBondContact OD1-OG1 2.87Å; L129-T134 VanDerWaalsContact O-CB 3.28Å; L129-T134 WeakPolarHBondContact O-CB 3.34Å; L129-T134 VanDerWaalsContact O-CG2 3.28Å; L129-T134 WeakPolarHBondContact O-CG2 3.44Å; F131-T134 PolarHBondContact O-N 3.18Å; G132-T134 VanDerWaalsContact C-N 3.29Å; G132-T134 PolarHBondContact O-N 3.49Å; T134-H136 VanDerWaalsContact C-N 3.3Å; T134-H136 PolarHBondContact O-N 3.47Å; T134-L137 PolarHBondContact O-N 3.43Å; T134-G138 PolarHBondContact O-N 2.84Å
135	K	85.8	Confident	86.3	Confident	57 Å²	57	25 Å²	25	25%	0.248	13%	0.13	C	C	.	.	H	α-helix	trans	-57.4	-45.6	172.2	176.3	172.9	174.5	165.2	0	110.7	R130 F131 G132 I133 G138 Q139 D187	R130-K135 HydrophobicContact CG-CB 4.44Å; R130-K135 HydrophobicContact CG-CD 4.42Å; R130-K135 HydrophobicContact CG-CG 4.23Å; F131-K135 PolarHBondContact O-N 3.16Å; G132-K135 PolarHBondContact O-N 3.35Å; I133-K135 PolarHBondContact O-N 2.73Å; K135-G138 PolarHBondContact O-N 3.28Å; K135-Q139 WeakPolarHBondContact O-CG 3.48Å; K135-Q139 PolarHBondContact O-N 3.1Å; K135-Q139 VanDerWaalsContact O-N 3.14Å; K135-D187 WeakPolarHBondContact CE-OD1 3.45Å; K135-D187 IonicContact NZ-OD1 2.84Å; K135-D187 PolarHBondContact NZ-OD1 3.41Å; K135-D187 IonicContact NZ-OD2 3.11Å
136	H	85.4	Confident	85.7	Confident	40 Å²	40	32 Å²	32	19%	0.185	17%	0.167	C	C	.	.	H	α-helix	trans	-68.5	-39.3	179.3	-70.4	-54.5	0	0	0	112.9	M101 I133 T134 G138 Q139 A140	M101-H136 HydrophobicContact SD-CB 3.82Å; M101-H136 PolarHBondContact SD-CD2 3.3Å; I133-H136 PolarHBondContact O-N 3.1Å; T134-H136 VanDerWaalsContact C-N 3.3Å; T134-H136 PolarHBondContact O-N 3.47Å; H136-G138 VanDerWaalsContact C-N 3.33Å; H136-G138 PolarHBondContact O-N 2.88Å; H136-Q139 PolarHBondContact ND1-OE1 3.37Å; H136-Q139 PolarHBondContact O-N 3.47Å; H136-A140 PolarHBondContact O-N 2.99Å
137	L	88.3	Confident	85	Confident	0 Å²	0	35.6 Å²	35.6	0%	0	20%	0.197	C	C	.	.	H	α-helix	trans	-59.3	-44.4	170.4	-178.5	73.4	0	0	0	111.5	L92 L113 V114 I124 T126 I133 T134 Q139 A140 V141	L92-L137 HydrophobicContact CD2-CB 4.35Å; L92-L137 HydrophobicContact CD2-CD2 4Å; L113-L137 HydrophobicContact CD2-CD1 3.96Å; V114-L137 HydrophobicContact CG2-CD1 4.18Å; I124-L137 HydrophobicContact CD1-CD1 4.45Å; I124-L137 HydrophobicContact CG2-CD2 3.81Å; T126-L137 HydrophobicContact CG2-CD2 3.32Å; I133-L137 PolarHBondContact O-N 3.5Å; T134-L137 PolarHBondContact O-N 3.43Å; L137-Q139 VanDerWaalsContact C-N 3.26Å; L137-Q139 PolarHBondContact O-N 3.25Å; L137-A140 WeakPolarHBondContact O-CB 3.36Å; L137-A140 PolarHBondContact O-N 3.46Å; L137-A140 VanDerWaalsContact O-N 3.08Å; L137-V141 HydrophobicContact CG-CG2 4.37Å; L137-V141 WeakPolarHBondContact O-CG2 3.46Å; L137-V141 PolarHBondContact O-N 3.28Å
138	G	87.6	Confident	84.3	Confident	0 Å²	0	35.9 Å²	35.9	0%	0	20%	0.201	C	C	.	.	H	α-helix	trans	-57.9	-38.3	176	0	0	0	0	0	112.4	T134 K135 H136 R142 H199	T134-G138 PolarHBondContact O-N 2.84Å; K135-G138 PolarHBondContact O-N 3.28Å; H136-G138 VanDerWaalsContact C-N 3.33Å; H136-G138 PolarHBondContact O-N 2.88Å; G138-R142 WeakPolarHBondContact O-CG 3.26Å; G138-R142 PolarHBondContact O-N 3.43Å; G138-R142 VanDerWaalsContact O-N 3.11Å; G138-H199 WeakPolarHBondContact O-CB 3.42Å
139	Q	85.9	Confident	82.9	Confident	43 Å²	43	43 Å²	43	20%	0.201	25%	0.245	C	C	.	.	H	α-helix	trans	-67.5	-43	172.9	-31.8	-169.1	-56.3	0	0	112	K135 H136 L137 V141 R142 D143	K135-Q139 WeakPolarHBondContact O-CG 3.48Å; K135-Q139 PolarHBondContact O-N 3.1Å; K135-Q139 VanDerWaalsContact O-N 3.14Å; H136-Q139 PolarHBondContact ND1-OE1 3.37Å; H136-Q139 PolarHBondContact O-N 3.47Å; L137-Q139 VanDerWaalsContact C-N 3.26Å; L137-Q139 PolarHBondContact O-N 3.25Å; Q139-V141 VanDerWaalsContact C-N 3.33Å; Q139-V141 PolarHBondContact O-N 3.45Å; Q139-R142 VanDerWaalsContact CB-NH2 3.27Å; Q139-R142 WeakPolarHBondContact O-CB 3.41Å; Q139-R142 PolarHBondContact O-N 3.5Å; Q139-D143 VanDerWaalsContact O-CG 3.23Å; Q139-D143 PolarHBondContact O-N 3.06Å
140	A	87.8	Confident	81.4	Confident	3 Å²	3	45.7 Å²	45.7	3%	0.025	26%	0.264	C	S	.	.	H	α-helix	trans	-58.7	-43.4	176.5	0	0	0	0	0	112.4	R110 V114 H136 L137 D143 H144	R110-A140 HydrophobicContact CB-CB 3.95Å; R110-A140 HydrophobicContact CG-CB 4.27Å; V114-A140 HydrophobicContact CG2-CB 3.79Å; H136-A140 PolarHBondContact O-N 2.99Å; L137-A140 WeakPolarHBondContact O-CB 3.36Å; L137-A140 PolarHBondContact O-N 3.46Å; L137-A140 VanDerWaalsContact O-N 3.08Å; A140-D143 PolarHBondContact O-N 3.25Å; A140-H144 WeakPolarHBondContact O-CB 3.49Å; A140-H144 PolarHBondContact O-N 3.45Å
141	V	87.9	Confident	80	Confident	15 Å²	15	48.6 Å²	48.6	9%	0.091	29%	0.291	C	S	.	.	H	α-helix	trans	-64.5	-39.4	176	175	0	0	0	0	111.2	V114 L137 Q139 S145 V155	V114-V141 HydrophobicContact CG2-CG2 4.02Å; L137-V141 HydrophobicContact CG-CG2 4.37Å; L137-V141 WeakPolarHBondContact O-CG2 3.46Å; L137-V141 PolarHBondContact O-N 3.28Å; Q139-V141 VanDerWaalsContact C-N 3.33Å; Q139-V141 PolarHBondContact O-N 3.45Å; V141-S145 VanDerWaalsContact O-CB 3.31Å; V141-S145 WeakPolarHBondContact O-CB 3.44Å; V141-S145 PolarHBondContact O-N 3.33Å; V141-V155 HydrophobicContact CG2-CG1 4.38Å
142	R	85.1	Confident	78.6	Confident	51 Å²	51	56.6 Å²	56.6	19%	0.192	33%	0.326	C	S	.	.	H	α-helix	trans	-59.6	-56	172	-76.3	-169.1	-66.8	-98.9	8.5	112.2	G138 Q139 H144 S145 L146 H199	G138-R142 WeakPolarHBondContact O-CG 3.26Å; G138-R142 PolarHBondContact O-N 3.43Å; G138-R142 VanDerWaalsContact O-N 3.11Å; Q139-R142 VanDerWaalsContact CB-NH2 3.27Å; Q139-R142 WeakPolarHBondContact O-CB 3.41Å; Q139-R142 PolarHBondContact O-N 3.5Å; R142-H144 PolarHBondContact O-N 3.29Å; R142-S145 PolarHBondContact O-N 3.25Å; R142-L146 WeakPolarHBondContact O-CG 3.5Å; R142-L146 PolarHBondContact O-N 3.15Å; R142-H199 WeakPolarHBondContact CD-CE1 3.43Å; R142-H199 WeakPolarHBondContact CD-NE2 3.38Å; R142-H199 HydrophobicContact CG-CB 4.11Å; R142-H199 VanDerWaalsContact CG-CD2 3.48Å; R142-H199 WeakPolarHBondContact CG-CD2 3.32Å; R142-H199 WeakPolarHBondContact CG-CE1 3.36Å; R142-H199 WeakPolarHBondContact CG-ND1 3.38Å; R142-H199 PolarHBondContact NH1-CD2 3.18Å; R142-H199 PolarHBondContact NH1-NE2 2.94Å
143	D	83.4	Confident	77.7	Confident	66 Å²	66	58.8 Å²	58.8	35%	0.353	34%	0.336	S	S	.	.	H	α-helix	trans	-58.1	-41.2	-173.1	-67.6	-4.3	0	0	0	109.5	Q139 A140 L146 A147	Q139-D143 VanDerWaalsContact O-CG 3.23Å; Q139-D143 PolarHBondContact O-N 3.06Å; A140-D143 PolarHBondContact O-N 3.25Å; D143-L146 PolarHBondContact O-N 2.88Å; D143-A147 VanDerWaalsContact O-CB 3.29Å; D143-A147 WeakPolarHBondContact O-CB 3.44Å; D143-A147 PolarHBondContact O-N 3.2Å
144	H	81.4	Confident	77.2	Confident	38 Å²	38	68.4 Å²	68.4	18%	0.176	37%	0.372	C	S	.	.	H	α-helix	trans	-70	-38.9	175.9	-159.9	-60.7	0	0	0	113	V114 Q118 A140 R142 L146 A147 S148	V114-H144 HydrophobicContact CG1-CB 3.49Å; V114-H144 VanDerWaalsContact CG1-CB 3.49Å; Q118-H144 PolarHBondContact OE1-CE1 3.05Å; Q118-H144 PolarHBondContact OE1-NE2 3.18Å; A140-H144 WeakPolarHBondContact O-CB 3.49Å; A140-H144 PolarHBondContact O-N 3.45Å; R142-H144 PolarHBondContact O-N 3.29Å; H144-L146 PolarHBondContact O-N 3.03Å; H144-A147 PolarHBondContact O-N 3.12Å; H144-S148 WeakPolarHBondContact O-CB 3.4Å; H144-S148 PolarHBondContact O-N 3.38Å
145	S	80.4	Confident	77.1	Confident	88 Å²	88	69.4 Å²	69.4	62%	0.615	38%	0.378	S	S	*	.	H	α-helix	trans	-64.9	-29.2	175	-175.3	0	0	0	0	112.5	V141 R142	V141-S145 VanDerWaalsContact O-CB 3.31Å; V141-S145 WeakPolarHBondContact O-CB 3.44Å; V141-S145 PolarHBondContact O-N 3.33Å; R142-S145 PolarHBondContact O-N 3.25Å
146	L	80.8	Confident	77.3	Confident	151 Å²	151	67.9 Å²	67.9	79%	0.791	37%	0.373	S	S	*	.	H	α-helix	trans	-80.3	-33	174.9	-68	172.3	0	0	0	112.2	R142 D143 H144	R142-L146 WeakPolarHBondContact O-CG 3.5Å; R142-L146 PolarHBondContact O-N 3.15Å; D143-L146 PolarHBondContact O-N 2.88Å; H144-L146 PolarHBondContact O-N 3.03Å
147	A	77.8	Confident	77.6	Confident	77 Å²	77	66 Å²	66	64%	0.636	37%	0.365	S	S	*	.	H	α-helix	trans	-84.9	-24.3	-179.8	0	0	0	0	0	114.1	D143 H144 T149	D143-A147 VanDerWaalsContact O-CB 3.29Å; D143-A147 WeakPolarHBondContact O-CB 3.44Å; D143-A147 PolarHBondContact O-N 3.2Å; H144-A147 PolarHBondContact O-N 3.12Å; A147-T149 PolarHBondContact O-N 3.38Å
148	S	72.1	Confident	77.9	Confident	35 Å²	35	66.1 Å²	66.1	25%	0.245	37%	0.366	C	S	.	.			trans	-71.2	124.3	-176.3	-179.5	0	0	0	0	111.9	Q118 H144 S150	Q118-S148 PolarHBondContact NE2-OG 3.34Å; Q118-S148 VanDerWaalsContact NE2-OG 3.17Å; H144-S148 WeakPolarHBondContact O-CB 3.4Å; H144-S148 PolarHBondContact O-N 3.38Å; S148-S150 PolarHBondContact OG-N 2.99Å; S148-S150 PolarHBondContact OG-O 3.2Å
149	T	60.5	Low	78.2	Confident	151 Å²	151	66.1 Å²	66.1	93%	0.926	37%	0.366	S	S	*	.			trans	-82.2	-14.4	173.9	52	0	0	0	0	113.2	A147	A147-T149 PolarHBondContact O-N 3.38Å
150	S	56.9	Low	78.5	Confident	57 Å²	57	64.1 Å²	64.1	40%	0.399	36%	0.356	S	S	.	.			trans	-90	124.7	-179.6	-178.5	0	0	0	0	111.8	S148 K152	S148-S150 PolarHBondContact OG-N 2.99Å; S148-S150 PolarHBondContact OG-O 3.2Å; S150-K152 PolarHBondContact OG-N 3.22Å
151	S	57.3	Low	78.6	Confident	107 Å²	107	64 Å²	64	75%	0.748	36%	0.355	S	S	*	.	S	Bend	trans	-84	-13.5	174	59	0	0	0	0	113.8
152	K	54.2	Low	78.7	Confident	184 Å²	184	63.9 Å²	63.9	80%	0.8	36%	0.355	S	S	*	.	S	Bend	trans	-83.6	-31.8	-170.8	-72.5	-177.5	-179.9	170.4	0	114.4	S150	S150-K152 PolarHBondContact OG-N 3.22Å
153	V	63.4	Low	78.8	Confident	62 Å²	62	62.5 Å²	62.5	38%	0.376	35%	0.349	S	S	.	.			trans	-121.5	103.3	-174.1	-170.8	0	0	0	0	109.8	Q118	Q118-V153 HydrophobicContact CG-CB 4.24Å; Q118-V153 HydrophobicContact CG-CG1 3.84Å; Q118-V153 PolarHBondContact NE2-O 2.84Å; Q118-V153 VanDerWaalsContact O-CG1 3.3Å; Q118-V153 WeakPolarHBondContact O-CG1 3.32Å
154	R	73	Confident	79	Confident	207 Å²	207	62.7 Å²	62.7	78%	0.781	35%	0.351	S	S	*	.			trans	-99.9	138.8	174.6	-69.7	-174.5	179	-174.8	-0.5	109.7	V156	R154-V156 PolarHBondContact O-N 2.9Å
155	V	84.9	Confident	79.2	Confident	26 Å²	26	63.6 Å²	63.6	16%	0.158	36%	0.356	C	S	.	.			trans	-69.6	122.9	175.6	178.4	0	0	0	0	109.2	V114 A117 Q118 I124 V141	V114-V155 HydrophobicContact CG1-CG1 4.5Å; V114-V155 HydrophobicContact CG1-CG2 3.93Å; A117-V155 HydrophobicContact CB-CG1 4.14Å; Q118-V155 HydrophobicContact CB-CG2 3.93Å; Q118-V155 HydrophobicContact CG-CG2 4.45Å; I124-V155 HydrophobicContact CD1-CG1 3.8Å; V141-V155 HydrophobicContact CG2-CG1 4.38Å
156	V	89.3	Confident	79.6	Confident	24 Å²	24	59.6 Å²	59.6	15%	0.145	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.4	101.1	-179.7	-177.3	0	0	0	0	109	L83 W123 I124 R154 I158	L83-V156 HydrophobicContact CD1-CG1 4.28Å; L83-V156 HydrophobicContact CD2-CG1 3.99Å; L83-V156 HydrophobicContact CD2-CG2 4.24Å; W123-V156 HydrophobicContact CG-CG1 4.34Å; I124-V156 PolarHBondContact N-O 3.36Å; R154-V156 PolarHBondContact O-N 2.9Å; V156-I158 HydrophobicContact CG1-CD1 4.29Å; V156-I158 HydrophobicContact CG1-CG1 4Å
157	A	91.8	Very high	79.8	Confident	1 Å²	1	55.1 Å²	55.1	1%	0.008	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.1	123.8	171.5	0	0	0	0	0	110.3	I124 S201 H202	I124-A157 WeakPolarHBondContact O-CA 3.2Å; A157-S201 PolarHBondContact O-N 3.14Å; A157-S201 PolarHBondContact O-OG 3.12Å; A157-H202 PolarHBondContact O-N 3.28Å
158	I	93.9	Very high	80.1	Confident	3 Å²	3	55.5 Å²	55.5	2%	0.015	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	121.2	-178.5	-52.7	-179.6	0	0	0	109.3	L77 L83 W123 I124 L125 T126 V156 H202 V204	L77-I158 HydrophobicContact CD1-CD1 4.27Å; L77-I158 HydrophobicContact CD2-CD1 4.34Å; L83-I158 HydrophobicContact CD1-CD1 4.41Å; W123-I158 HydrophobicContact CB-CD1 4.48Å; W123-I158 HydrophobicContact CD2-CD1 3.79Å; W123-I158 HydrophobicContact CE3-CD1 3.66Å; W123-I158 HydrophobicContact CG-CD1 4.18Å; W123-I158 HydrophobicContact CZ3-CD1 4.2Å; I124-I158 PolarHBondContact O-N 2.95Å; L125-I158 WeakPolarHBondContact CA-O 3.41Å; L125-I158 HydrophobicContact CG-CB 4.42Å; T126-I158 PolarHBondContact N-O 3.19Å; V156-I158 HydrophobicContact CG1-CD1 4.29Å; V156-I158 HydrophobicContact CG1-CG1 4Å; I158-H202 CarbonylContact C-O 3.56Å; I158-H202 WeakPolarHBondContact CA-O 3.3Å; I158-H202 HydrophobicContact CG1-CB 4.29Å; I158-H202 HydrophobicContact CG2-CB 4.37Å; I158-V204 HydrophobicContact CG2-CG2 4.5Å
159	G	93.4	Very high	80.7	Confident	0 Å²	0	59.2 Å²	59.2	0%	0	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.3	118.3	179.2	0	0	0	0	0	112.6	H202 F203 V204	G159-H202 PolarHBondContact N-O 3.45Å; G159-F203 CarbonylContact O-C 3.6Å; G159-F203 VanDerWaalsContact O-CA 3.32Å; G159-F203 WeakPolarHBondContact O-CA 3.49Å; G159-V204 PolarHBondContact O-N 3.41Å
160	I	92.4	Very high	81.7	Confident	1 Å²	1	60 Å²	60	1%	0.005	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	102.2	172.8	-53.9	-177.4	0	0	0	109	L125 T126 N127 V204 V206 T216 R220 L223	L125-I160 HydrophobicContact CD2-CD1 3.74Å; T126-I160 PolarHBondContact O-N 2.93Å; N127-I160 WeakPolarHBondContact CA-O 3.34Å; I160-V204 WeakPolarHBondContact CA-O 3.35Å; I160-V204 HydrophobicContact CG1-CB 4.25Å; I160-V206 HydrophobicContact CG2-CG2 4.05Å; I160-T216 HydrophobicContact CG2-CG2 4.23Å; I160-R220 HydrophobicContact CD1-CG 4.31Å; I160-R220 PolarHBondContact O-NH2 2.76Å; I160-L223 HydrophobicContact CD1-CD2 3.75Å
161	A	90.7	Very high	82.9	Confident	0 Å²	0	58 Å²	58	0%	0	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	147.3	-172.1	0	0	0	0	0	112.2	N127 L129 I166 V204 F205 V206	N127-A161 VanDerWaalsContact O-CB 3.23Å; N127-A161 WeakPolarHBondContact O-CB 3.43Å; L129-A161 HydrophobicContact CD1-CB 4.25Å; L129-A161 HydrophobicContact CD2-CB 4.13Å; L129-A161 HydrophobicContact CG-CB 4.01Å; A161-I166 HydrophobicContact CB-CD1 4.5Å; A161-V204 PolarHBondContact N-O 3.21Å; A161-F205 HydrophobicContact CB-CD1 4.11Å; A161-F205 HydrophobicContact CB-CE1 4.37Å; A161-F205 WeakPolarHBondContact O-CA 3.47Å; A161-V206 PolarHBondContact O-N 3.46Å
162	P	89.5	Confident	84	Confident	12 Å²	12	53.1 Å²	53.1	8%	0.078	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.5	134	170.3	32.7	-34.4	0	0	0	110.8	N164 M165 E208 T216	P162-N164 VanDerWaalsContact C-N 3.26Å; P162-N164 WeakPolarHBondContact CB-OD1 3.43Å; P162-N164 PolarHBondContact O-N 2.9Å; P162-M165 HydrophobicContact CB-CG 4.45Å; P162-M165 HydrophobicContact CG-CB 3.95Å; P162-M165 HydrophobicContact CG-CG 3.65Å; P162-M165 HydrophobicContact CG-SD 3.45Å; P162-M165 WeakPolarHBondContact CG-SD 3.32Å; P162-M165 PolarHBondContact O-N 2.97Å; P162-E208 HydrophobicContact CB-CG 3.81Å; P162-T216 HydrophobicContact CB-CG2 4.36Å; P162-T216 WeakPolarHBondContact CB-OG1 3.43Å
163	W	87.8	Confident	85.2	Confident	22 Å²	22	48.5 Å²	48.5	8%	0.083	23%	0.229	C	C	.	.	G	3₁₀ helix	trans	-64.6	-26.5	-173.2	179.4	-108.2	0	0	0	114.3	M165 I166 R169 L172 L173 F205 V206	W163-M165 VanDerWaalsContact C-N 3.35Å; W163-I166 HydrophobicContact CE3-CD1 3.87Å; W163-I166 HydrophobicContact CZ3-CD1 4.38Å; W163-R169 HydrophobicContact CH2-CB 4.09Å; W163-R169 HydrophobicContact CZ2-CB 3.92Å; W163-R169 HydrophobicContact CZ2-CG 4.42Å; W163-L172 HydrophobicContact CH2-CB 4.03Å; W163-L172 HydrophobicContact CH2-CD1 4.34Å; W163-L172 HydrophobicContact CZ3-CB 4.38Å; W163-L172 HydrophobicContact CZ3-CD1 4.03Å; W163-L173 HydrophobicContact CH2-CD2 4.15Å; W163-L173 HydrophobicContact CH2-CG 4.42Å; W163-L173 HydrophobicContact CZ2-CD2 3.86Å; W163-L173 HydrophobicContact CZ2-CG 4.15Å; W163-F205 HydrophobicContact CE3-CB 3.81Å; W163-F205 AromaticContact CE3-CD2 3.82Å; W163-F205 HydrophobicContact CE3-CD2 3.82Å; W163-F205 AromaticContact CE3-CG 3.94Å; W163-F205 HydrophobicContact CE3-CG 3.94Å; W163-F205 HydrophobicContact CZ3-CB 4.45Å; W163-F205 AromaticContact CZ3-CD2 3.63Å; W163-F205 HydrophobicContact CZ3-CD2 3.63Å; W163-F205 HydrophobicContact CZ3-CE2 4.18Å; W163-F205 HydrophobicContact CZ3-CG 4.23Å; W163-V206 WeakPolarHBondContact CB-O 3.41Å; W163-V206 PolarHBondContact N-O 3.38Å
164	N	86.6	Confident	85.5	Confident	71 Å²	71	50.3 Å²	50.3	38%	0.38	24%	0.241	S	C	.	.	G	3₁₀ helix	trans	-72.5	-24.1	177.9	57.1	-7.2	0	0	0	113.4	P162 E208	P162-N164 VanDerWaalsContact C-N 3.26Å; P162-N164 WeakPolarHBondContact CB-OD1 3.43Å; P162-N164 PolarHBondContact O-N 2.9Å; N164-E208 PolarHBondContact ND2-OE2 2.86Å
165	M	85.9	Confident	85.3	Confident	57 Å²	57	40.8 Å²	40.8	28%	0.281	21%	0.206	S	C	.	.	G	3₁₀ helix	trans	-93.3	4.2	-177.8	-57	-175	101.1	0	0	113.8	L129 P162 W163 V193 Y194	L129-M165 HydrophobicContact CD1-CB 4.3Å; P162-M165 HydrophobicContact CB-CG 4.45Å; P162-M165 HydrophobicContact CG-CB 3.95Å; P162-M165 HydrophobicContact CG-CG 3.65Å; P162-M165 HydrophobicContact CG-SD 3.45Å; P162-M165 WeakPolarHBondContact CG-SD 3.32Å; P162-M165 PolarHBondContact O-N 2.97Å; W163-M165 VanDerWaalsContact C-N 3.35Å; M165-V193 CarbonylContact O-C 3.58Å; M165-V193 WeakPolarHBondContact O-CA 3.47Å; M165-V193 WeakPolarHBondContact O-CG1 3.34Å; M165-Y194 HydrophobicContact CE-CD2 4.47Å; M165-Y194 HydrophobicContact CE-CE2 4.07Å; M165-Y194 PolarHBondContact O-N 3.5Å
166	I	88.8	Confident	84.4	Confident	4 Å²	4	45.7 Å²	45.7	2%	0.021	23%	0.225	C	C	.	.	B	Isolated β-bridge	trans	-90.3	123.5	-176.7	-60.4	167.9	0	0	0	111.5	L129 A161 W163 R169 L172 L196 F205	L129-I166 HydrophobicContact CD2-CG1 4.2Å; A161-I166 HydrophobicContact CB-CD1 4.5Å; W163-I166 HydrophobicContact CE3-CD1 3.87Å; W163-I166 HydrophobicContact CZ3-CD1 4.38Å; I166-R169 HydrophobicContact CB-CB 4.48Å; I166-R169 HydrophobicContact CG2-CB 4.43Å; I166-L172 HydrophobicContact CG2-CD1 3.99Å; I166-L196 HydrophobicContact CD1-CD2 4.33Å; I166-L196 HydrophobicContact CG1-CD2 4.22Å; I166-L196 HydrophobicContact CG2-CD1 4.26Å; I166-L196 HydrophobicContact CG2-CD2 4.18Å; I166-L196 HydrophobicContact CG2-CG 4.02Å; I166-F205 HydrophobicContact CD1-CB 4.41Å; I166-F205 HydrophobicContact CD1-CD1 3.32Å; I166-F205 HydrophobicContact CD1-CD2 4.19Å; I166-F205 HydrophobicContact CD1-CE1 3.45Å; I166-F205 VanDerWaalsContact CD1-CE1 3.45Å; I166-F205 HydrophobicContact CD1-CE2 4.3Å; I166-F205 HydrophobicContact CD1-CG 3.72Å; I166-F205 HydrophobicContact CD1-CZ 3.96Å
167	H	86.3	Confident	83	Confident	57 Å²	57	50.5 Å²	50.5	26%	0.264	25%	0.254	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.1	141.6	174.6	-174.9	-89.5	0	0	0	110.9	R169 Y183 L188 V193 Y194	H167-R169 PolarHBondContact O-N 2.99Å; H167-Y183 WeakPolarHBondContact O-CE2 3.36Å; H167-Y183 PolarHBondContact O-OH 2.77Å; H167-L188 HydrophobicContact CB-CD1 3.64Å; H167-L188 VanDerWaalsContact CD2-CD1 3.47Å; H167-L188 WeakPolarHBondContact CD2-CD1 3.49Å; H167-V193 HydrophobicContact CB-CG1 3.79Å; H167-Y194 WeakPolarHBondContact CB-O 3.46Å; H167-Y194 PolarHBondContact N-O 3.02Å
168	N	83.6	Confident	81.7	Confident	85 Å²	85	57.9 Å²	57.9	46%	0.455	29%	0.294	S	S	.	.	T	Hydrogen-bonded Turn	trans	53.1	35	-179.8	-159.2	15.1	0	0	0	114.8	K170 A171 Y183	N168-K170 PolarHBondContact O-N 2.85Å; N168-A171 WeakPolarHBondContact O-CB 3.35Å; N168-A171 PolarHBondContact O-N 3.31Å; N168-Y183 HydrophobicContact CB-CE2 4.3Å
169	R	84.6	Confident	80.8	Confident	113 Å²	113	62.9 Å²	62.9	43%	0.426	32%	0.317	S	S	.	.	H	α-helix	trans	-54.8	-20.2	179	66.9	-175.1	178.8	-173.4	-2.8	115.2	W163 I166 H167 A171 L172	W163-R169 HydrophobicContact CH2-CB 4.09Å; W163-R169 HydrophobicContact CZ2-CB 3.92Å; W163-R169 HydrophobicContact CZ2-CG 4.42Å; I166-R169 HydrophobicContact CB-CB 4.48Å; I166-R169 HydrophobicContact CG2-CB 4.43Å; H167-R169 PolarHBondContact O-N 2.99Å; R169-A171 VanDerWaalsContact C-N 3.31Å; R169-A171 PolarHBondContact O-N 3.3Å; R169-L172 PolarHBondContact O-N 3.41Å
170	K	82.3	Confident	80.2	Confident	166 Å²	166	65.7 Å²	65.7	72%	0.722	34%	0.335	S	S	*	.	H	α-helix	trans	-64.2	-34.5	175.8	-67.1	-177.3	-178.9	177.9	0	112.1	N168 L172 L173	N168-K170 PolarHBondContact O-N 2.85Å; K170-L172 PolarHBondContact O-N 2.79Å; K170-L173 PolarHBondContact O-N 3.43Å
171	A	80.8	Confident	79.8	Confident	17 Å²	17	65.9 Å²	65.9	14%	0.14	34%	0.337	C	S	.	.	H	α-helix	trans	-67.6	-23.4	176.5	0	0	0	0	0	113	N168 R169 T174 A181	N168-A171 WeakPolarHBondContact O-CB 3.35Å; N168-A171 PolarHBondContact O-N 3.31Å; R169-A171 VanDerWaalsContact C-N 3.31Å; R169-A171 PolarHBondContact O-N 3.3Å; A171-T174 PolarHBondContact O-OG1 3.38Å; A171-A181 VanDerWaalsContact O-CB 3.23Å; A171-A181 WeakPolarHBondContact O-CB 3.5Å
172	L	81.6	Confident	79.5	Confident	3 Å²	3	69 Å²	69	2%	0.016	36%	0.362	C	S	.	.	H	α-helix	trans	-80.4	-22	176.1	-59.5	172	0	0	0	112	I49 F61 W163 I166 R169 K170 T174 A181 Y183 L196 F205	I49-L172 HydrophobicContact CD1-CD2 3.75Å; I49-L172 HydrophobicContact CG1-CD2 3.99Å; I49-L172 HydrophobicContact CG2-CD2 4.46Å; F61-L172 HydrophobicContact CZ-CB 4.25Å; F61-L172 VanDerWaalsContact CZ-O 3.3Å; F61-L172 WeakPolarHBondContact CZ-O 3.26Å; W163-L172 HydrophobicContact CH2-CB 4.03Å; W163-L172 HydrophobicContact CH2-CD1 4.34Å; W163-L172 HydrophobicContact CZ3-CB 4.38Å; W163-L172 HydrophobicContact CZ3-CD1 4.03Å; I166-L172 HydrophobicContact CG2-CD1 3.99Å; R169-L172 PolarHBondContact O-N 3.41Å; K170-L172 PolarHBondContact O-N 2.79Å; L172-T174 VanDerWaalsContact C-N 3.28Å; L172-T174 PolarHBondContact O-N 3.19Å; L172-A181 HydrophobicContact CD2-CB 4.47Å; L172-Y183 HydrophobicContact CD2-CD2 4.08Å; L172-Y183 HydrophobicContact CG-CD2 4.36Å; L172-L196 HydrophobicContact CD1-CD1 3.98Å; L172-L196 HydrophobicContact CD2-CD1 4.46Å; L172-F205 HydrophobicContact CD1-CE2 3.85Å; L172-F205 HydrophobicContact CD1-CZ 4.2Å
173	L	79.1	Confident	79.4	Confident	88 Å²	88	68.4 Å²	68.4	46%	0.461	36%	0.359	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.9	-15.7	176.7	-63.5	173.6	0	0	0	112.8	W163 K170 A175	W163-L173 HydrophobicContact CH2-CD2 4.15Å; W163-L173 HydrophobicContact CH2-CG 4.42Å; W163-L173 HydrophobicContact CZ2-CD2 3.86Å; W163-L173 HydrophobicContact CZ2-CG 4.15Å; K170-L173 PolarHBondContact O-N 3.43Å; L173-A175 VanDerWaalsContact C-N 3.34Å
174	T	69.7	Low	79.3	Confident	100 Å²	100	70.6 Å²	70.6	61%	0.613	38%	0.375	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.5	-5.5	176.7	48.7	0	0	0	0	113.4	A171 L172 K176	A171-T174 PolarHBondContact O-OG1 3.38Å; L172-T174 VanDerWaalsContact C-N 3.28Å; L172-T174 PolarHBondContact O-N 3.19Å; T174-K176 PolarHBondContact O-N 2.94Å
175	A	67.5	Low	79.2	Confident	7 Å²	7	68.8 Å²	68.8	6%	0.058	37%	0.366	C	S	.	.			trans	-64.5	130	177.4	0	0	0	0	0	111.1	F61 L173 A181	F61-A175 HydrophobicContact CE1-CB 3.86Å; F61-A175 HydrophobicContact CZ-CB 3.88Å; L173-A175 VanDerWaalsContact C-N 3.34Å; A175-A181 HydrophobicContact CB-CB 3.84Å
176	K	66.3	Low	79	Confident	129 Å²	129	70.7 Å²	70.7	56%	0.561	38%	0.375	S	S	*	.	B	Isolated β-bridge	trans	-112.4	167	168.1	-64.5	177.1	-165.9	149.1	0	108.9	T174 D178 E179	T174-K176 PolarHBondContact O-N 2.94Å; K176-D178 PolarHBondContact O-N 3.45Å; K176-D178 VanDerWaalsContact O-N 3.13Å; K176-E179 HydrophobicContact CB-CB 4.38Å; K176-E179 PolarHBondContact N-O 3.14Å; K176-E179 IonicContact NZ-OE2 2.73Å; K176-E179 PolarHBondContact NZ-OE2 2.93Å; K176-E179 VanDerWaalsContact NZ-OE2 3.15Å; K176-E179 PolarHBondContact O-N 2.83Å; K176-E179 VanDerWaalsContact O-O 3.12Å
177	V	60.8	Low	78.5	Confident	124 Å²	124	75 Å²	75	75%	0.752	40%	0.398	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.4	-29.6	-178.3	-179	0	0	0	0	112.4
178	D	64.3	Low	78.2	Confident	156 Å²	156	75 Å²	75	83%	0.834	40%	0.399	S	S	*	.	T	Hydrogen-bonded Turn	trans	-111.5	-3.3	-178.6	-60.3	-43.5	0	0	0	114.7	K176	K176-D178 PolarHBondContact O-N 3.45Å; K176-D178 VanDerWaalsContact O-N 3.13Å
179	E	75.3	Confident	77.5	Confident	109 Å²	109	76.1 Å²	76.1	51%	0.509	41%	0.412	S	S	.	.	B	Isolated β-bridge	trans	-125.5	109.7	-179.6	-71.8	-179.7	150	0	0	110.1	K176	K176-E179 HydrophobicContact CB-CB 4.38Å; K176-E179 PolarHBondContact N-O 3.14Å; K176-E179 IonicContact NZ-OE2 2.73Å; K176-E179 PolarHBondContact NZ-OE2 2.93Å; K176-E179 VanDerWaalsContact NZ-OE2 3.15Å; K176-E179 PolarHBondContact O-N 2.83Å; K176-E179 VanDerWaalsContact O-O 3.12Å
180	P	80.2	Confident	76.6	Confident	59 Å²	59	77 Å²	77	38%	0.383	42%	0.42	S	S	.	.	P	Polyproline II helix	trans	-69.9	141.8	-179.2	29.1	-34	0	0	0	111.2	D48 D50 A182	D48-P180 HydrophobicContact CB-CB 3.97Å; D48-P180 CarbonylContact O-C 3.36Å; D48-P180 WeakPolarHBondContact O-CA 3.34Å; D50-P180 HydrophobicContact CB-CB 4.13Å; D50-P180 HydrophobicContact CB-CG 4.34Å; P180-A182 PolarHBondContact O-N 3.05Å
181	A	84.4	Confident	75.9	Confident	4 Å²	4	71 Å²	71	3%	0.033	41%	0.405	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.9	118.9	174.5	0	0	0	0	0	110.8	D48 I49 D50 A171 L172 A175 Y183	D48-A181 PolarHBondContact O-N 3.5Å; I49-A181 WeakPolarHBondContact CA-O 3.46Å; D50-A181 PolarHBondContact N-O 2.96Å; A171-A181 VanDerWaalsContact O-CB 3.23Å; A171-A181 WeakPolarHBondContact O-CB 3.5Å; L172-A181 HydrophobicContact CD2-CB 4.47Å; A175-A181 HydrophobicContact CB-CB 3.84Å; A181-Y183 PolarHBondContact O-N 3.34Å
182	A	84.6	Confident	75.4	Confident	65 Å²	65	74.1 Å²	74.1	54%	0.537	43%	0.431	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.5	116	171.7	0	0	0	0	0	110.3	D50 V52 P180	D50-A182 WeakPolarHBondContact O-CA 3.04Å; V52-A182 HydrophobicContact CG2-CB 3.81Å; P180-A182 PolarHBondContact O-N 3.05Å
183	Y	87.8	Confident	75.5	Confident	1 Å²	1	76.6 Å²	76.6	0%	0.004	45%	0.447	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124	125.9	179.6	-170.6	-87.5	0	0	0	110.7	I49 D50 F51 V52 H167 N168 L172 A181 P185 S195 L196	I49-Y183 HydrophobicContact CG2-CG 4.4Å; D50-Y183 PolarHBondContact O-N 3.29Å; F51-Y183 CarbonylContact C-O 3.28Å; F51-Y183 VanDerWaalsContact CA-O 3.29Å; F51-Y183 WeakPolarHBondContact CA-O 3Å; F51-Y183 AromaticContact CD1-CD1 3.81Å; F51-Y183 HydrophobicContact CD1-CD1 3.81Å; F51-Y183 AromaticContact CE1-CD1 3.64Å; F51-Y183 HydrophobicContact CE1-CD1 3.64Å; F51-Y183 HydrophobicContact CE1-CE1 4.26Å; F51-Y183 HydrophobicContact CE1-CG 4.38Å; V52-Y183 PolarHBondContact N-O 3.43Å; H167-Y183 WeakPolarHBondContact O-CE2 3.36Å; H167-Y183 PolarHBondContact O-OH 2.77Å; N168-Y183 HydrophobicContact CB-CE2 4.3Å; L172-Y183 HydrophobicContact CD2-CD2 4.08Å; L172-Y183 HydrophobicContact CG-CD2 4.36Å; A181-Y183 PolarHBondContact O-N 3.34Å; Y183-P185 WeakPolarHBondContact O-CD 3.32Å; Y183-S195 PolarHBondContact OH-OG 3.13Å; Y183-L196 HydrophobicContact CD1-CB 4.49Å; Y183-L196 HydrophobicContact CD2-CD1 4.48Å; Y183-L196 HydrophobicContact CE1-CB 3.85Å; Y183-L196 HydrophobicContact CE1-CD1 4.34Å; Y183-L196 HydrophobicContact CE1-CG 4.27Å; Y183-L196 HydrophobicContact CE2-CD1 4.17Å; Y183-L196 PolarHBondContact OH-N 3.31Å
184	T	85.7	Confident	75.9	Confident	68 Å²	68	73.4 Å²	73.4	42%	0.417	43%	0.428	S	S	.	.			trans	-100.2	112.6	178.3	-54.5	0	0	0	0	110
185	P	83.8	Confident	76.8	Confident	32 Å²	32	68.8 Å²	68.8	21%	0.208	40%	0.4	C	S	.	.			trans	-72.2	134.4	177.5	28.7	-31.3	0	0	0	110.7	F51 Y183 S195	F51-P185 HydrophobicContact CD1-CG 4.38Å; Y183-P185 WeakPolarHBondContact O-CD 3.32Å; P185-S195 WeakPolarHBondContact CA-OG 3.43Å
186	Q	82.1	Confident	77.9	Confident	98 Å²	98	68.4 Å²	68.4	46%	0.458	40%	0.397	S	S	.	.			trans	-132.9	144.4	-179.1	-64.9	-179.7	16.5	0	0	110.8	L188 S195	Q186-L188 PolarHBondContact O-N 3.45Å; Q186-S195 PolarHBondContact N-OG 3.49Å; Q186-S195 WeakPolarHBondContact O-CB 3.48Å
187	D	78.8	Confident	78.9	Confident	95 Å²	95	62.3 Å²	62.3	51%	0.508	37%	0.371	S	S	.	.			trans	-84.2	97.5	172.3	-76.1	-52.6	0	0	0	108.7	R130 K135	R130-D187 IonicContact CZ-OD1 3.66Å; R130-D187 IonicContact CZ-OD2 3.77Å; R130-D187 IonicContact NE-OD1 3.96Å; R130-D187 PolarHBondContact NE-OD1 3.49Å; R130-D187 IonicContact NE-OD2 3.17Å; R130-D187 IonicContact NH2-OD1 3.36Å; R130-D187 PolarHBondContact NH2-OD1 3.34Å; R130-D187 IonicContact NH2-OD2 3.86Å; R130-D187 PolarHBondContact NH2-OD2 2.93Å; K135-D187 WeakPolarHBondContact CE-OD1 3.45Å; K135-D187 IonicContact NZ-OD1 2.84Å; K135-D187 PolarHBondContact NZ-OD1 3.41Å; K135-D187 IonicContact NZ-OD2 3.11Å
188	L	78.7	Confident	80.2	Confident	55 Å²	55	56.6 Å²	56.6	29%	0.288	34%	0.336	S	S	.	.	P	Polyproline II helix	trans	-88.5	147.6	-178.9	-68.1	158.5	0	0	0	111	H167 Q186	H167-L188 HydrophobicContact CB-CD1 3.64Å; H167-L188 VanDerWaalsContact CD2-CD1 3.47Å; H167-L188 WeakPolarHBondContact CD2-CD1 3.49Å; Q186-L188 PolarHBondContact O-N 3.45Å
189	P	69.3	Low	81.4	Confident	110 Å²	110	50.3 Å²	50.3	71%	0.714	30%	0.302	S	S	*	.	P	Polyproline II helix	trans	-65.1	154.4	170.8	27.8	-33.2	0	0	0	111.3	G191	P189-G191 PolarHBondContact O-N 2.99Å
190	H	65.4	Low	82.1	Confident	131 Å²	131	45.2 Å²	45.2	61%	0.606	28%	0.278	S	S	*	.	S	Bend	trans	-50.9	126	178.2	-88.2	68.5	0	0	0	111.3	D96	D96-H190 PolarHBondContact O-NE2 3.08Å
191	G	67.3	Low	82.4	Confident	40 Å²	40	44 Å²	44	41%	0.412	27%	0.271	S	S	.	.	S	Bend	trans	-174.3	-170.8	-173.6	0	0	0	0	0	112.8	P189 V193 Y194	P189-G191 PolarHBondContact O-N 2.99Å; G191-V193 PolarHBondContact O-N 2.86Å; G191-Y194 PolarHBondContact O-OH 3.25Å
192	A	71.3	Confident	82.8	Confident	83 Å²	83	44.8 Å²	44.8	69%	0.686	27%	0.274	S	S	*	.	S	Bend	trans	-71.7	-12.1	-176.1	0	0	0	0	0	114.6
193	V	82.6	Confident	83.2	Confident	55 Å²	55	41.7 Å²	41.7	33%	0.333	25%	0.248	S	C	.	.			trans	-139.1	138	-170.9	-173.2	0	0	0	0	110.3	M165 H167 G191	M165-V193 CarbonylContact O-C 3.58Å; M165-V193 WeakPolarHBondContact O-CA 3.47Å; M165-V193 WeakPolarHBondContact O-CG1 3.34Å; H167-V193 HydrophobicContact CB-CG1 3.79Å; G191-V193 PolarHBondContact O-N 2.86Å
194	Y	87.3	Confident	83.5	Confident	20 Å²	20	41.7 Å²	41.7	8%	0.078	25%	0.249	C	C	.	.	B	Isolated β-bridge	trans	-127.2	154.8	-176.7	-60.7	-76.1	0	0	0	112.1	F131 M165 H167 G191	F131-Y194 HydrophobicContact CB-CD1 3.74Å; F131-Y194 HydrophobicContact CB-CE1 3.92Å; F131-Y194 HydrophobicContact CB-CG 4.37Å; F131-Y194 AromaticContact CD1-CD1 3.71Å; F131-Y194 HydrophobicContact CD1-CD1 3.71Å; F131-Y194 AromaticContact CD1-CD2 3.66Å; F131-Y194 HydrophobicContact CD1-CD2 3.66Å; F131-Y194 HydrophobicContact CD1-CE1 4.12Å; F131-Y194 HydrophobicContact CD1-CE2 4.09Å; F131-Y194 AromaticContact CD1-CG 3.45Å; F131-Y194 HydrophobicContact CD1-CG 3.45Å; F131-Y194 VanDerWaalsContact CD1-CG 3.45Å; F131-Y194 AromaticContact CE1-CD2 3.7Å; F131-Y194 HydrophobicContact CE1-CD2 3.7Å; F131-Y194 HydrophobicContact CE1-CE2 4.02Å; F131-Y194 AromaticContact CE1-CG 3.98Å; F131-Y194 HydrophobicContact CE1-CG 3.98Å; F131-Y194 AromaticContact CG-CD1 3.92Å; F131-Y194 HydrophobicContact CG-CD1 3.92Å; F131-Y194 HydrophobicContact CG-CD2 4.46Å; F131-Y194 HydrophobicContact CG-CE1 4.02Å; F131-Y194 HydrophobicContact CG-CG 4.15Å; F131-Y194 HydrophobicContact CZ-CE2 4.47Å; M165-Y194 HydrophobicContact CE-CD2 4.47Å; M165-Y194 HydrophobicContact CE-CE2 4.07Å; M165-Y194 PolarHBondContact O-N 3.5Å; H167-Y194 WeakPolarHBondContact CB-O 3.46Å; H167-Y194 PolarHBondContact N-O 3.02Å; G191-Y194 PolarHBondContact O-OH 3.25Å
195	S	89.3	Confident	83.8	Confident	3 Å²	3	38.5 Å²	38.5	2%	0.021	23%	0.229	C	C	.	.	P	Polyproline II helix	trans	-79.3	153.8	174.4	-163.6	0	0	0	0	111.4	R130 Y183 P185 Q186	R130-S195 WeakPolarHBondContact CB-O 3.44Å; R130-S195 PolarHBondContact N-O 3.49Å; Y183-S195 PolarHBondContact OH-OG 3.13Å; P185-S195 WeakPolarHBondContact CA-OG 3.43Å; Q186-S195 PolarHBondContact N-OG 3.49Å; Q186-S195 WeakPolarHBondContact O-CB 3.48Å
196	L	90	Very high	84.1	Confident	0 Å²	0	37 Å²	37	0%	0	22%	0.219	C	C	.	.	B	Isolated β-bridge	trans	-71.7	144.7	172.4	-64.8	172.5	0	0	0	111	I49 F51 L129 I166 L172 Y183 F203 F205	I49-L196 HydrophobicContact CD1-CD1 4.05Å; F51-L196 HydrophobicContact CE1-CB 4.05Å; F51-L196 HydrophobicContact CZ-CB 4.3Å; L129-L196 HydrophobicContact CD2-CD2 4.06Å; I166-L196 HydrophobicContact CD1-CD2 4.33Å; I166-L196 HydrophobicContact CG1-CD2 4.22Å; I166-L196 HydrophobicContact CG2-CD1 4.26Å; I166-L196 HydrophobicContact CG2-CD2 4.18Å; I166-L196 HydrophobicContact CG2-CG 4.02Å; L172-L196 HydrophobicContact CD1-CD1 3.98Å; L172-L196 HydrophobicContact CD2-CD1 4.46Å; Y183-L196 HydrophobicContact CD1-CB 4.49Å; Y183-L196 HydrophobicContact CD2-CD1 4.48Å; Y183-L196 HydrophobicContact CE1-CB 3.85Å; Y183-L196 HydrophobicContact CE1-CD1 4.34Å; Y183-L196 HydrophobicContact CE1-CG 4.27Å; Y183-L196 HydrophobicContact CE2-CD1 4.17Å; Y183-L196 PolarHBondContact OH-N 3.31Å; L196-F203 HydrophobicContact CB-CE1 4.47Å; L196-F203 HydrophobicContact CD2-CD1 4.21Å; L196-F203 HydrophobicContact CD2-CE1 4.18Å; L196-F205 HydrophobicContact CD1-CE1 4.43Å; L196-F205 HydrophobicContact CD1-CZ 3.79Å; L196-F205 HydrophobicContact CD2-CE1 3.66Å; L196-F205 HydrophobicContact CD2-CZ 3.88Å
197	D	89.1	Confident	84.3	Confident	0 Å²	0	34.9 Å²	34.9	0%	0	21%	0.209	C	C	.	.	P	Polyproline II helix	trans	-82.3	122.7	175.9	-173.7	-85.4	0	0	0	111.5	G128 R130 H199 H200 F203	G128-D197 PolarHBondContact O-N 2.85Å; G128-D197 VanDerWaalsContact O-N 3.1Å; R130-D197 HydrophobicContact CB-CB 4.22Å; D197-H199 PolarHBondContact O-N 3.43Å; D197-H199 VanDerWaalsContact O-N 3.07Å; D197-H199 WeakPolarHBondContact OD1-CB 3.32Å; D197-H199 IonicContact OD1-CD2 3.1Å; D197-H199 IonicContact OD1-CG 3.02Å; D197-H199 PolarHBondContact OD1-N 3.46Å; D197-H200 PolarHBondContact O-N 3.46Å; D197-H200 IonicContact OD1-CE1 3.12Å; D197-H200 IonicContact OD1-ND1 3.25Å; D197-H200 PolarHBondContact OD1-ND1 2.68Å; D197-H200 VanDerWaalsContact OD1-ND1 3.13Å; D197-F203 WeakPolarHBondContact O-CZ 3.5Å
198	S	87.8	Confident	84.3	Confident	4 Å²	4	33.2 Å²	33.2	3%	0.028	20%	0.198	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.8	-2.5	-174.4	43.4	0	0	0	0	115.6	T57	T57-S198 WeakPolarHBondContact CB-O 3.5Å; T57-S198 PolarHBondContact OG1-O 3.02Å
199	H	88.4	Confident	84	Confident	24 Å²	24	33.8 Å²	33.8	11%	0.111	20%	0.202	C	C	.	.	T	Hydrogen-bonded Turn	trans	-113	5.1	-176	-51.5	-58.1	0	0	0	113.6	G138 R142 D197	G138-H199 WeakPolarHBondContact O-CB 3.42Å; R142-H199 WeakPolarHBondContact CD-CE1 3.43Å; R142-H199 WeakPolarHBondContact CD-NE2 3.38Å; R142-H199 HydrophobicContact CG-CB 4.11Å; R142-H199 VanDerWaalsContact CG-CD2 3.48Å; R142-H199 WeakPolarHBondContact CG-CD2 3.32Å; R142-H199 WeakPolarHBondContact CG-CE1 3.36Å; R142-H199 WeakPolarHBondContact CG-ND1 3.38Å; R142-H199 PolarHBondContact NH1-CD2 3.18Å; R142-H199 PolarHBondContact NH1-NE2 2.94Å; D197-H199 PolarHBondContact O-N 3.43Å; D197-H199 VanDerWaalsContact O-N 3.07Å; D197-H199 WeakPolarHBondContact OD1-CB 3.32Å; D197-H199 IonicContact OD1-CD2 3.1Å; D197-H199 IonicContact OD1-CG 3.02Å; D197-H199 PolarHBondContact OD1-N 3.46Å
200	H	90.1	Very high	84	Confident	3 Å²	3	34.4 Å²	34.4	1%	0.014	21%	0.206	C	C	.	.			trans	-83	138.4	164.1	-69.9	65.2	0	0	0	109.4	T126 D197 F203	T126-H200 PolarHBondContact OG1-CD2 3.42Å; T126-H200 PolarHBondContact OG1-NE2 3.32Å; D197-H200 PolarHBondContact O-N 3.46Å; D197-H200 IonicContact OD1-CE1 3.12Å; D197-H200 IonicContact OD1-ND1 3.25Å; D197-H200 PolarHBondContact OD1-ND1 2.68Å; D197-H200 VanDerWaalsContact OD1-ND1 3.13Å; H200-F203 HydrophobicContact CB-CE1 3.75Å; H200-F203 HydrophobicContact CB-CE2 4.24Å; H200-F203 HydrophobicContact CB-CZ 3.54Å
201	S	87.6	Confident	83.9	Confident	34 Å²	34	35.2 Å²	35.2	24%	0.238	22%	0.215	C	C	.	.	S	Bend	trans	-83.1	-33.8	-176.8	58.4	0	0	0	0	112.4	G59 K60 A157	G59-S201 WeakPolarHBondContact CA-O 3.46Å; K60-S201 PolarHBondContact N-O 3.27Å; K60-S201 VanDerWaalsContact N-O 3.12Å; A157-S201 PolarHBondContact O-N 3.14Å; A157-S201 PolarHBondContact O-OG 3.12Å
202	H	92.4	Very high	83.8	Confident	20 Å²	20	40.1 Å²	40.1	9%	0.093	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.5	144.9	-171.9	-61.9	86.7	0	0	0	110.8	K60 W81 L83 A157 I158 G159	K60-H202 CarbonylContact O-C 3.56Å; K60-H202 WeakPolarHBondContact O-CA 3.37Å; W81-H202 AromaticContact CD2-CD2 3.88Å; W81-H202 HydrophobicContact CE3-CB 4.22Å; W81-H202 AromaticContact CE3-CD2 3.19Å; W81-H202 AromaticContact CE3-CG 3.97Å; W81-H202 HydrophobicContact CZ3-CB 3.83Å; W81-H202 AromaticContact CZ3-CD2 3.64Å; L83-H202 VanDerWaalsContact CD2-CE1 3.49Å; L83-H202 WeakPolarHBondContact CD2-CE1 3.38Å; A157-H202 PolarHBondContact O-N 3.28Å; I158-H202 CarbonylContact C-O 3.56Å; I158-H202 WeakPolarHBondContact CA-O 3.3Å; I158-H202 HydrophobicContact CG1-CB 4.29Å; I158-H202 HydrophobicContact CG2-CB 4.37Å; G159-H202 PolarHBondContact N-O 3.45Å
203	F	92.9	Very high	83.6	Confident	0 Å²	0	41.6 Å²	41.6	0%	0	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131	135.9	-178.6	-61.8	-86.8	0	0	0	112.6	I49 F51 K60 F61 V62 G159 L196 D197 H200 F205	I49-F203 HydrophobicContact CD1-CD2 4.1Å; I49-F203 HydrophobicContact CD1-CE2 4.4Å; F51-F203 HydrophobicContact CE2-CE2 4.06Å; F51-F203 HydrophobicContact CE2-CZ 4.37Å; F51-F203 AromaticContact CZ-CE2 3.86Å; F51-F203 HydrophobicContact CZ-CE2 3.86Å; F51-F203 AromaticContact CZ-CZ 3.88Å; F51-F203 HydrophobicContact CZ-CZ 3.88Å; K60-F203 PolarHBondContact O-N 2.97Å; F61-F203 CarbonylContact C-O 3.58Å; F61-F203 VanDerWaalsContact CA-O 3.27Å; F61-F203 WeakPolarHBondContact CA-O 3.47Å; F61-F203 HydrophobicContact CB-CB 3.88Å; V62-F203 PolarHBondContact N-O 3.2Å; G159-F203 CarbonylContact O-C 3.6Å; G159-F203 VanDerWaalsContact O-CA 3.32Å; G159-F203 WeakPolarHBondContact O-CA 3.49Å; L196-F203 HydrophobicContact CB-CE1 4.47Å; L196-F203 HydrophobicContact CD2-CD1 4.21Å; L196-F203 HydrophobicContact CD2-CE1 4.18Å; D197-F203 WeakPolarHBondContact O-CZ 3.5Å; H200-F203 HydrophobicContact CB-CE1 3.75Å; H200-F203 HydrophobicContact CB-CE2 4.24Å; H200-F203 HydrophobicContact CB-CZ 3.54Å; F203-F205 HydrophobicContact CB-CD1 4.33Å; F203-F205 HydrophobicContact CB-CE1 3.62Å; F203-F205 HydrophobicContact CB-CE2 4.38Å; F203-F205 HydrophobicContact CB-CZ 3.65Å; F203-F205 HydrophobicContact CD1-CE1 4.09Å; F203-F205 HydrophobicContact CD1-CZ 4.38Å; F203-F205 HydrophobicContact CG-CE1 4.11Å; F203-F205 HydrophobicContact CG-CZ 4.07Å
204	V	93	Very high	83.2	Confident	1 Å²	1	40.7 Å²	40.7	1%	0.006	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	110.4	171.7	-177.3	0	0	0	0	108	V62 V64 I73 I158 G159 I160 A161	V62-V204 HydrophobicContact CG1-CB 4.19Å; V62-V204 HydrophobicContact CG1-CG1 4.03Å; V62-V204 HydrophobicContact CG1-CG2 3.96Å; V64-V204 HydrophobicContact CG1-CG1 4.43Å; V64-V204 HydrophobicContact CG2-CG1 3.81Å; I73-V204 HydrophobicContact CD1-CG1 4.5Å; I73-V204 HydrophobicContact CG2-CG1 4.47Å; I73-V204 HydrophobicContact CG2-CG2 4.25Å; I158-V204 HydrophobicContact CG2-CG2 4.5Å; G159-V204 PolarHBondContact O-N 3.41Å; I160-V204 WeakPolarHBondContact CA-O 3.35Å; I160-V204 HydrophobicContact CG1-CB 4.25Å; A161-V204 PolarHBondContact N-O 3.21Å
205	F	92	Very high	82.9	Confident	0 Å²	0	40.1 Å²	40.1	0%	0	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	118.8	179.9	-57.3	-37.9	0	0	0	110.9	I49 F61 V62 R63 V64 A161 W163 I166 L172 L196 F203	I49-F205 HydrophobicContact CD1-CZ 4.47Å; F61-F205 HydrophobicContact CB-CD2 4.13Å; F61-F205 HydrophobicContact CB-CE2 3.52Å; F61-F205 HydrophobicContact CB-CZ 4.04Å; F61-F205 AromaticContact CD2-CD2 3.63Å; F61-F205 HydrophobicContact CD2-CD2 3.63Å; F61-F205 AromaticContact CD2-CE2 3.49Å; F61-F205 HydrophobicContact CD2-CE2 3.49Å; F61-F205 VanDerWaalsContact CD2-CE2 3.49Å; F61-F205 HydrophobicContact CE2-CD2 4.48Å; F61-F205 HydrophobicContact CE2-CE2 4.39Å; F61-F205 HydrophobicContact CG-CD2 4.21Å; F61-F205 AromaticContact CG-CE2 3.65Å; F61-F205 HydrophobicContact CG-CE2 3.65Å; V62-F205 PolarHBondContact O-N 2.92Å; R63-F205 CarbonylContact C-O 3.51Å; R63-F205 WeakPolarHBondContact CA-O 3.31Å; V64-F205 WeakPolarHBondContact CG2-O 3.31Å; V64-F205 PolarHBondContact N-O 3.18Å; A161-F205 HydrophobicContact CB-CD1 4.11Å; A161-F205 HydrophobicContact CB-CE1 4.37Å; A161-F205 WeakPolarHBondContact O-CA 3.47Å; W163-F205 HydrophobicContact CE3-CB 3.81Å; W163-F205 AromaticContact CE3-CD2 3.82Å; W163-F205 HydrophobicContact CE3-CD2 3.82Å; W163-F205 AromaticContact CE3-CG 3.94Å; W163-F205 HydrophobicContact CE3-CG 3.94Å; W163-F205 HydrophobicContact CZ3-CB 4.45Å; W163-F205 AromaticContact CZ3-CD2 3.63Å; W163-F205 HydrophobicContact CZ3-CD2 3.63Å; W163-F205 HydrophobicContact CZ3-CE2 4.18Å; W163-F205 HydrophobicContact CZ3-CG 4.23Å; I166-F205 HydrophobicContact CD1-CB 4.41Å; I166-F205 HydrophobicContact CD1-CD1 3.32Å; I166-F205 HydrophobicContact CD1-CD2 4.19Å; I166-F205 HydrophobicContact CD1-CE1 3.45Å; I166-F205 VanDerWaalsContact CD1-CE1 3.45Å; I166-F205 HydrophobicContact CD1-CE2 4.3Å; I166-F205 HydrophobicContact CD1-CG 3.72Å; I166-F205 HydrophobicContact CD1-CZ 3.96Å; L172-F205 HydrophobicContact CD1-CE2 3.85Å; L172-F205 HydrophobicContact CD1-CZ 4.2Å; L196-F205 HydrophobicContact CD1-CE1 4.43Å; L196-F205 HydrophobicContact CD1-CZ 3.79Å; L196-F205 HydrophobicContact CD2-CE1 3.66Å; L196-F205 HydrophobicContact CD2-CZ 3.88Å; F203-F205 HydrophobicContact CB-CD1 4.33Å; F203-F205 HydrophobicContact CB-CE1 3.62Å; F203-F205 HydrophobicContact CB-CE2 4.38Å; F203-F205 HydrophobicContact CB-CZ 3.65Å; F203-F205 HydrophobicContact CD1-CE1 4.09Å; F203-F205 HydrophobicContact CD1-CZ 4.38Å; F203-F205 HydrophobicContact CG-CE1 4.11Å; F203-F205 HydrophobicContact CG-CZ 4.07Å
206	V	90.1	Very high	82.8	Confident	0 Å²	0	40.5 Å²	40.5	0%	0	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	127.5	-178.9	-172.7	0	0	0	0	109.7	V64 I160 A161 W163 E208 T216 M219	V64-V206 HydrophobicContact CG2-CB 4.49Å; V64-V206 HydrophobicContact CG2-CG2 3.99Å; I160-V206 HydrophobicContact CG2-CG2 4.05Å; A161-V206 PolarHBondContact O-N 3.46Å; W163-V206 WeakPolarHBondContact CB-O 3.41Å; W163-V206 PolarHBondContact N-O 3.38Å; V206-E208 PolarHBondContact O-N 2.87Å; V206-T216 HydrophobicContact CB-CG2 4.2Å; V206-T216 HydrophobicContact CG2-CG2 4.14Å; V206-M219 HydrophobicContact CG1-CB 4.47Å; V206-M219 HydrophobicContact CG2-CB 4.37Å; V206-M219 HydrophobicContact CG2-CG 4.13Å
207	E	87.1	Confident	82.5	Confident	55 Å²	55	41.9 Å²	41.9	26%	0.257	24%	0.236	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.8	117.9	169.9	-65.6	179.5	163.3	0	0	110	R63 V64	R63-E207 HydrophobicContact CG-CG 4.35Å; R63-E207 IonicContact CZ-OE1 2.73Å; R63-E207 IonicContact NE-OE1 3.68Å; R63-E207 PolarHBondContact NE-OE1 3.05Å; R63-E207 IonicContact NH2-OE1 3.43Å; R63-E207 PolarHBondContact NH2-OE1 3.37Å; V64-E207 PolarHBondContact O-N 3.33Å
208	E	78.6	Confident	82.4	Confident	59 Å²	59	44.2 Å²	44.2	28%	0.276	25%	0.247	S	C	.	.	P	Polyproline II helix	trans	-81.9	136.3	173.5	-64.7	-154.7	144.1	0	0	111.1	P162 N164 V206 T216	P162-E208 HydrophobicContact CB-CG 3.81Å; N164-E208 PolarHBondContact ND2-OE2 2.86Å; V206-E208 PolarHBondContact O-N 2.87Å; E208-T216 PolarHBondContact OE1-OG1 2.91Å
209	D	73.3	Confident	82.4	Confident	67 Å²	67	44.2 Å²	44.2	36%	0.358	25%	0.247	S	C	.	.	B	Isolated β-bridge	trans	-80.5	121.6	169.7	-172.8	-15.1	0	0	0	108.6	N211 R212	D209-N211 PolarHBondContact O-N 3.38Å; D209-N211 VanDerWaalsContact O-N 3.1Å; D209-N211 PolarHBondContact OD1-N 3.25Å; D209-R212 HydrophobicContact CB-CB 4.23Å; D209-R212 CarbonylContact O-C 3.49Å; D209-R212 PolarHBondContact O-N 2.87Å
210	P	68.3	Low	82.4	Confident	123 Å²	123	44 Å²	44	80%	0.799	25%	0.245	S	C	*	.	T	Hydrogen-bonded Turn	trans	-54.6	-28	176.2	-23.3	32.3	0	0	0	113.3
211	N	63.2	Low	82.4	Confident	149 Å²	149	44.9 Å²	44.9	80%	0.797	25%	0.25	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87	-12.6	-179	-66.3	-22.2	0	0	0	113.3	D209	D209-N211 PolarHBondContact O-N 3.38Å; D209-N211 VanDerWaalsContact O-N 3.1Å; D209-N211 PolarHBondContact OD1-N 3.25Å
212	R	65.6	Low	82.5	Confident	142 Å²	142	47.5 Å²	47.5	54%	0.536	26%	0.258	S	S	.	.	B	Isolated β-bridge	trans	-137.6	79.5	-176.4	-165.6	175	168.7	177	-7.5	111.4	D209 G214 E218	D209-R212 HydrophobicContact CB-CB 4.23Å; D209-R212 CarbonylContact O-C 3.49Å; D209-R212 PolarHBondContact O-N 2.87Å; R212-G214 PolarHBondContact O-N 3.47Å; R212-E218 IonicContact CZ-OE2 3.78Å; R212-E218 IonicContact NE-OE2 3.99Å; R212-E218 IonicContact NH2-OE1 3.87Å; R212-E218 IonicContact NH2-OE2 3.63Å; R212-E218 PolarHBondContact NH2-OE2 3.34Å
213	P	66.2	Low	82.5	Confident	115 Å²	115	46.7 Å²	46.7	75%	0.747	25%	0.254	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.5	137.5	177.9	24.2	-32.7	0	0	0	111.5
214	G	74.9	Confident	82.5	Confident	35 Å²	35	47.3 Å²	47.3	36%	0.361	26%	0.257	S	S	.	.	T	Hydrogen-bonded Turn	trans	100.7	9.8	178.4	0	0	0	0	0	116.1	R212 T216 S217 E218	R212-G214 PolarHBondContact O-N 3.47Å; G214-T216 PolarHBondContact O-N 2.82Å; G214-S217 PolarHBondContact O-N 2.84Å; G214-E218 PolarHBondContact O-N 2.95Å; G214-E218 VanDerWaalsContact O-N 3.13Å
215	A	81.7	Confident	82.3	Confident	9 Å²	9	52 Å²	52	7%	0.074	28%	0.277	C	S	.	.	H	α-helix	trans	-53	-39.9	175.1	0	0	0	0	0	113	S217 E218 M219	A215-S217 VanDerWaalsContact C-N 3.34Å; A215-S217 PolarHBondContact O-N 2.96Å; A215-E218 PolarHBondContact O-N 3.13Å; A215-M219 PolarHBondContact O-N 3.26Å
216	T	85.8	Confident	82.3	Confident	11 Å²	11	53.5 Å²	53.5	7%	0.067	29%	0.285	C	S	.	.	H	α-helix	trans	-61.1	-40.6	176.8	-49.3	0	0	0	0	112.5	I160 P162 V206 E208 G214 R220	I160-T216 HydrophobicContact CG2-CG2 4.23Å; P162-T216 HydrophobicContact CB-CG2 4.36Å; P162-T216 WeakPolarHBondContact CB-OG1 3.43Å; V206-T216 HydrophobicContact CB-CG2 4.2Å; V206-T216 HydrophobicContact CG2-CG2 4.14Å; E208-T216 PolarHBondContact OE1-OG1 2.91Å; G214-T216 PolarHBondContact O-N 2.82Å; T216-R220 PolarHBondContact O-N 3.33Å
217	S	84.3	Confident	82.4	Confident	29 Å²	29	53.6 Å²	53.6	20%	0.203	29%	0.285	C	S	.	.	H	α-helix	trans	-70.8	-32.9	177.3	-171.1	0	0	0	0	112	G214 A215 V221 R258	G214-S217 PolarHBondContact O-N 2.84Å; A215-S217 VanDerWaalsContact C-N 3.34Å; A215-S217 PolarHBondContact O-N 2.96Å; S217-V221 WeakPolarHBondContact O-CG2 3.27Å; S217-V221 PolarHBondContact O-N 3.35Å; S217-R258 PolarHBondContact OG-NE 2.87Å
218	E	86.8	Confident	82.5	Confident	48 Å²	48	52.4 Å²	52.4	22%	0.224	28%	0.283	C	S	.	.	H	α-helix	trans	-69.9	-44.7	175.4	-168.6	179.2	149.2	0	0	111.1	R212 G214 A215 R220 V221 K222	R212-E218 IonicContact CZ-OE2 3.78Å; R212-E218 IonicContact NE-OE2 3.99Å; R212-E218 IonicContact NH2-OE1 3.87Å; R212-E218 IonicContact NH2-OE2 3.63Å; R212-E218 PolarHBondContact NH2-OE2 3.34Å; G214-E218 PolarHBondContact O-N 2.95Å; G214-E218 VanDerWaalsContact O-N 3.13Å; A215-E218 PolarHBondContact O-N 3.13Å; E218-R220 VanDerWaalsContact C-N 3.34Å; E218-R220 PolarHBondContact O-N 3.08Å; E218-V221 PolarHBondContact O-N 2.92Å; E218-K222 WeakPolarHBondContact O-CG 3.23Å; E218-K222 PolarHBondContact O-N 3.09Å; E218-K222 VanDerWaalsContact OE1-CE 3.26Å; E218-K222 WeakPolarHBondContact OE1-CE 3.2Å; E218-K222 IonicContact OE1-NZ 2.83Å; E218-K222 PolarHBondContact OE1-NZ 3.49Å
219	M	87.8	Confident	82.9	Confident	4 Å²	4	54.6 Å²	54.6	2%	0.02	30%	0.296	C	S	.	.	H	α-helix	trans	-58.1	-44.5	174.6	-178.6	62	72.8	0	0	111.5	S65 S66 T68 I73 V206 A215 V221 K222 L223	S65-M219 WeakPolarHBondContact O-CE 3.43Å; S66-M219 WeakPolarHBondContact O-CE 3.29Å; T68-M219 VanDerWaalsContact O-CE 3.32Å; T68-M219 WeakPolarHBondContact O-CE 3.36Å; I73-M219 HydrophobicContact CD1-CG 4.49Å; I73-M219 HydrophobicContact CD1-SD 3.81Å; V206-M219 HydrophobicContact CG1-CB 4.47Å; V206-M219 HydrophobicContact CG2-CB 4.37Å; V206-M219 HydrophobicContact CG2-CG 4.13Å; A215-M219 PolarHBondContact O-N 3.26Å; M219-V221 PolarHBondContact O-N 3.43Å; M219-K222 PolarHBondContact O-N 2.84Å; M219-L223 WeakPolarHBondContact O-CB 3.34Å; M219-L223 PolarHBondContact O-N 2.97Å
220	R	89.6	Confident	83.6	Confident	19 Å²	19	54 Å²	54	7%	0.072	29%	0.291	C	S	.	.	H	α-helix	trans	-59.1	-45.8	177.3	-172.1	179	-67.3	172	1.3	112.1	T126 I160 T216 E218 L223 L224	T126-R220 PolarHBondContact O-NH2 3.1Å; T126-R220 VanDerWaalsContact O-NH2 3.13Å; I160-R220 HydrophobicContact CD1-CG 4.31Å; I160-R220 PolarHBondContact O-NH2 2.76Å; T216-R220 PolarHBondContact O-N 3.33Å; E218-R220 VanDerWaalsContact C-N 3.34Å; E218-R220 PolarHBondContact O-N 3.08Å; R220-L223 PolarHBondContact O-N 2.88Å; R220-L224 HydrophobicContact CG-CD1 4.16Å; R220-L224 HydrophobicContact CG-CG 4.48Å; R220-L224 WeakPolarHBondContact O-CB 3.39Å; R220-L224 VanDerWaalsContact O-CG 3.27Å; R220-L224 WeakPolarHBondContact O-CG 3.48Å; R220-L224 PolarHBondContact O-N 2.88Å
221	V	89.7	Confident	84.4	Confident	22 Å²	22	55 Å²	55	13%	0.133	28%	0.279	C	S	.	.	H	α-helix	trans	-65	-41.3	178.3	173.8	0	0	0	0	111.4	S217 E218 M219 K225 R258 K261 N265	S217-V221 WeakPolarHBondContact O-CG2 3.27Å; S217-V221 PolarHBondContact O-N 3.35Å; E218-V221 PolarHBondContact O-N 2.92Å; M219-V221 PolarHBondContact O-N 3.43Å; V221-K225 WeakPolarHBondContact O-CB 3.49Å; V221-K225 PolarHBondContact O-N 3.15Å; V221-K225 VanDerWaalsContact O-N 3.07Å; V221-R258 HydrophobicContact CG2-CG 4.29Å; V221-K261 HydrophobicContact CG1-CB 4.48Å; V221-N265 WeakPolarHBondContact CG1-ND2 3.34Å
222	K	90.3	Very high	85.1	Confident	90 Å²	90	48.4 Å²	48.4	39%	0.391	24%	0.244	S	C	.	.	H	α-helix	trans	-63.9	-41.5	176.2	-72.3	178.8	-177.3	167.9	0	112.1	P70 E218 M219 H226	P70-K222 HydrophobicContact CG-CB 3.71Å; E218-K222 WeakPolarHBondContact O-CG 3.23Å; E218-K222 PolarHBondContact O-N 3.09Å; E218-K222 VanDerWaalsContact OE1-CE 3.26Å; E218-K222 WeakPolarHBondContact OE1-CE 3.2Å; E218-K222 IonicContact OE1-NZ 2.83Å; E218-K222 PolarHBondContact OE1-NZ 3.49Å; M219-K222 PolarHBondContact O-N 2.84Å; K222-H226 PolarHBondContact O-N 2.95Å
223	L	91.5	Very high	85.2	Confident	3 Å²	3	43.8 Å²	43.8	2%	0.016	24%	0.24	C	C	.	.	H	α-helix	trans	-66.3	-46.4	177.8	-176.3	63.3	0	0	0	111.9	P70 I73 I160 M219 R220 K225 H226 I227	P70-L223 HydrophobicContact CB-CD1 4.13Å; I73-L223 HydrophobicContact CB-CD1 4.15Å; I73-L223 HydrophobicContact CG2-CD1 4.14Å; I73-L223 HydrophobicContact CG2-CD2 4.17Å; I160-L223 HydrophobicContact CD1-CD2 3.75Å; M219-L223 WeakPolarHBondContact O-CB 3.34Å; M219-L223 PolarHBondContact O-N 2.97Å; R220-L223 PolarHBondContact O-N 2.88Å; L223-K225 VanDerWaalsContact C-N 3.32Å; L223-K225 PolarHBondContact O-N 3.19Å; L223-H226 PolarHBondContact O-N 3.45Å; L223-H226 VanDerWaalsContact O-N 3.12Å; L223-I227 HydrophobicContact CD1-CD1 4.23Å; L223-I227 HydrophobicContact CD1-CG1 4.41Å; L223-I227 HydrophobicContact CG-CD1 3.93Å; L223-I227 VanDerWaalsContact O-CG1 3.32Å; L223-I227 WeakPolarHBondContact O-CG1 3.47Å; L223-I227 PolarHBondContact O-N 3.38Å
224	L	91.9	Very high	85	Confident	13 Å²	13	41.4 Å²	41.4	7%	0.068	22%	0.217	C	C	.	.	H	α-helix	trans	-58.4	-44.1	176.4	-72.3	174.3	0	0	0	111.7	V89 A91 L125 R220 H226 I227 S228 V244	V89-L224 HydrophobicContact CG1-CD2 3.88Å; A91-L224 HydrophobicContact CB-CD1 3.92Å; A91-L224 HydrophobicContact CB-CD2 4.18Å; L125-L224 HydrophobicContact CD2-CD2 3.97Å; R220-L224 HydrophobicContact CG-CD1 4.16Å; R220-L224 HydrophobicContact CG-CG 4.48Å; R220-L224 WeakPolarHBondContact O-CB 3.39Å; R220-L224 VanDerWaalsContact O-CG 3.27Å; R220-L224 WeakPolarHBondContact O-CG 3.48Å; R220-L224 PolarHBondContact O-N 2.88Å; L224-H226 VanDerWaalsContact C-N 3.33Å; L224-H226 PolarHBondContact O-N 3.16Å; L224-I227 PolarHBondContact O-N 2.91Å; L224-S228 PolarHBondContact O-N 3.33Å; L224-V244 HydrophobicContact CB-CG1 4.22Å; L224-V244 HydrophobicContact CD2-CG1 3.78Å; L224-V244 HydrophobicContact CG-CG1 4.4Å
225	K	90.7	Very high	83.9	Confident	98 Å²	98	42.3 Å²	42.3	43%	0.426	23%	0.227	S	C	.	.	H	α-helix	trans	-62.6	-38.8	174.8	-176.4	177.4	-169.4	156.4	0	112.8	V221 L223 S228 L229 N265	V221-K225 WeakPolarHBondContact O-CB 3.49Å; V221-K225 PolarHBondContact O-N 3.15Å; V221-K225 VanDerWaalsContact O-N 3.07Å; L223-K225 VanDerWaalsContact C-N 3.32Å; L223-K225 PolarHBondContact O-N 3.19Å; K225-S228 PolarHBondContact O-OG 2.92Å; K225-L229 WeakPolarHBondContact O-CG 3.46Å; K225-N265 WeakPolarHBondContact CD-OD1 3.48Å; K225-N265 PolarHBondContact NZ-OD1 2.85Å
226	H	91.3	Very high	82.7	Confident	33 Å²	33	43.3 Å²	43.3	15%	0.153	24%	0.238	C	C	.	.	H	α-helix	trans	-67.1	-41.3	178	-179.7	60.1	0	0	0	111.4	P70 V71 K222 L223 L224 L229 Q230	P70-H226 HydrophobicContact CB-CB 3.72Å; V71-H226 WeakPolarHBondContact CA-NE2 3.26Å; V71-H226 VanDerWaalsContact CG2-CE1 3.44Å; V71-H226 WeakPolarHBondContact CG2-CE1 3.4Å; K222-H226 PolarHBondContact O-N 2.95Å; L223-H226 PolarHBondContact O-N 3.45Å; L223-H226 VanDerWaalsContact O-N 3.12Å; L224-H226 VanDerWaalsContact C-N 3.33Å; L224-H226 PolarHBondContact O-N 3.16Å; H226-L229 PolarHBondContact O-N 2.84Å; H226-Q230 PolarHBondContact CE1-NE2 2.97Å; H226-Q230 WeakPolarHBondContact O-CG 3.43Å; H226-Q230 PolarHBondContact O-NE2 2.88Å
227	I	91.5	Very high	80.9	Confident	1 Å²	1	46.7 Å²	46.7	1%	0.005	27%	0.266	C	S	.	.	H	α-helix	trans	-65.1	-40.3	177.6	-63.1	164.9	0	0	0	111	Y74 V89 W123 L223 L224 L229 Q230 I242	Y74-I227 HydrophobicContact CD2-CG1 3.85Å; Y74-I227 HydrophobicContact CE2-CG1 4.2Å; Y74-I227 HydrophobicContact CE2-CG2 4.47Å; V89-I227 HydrophobicContact CG2-CG2 3.78Å; W123-I227 HydrophobicContact CZ3-CD1 4.49Å; L223-I227 HydrophobicContact CD1-CD1 4.23Å; L223-I227 HydrophobicContact CD1-CG1 4.41Å; L223-I227 HydrophobicContact CG-CD1 3.93Å; L223-I227 VanDerWaalsContact O-CG1 3.32Å; L223-I227 WeakPolarHBondContact O-CG1 3.47Å; L223-I227 PolarHBondContact O-N 3.38Å; L224-I227 PolarHBondContact O-N 2.91Å; I227-L229 PolarHBondContact O-N 3.35Å; I227-Q230 WeakPolarHBondContact O-CB 3.34Å; I227-Q230 PolarHBondContact O-N 3.38Å; I227-I242 HydrophobicContact CG2-CB 4.42Å; I227-I242 HydrophobicContact CG2-CD1 4.23Å; I227-I242 HydrophobicContact CG2-CG2 4.03Å
228	S	89.1	Confident	79.6	Confident	30 Å²	30	45.4 Å²	45.4	21%	0.21	26%	0.258	C	S	.	.	H	α-helix	trans	-62.3	-25.6	-179.8	70.6	0	0	0	0	113.8	L224 K225 Q230 I242	L224-S228 PolarHBondContact O-N 3.33Å; K225-S228 PolarHBondContact O-OG 2.92Å; S228-Q230 VanDerWaalsContact C-N 3.33Å; S228-I242 WeakPolarHBondContact CA-O 3.4Å
229	L	88.2	Confident	79	Confident	106 Å²	106	45.3 Å²	45.3	56%	0.555	26%	0.262	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.4	-4.9	178.1	-64.2	170	0	0	0	113.1	K225 H226 I227	K225-L229 WeakPolarHBondContact O-CG 3.46Å; H226-L229 PolarHBondContact O-N 2.84Å; I227-L229 PolarHBondContact O-N 3.35Å
230	Q	88.4	Confident	78.6	Confident	53 Å²	53	45.2 Å²	45.2	25%	0.248	26%	0.262	C	S	.	.			trans	-81.7	147.8	175.9	-54.7	-50.3	-61.9	0	0	109.5	Y74 H226 I227 S228 I242	Y74-Q230 HydrophobicContact CD1-CG 4.19Å; Y74-Q230 HydrophobicContact CE1-CB 4.4Å; Y74-Q230 HydrophobicContact CE1-CG 3.72Å; Y74-Q230 HydrophobicContact CE2-CG 4.43Å; H226-Q230 PolarHBondContact CE1-NE2 2.97Å; H226-Q230 WeakPolarHBondContact O-CG 3.43Å; H226-Q230 PolarHBondContact O-NE2 2.88Å; I227-Q230 WeakPolarHBondContact O-CB 3.34Å; I227-Q230 PolarHBondContact O-N 3.38Å; S228-Q230 VanDerWaalsContact C-N 3.33Å; Q230-I242 HydrophobicContact CB-CD1 3.92Å; Q230-I242 WeakPolarHBondContact O-CG1 3.42Å; Q230-I242 PolarHBondContact O-N 2.79Å
231	R	84.5	Confident	78.3	Confident	144 Å²	144	48 Å²	48	54%	0.543	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	138.6	174	-68.1	-170	174	-157.1	-8.3	110.9	F240 E241	R231-F240 VanDerWaalsContact CA-O 3.29Å; R231-F240 WeakPolarHBondContact CA-O 3.49Å; R231-E241 HydrophobicContact CG-CG 3.88Å; R231-E241 IonicContact CZ-OE1 3.95Å; R231-E241 IonicContact NE-OE1 2.79Å; R231-E241 PolarHBondContact NE-OE1 3.02Å; R231-E241 IonicContact NH2-OE1 2.72Å; R231-E241 PolarHBondContact NH2-OE1 3.1Å
232	T	78.3	Confident	78.2	Confident	12 Å²	12	47.1 Å²	47.1	7%	0.074	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	148.4	175.7	-169.8	0	0	0	0	109.6	S239 F240 I242	T232-S239 WeakPolarHBondContact O-CA 3.35Å; T232-F240 HydrophobicContact CG2-CD2 4.18Å; T232-F240 HydrophobicContact CG2-CE1 4.34Å; T232-F240 HydrophobicContact CG2-CE2 3.58Å; T232-F240 HydrophobicContact CG2-CZ 3.68Å; T232-F240 PolarHBondContact N-O 2.72Å; T232-F240 PolarHBondContact O-N 3.31Å; T232-I242 HydrophobicContact CG2-CG1 3.86Å
233	G	66.4	Low	78.2	Confident	44 Å²	44	43.7 Å²	43.7	45%	0.454	26%	0.257	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	135	179.5	0	0	0	0	0	111.2	G238	G233-G238 WeakPolarHBondContact CA-O 3.47Å
234	Y	61.9	Low	78.1	Confident	65 Å²	65	44 Å²	44	26%	0.255	26%	0.259	S	S	.	.			trans	-106.8	89.4	176.3	-170.9	-92.7	0	0	0	110.8	H87 G236 A373 N406	H87-Y234 AromaticContact CE1-CD2 3.4Å; H87-Y234 VanDerWaalsContact CE1-CD2 3.4Å; H87-Y234 WeakPolarHBondContact CE1-CD2 3.24Å; H87-Y234 AromaticContact CE1-CE2 3.69Å; H87-Y234 AromaticContact ND1-CD2 3.87Å; H87-Y234 AromaticContact NE2-CD2 3.78Å; Y234-G236 PolarHBondContact O-N 3.22Å; Y234-A373 HydrophobicContact CD1-CB 3.85Å; Y234-A373 HydrophobicContact CD2-CB 3.85Å; Y234-A373 HydrophobicContact CE1-CB 4.14Å; Y234-A373 HydrophobicContact CE2-CB 4.12Å; Y234-A373 HydrophobicContact CG-CB 3.7Å; Y234-A373 PolarHBondContact OH-O 2.82Å; Y234-N406 HydrophobicContact CE1-CB 4.26Å; Y234-N406 PolarHBondContact O-ND2 2.9Å
235	G	51.9	Low	78.2	Confident	55 Å²	55	43.3 Å²	43.3	57%	0.567	26%	0.256	S	S	*	.	S	Bend	trans	63.8	5.2	167.4	0	0	0	0	0	117	I405	G235-I405 VanDerWaalsContact O-CG2 3.28Å; G235-I405 WeakPolarHBondContact O-CG2 3.45Å
236	G	56.1	Low	78.3	Confident	30 Å²	30	39 Å²	39	31%	0.309	24%	0.237	S	C	.	.	S	Bend	trans	-149.1	-166.6	-178	0	0	0	0	0	113.1	Y234 G238 D402	Y234-G236 PolarHBondContact O-N 3.22Å; G236-G238 VanDerWaalsContact C-N 3.25Å; G236-G238 PolarHBondContact O-N 3.48Å; G236-D402 WeakPolarHBondContact CA-OD1 3.45Å
237	A	49.1	Very low	78.4	Confident	81 Å²	81	37.5 Å²	37.5	67%	0.669	23%	0.231	S	C	*	.	S	Bend	trans	-73.8	-19	178.9	0	0	0	0	0	112.5	S239	A237-S239 PolarHBondContact O-N 3.47Å
238	G	57.3	Low	78.3	Confident	2 Å²	2	37.4 Å²	37.4	2%	0.021	23%	0.23	C	C	.	.			trans	-74.7	122.1	-177.4	0	0	0	0	0	113.9	G233 G236 E398	G233-G238 WeakPolarHBondContact CA-O 3.47Å; G236-G238 VanDerWaalsContact C-N 3.25Å; G236-G238 PolarHBondContact O-N 3.48Å; G238-E398 WeakPolarHBondContact CA-OE1 3.29Å
239	S	74.3	Confident	78.3	Confident	46 Å²	46	36 Å²	36	32%	0.322	22%	0.22	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-108	130.4	169.5	74.6	0	0	0	0	109.7	T232 A237	T232-S239 WeakPolarHBondContact O-CA 3.35Å; A237-S239 PolarHBondContact O-N 3.47Å
240	F	78.5	Confident	78	Confident	3 Å²	3	32.9 Å²	32.9	1%	0.013	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118	156.7	173	57.6	-91.8	0	0	0	110.5	H87 R231 T232 D366 K369 L370	H87-F240 HydrophobicContact CB-CE2 4.49Å; H87-F240 HydrophobicContact CB-CZ 4.2Å; R231-F240 VanDerWaalsContact CA-O 3.29Å; R231-F240 WeakPolarHBondContact CA-O 3.49Å; T232-F240 HydrophobicContact CG2-CD2 4.18Å; T232-F240 HydrophobicContact CG2-CE1 4.34Å; T232-F240 HydrophobicContact CG2-CE2 3.58Å; T232-F240 HydrophobicContact CG2-CZ 3.68Å; T232-F240 PolarHBondContact N-O 2.72Å; T232-F240 PolarHBondContact O-N 3.31Å; F240-D366 HydrophobicContact CB-CB 4.06Å; F240-K369 HydrophobicContact CB-CB 4.49Å; F240-K369 HydrophobicContact CB-CD 4.41Å; F240-K369 HydrophobicContact CD1-CB 4.16Å; F240-L370 HydrophobicContact CD2-CD2 3.71Å; F240-L370 HydrophobicContact CD2-CG 4.02Å; F240-L370 HydrophobicContact CE2-CD2 3.3Å; F240-L370 HydrophobicContact CE2-CG 4.1Å; F240-L370 HydrophobicContact CZ-CD2 3.84Å
241	E	84.1	Confident	77.6	Confident	78 Å²	78	30.3 Å²	30.3	36%	0.364	19%	0.191	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.2	138.6	175.1	-69.5	-179	-167.8	0	0	111	R231 P243 D366	R231-E241 HydrophobicContact CG-CG 3.88Å; R231-E241 IonicContact CZ-OE1 3.95Å; R231-E241 IonicContact NE-OE1 2.79Å; R231-E241 PolarHBondContact NE-OE1 3.02Å; R231-E241 IonicContact NH2-OE1 2.72Å; R231-E241 PolarHBondContact NH2-OE1 3.1Å; E241-P243 WeakPolarHBondContact O-CD 3.12Å; E241-P243 VanDerWaalsContact O-N 3.15Å; E241-D366 PolarHBondContact N-OD2 3.01Å
242	I	87.9	Confident	77.4	Confident	2 Å²	2	25.8 Å²	25.8	1%	0.01	18%	0.176	C	C	.	.			trans	-69.8	113.4	-175.4	-61.5	175.3	0	0	0	109.5	P86 V89 I227 S228 Q230 T232 V244	P86-I242 HydrophobicContact CG-CD1 4.2Å; P86-I242 HydrophobicContact CG-CG2 4.17Å; P86-I242 WeakPolarHBondContact O-CD1 3.24Å; P86-I242 WeakPolarHBondContact O-CG1 3.31Å; V89-I242 HydrophobicContact CG2-CG2 3.91Å; I227-I242 HydrophobicContact CG2-CB 4.42Å; I227-I242 HydrophobicContact CG2-CD1 4.23Å; I227-I242 HydrophobicContact CG2-CG2 4.03Å; S228-I242 WeakPolarHBondContact CA-O 3.4Å; Q230-I242 HydrophobicContact CB-CD1 3.92Å; Q230-I242 WeakPolarHBondContact O-CG1 3.42Å; Q230-I242 PolarHBondContact O-N 2.79Å; T232-I242 HydrophobicContact CG2-CG1 3.86Å; I242-V244 PolarHBondContact O-N 2.94Å
243	P	88.4	Confident	77.4	Confident	19 Å²	19	25.9 Å²	25.9	12%	0.123	18%	0.176	C	C	.	.			trans	-68.3	136.3	177.9	28.7	-35.5	0	0	0	110.5	H87 L88 V89 E241 L350 L370	H87-P243 VanDerWaalsContact O-CD 3.3Å; H87-P243 WeakPolarHBondContact O-CD 3.33Å; H87-P243 WeakPolarHBondContact O-CG 3.32Å; L88-P243 HydrophobicContact CB-CG 4.48Å; L88-P243 HydrophobicContact CD1-CB 4.13Å; L88-P243 HydrophobicContact CD1-CG 3.8Å; V89-P243 PolarHBondContact N-O 3.28Å; E241-P243 WeakPolarHBondContact O-CD 3.12Å; E241-P243 VanDerWaalsContact O-N 3.15Å; P243-L350 HydrophobicContact CB-CD1 3.85Å; P243-L350 HydrophobicContact CB-CD2 3.86Å; P243-L350 HydrophobicContact CB-CG 4.49Å; P243-L350 HydrophobicContact CG-CD1 4.18Å; P243-L370 HydrophobicContact CB-CD1 4.21Å; P243-L370 HydrophobicContact CG-CD1 3.72Å; P243-L370 HydrophobicContact CG-CD2 3.84Å; P243-L370 HydrophobicContact CG-CG 4.46Å
244	V	90.9	Very high	78	Confident	8 Å²	8	33.4 Å²	33.4	5%	0.048	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	121.2	176	-179.3	0	0	0	0	109.1	V89 L224 I242 T267 P268	V89-V244 HydrophobicContact CB-CG1 4.43Å; V89-V244 HydrophobicContact CB-CG2 4.12Å; V89-V244 HydrophobicContact CG1-CG1 4.36Å; V89-V244 WeakPolarHBondContact O-CA 3.23Å; L224-V244 HydrophobicContact CB-CG1 4.22Å; L224-V244 HydrophobicContact CD2-CG1 3.78Å; L224-V244 HydrophobicContact CG-CG1 4.4Å; I242-V244 PolarHBondContact O-N 2.94Å; V244-T267 HydrophobicContact CB-CG2 4.37Å; V244-T267 HydrophobicContact CG1-CG2 4.02Å; V244-T267 WeakPolarHBondContact O-CG2 3.43Å; V244-P268 VanDerWaalsContact O-CD 3.29Å; V244-P268 WeakPolarHBondContact O-CD 3.5Å; V244-P268 WeakPolarHBondContact O-CG 3.5Å
245	L	93.1	Very high	79.1	Confident	0 Å²	0	30.8 Å²	30.8	0%	0	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	133.2	177.3	-175.3	79.9	0	0	0	110.4	V89 V90 A91 P268 L270 I346 A349 L350	V89-L245 PolarHBondContact O-N 3.28Å; V90-L245 CarbonylContact C-O 3.53Å; V90-L245 WeakPolarHBondContact CA-O 3.43Å; A91-L245 PolarHBondContact N-O 2.99Å; L245-P268 HydrophobicContact CD1-CB 3.78Å; L245-P268 HydrophobicContact CD1-CG 3.86Å; L245-L270 HydrophobicContact CD1-CB 4.32Å; L245-L270 HydrophobicContact CD2-CB 3.99Å; L245-L270 HydrophobicContact CD2-CD2 4.12Å; L245-L270 HydrophobicContact CG-CB 4.35Å; L245-I346 HydrophobicContact CD2-CB 4.13Å; L245-I346 HydrophobicContact CD2-CG1 3.69Å; L245-I346 HydrophobicContact CD2-CG2 3.91Å; L245-A349 HydrophobicContact CD1-CB 4.14Å; L245-L350 HydrophobicContact CB-CD2 4.47Å; L245-L350 HydrophobicContact CD1-CD2 4.44Å
246	C	93.4	Very high	80.8	Confident	6 Å²	6	28.1 Å²	28.1	4%	0.041	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.7	124.6	169.7	-68.4	0	0	0	0	110.6	A91 P268 W269 L270	A91-C246 WeakPolarHBondContact O-CA 3.23Å; C246-P268 PolarHBondContact N-O 3.19Å; C246-W269 HydrophobicContact CB-CD2 3.47Å; C246-W269 VanDerWaalsContact CB-CD2 3.47Å; C246-W269 HydrophobicContact CB-CE3 3.58Å; C246-W269 HydrophobicContact CB-CG 4.06Å; C246-W269 HydrophobicContact CB-CH2 3.86Å; C246-W269 HydrophobicContact CB-CZ2 3.72Å; C246-W269 HydrophobicContact CB-CZ3 3.79Å; C246-W269 CarbonylContact O-C 3.54Å; C246-W269 WeakPolarHBondContact O-CA 3.34Å; C246-L270 PolarHBondContact O-N 2.87Å
247	L	92.2	Very high	82.2	Confident	2 Å²	2	33.2 Å²	33.2	1%	0.01	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	115.8	174.6	179.6	63.2	0	0	0	109.8	V90 A91 L92 V93 L113 V249 L270 L272	V90-L247 HydrophobicContact CG1-CB 4.12Å; A91-L247 PolarHBondContact O-N 3.07Å; L92-L247 HydrophobicContact CD1-CB 4.37Å; L92-L247 HydrophobicContact CD1-CD2 3.9Å; L92-L247 HydrophobicContact CD1-CG 4.14Å; V93-L247 PolarHBondContact N-O 2.83Å; L113-L247 HydrophobicContact CD1-CD2 4.26Å; L113-L247 HydrophobicContact CD2-CD2 4.03Å; L247-V249 HydrophobicContact CD1-CG2 4.47Å; L247-V249 HydrophobicContact CD2-CG2 4.17Å; L247-V249 HydrophobicContact CG-CG2 3.86Å; L247-L270 WeakPolarHBondContact CA-O 3.49Å; L247-L270 HydrophobicContact CD1-CB 4.01Å; L247-L270 HydrophobicContact CD1-CD2 3.88Å; L247-L270 HydrophobicContact CD1-CG 3.78Å; L247-L272 HydrophobicContact CD1-CD1 4.33Å; L247-L272 HydrophobicContact CD1-CD2 4.16Å; L247-L272 HydrophobicContact CD1-CG 3.94Å
248	L	91.2	Very high	83.9	Confident	0 Å²	0	32.2 Å²	32.2	0%	0	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.8	117.2	177.8	-177.3	64.9	0	0	0	110.4	V93 H250 I255 W269 L270 I271 L272 A279 L282	V93-L248 HydrophobicContact CG1-CD1 4.34Å; V93-L248 WeakPolarHBondContact O-CA 3.45Å; L248-H250 WeakPolarHBondContact CD1-O 3.29Å; L248-I255 HydrophobicContact CD1-CG2 3.97Å; L248-W269 HydrophobicContact CB-CE3 4.26Å; L248-W269 HydrophobicContact CB-CZ3 4.47Å; L248-L270 PolarHBondContact N-O 3.43Å; L248-I271 HydrophobicContact CB-CG1 4.47Å; L248-I271 HydrophobicContact CD2-CG1 4.34Å; L248-I271 HydrophobicContact CD2-CG2 4.3Å; L248-L272 PolarHBondContact O-N 3.25Å; L248-A279 HydrophobicContact CD2-CB 4.14Å; L248-A279 HydrophobicContact CG-CB 4.21Å; L248-L282 HydrophobicContact CD2-CD1 4.05Å
249	V	87.6	Confident	85.5	Confident	0 Å²	0	32.2 Å²	32.2	0%	0	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	106.8	178.2	-171	0	0	0	0	110.1	L92 V93 G94 L105 I133 L247 L272	L92-V249 HydrophobicContact CD1-CB 4.46Å; L92-V249 HydrophobicContact CD1-CG2 3.71Å; V93-V249 PolarHBondContact O-N 2.83Å; G94-V249 WeakPolarHBondContact CA-O 3.38Å; L105-V249 HydrophobicContact CD1-CG1 3.73Å; L105-V249 HydrophobicContact CD2-CG1 3.67Å; L105-V249 HydrophobicContact CG-CG1 4.06Å; I133-V249 HydrophobicContact CD1-CB 4.04Å; I133-V249 HydrophobicContact CD1-CG1 3.49Å; I133-V249 VanDerWaalsContact CD1-CG1 3.49Å; I133-V249 HydrophobicContact CG1-CB 4.38Å; I133-V249 HydrophobicContact CG1-CG1 4.34Å; L247-V249 HydrophobicContact CD1-CG2 4.47Å; L247-V249 HydrophobicContact CD2-CG2 4.17Å; L247-V249 HydrophobicContact CG-CG2 3.86Å; V249-L272 HydrophobicContact CB-CD1 4.47Å; V249-L272 HydrophobicContact CG1-CD1 4.26Å; V249-L272 HydrophobicContact CG2-CD1 3.6Å; V249-L272 HydrophobicContact CG2-CG 4.24Å
250	H	81.5	Confident	86.1	Confident	40 Å²	40	30.8 Å²	30.8	19%	0.185	14%	0.136	C	C	.	.	S	Bend	trans	56.3	166.9	-165.3	-157.6	67.5	0	0	0	111.7	L248 S275 G276 G277	L248-H250 WeakPolarHBondContact CD1-O 3.29Å; H250-S275 PolarHBondContact N-OG 3.19Å; H250-S275 VanDerWaalsContact N-OG 3.1Å; H250-S275 PolarHBondContact ND1-O 2.69Å; H250-G276 WeakPolarHBondContact CA-O 3.42Å; H250-G276 WeakPolarHBondContact ND1-CA 3.34Å; H250-G276 PolarHBondContact ND1-O 3.31Å; H250-G277 PolarHBondContact CE1-N 3.12Å
251	G	80.4	Confident	86.5	Confident	0 Å²	0	35.4 Å²	35.4	0%	0	16%	0.156	C	C	.	.			trans	-179.6	142.3	171.8	0	0	0	0	0	115.6	V278 F304	G251-V278 WeakPolarHBondContact O-CG2 3.22Å; G251-V278 PolarHBondContact O-N 2.85Å; G251-F304 WeakPolarHBondContact O-CZ 3.27Å
252	E	79.9	Confident	86.5	Confident	49 Å²	49	32 Å²	32	23%	0.229	14%	0.142	C	C	.	.			trans	-81.6	155.6	168.5	-69.8	179	-162.2	0	0	111.4	R254 I255	E252-R254 PolarHBondContact O-N 2.92Å; E252-I255 WeakPolarHBondContact O-CB 3.32Å; E252-I255 PolarHBondContact O-N 3.5Å
253	P	79.8	Confident	86.5	Confident	13 Å²	13	32.3 Å²	32.3	8%	0.084	14%	0.144	C	C	.	.	T	Hydrogen-bonded Turn	trans	-54	-25.7	178.9	-27.7	35.3	0	0	0	114.7	I255 L256 F304 W316	P253-I255 PolarHBondContact O-N 3.18Å; P253-L256 WeakPolarHBondContact O-CB 3.41Å; P253-L256 PolarHBondContact O-N 2.78Å; P253-L256 VanDerWaalsContact O-N 3.16Å; P253-F304 HydrophobicContact CG-CD2 4Å; P253-F304 HydrophobicContact CG-CE2 4.01Å; P253-F304 HydrophobicContact CG-CG 4.26Å; P253-F304 HydrophobicContact CG-CZ 4.28Å; P253-W316 HydrophobicContact CB-CD2 3.65Å; P253-W316 VanDerWaalsContact CB-CE2 3.49Å; P253-W316 HydrophobicContact CB-CE3 3.99Å; P253-W316 HydrophobicContact CB-CG 4.17Å; P253-W316 HydrophobicContact CB-CH2 4.11Å; P253-W316 HydrophobicContact CB-CZ2 3.74Å; P253-W316 HydrophobicContact CB-CZ3 4.21Å; P253-W316 HydrophobicContact CG-CD2 4.47Å; P253-W316 HydrophobicContact CG-CE3 4.32Å; P253-W316 HydrophobicContact CG-CH2 4.29Å; P253-W316 HydrophobicContact CG-CZ2 4.39Å; P253-W316 HydrophobicContact CG-CZ3 4.24Å
254	R	78.5	Confident	86.3	Confident	202 Å²	202	34.4 Å²	34.4	76%	0.762	17%	0.169	S	C	*	.	H	α-helix	trans	-60.6	-25.1	176.4	-64.7	176.1	176.4	177.3	1	113.3	E252 L256	E252-R254 PolarHBondContact O-N 2.92Å; R254-L256 VanDerWaalsContact C-N 3.34Å
255	I	84.9	Confident	86.1	Confident	10 Å²	10	36.2 Å²	36.2	5%	0.051	18%	0.178	C	C	.	.	H	α-helix	trans	-71	-29	179.3	-65.6	168.7	0	0	0	111.5	V93 L248 E252 P253 K257 R258 M259	V93-I255 HydrophobicContact CG1-CD1 4.04Å; V93-I255 HydrophobicContact CG1-CG1 4.19Å; V93-I255 HydrophobicContact CG1-CG2 3.56Å; L248-I255 HydrophobicContact CD1-CG2 3.97Å; E252-I255 WeakPolarHBondContact O-CB 3.32Å; E252-I255 PolarHBondContact O-N 3.5Å; P253-I255 PolarHBondContact O-N 3.18Å; I255-K257 PolarHBondContact O-N 2.7Å; I255-R258 CarbonylContact O-C 3.58Å; I255-R258 WeakPolarHBondContact O-CA 3.43Å; I255-R258 VanDerWaalsContact O-CB 3.31Å; I255-R258 WeakPolarHBondContact O-CB 3.45Å; I255-R258 PolarHBondContact O-N 3.38Å; I255-M259 PolarHBondContact O-N 3.12Å
256	L	86.9	Confident	85.7	Confident	0 Å²	0	39.4 Å²	39.4	0%	0	20%	0.2	C	C	.	.	H	α-helix	trans	-56.1	-38.6	179.6	-68.2	168.6	0	0	0	112.4	P253 R254 R258 M259 C260 V278 W316 L319 I320 I323	P253-L256 WeakPolarHBondContact O-CB 3.41Å; P253-L256 PolarHBondContact O-N 2.78Å; P253-L256 VanDerWaalsContact O-N 3.16Å; R254-L256 VanDerWaalsContact C-N 3.34Å; L256-R258 VanDerWaalsContact C-N 3.32Å; L256-R258 PolarHBondContact O-N 2.79Å; L256-M259 PolarHBondContact O-N 3.01Å; L256-C260 PolarHBondContact O-N 3.01Å; L256-V278 HydrophobicContact CD2-CG1 3.53Å; L256-V278 HydrophobicContact CG-CG1 4.01Å; L256-V278 HydrophobicContact CG-CG2 4.4Å; L256-W316 HydrophobicContact CD1-CB 3.98Å; L256-W316 HydrophobicContact CD1-CG 4.31Å; L256-L319 HydrophobicContact CB-CB 4.27Å; L256-L319 HydrophobicContact CB-CD1 4.27Å; L256-I320 HydrophobicContact CD1-CD1 4.02Å; L256-I320 HydrophobicContact CD1-CG1 3.86Å; L256-I320 HydrophobicContact CD2-CD1 4.47Å; L256-I320 HydrophobicContact CD2-CG1 3.71Å; L256-I320 HydrophobicContact CG-CG1 4.44Å; L256-I323 HydrophobicContact CB-CD1 4.49Å; L256-I323 HydrophobicContact CD2-CD1 3.72Å
257	K	86.1	Confident	85.4	Confident	136 Å²	136	39.7 Å²	39.7	59%	0.591	20%	0.202	S	C	*	.	H	α-helix	trans	-65.9	-34.4	176.3	-170.2	175.3	-175.6	175	0	112.4	I255 K261 L319	I255-K257 PolarHBondContact O-N 2.7Å; K257-K261 WeakPolarHBondContact O-CG 3.37Å; K257-K261 PolarHBondContact O-N 3.25Å; K257-L319 HydrophobicContact CB-CD1 4.38Å
258	R	86	Confident	85.4	Confident	61 Å²	61	40.1 Å²	40.1	23%	0.23	21%	0.205	C	C	.	.	H	α-helix	trans	-71.3	-42.7	174.2	-175.3	-173.2	-63.5	155.1	3.6	110.4	S217 V221 I255 L256 K261 G262	S217-R258 PolarHBondContact OG-NE 2.87Å; V221-R258 HydrophobicContact CG2-CG 4.29Å; I255-R258 CarbonylContact O-C 3.58Å; I255-R258 WeakPolarHBondContact O-CA 3.43Å; I255-R258 VanDerWaalsContact O-CB 3.31Å; I255-R258 WeakPolarHBondContact O-CB 3.45Å; I255-R258 PolarHBondContact O-N 3.38Å; L256-R258 VanDerWaalsContact C-N 3.32Å; L256-R258 PolarHBondContact O-N 2.79Å; R258-K261 PolarHBondContact O-N 2.95Å; R258-G262 PolarHBondContact O-N 3.37Å
259	M	89.2	Confident	85.4	Confident	1 Å²	1	40.2 Å²	40.2	1%	0.005	21%	0.205	C	C	.	.	H	α-helix	trans	-60.8	-48.8	179	-169.8	171.3	-178.1	0	0	112.1	I255 L256 K261 G262 I263 W269 I271 L282 I323 L330	I255-M259 PolarHBondContact O-N 3.12Å; L256-M259 PolarHBondContact O-N 3.01Å; M259-K261 VanDerWaalsContact C-N 3.27Å; M259-K261 PolarHBondContact O-N 3.36Å; M259-G262 PolarHBondContact O-N 3.02Å; M259-I263 HydrophobicContact CE-CD1 4.34Å; M259-I263 HydrophobicContact CG-CD1 4.02Å; M259-I263 WeakPolarHBondContact O-CG1 3.34Å; M259-I263 PolarHBondContact O-N 3.28Å; M259-W269 VanDerWaalsContact CA-CZ2 3.47Å; M259-W269 HydrophobicContact CB-CH2 3.95Å; M259-W269 HydrophobicContact CB-CZ2 3.96Å; M259-W269 HydrophobicContact CB-CZ3 4.28Å; M259-W269 HydrophobicContact CE-CB 3.99Å; M259-W269 HydrophobicContact CE-CD2 3.96Å; M259-W269 HydrophobicContact CE-CE3 4.11Å; M259-W269 HydrophobicContact CE-CG 3.89Å; M259-W269 HydrophobicContact CG-CD2 3.74Å; M259-W269 HydrophobicContact CG-CE3 3.94Å; M259-W269 HydrophobicContact CG-CG 4.33Å; M259-W269 HydrophobicContact CG-CH2 4.09Å; M259-W269 HydrophobicContact CG-CZ2 3.9Å; M259-W269 HydrophobicContact CG-CZ3 4.1Å; M259-W269 HydrophobicContact SD-CD2 4.29Å; M259-W269 HydrophobicContact SD-CE3 4.1Å; M259-W269 HydrophobicContact SD-CZ3 4.43Å; M259-I271 HydrophobicContact CE-CD1 4.28Å; M259-L282 HydrophobicContact CE-CD1 3.98Å; M259-L282 HydrophobicContact SD-CD1 3.83Å; M259-I323 HydrophobicContact CB-CD1 4.06Å; M259-I323 HydrophobicContact CE-CG2 3.61Å; M259-I323 HydrophobicContact CG-CD1 3.98Å; M259-I323 HydrophobicContact CG-CG1 4.22Å; M259-I323 HydrophobicContact SD-CD1 3.92Å; M259-I323 HydrophobicContact SD-CG1 4.44Å; M259-I323 HydrophobicContact SD-CG2 4.08Å; M259-L330 HydrophobicContact CE-CD2 3.4Å
260	C	87	Confident	85.6	Confident	17 Å²	17	40.3 Å²	40.3	12%	0.115	21%	0.206	C	C	.	.	H	α-helix	trans	-54.9	-39.4	173.1	-86.9	0	0	0	0	113.5	L256 G264 L319	L256-C260 PolarHBondContact O-N 3.01Å; C260-G264 PolarHBondContact O-N 2.98Å; C260-G264 VanDerWaalsContact O-N 3.14Å; C260-L319 HydrophobicContact CB-CD2 4.05Å; C260-L319 WeakPolarHBondContact SG-CD2 3.36Å; C260-L319 PolarHBondContact SG-O 3.47Å; C260-L319 VanDerWaalsContact SG-O 3.41Å
261	K	86.9	Confident	86.1	Confident	99 Å²	99	38.4 Å²	38.4	43%	0.43	20%	0.197	S	C	.	.	H	α-helix	trans	-71.5	-34.6	177.1	-73.1	-178	177.4	-170.6	0	112.6	V221 K257 R258 M259	V221-K261 HydrophobicContact CG1-CB 4.48Å; K257-K261 WeakPolarHBondContact O-CG 3.37Å; K257-K261 PolarHBondContact O-N 3.25Å; R258-K261 PolarHBondContact O-N 2.95Å; M259-K261 VanDerWaalsContact C-N 3.27Å; M259-K261 PolarHBondContact O-N 3.36Å
262	G	85.6	Confident	86.5	Confident	6 Å²	6	38.4 Å²	38.4	6%	0.062	20%	0.197	C	C	.	.	H	α-helix	trans	-69.4	-44.6	175.4	0	0	0	0	0	112.4	R258 M259 G264 N265 T267	R258-G262 PolarHBondContact O-N 3.37Å; M259-G262 PolarHBondContact O-N 3.02Å; G262-G264 VanDerWaalsContact C-N 3.27Å; G262-G264 PolarHBondContact O-N 3.37Å; G262-N265 CarbonylContact O-C 3.56Å; G262-N265 WeakPolarHBondContact O-CA 3.36Å; G262-N265 PolarHBondContact O-N 2.83Å; G262-T267 WeakPolarHBondContact O-CB 3.44Å; G262-T267 PolarHBondContact O-N 3.06Å; G262-T267 PolarHBondContact O-OG1 3.43Å
263	I	87.2	Confident	86.8	Confident	10 Å²	10	36.5 Å²	36.5	5%	0.051	19%	0.19	C	C	.	.	H	α-helix	trans	-59.8	-38.3	174.3	-71	171	0	0	0	111.1	M259 N265 S266 I323 H326 L329 L330	M259-I263 HydrophobicContact CE-CD1 4.34Å; M259-I263 HydrophobicContact CG-CD1 4.02Å; M259-I263 WeakPolarHBondContact O-CG1 3.34Å; M259-I263 PolarHBondContact O-N 3.28Å; I263-N265 PolarHBondContact O-N 3.18Å; I263-N265 VanDerWaalsContact O-N 3.12Å; I263-S266 PolarHBondContact O-N 3.22Å; I263-I323 HydrophobicContact CD1-CB 4.03Å; I263-I323 HydrophobicContact CD1-CG1 3.8Å; I263-I323 HydrophobicContact CD1-CG2 3.78Å; I263-H326 HydrophobicContact CG2-CB 3.75Å; I263-L329 HydrophobicContact CG2-CD1 4.13Å; I263-L330 HydrophobicContact CD1-CD2 4.28Å
264	G	84.4	Confident	86.8	Confident	63 Å²	63	37 Å²	37	65%	0.649	20%	0.198	S	C	*	.	T	Hydrogen-bonded Turn	trans	-63.5	-12.7	173.6	0	0	0	0	0	115.2	C260 G262	C260-G264 PolarHBondContact O-N 2.98Å; C260-G264 VanDerWaalsContact O-N 3.14Å; G262-G264 VanDerWaalsContact C-N 3.27Å; G262-G264 PolarHBondContact O-N 3.37Å
265	N	85.4	Confident	87	Confident	45 Å²	45	27.9 Å²	27.9	24%	0.241	17%	0.165	C	C	.	.	T	Hydrogen-bonded Turn	trans	-104.8	17.3	170.8	-66.1	-38.7	0	0	0	112.2	V221 K225 G262 I263 T267	V221-N265 WeakPolarHBondContact CG1-ND2 3.34Å; K225-N265 WeakPolarHBondContact CD-OD1 3.48Å; K225-N265 PolarHBondContact NZ-OD1 2.85Å; G262-N265 CarbonylContact O-C 3.56Å; G262-N265 WeakPolarHBondContact O-CA 3.36Å; G262-N265 PolarHBondContact O-N 2.83Å; I263-N265 PolarHBondContact O-N 3.18Å; I263-N265 VanDerWaalsContact O-N 3.12Å; N265-T267 PolarHBondContact O-N 2.96Å
266	S	85.3	Confident	86.8	Confident	67 Å²	67	28.2 Å²	28.2	47%	0.469	17%	0.17	S	C	.	.	T	Hydrogen-bonded Turn	trans	58.1	27	-176.8	-52.8	0	0	0	0	114.5	I263 P268	I263-S266 PolarHBondContact O-N 3.22Å; S266-P268 WeakPolarHBondContact O-CD 3.47Å
267	T	86.9	Confident	86.7	Confident	12 Å²	12	28.5 Å²	28.5	7%	0.074	17%	0.173	C	C	.	.			trans	-80.5	123.5	178.3	-49.3	0	0	0	0	110.6	V244 G262 N265 W269	V244-T267 HydrophobicContact CB-CG2 4.37Å; V244-T267 HydrophobicContact CG1-CG2 4.02Å; V244-T267 WeakPolarHBondContact O-CG2 3.43Å; G262-T267 WeakPolarHBondContact O-CB 3.44Å; G262-T267 PolarHBondContact O-N 3.06Å; G262-T267 PolarHBondContact O-OG1 3.43Å; N265-T267 PolarHBondContact O-N 2.96Å; T267-W269 PolarHBondContact O-NE1 3.49Å
268	P	91.8	Very high	86.7	Confident	12 Å²	12	22.1 Å²	22.1	8%	0.078	15%	0.146	C	C	.	.			trans	-68.7	147.7	176.7	24.6	-32.2	0	0	0	113.1	V244 L245 C246 S266 L350 A353	V244-P268 VanDerWaalsContact O-CD 3.29Å; V244-P268 WeakPolarHBondContact O-CD 3.5Å; V244-P268 WeakPolarHBondContact O-CG 3.5Å; L245-P268 HydrophobicContact CD1-CB 3.78Å; L245-P268 HydrophobicContact CD1-CG 3.86Å; C246-P268 PolarHBondContact N-O 3.19Å; S266-P268 WeakPolarHBondContact O-CD 3.47Å; P268-L350 HydrophobicContact CG-CD2 3.75Å; P268-A353 HydrophobicContact CB-CB 3.92Å; P268-A353 HydrophobicContact CG-CB 4.41Å
269	W	92.3	Very high	86.8	Confident	2 Å²	2	19.2 Å²	19.2	1%	0.008	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	125.8	179.6	-72.5	73.8	0	0	0	111.3	V93 C246 L248 M259 T267 L329 L330 T331	V93-W269 HydrophobicContact CB-CZ3 4.38Å; V93-W269 HydrophobicContact CG2-CH2 4.27Å; V93-W269 HydrophobicContact CG2-CZ3 4.33Å; C246-W269 HydrophobicContact CB-CD2 3.47Å; C246-W269 VanDerWaalsContact CB-CD2 3.47Å; C246-W269 HydrophobicContact CB-CE3 3.58Å; C246-W269 HydrophobicContact CB-CG 4.06Å; C246-W269 HydrophobicContact CB-CH2 3.86Å; C246-W269 HydrophobicContact CB-CZ2 3.72Å; C246-W269 HydrophobicContact CB-CZ3 3.79Å; C246-W269 CarbonylContact O-C 3.54Å; C246-W269 WeakPolarHBondContact O-CA 3.34Å; L248-W269 HydrophobicContact CB-CE3 4.26Å; L248-W269 HydrophobicContact CB-CZ3 4.47Å; M259-W269 VanDerWaalsContact CA-CZ2 3.47Å; M259-W269 HydrophobicContact CB-CH2 3.95Å; M259-W269 HydrophobicContact CB-CZ2 3.96Å; M259-W269 HydrophobicContact CB-CZ3 4.28Å; M259-W269 HydrophobicContact CE-CB 3.99Å; M259-W269 HydrophobicContact CE-CD2 3.96Å; M259-W269 HydrophobicContact CE-CE3 4.11Å; M259-W269 HydrophobicContact CE-CG 3.89Å; M259-W269 HydrophobicContact CG-CD2 3.74Å; M259-W269 HydrophobicContact CG-CE3 3.94Å; M259-W269 HydrophobicContact CG-CG 4.33Å; M259-W269 HydrophobicContact CG-CH2 4.09Å; M259-W269 HydrophobicContact CG-CZ2 3.9Å; M259-W269 HydrophobicContact CG-CZ3 4.1Å; M259-W269 HydrophobicContact SD-CD2 4.29Å; M259-W269 HydrophobicContact SD-CE3 4.1Å; M259-W269 HydrophobicContact SD-CZ3 4.43Å; T267-W269 PolarHBondContact O-NE1 3.49Å; W269-L329 PolarHBondContact N-O 2.93Å; W269-L330 HydrophobicContact CB-CD2 3.87Å; W269-L330 HydrophobicContact CG-CD2 4.47Å; W269-T331 PolarHBondContact O-N 3.01Å
270	L	92.6	Very high	86.7	Confident	1 Å²	1	21.3 Å²	21.3	1%	0.005	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.2	121.5	171.6	-178.5	58.3	0	0	0	109.2	L245 C246 L247 L248 T331 H333 L342 V345 I346	L245-L270 HydrophobicContact CD1-CB 4.32Å; L245-L270 HydrophobicContact CD2-CB 3.99Å; L245-L270 HydrophobicContact CD2-CD2 4.12Å; L245-L270 HydrophobicContact CG-CB 4.35Å; C246-L270 PolarHBondContact O-N 2.87Å; L247-L270 WeakPolarHBondContact CA-O 3.49Å; L247-L270 HydrophobicContact CD1-CB 4.01Å; L247-L270 HydrophobicContact CD1-CD2 3.88Å; L247-L270 HydrophobicContact CD1-CG 3.78Å; L248-L270 PolarHBondContact N-O 3.43Å; L270-T331 CarbonylContact C-O 3.58Å; L270-T331 WeakPolarHBondContact CA-O 3.49Å; L270-T331 HydrophobicContact CD1-CG2 4Å; L270-H333 HydrophobicContact CD1-CB 3.95Å; L270-L342 HydrophobicContact CD2-CD1 3.98Å; L270-V345 HydrophobicContact CD1-CG1 3.66Å; L270-V345 HydrophobicContact CD2-CG1 4.11Å; L270-I346 HydrophobicContact CD2-CG1 3.94Å
271	I	91.9	Very high	86.6	Confident	0 Å²	0	20.6 Å²	20.6	0%	0	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	123.4	-176.2	-53.5	173.7	0	0	0	108.8	L248 M259 A279 L282 V283 M286 T331 H333	L248-I271 HydrophobicContact CB-CG1 4.47Å; L248-I271 HydrophobicContact CD2-CG1 4.34Å; L248-I271 HydrophobicContact CD2-CG2 4.3Å; M259-I271 HydrophobicContact CE-CD1 4.28Å; I271-A279 HydrophobicContact CG2-CB 3.91Å; I271-L282 HydrophobicContact CD1-CB 4.08Å; I271-L282 HydrophobicContact CD1-CD1 4.01Å; I271-V283 HydrophobicContact CG2-CG2 3.73Å; I271-M286 HydrophobicContact CD1-SD 4.28Å; I271-T331 PolarHBondContact N-O 2.98Å; I271-H333 PolarHBondContact O-N 3.41Å
272	L	88.3	Confident	86.7	Confident	0 Å²	0	15.9 Å²	15.9	0%	0	12%	0.12	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.8	113	174.6	-62.9	-174.8	0	0	0	110.6	L105 T108 L247 L248 V249 S275 H333	L105-L272 HydrophobicContact CD1-CD1 3.63Å; T108-L272 HydrophobicContact CG2-CD1 4.29Å; L247-L272 HydrophobicContact CD1-CD1 4.33Å; L247-L272 HydrophobicContact CD1-CD2 4.16Å; L247-L272 HydrophobicContact CD1-CG 3.94Å; L248-L272 PolarHBondContact O-N 3.25Å; V249-L272 HydrophobicContact CB-CD1 4.47Å; V249-L272 HydrophobicContact CG1-CD1 4.26Å; V249-L272 HydrophobicContact CG2-CD1 3.6Å; V249-L272 HydrophobicContact CG2-CG 4.24Å; L272-S275 WeakPolarHBondContact O-CB 3.47Å; L272-S275 PolarHBondContact O-OG 2.9Å; L272-H333 HydrophobicContact CD2-CB 4.21Å
273	A	85.9	Confident	86.8	Confident	9 Å²	9	16.1 Å²	16.1	7%	0.074	12%	0.121	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.2	142	176	0	0	0	0	0	111.3	W104 S275 V283 V332 H333 D334	W104-A273 WeakPolarHBondContact CH2-O 3.45Å; A273-S275 VanDerWaalsContact C-N 3.26Å; A273-S275 PolarHBondContact O-N 3.25Å; A273-V283 HydrophobicContact CB-CG1 3.99Å; A273-V283 HydrophobicContact CB-CG2 4.12Å; A273-V332 HydrophobicContact CB-CG1 4.07Å; A273-H333 PolarHBondContact N-O 3.32Å; A273-D334 HydrophobicContact CB-CB 4.06Å
274	G	80.1	Confident	86.6	Confident	25 Å²	25	18 Å²	18	26%	0.258	13%	0.133	S	C	.	.	T	Hydrogen-bonded Turn	trans	77.7	7.9	179.7	0	0	0	0	0	114.4	K102 D280	K102-G274 PolarHBondContact NZ-O 3.49Å; G274-D280 VanDerWaalsContact CA-OD1 3.23Å; G274-D280 WeakPolarHBondContact CA-OD1 3.44Å; G274-D280 PolarHBondContact N-OD1 3.22Å
275	S	81.9	Confident	86.6	Confident	10 Å²	10	15.2 Å²	15.2	7%	0.07	10%	0.103	C	C	.	.	S	Bend	trans	-83.9	-11.4	178.8	68.5	0	0	0	0	113.6	H250 L272 A273 A279 D280	H250-S275 PolarHBondContact N-OG 3.19Å; H250-S275 VanDerWaalsContact N-OG 3.1Å; H250-S275 PolarHBondContact ND1-O 2.69Å; L272-S275 WeakPolarHBondContact O-CB 3.47Å; L272-S275 PolarHBondContact O-OG 2.9Å; A273-S275 VanDerWaalsContact C-N 3.26Å; A273-S275 PolarHBondContact O-N 3.25Å; S275-A279 VanDerWaalsContact OG-CB 3.32Å; S275-A279 WeakPolarHBondContact OG-CB 3.19Å; S275-D280 PolarHBondContact N-OD1 3.1Å; S275-D280 VanDerWaalsContact N-OD1 3.1Å
276	G	81.2	Confident	86.6	Confident	16 Å²	16	15.5 Å²	15.5	17%	0.165	10%	0.104	C	C	.	.			trans	90.3	172.4	174.6	0	0	0	0	0	115.3	H250 A279 D280	H250-G276 WeakPolarHBondContact CA-O 3.42Å; H250-G276 WeakPolarHBondContact ND1-CA 3.34Å; H250-G276 PolarHBondContact ND1-O 3.31Å; G276-A279 PolarHBondContact O-N 3.01Å; G276-D280 WeakPolarHBondContact CA-OD2 3.38Å; G276-D280 PolarHBondContact N-OD1 2.8Å; G276-D280 PolarHBondContact N-OD2 3.06Å
277	G	84.9	Confident	86.4	Confident	6 Å²	6	18.4 Å²	18.4	6%	0.062	11%	0.114	C	C	.	.	T	Hydrogen-bonded Turn	trans	63.9	-138.8	175.4	0	0	0	0	0	113	H250 A279 D280 I281	H250-G277 PolarHBondContact CE1-N 3.12Å; G277-A279 PolarHBondContact O-N 3.25Å; G277-D280 PolarHBondContact O-N 3.4Å; G277-I281 PolarHBondContact O-N 2.94Å
278	V	86.6	Confident	86.1	Confident	2 Å²	2	24.9 Å²	24.9	1%	0.012	14%	0.137	C	C	.	.	H	α-helix	trans	-61.2	-29.7	179.7	170.8	0	0	0	0	113.2	G251 L256 I281 L282 F304	G251-V278 WeakPolarHBondContact O-CG2 3.22Å; G251-V278 PolarHBondContact O-N 2.85Å; L256-V278 HydrophobicContact CD2-CG1 3.53Å; L256-V278 HydrophobicContact CG-CG1 4.01Å; L256-V278 HydrophobicContact CG-CG2 4.4Å; V278-I281 PolarHBondContact O-N 3.36Å; V278-L282 HydrophobicContact CG1-CD1 4.01Å; V278-L282 HydrophobicContact CG1-CG 4.33Å; V278-L282 WeakPolarHBondContact O-CG 3.47Å; V278-L282 PolarHBondContact O-N 2.83Å; V278-L282 VanDerWaalsContact O-N 3.1Å; V278-F304 HydrophobicContact CG2-CE2 4.15Å; V278-F304 HydrophobicContact CG2-CZ 4.18Å
279	A	87.9	Confident	84.9	Confident	0 Å²	0	27.6 Å²	27.6	0%	0	17%	0.167	C	C	.	.	H	α-helix	trans	-63.3	-48	-179.1	0	0	0	0	0	111.7	L248 I271 S275 G276 G277 I281 L282 V283	L248-A279 HydrophobicContact CD2-CB 4.14Å; L248-A279 HydrophobicContact CG-CB 4.21Å; I271-A279 HydrophobicContact CG2-CB 3.91Å; S275-A279 VanDerWaalsContact OG-CB 3.32Å; S275-A279 WeakPolarHBondContact OG-CB 3.19Å; G276-A279 PolarHBondContact O-N 3.01Å; G277-A279 PolarHBondContact O-N 3.25Å; A279-I281 VanDerWaalsContact C-N 3.35Å; A279-I281 PolarHBondContact O-N 2.94Å; A279-L282 PolarHBondContact O-N 3.04Å; A279-V283 WeakPolarHBondContact O-CG2 3.39Å; A279-V283 PolarHBondContact O-N 2.91Å
280	D	86.1	Confident	83.6	Confident	45 Å²	45	32.1 Å²	32.1	24%	0.241	20%	0.198	C	C	.	.	H	α-helix	trans	-70.8	-31.9	-178.8	-71.6	-1.3	0	0	0	112.1	G274 S275 G276 G277 V283 T284	G274-D280 VanDerWaalsContact CA-OD1 3.23Å; G274-D280 WeakPolarHBondContact CA-OD1 3.44Å; G274-D280 PolarHBondContact N-OD1 3.22Å; S275-D280 PolarHBondContact N-OD1 3.1Å; S275-D280 VanDerWaalsContact N-OD1 3.1Å; G276-D280 WeakPolarHBondContact CA-OD2 3.38Å; G276-D280 PolarHBondContact N-OD1 2.8Å; G276-D280 PolarHBondContact N-OD2 3.06Å; G277-D280 PolarHBondContact O-N 3.4Å; D280-V283 PolarHBondContact O-N 2.92Å; D280-T284 WeakPolarHBondContact O-CB 3.39Å; D280-T284 PolarHBondContact O-N 3.26Å; D280-T284 PolarHBondContact O-OG1 3.25Å
281	I	86.4	Confident	82.4	Confident	2 Å²	2	36 Å²	36	1%	0.01	21%	0.212	C	C	.	.	H	α-helix	trans	-58.1	-51.9	170.8	-69.2	172.9	0	0	0	109.9	G277 V278 A279 V283 T284 L285 L299 L300 T303 F304 I320	G277-I281 PolarHBondContact O-N 2.94Å; V278-I281 PolarHBondContact O-N 3.36Å; A279-I281 VanDerWaalsContact C-N 3.35Å; A279-I281 PolarHBondContact O-N 2.94Å; I281-V283 PolarHBondContact O-N 3.37Å; I281-T284 PolarHBondContact O-N 3.1Å; I281-L285 HydrophobicContact CG2-CD1 3.88Å; I281-L285 VanDerWaalsContact O-CG 3.23Å; I281-L285 WeakPolarHBondContact O-CG 3.22Å; I281-L285 PolarHBondContact O-N 2.87Å; I281-L299 HydrophobicContact CB-CD2 4.19Å; I281-L299 HydrophobicContact CG1-CD2 4.04Å; I281-L299 HydrophobicContact CG1-CG 4.14Å; I281-L299 HydrophobicContact CG2-CD2 4.1Å; I281-L300 HydrophobicContact CD1-CD2 3.78Å; I281-L300 HydrophobicContact CD1-CG 4.33Å; I281-T303 HydrophobicContact CD1-CG2 4.18Å; I281-F304 HydrophobicContact CD1-CE2 4Å; I281-I320 HydrophobicContact CG2-CD1 4.28Å
282	L	87.3	Confident	81.7	Confident	0 Å²	0	39.6 Å²	39.6	0%	0	23%	0.232	C	C	.	.	H	α-helix	trans	-62.7	-43.3	-179.9	-70.2	172.2	0	0	0	111.9	L248 M259 I271 V278 A279 T284 L285 M286 I320 I323 L324	L248-L282 HydrophobicContact CD2-CD1 4.05Å; M259-L282 HydrophobicContact CE-CD1 3.98Å; M259-L282 HydrophobicContact SD-CD1 3.83Å; I271-L282 HydrophobicContact CD1-CB 4.08Å; I271-L282 HydrophobicContact CD1-CD1 4.01Å; V278-L282 HydrophobicContact CG1-CD1 4.01Å; V278-L282 HydrophobicContact CG1-CG 4.33Å; V278-L282 WeakPolarHBondContact O-CG 3.47Å; V278-L282 PolarHBondContact O-N 2.83Å; V278-L282 VanDerWaalsContact O-N 3.1Å; A279-L282 PolarHBondContact O-N 3.04Å; L282-T284 PolarHBondContact O-N 3.48Å; L282-L285 PolarHBondContact O-N 2.91Å; L282-M286 WeakPolarHBondContact O-CB 3.31Å; L282-M286 VanDerWaalsContact O-CG 3.23Å; L282-M286 WeakPolarHBondContact O-CG 3.35Å; L282-M286 PolarHBondContact O-N 3.48Å; L282-I320 HydrophobicContact CD2-CG2 4.07Å; L282-I323 HydrophobicContact CD2-CG2 4.24Å; L282-L324 HydrophobicContact CD2-CD2 4.33Å
283	V	87.7	Confident	81	Confident	12 Å²	12	42.4 Å²	42.4	7%	0.073	26%	0.255	C	S	.	.	H	α-helix	trans	-62	-44.2	177.5	172	0	0	0	0	111.5	I271 A273 A279 D280 I281 L285 M286 N287 V332	I271-V283 HydrophobicContact CG2-CG2 3.73Å; A273-V283 HydrophobicContact CB-CG1 3.99Å; A273-V283 HydrophobicContact CB-CG2 4.12Å; A279-V283 WeakPolarHBondContact O-CG2 3.39Å; A279-V283 PolarHBondContact O-N 2.91Å; D280-V283 PolarHBondContact O-N 2.92Å; I281-V283 PolarHBondContact O-N 3.37Å; V283-L285 VanDerWaalsContact C-N 3.32Å; V283-L285 PolarHBondContact O-N 2.91Å; V283-M286 PolarHBondContact O-N 2.74Å; V283-N287 WeakPolarHBondContact O-CB 3.47Å; V283-N287 VanDerWaalsContact O-CG 3.31Å; V283-N287 PolarHBondContact O-N 3.43Å; V283-V332 HydrophobicContact CB-CG1 4.45Å; V283-V332 HydrophobicContact CG1-CG1 3.97Å; V283-V332 HydrophobicContact CG2-CG1 3.69Å; V283-V332 HydrophobicContact CG2-CG2 4.02Å
284	T	84.8	Confident	80.5	Confident	50 Å²	50	47.8 Å²	47.8	31%	0.307	28%	0.283	S	S	.	.	H	α-helix	trans	-61.2	-42.4	178.5	-56.1	0	0	0	0	111.2	D280 I281 L282 R288 L299	D280-T284 WeakPolarHBondContact O-CB 3.39Å; D280-T284 PolarHBondContact O-N 3.26Å; D280-T284 PolarHBondContact O-OG1 3.25Å; I281-T284 PolarHBondContact O-N 3.1Å; L282-T284 PolarHBondContact O-N 3.48Å; T284-R288 WeakPolarHBondContact O-CG 3.23Å; T284-R288 PolarHBondContact O-N 3.09Å; T284-R288 VanDerWaalsContact O-N 3.15Å; T284-L299 HydrophobicContact CG2-CD2 4.22Å
285	L	84.4	Confident	80.4	Confident	3 Å²	3	48 Å²	48	2%	0.016	28%	0.28	C	S	.	.	H	α-helix	trans	-69.9	-39.9	178.4	-64.7	170.3	0	0	0	112.3	I281 L282 V283 R288 G289 W291 V296 I320 L324	I281-L285 HydrophobicContact CG2-CD1 3.88Å; I281-L285 VanDerWaalsContact O-CG 3.23Å; I281-L285 WeakPolarHBondContact O-CG 3.22Å; I281-L285 PolarHBondContact O-N 2.87Å; L282-L285 PolarHBondContact O-N 2.91Å; V283-L285 VanDerWaalsContact C-N 3.32Å; V283-L285 PolarHBondContact O-N 2.91Å; L285-R288 PolarHBondContact O-N 2.88Å; L285-G289 PolarHBondContact O-N 3.39Å; L285-W291 HydrophobicContact CD2-CB 3.89Å; L285-V296 HydrophobicContact CD1-CG1 4.34Å; L285-V296 HydrophobicContact CD1-CG2 3.86Å; L285-V296 HydrophobicContact CD2-CG2 3.76Å; L285-V296 HydrophobicContact CG-CG2 4.49Å; L285-I320 HydrophobicContact CD1-CG2 3.74Å; L285-L324 HydrophobicContact CB-CD1 3.95Å; L285-L324 HydrophobicContact CD1-CD1 4.1Å
286	M	84	Confident	80.3	Confident	52 Å²	52	47.7 Å²	47.7	26%	0.256	28%	0.278	S	S	.	.	H	α-helix	trans	-64.6	-41.7	176.3	-73.5	178.9	70.8	0	0	112	I271 L282 V283 G289 L324 L330 V332	I271-M286 HydrophobicContact CD1-SD 4.28Å; L282-M286 WeakPolarHBondContact O-CB 3.31Å; L282-M286 VanDerWaalsContact O-CG 3.23Å; L282-M286 WeakPolarHBondContact O-CG 3.35Å; L282-M286 PolarHBondContact O-N 3.48Å; V283-M286 PolarHBondContact O-N 2.74Å; M286-G289 PolarHBondContact O-N 2.89Å; M286-L324 HydrophobicContact CG-CD2 3.66Å; M286-L330 HydrophobicContact CE-CB 3.65Å; M286-L330 HydrophobicContact CE-CD1 4.47Å; M286-L330 HydrophobicContact SD-CB 4Å; M286-L330 HydrophobicContact SD-CD1 4.03Å; M286-V332 HydrophobicContact CE-CG2 3.75Å; M286-V332 HydrophobicContact SD-CG2 3.69Å
287	N	82.1	Confident	80.2	Confident	127 Å²	127	50.4 Å²	50.4	68%	0.679	29%	0.286	S	S	*	.	H	α-helix	trans	-70.4	-31	179.5	-73.5	-13.3	0	0	0	112.9	V283 G289	V283-N287 WeakPolarHBondContact O-CB 3.47Å; V283-N287 VanDerWaalsContact O-CG 3.31Å; V283-N287 PolarHBondContact O-N 3.43Å; N287-G289 VanDerWaalsContact C-N 3.32Å
288	R	79.4	Confident	80	Confident	148 Å²	148	56.8 Å²	56.8	56%	0.558	31%	0.314	S	S	*	.	H	α-helix	trans	-70.9	-25.5	176.9	-79.1	-177.6	-179.8	-171.7	2.2	113.1	T284 L285 C290	T284-R288 WeakPolarHBondContact O-CG 3.23Å; T284-R288 PolarHBondContact O-N 3.09Å; T284-R288 VanDerWaalsContact O-N 3.15Å; L285-R288 PolarHBondContact O-N 2.88Å; R288-C290 PolarHBondContact O-N 3.32Å
289	G	67.4	Low	79.7	Confident	69 Å²	69	58.6 Å²	58.6	71%	0.711	32%	0.323	S	S	*	.	S	Bend	trans	69.8	-18.6	179.8	0	0	0	0	0	115.5	L285 M286 N287	L285-G289 PolarHBondContact O-N 3.39Å; M286-G289 PolarHBondContact O-N 2.89Å; N287-G289 VanDerWaalsContact C-N 3.32Å
290	C	63.9	Low	79.3	Confident	97 Å²	97	58.8 Å²	58.8	66%	0.655	33%	0.325	S	S	*	.			trans	-132.2	138.1	171.9	61.8	0	0	0	0	110.6	R288	R288-C290 PolarHBondContact O-N 3.32Å
291	W	69	Low	79	Confident	83 Å²	83	59.5 Å²	59.5	31%	0.314	33%	0.328	S	S	.	.			trans	-142.4	137.6	-177.9	47.1	-91.2	0	0	0	110.7	L285 V296 Q321 L324	L285-W291 HydrophobicContact CD2-CB 3.89Å; W291-V296 HydrophobicContact CB-CG2 4.49Å; W291-Q321 HydrophobicContact CH2-CB 3.8Å; W291-Q321 HydrophobicContact CH2-CG 3.42Å; W291-Q321 VanDerWaalsContact CH2-CG 3.42Å; W291-Q321 HydrophobicContact CZ2-CG 4.4Å; W291-Q321 HydrophobicContact CZ3-CB 3.84Å; W291-Q321 HydrophobicContact CZ3-CG 3.83Å; W291-L324 HydrophobicContact CD2-CD1 4.14Å; W291-L324 HydrophobicContact CG-CD1 4.1Å; W291-L324 HydrophobicContact CZ2-CB 4.39Å
292	D	76.6	Confident	78.6	Confident	76 Å²	76	65.9 Å²	65.9	41%	0.406	36%	0.362	S	S	.	.			trans	-113.1	152	174.1	58.5	-57.8	0	0	0	109.9	D294 S295 V296	D292-D294 PolarHBondContact O-N 2.98Å; D292-S295 VanDerWaalsContact CG-OG 3.22Å; D292-S295 PolarHBondContact O-N 3.42Å; D292-S295 WeakPolarHBondContact OD1-CB 3.3Å; D292-S295 PolarHBondContact OD1-OG 3.41Å; D292-S295 PolarHBondContact OD2-N 3.27Å; D292-S295 PolarHBondContact OD2-OG 3.41Å; D292-V296 WeakPolarHBondContact O-CG2 3.44Å; D292-V296 PolarHBondContact O-N 3.28Å; D292-V296 VanDerWaalsContact O-N 3.16Å
293	A	73.9	Confident	78.1	Confident	59 Å²	59	68.1 Å²	68.1	49%	0.488	38%	0.376	S	S	.	.	H	α-helix	trans	-59.5	-30.9	-177.4	0	0	0	0	0	112.1	H297 V317	A293-H297 WeakPolarHBondContact O-CB 3.1Å; A293-H297 PolarHBondContact O-N 2.89Å; A293-V317 HydrophobicContact CB-CG1 4.16Å
294	D	75.9	Confident	77.7	Confident	122 Å²	122	69.4 Å²	69.4	65%	0.652	38%	0.38	S	S	*	.	H	α-helix	trans	-74.2	-45.9	-178.6	-59.7	-33.8	0	0	0	111.1	D292 V296 H297 E298	D292-D294 PolarHBondContact O-N 2.98Å; D294-V296 VanDerWaalsContact C-N 3.32Å; D294-V296 PolarHBondContact O-N 2.89Å; D294-H297 WeakPolarHBondContact O-CA 3.43Å; D294-H297 VanDerWaalsContact O-CB 3.31Å; D294-H297 WeakPolarHBondContact O-CB 3.48Å; D294-H297 PolarHBondContact O-N 3.39Å; D294-H297 VanDerWaalsContact O-N 3.09Å; D294-E298 PolarHBondContact O-N 3.05Å
295	S	77.4	Confident	76.9	Confident	30 Å²	30	70.4 Å²	70.4	21%	0.21	39%	0.388	C	S	.	.	H	α-helix	trans	-59	-38.9	171.9	-69.4	0	0	0	0	113.5	D292 H297 L299	D292-S295 VanDerWaalsContact CG-OG 3.22Å; D292-S295 PolarHBondContact O-N 3.42Å; D292-S295 WeakPolarHBondContact OD1-CB 3.3Å; D292-S295 PolarHBondContact OD1-OG 3.41Å; D292-S295 PolarHBondContact OD2-N 3.27Å; D292-S295 PolarHBondContact OD2-OG 3.41Å; S295-H297 VanDerWaalsContact C-N 3.31Å; S295-L299 WeakPolarHBondContact O-CB 3.37Å; S295-L299 PolarHBondContact O-N 3.37Å
296	V	79.6	Confident	75.8	Confident	2 Å²	2	77.8 Å²	77.8	1%	0.012	43%	0.427	C	S	.	.	H	α-helix	trans	-68.1	-37.1	176.6	-178.4	0	0	0	0	110.4	L285 W291 D292 D294 L299 L300 V317 I320	L285-V296 HydrophobicContact CD1-CG1 4.34Å; L285-V296 HydrophobicContact CD1-CG2 3.86Å; L285-V296 HydrophobicContact CD2-CG2 3.76Å; L285-V296 HydrophobicContact CG-CG2 4.49Å; W291-V296 HydrophobicContact CB-CG2 4.49Å; D292-V296 WeakPolarHBondContact O-CG2 3.44Å; D292-V296 PolarHBondContact O-N 3.28Å; D292-V296 VanDerWaalsContact O-N 3.16Å; D294-V296 VanDerWaalsContact C-N 3.32Å; D294-V296 PolarHBondContact O-N 2.89Å; V296-L299 PolarHBondContact O-N 3.46Å; V296-L300 HydrophobicContact CG1-CD1 4.07Å; V296-L300 WeakPolarHBondContact O-CB 3.41Å; V296-L300 WeakPolarHBondContact O-CG 3.45Å; V296-L300 PolarHBondContact O-N 2.83Å; V296-V317 HydrophobicContact CB-CG1 4.49Å; V296-V317 HydrophobicContact CB-CG2 4.45Å; V296-V317 HydrophobicContact CG1-CG1 4.43Å; V296-V317 HydrophobicContact CG1-CG2 4.04Å; V296-I320 HydrophobicContact CG1-CD1 3.87Å; V296-I320 HydrophobicContact CG1-CG2 4.39Å
297	H	79.4	Confident	74.5	Confident	73 Å²	73	76.5 Å²	76.5	34%	0.338	43%	0.425	S	S	.	.	H	α-helix	trans	-63.3	-46.2	176.7	-163.9	79.3	0	0	0	111.5	A293 D294 S295 L300 L301 I313	A293-H297 WeakPolarHBondContact O-CB 3.1Å; A293-H297 PolarHBondContact O-N 2.89Å; D294-H297 WeakPolarHBondContact O-CA 3.43Å; D294-H297 VanDerWaalsContact O-CB 3.31Å; D294-H297 WeakPolarHBondContact O-CB 3.48Å; D294-H297 PolarHBondContact O-N 3.39Å; D294-H297 VanDerWaalsContact O-N 3.09Å; S295-H297 VanDerWaalsContact C-N 3.31Å; H297-L300 PolarHBondContact O-N 3.49Å; H297-L301 WeakPolarHBondContact O-CG 3.44Å; H297-L301 PolarHBondContact O-N 3.27Å; H297-L301 VanDerWaalsContact O-N 3.11Å; H297-I313 WeakPolarHBondContact CE1-CG2 3.15Å; H297-I313 WeakPolarHBondContact ND1-CG2 3.46Å
298	E	80	Confident	73	Confident	141 Å²	141	77.2 Å²	77.2	66%	0.659	42%	0.424	S	S	*	.	H	α-helix	trans	-61.5	-46.5	175.9	-72.3	-168.7	164.7	0	0	111.9	D294 L300 L301 D302	D294-E298 PolarHBondContact O-N 3.05Å; E298-L300 VanDerWaalsContact C-N 3.3Å; E298-L300 PolarHBondContact O-N 2.92Å; E298-L301 PolarHBondContact O-N 2.86Å; E298-L301 VanDerWaalsContact O-N 3.16Å; E298-D302 WeakPolarHBondContact O-CB 3.38Å; E298-D302 PolarHBondContact O-N 2.95Å
299	L	81.2	Confident	71.8	Confident	39 Å²	39	77.5 Å²	77.5	20%	0.204	43%	0.432	C	S	.	.	H	α-helix	trans	-65.2	-33.6	-178.2	-154.6	70.4	0	0	0	112.5	I281 T284 S295 V296 T303	I281-L299 HydrophobicContact CB-CD2 4.19Å; I281-L299 HydrophobicContact CG1-CD2 4.04Å; I281-L299 HydrophobicContact CG1-CG 4.14Å; I281-L299 HydrophobicContact CG2-CD2 4.1Å; T284-L299 HydrophobicContact CG2-CD2 4.22Å; S295-L299 WeakPolarHBondContact O-CB 3.37Å; S295-L299 PolarHBondContact O-N 3.37Å; V296-L299 PolarHBondContact O-N 3.46Å; L299-T303 WeakPolarHBondContact O-CB 3.44Å; L299-T303 PolarHBondContact O-N 2.91Å; L299-T303 VanDerWaalsContact O-N 3.1Å; L299-T303 PolarHBondContact O-OG1 3.34Å
300	L	79.4	Confident	71.2	Confident	5 Å²	5	79.1 Å²	79.1	3%	0.026	43%	0.432	C	S	.	.	H	α-helix	trans	-68.6	-40	173.9	-81.5	167.1	0	0	0	112.4	I281 V296 H297 E298 F304 I313 W316 V317 I320	I281-L300 HydrophobicContact CD1-CD2 3.78Å; I281-L300 HydrophobicContact CD1-CG 4.33Å; V296-L300 HydrophobicContact CG1-CD1 4.07Å; V296-L300 WeakPolarHBondContact O-CB 3.41Å; V296-L300 WeakPolarHBondContact O-CG 3.45Å; V296-L300 PolarHBondContact O-N 2.83Å; H297-L300 PolarHBondContact O-N 3.49Å; E298-L300 VanDerWaalsContact C-N 3.3Å; E298-L300 PolarHBondContact O-N 2.92Å; L300-F304 HydrophobicContact CD2-CD2 4.38Å; L300-F304 PolarHBondContact O-N 3.2Å; L300-I313 HydrophobicContact CD1-CG2 4.11Å; L300-W316 HydrophobicContact CD1-CB 4.24Å; L300-V317 HydrophobicContact CD1-CG2 3.98Å; L300-I320 HydrophobicContact CD1-CD1 4.13Å; L300-I320 HydrophobicContact CD2-CD1 4.38Å; L300-I320 HydrophobicContact CG-CD1 4.49Å
301	L	78.6	Confident	71	Confident	60 Å²	60	79.4 Å²	79.4	31%	0.314	43%	0.431	S	S	.	.	H	α-helix	trans	-69.1	-40.1	178.1	-74.6	171.1	0	0	0	112	H297 E298 I313	H297-L301 WeakPolarHBondContact O-CG 3.44Å; H297-L301 PolarHBondContact O-N 3.27Å; H297-L301 VanDerWaalsContact O-N 3.11Å; E298-L301 PolarHBondContact O-N 2.86Å; E298-L301 VanDerWaalsContact O-N 3.16Å; L301-I313 HydrophobicContact CD2-CD1 3.78Å
302	D	79.1	Confident	70.9	Confident	135 Å²	135	79.1 Å²	79.1	72%	0.722	44%	0.436	S	S	*	.	H	α-helix	trans	-65.8	-42	176.8	-170.7	52.9	0	0	0	111.6	E298	E298-D302 WeakPolarHBondContact O-CB 3.38Å; E298-D302 PolarHBondContact O-N 2.95Å
303	T	76.7	Confident	70.8	Confident	48 Å²	48	75.9 Å²	75.9	29%	0.294	42%	0.418	S	S	.	.	H	α-helix	trans	-77.1	-32	-178.2	-50.7	0	0	0	0	113	I281 L299	I281-T303 HydrophobicContact CD1-CG2 4.18Å; L299-T303 WeakPolarHBondContact O-CB 3.44Å; L299-T303 PolarHBondContact O-N 2.91Å; L299-T303 VanDerWaalsContact O-N 3.1Å; L299-T303 PolarHBondContact O-OG1 3.34Å
304	F	78.9	Confident	71	Confident	38 Å²	38	76.1 Å²	76.1	17%	0.167	42%	0.416	C	S	.	.			trans	-127.7	74.7	-176.4	-60.2	-75.3	0	0	0	112.7	G251 P253 V278 I281 L300 N306 A307	G251-F304 WeakPolarHBondContact O-CZ 3.27Å; P253-F304 HydrophobicContact CG-CD2 4Å; P253-F304 HydrophobicContact CG-CE2 4.01Å; P253-F304 HydrophobicContact CG-CG 4.26Å; P253-F304 HydrophobicContact CG-CZ 4.28Å; V278-F304 HydrophobicContact CG2-CE2 4.15Å; V278-F304 HydrophobicContact CG2-CZ 4.18Å; I281-F304 HydrophobicContact CD1-CE2 4Å; L300-F304 HydrophobicContact CD2-CD2 4.38Å; L300-F304 PolarHBondContact O-N 3.2Å; F304-N306 PolarHBondContact O-N 3.37Å; F304-A307 HydrophobicContact CB-CB 4.09Å; F304-A307 WeakPolarHBondContact O-CB 3.46Å; F304-A307 PolarHBondContact O-N 3.49Å
305	P	67.1	Low	71.3	Confident	71 Å²	71	74.1 Å²	74.1	46%	0.461	41%	0.406	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.6	-27.3	-178.4	21.3	-32	0	0	0	113.4	A307 H308	P305-A307 PolarHBondContact O-N 3.29Å; P305-H308 PolarHBondContact O-CD2 2.78Å; P305-H308 PolarHBondContact O-CE1 2.95Å; P305-H308 PolarHBondContact O-NE2 3.43Å
306	N	61.7	Low	71.6	Confident	158 Å²	158	74.8 Å²	74.8	85%	0.845	40%	0.404	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.9	0.3	-179.1	-63.9	-21.2	0	0	0	114.5	F304	F304-N306 PolarHBondContact O-N 3.37Å
307	A	57.3	Low	71.8	Confident	26 Å²	26	75.5 Å²	75.5	22%	0.215	41%	0.408	C	S	.	.			trans	-99.7	30.9	-171.8	0	0	0	0	0	114.5	F304 P305 H309 W316	F304-A307 HydrophobicContact CB-CB 4.09Å; F304-A307 WeakPolarHBondContact O-CB 3.46Å; F304-A307 PolarHBondContact O-N 3.49Å; P305-A307 PolarHBondContact O-N 3.29Å; A307-H309 PolarHBondContact O-N 3.18Å; A307-W316 HydrophobicContact CB-CH2 4.13Å; A307-W316 HydrophobicContact CB-CZ3 4.1Å
308	H	50.7	Low	72.1	Confident	142 Å²	142	78.1 Å²	78.1	66%	0.657	42%	0.418	S	S	*	.			trans	-66.1	12	-171.2	-67.2	-51	0	0	0	117.6	P305 S310	P305-H308 PolarHBondContact O-CD2 2.78Å; P305-H308 PolarHBondContact O-CE1 2.95Å; P305-H308 PolarHBondContact O-NE2 3.43Å; H308-S310 PolarHBondContact O-N 3.43Å
309	H	54.7	Low	72.4	Confident	154 Å²	154	73.5 Å²	73.5	71%	0.713	40%	0.398	S	S	*	.			trans	-86.2	111.1	174.8	-71.4	-59.3	0	0	0	111.1	A307 T311 D312	A307-H309 PolarHBondContact O-N 3.18Å; H309-T311 VanDerWaalsContact C-N 3.31Å; H309-T311 PolarHBondContact O-N 3.06Å; H309-T311 VanDerWaalsContact O-N 3.11Å; H309-D312 PolarHBondContact O-N 3.27Å
310	S	55.1	Low	72.7	Confident	103 Å²	103	71.8 Å²	71.8	72%	0.72	39%	0.389	S	S	*	.	H	α-helix	trans	-64.2	-15.8	-163	58.3	0	0	0	0	117.3	H308	H308-S310 PolarHBondContact O-N 3.43Å
311	T	57.7	Low	72.9	Confident	103 Å²	103	75.7 Å²	75.7	63%	0.632	41%	0.407	S	S	*	.	H	α-helix	trans	-83.4	-24.6	-177.1	47.7	0	0	0	0	114.4	H309 N315	H309-T311 VanDerWaalsContact C-N 3.31Å; H309-T311 PolarHBondContact O-N 3.06Å; H309-T311 VanDerWaalsContact O-N 3.11Å; T311-N315 PolarHBondContact O-ND2 3.02Å
312	D	67.9	Low	73.3	Confident	77 Å²	77	78.8 Å²	78.8	41%	0.412	42%	0.418	S	S	.	.	H	α-helix	trans	-86.5	-28.5	-175.7	-75.8	-24.6	0	0	0	113	H309 S314 N315 W316	H309-D312 PolarHBondContact O-N 3.27Å; D312-S314 PolarHBondContact O-N 3.43Å; D312-N315 WeakPolarHBondContact O-CB 3.43Å; D312-N315 PolarHBondContact O-N 2.89Å; D312-N315 VanDerWaalsContact O-N 3.16Å; D312-W316 HydrophobicContact CB-CD2 4.39Å; D312-W316 HydrophobicContact CB-CH2 3.81Å; D312-W316 HydrophobicContact CB-CZ2 3.47Å; D312-W316 VanDerWaalsContact CB-CZ2 3.47Å; D312-W316 HydrophobicContact CB-CZ3 4.41Å; D312-W316 VanDerWaalsContact O-CD2 3.29Å; D312-W316 VanDerWaalsContact O-CG 3.24Å; D312-W316 PolarHBondContact O-N 3.42Å
313	I	74.8	Confident	73.7	Confident	7 Å²	7	72.4 Å²	72.4	4%	0.036	38%	0.384	C	S	.	.	H	α-helix	trans	-65.3	-43.9	-178	-53.6	172.6	0	0	0	111.3	H297 L300 L301 N315 W316 V317	H297-I313 WeakPolarHBondContact CE1-CG2 3.15Å; H297-I313 WeakPolarHBondContact ND1-CG2 3.46Å; L300-I313 HydrophobicContact CD1-CG2 4.11Å; L301-I313 HydrophobicContact CD2-CD1 3.78Å; I313-N315 PolarHBondContact O-N 3.19Å; I313-W316 HydrophobicContact CB-CE3 4.24Å; I313-W316 HydrophobicContact CG1-CE3 3.96Å; I313-W316 HydrophobicContact CG1-CZ3 3.76Å; I313-W316 PolarHBondContact O-N 2.89Å; I313-W316 VanDerWaalsContact O-N 3.08Å; I313-V317 HydrophobicContact CG2-CG2 4.49Å; I313-V317 WeakPolarHBondContact O-CG2 3.42Å; I313-V317 PolarHBondContact O-N 2.86Å
314	S	78.8	Confident	74.2	Confident	64 Å²	64	71.1 Å²	71.1	45%	0.448	38%	0.375	S	S	.	.	H	α-helix	trans	-60.7	-35.2	175.7	-174.3	0	0	0	0	112.1	D312 K318	D312-S314 PolarHBondContact O-N 3.43Å; S314-K318 WeakPolarHBondContact O-CG 3.01Å; S314-K318 PolarHBondContact O-N 3.2Å
315	N	82.3	Confident	74.5	Confident	81 Å²	81	74.1 Å²	74.1	43%	0.433	39%	0.393	S	S	.	.	H	α-helix	trans	-69.4	-38.6	174.5	-70.4	-30.6	0	0	0	111.8	T311 D312 I313 K318 L319	T311-N315 PolarHBondContact O-ND2 3.02Å; D312-N315 WeakPolarHBondContact O-CB 3.43Å; D312-N315 PolarHBondContact O-N 2.89Å; D312-N315 VanDerWaalsContact O-N 3.16Å; I313-N315 PolarHBondContact O-N 3.19Å; N315-K318 PolarHBondContact O-N 2.88Å; N315-L319 VanDerWaalsContact O-CG 3.29Å; N315-L319 WeakPolarHBondContact O-CG 3.29Å; N315-L319 PolarHBondContact O-N 3.07Å; N315-L319 VanDerWaalsContact O-N 3.07Å
316	W	83.7	Confident	75.3	Confident	44 Å²	44	74 Å²	74	17%	0.167	39%	0.386	C	S	.	.	H	α-helix	trans	-66.4	-41	176.1	-59.4	-29.5	0	0	0	112.5	P253 L256 L300 A307 D312 I313 K318 L319 I320	P253-W316 HydrophobicContact CB-CD2 3.65Å; P253-W316 VanDerWaalsContact CB-CE2 3.49Å; P253-W316 HydrophobicContact CB-CE3 3.99Å; P253-W316 HydrophobicContact CB-CG 4.17Å; P253-W316 HydrophobicContact CB-CH2 4.11Å; P253-W316 HydrophobicContact CB-CZ2 3.74Å; P253-W316 HydrophobicContact CB-CZ3 4.21Å; P253-W316 HydrophobicContact CG-CD2 4.47Å; P253-W316 HydrophobicContact CG-CE3 4.32Å; P253-W316 HydrophobicContact CG-CH2 4.29Å; P253-W316 HydrophobicContact CG-CZ2 4.39Å; P253-W316 HydrophobicContact CG-CZ3 4.24Å; L256-W316 HydrophobicContact CD1-CB 3.98Å; L256-W316 HydrophobicContact CD1-CG 4.31Å; L300-W316 HydrophobicContact CD1-CB 4.24Å; A307-W316 HydrophobicContact CB-CH2 4.13Å; A307-W316 HydrophobicContact CB-CZ3 4.1Å; D312-W316 HydrophobicContact CB-CD2 4.39Å; D312-W316 HydrophobicContact CB-CH2 3.81Å; D312-W316 HydrophobicContact CB-CZ2 3.47Å; D312-W316 VanDerWaalsContact CB-CZ2 3.47Å; D312-W316 HydrophobicContact CB-CZ3 4.41Å; D312-W316 VanDerWaalsContact O-CD2 3.29Å; D312-W316 VanDerWaalsContact O-CG 3.24Å; D312-W316 PolarHBondContact O-N 3.42Å; I313-W316 HydrophobicContact CB-CE3 4.24Å; I313-W316 HydrophobicContact CG1-CE3 3.96Å; I313-W316 HydrophobicContact CG1-CZ3 3.76Å; I313-W316 PolarHBondContact O-N 2.89Å; I313-W316 VanDerWaalsContact O-N 3.08Å; W316-K318 VanDerWaalsContact C-N 3.34Å; W316-K318 PolarHBondContact O-N 2.86Å; W316-L319 PolarHBondContact O-N 3.49Å; W316-L319 VanDerWaalsContact O-N 3.14Å; W316-I320 WeakPolarHBondContact O-CG1 3.33Å; W316-I320 PolarHBondContact O-N 2.95Å
317	V	83.5	Confident	76.3	Confident	17 Å²	17	67.8 Å²	67.8	10%	0.103	36%	0.359	C	S	.	.	H	α-helix	trans	-58.1	-46.7	174.6	174.8	0	0	0	0	110.7	A293 V296 L300 I313 L319 I320 Q321	A293-V317 HydrophobicContact CB-CG1 4.16Å; V296-V317 HydrophobicContact CB-CG1 4.49Å; V296-V317 HydrophobicContact CB-CG2 4.45Å; V296-V317 HydrophobicContact CG1-CG1 4.43Å; V296-V317 HydrophobicContact CG1-CG2 4.04Å; L300-V317 HydrophobicContact CD1-CG2 3.98Å; I313-V317 HydrophobicContact CG2-CG2 4.49Å; I313-V317 WeakPolarHBondContact O-CG2 3.42Å; I313-V317 PolarHBondContact O-N 2.86Å; V317-L319 VanDerWaalsContact C-N 3.32Å; V317-L319 PolarHBondContact O-N 2.73Å; V317-I320 PolarHBondContact O-N 3.11Å; V317-Q321 PolarHBondContact O-N 3.43Å
318	K	84.3	Confident	77.6	Confident	128 Å²	128	69.7 Å²	69.7	56%	0.557	36%	0.363	S	S	*	.	H	α-helix	trans	-61.2	-37.7	175.7	-71.8	175.8	-176.4	174.4	0	113.1	S314 N315 W316 K322	S314-K318 WeakPolarHBondContact O-CG 3.01Å; S314-K318 PolarHBondContact O-N 3.2Å; N315-K318 PolarHBondContact O-N 2.88Å; W316-K318 VanDerWaalsContact C-N 3.34Å; W316-K318 PolarHBondContact O-N 2.86Å; K318-K322 PolarHBondContact O-N 2.87Å
319	L	87.3	Confident	79.4	Confident	44 Å²	44	63.1 Å²	63.1	23%	0.23	33%	0.333	C	S	.	.	H	α-helix	trans	-68.7	-41.4	177	-70.2	169.2	0	0	0	111.4	L256 K257 C260 N315 W316 V317 K322 I323	L256-L319 HydrophobicContact CB-CB 4.27Å; L256-L319 HydrophobicContact CB-CD1 4.27Å; K257-L319 HydrophobicContact CB-CD1 4.38Å; C260-L319 HydrophobicContact CB-CD2 4.05Å; C260-L319 WeakPolarHBondContact SG-CD2 3.36Å; C260-L319 PolarHBondContact SG-O 3.47Å; C260-L319 VanDerWaalsContact SG-O 3.41Å; N315-L319 VanDerWaalsContact O-CG 3.29Å; N315-L319 WeakPolarHBondContact O-CG 3.29Å; N315-L319 PolarHBondContact O-N 3.07Å; N315-L319 VanDerWaalsContact O-N 3.07Å; W316-L319 PolarHBondContact O-N 3.49Å; W316-L319 VanDerWaalsContact O-N 3.14Å; V317-L319 VanDerWaalsContact C-N 3.32Å; V317-L319 PolarHBondContact O-N 2.73Å; L319-K322 PolarHBondContact O-N 2.88Å; L319-I323 WeakPolarHBondContact O-CD1 3.32Å; L319-I323 VanDerWaalsContact O-CG1 3.23Å; L319-I323 WeakPolarHBondContact O-CG1 3.39Å; L319-I323 PolarHBondContact O-N 3.4Å
320	I	86.8	Confident	81.1	Confident	2 Å²	2	55.8 Å²	55.8	1%	0.01	30%	0.299	C	S	.	.	H	α-helix	trans	-62.8	-44.8	176.8	-70.1	168.3	0	0	0	110.6	L256 I281 L282 L285 V296 L300 W316 V317 K322 I323 L324	L256-I320 HydrophobicContact CD1-CD1 4.02Å; L256-I320 HydrophobicContact CD1-CG1 3.86Å; L256-I320 HydrophobicContact CD2-CD1 4.47Å; L256-I320 HydrophobicContact CD2-CG1 3.71Å; L256-I320 HydrophobicContact CG-CG1 4.44Å; I281-I320 HydrophobicContact CG2-CD1 4.28Å; L282-I320 HydrophobicContact CD2-CG2 4.07Å; L285-I320 HydrophobicContact CD1-CG2 3.74Å; V296-I320 HydrophobicContact CG1-CD1 3.87Å; V296-I320 HydrophobicContact CG1-CG2 4.39Å; L300-I320 HydrophobicContact CD1-CD1 4.13Å; L300-I320 HydrophobicContact CD2-CD1 4.38Å; L300-I320 HydrophobicContact CG-CD1 4.49Å; W316-I320 WeakPolarHBondContact O-CG1 3.33Å; W316-I320 PolarHBondContact O-N 2.95Å; V317-I320 PolarHBondContact O-N 3.11Å; I320-K322 PolarHBondContact O-N 3.19Å; I320-I323 WeakPolarHBondContact O-CB 3.42Å; I320-I323 PolarHBondContact O-N 2.86Å; I320-I323 VanDerWaalsContact O-N 3.11Å; I320-L324 HydrophobicContact CG2-CD1 3.81Å; I320-L324 HydrophobicContact CG2-CG 4.25Å; I320-L324 WeakPolarHBondContact O-CG 3.32Å; I320-L324 PolarHBondContact O-N 2.91Å
321	Q	84.4	Confident	82.7	Confident	88 Å²	88	51.7 Å²	51.7	41%	0.411	27%	0.27	S	S	.	.	H	α-helix	trans	-54	-52.1	174.4	164.8	159.7	33.3	0	0	111.5	W291 V317 I323 L324 D325	W291-Q321 HydrophobicContact CH2-CB 3.8Å; W291-Q321 HydrophobicContact CH2-CG 3.42Å; W291-Q321 VanDerWaalsContact CH2-CG 3.42Å; W291-Q321 HydrophobicContact CZ2-CG 4.4Å; W291-Q321 HydrophobicContact CZ3-CB 3.84Å; W291-Q321 HydrophobicContact CZ3-CG 3.83Å; V317-Q321 PolarHBondContact O-N 3.43Å; Q321-I323 PolarHBondContact O-N 3.39Å; Q321-L324 PolarHBondContact O-N 2.86Å; Q321-L324 VanDerWaalsContact O-N 3.12Å; Q321-D325 VanDerWaalsContact O-CG 3.24Å; Q321-D325 PolarHBondContact O-N 2.93Å
322	K	85.8	Confident	84.3	Confident	124 Å²	124	48.5 Å²	48.5	54%	0.539	25%	0.25	S	S	.	.	H	α-helix	trans	-60.4	-31.5	178.9	-170.5	174.3	-177.4	174.5	0	113.4	K318 L319 I320 H326	K318-K322 PolarHBondContact O-N 2.87Å; L319-K322 PolarHBondContact O-N 2.88Å; I320-K322 PolarHBondContact O-N 3.19Å; K322-H326 PolarHBondContact O-ND1 3.03Å
323	I	88.6	Confident	85.2	Confident	1 Å²	1	45 Å²	45	1%	0.005	23%	0.231	C	C	.	.	H	α-helix	trans	-70.1	-48.4	175.7	-71.7	160.2	0	0	0	110.3	L256 M259 I263 L282 L319 I320 Q321 D325 H326 L330	L256-I323 HydrophobicContact CB-CD1 4.49Å; L256-I323 HydrophobicContact CD2-CD1 3.72Å; M259-I323 HydrophobicContact CB-CD1 4.06Å; M259-I323 HydrophobicContact CE-CG2 3.61Å; M259-I323 HydrophobicContact CG-CD1 3.98Å; M259-I323 HydrophobicContact CG-CG1 4.22Å; M259-I323 HydrophobicContact SD-CD1 3.92Å; M259-I323 HydrophobicContact SD-CG1 4.44Å; M259-I323 HydrophobicContact SD-CG2 4.08Å; I263-I323 HydrophobicContact CD1-CB 4.03Å; I263-I323 HydrophobicContact CD1-CG1 3.8Å; I263-I323 HydrophobicContact CD1-CG2 3.78Å; L282-I323 HydrophobicContact CD2-CG2 4.24Å; L319-I323 WeakPolarHBondContact O-CD1 3.32Å; L319-I323 VanDerWaalsContact O-CG1 3.23Å; L319-I323 WeakPolarHBondContact O-CG1 3.39Å; L319-I323 PolarHBondContact O-N 3.4Å; I320-I323 WeakPolarHBondContact O-CB 3.42Å; I320-I323 PolarHBondContact O-N 2.86Å; I320-I323 VanDerWaalsContact O-N 3.11Å; Q321-I323 PolarHBondContact O-N 3.39Å; I323-D325 VanDerWaalsContact C-N 3.32Å; I323-D325 PolarHBondContact O-N 2.93Å; I323-H326 PolarHBondContact O-N 3.38Å; I323-H326 VanDerWaalsContact O-N 3.12Å; I323-L330 HydrophobicContact CG2-CD1 3.76Å; I323-L330 HydrophobicContact CG2-CD2 4.25Å
324	L	86.3	Confident	85.6	Confident	22 Å²	22	46.3 Å²	46.3	12%	0.115	24%	0.238	C	C	.	.	H	α-helix	trans	-67.6	-29.7	-177.2	-67.5	174.4	0	0	0	113	L282 L285 M286 W291 I320 Q321 H326 G327 L330	L282-L324 HydrophobicContact CD2-CD2 4.33Å; L285-L324 HydrophobicContact CB-CD1 3.95Å; L285-L324 HydrophobicContact CD1-CD1 4.1Å; M286-L324 HydrophobicContact CG-CD2 3.66Å; W291-L324 HydrophobicContact CD2-CD1 4.14Å; W291-L324 HydrophobicContact CG-CD1 4.1Å; W291-L324 HydrophobicContact CZ2-CB 4.39Å; I320-L324 HydrophobicContact CG2-CD1 3.81Å; I320-L324 HydrophobicContact CG2-CG 4.25Å; I320-L324 WeakPolarHBondContact O-CG 3.32Å; I320-L324 PolarHBondContact O-N 2.91Å; Q321-L324 PolarHBondContact O-N 2.86Å; Q321-L324 VanDerWaalsContact O-N 3.12Å; L324-H326 PolarHBondContact O-N 3.46Å; L324-H326 VanDerWaalsContact O-N 3.11Å; L324-G327 PolarHBondContact O-N 3.18Å; L324-G327 VanDerWaalsContact O-N 3.16Å; L324-L330 HydrophobicContact CD2-CD1 4.4Å
325	D	85.1	Confident	85.2	Confident	100 Å²	100	44.8 Å²	44.8	54%	0.535	23%	0.227	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56.9	-24.4	172.2	-66.1	-23.2	0	0	0	112.5	Q321 I323	Q321-D325 VanDerWaalsContact O-CG 3.24Å; Q321-D325 PolarHBondContact O-N 2.93Å; I323-D325 VanDerWaalsContact C-N 3.32Å; I323-D325 PolarHBondContact O-N 2.93Å
326	H	85.5	Confident	84.5	Confident	69 Å²	69	46.5 Å²	46.5	32%	0.319	23%	0.232	S	C	.	.	T	Hydrogen-bonded Turn	trans	-105.6	42.2	178.4	-59.6	78.4	0	0	0	112	I263 K322 I323 L324 H328 L329	I263-H326 HydrophobicContact CG2-CB 3.75Å; K322-H326 PolarHBondContact O-ND1 3.03Å; I323-H326 PolarHBondContact O-N 3.38Å; I323-H326 VanDerWaalsContact O-N 3.12Å; L324-H326 PolarHBondContact O-N 3.46Å; L324-H326 VanDerWaalsContact O-N 3.11Å; H326-H328 PolarHBondContact O-N 3.43Å; H326-L329 HydrophobicContact CB-CD1 4.49Å; H326-L329 PolarHBondContact O-N 3.04Å
327	G	82.6	Confident	83.6	Confident	27 Å²	27	50 Å²	50	28%	0.278	25%	0.25	S	S	.	.	G	3₁₀ helix	trans	-57.6	-18.2	-175.8	0	0	0	0	0	116	L324 L329 L330	L324-G327 PolarHBondContact O-N 3.18Å; L324-G327 VanDerWaalsContact O-N 3.16Å; G327-L329 VanDerWaalsContact C-N 3.33Å; G327-L329 PolarHBondContact O-N 3.45Å; G327-L330 PolarHBondContact O-N 3.01Å
328	H	83.8	Confident	82.6	Confident	66 Å²	66	53.4 Å²	53.4	31%	0.306	27%	0.265	S	S	.	.	G	3₁₀ helix	trans	-68.1	-28.9	174.5	60.3	-87.4	0	0	0	113.3	H326 L330 S356	H326-H328 PolarHBondContact O-N 3.43Å; H328-L330 VanDerWaalsContact C-N 3.31Å; H328-S356 VanDerWaalsContact CB-OG 3.24Å; H328-S356 WeakPolarHBondContact CB-OG 3.36Å; H328-S356 PolarHBondContact CD2-OG 3.19Å
329	L	88.1	Confident	81.5	Confident	4 Å²	4	51.4 Å²	51.4	2%	0.021	27%	0.267	C	S	.	.	G	3₁₀ helix	trans	-83.7	-7.1	174.7	-63.9	176.5	0	0	0	113	I263 W269 H326 G327 A353	I263-L329 HydrophobicContact CG2-CD1 4.13Å; W269-L329 PolarHBondContact N-O 2.93Å; H326-L329 HydrophobicContact CB-CD1 4.49Å; H326-L329 PolarHBondContact O-N 3.04Å; G327-L329 VanDerWaalsContact C-N 3.33Å; G327-L329 PolarHBondContact O-N 3.45Å; L329-A353 HydrophobicContact CD2-CB 3.75Å
330	L	90.3	Very high	80.7	Confident	0 Å²	0	51.6 Å²	51.6	0%	0	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	122.5	-177.5	-54.5	-177.9	0	0	0	109.9	M259 I263 W269 M286 I323 L324 G327 H328 K352	M259-L330 HydrophobicContact CE-CD2 3.4Å; I263-L330 HydrophobicContact CD1-CD2 4.28Å; W269-L330 HydrophobicContact CB-CD2 3.87Å; W269-L330 HydrophobicContact CG-CD2 4.47Å; M286-L330 HydrophobicContact CE-CB 3.65Å; M286-L330 HydrophobicContact CE-CD1 4.47Å; M286-L330 HydrophobicContact SD-CB 4Å; M286-L330 HydrophobicContact SD-CD1 4.03Å; I323-L330 HydrophobicContact CG2-CD1 3.76Å; I323-L330 HydrophobicContact CG2-CD2 4.25Å; L324-L330 HydrophobicContact CD2-CD1 4.4Å; G327-L330 PolarHBondContact O-N 3.01Å; H328-L330 VanDerWaalsContact C-N 3.31Å; L330-K352 PolarHBondContact O-NZ 3.07Å
331	T	90	Very high	80.2	Confident	17 Å²	17	55.9 Å²	55.9	10%	0.104	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120	128.1	173.6	-56.5	0	0	0	0	108.9	W269 L270 I271 A349	W269-T331 PolarHBondContact O-N 3.01Å; L270-T331 CarbonylContact C-O 3.58Å; L270-T331 WeakPolarHBondContact CA-O 3.49Å; L270-T331 HydrophobicContact CD1-CG2 4Å; I271-T331 PolarHBondContact N-O 2.98Å; T331-A349 HydrophobicContact CG2-CB 3.95Å; T331-A349 WeakPolarHBondContact OG1-CA 3.49Å; T331-A349 WeakPolarHBondContact OG1-CB 3.43Å
332	V	89.6	Confident	80.1	Confident	37 Å²	37	52 Å²	52	22%	0.224	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.4	133.9	176.4	177.5	0	0	0	0	107.8	A273 V283 M286	A273-V332 HydrophobicContact CB-CG1 4.07Å; V283-V332 HydrophobicContact CB-CG1 4.45Å; V283-V332 HydrophobicContact CG1-CG1 3.97Å; V283-V332 HydrophobicContact CG2-CG1 3.69Å; V283-V332 HydrophobicContact CG2-CG2 4.02Å; M286-V332 HydrophobicContact CE-CG2 3.75Å; M286-V332 HydrophobicContact SD-CG2 3.69Å
333	H	86.8	Confident	79.7	Confident	4 Å²	4	47 Å²	47	2%	0.019	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	123.5	171.4	179.1	50.2	0	0	0	109.6	L270 I271 L272 A273 P335 E338 V345	L270-H333 HydrophobicContact CD1-CB 3.95Å; I271-H333 PolarHBondContact O-N 3.41Å; L272-H333 HydrophobicContact CD2-CB 4.21Å; A273-H333 PolarHBondContact N-O 3.32Å; H333-P335 WeakPolarHBondContact O-CD 3.26Å; H333-E338 IonicContact CE1-OE2 3.15Å; H333-E338 IonicContact ND1-OE2 3.39Å; H333-E338 PolarHBondContact ND1-OE2 3.01Å; H333-E338 VanDerWaalsContact ND1-OE2 3.12Å; H333-V345 HydrophobicContact CB-CG1 3.75Å
334	D	83.4	Confident	79.4	Confident	33 Å²	33	47.3 Å²	47.3	18%	0.176	26%	0.256	C	S	.	.			trans	-104.6	98.7	172.5	-173.7	-13.9	0	0	0	109	A273 E336 Q337 E338	A273-D334 HydrophobicContact CB-CB 4.06Å; D334-E336 PolarHBondContact O-N 3.46Å; D334-E336 PolarHBondContact OD1-N 2.94Å; D334-Q337 HydrophobicContact CB-CB 4.28Å; D334-Q337 PolarHBondContact O-N 3.28Å; D334-Q337 PolarHBondContact OD1-N 3.28Å; D334-Q337 VanDerWaalsContact OD2-CG 3.31Å; D334-Q337 WeakPolarHBondContact OD2-CG 3.31Å; D334-Q337 PolarHBondContact OD2-NE2 3.39Å; D334-E338 WeakPolarHBondContact O-CB 3.43Å; D334-E338 PolarHBondContact O-N 3.44Å
335	P	71.7	Confident	79.4	Confident	32 Å²	32	46.7 Å²	46.7	21%	0.208	25%	0.252	C	S	.	.	T	Hydrogen-bonded Turn	trans	-71	-10	-178	26.5	-31.6	0	0	0	113.8	W104 H333	W104-P335 HydrophobicContact CD2-CG 4.48Å; W104-P335 HydrophobicContact CE3-CB 4.28Å; W104-P335 HydrophobicContact CE3-CG 3.48Å; W104-P335 VanDerWaalsContact CE3-CG 3.48Å; W104-P335 HydrophobicContact CH2-CG 3.87Å; W104-P335 HydrophobicContact CZ3-CB 4.33Å; W104-P335 HydrophobicContact CZ3-CG 3.15Å; H333-P335 WeakPolarHBondContact O-CD 3.26Å
336	E	66.7	Low	79.5	Confident	117 Å²	117	42 Å²	42	55%	0.547	23%	0.228	S	C	.	.	T	Hydrogen-bonded Turn	trans	-83.6	-33	172.7	-66.9	-177.9	167.6	0	0	111.2	W104 D334	W104-E336 PolarHBondContact NE1-OE1 3.44Å; D334-E336 PolarHBondContact O-N 3.46Å; D334-E336 PolarHBondContact OD1-N 2.94Å
337	Q	64.1	Low	79.4	Confident	117 Å²	117	38.8 Å²	38.8	55%	0.547	21%	0.213	S	C	.	.	T	Hydrogen-bonded Turn	trans	-94.4	-35	179.9	-65.3	-178.7	41	0	0	113.4	D334	D334-Q337 HydrophobicContact CB-CB 4.28Å; D334-Q337 PolarHBondContact O-N 3.28Å; D334-Q337 PolarHBondContact OD1-N 3.28Å; D334-Q337 VanDerWaalsContact OD2-CG 3.31Å; D334-Q337 WeakPolarHBondContact OD2-CG 3.31Å; D334-Q337 PolarHBondContact OD2-NE2 3.39Å
338	E	63.3	Low	79.5	Confident	90 Å²	90	41.7 Å²	41.7	42%	0.421	22%	0.217	S	C	.	.			trans	-105.7	112.2	-176.6	-64.9	-176.7	157.6	0	0	111.6	H333 D334 S340	H333-E338 IonicContact CE1-OE2 3.15Å; H333-E338 IonicContact ND1-OE2 3.39Å; H333-E338 PolarHBondContact ND1-OE2 3.01Å; H333-E338 VanDerWaalsContact ND1-OE2 3.12Å; D334-E338 WeakPolarHBondContact O-CB 3.43Å; D334-E338 PolarHBondContact O-N 3.44Å; E338-S340 PolarHBondContact O-N 3.19Å; E338-S340 VanDerWaalsContact O-N 3.1Å
339	S	61.8	Low	79.7	Confident	86 Å²	86	38.5 Å²	38.5	60%	0.601	20%	0.203	S	C	*	.			trans	-74.3	9.6	173.8	70.7	0	0	0	0	114.4	E341 K1111	S339-E341 PolarHBondContact O-N 2.9Å; S339-K1111 WeakPolarHBondContact OG-CE 3.44Å; S339-K1111 PolarHBondContact OG-NZ 2.83Å
340	S	69.5	Low	79.5	Confident	47 Å²	47	38.7 Å²	38.7	33%	0.329	20%	0.204	S	C	.	.			trans	-68.5	130.3	-178.7	-77.5	0	0	0	0	109.6	E338 T344	E338-S340 PolarHBondContact O-N 3.19Å; E338-S340 VanDerWaalsContact O-N 3.1Å; S340-T344 WeakPolarHBondContact CB-OG1 3.49Å
341	E	76.7	Confident	79.2	Confident	93 Å²	93	39 Å²	39	44%	0.435	21%	0.206	S	C	.	.			trans	-61.5	144.5	176.1	-64.2	-164.8	164.2	0	0	110.2	K115 S339 D343 T344 V345	K115-E341 IonicContact NZ-OE1 3.9Å; K115-E341 PolarHBondContact NZ-OE1 3.28Å; K115-E341 IonicContact NZ-OE2 2.66Å; K115-E341 PolarHBondContact NZ-OE2 3.5Å; S339-E341 PolarHBondContact O-N 2.9Å; E341-D343 WeakPolarHBondContact CB-OD1 3.5Å; E341-D343 PolarHBondContact O-N 3.13Å; E341-D343 VanDerWaalsContact O-N 3.13Å; E341-T344 HydrophobicContact CB-CG2 4.44Å; E341-T344 WeakPolarHBondContact O-CB 3.44Å; E341-T344 PolarHBondContact O-N 3.42Å; E341-T344 PolarHBondContact O-OG1 3.35Å; E341-V345 PolarHBondContact O-N 3.07Å
342	L	83	Confident	78.9	Confident	5 Å²	5	42.6 Å²	42.6	3%	0.026	22%	0.22	C	C	.	.	H	α-helix	trans	-60.7	-29.1	-172	-170.5	65.8	0	0	0	113.1	T108 L113 L270 T344 V345 I346	T108-L342 HydrophobicContact CG2-CD2 4.39Å; L113-L342 HydrophobicContact CB-CD2 3.73Å; L113-L342 HydrophobicContact CD1-CD2 4.24Å; L270-L342 HydrophobicContact CD2-CD1 3.98Å; L342-T344 VanDerWaalsContact C-N 3.34Å; L342-T344 PolarHBondContact O-N 3.14Å; L342-V345 PolarHBondContact O-N 3.45Å; L342-I346 HydrophobicContact CG-CD1 4.06Å; L342-I346 HydrophobicContact CG-CG1 4.41Å; L342-I346 WeakPolarHBondContact O-CB 3.29Å; L342-I346 WeakPolarHBondContact O-CD1 3.31Å; L342-I346 WeakPolarHBondContact O-CG1 3.35Å; L342-I346 PolarHBondContact O-N 3.49Å
343	D	76.1	Confident	78.5	Confident	19 Å²	19	41.1 Å²	41.1	10%	0.102	21%	0.211	C	C	.	.	H	α-helix	trans	-61.8	-38.8	174.1	62.6	-19.2	0	0	0	112.5	A116 E341 I346 L347 R376	A116-D343 HydrophobicContact CB-CB 3.7Å; E341-D343 WeakPolarHBondContact CB-OD1 3.5Å; E341-D343 PolarHBondContact O-N 3.13Å; E341-D343 VanDerWaalsContact O-N 3.13Å; D343-I346 PolarHBondContact O-N 3.01Å; D343-L347 PolarHBondContact O-N 3.05Å; D343-R376 IonicContact OD1-NH1 3.53Å; D343-R376 IonicContact OD2-NH1 2.78Å; D343-R376 PolarHBondContact OD2-NH1 3.48Å; D343-R376 VanDerWaalsContact OD2-NH1 3.09Å
344	T	82.3	Confident	77.8	Confident	9 Å²	9	42.2 Å²	42.2	6%	0.055	22%	0.22	C	C	.	.	H	α-helix	trans	-64.4	-44	174.9	64.6	0	0	0	0	112.1	S340 E341 L342 I346 L347 K348 I379	S340-T344 WeakPolarHBondContact CB-OG1 3.49Å; E341-T344 HydrophobicContact CB-CG2 4.44Å; E341-T344 WeakPolarHBondContact O-CB 3.44Å; E341-T344 PolarHBondContact O-N 3.42Å; E341-T344 PolarHBondContact O-OG1 3.35Å; L342-T344 VanDerWaalsContact C-N 3.34Å; L342-T344 PolarHBondContact O-N 3.14Å; T344-I346 VanDerWaalsContact C-N 3.31Å; T344-L347 PolarHBondContact O-N 3Å; T344-K348 WeakPolarHBondContact O-CB 3.36Å; T344-K348 WeakPolarHBondContact O-CG 3.18Å; T344-K348 PolarHBondContact O-N 3.02Å; T344-I379 HydrophobicContact CG2-CD1 4.24Å
345	V	86.2	Confident	77.1	Confident	8 Å²	8	46.1 Å²	46.1	5%	0.048	24%	0.235	C	C	.	.	H	α-helix	trans	-67.9	-38.8	-178.2	179.6	0	0	0	0	109.9	L270 H333 E341 L342 K348 A349	L270-V345 HydrophobicContact CD1-CG1 3.66Å; L270-V345 HydrophobicContact CD2-CG1 4.11Å; H333-V345 HydrophobicContact CB-CG1 3.75Å; E341-V345 PolarHBondContact O-N 3.07Å; L342-V345 PolarHBondContact O-N 3.45Å; V345-K348 PolarHBondContact O-N 2.94Å; V345-A349 WeakPolarHBondContact O-CB 3.38Å; V345-A349 PolarHBondContact O-N 3.1Å
346	I	87.8	Confident	76.7	Confident	3 Å²	3	47.4 Å²	47.4	2%	0.015	25%	0.245	C	C	.	.	H	α-helix	trans	-58.6	-50	172.6	-73.9	165.7	0	0	0	110.3	L88 A116 L245 L270 L342 D343 T344 K348 A349 L350 W374	L88-I346 HydrophobicContact CD1-CG2 4.43Å; L88-I346 HydrophobicContact CD2-CG2 3.78Å; A116-I346 HydrophobicContact CB-CD1 4.22Å; L245-I346 HydrophobicContact CD2-CB 4.13Å; L245-I346 HydrophobicContact CD2-CG1 3.69Å; L245-I346 HydrophobicContact CD2-CG2 3.91Å; L270-I346 HydrophobicContact CD2-CG1 3.94Å; L342-I346 HydrophobicContact CG-CD1 4.06Å; L342-I346 HydrophobicContact CG-CG1 4.41Å; L342-I346 WeakPolarHBondContact O-CB 3.29Å; L342-I346 WeakPolarHBondContact O-CD1 3.31Å; L342-I346 WeakPolarHBondContact O-CG1 3.35Å; L342-I346 PolarHBondContact O-N 3.49Å; D343-I346 PolarHBondContact O-N 3.01Å; T344-I346 VanDerWaalsContact C-N 3.31Å; I346-K348 PolarHBondContact O-N 3.12Å; I346-A349 WeakPolarHBondContact O-CB 3.4Å; I346-A349 PolarHBondContact O-N 2.99Å; I346-L350 HydrophobicContact CG2-CD1 4.37Å; I346-L350 WeakPolarHBondContact O-CG 3.33Å; I346-L350 PolarHBondContact O-N 2.79Å; I346-L350 VanDerWaalsContact O-N 3.09Å; I346-W374 HydrophobicContact CG2-CH2 3.96Å; I346-W374 HydrophobicContact CG2-CZ3 4.09Å
347	L	83.4	Confident	76.4	Confident	1 Å²	1	47.7 Å²	47.7	1%	0.005	25%	0.246	C	C	.	.	H	α-helix	trans	-63.9	-42.8	179.4	-168.1	60.6	0	0	0	111.5	D343 T344 A349 L350 V351 L370 A371 W374 R376 I379	D343-L347 PolarHBondContact O-N 3.05Å; T344-L347 PolarHBondContact O-N 3Å; L347-A349 VanDerWaalsContact C-N 3.3Å; L347-A349 PolarHBondContact O-N 3.1Å; L347-L350 WeakPolarHBondContact O-CB 3.42Å; L347-L350 PolarHBondContact O-N 2.83Å; L347-L350 VanDerWaalsContact O-N 3.15Å; L347-V351 HydrophobicContact CG-CG2 4.49Å; L347-V351 WeakPolarHBondContact O-CG2 3.5Å; L347-V351 PolarHBondContact O-N 3.19Å; L347-L370 HydrophobicContact CD1-CB 4.38Å; L347-A371 HydrophobicContact CD2-CB 4.18Å; L347-W374 HydrophobicContact CB-CE3 4.01Å; L347-W374 HydrophobicContact CB-CZ3 3.65Å; L347-W374 HydrophobicContact CD1-CE3 3.84Å; L347-W374 HydrophobicContact CD1-CH2 4.1Å; L347-W374 HydrophobicContact CD1-CZ3 3.65Å; L347-W374 HydrophobicContact CD2-CE3 4.17Å; L347-W374 HydrophobicContact CG-CE3 4.23Å; L347-W374 HydrophobicContact CG-CZ3 4.13Å; L347-R376 HydrophobicContact CD2-CB 3.95Å; L347-R376 HydrophobicContact CD2-CG 4.3Å; L347-I379 HydrophobicContact CB-CD1 3.96Å; L347-I379 HydrophobicContact CD2-CB 4.03Å; L347-I379 HydrophobicContact CD2-CD1 3.76Å; L347-I379 HydrophobicContact CD2-CG1 4.47Å; L347-I379 HydrophobicContact CD2-CG2 3.83Å; L347-I379 HydrophobicContact CG-CD1 4.29Å; L347-I379 HydrophobicContact CG-CG2 4.11Å
348	K	84.9	Confident	76.4	Confident	87 Å²	87	43.6 Å²	43.6	38%	0.378	23%	0.23	S	C	.	.	H	α-helix	trans	-59.5	-39.9	175.1	-75	-173.1	175.3	-161.8	0	112.7	T344 V345 I346 L350 V351 K352 D383	T344-K348 WeakPolarHBondContact O-CB 3.36Å; T344-K348 WeakPolarHBondContact O-CG 3.18Å; T344-K348 PolarHBondContact O-N 3.02Å; V345-K348 PolarHBondContact O-N 2.94Å; I346-K348 PolarHBondContact O-N 3.12Å; K348-L350 VanDerWaalsContact C-N 3.32Å; K348-V351 PolarHBondContact O-N 3Å; K348-K352 WeakPolarHBondContact O-CB 3.41Å; K348-K352 PolarHBondContact O-N 2.86Å; K348-D383 VanDerWaalsContact CE-OD2 3.29Å; K348-D383 WeakPolarHBondContact CE-OD2 3.27Å
349	A	87	Confident	76.5	Confident	0 Å²	0	46.6 Å²	46.6	0%	0	24%	0.244	C	C	.	.	H	α-helix	trans	-64.3	-38.4	176.8	0	0	0	0	0	111.8	L245 T331 V345 I346 L347 A353	L245-A349 HydrophobicContact CD1-CB 4.14Å; T331-A349 HydrophobicContact CG2-CB 3.95Å; T331-A349 WeakPolarHBondContact OG1-CA 3.49Å; T331-A349 WeakPolarHBondContact OG1-CB 3.43Å; V345-A349 WeakPolarHBondContact O-CB 3.38Å; V345-A349 PolarHBondContact O-N 3.1Å; I346-A349 WeakPolarHBondContact O-CB 3.4Å; I346-A349 PolarHBondContact O-N 2.99Å; L347-A349 VanDerWaalsContact C-N 3.3Å; L347-A349 PolarHBondContact O-N 3.1Å; A349-A353 WeakPolarHBondContact O-CB 3.42Å; A349-A353 PolarHBondContact O-N 3.02Å
350	L	85.8	Confident	77	Confident	8 Å²	8	48.8 Å²	48.8	4%	0.042	25%	0.245	C	C	.	.	H	α-helix	trans	-66.3	-51	174.8	-65.2	172.2	0	0	0	111.1	L88 P243 L245 P268 I346 L347 K348 K352 A353 C354 W374	L88-L350 HydrophobicContact CD1-CD1 3.98Å; P243-L350 HydrophobicContact CB-CD1 3.85Å; P243-L350 HydrophobicContact CB-CD2 3.86Å; P243-L350 HydrophobicContact CB-CG 4.49Å; P243-L350 HydrophobicContact CG-CD1 4.18Å; L245-L350 HydrophobicContact CB-CD2 4.47Å; L245-L350 HydrophobicContact CD1-CD2 4.44Å; P268-L350 HydrophobicContact CG-CD2 3.75Å; I346-L350 HydrophobicContact CG2-CD1 4.37Å; I346-L350 WeakPolarHBondContact O-CG 3.33Å; I346-L350 PolarHBondContact O-N 2.79Å; I346-L350 VanDerWaalsContact O-N 3.09Å; L347-L350 WeakPolarHBondContact O-CB 3.42Å; L347-L350 PolarHBondContact O-N 2.83Å; L347-L350 VanDerWaalsContact O-N 3.15Å; K348-L350 VanDerWaalsContact C-N 3.32Å; L350-K352 VanDerWaalsContact C-N 3.32Å; L350-K352 PolarHBondContact O-N 3.06Å; L350-A353 WeakPolarHBondContact O-CB 3.36Å; L350-A353 PolarHBondContact O-N 2.89Å; L350-A353 VanDerWaalsContact O-N 3.15Å; L350-C354 PolarHBondContact O-N 3.24Å; L350-C354 PolarHBondContact O-SG 3.31Å; L350-W374 HydrophobicContact CD1-CH2 3.86Å
351	V	82.8	Confident	77.1	Confident	6 Å²	6	47 Å²	47	4%	0.036	23%	0.233	C	C	.	.	H	α-helix	trans	-60.1	-41.3	179	175.8	0	0	0	0	111.6	L347 K348 A353 C354 K355 E367 D383 I384	L347-V351 HydrophobicContact CG-CG2 4.49Å; L347-V351 WeakPolarHBondContact O-CG2 3.5Å; L347-V351 PolarHBondContact O-N 3.19Å; K348-V351 PolarHBondContact O-N 3Å; V351-A353 VanDerWaalsContact C-N 3.34Å; V351-A353 PolarHBondContact O-N 3.1Å; V351-C354 PolarHBondContact O-N 3.03Å; V351-K355 PolarHBondContact O-N 2.83Å; V351-E367 HydrophobicContact CG2-CB 4.25Å; V351-E367 HydrophobicContact CG2-CG 4.33Å; V351-D383 HydrophobicContact CG1-CB 4.32Å; V351-I384 HydrophobicContact CG1-CG1 4.37Å
352	K	84.9	Confident	77.1	Confident	92 Å²	92	47.7 Å²	47.7	40%	0.4	24%	0.236	S	C	.	.	H	α-helix	trans	-61.4	-41.4	177	-176.7	-173.6	175.6	-168.3	0	112.2	L330 K348 L350 C354 K355	L330-K352 PolarHBondContact O-NZ 3.07Å; K348-K352 WeakPolarHBondContact O-CB 3.41Å; K348-K352 PolarHBondContact O-N 2.86Å; L350-K352 VanDerWaalsContact C-N 3.32Å; L350-K352 PolarHBondContact O-N 3.06Å; K352-C354 VanDerWaalsContact C-N 3.27Å; K352-C354 PolarHBondContact O-N 3.04Å; K352-K355 PolarHBondContact O-N 3.1Å
353	A	80.4	Confident	76.7	Confident	6 Å²	6	51.4 Å²	51.4	5%	0.05	26%	0.256	C	S	.	.	H	α-helix	trans	-63.3	-35.3	179.4	0	0	0	0	0	112	P268 L329 A349 L350 V351 S356	P268-A353 HydrophobicContact CB-CB 3.92Å; P268-A353 HydrophobicContact CG-CB 4.41Å; L329-A353 HydrophobicContact CD2-CB 3.75Å; A349-A353 WeakPolarHBondContact O-CB 3.42Å; A349-A353 PolarHBondContact O-N 3.02Å; L350-A353 WeakPolarHBondContact O-CB 3.36Å; L350-A353 PolarHBondContact O-N 2.89Å; L350-A353 VanDerWaalsContact O-N 3.15Å; V351-A353 VanDerWaalsContact C-N 3.34Å; V351-A353 PolarHBondContact O-N 3.1Å; A353-S356 PolarHBondContact O-OG 3.4Å
354	C	72.8	Confident	76.8	Confident	28 Å²	28	50.9 Å²	50.9	19%	0.189	25%	0.253	C	S	.	.	H	α-helix	trans	-79.1	-37.3	179.1	-58.9	0	0	0	0	112.5	L350 V351 K352 S356 Q357 E367	L350-C354 PolarHBondContact O-N 3.24Å; L350-C354 PolarHBondContact O-SG 3.31Å; V351-C354 PolarHBondContact O-N 3.03Å; K352-C354 VanDerWaalsContact C-N 3.27Å; K352-C354 PolarHBondContact O-N 3.04Å; C354-S356 PolarHBondContact O-N 3.36Å; C354-Q357 PolarHBondContact O-N 3.13Å; C354-E367 HydrophobicContact CB-CG 4.36Å; C354-E367 PolarHBondContact SG-OE1 2.96Å
355	K	67.3	Low	76.8	Confident	115 Å²	115	51 Å²	51	50%	0.5	25%	0.253	S	S	.	.	H	α-helix	trans	-54.1	-26.5	-179.7	-172.1	172	-177.7	170.8	0	114.9	V351 K352 F364	V351-K355 PolarHBondContact O-N 2.83Å; K352-K355 PolarHBondContact O-N 3.1Å; K355-F364 HydrophobicContact CB-CE1 4.18Å; K355-F364 HydrophobicContact CB-CZ 4.24Å; K355-F364 HydrophobicContact CG-CZ 4.32Å
356	S	64.2	Low	76.5	Confident	59 Å²	59	52.2 Å²	52.2	41%	0.413	26%	0.26	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.5	-12.6	178.7	51.3	0	0	0	0	115.3	H328 A353 C354	H328-S356 VanDerWaalsContact CB-OG 3.24Å; H328-S356 WeakPolarHBondContact CB-OG 3.36Å; H328-S356 PolarHBondContact CD2-OG 3.19Å; A353-S356 PolarHBondContact O-OG 3.4Å; C354-S356 PolarHBondContact O-N 3.36Å
357	Q	60.8	Low	76.3	Confident	123 Å²	123	53.1 Å²	53.1	58%	0.575	26%	0.264	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.2	-32.2	-177.5	-79.4	179.1	-7	0	0	112.7	C354	C354-Q357 PolarHBondContact O-N 3.13Å
358	S	63.3	Low	76.4	Confident	31 Å²	31	53.1 Å²	53.1	22%	0.217	26%	0.264	C	S	.	.			trans	-164.9	162	-176.5	-178.6	0	0	0	0	112.1	E360 D363	S358-E360 PolarHBondContact OG-N 3.18Å; S358-D363 WeakPolarHBondContact CB-OD2 3.48Å; S358-D363 PolarHBondContact OG-OD2 2.9Å
359	Q	66.4	Low	76.4	Confident	152 Å²	152	49.8 Å²	49.8	71%	0.71	25%	0.249	S	C	*	.			trans	-106.7	1.7	173.3	-69.3	-179.5	-26.7	0	0	112.4
360	E	71.8	Confident	76.1	Confident	132 Å²	132	50 Å²	50	62%	0.617	25%	0.25	S	S	*	.			trans	-79.3	138.4	-178.4	-63.3	-174.6	-175.4	0	0	111.6	S358 Q362 D363 F364	S358-E360 PolarHBondContact OG-N 3.18Å; E360-Q362 PolarHBondContact O-N 2.79Å; E360-D363 PolarHBondContact O-N 3.12Å; E360-F364 WeakPolarHBondContact O-CD2 3.39Å
361	A	71.8	Confident	76.1	Confident	10 Å²	10	49.6 Å²	49.6	8%	0.083	25%	0.248	C	C	.	.	G	3₁₀ helix	trans	-59.8	-30.5	-177.7	0	0	0	0	0	113.7	D363 F364 L365 V389 W391	A361-D363 VanDerWaalsContact C-N 3.26Å; A361-D363 PolarHBondContact O-N 3.09Å; A361-F364 PolarHBondContact O-N 3.31Å; A361-F364 VanDerWaalsContact O-N 3.12Å; A361-L365 PolarHBondContact O-N 3.33Å; A361-V389 HydrophobicContact CB-CG1 3.81Å; A361-W391 HydrophobicContact CB-CD2 4.38Å; A361-W391 HydrophobicContact CB-CE3 4.03Å; A361-W391 HydrophobicContact CB-CH2 4.45Å; A361-W391 HydrophobicContact CB-CZ3 4.08Å
362	Q	76.1	Confident	76.2	Confident	107 Å²	107	49.5 Å²	49.5	50%	0.5	25%	0.248	S	C	.	.	G	3₁₀ helix	trans	-62.3	-33.2	179.9	-69.5	-69.5	-36.7	0	0	112.5	E360 F364 L365 D395	E360-Q362 PolarHBondContact O-N 2.79Å; Q362-F364 PolarHBondContact O-N 2.98Å; Q362-L365 PolarHBondContact O-N 2.79Å; Q362-D395 PolarHBondContact NE2-OD1 2.86Å
363	D	75	Confident	76	Confident	83 Å²	83	45.5 Å²	45.5	44%	0.444	23%	0.232	S	C	.	.	G	3₁₀ helix	trans	-77.9	-9	179.4	-62.9	-40.3	0	0	0	113	S358 E360 A361	S358-D363 WeakPolarHBondContact CB-OD2 3.48Å; S358-D363 PolarHBondContact OG-OD2 2.9Å; E360-D363 PolarHBondContact O-N 3.12Å; A361-D363 VanDerWaalsContact C-N 3.26Å; A361-D363 PolarHBondContact O-N 3.09Å
364	F	78.8	Confident	75.9	Confident	9 Å²	9	46.5 Å²	46.5	4%	0.039	23%	0.234	C	C	.	.	G	3₁₀ helix	trans	-104	-3.4	173.8	-69	-87.3	0	0	0	113.1	K355 E360 A361 Q362 E367 L368 V389 W391	K355-F364 HydrophobicContact CB-CE1 4.18Å; K355-F364 HydrophobicContact CB-CZ 4.24Å; K355-F364 HydrophobicContact CG-CZ 4.32Å; E360-F364 WeakPolarHBondContact O-CD2 3.39Å; A361-F364 PolarHBondContact O-N 3.31Å; A361-F364 VanDerWaalsContact O-N 3.12Å; Q362-F364 PolarHBondContact O-N 2.98Å; F364-E367 WeakPolarHBondContact CA-OE2 3.44Å; F364-E367 PolarHBondContact O-N 3.36Å; F364-L368 WeakPolarHBondContact O-CB 3.2Å; F364-L368 PolarHBondContact O-N 3.33Å; F364-V389 HydrophobicContact CD2-CG2 4Å; F364-V389 HydrophobicContact CE2-CG2 3.69Å; F364-V389 HydrophobicContact CZ-CG2 4.18Å; F364-W391 HydrophobicContact CB-CH2 3.98Å; F364-W391 HydrophobicContact CB-CZ2 4.11Å
365	L	81.4	Confident	76.4	Confident	10 Å²	10	48.9 Å²	48.9	5%	0.052	25%	0.245	C	C	.	.	H	α-helix	trans	-66	-38.5	-176.5	-78.1	176.5	0	0	0	112.2	A361 Q362 E367 L368 K369 W391 D395	A361-L365 PolarHBondContact O-N 3.33Å; Q362-L365 PolarHBondContact O-N 2.79Å; L365-E367 VanDerWaalsContact C-N 3.34Å; L365-L368 PolarHBondContact O-N 2.85Å; L365-K369 WeakPolarHBondContact O-CB 3.46Å; L365-K369 VanDerWaalsContact O-CG 3.23Å; L365-K369 WeakPolarHBondContact O-CG 3.41Å; L365-K369 PolarHBondContact O-N 3.32Å; L365-W391 HydrophobicContact CD2-CH2 4.4Å; L365-W391 HydrophobicContact CD2-CZ3 3.79Å; L365-D395 WeakPolarHBondContact CD2-O 3.49Å
366	D	80.6	Confident	77.2	Confident	35 Å²	35	45.7 Å²	45.7	19%	0.187	23%	0.23	C	C	.	.	H	α-helix	trans	-67.8	-37	178.9	-82	1.5	0	0	0	110.9	F240 E241 K369 L370	F240-D366 HydrophobicContact CB-CB 4.06Å; E241-D366 PolarHBondContact N-OD2 3.01Å; D366-K369 PolarHBondContact O-N 2.8Å; D366-L370 WeakPolarHBondContact O-CB 3.42Å; D366-L370 VanDerWaalsContact O-CG 3.23Å; D366-L370 WeakPolarHBondContact O-CG 3.46Å; D366-L370 PolarHBondContact O-N 3.02Å
367	E	82.1	Confident	78.4	Confident	22 Å²	22	44.3 Å²	44.3	10%	0.103	22%	0.219	C	C	.	.	H	α-helix	trans	-68.4	-37.7	174.3	-69.3	63.8	-146.5	0	0	111.7	V351 C354 F364 L365 L370 A371 I384	V351-E367 HydrophobicContact CG2-CB 4.25Å; V351-E367 HydrophobicContact CG2-CG 4.33Å; C354-E367 HydrophobicContact CB-CG 4.36Å; C354-E367 PolarHBondContact SG-OE1 2.96Å; F364-E367 WeakPolarHBondContact CA-OE2 3.44Å; F364-E367 PolarHBondContact O-N 3.36Å; L365-E367 VanDerWaalsContact C-N 3.34Å; E367-L370 WeakPolarHBondContact O-CB 3.5Å; E367-L370 PolarHBondContact O-N 3.08Å; E367-A371 WeakPolarHBondContact O-CB 3.46Å; E367-A371 PolarHBondContact O-N 3.42Å; E367-I384 HydrophobicContact CB-CD1 4.47Å
368	L	86.3	Confident	79.5	Confident	0 Å²	0	42.3 Å²	42.3	0%	0	21%	0.213	C	C	.	.	H	α-helix	trans	-67.4	-43.1	174.2	-173.9	58.8	0	0	0	110.9	F364 L365 L370 A371 V372 A380 I384 F385 W391 L396 V399 F415	F364-L368 WeakPolarHBondContact O-CB 3.2Å; F364-L368 PolarHBondContact O-N 3.33Å; L365-L368 PolarHBondContact O-N 2.85Å; L368-L370 VanDerWaalsContact C-N 3.3Å; L368-L370 PolarHBondContact O-N 3.01Å; L368-A371 PolarHBondContact O-N 3.1Å; L368-V372 VanDerWaalsContact O-CG2 3.31Å; L368-V372 WeakPolarHBondContact O-CG2 3.15Å; L368-V372 PolarHBondContact O-N 2.86Å; L368-A380 HydrophobicContact CD1-CB 4.13Å; L368-I384 HydrophobicContact CB-CD1 4.35Å; L368-I384 HydrophobicContact CD1-CD1 4.12Å; L368-F385 HydrophobicContact CD1-CE2 4.01Å; L368-F385 HydrophobicContact CD1-CZ 4.42Å; L368-F385 HydrophobicContact CD2-CZ 4.23Å; L368-W391 HydrophobicContact CD2-CH2 3.97Å; L368-W391 HydrophobicContact CD2-CZ3 4.07Å; L368-L396 HydrophobicContact CD2-CD2 3.78Å; L368-V399 HydrophobicContact CD2-CB 4.46Å; L368-V399 HydrophobicContact CD2-CG1 4.31Å; L368-V399 HydrophobicContact CD2-CG2 3.92Å; L368-V399 HydrophobicContact CG-CG1 4.24Å; L368-F415 HydrophobicContact CD1-CE1 4.09Å; L368-F415 HydrophobicContact CD1-CZ 4.39Å; L368-F415 HydrophobicContact CD2-CE1 4.06Å; L368-F415 HydrophobicContact CD2-CZ 4.42Å; L368-F415 HydrophobicContact CG-CE1 4.38Å; L368-F415 HydrophobicContact CG-CZ 4.45Å
369	K	84.5	Confident	80.5	Confident	18 Å²	18	40.9 Å²	40.9	8%	0.078	20%	0.202	C	C	.	.	H	α-helix	trans	-58.6	-41.8	172.3	-73.7	171.2	-171	-178.9	0	111.2	F240 L365 D366 V372 A373 E398 V399	F240-K369 HydrophobicContact CB-CB 4.49Å; F240-K369 HydrophobicContact CB-CD 4.41Å; F240-K369 HydrophobicContact CD1-CB 4.16Å; L365-K369 WeakPolarHBondContact O-CB 3.46Å; L365-K369 VanDerWaalsContact O-CG 3.23Å; L365-K369 WeakPolarHBondContact O-CG 3.41Å; L365-K369 PolarHBondContact O-N 3.32Å; D366-K369 PolarHBondContact O-N 2.8Å; K369-V372 PolarHBondContact O-N 2.89Å; K369-A373 WeakPolarHBondContact O-CB 3.38Å; K369-A373 PolarHBondContact O-N 2.84Å; K369-E398 WeakPolarHBondContact CE-OE1 3.3Å; K369-E398 WeakPolarHBondContact CE-OE2 3.47Å; K369-E398 IonicContact NZ-OE1 2.77Å; K369-E398 PolarHBondContact NZ-OE1 2.83Å; K369-E398 IonicContact NZ-OE2 3.88Å; K369-E398 PolarHBondContact NZ-OE2 3.14Å; K369-V399 HydrophobicContact CG-CG1 3.54Å
370	L	81.7	Confident	81.4	Confident	3 Å²	3	33.7 Å²	33.7	2%	0.016	17%	0.169	C	C	.	.	H	α-helix	trans	-62.8	-45.1	173.9	-75.9	166.3	0	0	0	112	F240 P243 L347 D366 E367 L368 V372 A373 W374	F240-L370 HydrophobicContact CD2-CD2 3.71Å; F240-L370 HydrophobicContact CD2-CG 4.02Å; F240-L370 HydrophobicContact CE2-CD2 3.3Å; F240-L370 HydrophobicContact CE2-CG 4.1Å; F240-L370 HydrophobicContact CZ-CD2 3.84Å; P243-L370 HydrophobicContact CB-CD1 4.21Å; P243-L370 HydrophobicContact CG-CD1 3.72Å; P243-L370 HydrophobicContact CG-CD2 3.84Å; P243-L370 HydrophobicContact CG-CG 4.46Å; L347-L370 HydrophobicContact CD1-CB 4.38Å; D366-L370 WeakPolarHBondContact O-CB 3.42Å; D366-L370 VanDerWaalsContact O-CG 3.23Å; D366-L370 WeakPolarHBondContact O-CG 3.46Å; D366-L370 PolarHBondContact O-N 3.02Å; E367-L370 WeakPolarHBondContact O-CB 3.5Å; E367-L370 PolarHBondContact O-N 3.08Å; L368-L370 VanDerWaalsContact C-N 3.3Å; L368-L370 PolarHBondContact O-N 3.01Å; L370-V372 VanDerWaalsContact C-N 3.32Å; L370-V372 PolarHBondContact O-N 3.39Å; L370-A373 PolarHBondContact O-N 3.4Å; L370-W374 HydrophobicContact CD2-CZ2 4.21Å; L370-W374 WeakPolarHBondContact O-CB 3.42Å; L370-W374 VanDerWaalsContact O-CG 3.31Å; L370-W374 PolarHBondContact O-N 2.96Å
371	A	85.2	Confident	82.2	Confident	1 Å²	1	33.3 Å²	33.3	1%	0.008	17%	0.165	C	C	.	.	H	α-helix	trans	-61.5	-40.6	177.1	0	0	0	0	0	111.9	L347 E367 L368 W374 N375 R376 A380 I384 F411	L347-A371 HydrophobicContact CD2-CB 4.18Å; E367-A371 WeakPolarHBondContact O-CB 3.46Å; E367-A371 PolarHBondContact O-N 3.42Å; L368-A371 PolarHBondContact O-N 3.1Å; A371-W374 PolarHBondContact O-N 3.49Å; A371-N375 PolarHBondContact O-N 3.27Å; A371-R376 PolarHBondContact O-N 3.29Å; A371-A380 HydrophobicContact CB-CB 4.23Å; A371-I384 HydrophobicContact CB-CD1 4.43Å; A371-F411 VanDerWaalsContact C-CZ 3.46Å; A371-F411 HydrophobicContact CB-CE1 4.45Å; A371-F411 HydrophobicContact CB-CZ 4.18Å; A371-F411 WeakPolarHBondContact O-CE2 3.3Å; A371-F411 VanDerWaalsContact O-CZ 3.24Å; A371-F411 WeakPolarHBondContact O-CZ 3.47Å
372	V	85.8	Confident	82.8	Confident	4 Å²	4	35.3 Å²	35.3	2%	0.024	18%	0.179	C	C	.	.	H	α-helix	trans	-63.3	-48.4	174	172.8	0	0	0	0	110.7	L368 K369 L370 W374 N375 A403 F411 F415	L368-V372 VanDerWaalsContact O-CG2 3.31Å; L368-V372 WeakPolarHBondContact O-CG2 3.15Å; L368-V372 PolarHBondContact O-N 2.86Å; K369-V372 PolarHBondContact O-N 2.89Å; L370-V372 VanDerWaalsContact C-N 3.32Å; L370-V372 PolarHBondContact O-N 3.39Å; V372-W374 VanDerWaalsContact C-N 3.27Å; V372-W374 PolarHBondContact O-N 3.44Å; V372-N375 PolarHBondContact O-N 2.94Å; V372-N375 VanDerWaalsContact O-N 3.12Å; V372-A403 HydrophobicContact CG1-CB 4.27Å; V372-F411 HydrophobicContact CG2-CD1 3.62Å; V372-F411 HydrophobicContact CG2-CD2 4.38Å; V372-F411 HydrophobicContact CG2-CE1 3.72Å; V372-F411 HydrophobicContact CG2-CE2 4.49Å; V372-F411 HydrophobicContact CG2-CG 3.97Å; V372-F411 HydrophobicContact CG2-CZ 4.18Å; V372-F415 HydrophobicContact CG2-CE2 4.4Å; V372-F415 HydrophobicContact CG2-CZ 3.88Å
373	A	79.9	Confident	83	Confident	8 Å²	8	32.9 Å²	32.9	7%	0.066	17%	0.169	C	C	.	.	H	α-helix	trans	-60.1	-36.6	178.5	0	0	0	0	0	112.3	Y234 K369 L370 N375	Y234-A373 HydrophobicContact CD1-CB 3.85Å; Y234-A373 HydrophobicContact CD2-CB 3.85Å; Y234-A373 HydrophobicContact CE1-CB 4.14Å; Y234-A373 HydrophobicContact CE2-CB 4.12Å; Y234-A373 HydrophobicContact CG-CB 3.7Å; Y234-A373 PolarHBondContact OH-O 2.82Å; K369-A373 WeakPolarHBondContact O-CB 3.38Å; K369-A373 PolarHBondContact O-N 2.84Å; L370-A373 PolarHBondContact O-N 3.4Å; A373-N375 VanDerWaalsContact C-N 3.34Å
374	W	78.9	Confident	83.4	Confident	26 Å²	26	29 Å²	29	10%	0.098	15%	0.148	C	C	.	.	T	Hydrogen-bonded Turn	trans	-88.4	-1.3	-179.9	-62.4	6.8	0	0	0	113.5	L88 T120 I346 L347 L350 L370 A371 V372 R376	L88-W374 HydrophobicContact CB-CH2 4.49Å; L88-W374 HydrophobicContact CB-CZ2 3.89Å; L88-W374 HydrophobicContact CD1-CH2 4.13Å; L88-W374 HydrophobicContact CD1-CZ2 4.24Å; L88-W374 HydrophobicContact CD2-CH2 3.69Å; L88-W374 HydrophobicContact CD2-CZ2 3.88Å; L88-W374 HydrophobicContact CG-CH2 4.31Å; L88-W374 HydrophobicContact CG-CZ2 4.2Å; T120-W374 HydrophobicContact CG2-CD2 3.47Å; T120-W374 VanDerWaalsContact CG2-CD2 3.47Å; T120-W374 HydrophobicContact CG2-CE3 3.84Å; T120-W374 HydrophobicContact CG2-CG 3.85Å; T120-W374 HydrophobicContact CG2-CH2 4.36Å; T120-W374 HydrophobicContact CG2-CZ2 4.02Å; T120-W374 HydrophobicContact CG2-CZ3 4.23Å; I346-W374 HydrophobicContact CG2-CH2 3.96Å; I346-W374 HydrophobicContact CG2-CZ3 4.09Å; L347-W374 HydrophobicContact CB-CE3 4.01Å; L347-W374 HydrophobicContact CB-CZ3 3.65Å; L347-W374 HydrophobicContact CD1-CE3 3.84Å; L347-W374 HydrophobicContact CD1-CH2 4.1Å; L347-W374 HydrophobicContact CD1-CZ3 3.65Å; L347-W374 HydrophobicContact CD2-CE3 4.17Å; L347-W374 HydrophobicContact CG-CE3 4.23Å; L347-W374 HydrophobicContact CG-CZ3 4.13Å; L350-W374 HydrophobicContact CD1-CH2 3.86Å; L370-W374 HydrophobicContact CD2-CZ2 4.21Å; L370-W374 WeakPolarHBondContact O-CB 3.42Å; L370-W374 VanDerWaalsContact O-CG 3.31Å; L370-W374 PolarHBondContact O-N 2.96Å; A371-W374 PolarHBondContact O-N 3.49Å; V372-W374 VanDerWaalsContact C-N 3.27Å; V372-W374 PolarHBondContact O-N 3.44Å; W374-R376 VanDerWaalsContact C-N 3.33Å; W374-R376 HydrophobicContact CB-CG 4.06Å; W374-R376 PolarHBondContact O-N 3.47Å
375	N	82.6	Confident	83.7	Confident	79 Å²	79	29.5 Å²	29.5	42%	0.422	15%	0.151	S	C	.	.	T	Hydrogen-bonded Turn	trans	56.1	40.5	-176.7	-162.3	33.6	0	0	0	113.7	A371 V372 A373 K408	A371-N375 PolarHBondContact O-N 3.27Å; V372-N375 PolarHBondContact O-N 2.94Å; V372-N375 VanDerWaalsContact O-N 3.12Å; A373-N375 VanDerWaalsContact C-N 3.34Å; N375-K408 HydrophobicContact CB-CD 4.38Å; N375-K408 WeakPolarHBondContact OD1-CD 3.42Å
376	R	84.9	Confident	83.5	Confident	47 Å²	47	35.1 Å²	35.1	18%	0.177	18%	0.18	C	C	.	.			trans	-108	72.4	-178.6	-61.9	-53.1	-61.5	-130.3	12.9	112.3	D343 L347 A371 W374 D378 I379 A380	D343-R376 IonicContact OD1-NH1 3.53Å; D343-R376 IonicContact OD2-NH1 2.78Å; D343-R376 PolarHBondContact OD2-NH1 3.48Å; D343-R376 VanDerWaalsContact OD2-NH1 3.09Å; L347-R376 HydrophobicContact CD2-CB 3.95Å; L347-R376 HydrophobicContact CD2-CG 4.3Å; A371-R376 PolarHBondContact O-N 3.29Å; W374-R376 VanDerWaalsContact C-N 3.33Å; W374-R376 HydrophobicContact CB-CG 4.06Å; W374-R376 PolarHBondContact O-N 3.47Å; R376-D378 VanDerWaalsContact C-N 3.25Å; R376-D378 VanDerWaalsContact C-OD1 3.31Å; R376-D378 WeakPolarHBondContact CA-OD1 3.43Å; R376-D378 IonicContact CZ-OD1 3.44Å; R376-D378 IonicContact CZ-OD2 2.59Å; R376-D378 IonicContact NE-OD1 3.81Å; R376-D378 PolarHBondContact NE-OD1 3.37Å; R376-D378 VanDerWaalsContact NE-OD1 3.14Å; R376-D378 IonicContact NE-OD2 2.71Å; R376-D378 IonicContact NH2-OD1 3.7Å; R376-D378 IonicContact NH2-OD2 2.76Å; R376-D378 PolarHBondContact NH2-OD2 3.01Å; R376-D378 PolarHBondContact O-N 3.5Å; R376-I379 HydrophobicContact CB-CB 4.44Å; R376-I379 HydrophobicContact CB-CD1 4.24Å; R376-I379 HydrophobicContact CB-CG1 4.49Å; R376-I379 PolarHBondContact O-N 2.94Å; R376-A380 PolarHBondContact O-N 3.17Å
377	V	87.8	Confident	82.8	Confident	30 Å²	30	34.4 Å²	34.4	18%	0.182	18%	0.182	C	C	.	.	H	α-helix	trans	-64.4	-32.9	-179.8	-174.5	0	0	0	0	111.6	I379 A380 K381 D410 F411 L414	V377-I379 VanDerWaalsContact C-N 3.32Å; V377-I379 PolarHBondContact O-N 3.35Å; V377-A380 PolarHBondContact O-N 3.03Å; V377-K381 WeakPolarHBondContact O-CB 3.34Å; V377-K381 PolarHBondContact O-N 2.93Å; V377-D410 HydrophobicContact CG1-CB 4.33Å; V377-D410 HydrophobicContact CG2-CB 3.7Å; V377-F411 HydrophobicContact CB-CE2 4.23Å; V377-F411 HydrophobicContact CB-CZ 4.32Å; V377-F411 HydrophobicContact CG2-CD1 4.44Å; V377-F411 HydrophobicContact CG2-CD2 3.4Å; V377-F411 HydrophobicContact CG2-CE1 4.4Å; V377-F411 HydrophobicContact CG2-CE2 3.32Å; V377-F411 HydrophobicContact CG2-CG 3.98Å; V377-F411 HydrophobicContact CG2-CZ 3.87Å; V377-L414 HydrophobicContact CG1-CB 4.46Å; V377-L414 HydrophobicContact CG1-CD2 4Å
378	D	84.5	Confident	82.2	Confident	82 Å²	82	40.1 Å²	40.1	44%	0.439	21%	0.213	S	C	.	.	H	α-helix	trans	-57.1	-44.3	177.6	56.5	-31.1	0	0	0	112.2	R376 S382	R376-D378 VanDerWaalsContact C-N 3.25Å; R376-D378 VanDerWaalsContact C-OD1 3.31Å; R376-D378 WeakPolarHBondContact CA-OD1 3.43Å; R376-D378 IonicContact CZ-OD1 3.44Å; R376-D378 IonicContact CZ-OD2 2.59Å; R376-D378 IonicContact NE-OD1 3.81Å; R376-D378 PolarHBondContact NE-OD1 3.37Å; R376-D378 VanDerWaalsContact NE-OD1 3.14Å; R376-D378 IonicContact NE-OD2 2.71Å; R376-D378 IonicContact NH2-OD1 3.7Å; R376-D378 IonicContact NH2-OD2 2.76Å; R376-D378 PolarHBondContact NH2-OD2 3.01Å; R376-D378 PolarHBondContact O-N 3.5Å; D378-S382 WeakPolarHBondContact O-CB 3.32Å; D378-S382 PolarHBondContact O-N 3.33Å; D378-S382 PolarHBondContact O-OG 3.37Å
379	I	84.1	Confident	81.7	Confident	1 Å²	1	41 Å²	41	1%	0.005	22%	0.219	C	C	.	.	H	α-helix	trans	-75.3	-43.1	180	-62.6	173.9	0	0	0	110.4	T344 L347 R376 V377 K381 S382 D383	T344-I379 HydrophobicContact CG2-CD1 4.24Å; L347-I379 HydrophobicContact CB-CD1 3.96Å; L347-I379 HydrophobicContact CD2-CB 4.03Å; L347-I379 HydrophobicContact CD2-CD1 3.76Å; L347-I379 HydrophobicContact CD2-CG1 4.47Å; L347-I379 HydrophobicContact CD2-CG2 3.83Å; L347-I379 HydrophobicContact CG-CD1 4.29Å; L347-I379 HydrophobicContact CG-CG2 4.11Å; R376-I379 HydrophobicContact CB-CB 4.44Å; R376-I379 HydrophobicContact CB-CD1 4.24Å; R376-I379 HydrophobicContact CB-CG1 4.49Å; R376-I379 PolarHBondContact O-N 2.94Å; V377-I379 VanDerWaalsContact C-N 3.32Å; V377-I379 PolarHBondContact O-N 3.35Å; I379-K381 VanDerWaalsContact C-N 3.31Å; I379-K381 PolarHBondContact O-N 3.45Å; I379-S382 PolarHBondContact O-N 3.25Å; I379-D383 HydrophobicContact CG2-CB 4.33Å; I379-D383 WeakPolarHBondContact O-CB 3.45Å; I379-D383 PolarHBondContact O-N 2.85Å
380	A	86.6	Confident	81.4	Confident	0 Å²	0	48.6 Å²	48.6	0%	0	25%	0.254	C	S	.	.	I	π-helix	trans	-56.9	-46.8	175.1	0	0	0	0	0	111.5	L368 A371 R376 V377 I384 F385 F411 L414	L368-A380 HydrophobicContact CD1-CB 4.13Å; A371-A380 HydrophobicContact CB-CB 4.23Å; R376-A380 PolarHBondContact O-N 3.17Å; V377-A380 PolarHBondContact O-N 3.03Å; A380-I384 HydrophobicContact CB-CD1 4.43Å; A380-I384 WeakPolarHBondContact O-CA 3.16Å; A380-I384 WeakPolarHBondContact O-CB 3.05Å; A380-I384 PolarHBondContact O-N 2.99Å; A380-F385 WeakPolarHBondContact O-CD2 3.48Å; A380-F385 PolarHBondContact O-N 3.22Å; A380-F411 HydrophobicContact CB-CE1 3.64Å; A380-F411 HydrophobicContact CB-CZ 4.2Å; A380-L414 HydrophobicContact CB-CD2 3.99Å
381	K	87.9	Confident	81.5	Confident	124 Å²	124	50.3 Å²	50.3	54%	0.539	26%	0.261	S	S	.	.	I	π-helix	trans	-65.2	-45	178.9	-172.6	172.6	-176	169.2	0	112.7	V377 I379 N386 L414	V377-K381 WeakPolarHBondContact O-CB 3.34Å; V377-K381 PolarHBondContact O-N 2.93Å; I379-K381 VanDerWaalsContact C-N 3.31Å; I379-K381 PolarHBondContact O-N 3.45Å; K381-N386 VanDerWaalsContact O-CG 3.23Å; K381-N386 PolarHBondContact O-N 2.58Å; K381-N386 PolarHBondContact O-ND2 2.98Å; K381-N386 PolarHBondContact O-OD1 3.13Å; K381-L414 HydrophobicContact CB-CD1 4Å; K381-L414 HydrophobicContact CB-CD2 4.32Å; K381-L414 HydrophobicContact CD-CD1 4.16Å; K381-L414 HydrophobicContact CG-CD1 3.95Å
382	S	84.8	Confident	81.5	Confident	53 Å²	53	57 Å²	57	37%	0.371	29%	0.289	S	S	.	.	I	π-helix	trans	-84.2	-32.3	-172	57.7	0	0	0	0	115.3	D378 I379 N386	D378-S382 WeakPolarHBondContact O-CB 3.32Å; D378-S382 PolarHBondContact O-N 3.33Å; D378-S382 PolarHBondContact O-OG 3.37Å; I379-S382 PolarHBondContact O-N 3.25Å; S382-N386 WeakPolarHBondContact O-CB 3.46Å
383	D	79.7	Confident	81.3	Confident	56 Å²	56	58.8 Å²	58.8	30%	0.299	31%	0.305	S	S	.	.	I	π-helix	trans	-113.2	-28.4	-171.9	-66.1	-42.8	0	0	0	113.1	K348 V351 I379	K348-D383 VanDerWaalsContact CE-OD2 3.29Å; K348-D383 WeakPolarHBondContact CE-OD2 3.27Å; V351-D383 HydrophobicContact CG1-CB 4.32Å; I379-D383 HydrophobicContact CG2-CB 4.33Å; I379-D383 WeakPolarHBondContact O-CB 3.45Å; I379-D383 PolarHBondContact O-N 2.85Å
384	I	83.8	Confident	81.5	Confident	2 Å²	2	62.2 Å²	62.2	1%	0.01	33%	0.327	C	S	.	.	I	π-helix	trans	-95.4	-54.4	-179.9	-55.8	179	0	0	0	111.2	V351 E367 L368 A371 A380 W391	V351-I384 HydrophobicContact CG1-CG1 4.37Å; E367-I384 HydrophobicContact CB-CD1 4.47Å; L368-I384 HydrophobicContact CB-CD1 4.35Å; L368-I384 HydrophobicContact CD1-CD1 4.12Å; A371-I384 HydrophobicContact CB-CD1 4.43Å; A380-I384 HydrophobicContact CB-CD1 4.43Å; A380-I384 WeakPolarHBondContact O-CA 3.16Å; A380-I384 WeakPolarHBondContact O-CB 3.05Å; A380-I384 PolarHBondContact O-N 2.99Å; I384-W391 HydrophobicContact CG2-CH2 4.29Å; I384-W391 HydrophobicContact CG2-CZ2 3.48Å; I384-W391 VanDerWaalsContact CG2-CZ2 3.48Å
385	F	84.2	Confident	81.8	Confident	19 Å²	19	62.3 Å²	62.3	8%	0.083	33%	0.329	C	S	.	.	I	π-helix	trans	-81.4	-26.1	-176.3	-75	-73.1	0	0	0	114.5	L368 A380 G387 W391 L396 L414 F415 N418	L368-F385 HydrophobicContact CD1-CE2 4.01Å; L368-F385 HydrophobicContact CD1-CZ 4.42Å; L368-F385 HydrophobicContact CD2-CZ 4.23Å; A380-F385 WeakPolarHBondContact O-CD2 3.48Å; A380-F385 PolarHBondContact O-N 3.22Å; F385-G387 PolarHBondContact O-N 2.79Å; F385-W391 AromaticContact CD1-CD1 3.78Å; F385-W391 HydrophobicContact CD1-CG 4.32Å; F385-W391 AromaticContact CD1-NE1 3.81Å; F385-W391 AromaticContact CE1-CD1 3.92Å; F385-W391 HydrophobicContact CE1-CD2 4.14Å; F385-W391 HydrophobicContact CE1-CG 4.01Å; F385-W391 AromaticContact CE1-NE1 3.99Å; F385-L396 HydrophobicContact CE1-CD1 4.41Å; F385-L396 HydrophobicContact CE1-CD2 4.33Å; F385-L396 HydrophobicContact CZ-CD2 4.14Å; F385-L414 HydrophobicContact CD2-CD1 4.38Å; F385-L414 HydrophobicContact CD2-CD2 3.71Å; F385-L414 HydrophobicContact CD2-CG 4.04Å; F385-L414 HydrophobicContact CE2-CD2 3.66Å; F385-L414 HydrophobicContact CE2-CG 3.98Å; F385-F415 HydrophobicContact CE2-CD1 4.18Å; F385-F415 AromaticContact CE2-CE1 3.96Å; F385-F415 HydrophobicContact CE2-CE1 3.96Å; F385-F415 AromaticContact CZ-CD1 3.75Å; F385-F415 HydrophobicContact CZ-CD1 3.75Å; F385-F415 AromaticContact CZ-CE1 3.77Å; F385-F415 HydrophobicContact CZ-CE1 3.77Å; F385-N418 HydrophobicContact CD1-CB 4.01Å; F385-N418 HydrophobicContact CE1-CB 3.95Å
386	N	76.8	Confident	82	Confident	127 Å²	127	58.6 Å²	58.6	68%	0.679	31%	0.31	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.2	3.8	174.6	-80.9	-9.4	0	0	0	113.5	K381 S382	K381-N386 VanDerWaalsContact O-CG 3.23Å; K381-N386 PolarHBondContact O-N 2.58Å; K381-N386 PolarHBondContact O-ND2 2.98Å; K381-N386 PolarHBondContact O-OD1 3.13Å; S382-N386 WeakPolarHBondContact O-CB 3.46Å
387	G	67.1	Low	82.1	Confident	21 Å²	21	58.9 Å²	58.9	22%	0.216	31%	0.313	C	S	.	.	S	Bend	trans	-81.5	178.2	176.8	0	0	0	0	0	113.3	F385 V389	F385-G387 PolarHBondContact O-N 2.79Å; G387-V389 PolarHBondContact O-N 3.34Å
388	D	68.5	Low	82	Confident	141 Å²	141	60.9 Å²	60.9	75%	0.754	32%	0.32	S	S	*	.	S	Bend	trans	-76.3	23.2	176.4	-54.8	-53.4	0	0	0	113.1
389	V	76.7	Confident	82.2	Confident	20 Å²	20	57 Å²	57	12%	0.121	30%	0.3	C	S	.	.			trans	-96.1	121.2	-173.8	-178	0	0	0	0	109.9	A361 F364 G387 W391	A361-V389 HydrophobicContact CB-CG1 3.81Å; F364-V389 HydrophobicContact CD2-CG2 4Å; F364-V389 HydrophobicContact CE2-CG2 3.69Å; F364-V389 HydrophobicContact CZ-CG2 4.18Å; G387-V389 PolarHBondContact O-N 3.34Å; V389-W391 HydrophobicContact CG1-CD2 4.46Å; V389-W391 HydrophobicContact CG1-CZ2 4.2Å; V389-W391 PolarHBondContact O-N 3.12Å
390	E	78.4	Confident	82.5	Confident	177 Å²	177	57 Å²	57	83%	0.827	30%	0.3	S	S	*	.			trans	-84.4	111.2	172.7	-67.7	-173	172.9	0	0	110.6
391	W	84.2	Confident	82.7	Confident	39 Å²	39	57.9 Å²	57.9	15%	0.148	30%	0.304	C	S	.	.			trans	-88.1	132.6	177.4	-67.3	89.5	0	0	0	111.4	A361 F364 L365 L368 I384 F385 V389 D395 L396	A361-W391 HydrophobicContact CB-CD2 4.38Å; A361-W391 HydrophobicContact CB-CE3 4.03Å; A361-W391 HydrophobicContact CB-CH2 4.45Å; A361-W391 HydrophobicContact CB-CZ3 4.08Å; F364-W391 HydrophobicContact CB-CH2 3.98Å; F364-W391 HydrophobicContact CB-CZ2 4.11Å; L365-W391 HydrophobicContact CD2-CH2 4.4Å; L365-W391 HydrophobicContact CD2-CZ3 3.79Å; L368-W391 HydrophobicContact CD2-CH2 3.97Å; L368-W391 HydrophobicContact CD2-CZ3 4.07Å; I384-W391 HydrophobicContact CG2-CH2 4.29Å; I384-W391 HydrophobicContact CG2-CZ2 3.48Å; I384-W391 VanDerWaalsContact CG2-CZ2 3.48Å; F385-W391 AromaticContact CD1-CD1 3.78Å; F385-W391 HydrophobicContact CD1-CG 4.32Å; F385-W391 AromaticContact CD1-NE1 3.81Å; F385-W391 AromaticContact CE1-CD1 3.92Å; F385-W391 HydrophobicContact CE1-CD2 4.14Å; F385-W391 HydrophobicContact CE1-CG 4.01Å; F385-W391 AromaticContact CE1-NE1 3.99Å; V389-W391 HydrophobicContact CG1-CD2 4.46Å; V389-W391 HydrophobicContact CG1-CZ2 4.2Å; V389-W391 PolarHBondContact O-N 3.12Å; W391-D395 HydrophobicContact CE3-CB 4.39Å; W391-L396 HydrophobicContact CB-CD1 4.32Å; W391-L396 HydrophobicContact CD2-CD2 4.15Å; W391-L396 HydrophobicContact CE3-CD2 3.48Å; W391-L396 VanDerWaalsContact CE3-CD2 3.48Å; W391-L396 HydrophobicContact CE3-CG 4.09Å; W391-L396 HydrophobicContact CZ3-CD2 3.88Å
392	K	83.9	Confident	82.6	Confident	141 Å²	141	52.5 Å²	52.5	61%	0.613	28%	0.281	S	S	*	.			trans	-99.1	152.2	168.1	-58.9	173	-176.4	167.5	0	110	C394 D395	K392-C394 PolarHBondContact O-N 2.94Å; K392-D395 WeakPolarHBondContact CB-OD2 3.24Å; K392-D395 PolarHBondContact N-OD2 3.42Å; K392-D395 PolarHBondContact O-N 3.3Å
393	A	82.5	Confident	82.9	Confident	42 Å²	42	50 Å²	50	35%	0.347	26%	0.264	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.5	-35.2	178.6	0	0	0	0	0	112.9	D395 L396 E397	A393-D395 VanDerWaalsContact C-N 3.34Å; A393-D395 PolarHBondContact O-N 3.43Å; A393-L396 PolarHBondContact O-N 3.24Å; A393-E397 VanDerWaalsContact O-CG 3.27Å; A393-E397 WeakPolarHBondContact O-CG 3.37Å
394	C	83.9	Confident	83.5	Confident	79 Å²	79	47.3 Å²	47.3	53%	0.534	25%	0.249	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.1	-32.5	177.6	55.4	0	0	0	0	113.8	K392 L396	K392-C394 PolarHBondContact O-N 2.94Å; C394-L396 VanDerWaalsContact C-N 3.27Å; C394-L396 PolarHBondContact O-N 3.43Å
395	D	84.5	Confident	83.7	Confident	28 Å²	28	48.2 Å²	48.2	15%	0.15	25%	0.254	C	S	.	.	T	Hydrogen-bonded Turn	trans	-72	-27.7	-179.9	-57.3	-45.7	0	0	0	111	Q362 L365 W391 K392 A393	Q362-D395 PolarHBondContact NE2-OD1 2.86Å; L365-D395 WeakPolarHBondContact CD2-O 3.49Å; W391-D395 HydrophobicContact CE3-CB 4.39Å; K392-D395 WeakPolarHBondContact CB-OD2 3.24Å; K392-D395 PolarHBondContact N-OD2 3.42Å; K392-D395 PolarHBondContact O-N 3.3Å; A393-D395 VanDerWaalsContact C-N 3.34Å; A393-D395 PolarHBondContact O-N 3.43Å
396	L	87.8	Confident	83.8	Confident	1 Å²	1	49.1 Å²	49.1	1%	0.005	26%	0.259	C	S	.	.	T	Hydrogen-bonded Turn	trans	-90.1	-5.2	-176.8	-63.4	176.9	0	0	0	114	L368 F385 W391 A393 C394 E398 V399 M400 F415 V420	L368-L396 HydrophobicContact CD2-CD2 3.78Å; F385-L396 HydrophobicContact CE1-CD1 4.41Å; F385-L396 HydrophobicContact CE1-CD2 4.33Å; F385-L396 HydrophobicContact CZ-CD2 4.14Å; W391-L396 HydrophobicContact CB-CD1 4.32Å; W391-L396 HydrophobicContact CD2-CD2 4.15Å; W391-L396 HydrophobicContact CE3-CD2 3.48Å; W391-L396 VanDerWaalsContact CE3-CD2 3.48Å; W391-L396 HydrophobicContact CE3-CG 4.09Å; W391-L396 HydrophobicContact CZ3-CD2 3.88Å; A393-L396 PolarHBondContact O-N 3.24Å; C394-L396 VanDerWaalsContact C-N 3.27Å; C394-L396 PolarHBondContact O-N 3.43Å; L396-E398 PolarHBondContact O-N 3.28Å; L396-V399 HydrophobicContact CB-CG2 4.26Å; L396-V399 HydrophobicContact CD2-CG2 4.01Å; L396-V399 WeakPolarHBondContact O-CG2 3.28Å; L396-M400 WeakPolarHBondContact O-CB 3.45Å; L396-M400 PolarHBondContact O-N 2.9Å; L396-F415 HydrophobicContact CD2-CD1 4.47Å; L396-V420 HydrophobicContact CB-CG2 3.66Å; L396-V420 HydrophobicContact CD1-CG2 3.68Å; L396-V420 HydrophobicContact CG-CG2 4.34Å
397	E	87.1	Confident	84.5	Confident	53 Å²	53	46.3 Å²	46.3	25%	0.248	24%	0.244	C	C	.	.	H	α-helix	trans	-66.6	-40.4	-174.2	-59.6	-169.6	126.3	0	0	112.8	A393 M400 M401 F425 R430	A393-E397 VanDerWaalsContact O-CG 3.27Å; A393-E397 WeakPolarHBondContact O-CG 3.37Å; E397-M400 PolarHBondContact O-N 3.14Å; E397-M401 PolarHBondContact O-N 3.48Å; E397-F425 HydrophobicContact CB-CD2 4.02Å; E397-F425 HydrophobicContact CB-CE2 4.01Å; E397-F425 HydrophobicContact CG-CD2 4.03Å; E397-F425 WeakPolarHBondContact O-CE2 3.47Å; E397-R430 VanDerWaalsContact CD-NH1 3.25Å; E397-R430 IonicContact OE1-CZ 3.66Å; E397-R430 IonicContact OE1-NH1 3.97Å; E397-R430 PolarHBondContact OE1-NH1 3.48Å; E397-R430 IonicContact OE1-NH2 3.68Å; E397-R430 IonicContact OE2-CZ 2.67Å; E397-R430 IonicContact OE2-NH1 3.64Å; E397-R430 IonicContact OE2-NH2 3.41Å; E397-R430 PolarHBondContact OE2-NH2 3.49Å
398	E	85.9	Confident	85.6	Confident	73 Å²	73	47 Å²	47	34%	0.341	24%	0.242	S	C	.	.	H	α-helix	trans	-66.5	-48.2	-179.9	-168.1	-171.7	167.8	0	0	111	G238 K369 L396 M400 M401 D402	G238-E398 WeakPolarHBondContact CA-OE1 3.29Å; K369-E398 WeakPolarHBondContact CE-OE1 3.3Å; K369-E398 WeakPolarHBondContact CE-OE2 3.47Å; K369-E398 IonicContact NZ-OE1 2.77Å; K369-E398 PolarHBondContact NZ-OE1 2.83Å; K369-E398 IonicContact NZ-OE2 3.88Å; K369-E398 PolarHBondContact NZ-OE2 3.14Å; L396-E398 PolarHBondContact O-N 3.28Å; E398-M400 VanDerWaalsContact C-N 3.31Å; E398-M400 PolarHBondContact O-N 3.14Å; E398-M401 WeakPolarHBondContact O-CB 3.28Å; E398-M401 PolarHBondContact O-N 2.9Å; E398-D402 PolarHBondContact O-N 3.46Å
399	V	88	Confident	86.7	Confident	1 Å²	1	40.7 Å²	40.7	1%	0.006	21%	0.208	C	C	.	.	H	α-helix	trans	-67.6	-30.3	177.2	-75.5	0	0	0	0	112.7	L368 K369 L396 A403 F415	L368-V399 HydrophobicContact CD2-CB 4.46Å; L368-V399 HydrophobicContact CD2-CG1 4.31Å; L368-V399 HydrophobicContact CD2-CG2 3.92Å; L368-V399 HydrophobicContact CG-CG1 4.24Å; K369-V399 HydrophobicContact CG-CG1 3.54Å; L396-V399 HydrophobicContact CB-CG2 4.26Å; L396-V399 HydrophobicContact CD2-CG2 4.01Å; L396-V399 WeakPolarHBondContact O-CG2 3.28Å; V399-A403 VanDerWaalsContact O-CB 3.29Å; V399-A403 WeakPolarHBondContact O-CB 3.38Å; V399-A403 PolarHBondContact O-N 2.94Å; V399-F415 HydrophobicContact CB-CE2 4.23Å; V399-F415 HydrophobicContact CB-CZ 4.08Å; V399-F415 HydrophobicContact CG2-CE2 4.3Å; V399-F415 HydrophobicContact CG2-CZ 4.08Å
400	M	90.8	Very high	87.5	Confident	0 Å²	0	43.1 Å²	43.1	0%	0	22%	0.221	C	C	.	.	H	α-helix	trans	-63.8	-45.6	170.6	177.6	62.5	83.8	0	0	110.9	L396 E397 E398 D402 A403 L404 V412 F415 V416 V420 F425	L396-M400 WeakPolarHBondContact O-CB 3.45Å; L396-M400 PolarHBondContact O-N 2.9Å; E397-M400 PolarHBondContact O-N 3.14Å; E398-M400 VanDerWaalsContact C-N 3.31Å; E398-M400 PolarHBondContact O-N 3.14Å; M400-D402 PolarHBondContact O-N 3.09Å; M400-A403 PolarHBondContact O-N 3.49Å; M400-L404 HydrophobicContact CG-CD1 4.21Å; M400-L404 VanDerWaalsContact O-CG 3.29Å; M400-L404 WeakPolarHBondContact O-CG 3.42Å; M400-L404 PolarHBondContact O-N 3.05Å; M400-L404 HydrophobicContact SD-CD1 4.46Å; M400-L404 HydrophobicContact SD-CG 4.36Å; M400-V412 HydrophobicContact CE-CG1 4.4Å; M400-V412 HydrophobicContact SD-CB 4.36Å; M400-V412 HydrophobicContact SD-CG1 3.97Å; M400-V412 HydrophobicContact SD-CG2 4.16Å; M400-F415 HydrophobicContact CB-CD2 4.38Å; M400-F415 HydrophobicContact CE-CB 3.43Å; M400-F415 VanDerWaalsContact CE-CB 3.43Å; M400-F415 HydrophobicContact CE-CD2 4.08Å; M400-F415 HydrophobicContact CE-CG 4.27Å; M400-F415 HydrophobicContact SD-CD2 4.15Å; M400-V416 HydrophobicContact CE-CG2 4.13Å; M400-V420 HydrophobicContact CE-CB 3.99Å; M400-V420 HydrophobicContact CE-CG1 3.69Å; M400-V420 HydrophobicContact CE-CG2 4.33Å; M400-F425 HydrophobicContact CB-CE2 4.08Å; M400-F425 HydrophobicContact CB-CZ 4.14Å; M400-F425 HydrophobicContact CG-CD1 4.36Å; M400-F425 HydrophobicContact CG-CD2 4.43Å; M400-F425 HydrophobicContact CG-CE1 3.86Å; M400-F425 HydrophobicContact CG-CE2 3.95Å; M400-F425 HydrophobicContact CG-CZ 3.63Å
401	M	89.8	Confident	88.2	Confident	18 Å²	18	34.7 Å²	34.7	9%	0.089	18%	0.181	C	C	.	.	H	α-helix	trans	-61.1	-45	176.7	-170.5	65	176.7	0	0	111.4	E397 E398 A403 L404 I405 E433 L434	E397-M401 PolarHBondContact O-N 3.48Å; E398-M401 WeakPolarHBondContact O-CB 3.28Å; E398-M401 PolarHBondContact O-N 2.9Å; M401-A403 PolarHBondContact O-N 3.07Å; M401-L404 PolarHBondContact O-N 3.38Å; M401-I405 HydrophobicContact CE-CD1 4.01Å; M401-I405 HydrophobicContact CE-CG1 4.32Å; M401-I405 HydrophobicContact CG-CD1 3.98Å; M401-I405 VanDerWaalsContact O-CG1 3.3Å; M401-I405 WeakPolarHBondContact O-CG1 3.09Å; M401-I405 PolarHBondContact O-N 2.76Å; M401-E433 HydrophobicContact CE-CB 3.76Å; M401-E433 HydrophobicContact CE-CG 3.59Å; M401-L434 HydrophobicContact CE-CB 4.39Å; M401-L434 HydrophobicContact CE-CD2 3.5Å; M401-L434 VanDerWaalsContact CE-CD2 3.5Å; M401-L434 HydrophobicContact CE-CG 3.6Å; M401-L434 HydrophobicContact SD-CD2 3.49Å; M401-L434 WeakPolarHBondContact SD-CD2 3.17Å; M401-L434 HydrophobicContact SD-CG 3.81Å
402	D	87.3	Confident	88.6	Confident	12 Å²	12	32.9 Å²	32.9	6%	0.064	17%	0.174	C	C	.	.	H	α-helix	trans	-63.9	-39.5	177.6	-73.3	-16.3	0	0	0	112.2	G236 E398 M400 I405 N406	G236-D402 WeakPolarHBondContact CA-OD1 3.45Å; E398-D402 PolarHBondContact O-N 3.46Å; M400-D402 PolarHBondContact O-N 3.09Å; D402-I405 PolarHBondContact O-N 3.33Å; D402-N406 WeakPolarHBondContact O-CB 3.48Å; D402-N406 PolarHBondContact O-N 3.05Å; D402-N406 PolarHBondContact O-ND2 3.08Å
403	A	90.4	Very high	89	Confident	0 Å²	0	30.7 Å²	30.7	0%	0	16%	0.162	C	C	.	.	H	α-helix	trans	-65.8	-39	176	0	0	0	0	0	112.2	V372 V399 M400 M401 D407 K408 F411 V412 F415	V372-A403 HydrophobicContact CG1-CB 4.27Å; V399-A403 VanDerWaalsContact O-CB 3.29Å; V399-A403 WeakPolarHBondContact O-CB 3.38Å; V399-A403 PolarHBondContact O-N 2.94Å; M400-A403 PolarHBondContact O-N 3.49Å; M401-A403 PolarHBondContact O-N 3.07Å; A403-D407 PolarHBondContact O-N 3.39Å; A403-K408 HydrophobicContact CB-CB 4.31Å; A403-K408 PolarHBondContact O-N 2.82Å; A403-F411 HydrophobicContact CB-CB 4.07Å; A403-V412 HydrophobicContact CB-CG2 4.11Å; A403-F415 HydrophobicContact CB-CE2 3.95Å
404	L	91.1	Very high	89.4	Confident	0 Å²	0	29 Å²	29	0%	0	15%	0.148	C	C	.	.	H	α-helix	trans	-62.7	-55.3	172.7	-70.5	169.7	0	0	0	110	M400 M401 N406 D407 V412 F425 L434 L535 W538 R544 M547 F551	M400-L404 HydrophobicContact CG-CD1 4.21Å; M400-L404 VanDerWaalsContact O-CG 3.29Å; M400-L404 WeakPolarHBondContact O-CG 3.42Å; M400-L404 PolarHBondContact O-N 3.05Å; M400-L404 HydrophobicContact SD-CD1 4.46Å; M400-L404 HydrophobicContact SD-CG 4.36Å; M401-L404 PolarHBondContact O-N 3.38Å; L404-N406 VanDerWaalsContact C-N 3.28Å; L404-N406 PolarHBondContact O-N 2.88Å; L404-D407 PolarHBondContact O-N 3.44Å; L404-V412 HydrophobicContact CD2-CG1 4.44Å; L404-V412 HydrophobicContact CD2-CG2 3.95Å; L404-V412 HydrophobicContact CG-CG2 4.35Å; L404-F425 HydrophobicContact CD1-CE1 3.84Å; L404-F425 HydrophobicContact CD1-CZ 4.18Å; L404-L434 HydrophobicContact CB-CD2 3.93Å; L404-L434 HydrophobicContact CD1-CD1 4.31Å; L404-L434 HydrophobicContact CD1-CD2 4.39Å; L404-L535 HydrophobicContact CD1-CD2 4.41Å; L404-W538 HydrophobicContact CB-CH2 4.11Å; L404-W538 HydrophobicContact CD2-CZ3 4.27Å; L404-W538 WeakPolarHBondContact O-CH2 3.44Å; L404-R544 PolarHBondContact O-NH1 2.99Å; L404-M547 HydrophobicContact CD2-SD 4.14Å; L404-F551 HydrophobicContact CD2-CE2 4.41Å; L404-F551 HydrophobicContact CD2-CZ 3.62Å
405	I	89.5	Confident	89.8	Confident	20 Å²	20	25.3 Å²	25.3	10%	0.103	12%	0.122	C	C	.	.	H	α-helix	trans	-56.5	-43.2	-176.2	-65.1	167.7	0	0	0	111.5	G235 M401 D402 D407 L434 R544	G235-I405 VanDerWaalsContact O-CG2 3.28Å; G235-I405 WeakPolarHBondContact O-CG2 3.45Å; M401-I405 HydrophobicContact CE-CD1 4.01Å; M401-I405 HydrophobicContact CE-CG1 4.32Å; M401-I405 HydrophobicContact CG-CD1 3.98Å; M401-I405 VanDerWaalsContact O-CG1 3.3Å; M401-I405 WeakPolarHBondContact O-CG1 3.09Å; M401-I405 PolarHBondContact O-N 2.76Å; D402-I405 PolarHBondContact O-N 3.33Å; I405-D407 PolarHBondContact O-N 2.92Å; I405-L434 HydrophobicContact CG1-CD2 4.14Å; I405-R544 PolarHBondContact O-NH1 3.34Å; I405-R544 VanDerWaalsContact O-NH1 3.07Å; I405-R544 PolarHBondContact O-NH2 2.88Å
406	N	86.6	Confident	90.1	Very high	38 Å²	38	25.2 Å²	25.2	20%	0.203	12%	0.123	C	C	.	.	T	Hydrogen-bonded Turn	trans	-87.4	10.7	-174.7	-66.6	-64.9	0	0	0	115.6	Y234 D402 L404 K408	Y234-N406 HydrophobicContact CE1-CB 4.26Å; Y234-N406 PolarHBondContact O-ND2 2.9Å; D402-N406 WeakPolarHBondContact O-CB 3.48Å; D402-N406 PolarHBondContact O-N 3.05Å; D402-N406 PolarHBondContact O-ND2 3.08Å; L404-N406 VanDerWaalsContact C-N 3.28Å; L404-N406 PolarHBondContact O-N 2.88Å; N406-K408 HydrophobicContact CB-CG 4.23Å
407	D	89.8	Confident	90.1	Very high	68 Å²	68	30.8 Å²	30.8	36%	0.364	15%	0.153	S	C	.	.	T	Hydrogen-bonded Turn	trans	57.7	54.5	176.9	-162.8	32.5	0	0	0	113.5	A403 L404 I405 P409 R544 M547	A403-D407 PolarHBondContact O-N 3.39Å; L404-D407 PolarHBondContact O-N 3.44Å; I405-D407 PolarHBondContact O-N 2.92Å; D407-P409 VanDerWaalsContact C-CD 3.48Å; D407-P409 WeakPolarHBondContact O-CD 3.5Å; D407-R544 WeakPolarHBondContact OD1-CD 3.32Å; D407-M547 WeakPolarHBondContact OD1-CE 3.28Å
408	K	91.3	Very high	90.2	Very high	36 Å²	36	31.5 Å²	31.5	16%	0.157	16%	0.158	C	C	.	.			trans	-111.4	74.9	-178.9	-57.4	-55.8	-174	-170.9	0	111.9	N375 A403 N406 D410 F411 V412	N375-K408 HydrophobicContact CB-CD 4.38Å; N375-K408 WeakPolarHBondContact OD1-CD 3.42Å; A403-K408 HydrophobicContact CB-CB 4.31Å; A403-K408 PolarHBondContact O-N 2.82Å; N406-K408 HydrophobicContact CB-CG 4.23Å; K408-D410 VanDerWaalsContact C-N 3.32Å; K408-D410 PolarHBondContact O-N 2.79Å; K408-F411 HydrophobicContact CB-CB 4.22Å; K408-F411 HydrophobicContact CB-CD2 4.2Å; K408-F411 PolarHBondContact O-N 2.66Å; K408-V412 PolarHBondContact O-N 3.45Å
409	P	92.2	Very high	90	Very high	8 Å²	8	30.5 Å²	30.5	5%	0.052	17%	0.168	C	C	.	.	H	α-helix	trans	-58.7	-38.2	-173.4	21.1	-32.7	0	0	0	113.9	D407 F411 V412 R413 Q546 M547	D407-P409 VanDerWaalsContact C-CD 3.48Å; D407-P409 WeakPolarHBondContact O-CD 3.5Å; P409-F411 VanDerWaalsContact C-N 3.34Å; P409-F411 PolarHBondContact O-N 3.28Å; P409-V412 PolarHBondContact O-N 3.03Å; P409-R413 WeakPolarHBondContact O-CG 3.36Å; P409-R413 PolarHBondContact O-N 3.16Å; P409-Q546 HydrophobicContact CB-CB 4.33Å; P409-Q546 HydrophobicContact CG-CB 3.93Å; P409-M547 HydrophobicContact CB-CG 3.82Å; P409-M547 HydrophobicContact CG-CG 4.46Å
410	D	92.4	Very high	90	Very high	72 Å²	72	30.8 Å²	30.8	39%	0.385	17%	0.169	S	C	.	.	H	α-helix	trans	-70.5	-30.3	-176.7	-64.6	-39.8	0	0	0	112.8	V377 K408 R413 L414	V377-D410 HydrophobicContact CG1-CB 4.33Å; V377-D410 HydrophobicContact CG2-CB 3.7Å; K408-D410 VanDerWaalsContact C-N 3.32Å; K408-D410 PolarHBondContact O-N 2.79Å; D410-R413 IonicContact OD1-NH1 2.99Å; D410-R413 PolarHBondContact OD1-NH1 2.86Å; D410-R413 VanDerWaalsContact OD1-NH1 3.14Å; D410-L414 WeakPolarHBondContact O-CB 3.46Å; D410-L414 PolarHBondContact O-N 2.97Å
411	F	92.8	Very high	89.8	Confident	0 Å²	0	35.2 Å²	35.2	0%	0	19%	0.193	C	C	.	.	H	α-helix	trans	-70.9	-40.7	170.5	-87.6	-76.2	0	0	0	111.7	A371 V372 V377 A380 A403 K408 P409 R413 L414 F415	A371-F411 VanDerWaalsContact C-CZ 3.46Å; A371-F411 HydrophobicContact CB-CE1 4.45Å; A371-F411 HydrophobicContact CB-CZ 4.18Å; A371-F411 WeakPolarHBondContact O-CE2 3.3Å; A371-F411 VanDerWaalsContact O-CZ 3.24Å; A371-F411 WeakPolarHBondContact O-CZ 3.47Å; V372-F411 HydrophobicContact CG2-CD1 3.62Å; V372-F411 HydrophobicContact CG2-CD2 4.38Å; V372-F411 HydrophobicContact CG2-CE1 3.72Å; V372-F411 HydrophobicContact CG2-CE2 4.49Å; V372-F411 HydrophobicContact CG2-CG 3.97Å; V372-F411 HydrophobicContact CG2-CZ 4.18Å; V377-F411 HydrophobicContact CB-CE2 4.23Å; V377-F411 HydrophobicContact CB-CZ 4.32Å; V377-F411 HydrophobicContact CG2-CD1 4.44Å; V377-F411 HydrophobicContact CG2-CD2 3.4Å; V377-F411 HydrophobicContact CG2-CE1 4.4Å; V377-F411 HydrophobicContact CG2-CE2 3.32Å; V377-F411 HydrophobicContact CG2-CG 3.98Å; V377-F411 HydrophobicContact CG2-CZ 3.87Å; A380-F411 HydrophobicContact CB-CE1 3.64Å; A380-F411 HydrophobicContact CB-CZ 4.2Å; A403-F411 HydrophobicContact CB-CB 4.07Å; K408-F411 HydrophobicContact CB-CB 4.22Å; K408-F411 HydrophobicContact CB-CD2 4.2Å; K408-F411 PolarHBondContact O-N 2.66Å; P409-F411 VanDerWaalsContact C-N 3.34Å; P409-F411 PolarHBondContact O-N 3.28Å; F411-R413 VanDerWaalsContact C-N 3.3Å; F411-R413 PolarHBondContact O-N 2.92Å; F411-L414 HydrophobicContact CD1-CD2 4.46Å; F411-L414 PolarHBondContact O-N 3.25Å; F411-F415 HydrophobicContact CB-CE2 4.1Å; F411-F415 HydrophobicContact CB-CZ 4.34Å; F411-F415 HydrophobicContact CD1-CE1 4.21Å; F411-F415 HydrophobicContact CD1-CE2 4.4Å; F411-F415 AromaticContact CD1-CZ 3.8Å; F411-F415 HydrophobicContact CD1-CZ 3.8Å; F411-F415 VanDerWaalsContact O-CD2 3.22Å; F411-F415 WeakPolarHBondContact O-CD2 3.29Å; F411-F415 WeakPolarHBondContact O-CG 3.33Å; F411-F415 PolarHBondContact O-N 3.24Å
412	V	92.8	Very high	89.6	Confident	0 Å²	0	34.4 Å²	34.4	0%	0	19%	0.189	C	C	.	.	H	α-helix	trans	-59.8	-43.1	175.4	177.8	0	0	0	0	110.6	M400 A403 L404 K408 P409 F415 V416 M547 Y550 F551	M400-V412 HydrophobicContact CE-CG1 4.4Å; M400-V412 HydrophobicContact SD-CB 4.36Å; M400-V412 HydrophobicContact SD-CG1 3.97Å; M400-V412 HydrophobicContact SD-CG2 4.16Å; A403-V412 HydrophobicContact CB-CG2 4.11Å; L404-V412 HydrophobicContact CD2-CG1 4.44Å; L404-V412 HydrophobicContact CD2-CG2 3.95Å; L404-V412 HydrophobicContact CG-CG2 4.35Å; K408-V412 PolarHBondContact O-N 3.45Å; P409-V412 PolarHBondContact O-N 3.03Å; V412-F415 PolarHBondContact O-N 3.28Å; V412-V416 WeakPolarHBondContact O-CG2 3.34Å; V412-V416 PolarHBondContact O-N 3.23Å; V412-M547 HydrophobicContact CG2-SD 4.33Å; V412-Y550 HydrophobicContact CG1-CD1 4.35Å; V412-Y550 HydrophobicContact CG1-CE1 3.96Å; V412-F551 HydrophobicContact CG1-CE1 4.07Å; V412-F551 HydrophobicContact CG1-CZ 4.39Å
413	R	92.4	Very high	89.4	Confident	95 Å²	95	35 Å²	35	36%	0.358	20%	0.197	S	C	.	.	H	α-helix	trans	-58.2	-52.1	172.1	-73.1	172.2	-177.9	166.6	-6.6	111.6	P409 D410 F411 F415 V416 D417 Y550	P409-R413 WeakPolarHBondContact O-CG 3.36Å; P409-R413 PolarHBondContact O-N 3.16Å; D410-R413 IonicContact OD1-NH1 2.99Å; D410-R413 PolarHBondContact OD1-NH1 2.86Å; D410-R413 VanDerWaalsContact OD1-NH1 3.14Å; F411-R413 VanDerWaalsContact C-N 3.3Å; F411-R413 PolarHBondContact O-N 2.92Å; R413-F415 VanDerWaalsContact C-N 3.28Å; R413-F415 PolarHBondContact O-N 3.39Å; R413-V416 PolarHBondContact O-N 3.26Å; R413-D417 WeakPolarHBondContact O-CB 3.42Å; R413-D417 PolarHBondContact O-N 2.99Å; R413-Y550 HydrophobicContact CG-CD1 4.27Å; R413-Y550 HydrophobicContact CG-CD2 3.7Å; R413-Y550 HydrophobicContact CG-CE1 4.09Å; R413-Y550 HydrophobicContact CG-CE2 3.5Å; R413-Y550 VanDerWaalsContact CG-CE2 3.5Å; R413-Y550 HydrophobicContact CG-CG 4.08Å
414	L	91.9	Very high	89.2	Confident	8 Å²	8	39.9 Å²	39.9	4%	0.042	22%	0.22	C	C	.	.	H	α-helix	trans	-56.4	-41.6	179.8	-176.6	65.9	0	0	0	112.1	V377 A380 K381 F385 D410 F411 N418	V377-L414 HydrophobicContact CG1-CB 4.46Å; V377-L414 HydrophobicContact CG1-CD2 4Å; A380-L414 HydrophobicContact CB-CD2 3.99Å; K381-L414 HydrophobicContact CB-CD1 4Å; K381-L414 HydrophobicContact CB-CD2 4.32Å; K381-L414 HydrophobicContact CD-CD1 4.16Å; K381-L414 HydrophobicContact CG-CD1 3.95Å; F385-L414 HydrophobicContact CD2-CD1 4.38Å; F385-L414 HydrophobicContact CD2-CD2 3.71Å; F385-L414 HydrophobicContact CD2-CG 4.04Å; F385-L414 HydrophobicContact CE2-CD2 3.66Å; F385-L414 HydrophobicContact CE2-CG 3.98Å; D410-L414 WeakPolarHBondContact O-CB 3.46Å; D410-L414 PolarHBondContact O-N 2.97Å; F411-L414 HydrophobicContact CD1-CD2 4.46Å; F411-L414 PolarHBondContact O-N 3.25Å; L414-N418 WeakPolarHBondContact CD1-ND2 3.46Å; L414-N418 WeakPolarHBondContact O-CB 3.49Å; L414-N418 PolarHBondContact O-N 3.43Å; L414-N418 VanDerWaalsContact O-N 3.08Å; L414-N418 PolarHBondContact O-ND2 3.45Å
415	F	91.8	Very high	89.1	Confident	0 Å²	0	40 Å²	40	0%	0	22%	0.221	C	C	.	.	H	α-helix	trans	-71.3	-37.8	179.6	-61.6	-30.4	0	0	0	113.1	L368 V372 F385 L396 V399 M400 A403 F411 V412 R413 N418 G419 V420	L368-F415 HydrophobicContact CD1-CE1 4.09Å; L368-F415 HydrophobicContact CD1-CZ 4.39Å; L368-F415 HydrophobicContact CD2-CE1 4.06Å; L368-F415 HydrophobicContact CD2-CZ 4.42Å; L368-F415 HydrophobicContact CG-CE1 4.38Å; L368-F415 HydrophobicContact CG-CZ 4.45Å; V372-F415 HydrophobicContact CG2-CE2 4.4Å; V372-F415 HydrophobicContact CG2-CZ 3.88Å; F385-F415 HydrophobicContact CE2-CD1 4.18Å; F385-F415 AromaticContact CE2-CE1 3.96Å; F385-F415 HydrophobicContact CE2-CE1 3.96Å; F385-F415 AromaticContact CZ-CD1 3.75Å; F385-F415 HydrophobicContact CZ-CD1 3.75Å; F385-F415 AromaticContact CZ-CE1 3.77Å; F385-F415 HydrophobicContact CZ-CE1 3.77Å; L396-F415 HydrophobicContact CD2-CD1 4.47Å; V399-F415 HydrophobicContact CB-CE2 4.23Å; V399-F415 HydrophobicContact CB-CZ 4.08Å; V399-F415 HydrophobicContact CG2-CE2 4.3Å; V399-F415 HydrophobicContact CG2-CZ 4.08Å; M400-F415 HydrophobicContact CB-CD2 4.38Å; M400-F415 HydrophobicContact CE-CB 3.43Å; M400-F415 VanDerWaalsContact CE-CB 3.43Å; M400-F415 HydrophobicContact CE-CD2 4.08Å; M400-F415 HydrophobicContact CE-CG 4.27Å; M400-F415 HydrophobicContact SD-CD2 4.15Å; A403-F415 HydrophobicContact CB-CE2 3.95Å; F411-F415 HydrophobicContact CB-CE2 4.1Å; F411-F415 HydrophobicContact CB-CZ 4.34Å; F411-F415 HydrophobicContact CD1-CE1 4.21Å; F411-F415 HydrophobicContact CD1-CE2 4.4Å; F411-F415 AromaticContact CD1-CZ 3.8Å; F411-F415 HydrophobicContact CD1-CZ 3.8Å; F411-F415 VanDerWaalsContact O-CD2 3.22Å; F411-F415 WeakPolarHBondContact O-CD2 3.29Å; F411-F415 WeakPolarHBondContact O-CG 3.33Å; F411-F415 PolarHBondContact O-N 3.24Å; V412-F415 PolarHBondContact O-N 3.28Å; R413-F415 VanDerWaalsContact C-N 3.28Å; R413-F415 PolarHBondContact O-N 3.39Å; F415-N418 CarbonylContact O-C 3.59Å; F415-N418 PolarHBondContact O-N 3.06Å; F415-G419 PolarHBondContact O-N 2.89Å; F415-V420 HydrophobicContact CB-CG2 4.09Å; F415-V420 WeakPolarHBondContact O-CB 3.47Å; F415-V420 WeakPolarHBondContact O-CG2 3.43Å; F415-V420 PolarHBondContact O-N 3.47Å; F415-V420 VanDerWaalsContact O-N 3.1Å
416	V	90.6	Very high	89.1	Confident	26 Å²	26	39.1 Å²	39.1	16%	0.158	22%	0.216	C	C	.	.	H	α-helix	trans	-65.6	-43.1	173.6	173	0	0	0	0	110.6	M400 V412 R413 N418 G419 L422 W532 Y550	M400-V416 HydrophobicContact CE-CG2 4.13Å; V412-V416 WeakPolarHBondContact O-CG2 3.34Å; V412-V416 PolarHBondContact O-N 3.23Å; R413-V416 PolarHBondContact O-N 3.26Å; V416-N418 PolarHBondContact O-N 3.12Å; V416-G419 PolarHBondContact O-N 3.34Å; V416-G419 VanDerWaalsContact O-N 3.13Å; V416-L422 HydrophobicContact CG2-CG 4.45Å; V416-W532 HydrophobicContact CG1-CH2 4.46Å; V416-Y550 WeakPolarHBondContact CB-OH 3.45Å
417	D	88.8	Confident	89.2	Confident	119 Å²	119	38.5 Å²	38.5	64%	0.636	21%	0.214	S	C	*	.	H	α-helix	trans	-61	-30.2	176.3	-67.3	-15.9	0	0	0	112.3	R413	R413-D417 WeakPolarHBondContact O-CB 3.42Å; R413-D417 PolarHBondContact O-N 2.99Å
418	N	87.7	Confident	89	Confident	67 Å²	67	36.4 Å²	36.4	36%	0.358	20%	0.201	S	C	.	.	T	Hydrogen-bonded Turn	trans	-95.6	19	178.3	-72.5	-80.9	0	0	0	114.1	F385 L414 F415 V416	F385-N418 HydrophobicContact CD1-CB 4.01Å; F385-N418 HydrophobicContact CE1-CB 3.95Å; L414-N418 WeakPolarHBondContact CD1-ND2 3.46Å; L414-N418 WeakPolarHBondContact O-CB 3.49Å; L414-N418 PolarHBondContact O-N 3.43Å; L414-N418 VanDerWaalsContact O-N 3.08Å; L414-N418 PolarHBondContact O-ND2 3.45Å; F415-N418 CarbonylContact O-C 3.59Å; F415-N418 PolarHBondContact O-N 3.06Å; V416-N418 PolarHBondContact O-N 3.12Å
419	G	81.4	Confident	88.6	Confident	53 Å²	53	35.5 Å²	35.5	55%	0.546	20%	0.202	S	C	.	.	T	Hydrogen-bonded Turn	trans	104.4	11.1	164.5	0	0	0	0	0	117	F415 V416 N421	F415-G419 PolarHBondContact O-N 2.89Å; V416-G419 PolarHBondContact O-N 3.34Å; V416-G419 VanDerWaalsContact O-N 3.13Å; G419-N421 PolarHBondContact O-N 2.75Å
420	V	88	Confident	88.4	Confident	7 Å²	7	38.1 Å²	38.1	4%	0.042	21%	0.211	C	C	.	.			trans	-76.5	114.4	171.2	178.8	0	0	0	0	110.8	L396 M400 F415 F425	L396-V420 HydrophobicContact CB-CG2 3.66Å; L396-V420 HydrophobicContact CD1-CG2 3.68Å; L396-V420 HydrophobicContact CG-CG2 4.34Å; M400-V420 HydrophobicContact CE-CB 3.99Å; M400-V420 HydrophobicContact CE-CG1 3.69Å; M400-V420 HydrophobicContact CE-CG2 4.33Å; F415-V420 HydrophobicContact CB-CG2 4.09Å; F415-V420 WeakPolarHBondContact O-CB 3.47Å; F415-V420 WeakPolarHBondContact O-CG2 3.43Å; F415-V420 PolarHBondContact O-N 3.47Å; F415-V420 VanDerWaalsContact O-N 3.1Å; V420-F425 HydrophobicContact CG1-CB 4.48Å
421	N	87.2	Confident	88.3	Confident	92 Å²	92	34.7 Å²	34.7	49%	0.492	19%	0.192	S	C	.	.			trans	-88.5	112.9	173.2	-170.9	-31.1	0	0	0	111.2	G419 G423 E424 F425	G419-N421 PolarHBondContact O-N 2.75Å; N421-G423 PolarHBondContact O-N 3.41Å; N421-G423 PolarHBondContact OD1-N 3.04Å; N421-E424 HydrophobicContact CB-CG 4.26Å; N421-E424 PolarHBondContact O-N 2.74Å; N421-E424 VanDerWaalsContact O-N 3.1Å; N421-F425 WeakPolarHBondContact O-CB 3.45Å; N421-F425 PolarHBondContact O-N 3.02Å
422	L	86.2	Confident	88	Confident	2 Å²	2	35.8 Å²	35.8	1%	0.01	20%	0.198	C	C	.	.	H	α-helix	trans	-63.7	-24.1	-179.7	-72.1	-178.9	0	0	0	114.5	V416 E424 F425 L426 W532 L535	V416-L422 HydrophobicContact CG2-CG 4.45Å; L422-E424 VanDerWaalsContact C-N 3.32Å; L422-F425 HydrophobicContact CD2-CD1 3.82Å; L422-F425 HydrophobicContact CD2-CE1 4.49Å; L422-L426 WeakPolarHBondContact O-CB 3.5Å; L422-L426 PolarHBondContact O-N 3.37Å; L422-W532 HydrophobicContact CB-CZ2 4.25Å; L422-W532 HydrophobicContact CD1-CD2 3.96Å; L422-W532 HydrophobicContact CD1-CE3 3.53Å; L422-W532 HydrophobicContact CD1-CH2 3.2Å; L422-W532 HydrophobicContact CD1-CZ2 3.63Å; L422-W532 HydrophobicContact CD1-CZ3 3.14Å; L422-W532 HydrophobicContact CG-CH2 4.1Å; L422-W532 HydrophobicContact CG-CZ2 4.22Å; L422-W532 HydrophobicContact CG-CZ3 4.43Å; L422-L535 HydrophobicContact CD1-CD1 3.85Å; L422-L535 HydrophobicContact CD2-CD1 4.08Å; L422-L535 HydrophobicContact CG-CD1 4.48Å
423	G	83.3	Confident	87.8	Confident	23 Å²	23	39.4 Å²	39.4	24%	0.237	21%	0.214	C	C	.	.	H	α-helix	trans	-72.7	-23.9	175.2	0	0	0	0	0	114	N421	N421-G423 PolarHBondContact O-N 3.41Å; N421-G423 PolarHBondContact OD1-N 3.04Å
424	E	84.9	Confident	87.6	Confident	104 Å²	104	34.9 Å²	34.9	49%	0.486	20%	0.197	S	C	.	.	H	α-helix	trans	-91.3	-33.8	172.7	-55	-156	126	0	0	111.7	N421 L422 R527	N421-E424 HydrophobicContact CB-CG 4.26Å; N421-E424 PolarHBondContact O-N 2.74Å; N421-E424 VanDerWaalsContact O-N 3.1Å; L422-E424 VanDerWaalsContact C-N 3.32Å; E424-R527 IonicContact OE1-CZ 2.82Å; E424-R527 IonicContact OE1-NH1 2.66Å; E424-R527 PolarHBondContact OE1-NH1 3.3Å; E424-R527 IonicContact OE1-NH2 3.71Å
425	F	89.1	Confident	87.5	Confident	3 Å²	3	34.6 Å²	34.6	1%	0.013	20%	0.196	C	C	.	.	H	α-helix	trans	-70	-42.2	-179.7	169.2	-101.5	0	0	0	113.5	E397 M400 L404 V420 N421 L422 T427 R430	E397-F425 HydrophobicContact CB-CD2 4.02Å; E397-F425 HydrophobicContact CB-CE2 4.01Å; E397-F425 HydrophobicContact CG-CD2 4.03Å; E397-F425 WeakPolarHBondContact O-CE2 3.47Å; M400-F425 HydrophobicContact CB-CE2 4.08Å; M400-F425 HydrophobicContact CB-CZ 4.14Å; M400-F425 HydrophobicContact CG-CD1 4.36Å; M400-F425 HydrophobicContact CG-CD2 4.43Å; M400-F425 HydrophobicContact CG-CE1 3.86Å; M400-F425 HydrophobicContact CG-CE2 3.95Å; M400-F425 HydrophobicContact CG-CZ 3.63Å; L404-F425 HydrophobicContact CD1-CE1 3.84Å; L404-F425 HydrophobicContact CD1-CZ 4.18Å; V420-F425 HydrophobicContact CG1-CB 4.48Å; N421-F425 WeakPolarHBondContact O-CB 3.45Å; N421-F425 PolarHBondContact O-N 3.02Å; L422-F425 HydrophobicContact CD2-CD1 3.82Å; L422-F425 HydrophobicContact CD2-CE1 4.49Å; F425-T427 PolarHBondContact O-N 3.32Å; F425-R430 VanDerWaalsContact CD2-NH1 3.3Å; F425-R430 WeakPolarHBondContact O-CD 3.47Å; F425-R430 PolarHBondContact O-NH1 3.24Å
426	L	89.5	Confident	87.2	Confident	0 Å²	0	38.9 Å²	38.9	0%	0	21%	0.212	C	C	.	.			trans	-88.5	104.6	-169.8	-164	74.8	0	0	0	112.6	L422 L431 L434 C528 P531 D534 L535	L422-L426 WeakPolarHBondContact O-CB 3.5Å; L422-L426 PolarHBondContact O-N 3.37Å; L426-L431 HydrophobicContact CD1-CB 4.4Å; L426-L434 HydrophobicContact CD1-CD1 4.35Å; L426-C528 HydrophobicContact CD2-CB 4.13Å; L426-C528 HydrophobicContact CG-CB 4.48Å; L426-C528 PolarHBondContact O-N 2.95Å; L426-C528 VanDerWaalsContact O-N 3.14Å; L426-P531 HydrophobicContact CB-CB 4.03Å; L426-P531 HydrophobicContact CD2-CB 3.77Å; L426-D534 HydrophobicContact CD2-CB 4.25Å; L426-L535 HydrophobicContact CD1-CD2 4.02Å; L426-L535 HydrophobicContact CD1-CG 4.3Å; L426-L535 HydrophobicContact CD2-CD1 4.39Å; L426-L535 HydrophobicContact CD2-CG 3.98Å
427	T	88.8	Confident	87	Confident	25 Å²	25	39.6 Å²	39.6	15%	0.153	22%	0.218	C	C	.	.	B	Isolated β-bridge	trans	-99.4	159.6	168.1	63.2	0	0	0	0	111.1	F425 G429 R430 L431 E526	F425-T427 PolarHBondContact O-N 3.32Å; T427-G429 PolarHBondContact O-N 2.91Å; T427-R430 PolarHBondContact O-N 3.27Å; T427-R430 PolarHBondContact OG1-N 2.88Å; T427-L431 PolarHBondContact O-N 3.44Å; T427-E526 WeakPolarHBondContact CA-O 3.4Å
428	Y	84.9	Confident	86.8	Confident	24 Å²	24	34.2 Å²	34.2	9%	0.094	19%	0.19	C	C	.	.	H	α-helix	trans	-59.2	-31.3	175.9	-72.8	-65	0	0	0	112.9	Q432 L482 Y501 P522 E526 C528	Y428-Q432 WeakPolarHBondContact O-CB 3.46Å; Y428-Q432 PolarHBondContact O-N 2.94Å; Y428-L482 HydrophobicContact CD1-CD1 3.62Å; Y428-L482 HydrophobicContact CG-CD1 4.18Å; Y428-Y501 HydrophobicContact CD1-CD1 4.26Å; Y428-Y501 HydrophobicContact CD1-CE1 4.49Å; Y428-Y501 AromaticContact CE1-CD1 3.85Å; Y428-Y501 HydrophobicContact CE1-CD1 3.85Å; Y428-Y501 HydrophobicContact CE1-CE1 4.07Å; Y428-P522 HydrophobicContact CD2-CB 4.25Å; Y428-E526 HydrophobicContact CD2-CB 4.12Å; Y428-E526 VanDerWaalsContact CD2-O 3.31Å; Y428-E526 WeakPolarHBondContact CD2-O 3.35Å; Y428-E526 HydrophobicContact CE2-CB 4.46Å; Y428-E526 HydrophobicContact CE2-CG 4.42Å; Y428-E526 PolarHBondContact N-O 3.18Å; Y428-E526 VanDerWaalsContact N-O 3.1Å; Y428-C528 HydrophobicContact CE1-CB 4.41Å
429	G	84.2	Confident	86.6	Confident	17 Å²	17	34.5 Å²	34.5	18%	0.175	20%	0.197	C	C	.	.	H	α-helix	trans	-65.6	-46.6	173.9	0	0	0	0	0	113.3	T427 Q432 E433 L524	T427-G429 PolarHBondContact O-N 2.91Å; G429-Q432 WeakPolarHBondContact O-CB 3.4Å; G429-Q432 PolarHBondContact O-N 3.17Å; G429-E433 PolarHBondContact O-N 3.02Å; G429-L524 WeakPolarHBondContact CA-O 3.41Å; G429-L524 PolarHBondContact N-O 2.87Å
430	R	88	Confident	86.6	Confident	63 Å²	63	37.1 Å²	37.1	24%	0.238	20%	0.195	C	C	.	.	H	α-helix	trans	-65.2	-39.6	175.9	-75.5	175.7	173.5	171.6	-0.1	111.9	E397 F425 T427 Q432 E433 L434	E397-R430 VanDerWaalsContact CD-NH1 3.25Å; E397-R430 IonicContact OE1-CZ 3.66Å; E397-R430 IonicContact OE1-NH1 3.97Å; E397-R430 PolarHBondContact OE1-NH1 3.48Å; E397-R430 IonicContact OE1-NH2 3.68Å; E397-R430 IonicContact OE2-CZ 2.67Å; E397-R430 IonicContact OE2-NH1 3.64Å; E397-R430 IonicContact OE2-NH2 3.41Å; E397-R430 PolarHBondContact OE2-NH2 3.49Å; F425-R430 VanDerWaalsContact CD2-NH1 3.3Å; F425-R430 WeakPolarHBondContact O-CD 3.47Å; F425-R430 PolarHBondContact O-NH1 3.24Å; T427-R430 PolarHBondContact O-N 3.27Å; T427-R430 PolarHBondContact OG1-N 2.88Å; R430-Q432 VanDerWaalsContact C-N 3.3Å; R430-Q432 PolarHBondContact O-N 2.92Å; R430-E433 WeakPolarHBondContact O-CB 3.3Å; R430-E433 PolarHBondContact O-N 2.88Å; R430-L434 PolarHBondContact O-N 3.13Å
431	L	89.1	Confident	86.3	Confident	0 Å²	0	45.6 Å²	45.6	0%	0	23%	0.231	C	C	.	.	H	α-helix	trans	-61	-41.5	174	-177.6	63.9	0	0	0	111.5	L426 T427 E433 L434 Y435 L482 Y501 D534	L426-L431 HydrophobicContact CD1-CB 4.4Å; T427-L431 PolarHBondContact O-N 3.44Å; L431-E433 VanDerWaalsContact C-N 3.32Å; L431-E433 PolarHBondContact O-N 3.36Å; L431-L434 WeakPolarHBondContact O-CB 3.42Å; L431-L434 PolarHBondContact O-N 3.28Å; L431-Y435 HydrophobicContact CD1-CD2 4.24Å; L431-Y435 HydrophobicContact CD1-CE2 3.81Å; L431-Y435 HydrophobicContact CG-CD2 4.18Å; L431-Y435 HydrophobicContact CG-CE2 3.99Å; L431-Y435 VanDerWaalsContact O-CD2 3.26Å; L431-Y435 WeakPolarHBondContact O-CD2 3.32Å; L431-Y435 PolarHBondContact O-N 2.95Å; L431-Y435 VanDerWaalsContact O-N 3.14Å; L431-L482 HydrophobicContact CD2-CD2 4.03Å; L431-L482 HydrophobicContact CG-CD2 4.07Å; L431-Y501 HydrophobicContact CD2-CE1 3.63Å; L431-D534 HydrophobicContact CD1-CB 4.41Å; L431-D534 HydrophobicContact CD2-CB 4.05Å
432	Q	88	Confident	86.2	Confident	24 Å²	24	42.6 Å²	42.6	11%	0.112	22%	0.218	C	C	.	.	H	α-helix	trans	-63.9	-38.6	175.7	-174	173.2	-12.6	0	0	111.8	Y428 G429 R430 Y435 W436 F480 L482	Y428-Q432 WeakPolarHBondContact O-CB 3.46Å; Y428-Q432 PolarHBondContact O-N 2.94Å; G429-Q432 WeakPolarHBondContact O-CB 3.4Å; G429-Q432 PolarHBondContact O-N 3.17Å; R430-Q432 VanDerWaalsContact C-N 3.3Å; R430-Q432 PolarHBondContact O-N 2.92Å; Q432-Y435 PolarHBondContact O-N 2.91Å; Q432-W436 HydrophobicContact CG-CD2 4.36Å; Q432-W436 HydrophobicContact CG-CH2 4.18Å; Q432-W436 HydrophobicContact CG-CZ2 3.76Å; Q432-W436 PolarHBondContact O-N 3.34Å; Q432-F480 PolarHBondContact NE2-O 2.95Å; Q432-L482 HydrophobicContact CB-CD2 4.37Å; Q432-L482 HydrophobicContact CB-CG 4.37Å
433	E	87.1	Confident	86.3	Confident	75 Å²	75	43.6 Å²	43.6	35%	0.35	22%	0.223	S	C	.	.	H	α-helix	trans	-62.8	-40.5	173.7	-170.2	177	-169.1	0	0	112.5	M401 G429 R430 L431 Y435 W436 S437	M401-E433 HydrophobicContact CE-CB 3.76Å; M401-E433 HydrophobicContact CE-CG 3.59Å; G429-E433 PolarHBondContact O-N 3.02Å; R430-E433 WeakPolarHBondContact O-CB 3.3Å; R430-E433 PolarHBondContact O-N 2.88Å; L431-E433 VanDerWaalsContact C-N 3.32Å; L431-E433 PolarHBondContact O-N 3.36Å; E433-Y435 VanDerWaalsContact C-N 3.28Å; E433-Y435 PolarHBondContact O-N 3.46Å; E433-W436 HydrophobicContact CB-CE3 4.27Å; E433-W436 HydrophobicContact CG-CE3 4.46Å; E433-W436 WeakPolarHBondContact O-CA 3.12Å; E433-W436 WeakPolarHBondContact O-CB 3.23Å; E433-W436 PolarHBondContact O-N 3.34Å; E433-S437 PolarHBondContact O-N 3.32Å
434	L	89.7	Confident	86.6	Confident	0 Å²	0	42.5 Å²	42.5	0%	0	21%	0.212	C	C	.	.	H	α-helix	trans	-61.5	-33.7	173.2	-74.6	175.4	0	0	0	112.9	M401 L404 I405 L426 R430 L431 S437 L535 W538	M401-L434 HydrophobicContact CE-CB 4.39Å; M401-L434 HydrophobicContact CE-CD2 3.5Å; M401-L434 VanDerWaalsContact CE-CD2 3.5Å; M401-L434 HydrophobicContact CE-CG 3.6Å; M401-L434 HydrophobicContact SD-CD2 3.49Å; M401-L434 WeakPolarHBondContact SD-CD2 3.17Å; M401-L434 HydrophobicContact SD-CG 3.81Å; L404-L434 HydrophobicContact CB-CD2 3.93Å; L404-L434 HydrophobicContact CD1-CD1 4.31Å; L404-L434 HydrophobicContact CD1-CD2 4.39Å; I405-L434 HydrophobicContact CG1-CD2 4.14Å; L426-L434 HydrophobicContact CD1-CD1 4.35Å; R430-L434 PolarHBondContact O-N 3.13Å; L431-L434 WeakPolarHBondContact O-CB 3.42Å; L431-L434 PolarHBondContact O-N 3.28Å; L434-S437 PolarHBondContact O-OG 3.49Å; L434-L535 HydrophobicContact CD1-CD2 3.71Å; L434-W538 HydrophobicContact CB-CZ2 4.36Å; L434-W538 HydrophobicContact CD2-CH2 4.28Å; L434-W538 HydrophobicContact CD2-CZ2 3.85Å; L434-W538 PolarHBondContact O-NE1 3.15Å
435	Y	88.9	Confident	86.8	Confident	2 Å²	2	38.6 Å²	38.6	1%	0.008	19%	0.193	C	C	.	.	H	α-helix	trans	-77.6	-23.3	173.2	-80	-71.6	0	0	0	112.8	L431 Q432 E433 V438 L444 L448 L482 V485 W538 L541	L431-Y435 HydrophobicContact CD1-CD2 4.24Å; L431-Y435 HydrophobicContact CD1-CE2 3.81Å; L431-Y435 HydrophobicContact CG-CD2 4.18Å; L431-Y435 HydrophobicContact CG-CE2 3.99Å; L431-Y435 VanDerWaalsContact O-CD2 3.26Å; L431-Y435 WeakPolarHBondContact O-CD2 3.32Å; L431-Y435 PolarHBondContact O-N 2.95Å; L431-Y435 VanDerWaalsContact O-N 3.14Å; Q432-Y435 PolarHBondContact O-N 2.91Å; E433-Y435 VanDerWaalsContact C-N 3.28Å; E433-Y435 PolarHBondContact O-N 3.46Å; Y435-V438 WeakPolarHBondContact O-CG2 3.25Å; Y435-L444 HydrophobicContact CD1-CD2 4.25Å; Y435-L444 HydrophobicContact CE1-CD2 4.22Å; Y435-L448 HydrophobicContact CD1-CD1 4.41Å; Y435-L482 HydrophobicContact CD2-CD2 4.21Å; Y435-V485 HydrophobicContact CD1-CG1 4.45Å; Y435-V485 HydrophobicContact CD1-CG2 3.98Å; Y435-V485 HydrophobicContact CD2-CG1 4.44Å; Y435-V485 HydrophobicContact CD2-CG2 3.99Å; Y435-V485 HydrophobicContact CE1-CG1 3.88Å; Y435-V485 HydrophobicContact CE1-CG2 4.24Å; Y435-V485 HydrophobicContact CE2-CG1 3.87Å; Y435-V485 HydrophobicContact CE2-CG2 4.25Å; Y435-V485 HydrophobicContact CG-CG2 3.85Å; Y435-W538 AromaticContact CD1-CD1 3.98Å; Y435-W538 HydrophobicContact CE1-CB 4.44Å; Y435-W538 AromaticContact CE1-CD1 3.89Å; Y435-W538 HydrophobicContact CE2-CB 4.4Å; Y435-L541 HydrophobicContact CE1-CD1 4.13Å
436	W	86.4	Confident	86.8	Confident	90 Å²	90	42.5 Å²	42.5	34%	0.341	21%	0.214	S	C	.	.	H	α-helix	trans	-74.6	-33.1	171.4	-70.6	-23.5	0	0	0	113.4	Q432 E433 V438 R479 F480	Q432-W436 HydrophobicContact CG-CD2 4.36Å; Q432-W436 HydrophobicContact CG-CH2 4.18Å; Q432-W436 HydrophobicContact CG-CZ2 3.76Å; Q432-W436 PolarHBondContact O-N 3.34Å; E433-W436 HydrophobicContact CB-CE3 4.27Å; E433-W436 HydrophobicContact CG-CE3 4.46Å; E433-W436 WeakPolarHBondContact O-CA 3.12Å; E433-W436 WeakPolarHBondContact O-CB 3.23Å; E433-W436 PolarHBondContact O-N 3.34Å; W436-V438 PolarHBondContact O-N 2.86Å; W436-R479 HydrophobicContact CZ2-CB 3.84Å; W436-R479 HydrophobicContact CZ2-CG 4.15Å; W436-R479 VanDerWaalsContact NE1-C 3.34Å; W436-F480 PolarHBondContact NE1-O 2.83Å
437	S	84.8	Confident	86.7	Confident	41 Å²	41	44.1 Å²	44.1	29%	0.287	22%	0.223	S	C	.	.	T	Hydrogen-bonded Turn	trans	-75.5	1.7	-179.3	67	0	0	0	0	113.9	E433 L434 S439	E433-S437 PolarHBondContact O-N 3.32Å; L434-S437 PolarHBondContact O-OG 3.49Å; S437-S439 PolarHBondContact O-N 3.47Å
438	V	86.1	Confident	86.7	Confident	7 Å²	7	42.9 Å²	42.9	4%	0.042	22%	0.215	C	C	.	.	S	Bend	trans	-66	132.4	179.4	179.5	0	0	0	0	110.3	Y435 W436 E440 L444 H445 Q542	Y435-V438 WeakPolarHBondContact O-CG2 3.25Å; W436-V438 PolarHBondContact O-N 2.86Å; V438-E440 PolarHBondContact O-N 3.06Å; V438-L444 HydrophobicContact CG1-CB 4.3Å; V438-L444 HydrophobicContact CG1-CD2 4.18Å; V438-L444 HydrophobicContact CG1-CG 4.42Å; V438-L444 HydrophobicContact CG2-CD2 3.99Å; V438-H445 HydrophobicContact CG1-CB 4.2Å; V438-Q542 HydrophobicContact CG1-CG 4.4Å; V438-Q542 HydrophobicContact CG2-CG 4.35Å
439	S	82.8	Confident	86.9	Confident	73 Å²	73	44.2 Å²	44.2	51%	0.51	22%	0.223	S	C	.	.			trans	-57.2	134	178.8	177.4	0	0	0	0	112.3	S437 K441 S442 H445	S437-S439 PolarHBondContact O-N 3.47Å; S439-K441 PolarHBondContact O-N 2.89Å; S439-K441 PolarHBondContact OG-N 3.43Å; S439-S442 VanDerWaalsContact O-CB 3.23Å; S439-S442 WeakPolarHBondContact O-CB 3.34Å; S439-S442 PolarHBondContact O-N 3.01Å; S439-H445 WeakPolarHBondContact O-CB 3.31Å
440	E	82.1	Confident	87.1	Confident	107 Å²	107	49.2 Å²	49.2	50%	0.5	24%	0.241	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59	-20.8	177.2	-68.2	168.3	-159.4	0	0	113.1	V438 K477	V438-E440 PolarHBondContact O-N 3.06Å; E440-K477 WeakPolarHBondContact OE1-CE 3.44Å; E440-K477 IonicContact OE1-NZ 3.04Å; E440-K477 PolarHBondContact OE1-NZ 2.98Å
441	K	81.3	Confident	87	Confident	186 Å²	186	47.3 Å²	47.3	81%	0.809	23%	0.234	S	C	*	.	T	Hydrogen-bonded Turn	trans	-84.1	-11.2	177	-62.1	-176.5	179.6	-178.5	0	113.5	S439	S439-K441 PolarHBondContact O-N 2.89Å; S439-K441 PolarHBondContact OG-N 3.43Å
442	S	85.3	Confident	86.8	Confident	29 Å²	29	50.3 Å²	50.3	20%	0.203	25%	0.246	C	C	.	.	S	Bend	trans	-75.6	144.8	-178.1	-178.4	0	0	0	0	111.5	S439 L444 H445 N446	S439-S442 VanDerWaalsContact O-CB 3.23Å; S439-S442 WeakPolarHBondContact O-CB 3.34Å; S439-S442 PolarHBondContact O-N 3.01Å; S442-L444 PolarHBondContact O-N 2.97Å; S442-L444 PolarHBondContact OG-N 3.04Å; S442-H445 PolarHBondContact O-N 2.95Å; S442-N446 PolarHBondContact O-N 2.85Å; S442-N446 PolarHBondContact O-ND2 3.24Å
443	L	87.8	Confident	86.7	Confident	22 Å²	22	54.2 Å²	54.2	12%	0.115	26%	0.264	C	S	.	.	H	α-helix	trans	-53.8	-39.7	171	180	63.3	0	0	0	112.1	H445 N446 L447 M572 L575 E576	L443-H445 VanDerWaalsContact C-N 3.34Å; L443-H445 PolarHBondContact O-N 3.38Å; L443-N446 PolarHBondContact O-N 3.23Å; L443-L447 HydrophobicContact CD1-CG 4.45Å; L443-L447 HydrophobicContact CG-CD1 4.17Å; L443-L447 HydrophobicContact CG-CG 4.46Å; L443-L447 WeakPolarHBondContact O-CG 3.46Å; L443-L447 PolarHBondContact O-N 3.18Å; L443-M572 HydrophobicContact CD2-CB 4.28Å; L443-M572 HydrophobicContact CD2-CE 4.11Å; L443-M572 WeakPolarHBondContact CD2-O 3.32Å; L443-L575 HydrophobicContact CD1-CB 4.41Å; L443-L575 HydrophobicContact CD2-CB 4.2Å; L443-E576 HydrophobicContact CD2-CB 4.15Å
444	L	89.1	Confident	86.4	Confident	1 Å²	1	53.3 Å²	53.3	1%	0.005	26%	0.26	C	S	.	.	H	α-helix	trans	-60.4	-43	179.8	177.8	61.9	0	0	0	112.1	Y435 V438 S442 N446 L447 L448 L541 Q542	Y435-L444 HydrophobicContact CD1-CD2 4.25Å; Y435-L444 HydrophobicContact CE1-CD2 4.22Å; V438-L444 HydrophobicContact CG1-CB 4.3Å; V438-L444 HydrophobicContact CG1-CD2 4.18Å; V438-L444 HydrophobicContact CG1-CG 4.42Å; V438-L444 HydrophobicContact CG2-CD2 3.99Å; S442-L444 PolarHBondContact O-N 2.97Å; S442-L444 PolarHBondContact OG-N 3.04Å; L444-N446 VanDerWaalsContact C-N 3.32Å; L444-N446 PolarHBondContact O-N 2.95Å; L444-L447 PolarHBondContact O-N 3.19Å; L444-L448 HydrophobicContact CD1-CD1 4.09Å; L444-L448 HydrophobicContact CD1-CG 4.11Å; L444-L448 HydrophobicContact CG-CD1 3.94Å; L444-L448 HydrophobicContact CG-CG 4.38Å; L444-L448 WeakPolarHBondContact O-CB 3.39Å; L444-L448 WeakPolarHBondContact O-CG 3.38Å; L444-L448 PolarHBondContact O-N 3.44Å; L444-L541 HydrophobicContact CD1-CB 4.11Å; L444-L541 HydrophobicContact CD1-CD1 4.27Å; L444-L541 HydrophobicContact CD1-CD2 4.34Å; L444-L541 HydrophobicContact CD1-CG 4.5Å; L444-L541 HydrophobicContact CD2-CB 3.85Å; L444-Q542 HydrophobicContact CD2-CG 3.84Å
445	H	89.6	Confident	86	Confident	21 Å²	21	55.9 Å²	55.9	10%	0.097	27%	0.271	C	S	.	.	H	α-helix	trans	-61.2	-43.2	178.6	-173.5	93.2	0	0	0	111	V438 S439 S442 L443 L447 L448 L449 F480	V438-H445 HydrophobicContact CG1-CB 4.2Å; S439-H445 WeakPolarHBondContact O-CB 3.31Å; S442-H445 PolarHBondContact O-N 2.95Å; L443-H445 VanDerWaalsContact C-N 3.34Å; L443-H445 PolarHBondContact O-N 3.38Å; H445-L447 PolarHBondContact O-N 3.01Å; H445-L448 PolarHBondContact O-N 2.99Å; H445-L449 VanDerWaalsContact O-CB 3.31Å; H445-L449 WeakPolarHBondContact O-CB 3.29Å; H445-L449 PolarHBondContact O-N 3.1Å; H445-F480 AromaticContact CE1-CE2 3.67Å; H445-F480 AromaticContact CE1-CZ 3.68Å; H445-F480 AromaticContact ND1-CE2 3.66Å; H445-F480 AromaticContact ND1-CZ 3.95Å
446	N	88.9	Confident	85.5	Confident	85 Å²	85	60 Å²	60	46%	0.455	29%	0.29	S	S	.	.	H	α-helix	trans	-63.4	-39.6	177.1	-66.9	-36.2	0	0	0	112.4	S442 L443 L444 K450	S442-N446 PolarHBondContact O-N 2.85Å; S442-N446 PolarHBondContact O-ND2 3.24Å; L443-N446 PolarHBondContact O-N 3.23Å; L444-N446 VanDerWaalsContact C-N 3.32Å; L444-N446 PolarHBondContact O-N 2.95Å; N446-K450 WeakPolarHBondContact O-CB 3.46Å; N446-K450 PolarHBondContact O-N 3Å
447	L	88.6	Confident	85.1	Confident	34 Å²	34	62 Å²	62	18%	0.178	31%	0.307	C	S	.	.	H	α-helix	trans	-67.9	-43.4	177	-67.3	176.1	0	0	0	112	L443 L444 H445 K450 K451 V488 F492 L575	L443-L447 HydrophobicContact CD1-CG 4.45Å; L443-L447 HydrophobicContact CG-CD1 4.17Å; L443-L447 HydrophobicContact CG-CG 4.46Å; L443-L447 WeakPolarHBondContact O-CG 3.46Å; L443-L447 PolarHBondContact O-N 3.18Å; L444-L447 PolarHBondContact O-N 3.19Å; H445-L447 PolarHBondContact O-N 3.01Å; L447-K450 PolarHBondContact O-N 2.99Å; L447-K451 WeakPolarHBondContact O-CG 3.32Å; L447-K451 PolarHBondContact O-N 3.41Å; L447-V488 HydrophobicContact CB-CG2 4.39Å; L447-F492 HydrophobicContact CD1-CE2 4.46Å; L447-F492 HydrophobicContact CD1-CZ 3.69Å; L447-L575 HydrophobicContact CD1-CD1 4.4Å; L447-L575 HydrophobicContact CD2-CD1 4.3Å
448	L	89	Confident	84.5	Confident	0 Å²	0	65.6 Å²	65.6	0%	0	32%	0.322	C	S	.	.	H	α-helix	trans	-63.7	-42.3	176	-71	172.2	0	0	0	111.4	Y435 L444 H445 K450 K451 Y452 F480 E484 V485 V488	Y435-L448 HydrophobicContact CD1-CD1 4.41Å; L444-L448 HydrophobicContact CD1-CD1 4.09Å; L444-L448 HydrophobicContact CD1-CG 4.11Å; L444-L448 HydrophobicContact CG-CD1 3.94Å; L444-L448 HydrophobicContact CG-CG 4.38Å; L444-L448 WeakPolarHBondContact O-CB 3.39Å; L444-L448 WeakPolarHBondContact O-CG 3.38Å; L444-L448 PolarHBondContact O-N 3.44Å; H445-L448 PolarHBondContact O-N 2.99Å; L448-K450 PolarHBondContact O-N 3.08Å; L448-K451 PolarHBondContact O-N 3.37Å; L448-Y452 WeakPolarHBondContact O-CB 3.43Å; L448-Y452 PolarHBondContact O-N 3.27Å; L448-F480 HydrophobicContact CB-CD1 3.91Å; L448-F480 HydrophobicContact CB-CD2 4.25Å; L448-F480 HydrophobicContact CB-CE1 3.91Å; L448-F480 HydrophobicContact CB-CE2 4.24Å; L448-F480 HydrophobicContact CB-CG 4.09Å; L448-F480 HydrophobicContact CB-CZ 4.08Å; L448-F480 HydrophobicContact CD1-CD2 4.11Å; L448-F480 HydrophobicContact CD1-CE2 4.47Å; L448-F480 HydrophobicContact CD1-CG 4.4Å; L448-E484 HydrophobicContact CD2-CB 4.29Å; L448-V485 HydrophobicContact CD2-CB 4.47Å; L448-V485 HydrophobicContact CD2-CG2 3.86Å; L448-V488 HydrophobicContact CD2-CG2 3.94Å
449	L	89.3	Confident	83.8	Confident	51 Å²	51	69.1 Å²	69.1	27%	0.267	34%	0.341	S	S	.	.	H	α-helix	trans	-59.6	-46.5	175.7	-174.8	63	0	0	0	111.5	H445 K451 Y452 E453 P478 F480	H445-L449 VanDerWaalsContact O-CB 3.31Å; H445-L449 WeakPolarHBondContact O-CB 3.29Å; H445-L449 PolarHBondContact O-N 3.1Å; L449-K451 VanDerWaalsContact C-N 3.33Å; L449-K451 PolarHBondContact O-N 3.49Å; L449-Y452 WeakPolarHBondContact O-CB 3.29Å; L449-Y452 PolarHBondContact O-N 2.68Å; L449-E453 WeakPolarHBondContact O-CG 3.48Å; L449-E453 PolarHBondContact O-N 3.17Å; L449-P478 HydrophobicContact CD1-CB 4.36Å; L449-P478 HydrophobicContact CD1-CG 4.09Å; L449-F480 HydrophobicContact CB-CE1 4.4Å; L449-F480 HydrophobicContact CB-CZ 4.49Å
450	K	87.1	Confident	83	Confident	123 Å²	123	67.7 Å²	67.7	54%	0.535	34%	0.337	S	S	.	.	H	α-helix	trans	-58.8	-42.8	176	-175.6	178.7	178.5	179.8	0	112.3	N446 L447 L448 E453 E454	N446-K450 WeakPolarHBondContact O-CB 3.46Å; N446-K450 PolarHBondContact O-N 3Å; L447-K450 PolarHBondContact O-N 2.99Å; L448-K450 PolarHBondContact O-N 3.08Å; K450-E453 PolarHBondContact O-N 2.91Å; K450-E454 WeakPolarHBondContact O-CG 3.29Å; K450-E454 PolarHBondContact O-N 3.01Å
451	K	86.4	Confident	82.1	Confident	22 Å²	22	66.8 Å²	66.8	10%	0.096	35%	0.348	C	S	.	.	H	α-helix	trans	-70.2	-34.7	177.7	-67.5	-46	-171.7	-179.5	0	113.1	L447 L448 L449 E454 K455 E484 K487 V488 D491	L447-K451 WeakPolarHBondContact O-CG 3.32Å; L447-K451 PolarHBondContact O-N 3.41Å; L448-K451 PolarHBondContact O-N 3.37Å; L449-K451 VanDerWaalsContact C-N 3.33Å; L449-K451 PolarHBondContact O-N 3.49Å; K451-E454 VanDerWaalsContact CD-OE2 3.23Å; K451-E454 WeakPolarHBondContact CD-OE2 3.42Å; K451-E454 IonicContact NZ-OE1 2.86Å; K451-E454 PolarHBondContact NZ-OE1 3.24Å; K451-E454 IonicContact NZ-OE2 3.83Å; K451-E454 PolarHBondContact NZ-OE2 2.76Å; K451-E454 PolarHBondContact O-N 3.12Å; K451-K455 PolarHBondContact O-N 3.05Å; K451-K455 VanDerWaalsContact O-N 3.09Å; K451-E484 HydrophobicContact CB-CB 4.27Å; K451-E484 HydrophobicContact CB-CG 4.42Å; K451-K487 HydrophobicContact CD-CD 4Å; K451-K487 HydrophobicContact CD-CG 4.31Å; K451-K487 HydrophobicContact CG-CD 4.48Å; K451-V488 HydrophobicContact CB-CG2 4.5Å; K451-V488 HydrophobicContact CG-CG2 3.7Å; K451-D491 WeakPolarHBondContact CE-OD2 3.5Å; K451-D491 IonicContact NZ-OD1 2.71Å; K451-D491 IonicContact NZ-OD2 3.15Å; K451-D491 PolarHBondContact NZ-OD2 3.04Å
452	Y	84.8	Confident	81	Confident	64 Å²	64	62 Å²	62	25%	0.251	34%	0.343	S	S	.	.	H	α-helix	trans	-62.6	-46.4	173.3	179.2	-100.6	0	0	0	111	L448 L449 K455 Q456 P478	L448-Y452 WeakPolarHBondContact O-CB 3.43Å; L448-Y452 PolarHBondContact O-N 3.27Å; L449-Y452 WeakPolarHBondContact O-CB 3.29Å; L449-Y452 PolarHBondContact O-N 2.68Å; Y452-K455 WeakPolarHBondContact O-CB 3.42Å; Y452-K455 PolarHBondContact O-N 2.8Å; Y452-Q456 HydrophobicContact CD1-CG 4.35Å; Y452-Q456 HydrophobicContact CE1-CG 3.98Å; Y452-Q456 WeakPolarHBondContact O-CG 3.44Å; Y452-Q456 PolarHBondContact O-N 3.49Å; Y452-Q456 PolarHBondContact OH-NE2 3.1Å; Y452-Q456 VanDerWaalsContact OH-NE2 3.12Å; Y452-P478 HydrophobicContact CE1-CB 4.49Å
453	E	85.1	Confident	79.5	Confident	105 Å²	105	69 Å²	69	49%	0.491	37%	0.365	S	S	.	.	H	α-helix	trans	-61.8	-44.3	175.4	-71	174.8	175.9	0	0	112.5	L449 K450 K455 Q456 L457	L449-E453 WeakPolarHBondContact O-CG 3.48Å; L449-E453 PolarHBondContact O-N 3.17Å; K450-E453 PolarHBondContact O-N 2.91Å; E453-K455 VanDerWaalsContact C-N 3.28Å; E453-K455 PolarHBondContact O-N 3.46Å; E453-Q456 PolarHBondContact O-N 3.4Å; E453-L457 WeakPolarHBondContact O-CG 3.39Å; E453-L457 PolarHBondContact O-N 3.38Å
454	E	82.5	Confident	77.6	Confident	56 Å²	56	74.1 Å²	74.1	26%	0.262	40%	0.397	S	S	.	.	H	α-helix	trans	-56	-42	174.4	-77	174.7	-166.2	0	0	111.9	K450 K451 L457 L458 K487	K450-E454 WeakPolarHBondContact O-CG 3.29Å; K450-E454 PolarHBondContact O-N 3.01Å; K451-E454 VanDerWaalsContact CD-OE2 3.23Å; K451-E454 WeakPolarHBondContact CD-OE2 3.42Å; K451-E454 IonicContact NZ-OE1 2.86Å; K451-E454 PolarHBondContact NZ-OE1 3.24Å; K451-E454 IonicContact NZ-OE2 3.83Å; K451-E454 PolarHBondContact NZ-OE2 2.76Å; K451-E454 PolarHBondContact O-N 3.12Å; E454-L457 PolarHBondContact O-N 2.76Å; E454-L458 WeakPolarHBondContact O-CG 3.45Å; E454-L458 PolarHBondContact O-N 3.36Å; E454-L458 VanDerWaalsContact O-N 3.11Å; E454-K487 IonicContact OE2-NZ 2.88Å; E454-K487 PolarHBondContact OE2-NZ 3.31Å
455	K	79.8	Confident	75.7	Confident	54 Å²	54	80.6 Å²	80.6	24%	0.235	44%	0.439	C	S	.	.	H	α-helix	trans	-67.4	-43.2	177.3	178	-176.2	172.7	-179.7	0	111.6	K451 Y452 E453 L457 L458 L459 T481 F483 E484	K451-K455 PolarHBondContact O-N 3.05Å; K451-K455 VanDerWaalsContact O-N 3.09Å; Y452-K455 WeakPolarHBondContact O-CB 3.42Å; Y452-K455 PolarHBondContact O-N 2.8Å; E453-K455 VanDerWaalsContact C-N 3.28Å; E453-K455 PolarHBondContact O-N 3.46Å; K455-L457 VanDerWaalsContact C-N 3.29Å; K455-L457 PolarHBondContact O-N 2.82Å; K455-L458 PolarHBondContact O-N 3.31Å; K455-L459 HydrophobicContact CG-CD1 3.99Å; K455-L459 HydrophobicContact CG-CG 4.5Å; K455-L459 WeakPolarHBondContact O-CG 3.32Å; K455-L459 PolarHBondContact O-N 3.33Å; K455-T481 PolarHBondContact NZ-OG1 2.87Å; K455-F483 HydrophobicContact CD-CD1 4.22Å; K455-F483 HydrophobicContact CD-CE1 4.43Å; K455-E484 WeakPolarHBondContact CD-OE1 3.44Å; K455-E484 WeakPolarHBondContact CE-OE1 3.03Å; K455-E484 IonicContact NZ-OE1 2.68Å; K455-E484 PolarHBondContact NZ-OE1 3.38Å
456	Q	78.8	Confident	73.6	Confident	88 Å²	88	82.3 Å²	82.3	41%	0.411	46%	0.463	S	S	.	.	H	α-helix	trans	-62.1	-38.1	177.3	-70	-64.1	-11.3	0	0	111.7	Y452 E453 L459 G460	Y452-Q456 HydrophobicContact CD1-CG 4.35Å; Y452-Q456 HydrophobicContact CE1-CG 3.98Å; Y452-Q456 WeakPolarHBondContact O-CG 3.44Å; Y452-Q456 PolarHBondContact O-N 3.49Å; Y452-Q456 PolarHBondContact OH-NE2 3.1Å; Y452-Q456 VanDerWaalsContact OH-NE2 3.12Å; E453-Q456 PolarHBondContact O-N 3.4Å; Q456-L459 PolarHBondContact O-N 3.4Å; Q456-G460 PolarHBondContact O-N 3.23Å
457	L	77.3	Confident	71.5	Confident	132 Å²	132	84.1 Å²	84.1	69%	0.691	48%	0.48	S	S	*	.	H	α-helix	trans	-64.9	-42.7	174.5	-71.3	170.5	0	0	0	112.5	E453 E454 K455 G460 A461	E453-L457 WeakPolarHBondContact O-CG 3.39Å; E453-L457 PolarHBondContact O-N 3.38Å; E454-L457 PolarHBondContact O-N 2.76Å; K455-L457 VanDerWaalsContact C-N 3.29Å; K455-L457 PolarHBondContact O-N 2.82Å; L457-G460 PolarHBondContact O-N 2.88Å; L457-A461 WeakPolarHBondContact O-CB 3.47Å; L457-A461 PolarHBondContact O-N 2.91Å
458	L	73.9	Confident	69.4	Low	118 Å²	118	88.8 Å²	88.8	62%	0.618	51%	0.512	S	S	*	.	H	α-helix	trans	-64.3	-41.1	175.9	-71.6	170.7	0	0	0	112.1	E454 K455 A461 A462	E454-L458 WeakPolarHBondContact O-CG 3.45Å; E454-L458 PolarHBondContact O-N 3.36Å; E454-L458 VanDerWaalsContact O-N 3.11Å; K455-L458 PolarHBondContact O-N 3.31Å; L458-A461 PolarHBondContact O-N 3.47Å; L458-A462 PolarHBondContact O-N 2.87Å
459	L	71.1	Confident	66.7	Low	81 Å²	81	91.4 Å²	91.4	42%	0.424	54%	0.539	S	S	.	.	H	α-helix	trans	-68.8	-34.1	175.5	-70.6	170.7	0	0	0	112.2	K455 Q456 A462 R463	K455-L459 HydrophobicContact CG-CD1 3.99Å; K455-L459 HydrophobicContact CG-CG 4.5Å; K455-L459 WeakPolarHBondContact O-CG 3.32Å; K455-L459 PolarHBondContact O-N 3.33Å; Q456-L459 PolarHBondContact O-N 3.4Å; L459-A462 PolarHBondContact O-N 2.87Å; L459-R463 PolarHBondContact O-N 3.31Å
460	G	65.8	Low	64.3	Low	43 Å²	43	98.4 Å²	98.4	44%	0.443	57%	0.57	S	S	.	*	H	α-helix	trans	-66.7	-40.3	173.4	0	0	0	0	0	112.7	Q456 L457 A462 R463	Q456-G460 PolarHBondContact O-N 3.23Å; L457-G460 PolarHBondContact O-N 2.88Å; G460-A462 VanDerWaalsContact C-N 3.3Å; G460-A462 PolarHBondContact O-N 3.43Å; G460-R463 PolarHBondContact O-N 2.79Å
461	A	63.6	Low	61.7	Low	88 Å²	88	99.7 Å²	99.7	73%	0.727	58%	0.577	S	S	*	*	H	α-helix	trans	-68.8	-26.7	176.3	0	0	0	0	0	113.3	L457 L458	L457-A461 WeakPolarHBondContact O-CB 3.47Å; L457-A461 PolarHBondContact O-N 2.91Å; L458-A461 PolarHBondContact O-N 3.47Å
462	A	57.7	Low	59.4	Low	84 Å²	84	103.8 Å²	103.8	69%	0.694	61%	0.606	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.7	-12.9	176.3	0	0	0	0	0	113.8	L458 L459 G460	L458-A462 PolarHBondContact O-N 2.87Å; L459-A462 PolarHBondContact O-N 2.87Å; G460-A462 VanDerWaalsContact C-N 3.3Å; G460-A462 PolarHBondContact O-N 3.43Å
463	R	52.8	Low	57.1	Low	176 Å²	176	105.6 Å²	105.6	66%	0.664	63%	0.628	S	S	*	*	S	Bend	trans	-88.2	114.4	175.6	-74.6	179.3	178	175	2.1	110.1	L459 G460	L459-R463 PolarHBondContact O-N 3.31Å; G460-R463 PolarHBondContact O-N 2.79Å
464	T	48.7	Very low	54.9	Low	131 Å²	131	108.9 Å²	108.9	80%	0.804	64%	0.644	S	S	*	*			trans	-59	147.5	166.2	37.9	0	0	0	0	111.3	G466	T464-G466 PolarHBondContact O-N 2.98Å
465	P	49.1	Very low	52.9	Low	136 Å²	136	115.5 Å²	115.5	88%	0.883	68%	0.675	S	S	*	*			trans	-69.8	95.8	-176.6	28.4	-33.7	0	0	0	111
466	G	45	Very low	51.4	Low	58 Å²	58	115.5 Å²	115.5	60%	0.598	69%	0.69	S	S	*	*			trans	-97.1	159.2	164	0	0	0	0	0	111.2	T464	T464-G466 PolarHBondContact O-N 2.98Å
467	P	44.7	Very low	50.5	Low	123 Å²	123	118.9 Å²	118.9	80%	0.799	70%	0.703	S	S	*	*			trans	-64.7	152.2	-173.4	26.8	-32.6	0	0	0	112.1	G469	P467-G469 PolarHBondContact O-N 3.34Å
468	P	44.5	Very low	49.9	Very low	131 Å²	131	114.8 Å²	114.8	85%	0.851	69%	0.685	S	S	*	*			trans	-72.7	91.9	-168.1	29.4	-33.7	0	0	0	111.3
469	G	33.4	Very low	49.9	Very low	56 Å²	56	117.8 Å²	117.8	58%	0.577	69%	0.688	S	S	*	*			trans	-75.3	133.9	161.5	0	0	0	0	0	109.8	P467 H471	P467-G469 PolarHBondContact O-N 3.34Å; G469-H471 PolarHBondContact O-N 2.92Å
470	H	37.5	Very low	50.4	Low	197 Å²	197	114.1 Å²	114.1	91%	0.912	67%	0.668	S	S	*	*			trans	-42.6	110.1	177.2	-83.6	6.7	0	0	0	112.8
471	H	34.1	Very low	51.2	Low	150 Å²	150	114.3 Å²	114.3	69%	0.694	66%	0.661	S	S	*	*			trans	-86	128	157.1	-72.5	-60	0	0	0	107.7	G469 S473	G469-H471 PolarHBondContact O-N 2.92Å; H471-S473 PolarHBondContact O-N 2.8Å
472	P	37.2	Very low	52.1	Low	108 Å²	108	111 Å²	111	70%	0.701	63%	0.631	S	S	*	*			trans	-64.6	130.1	171	26.5	-28.6	0	0	0	108	E474	P472-E474 PolarHBondContact O-N 2.86Å
473	S	36.3	Very low	53.3	Low	102 Å²	102	110.5 Å²	110.5	71%	0.713	61%	0.614	S	S	*	*			trans	-64.5	103.5	166	68.1	0	0	0	0	107.5	H471 Q475	H471-S473 PolarHBondContact O-N 2.8Å; S473-Q475 VanDerWaalsContact C-N 3.32Å; S473-Q475 PolarHBondContact O-N 3.39Å
474	E	40	Very low	54.8	Low	174 Å²	174	102.2 Å²	102.2	81%	0.813	58%	0.582	S	S	*	*			trans	-71.8	95.8	165.7	-74.1	-170.6	162.1	0	0	107.4	P472 G476	P472-E474 PolarHBondContact O-N 2.86Å; E474-G476 PolarHBondContact O-N 3.15Å
475	Q	39.8	Very low	56.6	Low	195 Å²	195	96.1 Å²	96.1	91%	0.911	55%	0.545	S	S	*	.			trans	-69.6	47.1	162.8	-68.6	179	-20.7	0	0	110.1	S473	S473-Q475 VanDerWaalsContact C-N 3.32Å; S473-Q475 PolarHBondContact O-N 3.39Å
476	G	48.8	Very low	58.4	Low	55 Å²	55	90 Å²	90	57%	0.567	51%	0.505	S	S	*	.	S	Bend	trans	-124.7	153.1	-176	0	0	0	0	0	111.4	E474	E474-G476 PolarHBondContact O-N 3.15Å
477	K	59.3	Low	60.3	Low	158 Å²	158	89.9 Å²	89.9	69%	0.687	49%	0.489	S	S	*	.			trans	-57	141.7	174.9	-68	-170.4	-179.6	-149.2	0	110.6	E440 R479	E440-K477 WeakPolarHBondContact OE1-CE 3.44Å; E440-K477 IonicContact OE1-NZ 3.04Å; E440-K477 PolarHBondContact OE1-NZ 2.98Å; K477-R479 PolarHBondContact O-N 3.35Å
478	P	65.4	Low	62.4	Low	46 Å²	46	84.2 Å²	84.2	30%	0.299	45%	0.452	S	S	.	.			trans	-60.6	124.3	178.6	25	-32.9	0	0	0	110.3	L449 Y452 F480	L449-P478 HydrophobicContact CD1-CB 4.36Å; L449-P478 HydrophobicContact CD1-CG 4.09Å; Y452-P478 HydrophobicContact CE1-CB 4.49Å; P478-F480 HydrophobicContact CB-CE1 4.16Å; P478-F480 HydrophobicContact CB-CZ 4.35Å; P478-F480 HydrophobicContact CG-CE1 4.28Å; P478-F480 HydrophobicContact CG-CZ 4Å
479	R	73.6	Confident	64.4	Low	182 Å²	182	78 Å²	78	69%	0.687	41%	0.411	S	S	*	.			trans	-92.3	100.8	177.1	-71.5	-175.4	176.9	-176.9	-2.6	110.1	W436 K477	W436-R479 HydrophobicContact CZ2-CB 3.84Å; W436-R479 HydrophobicContact CZ2-CG 4.15Å; W436-R479 VanDerWaalsContact NE1-C 3.34Å; K477-R479 PolarHBondContact O-N 3.35Å
480	F	80.3	Confident	66.9	Low	3 Å²	3	80 Å²	80	1%	0.013	40%	0.404	C	S	.	.			trans	-66.5	146.4	174.5	-49.5	-58.5	0	0	0	112.2	Q432 W436 H445 L448 L449 P478	Q432-F480 PolarHBondContact NE2-O 2.95Å; W436-F480 PolarHBondContact NE1-O 2.83Å; H445-F480 AromaticContact CE1-CE2 3.67Å; H445-F480 AromaticContact CE1-CZ 3.68Å; H445-F480 AromaticContact ND1-CE2 3.66Å; H445-F480 AromaticContact ND1-CZ 3.95Å; L448-F480 HydrophobicContact CB-CD1 3.91Å; L448-F480 HydrophobicContact CB-CD2 4.25Å; L448-F480 HydrophobicContact CB-CE1 3.91Å; L448-F480 HydrophobicContact CB-CE2 4.24Å; L448-F480 HydrophobicContact CB-CG 4.09Å; L448-F480 HydrophobicContact CB-CZ 4.08Å; L448-F480 HydrophobicContact CD1-CD2 4.11Å; L448-F480 HydrophobicContact CD1-CE2 4.47Å; L448-F480 HydrophobicContact CD1-CG 4.4Å; L449-F480 HydrophobicContact CB-CE1 4.4Å; L449-F480 HydrophobicContact CB-CZ 4.49Å; P478-F480 HydrophobicContact CB-CE1 4.16Å; P478-F480 HydrophobicContact CB-CZ 4.35Å; P478-F480 HydrophobicContact CG-CE1 4.28Å; P478-F480 HydrophobicContact CG-CZ 4Å
481	T	83.6	Confident	69.1	Low	48 Å²	48	74.5 Å²	74.5	29%	0.294	38%	0.381	S	S	.	.			trans	-106.7	162.2	170.8	70.4	0	0	0	0	109.8	K455 F483 E484	K455-T481 PolarHBondContact NZ-OG1 2.87Å; T481-F483 PolarHBondContact O-N 2.98Å; T481-E484 VanDerWaalsContact C-OE2 3.29Å; T481-E484 WeakPolarHBondContact CA-OE2 3.46Å; T481-E484 VanDerWaalsContact CB-OE2 3.25Å; T481-E484 WeakPolarHBondContact CB-OE2 3.4Å; T481-E484 PolarHBondContact N-OE2 3.17Å; T481-E484 PolarHBondContact O-N 3.42Å; T481-E484 VanDerWaalsContact O-N 3.11Å; T481-E484 VanDerWaalsContact OG1-CD 3.26Å; T481-E484 PolarHBondContact OG1-OE1 3.29Å; T481-E484 PolarHBondContact OG1-OE2 3.41Å
482	L	82.9	Confident	71.6	Confident	18 Å²	18	67.8 Å²	67.8	9%	0.094	35%	0.35	C	S	.	.	H	α-helix	trans	-61.6	-17.3	176.6	-64	176.2	0	0	0	112.8	Y428 L431 Q432 Y435 V485 A486 Y501	Y428-L482 HydrophobicContact CD1-CD1 3.62Å; Y428-L482 HydrophobicContact CG-CD1 4.18Å; L431-L482 HydrophobicContact CD2-CD2 4.03Å; L431-L482 HydrophobicContact CG-CD2 4.07Å; Q432-L482 HydrophobicContact CB-CD2 4.37Å; Q432-L482 HydrophobicContact CB-CG 4.37Å; Y435-L482 HydrophobicContact CD2-CD2 4.21Å; L482-V485 PolarHBondContact O-N 2.9Å; L482-A486 WeakPolarHBondContact O-CB 3Å; L482-A486 PolarHBondContact O-N 3.38Å; L482-Y501 HydrophobicContact CB-CG 4.29Å; L482-Y501 HydrophobicContact CD1-CD1 4.24Å
483	F	81.9	Confident	73.7	Confident	74 Å²	74	62.7 Å²	62.7	33%	0.325	32%	0.317	S	S	.	.	H	α-helix	trans	-66.2	-42.4	173.3	-179.8	-94	0	0	0	112.8	K455 T481 V485 A486 K487	K455-F483 HydrophobicContact CD-CD1 4.22Å; K455-F483 HydrophobicContact CD-CE1 4.43Å; T481-F483 PolarHBondContact O-N 2.98Å; F483-V485 VanDerWaalsContact C-N 3.29Å; F483-A486 PolarHBondContact O-N 3.12Å; F483-K487 PolarHBondContact O-N 2.86Å
484	E	84.6	Confident	75.8	Confident	2 Å²	2	62.5 Å²	62.5	1%	0.009	31%	0.305	C	S	.	.	H	α-helix	trans	-66	-37.8	175.7	-66.2	78.8	-158.7	0	0	110.4	L448 K451 K455 T481 K487 V488	L448-E484 HydrophobicContact CD2-CB 4.29Å; K451-E484 HydrophobicContact CB-CB 4.27Å; K451-E484 HydrophobicContact CB-CG 4.42Å; K455-E484 WeakPolarHBondContact CD-OE1 3.44Å; K455-E484 WeakPolarHBondContact CE-OE1 3.03Å; K455-E484 IonicContact NZ-OE1 2.68Å; K455-E484 PolarHBondContact NZ-OE1 3.38Å; T481-E484 VanDerWaalsContact C-OE2 3.29Å; T481-E484 WeakPolarHBondContact CA-OE2 3.46Å; T481-E484 VanDerWaalsContact CB-OE2 3.25Å; T481-E484 WeakPolarHBondContact CB-OE2 3.4Å; T481-E484 PolarHBondContact N-OE2 3.17Å; T481-E484 PolarHBondContact O-N 3.42Å; T481-E484 VanDerWaalsContact O-N 3.11Å; T481-E484 VanDerWaalsContact OG1-CD 3.26Å; T481-E484 PolarHBondContact OG1-OE1 3.29Å; T481-E484 PolarHBondContact OG1-OE2 3.41Å; E484-K487 PolarHBondContact O-N 2.83Å; E484-V488 WeakPolarHBondContact O-CG2 3.35Å; E484-V488 PolarHBondContact O-N 3.11Å
485	V	87.4	Confident	77.1	Confident	2 Å²	2	57.6 Å²	57.6	1%	0.012	28%	0.284	C	S	.	.	H	α-helix	trans	-60.5	-48.2	174.2	-178.5	0	0	0	0	110.9	Y435 L448 L482 F483 K487 V488 L489	Y435-V485 HydrophobicContact CD1-CG1 4.45Å; Y435-V485 HydrophobicContact CD1-CG2 3.98Å; Y435-V485 HydrophobicContact CD2-CG1 4.44Å; Y435-V485 HydrophobicContact CD2-CG2 3.99Å; Y435-V485 HydrophobicContact CE1-CG1 3.88Å; Y435-V485 HydrophobicContact CE1-CG2 4.24Å; Y435-V485 HydrophobicContact CE2-CG1 3.87Å; Y435-V485 HydrophobicContact CE2-CG2 4.25Å; Y435-V485 HydrophobicContact CG-CG2 3.85Å; L448-V485 HydrophobicContact CD2-CB 4.47Å; L448-V485 HydrophobicContact CD2-CG2 3.86Å; L482-V485 PolarHBondContact O-N 2.9Å; F483-V485 VanDerWaalsContact C-N 3.29Å; V485-K487 VanDerWaalsContact C-N 3.26Å; V485-K487 PolarHBondContact O-N 3.21Å; V485-V488 PolarHBondContact O-N 2.8Å; V485-V488 VanDerWaalsContact O-N 3.16Å; V485-L489 HydrophobicContact CG1-CD1 4.16Å; V485-L489 WeakPolarHBondContact O-CG 3.4Å; V485-L489 PolarHBondContact O-N 3.27Å
486	A	85.8	Confident	78.4	Confident	7 Å²	7	48.5 Å²	48.5	6%	0.058	24%	0.242	C	C	.	.	H	α-helix	trans	-58.5	-37.9	176.1	0	0	0	0	0	112.5	L482 F483 L489 K490 F500 Y501	L482-A486 WeakPolarHBondContact O-CB 3Å; L482-A486 PolarHBondContact O-N 3.38Å; F483-A486 PolarHBondContact O-N 3.12Å; A486-L489 PolarHBondContact O-N 3.33Å; A486-K490 VanDerWaalsContact O-CB 3.31Å; A486-K490 WeakPolarHBondContact O-CB 3.04Å; A486-K490 PolarHBondContact O-N 3.26Å; A486-F500 WeakPolarHBondContact CB-O 3.48Å; A486-Y501 HydrophobicContact CB-CD2 4.35Å
487	K	84.8	Confident	79.4	Confident	57 Å²	57	46.2 Å²	46.2	25%	0.248	22%	0.218	C	C	.	.	H	α-helix	trans	-69.2	-38.8	177.1	-164.8	177.6	-176.2	-164	0	112.1	K451 E454 F483 E484 V485 K490 D491	K451-K487 HydrophobicContact CD-CD 4Å; K451-K487 HydrophobicContact CD-CG 4.31Å; K451-K487 HydrophobicContact CG-CD 4.48Å; E454-K487 IonicContact OE2-NZ 2.88Å; E454-K487 PolarHBondContact OE2-NZ 3.31Å; F483-K487 PolarHBondContact O-N 2.86Å; E484-K487 PolarHBondContact O-N 2.83Å; V485-K487 VanDerWaalsContact C-N 3.26Å; V485-K487 PolarHBondContact O-N 3.21Å; K487-K490 PolarHBondContact O-N 3.02Å; K487-D491 PolarHBondContact O-N 3.07Å
488	V	88.3	Confident	79.7	Confident	4 Å²	4	43.5 Å²	43.5	2%	0.024	21%	0.206	C	C	.	.	H	α-helix	trans	-64	-45.6	172.7	172.9	0	0	0	0	110.6	L447 L448 K451 E484 V485 K490 D491 F492	L447-V488 HydrophobicContact CB-CG2 4.39Å; L448-V488 HydrophobicContact CD2-CG2 3.94Å; K451-V488 HydrophobicContact CB-CG2 4.5Å; K451-V488 HydrophobicContact CG-CG2 3.7Å; E484-V488 WeakPolarHBondContact O-CG2 3.35Å; E484-V488 PolarHBondContact O-N 3.11Å; V485-V488 PolarHBondContact O-N 2.8Å; V485-V488 VanDerWaalsContact O-N 3.16Å; V488-K490 VanDerWaalsContact C-N 3.31Å; V488-K490 PolarHBondContact O-N 2.7Å; V488-D491 WeakPolarHBondContact O-CB 3.12Å; V488-D491 PolarHBondContact O-N 3.28Å; V488-D491 VanDerWaalsContact O-N 3.14Å; V488-F492 HydrophobicContact CG1-CD2 4.12Å; V488-F492 HydrophobicContact CG1-CE2 3.55Å; V488-F492 HydrophobicContact CG1-CZ 4.12Å; V488-F492 WeakPolarHBondContact O-CD2 3.45Å; V488-F492 PolarHBondContact O-N 3.42Å
489	L	87.6	Confident	79.8	Confident	0 Å²	0	43.3 Å²	43.3	0%	0	21%	0.212	C	C	.	.	H	α-helix	trans	-61.3	-39.7	175.9	-72.9	173.1	0	0	0	112	V485 A486 D491 F492 L493 F500 Y501 L537 L541 I568	V485-L489 HydrophobicContact CG1-CD1 4.16Å; V485-L489 WeakPolarHBondContact O-CG 3.4Å; V485-L489 PolarHBondContact O-N 3.27Å; A486-L489 PolarHBondContact O-N 3.33Å; L489-D491 VanDerWaalsContact C-N 3.32Å; L489-D491 PolarHBondContact O-N 3.06Å; L489-F492 PolarHBondContact O-N 2.88Å; L489-F492 VanDerWaalsContact O-N 3.11Å; L489-L493 PolarHBondContact O-N 2.98Å; L489-F500 HydrophobicContact CD1-CD2 4.34Å; L489-Y501 HydrophobicContact CD1-CD2 4.42Å; L489-Y501 HydrophobicContact CD1-CE2 3.86Å; L489-L537 HydrophobicContact CD1-CD1 4.27Å; L489-L537 HydrophobicContact CD2-CD2 4.2Å; L489-L541 HydrophobicContact CD2-CD1 4Å; L489-I568 HydrophobicContact CD2-CD1 4.26Å
490	K	85.7	Confident	79.7	Confident	97 Å²	97	35.3 Å²	35.3	42%	0.422	18%	0.182	S	C	.	.	H	α-helix	trans	-62.6	-36.3	174.2	-175.6	171.7	-175.6	167.1	0	112.8	A486 K487 V488 F492 H494	A486-K490 VanDerWaalsContact O-CB 3.31Å; A486-K490 WeakPolarHBondContact O-CB 3.04Å; A486-K490 PolarHBondContact O-N 3.26Å; K487-K490 PolarHBondContact O-N 3.02Å; V488-K490 VanDerWaalsContact C-N 3.31Å; V488-K490 PolarHBondContact O-N 2.7Å; K490-F492 PolarHBondContact O-N 3.48Å; K490-H494 VanDerWaalsContact O-CA 3.23Å; K490-H494 WeakPolarHBondContact O-CA 3.5Å; K490-H494 PolarHBondContact O-N 3.3Å
491	D	84.8	Confident	79.5	Confident	82 Å²	82	36.8 Å²	36.8	44%	0.439	19%	0.188	S	C	.	.	H	α-helix	trans	-66.4	-25.9	175.5	-75.9	-2.1	0	0	0	112.1	K451 K487 V488 L489	K451-D491 WeakPolarHBondContact CE-OD2 3.5Å; K451-D491 IonicContact NZ-OD1 2.71Å; K451-D491 IonicContact NZ-OD2 3.15Å; K451-D491 PolarHBondContact NZ-OD2 3.04Å; K487-D491 PolarHBondContact O-N 3.07Å; V488-D491 WeakPolarHBondContact O-CB 3.12Å; V488-D491 PolarHBondContact O-N 3.28Å; V488-D491 VanDerWaalsContact O-N 3.14Å; L489-D491 VanDerWaalsContact C-N 3.32Å; L489-D491 PolarHBondContact O-N 3.06Å
492	F	86.2	Confident	78.5	Confident	9 Å²	9	38.3 Å²	38.3	4%	0.039	19%	0.192	C	C	.	.	H	α-helix	trans	-91	-51.3	178.7	-62.5	-35.9	0	0	0	113.6	L447 V488 L489 K490 H494 L541 K567 I568 E571 M572 L575	L447-F492 HydrophobicContact CD1-CE2 4.46Å; L447-F492 HydrophobicContact CD1-CZ 3.69Å; V488-F492 HydrophobicContact CG1-CD2 4.12Å; V488-F492 HydrophobicContact CG1-CE2 3.55Å; V488-F492 HydrophobicContact CG1-CZ 4.12Å; V488-F492 WeakPolarHBondContact O-CD2 3.45Å; V488-F492 PolarHBondContact O-N 3.42Å; L489-F492 PolarHBondContact O-N 2.88Å; L489-F492 VanDerWaalsContact O-N 3.11Å; K490-F492 PolarHBondContact O-N 3.48Å; F492-H494 PolarHBondContact O-ND1 3.48Å; F492-L541 HydrophobicContact CD2-CD2 4.07Å; F492-L541 HydrophobicContact CE2-CD2 3.7Å; F492-K567 VanDerWaalsContact O-CE 3.26Å; F492-K567 WeakPolarHBondContact O-CE 3.35Å; F492-I568 HydrophobicContact CB-CG1 4.43Å; F492-I568 HydrophobicContact CD2-CG2 4.36Å; F492-E571 HydrophobicContact CD1-CB 3.69Å; F492-E571 HydrophobicContact CD1-CG 4.3Å; F492-E571 HydrophobicContact CE1-CB 4.03Å; F492-E571 HydrophobicContact CG-CB 4.49Å; F492-M572 HydrophobicContact CE2-CG 4.22Å; F492-M572 HydrophobicContact CZ-CG 4Å; F492-L575 HydrophobicContact CE1-CD1 3.87Å; F492-L575 HydrophobicContact CZ-CD1 4.39Å
493	L	80.7	Confident	76.8	Confident	1 Å²	1	43.8 Å²	43.8	1%	0.005	22%	0.215	C	C	.	.	H	α-helix	trans	-101.3	6.7	-172.3	-69.1	170	0	0	0	113.3	L489 D495 S496 C497 A564 K567 I568 W621	L489-L493 PolarHBondContact O-N 2.98Å; L493-D495 PolarHBondContact O-N 3.37Å; L493-S496 VanDerWaalsContact O-CB 3.27Å; L493-S496 WeakPolarHBondContact O-CB 3.47Å; L493-S496 PolarHBondContact O-N 3.26Å; L493-C497 HydrophobicContact CB-CB 4.13Å; L493-C497 VanDerWaalsContact CB-SG 3.57Å; L493-C497 WeakPolarHBondContact CD1-SG 3.21Å; L493-A564 HydrophobicContact CD1-CB 4.43Å; L493-A564 HydrophobicContact CD2-CB 4.29Å; L493-K567 HydrophobicContact CD2-CB 3.96Å; L493-K567 HydrophobicContact CD2-CG 3.82Å; L493-I568 HydrophobicContact CD1-CD1 3.93Å; L493-I568 HydrophobicContact CD1-CG1 4.15Å; L493-I568 HydrophobicContact CG-CG1 4.23Å; L493-W621 HydrophobicContact CD1-CZ3 4.16Å
494	H	79.8	Confident	74.4	Confident	98 Å²	98	46.7 Å²	46.7	45%	0.454	23%	0.231	S	C	.	.	G	3₁₀ helix	trans	50.8	-122.4	173.6	-65.5	68.2	0	0	0	112.9	K490 F492 S496	K490-H494 VanDerWaalsContact O-CA 3.23Å; K490-H494 WeakPolarHBondContact O-CA 3.5Å; K490-H494 PolarHBondContact O-N 3.3Å; F492-H494 PolarHBondContact O-ND1 3.48Å; H494-S496 VanDerWaalsContact C-N 3.32Å
495	D	68.4	Low	72	Confident	72 Å²	72	50.6 Å²	50.6	39%	0.385	26%	0.257	S	S	.	.	G	3₁₀ helix	trans	-81.1	-15.6	-176.6	-64.4	-35.9	0	0	0	112	L493 C497 K498	L493-D495 PolarHBondContact O-N 3.37Å; D495-C497 PolarHBondContact O-N 3.47Å; D495-C497 VanDerWaalsContact O-N 3.16Å; D495-K498 WeakPolarHBondContact O-CB 3.37Å; D495-K498 PolarHBondContact O-N 2.97Å; D495-K498 VanDerWaalsContact O-N 3.14Å
496	S	67.8	Low	69.2	Low	4 Å²	4	55.2 Å²	55.2	3%	0.028	30%	0.295	C	S	.	.	G	3₁₀ helix	trans	-69	-9	176.7	-57.3	0	0	0	0	115	L493 H494 S622 S624 E632	L493-S496 VanDerWaalsContact O-CB 3.27Å; L493-S496 WeakPolarHBondContact O-CB 3.47Å; L493-S496 PolarHBondContact O-N 3.26Å; H494-S496 VanDerWaalsContact C-N 3.32Å; S496-S622 VanDerWaalsContact O-CB 3.26Å; S496-S622 WeakPolarHBondContact O-CB 3.36Å; S496-S624 VanDerWaalsContact CA-OG 3.24Å; S496-S624 WeakPolarHBondContact CA-OG 3.33Å; S496-S624 WeakPolarHBondContact CB-OG 3.38Å; S496-E632 WeakPolarHBondContact CB-OE2 3.46Å; S496-E632 PolarHBondContact OG-OE1 3.44Å; S496-E632 PolarHBondContact OG-OE2 3.2Å
497	C	68.5	Low	66.6	Low	7 Å²	7	64 Å²	64	5%	0.047	34%	0.335	C	S	.	.	G	3₁₀ helix	trans	-114.4	16.9	173.7	-86.2	0	0	0	0	113.6	L493 D495 G499 F500	L493-C497 HydrophobicContact CB-CB 4.13Å; L493-C497 VanDerWaalsContact CB-SG 3.57Å; L493-C497 WeakPolarHBondContact CD1-SG 3.21Å; D495-C497 PolarHBondContact O-N 3.47Å; D495-C497 VanDerWaalsContact O-N 3.16Å; C497-G499 PolarHBondContact O-N 2.74Å; C497-F500 HydrophobicContact CB-CB 4.44Å; C497-F500 HydrophobicContact CB-CD1 4.42Å; C497-F500 HydrophobicContact CB-CD2 4.17Å; C497-F500 HydrophobicContact CB-CG 4.1Å; C497-F500 WeakPolarHBondContact O-CB 3.28Å; C497-F500 PolarHBondContact O-N 2.79Å; C497-F500 VanDerWaalsContact SG-CD2 3.54Å; C497-F500 VanDerWaalsContact SG-CE2 3.51Å
498	K	66.7	Low	63.9	Low	100 Å²	100	70 Å²	70	44%	0.435	36%	0.361	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.9	124.2	-178.4	-168.5	178.9	175.2	-168.2	0	110.8	D495 S622 E809	D495-K498 WeakPolarHBondContact O-CB 3.37Å; D495-K498 PolarHBondContact O-N 2.97Å; D495-K498 VanDerWaalsContact O-N 3.14Å; K498-S622 PolarHBondContact N-OG 3.43Å; K498-S622 WeakPolarHBondContact O-CB 3.28Å; K498-S622 PolarHBondContact O-OG 3.36Å; K498-E809 IonicContact NZ-OE1 3.07Å; K498-E809 PolarHBondContact NZ-OE1 3.34Å; K498-E809 IonicContact NZ-OE2 2.83Å; K498-E809 PolarHBondContact NZ-OE2 2.98Å
499	G	65.6	Low	61	Low	43 Å²	43	75.3 Å²	75.3	44%	0.443	40%	0.396	S	S	.	.	T	Hydrogen-bonded Turn	trans	89.6	-5.8	-177.9	0	0	0	0	0	115.6	C497 Y501 Q502	C497-G499 PolarHBondContact O-N 2.74Å; G499-Y501 PolarHBondContact O-N 2.77Å; G499-Y501 VanDerWaalsContact O-N 3.16Å; G499-Q502 PolarHBondContact O-N 3.33Å; G499-Q502 VanDerWaalsContact O-N 3.11Å
500	F	73.6	Confident	58.5	Low	13 Å²	13	81.2 Å²	81.2	6%	0.057	43%	0.434	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60.8	120.4	174.1	-83.5	32.4	0	0	0	110.1	A486 L489 C497 Q502 L537 C620 W621	A486-F500 WeakPolarHBondContact CB-O 3.48Å; L489-F500 HydrophobicContact CD1-CD2 4.34Å; C497-F500 HydrophobicContact CB-CB 4.44Å; C497-F500 HydrophobicContact CB-CD1 4.42Å; C497-F500 HydrophobicContact CB-CD2 4.17Å; C497-F500 HydrophobicContact CB-CG 4.1Å; C497-F500 WeakPolarHBondContact O-CB 3.28Å; C497-F500 PolarHBondContact O-N 2.79Å; C497-F500 VanDerWaalsContact SG-CD2 3.54Å; C497-F500 VanDerWaalsContact SG-CE2 3.51Å; F500-Q502 PolarHBondContact O-N 3.07Å; F500-L537 HydrophobicContact CD2-CD1 4.29Å; F500-L537 HydrophobicContact CE2-CD1 3.94Å; F500-C620 WeakPolarHBondContact CZ-O 3.07Å; F500-W621 HydrophobicContact CE2-CE3 4.18Å; F500-W621 HydrophobicContact CE2-CZ3 4.23Å; F500-W621 AromaticContact CZ-CE3 3.91Å; F500-W621 HydrophobicContact CZ-CE3 3.91Å; F500-W621 HydrophobicContact CZ-CZ3 4.4Å
501	Y	74.1	Confident	56.1	Low	35 Å²	35	86.8 Å²	86.8	14%	0.137	46%	0.458	C	S	.	.	T	Hydrogen-bonded Turn	trans	51.9	19.2	-175.9	-42.2	-70.4	0	0	0	114.3	Y428 L431 L482 A486 L489 G499 D534	Y428-Y501 HydrophobicContact CD1-CD1 4.26Å; Y428-Y501 HydrophobicContact CD1-CE1 4.49Å; Y428-Y501 AromaticContact CE1-CD1 3.85Å; Y428-Y501 HydrophobicContact CE1-CD1 3.85Å; Y428-Y501 HydrophobicContact CE1-CE1 4.07Å; L431-Y501 HydrophobicContact CD2-CE1 3.63Å; L482-Y501 HydrophobicContact CB-CG 4.29Å; L482-Y501 HydrophobicContact CD1-CD1 4.24Å; A486-Y501 HydrophobicContact CB-CD2 4.35Å; L489-Y501 HydrophobicContact CD1-CD2 4.42Å; L489-Y501 HydrophobicContact CD1-CE2 3.86Å; G499-Y501 PolarHBondContact O-N 2.77Å; G499-Y501 VanDerWaalsContact O-N 3.16Å; Y501-D534 WeakPolarHBondContact OH-CB 3.45Å; Y501-D534 PolarHBondContact OH-OD1 3.5Å
502	Q	63.2	Low	53.9	Low	80 Å²	80	86 Å²	86	37%	0.374	47%	0.47	S	S	.	.			trans	-118.3	71.9	-169.9	-157.2	168.5	57	0	0	110.4	G499 F500	G499-Q502 PolarHBondContact O-N 3.33Å; G499-Q502 VanDerWaalsContact O-N 3.11Å; F500-Q502 PolarHBondContact O-N 3.07Å
503	K	48.5	Very low	51.3	Low	132 Å²	132	97.7 Å²	97.7	57%	0.574	51%	0.513	S	S	*	.			trans	-95.6	81.9	156	-76.4	177	-175.2	162.3	0	107.8	E529	K503-E529 IonicContact NZ-OE1 2.71Å
504	M	31.3	Very low	49.3	Very low	136 Å²	136	104.9 Å²	104.9	67%	0.67	55%	0.551	S	S	*	*			trans	-95.6	142.5	162.2	-81.3	-70.8	-74.1	0	0	108.7	A506	M504-A506 PolarHBondContact O-N 3.3Å
505	P	33.3	Very low	47.3	Very low	84 Å²	84	109.3 Å²	109.3	55%	0.545	57%	0.569	S	S	.	*			trans	-61.1	124.7	169.5	27.2	-31.2	0	0	0	107.6	E507	P505-E507 PolarHBondContact O-N 3.47Å
506	A	28.9	Very low	45.3	Very low	98 Å²	98	115.1 Å²	115.1	81%	0.81	59%	0.594	S	S	*	*			trans	-58	107.2	163.3	0	0	0	0	0	107.3	M504 K508	M504-A506 PolarHBondContact O-N 3.3Å; A506-K508 PolarHBondContact O-N 3.3Å
507	E	30.4	Very low	43.3	Very low	191 Å²	191	119.2 Å²	119.2	89%	0.893	62%	0.623	S	S	*	*			trans	-60.7	90.3	167.2	-83.1	-174.1	145.7	0	0	108.7	P505	P505-E507 PolarHBondContact O-N 3.47Å
508	K	28.6	Very low	41.6	Very low	183 Å²	183	128.4 Å²	128.4	80%	0.796	67%	0.665	S	S	*	*			trans	-100.4	117.4	139.1	-75.5	-175.4	178.3	177.3	0	105.6	A506 P510	A506-K508 PolarHBondContact O-N 3.3Å; K508-P510 WeakPolarHBondContact O-CD 3.41Å
509	P	28.6	Very low	40.3	Very low	117 Å²	117	132 Å²	132	76%	0.76	68%	0.68	S	S	*	*			trans	-68.5	115.1	174.5	27	-30.7	0	0	0	108.4	K511	P509-K511 PolarHBondContact O-N 2.72Å
510	P	34.3	Very low	38.9	Very low	124 Å²	124	136.3 Å²	136.3	81%	0.805	69%	0.693	S	S	*	*			trans	-78.5	119.7	160.4	15	3.4	0	0	0	106.4	K508 G512	K508-P510 WeakPolarHBondContact O-CD 3.41Å; P510-G512 PolarHBondContact O-N 2.71Å
511	K	35.8	Very low	37.4	Very low	213 Å²	213	142.4 Å²	142.4	93%	0.926	73%	0.726	S	S	*	*			trans	-54.4	115.6	173.3	-72.7	178.2	176.1	177.5	0	109.8	P509	P509-K511 PolarHBondContact O-N 2.72Å
512	G	38.3	Very low	36.2	Very low	66 Å²	66	142.7 Å²	142.7	68%	0.68	73%	0.732	S	S	*	*			trans	71.6	104.3	152.7	0	0	0	0	0	116.7	P510	P510-G512 PolarHBondContact O-N 2.71Å
513	R	30.5	Very low	36	Very low	254 Å²	254	145.7 Å²	145.7	96%	0.958	75%	0.746	S	S	*	*				-175.9	134.2	119.5	-96.2	165.6	-160.5	-154.6	5.9	109.5
514	L	38.6	Very low	36.7	Very low	153 Å²	153	143.3 Å²	143.3	80%	0.801	74%	0.739	S	S	*	*			trans	-62.8	146.1	-179.6	-90.9	96.2	0	0	0	112.5
515	F	37.4	Very low	38.4	Very low	190 Å²	190	144.5 Å²	144.5	83%	0.833	74%	0.743	S	S	*	*			trans	64.5	88.4	163.4	-74.5	-77.9	0	0	0	118.2
516	H	27.1	Very low	40.5	Very low	194 Å²	194	144.6 Å²	144.6	90%	0.898	74%	0.737	S	S	*	*			trans	-157.8	123.4	133.7	-129.1	25.1	0	0	0	113.5
517	S	26.3	Very low	43	Very low	91 Å²	91	146.7 Å²	146.7	64%	0.636	72%	0.723	S	S	*	*			trans	44.1	112.3	154.9	-145.6	0	0	0	0	120.9	K519	S517-K519 PolarHBondContact O-N 3.07Å
518	Q	33.4	Very low	45.4	Very low	200 Å²	200	138 Å²	138	94%	0.935	68%	0.684	S	S	*	*			trans	-47.5	93.4	151.1	-166.4	175.7	20.3	0	0	111.1
519	K	37.8	Very low	47.8	Very low	174 Å²	174	135 Å²	135	76%	0.757	67%	0.673	S	S	*	*			trans	-137.7	139	162.5	-81.9	-169.9	173.5	-174	0	108.5	S517	S517-K519 PolarHBondContact O-N 3.07Å
520	N	36	Very low	50.6	Low	134 Å²	134	131.9 Å²	131.9	72%	0.717	65%	0.648	S	S	*	*			trans	107.8	39.2	-180	-49.1	-22.4	0	0	0	115.9
521	L	43.1	Very low	53.2	Low	141 Å²	141	126.8 Å²	126.8	74%	0.738	61%	0.614	S	S	*	*	S	Bend	trans	-94.7	139.7	137.7	-160.2	72.8	0	0	0	104.8	E523 L524	L521-E523 PolarHBondContact O-N 3.33Å; L521-L524 HydrophobicContact CD2-CD1 4.39Å
522	P	49.4	Very low	55.9	Low	42 Å²	42	119 Å²	119	27%	0.273	58%	0.579	S	S	.	*	P	Polyproline II helix	trans	-52.2	120.9	165.1	20.9	-29	0	0	0	106.5	Y428 L524	Y428-P522 HydrophobicContact CD2-CB 4.25Å; P522-L524 PolarHBondContact O-N 3.35Å
523	E	57.5	Low	58.4	Low	142 Å²	142	117 Å²	117	66%	0.664	55%	0.552	S	S	*	*	P	Polyproline II helix	trans	-57.7	128.4	176.8	-160.3	158.3	-156.9	0	0	105.2	L521 E525 E526	L521-E523 PolarHBondContact O-N 3.33Å; E523-E525 PolarHBondContact O-N 3.5Å; E523-E526 VanDerWaalsContact O-CB 3.26Å; E523-E526 WeakPolarHBondContact O-CB 3.36Å; E523-E526 PolarHBondContact O-N 3.47Å
524	L	64.3	Low	61.3	Low	82 Å²	82	105 Å²	105	43%	0.429	51%	0.506	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.4	-15.9	-174.5	-88.1	78	0	0	0	112.2	G429 L521 P522	G429-L524 WeakPolarHBondContact CA-O 3.41Å; G429-L524 PolarHBondContact N-O 2.87Å; L521-L524 HydrophobicContact CD2-CD1 4.39Å; P522-L524 PolarHBondContact O-N 3.35Å
525	E	66.6	Low	63.9	Low	162 Å²	162	97.7 Å²	97.7	76%	0.757	47%	0.468	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.3	-9.4	175.4	-60.7	-179	178.6	0	0	113.8	E523	E523-E525 PolarHBondContact O-N 3.5Å
526	E	78.1	Confident	66.5	Low	86 Å²	86	88.8 Å²	88.8	40%	0.402	43%	0.429	S	S	.	.	S	Bend	trans	-67.3	137.3	176.1	-167.6	177.6	-171.8	0	0	110.3	T427 Y428 E523	T427-E526 WeakPolarHBondContact CA-O 3.4Å; Y428-E526 HydrophobicContact CD2-CB 4.12Å; Y428-E526 VanDerWaalsContact CD2-O 3.31Å; Y428-E526 WeakPolarHBondContact CD2-O 3.35Å; Y428-E526 HydrophobicContact CE2-CB 4.46Å; Y428-E526 HydrophobicContact CE2-CG 4.42Å; Y428-E526 PolarHBondContact N-O 3.18Å; Y428-E526 VanDerWaalsContact N-O 3.1Å; E523-E526 VanDerWaalsContact O-CB 3.26Å; E523-E526 WeakPolarHBondContact O-CB 3.36Å; E523-E526 PolarHBondContact O-N 3.47Å
527	R	80.6	Confident	69.7	Low	141 Å²	141	79.5 Å²	79.5	53%	0.532	39%	0.386	S	S	.	.	B	Isolated β-bridge	trans	-72.2	143.4	-179.4	-63.5	-180	-178.4	-168.3	-4.6	110.3	E424	E424-R527 IonicContact OE1-CZ 2.82Å; E424-R527 IonicContact OE1-NH1 2.66Å; E424-R527 PolarHBondContact OE1-NH1 3.3Å; E424-R527 IonicContact OE1-NH2 3.71Å
528	C	81.6	Confident	72.8	Confident	9 Å²	9	75.2 Å²	75.2	6%	0.061	36%	0.356	C	S	.	.	P	Polyproline II helix	trans	-67.8	135.5	175.7	-63.2	0	0	0	0	111.1	L426 Y428 H530	L426-C528 HydrophobicContact CD2-CB 4.13Å; L426-C528 HydrophobicContact CG-CB 4.48Å; L426-C528 PolarHBondContact O-N 2.95Å; L426-C528 VanDerWaalsContact O-N 3.14Å; Y428-C528 HydrophobicContact CE1-CB 4.41Å; C528-H530 VanDerWaalsContact C-N 3.28Å; C528-H530 PolarHBondContact O-N 3.38Å
529	E	79.2	Confident	75.7	Confident	120 Å²	120	65.7 Å²	65.7	56%	0.561	31%	0.311	S	S	*	.	S	Bend	trans	-60.5	-36.4	179	-67.5	178.1	177	0	0	112.4	K503	K503-E529 IonicContact NZ-OE1 2.71Å
530	H	86.4	Confident	78.3	Confident	51 Å²	51	57.5 Å²	57.5	24%	0.236	28%	0.276	C	S	.	.	S	Bend	trans	-137.5	80.8	-179.2	-61.9	-51.3	0	0	0	111.8	C528 W532 R533 D534 C620	C528-H530 VanDerWaalsContact C-N 3.28Å; C528-H530 PolarHBondContact O-N 3.38Å; H530-W532 PolarHBondContact O-N 2.94Å; H530-R533 HydrophobicContact CB-CB 4.02Å; H530-R533 PolarHBondContact O-N 3.17Å; H530-D534 PolarHBondContact O-N 2.88Å; H530-C620 VanDerWaalsContact CE1-SG 3.59Å
531	P	90.2	Very high	81	Confident	17 Å²	17	51.1 Å²	51.1	11%	0.11	24%	0.242	C	C	.	.	H	α-helix	trans	-63.6	-39.5	-169.4	26.8	-38.1	0	0	0	113.9	L426 R533 D534 L535	L426-P531 HydrophobicContact CB-CB 4.03Å; L426-P531 HydrophobicContact CD2-CB 3.77Å; P531-R533 PolarHBondContact O-N 3.47Å; P531-D534 PolarHBondContact O-N 3.25Å; P531-L535 WeakPolarHBondContact O-CG 3.32Å; P531-L535 PolarHBondContact O-N 3.43Å
532	W	91.6	Very high	83.2	Confident	49 Å²	49	45.7 Å²	45.7	19%	0.186	21%	0.212	C	C	.	.	H	α-helix	trans	-64.9	-38.6	178.7	-64.8	106.7	0	0	0	112.6	V416 L422 H530 F536 Y550 F551 M554	V416-W532 HydrophobicContact CG1-CH2 4.46Å; L422-W532 HydrophobicContact CB-CZ2 4.25Å; L422-W532 HydrophobicContact CD1-CD2 3.96Å; L422-W532 HydrophobicContact CD1-CE3 3.53Å; L422-W532 HydrophobicContact CD1-CH2 3.2Å; L422-W532 HydrophobicContact CD1-CZ2 3.63Å; L422-W532 HydrophobicContact CD1-CZ3 3.14Å; L422-W532 HydrophobicContact CG-CH2 4.1Å; L422-W532 HydrophobicContact CG-CZ2 4.22Å; L422-W532 HydrophobicContact CG-CZ3 4.43Å; H530-W532 PolarHBondContact O-N 2.94Å; W532-F536 WeakPolarHBondContact O-CB 3.38Å; W532-F536 PolarHBondContact O-N 3.19Å; W532-Y550 HydrophobicContact CZ3-CE1 4.38Å; W532-F551 HydrophobicContact CE3-CD1 4.1Å; W532-F551 HydrophobicContact CZ3-CD1 4.05Å; W532-M554 HydrophobicContact CD2-CB 3.89Å; W532-M554 HydrophobicContact CE3-CB 3.44Å; W532-M554 VanDerWaalsContact CE3-CB 3.44Å; W532-M554 HydrophobicContact CE3-CG 4.32Å; W532-M554 HydrophobicContact CH2-CB 3.52Å; W532-M554 HydrophobicContact CH2-CE 3.93Å; W532-M554 HydrophobicContact CH2-CG 3.73Å; W532-M554 HydrophobicContact CZ2-CB 3.98Å; W532-M554 HydrophobicContact CZ2-CE 4.16Å; W532-M554 HydrophobicContact CZ3-CB 3.22Å; W532-M554 HydrophobicContact CZ3-CG 3.61Å
533	R	91	Very high	85.2	Confident	26 Å²	26	45.3 Å²	45.3	10%	0.098	21%	0.208	C	C	.	.	H	α-helix	trans	-64.3	-45.6	175.6	-179.1	-159.5	65.6	-163.5	-7.4	110.6	H530 P531 F536 L537 C620 W621	H530-R533 HydrophobicContact CB-CB 4.02Å; H530-R533 PolarHBondContact O-N 3.17Å; P531-R533 PolarHBondContact O-N 3.47Å; R533-F536 WeakPolarHBondContact O-CB 3.49Å; R533-F536 PolarHBondContact O-N 2.87Å; R533-L537 HydrophobicContact CG-CD1 4.17Å; R533-L537 WeakPolarHBondContact O-CG 3.37Å; R533-L537 PolarHBondContact O-N 3.37Å; R533-C620 VanDerWaalsContact CD-O 3.26Å; R533-C620 WeakPolarHBondContact CD-O 3.31Å; R533-C620 PolarHBondContact NH1-O 3.37Å; R533-W621 HydrophobicContact CG-CH2 4.04Å; R533-W621 HydrophobicContact CG-CZ2 3.83Å
534	D	90.9	Very high	86.8	Confident	0 Å²	0	40 Å²	40	0%	0	18%	0.182	C	C	.	.	H	α-helix	trans	-69	-40.1	-174.4	-63.4	-13.1	0	0	0	111.1	L426 L431 Y501 H530 P531 L537 W538	L426-D534 HydrophobicContact CD2-CB 4.25Å; L431-D534 HydrophobicContact CD1-CB 4.41Å; L431-D534 HydrophobicContact CD2-CB 4.05Å; Y501-D534 WeakPolarHBondContact OH-CB 3.45Å; Y501-D534 PolarHBondContact OH-OD1 3.5Å; H530-D534 PolarHBondContact O-N 2.88Å; P531-D534 PolarHBondContact O-N 3.25Å; D534-L537 PolarHBondContact O-N 3.1Å; D534-W538 WeakPolarHBondContact O-CB 3.47Å; D534-W538 PolarHBondContact O-N 3.24Å
535	L	93	Very high	88	Confident	0 Å²	0	39.2 Å²	39.2	0%	0	18%	0.176	C	C	.	.	H	α-helix	trans	-67.3	-38.5	171.4	-73	172.6	0	0	0	112.8	L404 L422 L426 L434 P531 W538 A539 F551	L404-L535 HydrophobicContact CD1-CD2 4.41Å; L422-L535 HydrophobicContact CD1-CD1 3.85Å; L422-L535 HydrophobicContact CD2-CD1 4.08Å; L422-L535 HydrophobicContact CG-CD1 4.48Å; L426-L535 HydrophobicContact CD1-CD2 4.02Å; L426-L535 HydrophobicContact CD1-CG 4.3Å; L426-L535 HydrophobicContact CD2-CD1 4.39Å; L426-L535 HydrophobicContact CD2-CG 3.98Å; L434-L535 HydrophobicContact CD1-CD2 3.71Å; P531-L535 WeakPolarHBondContact O-CG 3.32Å; P531-L535 PolarHBondContact O-N 3.43Å; L535-W538 PolarHBondContact O-N 3.44Å; L535-A539 WeakPolarHBondContact O-CB 3.18Å; L535-A539 PolarHBondContact O-N 3.2Å; L535-F551 HydrophobicContact CB-CD1 4.39Å; L535-F551 HydrophobicContact CB-CD2 3.94Å; L535-F551 HydrophobicContact CB-CE1 4.46Å; L535-F551 HydrophobicContact CB-CE2 4.01Å; L535-F551 HydrophobicContact CB-CG 4.16Å; L535-F551 HydrophobicContact CB-CZ 4.29Å; L535-F551 HydrophobicContact CD1-CE1 4.36Å
536	F	93.6	Very high	89.1	Confident	3 Å²	3	37.6 Å²	37.6	1%	0.013	17%	0.169	C	C	.	.	H	α-helix	trans	-59.5	-49.5	173.3	172.6	-107.9	0	0	0	111.2	W532 R533 W538 A539 V540 A548 F551 W552 A561 Y590	W532-F536 WeakPolarHBondContact O-CB 3.38Å; W532-F536 PolarHBondContact O-N 3.19Å; R533-F536 WeakPolarHBondContact O-CB 3.49Å; R533-F536 PolarHBondContact O-N 2.87Å; F536-W538 VanDerWaalsContact C-N 3.35Å; F536-W538 PolarHBondContact O-N 3.39Å; F536-A539 PolarHBondContact O-N 3.46Å; F536-V540 HydrophobicContact CD1-CG2 4.41Å; F536-V540 HydrophobicContact CD2-CG2 3.94Å; F536-V540 HydrophobicContact CE1-CG2 4.04Å; F536-V540 HydrophobicContact CE2-CG2 3.51Å; F536-V540 HydrophobicContact CG-CG2 4.37Å; F536-V540 HydrophobicContact CZ-CG2 3.58Å; F536-V540 WeakPolarHBondContact O-CB 3.49Å; F536-V540 VanDerWaalsContact O-CG2 3.28Å; F536-V540 WeakPolarHBondContact O-CG2 3.38Å; F536-V540 PolarHBondContact O-N 3.31Å; F536-A548 HydrophobicContact CD2-CB 4.32Å; F536-A548 WeakPolarHBondContact CD2-O 3.47Å; F536-A548 HydrophobicContact CE2-CB 4.31Å; F536-F551 HydrophobicContact CB-CB 3.98Å; F536-W552 HydrophobicContact CD2-CB 3.97Å; F536-W552 HydrophobicContact CE2-CB 3.79Å; F536-W552 HydrophobicContact CE2-CG 4.48Å; F536-A561 HydrophobicContact CE1-CB 4.25Å; F536-A561 VanDerWaalsContact CE1-O 3.24Å; F536-A561 WeakPolarHBondContact CE1-O 3.45Å; F536-A561 WeakPolarHBondContact CZ-O 3.23Å; F536-Y590 AromaticContact CE2-CE1 3.67Å; F536-Y590 HydrophobicContact CE2-CE1 3.67Å; F536-Y590 HydrophobicContact CZ-CD1 4.35Å; F536-Y590 AromaticContact CZ-CE1 3.88Å; F536-Y590 HydrophobicContact CZ-CE1 3.88Å
537	L	92.3	Very high	89.7	Confident	0 Å²	0	33.5 Å²	33.5	0%	0	15%	0.149	C	C	.	.	H	α-helix	trans	-59.5	-44.3	176.7	-72.9	171.7	0	0	0	112	L489 F500 R533 D534 A539 V540 L541 I568 W621	L489-L537 HydrophobicContact CD1-CD1 4.27Å; L489-L537 HydrophobicContact CD2-CD2 4.2Å; F500-L537 HydrophobicContact CD2-CD1 4.29Å; F500-L537 HydrophobicContact CE2-CD1 3.94Å; R533-L537 HydrophobicContact CG-CD1 4.17Å; R533-L537 WeakPolarHBondContact O-CG 3.37Å; R533-L537 PolarHBondContact O-N 3.37Å; D534-L537 PolarHBondContact O-N 3.1Å; L537-A539 VanDerWaalsContact C-N 3.34Å; L537-A539 PolarHBondContact O-N 3.35Å; L537-V540 PolarHBondContact O-N 2.73Å; L537-L541 VanDerWaalsContact O-CB 3.3Å; L537-L541 WeakPolarHBondContact O-CB 3.42Å; L537-L541 WeakPolarHBondContact O-CD1 3.3Å; L537-L541 WeakPolarHBondContact O-CG 3.44Å; L537-L541 PolarHBondContact O-N 2.97Å; L537-I568 HydrophobicContact CD2-CD1 3.44Å; L537-I568 VanDerWaalsContact CD2-CD1 3.44Å; L537-W621 HydrophobicContact CD1-CH2 4.45Å; L537-W621 HydrophobicContact CD1-CZ3 4.46Å; L537-W621 HydrophobicContact CD2-CH2 3.81Å; L537-W621 HydrophobicContact CD2-CZ3 3.98Å; L537-W621 HydrophobicContact CG-CH2 4.2Å
538	W	93.1	Very high	90.3	Very high	0 Å²	0	26.8 Å²	26.8	0%	0	12%	0.124	C	C	.	.	H	α-helix	trans	-61.5	-39.4	176.7	169	85.7	0	0	0	112.9	L404 L434 Y435 D534 L535 F536 Q542 M547 F551	L404-W538 HydrophobicContact CB-CH2 4.11Å; L404-W538 HydrophobicContact CD2-CZ3 4.27Å; L404-W538 WeakPolarHBondContact O-CH2 3.44Å; L434-W538 HydrophobicContact CB-CZ2 4.36Å; L434-W538 HydrophobicContact CD2-CH2 4.28Å; L434-W538 HydrophobicContact CD2-CZ2 3.85Å; L434-W538 PolarHBondContact O-NE1 3.15Å; Y435-W538 AromaticContact CD1-CD1 3.98Å; Y435-W538 HydrophobicContact CE1-CB 4.44Å; Y435-W538 AromaticContact CE1-CD1 3.89Å; Y435-W538 HydrophobicContact CE2-CB 4.4Å; D534-W538 WeakPolarHBondContact O-CB 3.47Å; D534-W538 PolarHBondContact O-N 3.24Å; L535-W538 PolarHBondContact O-N 3.44Å; F536-W538 VanDerWaalsContact C-N 3.35Å; F536-W538 PolarHBondContact O-N 3.39Å; W538-Q542 PolarHBondContact O-NE2 3.39Å; W538-Q542 VanDerWaalsContact O-NE2 3.09Å; W538-M547 HydrophobicContact CH2-CE 3.6Å; W538-M547 HydrophobicContact CZ3-CE 3.43Å; W538-M547 VanDerWaalsContact CZ3-CE 3.43Å; W538-M547 HydrophobicContact CZ3-SD 4.49Å; W538-F551 HydrophobicContact CZ3-CE2 4.43Å
539	A	93.4	Very high	90.7	Very high	0 Å²	0	29 Å²	29	0%	0	14%	0.135	C	C	.	.	H	α-helix	trans	-72.3	-42.9	178	0	0	0	0	0	112.3	L535 F536 L537 Q542 N543 R544 M547 A548 F551	L535-A539 WeakPolarHBondContact O-CB 3.18Å; L535-A539 PolarHBondContact O-N 3.2Å; F536-A539 PolarHBondContact O-N 3.46Å; L537-A539 VanDerWaalsContact C-N 3.34Å; L537-A539 PolarHBondContact O-N 3.35Å; A539-Q542 PolarHBondContact O-N 2.88Å; A539-N543 PolarHBondContact O-N 3.12Å; A539-R544 HydrophobicContact CB-CB 4.49Å; A539-R544 PolarHBondContact O-N 3.49Å; A539-M547 HydrophobicContact CB-CB 4.31Å; A539-A548 HydrophobicContact CB-CB 3.77Å; A539-F551 HydrophobicContact CB-CD2 3.95Å; A539-F551 HydrophobicContact CB-CE2 4.1Å
540	V	92.7	Very high	91.3	Very high	2 Å²	2	24.1 Å²	24.1	1%	0.012	11%	0.112	C	C	.	.	H	α-helix	trans	-62.5	-44.7	177.3	173	0	0	0	0	111	F536 L537 Q542 N543 A548 I568 L569	F536-V540 HydrophobicContact CD1-CG2 4.41Å; F536-V540 HydrophobicContact CD2-CG2 3.94Å; F536-V540 HydrophobicContact CE1-CG2 4.04Å; F536-V540 HydrophobicContact CE2-CG2 3.51Å; F536-V540 HydrophobicContact CG-CG2 4.37Å; F536-V540 HydrophobicContact CZ-CG2 3.58Å; F536-V540 WeakPolarHBondContact O-CB 3.49Å; F536-V540 VanDerWaalsContact O-CG2 3.28Å; F536-V540 WeakPolarHBondContact O-CG2 3.38Å; F536-V540 PolarHBondContact O-N 3.31Å; L537-V540 PolarHBondContact O-N 2.73Å; V540-Q542 PolarHBondContact O-N 3.36Å; V540-Q542 VanDerWaalsContact O-N 3.13Å; V540-N543 PolarHBondContact O-N 3.33Å; V540-A548 HydrophobicContact CG2-CB 3.82Å; V540-I568 HydrophobicContact CG1-CB 4.09Å; V540-I568 HydrophobicContact CG1-CG2 3.83Å; V540-L569 HydrophobicContact CG1-CD1 4.2Å; V540-L569 HydrophobicContact CG1-CD2 3.94Å; V540-L569 HydrophobicContact CG1-CG 3.73Å
541	L	91.8	Very high	91.6	Very high	0 Å²	0	21.8 Å²	21.8	0%	0	10%	0.101	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.2	-15.8	179.1	-74.6	170.3	0	0	0	114.1	Y435 L444 L489 F492 L537 I568 M572	Y435-L541 HydrophobicContact CE1-CD1 4.13Å; L444-L541 HydrophobicContact CD1-CB 4.11Å; L444-L541 HydrophobicContact CD1-CD1 4.27Å; L444-L541 HydrophobicContact CD1-CD2 4.34Å; L444-L541 HydrophobicContact CD1-CG 4.5Å; L444-L541 HydrophobicContact CD2-CB 3.85Å; L489-L541 HydrophobicContact CD2-CD1 4Å; F492-L541 HydrophobicContact CD2-CD2 4.07Å; F492-L541 HydrophobicContact CE2-CD2 3.7Å; L537-L541 VanDerWaalsContact O-CB 3.3Å; L537-L541 WeakPolarHBondContact O-CB 3.42Å; L537-L541 WeakPolarHBondContact O-CD1 3.3Å; L537-L541 WeakPolarHBondContact O-CG 3.44Å; L537-L541 PolarHBondContact O-N 2.97Å; L541-I568 HydrophobicContact CD2-CG2 3.65Å; L541-I568 HydrophobicContact CG-CG2 4.32Å; L541-M572 HydrophobicContact CD2-SD 4.02Å; L541-M572 WeakPolarHBondContact O-CE 3.34Å
542	Q	90.3	Very high	91.6	Very high	27 Å²	27	21.3 Å²	21.3	13%	0.126	10%	0.097	C	C	.	.	T	Hydrogen-bonded Turn	trans	-103.8	4.7	175	-73	177.8	89.3	0	0	113.3	V438 L444 W538 A539 V540 R544	V438-Q542 HydrophobicContact CG1-CG 4.4Å; V438-Q542 HydrophobicContact CG2-CG 4.35Å; L444-Q542 HydrophobicContact CD2-CG 3.84Å; W538-Q542 PolarHBondContact O-NE2 3.39Å; W538-Q542 VanDerWaalsContact O-NE2 3.09Å; A539-Q542 PolarHBondContact O-N 2.88Å; V540-Q542 PolarHBondContact O-N 3.36Å; V540-Q542 VanDerWaalsContact O-N 3.13Å; Q542-R544 VanDerWaalsContact C-N 3.27Å; Q542-R544 HydrophobicContact CB-CG 3.92Å; Q542-R544 PolarHBondContact O-N 3.02Å
543	N	90.8	Very high	91.5	Very high	34 Å²	34	19.9 Å²	19.9	18%	0.182	10%	0.096	C	C	.	.	T	Hydrogen-bonded Turn	trans	57	35.3	-173	-166	28.5	0	0	0	113.6	A539 V540 Q545 S584 M585	A539-N543 PolarHBondContact O-N 3.12Å; V540-N543 PolarHBondContact O-N 3.33Å; N543-Q545 PolarHBondContact O-N 3.28Å; N543-S584 PolarHBondContact ND2-OG 3.48Å; N543-M585 HydrophobicContact CB-CE 4.33Å; N543-M585 HydrophobicContact CB-CG 4.24Å
544	R	90.9	Very high	91.4	Very high	30 Å²	30	22.4 Å²	22.4	11%	0.113	11%	0.11	C	C	.	.			trans	-90.3	79.5	176.6	-62.6	-177.5	-172.6	-152.5	6.3	110.8	L404 I405 D407 A539 Q542 Q546 M547 A548	L404-R544 PolarHBondContact O-NH1 2.99Å; I405-R544 PolarHBondContact O-NH1 3.34Å; I405-R544 VanDerWaalsContact O-NH1 3.07Å; I405-R544 PolarHBondContact O-NH2 2.88Å; D407-R544 WeakPolarHBondContact OD1-CD 3.32Å; A539-R544 HydrophobicContact CB-CB 4.49Å; A539-R544 PolarHBondContact O-N 3.49Å; Q542-R544 VanDerWaalsContact C-N 3.27Å; Q542-R544 HydrophobicContact CB-CG 3.92Å; Q542-R544 PolarHBondContact O-N 3.02Å; R544-Q546 PolarHBondContact O-N 2.96Å; R544-M547 HydrophobicContact CB-CB 4.45Å; R544-M547 PolarHBondContact O-N 2.89Å; R544-A548 VanDerWaalsContact O-CB 3.29Å; R544-A548 WeakPolarHBondContact O-CB 3.05Å; R544-A548 PolarHBondContact O-N 2.94Å
545	Q	89.4	Confident	91.2	Very high	67 Å²	67	22.8 Å²	22.8	31%	0.313	11%	0.113	S	C	.	.	H	α-helix	trans	-60.8	-43.4	-168.1	-61.8	-170	-8.6	0	0	113.9	N543 A548 N549 S584	N543-Q545 PolarHBondContact O-N 3.28Å; Q545-A548 PolarHBondContact O-N 3.42Å; Q545-N549 WeakPolarHBondContact O-CB 3.47Å; Q545-N549 PolarHBondContact O-N 3.13Å; Q545-N549 PolarHBondContact O-ND2 3.23Å; Q545-N549 PolarHBondContact O-OD1 3.42Å; Q545-S584 PolarHBondContact NE2-O 2.97Å; Q545-S584 PolarHBondContact NE2-OG 2.88Å
546	Q	89.9	Confident	90.8	Very high	127 Å²	127	25.1 Å²	25.1	59%	0.593	13%	0.128	S	C	*	.	H	α-helix	trans	-66.5	-43.2	-177.1	-66.7	-175.8	-5.7	0	0	112.5	P409 R544 Y550	P409-Q546 HydrophobicContact CB-CB 4.33Å; P409-Q546 HydrophobicContact CG-CB 3.93Å; R544-Q546 PolarHBondContact O-N 2.96Å; Q546-Y550 PolarHBondContact O-N 2.97Å
547	M	91.9	Very high	90.6	Very high	0 Å²	0	25 Å²	25	0%	0	13%	0.128	C	C	.	.	H	α-helix	trans	-66.7	-44.1	174.6	-79.4	-144.7	-65.1	0	0	111.9	L404 D407 P409 V412 W538 A539 R544 N549 Y550 F551	L404-M547 HydrophobicContact CD2-SD 4.14Å; D407-M547 WeakPolarHBondContact OD1-CE 3.28Å; P409-M547 HydrophobicContact CB-CG 3.82Å; P409-M547 HydrophobicContact CG-CG 4.46Å; V412-M547 HydrophobicContact CG2-SD 4.33Å; W538-M547 HydrophobicContact CH2-CE 3.6Å; W538-M547 HydrophobicContact CZ3-CE 3.43Å; W538-M547 VanDerWaalsContact CZ3-CE 3.43Å; W538-M547 HydrophobicContact CZ3-SD 4.49Å; A539-M547 HydrophobicContact CB-CB 4.31Å; R544-M547 HydrophobicContact CB-CB 4.45Å; R544-M547 PolarHBondContact O-N 2.89Å; M547-N549 VanDerWaalsContact C-N 3.33Å; M547-N549 PolarHBondContact O-N 3.36Å; M547-Y550 WeakPolarHBondContact O-CB 3.48Å; M547-Y550 PolarHBondContact O-N 3.41Å; M547-Y550 VanDerWaalsContact O-N 3.13Å; M547-F551 HydrophobicContact CB-CE2 4.04Å; M547-F551 VanDerWaalsContact O-CD2 3.3Å; M547-F551 WeakPolarHBondContact O-CD2 3.26Å; M547-F551 WeakPolarHBondContact O-CG 3.28Å; M547-F551 PolarHBondContact O-N 3.14Å; M547-F551 HydrophobicContact SD-CE2 4.33Å; M547-F551 HydrophobicContact SD-CZ 4.24Å
548	A	92.6	Very high	90.5	Very high	1 Å²	1	25.1 Å²	25.1	1%	0.008	13%	0.129	C	C	.	.	H	α-helix	trans	-62.7	-39.2	179.2	0	0	0	0	0	112.1	F536 A539 V540 R544 Q545 Y550 F551 W552 Y590	F536-A548 HydrophobicContact CD2-CB 4.32Å; F536-A548 WeakPolarHBondContact CD2-O 3.47Å; F536-A548 HydrophobicContact CE2-CB 4.31Å; A539-A548 HydrophobicContact CB-CB 3.77Å; V540-A548 HydrophobicContact CG2-CB 3.82Å; R544-A548 VanDerWaalsContact O-CB 3.29Å; R544-A548 WeakPolarHBondContact O-CB 3.05Å; R544-A548 PolarHBondContact O-N 2.94Å; Q545-A548 PolarHBondContact O-N 3.42Å; A548-Y550 VanDerWaalsContact C-N 3.31Å; A548-Y550 PolarHBondContact O-N 3.46Å; A548-F551 PolarHBondContact O-N 3.4Å; A548-W552 WeakPolarHBondContact O-CB 3.47Å; A548-W552 PolarHBondContact O-N 3Å; A548-Y590 WeakPolarHBondContact CB-OH 3.27Å
549	N	90.3	Very high	90.4	Very high	54 Å²	54	25.2 Å²	25.2	29%	0.289	13%	0.129	S	C	.	.	H	α-helix	trans	-61.9	-38.8	173.8	-68.6	-7.1	0	0	0	112	Q545 M547 A553 Y590	Q545-N549 WeakPolarHBondContact O-CB 3.47Å; Q545-N549 PolarHBondContact O-N 3.13Å; Q545-N549 PolarHBondContact O-ND2 3.23Å; Q545-N549 PolarHBondContact O-OD1 3.42Å; M547-N549 VanDerWaalsContact C-N 3.33Å; M547-N549 PolarHBondContact O-N 3.36Å; N549-A553 WeakPolarHBondContact O-CB 3.25Å; N549-A553 PolarHBondContact O-N 3.44Å; N549-Y590 PolarHBondContact OD1-OH 3.13Å; N549-Y590 VanDerWaalsContact OD1-OH 3.13Å
550	Y	90.9	Very high	90.2	Very high	19 Å²	19	25.2 Å²	25.2	8%	0.075	13%	0.13	C	C	.	.	H	α-helix	trans	-67.6	-46.5	176.2	175.9	-114	0	0	0	112.1	V412 R413 V416 W532 Q546 M547 A548 W552 A553 M554	V412-Y550 HydrophobicContact CG1-CD1 4.35Å; V412-Y550 HydrophobicContact CG1-CE1 3.96Å; R413-Y550 HydrophobicContact CG-CD1 4.27Å; R413-Y550 HydrophobicContact CG-CD2 3.7Å; R413-Y550 HydrophobicContact CG-CE1 4.09Å; R413-Y550 HydrophobicContact CG-CE2 3.5Å; R413-Y550 VanDerWaalsContact CG-CE2 3.5Å; R413-Y550 HydrophobicContact CG-CG 4.08Å; V416-Y550 WeakPolarHBondContact CB-OH 3.45Å; W532-Y550 HydrophobicContact CZ3-CE1 4.38Å; Q546-Y550 PolarHBondContact O-N 2.97Å; M547-Y550 WeakPolarHBondContact O-CB 3.48Å; M547-Y550 PolarHBondContact O-N 3.41Å; M547-Y550 VanDerWaalsContact O-N 3.13Å; A548-Y550 VanDerWaalsContact C-N 3.31Å; A548-Y550 PolarHBondContact O-N 3.46Å; Y550-W552 VanDerWaalsContact C-N 3.29Å; Y550-W552 PolarHBondContact O-N 2.62Å; Y550-A553 WeakPolarHBondContact O-CB 3.17Å; Y550-A553 PolarHBondContact O-N 3.38Å; Y550-A553 VanDerWaalsContact O-N 3.16Å; Y550-M554 HydrophobicContact CD2-CG 4.2Å; Y550-M554 HydrophobicContact CE1-CG 4.42Å; Y550-M554 HydrophobicContact CE2-CG 3.7Å; Y550-M554 HydrophobicContact CE2-SD 4.17Å; Y550-M554 WeakPolarHBondContact O-CG 3.44Å; Y550-M554 PolarHBondContact O-N 3.44Å
551	F	92.3	Very high	90.2	Very high	1 Å²	1	25.5 Å²	25.5	0%	0.004	13%	0.132	C	C	.	.	H	α-helix	trans	-65.2	-33.8	177.6	-60.8	-38.6	0	0	0	112.7	L404 V412 W532 L535 F536 W538 A539 M547 A548 M554 G555	L404-F551 HydrophobicContact CD2-CE2 4.41Å; L404-F551 HydrophobicContact CD2-CZ 3.62Å; V412-F551 HydrophobicContact CG1-CE1 4.07Å; V412-F551 HydrophobicContact CG1-CZ 4.39Å; W532-F551 HydrophobicContact CE3-CD1 4.1Å; W532-F551 HydrophobicContact CZ3-CD1 4.05Å; L535-F551 HydrophobicContact CB-CD1 4.39Å; L535-F551 HydrophobicContact CB-CD2 3.94Å; L535-F551 HydrophobicContact CB-CE1 4.46Å; L535-F551 HydrophobicContact CB-CE2 4.01Å; L535-F551 HydrophobicContact CB-CG 4.16Å; L535-F551 HydrophobicContact CB-CZ 4.29Å; L535-F551 HydrophobicContact CD1-CE1 4.36Å; F536-F551 HydrophobicContact CB-CB 3.98Å; W538-F551 HydrophobicContact CZ3-CE2 4.43Å; A539-F551 HydrophobicContact CB-CD2 3.95Å; A539-F551 HydrophobicContact CB-CE2 4.1Å; M547-F551 HydrophobicContact CB-CE2 4.04Å; M547-F551 VanDerWaalsContact O-CD2 3.3Å; M547-F551 WeakPolarHBondContact O-CD2 3.26Å; M547-F551 WeakPolarHBondContact O-CG 3.28Å; M547-F551 PolarHBondContact O-N 3.14Å; M547-F551 HydrophobicContact SD-CE2 4.33Å; M547-F551 HydrophobicContact SD-CZ 4.24Å; A548-F551 PolarHBondContact O-N 3.4Å; F551-M554 PolarHBondContact O-N 2.9Å; F551-G555 PolarHBondContact O-N 3.44Å
552	W	91.9	Very high	90.2	Very high	8 Å²	8	25.5 Å²	25.5	3%	0.03	13%	0.132	C	C	.	.	H	α-helix	trans	-64.9	-44.9	170.9	176.4	80.2	0	0	0	111.9	F536 A548 Y550 M554 G555 A558 F593 V598 L1084	F536-W552 HydrophobicContact CD2-CB 3.97Å; F536-W552 HydrophobicContact CE2-CB 3.79Å; F536-W552 HydrophobicContact CE2-CG 4.48Å; A548-W552 WeakPolarHBondContact O-CB 3.47Å; A548-W552 PolarHBondContact O-N 3Å; Y550-W552 VanDerWaalsContact C-N 3.29Å; Y550-W552 PolarHBondContact O-N 2.62Å; W552-M554 PolarHBondContact O-N 3.45Å; W552-G555 PolarHBondContact O-N 2.91Å; W552-A558 HydrophobicContact CZ2-CB 4.04Å; W552-A558 PolarHBondContact NE1-O 3.26Å; W552-F593 HydrophobicContact CH2-CB 4.02Å; W552-F593 HydrophobicContact CH2-CG 4.4Å; W552-F593 HydrophobicContact CZ2-CB 3.95Å; W552-V598 HydrophobicContact CH2-CG2 3.68Å; W552-V598 HydrophobicContact CZ2-CG2 3.61Å; W552-L1084 HydrophobicContact CZ3-CD2 4.2Å
553	A	89.1	Confident	90.2	Very high	18 Å²	18	24.2 Å²	24.2	15%	0.149	13%	0.126	C	C	.	.	H	α-helix	trans	-60.3	-33.1	177.4	0	0	0	0	0	112.2	N549 Y550 K1080 L1084	N549-A553 WeakPolarHBondContact O-CB 3.25Å; N549-A553 PolarHBondContact O-N 3.44Å; Y550-A553 WeakPolarHBondContact O-CB 3.17Å; Y550-A553 PolarHBondContact O-N 3.38Å; Y550-A553 VanDerWaalsContact O-N 3.16Å; A553-K1080 WeakPolarHBondContact O-CE 3.4Å; A553-K1080 PolarHBondContact O-NZ 3.4Å; A553-L1084 HydrophobicContact CB-CD1 3.86Å
554	M	88.3	Confident	90.2	Very high	80 Å²	80	22.6 Å²	22.6	39%	0.394	12%	0.118	S	C	.	.	H	α-helix	trans	-89.7	-21.7	178.8	-63	-59.4	-72.3	0	0	114.3	W532 Y550 F551 W552	W532-M554 HydrophobicContact CD2-CB 3.89Å; W532-M554 HydrophobicContact CE3-CB 3.44Å; W532-M554 VanDerWaalsContact CE3-CB 3.44Å; W532-M554 HydrophobicContact CE3-CG 4.32Å; W532-M554 HydrophobicContact CH2-CB 3.52Å; W532-M554 HydrophobicContact CH2-CE 3.93Å; W532-M554 HydrophobicContact CH2-CG 3.73Å; W532-M554 HydrophobicContact CZ2-CB 3.98Å; W532-M554 HydrophobicContact CZ2-CE 4.16Å; W532-M554 HydrophobicContact CZ3-CB 3.22Å; W532-M554 HydrophobicContact CZ3-CG 3.61Å; Y550-M554 HydrophobicContact CD2-CG 4.2Å; Y550-M554 HydrophobicContact CE1-CG 4.42Å; Y550-M554 HydrophobicContact CE2-CG 3.7Å; Y550-M554 HydrophobicContact CE2-SD 4.17Å; Y550-M554 WeakPolarHBondContact O-CG 3.44Å; Y550-M554 PolarHBondContact O-N 3.44Å; F551-M554 PolarHBondContact O-N 2.9Å; W552-M554 PolarHBondContact O-N 3.45Å
555	G	86.8	Confident	90.2	Very high	7 Å²	7	21.2 Å²	21.2	7%	0.072	11%	0.112	C	C	.	.	S	Bend	trans	-74.7	157.2	-174.7	0	0	0	0	0	115.1	F551 W552 K1080	F551-G555 PolarHBondContact O-N 3.44Å; W552-G555 PolarHBondContact O-N 2.91Å; G555-K1080 PolarHBondContact O-NZ 2.85Å
556	P	85.8	Confident	90.2	Very high	49 Å²	49	18.4 Å²	18.4	32%	0.318	10%	0.1	S	C	.	.	S	Bend	trans	-77.3	164.7	168.8	34.1	-35.1	0	0	0	111.8	I1073	P556-I1073 HydrophobicContact CB-CG2 4.39Å
557	E	88.3	Confident	90.3	Very high	1 Å²	1	13.5 Å²	13.5	1%	0.005	8%	0.077	C	C	.	.			trans	53.7	57	177.1	-50.3	-167.1	137.8	0	0	113.3	V559 A560 A561 R616 T618 Q619 C620 I1073	E557-V559 VanDerWaalsContact C-N 3.34Å; E557-V559 PolarHBondContact O-N 2.9Å; E557-A560 HydrophobicContact CB-CB 4.34Å; E557-A560 PolarHBondContact O-N 3.19Å; E557-A561 WeakPolarHBondContact O-CB 3.4Å; E557-A561 PolarHBondContact O-N 2.66Å; E557-R616 IonicContact OE1-CZ 2.83Å; E557-R616 IonicContact OE1-NH1 2.83Å; E557-R616 PolarHBondContact OE1-NH1 3.19Å; E557-R616 IonicContact OE1-NH2 2.71Å; E557-R616 PolarHBondContact OE1-NH2 3.24Å; E557-T618 WeakPolarHBondContact OE2-CB 3.23Å; E557-Q619 PolarHBondContact OE1-N 3.26Å; E557-C620 VanDerWaalsContact OE2-CB 3.25Å; E557-C620 WeakPolarHBondContact OE2-CB 3.42Å; E557-C620 PolarHBondContact OE2-N 3.43Å; E557-I1073 HydrophobicContact CG-CG1 4.47Å
558	A	89.9	Confident	90.3	Very high	3 Å²	3	13.5 Å²	13.5	3%	0.025	8%	0.077	C	C	.	.	H	α-helix	trans	-63.1	-35.6	-170.3	0	0	0	0	0	113.8	W552 A562 V598 E1076 K1080	W552-A558 HydrophobicContact CZ2-CB 4.04Å; W552-A558 PolarHBondContact NE1-O 3.26Å; A558-A562 WeakPolarHBondContact O-CB 3.44Å; A558-A562 PolarHBondContact O-N 3.15Å; A558-V598 HydrophobicContact CB-CG1 4.45Å; A558-V598 HydrophobicContact CB-CG2 4.33Å; A558-E1076 PolarHBondContact N-OE1 3.47Å; A558-K1080 HydrophobicContact CB-CD 3.72Å; A558-K1080 HydrophobicContact CB-CG 4.3Å
559	V	91.2	Very high	90.2	Very high	1 Å²	1	13.7 Å²	13.7	1%	0.006	8%	0.077	C	C	.	.	H	α-helix	trans	-65.4	-46.5	178	-177.6	0	0	0	0	110.5	E557 A562 L563 V598 F599 L613 V626 F638 E1076	E557-V559 VanDerWaalsContact C-N 3.34Å; E557-V559 PolarHBondContact O-N 2.9Å; V559-A562 PolarHBondContact O-N 3.03Å; V559-L563 HydrophobicContact CG1-CD1 4.31Å; V559-L563 WeakPolarHBondContact O-CG 3.35Å; V559-L563 PolarHBondContact O-N 3.41Å; V559-L563 VanDerWaalsContact O-N 3.16Å; V559-V598 HydrophobicContact CG2-CB 4.04Å; V559-V598 HydrophobicContact CG2-CG1 3.68Å; V559-F599 HydrophobicContact CG2-CB 4.45Å; V559-L613 HydrophobicContact CG2-CD2 4.09Å; V559-V626 HydrophobicContact CG1-CG1 3.69Å; V559-F638 HydrophobicContact CG1-CE2 4.12Å; V559-F638 HydrophobicContact CG1-CZ 4.26Å; V559-E1076 PolarHBondContact N-OE1 3.36Å
560	A	90.4	Very high	90.2	Very high	1 Å²	1	14.3 Å²	14.3	1%	0.008	8%	0.078	C	C	.	.	H	α-helix	trans	-65	-43.4	178.3	0	0	0	0	0	111.7	E557 A562 L563 A564 T618 W621 V626 L629	E557-A560 HydrophobicContact CB-CB 4.34Å; E557-A560 PolarHBondContact O-N 3.19Å; A560-A562 PolarHBondContact O-N 3.21Å; A560-L563 PolarHBondContact O-N 3.22Å; A560-A564 WeakPolarHBondContact O-CB 3.45Å; A560-A564 PolarHBondContact O-N 3Å; A560-T618 HydrophobicContact CB-CG2 4.05Å; A560-W621 HydrophobicContact CB-CG 4.39Å; A560-V626 HydrophobicContact CB-CG2 4.47Å; A560-L629 HydrophobicContact CB-CD1 3.95Å
561	A	91.2	Very high	90.1	Very high	8 Å²	8	15 Å²	15	7%	0.066	8%	0.081	C	C	.	.	H	α-helix	trans	-62.7	-41	178.1	0	0	0	0	0	112.7	F536 E557 A564 G565 W621	F536-A561 HydrophobicContact CE1-CB 4.25Å; F536-A561 VanDerWaalsContact CE1-O 3.24Å; F536-A561 WeakPolarHBondContact CE1-O 3.45Å; F536-A561 WeakPolarHBondContact CZ-O 3.23Å; E557-A561 WeakPolarHBondContact O-CB 3.4Å; E557-A561 PolarHBondContact O-N 2.66Å; A561-A564 PolarHBondContact O-N 3.12Å; A561-G565 PolarHBondContact O-N 2.96Å; A561-W621 HydrophobicContact CB-CZ2 3.84Å
562	A	91.8	Very high	90	Very high	0 Å²	0	15 Å²	15	0%	0	8%	0.082	C	C	.	.	H	α-helix	trans	-64.1	-42.2	176.6	0	0	0	0	0	112	A558 V559 A560 G565 C566 F593 A594	A558-A562 WeakPolarHBondContact O-CB 3.44Å; A558-A562 PolarHBondContact O-N 3.15Å; V559-A562 PolarHBondContact O-N 3.03Å; A560-A562 PolarHBondContact O-N 3.21Å; A562-G565 PolarHBondContact O-N 2.93Å; A562-C566 WeakPolarHBondContact O-CB 3.41Å; A562-C566 PolarHBondContact O-N 3.29Å; A562-F593 HydrophobicContact CB-CB 4.41Å; A562-A594 HydrophobicContact CB-CB 3.73Å
563	L	91.1	Very high	89.9	Confident	0 Å²	0	14.9 Å²	14.9	0%	0	8%	0.082	C	C	.	.	H	α-helix	trans	-66.3	-42.1	177.1	-68.7	170	0	0	0	112.3	V559 A560 C566 K567 A594 V626 L629 A630 A635 F638	V559-L563 HydrophobicContact CG1-CD1 4.31Å; V559-L563 WeakPolarHBondContact O-CG 3.35Å; V559-L563 PolarHBondContact O-N 3.41Å; V559-L563 VanDerWaalsContact O-N 3.16Å; A560-L563 PolarHBondContact O-N 3.22Å; L563-C566 WeakPolarHBondContact O-CB 3.26Å; L563-C566 PolarHBondContact O-N 3.39Å; L563-K567 PolarHBondContact O-N 2.94Å; L563-A594 HydrophobicContact CD2-CB 3.92Å; L563-A594 HydrophobicContact CG-CB 4.02Å; L563-V626 HydrophobicContact CD1-CG1 3.61Å; L563-L629 HydrophobicContact CB-CB 4.38Å; L563-A630 HydrophobicContact CD1-CB 3.92Å; L563-A630 HydrophobicContact CD2-CB 4.16Å; L563-A635 HydrophobicContact CD2-CB 3.89Å; L563-F638 HydrophobicContact CD1-CE1 4.47Å; L563-F638 HydrophobicContact CD1-CZ 4.4Å; L563-F638 HydrophobicContact CD2-CD2 4.41Å; L563-F638 HydrophobicContact CD2-CG 4.28Å
564	A	90.4	Very high	89.9	Confident	0 Å²	0	22.6 Å²	22.6	0%	0	11%	0.108	C	C	.	.	H	α-helix	trans	-62.5	-44	174.9	0	0	0	0	0	111.7	L493 A560 A561 C566 K567 I568 W621	L493-A564 HydrophobicContact CD1-CB 4.43Å; L493-A564 HydrophobicContact CD2-CB 4.29Å; A560-A564 WeakPolarHBondContact O-CB 3.45Å; A560-A564 PolarHBondContact O-N 3Å; A561-A564 PolarHBondContact O-N 3.12Å; A564-C566 VanDerWaalsContact C-N 3.33Å; A564-C566 PolarHBondContact O-N 3.5Å; A564-K567 PolarHBondContact O-N 2.93Å; A564-I568 WeakPolarHBondContact O-CG1 3.12Å; A564-I568 PolarHBondContact O-N 2.86Å; A564-W621 HydrophobicContact CB-CD2 4.3Å; A564-W621 HydrophobicContact CB-CE3 3.79Å; A564-W621 HydrophobicContact CB-CH2 3.41Å; A564-W621 VanDerWaalsContact CB-CH2 3.41Å; A564-W621 HydrophobicContact CB-CZ2 3.96Å; A564-W621 HydrophobicContact CB-CZ3 3.31Å
565	G	91.1	Very high	90	Very high	0 Å²	0	22.7 Å²	22.7	0%	0	11%	0.109	C	C	.	.	H	α-helix	trans	-60	-42	173.5	0	0	0	0	0	112.5	A561 A562 I568 L569	A561-G565 PolarHBondContact O-N 2.96Å; A562-G565 PolarHBondContact O-N 2.93Å; G565-I568 PolarHBondContact O-N 2.98Å; G565-L569 WeakPolarHBondContact O-CB 3.27Å; G565-L569 WeakPolarHBondContact O-CG 3.48Å; G565-L569 PolarHBondContact O-N 2.81Å
566	C	90.3	Very high	90	Very high	8 Å²	8	24.2 Å²	24.2	5%	0.054	11%	0.114	C	C	.	.	H	α-helix	trans	-59.9	-46.5	175.4	-176.1	0	0	0	0	112	A562 L563 A564 L569 K570	A562-C566 WeakPolarHBondContact O-CB 3.41Å; A562-C566 PolarHBondContact O-N 3.29Å; L563-C566 WeakPolarHBondContact O-CB 3.26Å; L563-C566 PolarHBondContact O-N 3.39Å; A564-C566 VanDerWaalsContact C-N 3.33Å; A564-C566 PolarHBondContact O-N 3.5Å; C566-L569 PolarHBondContact O-N 3.1Å; C566-K570 WeakPolarHBondContact O-CB 3.42Å; C566-K570 WeakPolarHBondContact O-CG 3.37Å; C566-K570 PolarHBondContact O-N 3.22Å; C566-K570 WeakPolarHBondContact SG-CE 3.28Å
567	K	90.5	Very high	90	Very high	24 Å²	24	27.5 Å²	27.5	10%	0.104	14%	0.139	C	C	.	.	H	α-helix	trans	-61.6	-48.7	177	178.2	48.1	167.4	-171.6	0	111.7	F492 L493 L563 A564 L569 K570 E571 E632 A633	F492-K567 VanDerWaalsContact O-CE 3.26Å; F492-K567 WeakPolarHBondContact O-CE 3.35Å; L493-K567 HydrophobicContact CD2-CB 3.96Å; L493-K567 HydrophobicContact CD2-CG 3.82Å; L563-K567 PolarHBondContact O-N 2.94Å; A564-K567 PolarHBondContact O-N 2.93Å; K567-L569 PolarHBondContact O-N 2.79Å; K567-K570 PolarHBondContact O-N 2.7Å; K567-E571 HydrophobicContact CD-CG 4.01Å; K567-E571 IonicContact NZ-OE1 3.76Å; K567-E571 PolarHBondContact NZ-OE1 2.86Å; K567-E571 PolarHBondContact O-N 3.39Å; K567-E632 VanDerWaalsContact CD-O 3.25Å; K567-E632 WeakPolarHBondContact CD-O 3.5Å; K567-E632 WeakPolarHBondContact CE-O 3.41Å; K567-E632 PolarHBondContact NZ-O 3.43Å; K567-A633 HydrophobicContact CB-CB 3.93Å
568	I	91.5	Very high	89.9	Confident	0 Å²	0	33 Å²	33	0%	0	16%	0.164	C	C	.	.	H	α-helix	trans	-58.2	-48.6	180	-68.1	167.7	0	0	0	110.4	L489 F492 L493 L537 V540 L541 A564 G565 K570 E571 M572	L489-I568 HydrophobicContact CD2-CD1 4.26Å; F492-I568 HydrophobicContact CB-CG1 4.43Å; F492-I568 HydrophobicContact CD2-CG2 4.36Å; L493-I568 HydrophobicContact CD1-CD1 3.93Å; L493-I568 HydrophobicContact CD1-CG1 4.15Å; L493-I568 HydrophobicContact CG-CG1 4.23Å; L537-I568 HydrophobicContact CD2-CD1 3.44Å; L537-I568 VanDerWaalsContact CD2-CD1 3.44Å; V540-I568 HydrophobicContact CG1-CB 4.09Å; V540-I568 HydrophobicContact CG1-CG2 3.83Å; L541-I568 HydrophobicContact CD2-CG2 3.65Å; L541-I568 HydrophobicContact CG-CG2 4.32Å; A564-I568 WeakPolarHBondContact O-CG1 3.12Å; A564-I568 PolarHBondContact O-N 2.86Å; G565-I568 PolarHBondContact O-N 2.98Å; I568-K570 PolarHBondContact O-N 2.78Å; I568-E571 PolarHBondContact O-N 2.93Å; I568-M572 HydrophobicContact CG2-CG 4.2Å; I568-M572 HydrophobicContact CG2-SD 3.86Å; I568-M572 WeakPolarHBondContact O-CB 3.4Å; I568-M572 VanDerWaalsContact O-CG 3.3Å; I568-M572 WeakPolarHBondContact O-CG 3.37Å; I568-M572 PolarHBondContact O-N 2.69Å
569	L	91.1	Very high	89.6	Confident	5 Å²	5	35.9 Å²	35.9	3%	0.026	19%	0.188	C	C	.	.	H	α-helix	trans	-66.6	-37.2	-178.7	-69.6	168.8	0	0	0	112.8	V540 G565 C566 K567 M572 A573 M585 A588 Y590	V540-L569 HydrophobicContact CG1-CD1 4.2Å; V540-L569 HydrophobicContact CG1-CD2 3.94Å; V540-L569 HydrophobicContact CG1-CG 3.73Å; G565-L569 WeakPolarHBondContact O-CB 3.27Å; G565-L569 WeakPolarHBondContact O-CG 3.48Å; G565-L569 PolarHBondContact O-N 2.81Å; C566-L569 PolarHBondContact O-N 3.1Å; K567-L569 PolarHBondContact O-N 2.79Å; L569-M572 PolarHBondContact O-N 3.01Å; L569-A573 WeakPolarHBondContact O-CB 3.33Å; L569-A573 PolarHBondContact O-N 3Å; L569-M585 HydrophobicContact CD2-CB 4.31Å; L569-M585 HydrophobicContact CD2-CG 4.1Å; L569-A588 HydrophobicContact CD1-CB 3.61Å; L569-Y590 HydrophobicContact CD1-CD2 3.33Å; L569-Y590 HydrophobicContact CD1-CE2 3.45Å; L569-Y590 VanDerWaalsContact CD1-CE2 3.45Å; L569-Y590 HydrophobicContact CD1-CG 4.47Å
570	K	89.9	Confident	89.3	Confident	67 Å²	67	43.1 Å²	43.1	29%	0.291	22%	0.222	S	C	.	.	H	α-helix	trans	-62.4	-44	174.6	-78.4	176.1	178	169.9	0	111.9	C566 K567 I568 R574 E591 A633 D634	C566-K570 WeakPolarHBondContact O-CB 3.42Å; C566-K570 WeakPolarHBondContact O-CG 3.37Å; C566-K570 PolarHBondContact O-N 3.22Å; C566-K570 WeakPolarHBondContact SG-CE 3.28Å; K567-K570 PolarHBondContact O-N 2.7Å; I568-K570 PolarHBondContact O-N 2.78Å; K570-R574 PolarHBondContact O-N 2.88Å; K570-E591 IonicContact NZ-OE2 2.63Å; K570-E591 PolarHBondContact NZ-OE2 3.39Å; K570-A633 WeakPolarHBondContact CD-O 3.49Å; K570-A633 PolarHBondContact NZ-O 3.47Å; K570-A633 VanDerWaalsContact NZ-O 3.09Å; K570-D634 PolarHBondContact NZ-O 3.16Å; K570-D634 VanDerWaalsContact NZ-O 3.12Å
571	E	89.8	Confident	88.9	Confident	33 Å²	33	44.3 Å²	44.3	15%	0.154	23%	0.23	C	C	.	.	H	α-helix	trans	-70.5	-41.3	177.1	-69.8	-56.7	149.6	0	0	112.2	F492 K567 I568 A573 R574 L575	F492-E571 HydrophobicContact CD1-CB 3.69Å; F492-E571 HydrophobicContact CD1-CG 4.3Å; F492-E571 HydrophobicContact CE1-CB 4.03Å; F492-E571 HydrophobicContact CG-CB 4.49Å; K567-E571 HydrophobicContact CD-CG 4.01Å; K567-E571 IonicContact NZ-OE1 3.76Å; K567-E571 PolarHBondContact NZ-OE1 2.86Å; K567-E571 PolarHBondContact O-N 3.39Å; I568-E571 PolarHBondContact O-N 2.93Å; E571-A573 VanDerWaalsContact C-N 3.35Å; E571-A573 PolarHBondContact O-N 2.81Å; E571-R574 WeakPolarHBondContact O-CB 3.39Å; E571-R574 PolarHBondContact O-N 2.85Å; E571-R574 VanDerWaalsContact O-N 3.13Å; E571-R574 IonicContact OE2-CZ 3.71Å; E571-R574 IonicContact OE2-NE 3.14Å; E571-R574 PolarHBondContact OE2-NE 3.02Å; E571-R574 VanDerWaalsContact OE2-NE 3.08Å; E571-R574 IonicContact OE2-NH2 3.47Å; E571-R574 PolarHBondContact OE2-NH2 3Å; E571-L575 PolarHBondContact O-N 2.88Å
572	M	89.8	Confident	88.7	Confident	3 Å²	3	44.5 Å²	44.5	2%	0.015	23%	0.232	C	C	.	.	H	α-helix	trans	-61.2	-43.6	175.1	-76.5	-171.8	70.1	0	0	111.8	L443 F492 L541 I568 L569 R574 L575 E576 M585	L443-M572 HydrophobicContact CD2-CB 4.28Å; L443-M572 HydrophobicContact CD2-CE 4.11Å; L443-M572 WeakPolarHBondContact CD2-O 3.32Å; F492-M572 HydrophobicContact CE2-CG 4.22Å; F492-M572 HydrophobicContact CZ-CG 4Å; L541-M572 HydrophobicContact CD2-SD 4.02Å; L541-M572 WeakPolarHBondContact O-CE 3.34Å; I568-M572 HydrophobicContact CG2-CG 4.2Å; I568-M572 HydrophobicContact CG2-SD 3.86Å; I568-M572 WeakPolarHBondContact O-CB 3.4Å; I568-M572 VanDerWaalsContact O-CG 3.3Å; I568-M572 WeakPolarHBondContact O-CG 3.37Å; I568-M572 PolarHBondContact O-N 2.69Å; L569-M572 PolarHBondContact O-N 3.01Å; M572-R574 PolarHBondContact O-N 3.07Å; M572-L575 PolarHBondContact O-N 3.22Å; M572-E576 WeakPolarHBondContact O-CB 3.39Å; M572-E576 PolarHBondContact O-N 2.93Å; M572-M585 HydrophobicContact CB-SD 3.57Å; M572-M585 VanDerWaalsContact CB-SD 3.57Å; M572-M585 HydrophobicContact CE-SD 4.38Å
573	A	90.8	Very high	88.4	Confident	5 Å²	5	52.4 Å²	52.4	4%	0.041	26%	0.261	C	S	.	.	H	α-helix	trans	-63.6	-21.7	176.6	0	0	0	0	0	113.6	L569 E571 M585 K586	L569-A573 WeakPolarHBondContact O-CB 3.33Å; L569-A573 PolarHBondContact O-N 3Å; E571-A573 VanDerWaalsContact C-N 3.35Å; E571-A573 PolarHBondContact O-N 2.81Å; A573-M585 HydrophobicContact CB-CB 3.81Å; A573-M585 HydrophobicContact CB-SD 4.45Å; A573-K586 HydrophobicContact CB-CD 4.44Å; A573-K586 HydrophobicContact CB-CG 3.75Å
574	R	89.2	Confident	88.1	Confident	180 Å²	180	54.3 Å²	54.3	68%	0.679	28%	0.275	S	S	*	.	H	α-helix	trans	-80.7	-31	174.7	-172.7	175.9	68.3	116	-3.6	112.2	K570 E571 M572	K570-R574 PolarHBondContact O-N 2.88Å; E571-R574 WeakPolarHBondContact O-CB 3.39Å; E571-R574 PolarHBondContact O-N 2.85Å; E571-R574 VanDerWaalsContact O-N 3.13Å; E571-R574 IonicContact OE2-CZ 3.71Å; E571-R574 IonicContact OE2-NE 3.14Å; E571-R574 PolarHBondContact OE2-NE 3.02Å; E571-R574 VanDerWaalsContact OE2-NE 3.08Å; E571-R574 IonicContact OE2-NH2 3.47Å; E571-R574 PolarHBondContact OE2-NH2 3Å; M572-R574 PolarHBondContact O-N 3.07Å
575	L	88.6	Confident	87.9	Confident	82 Å²	82	54.6 Å²	54.6	43%	0.429	28%	0.276	S	S	.	.	H	α-helix	trans	-89.4	-17.9	179.4	-63.9	175.9	0	0	0	113.2	L443 L447 F492 E571 M572	L443-L575 HydrophobicContact CD1-CB 4.41Å; L443-L575 HydrophobicContact CD2-CB 4.2Å; L447-L575 HydrophobicContact CD1-CD1 4.4Å; L447-L575 HydrophobicContact CD2-CD1 4.3Å; F492-L575 HydrophobicContact CE1-CD1 3.87Å; F492-L575 HydrophobicContact CZ-CD1 4.39Å; E571-L575 PolarHBondContact O-N 2.88Å; M572-L575 PolarHBondContact O-N 3.22Å
576	E	87.4	Confident	87.5	Confident	38 Å²	38	61.5 Å²	61.5	18%	0.178	31%	0.306	C	S	.	.			trans	-70.2	134.2	-179.3	-173.7	56.4	-94.6	0	0	112	L443 M572 E578 A582 M585	L443-E576 HydrophobicContact CD2-CB 4.15Å; M572-E576 WeakPolarHBondContact O-CB 3.39Å; M572-E576 PolarHBondContact O-N 2.93Å; E576-E578 HydrophobicContact CG-CB 4.43Å; E576-E578 PolarHBondContact OE1-N 3.19Å; E576-A582 HydrophobicContact CB-CB 4.06Å; E576-A582 HydrophobicContact CG-CB 4.11Å; E576-M585 HydrophobicContact CB-CE 4.21Å; E576-M585 HydrophobicContact CG-CE 3.99Å
577	S	85.1	Confident	86.9	Confident	119 Å²	119	68 Å²	68	83%	0.832	34%	0.336	S	S	*	.			trans	-89.2	-28.9	179.2	66.9	0	0	0	0	112.4
578	E	86.3	Confident	86.2	Confident	116 Å²	116	67.8 Å²	67.8	54%	0.542	34%	0.338	S	S	.	.			trans	-82.2	119.1	-179.4	-173.2	169.7	-154.8	0	0	111.5	E576 E580 S581 A582	E576-E578 HydrophobicContact CG-CB 4.43Å; E576-E578 PolarHBondContact OE1-N 3.19Å; E578-E580 VanDerWaalsContact C-N 3.34Å; E578-E580 PolarHBondContact O-N 3.25Å; E578-S581 PolarHBondContact O-N 2.97Å; E578-A582 WeakPolarHBondContact O-CB 3.26Å; E578-A582 PolarHBondContact O-N 2.99Å
579	A	83.7	Confident	85.3	Confident	64 Å²	64	73.7 Å²	73.7	53%	0.529	36%	0.364	S	S	.	.	H	α-helix	trans	-63.4	-34.5	-173.4	0	0	0	0	0	114	R583	A579-R583 WeakPolarHBondContact O-CB 3.45Å; A579-R583 VanDerWaalsContact O-CG 3.28Å; A579-R583 WeakPolarHBondContact O-CG 3.38Å; A579-R583 PolarHBondContact O-N 2.92Å
580	E	84.8	Confident	84.7	Confident	153 Å²	153	73.6 Å²	73.6	72%	0.715	36%	0.363	S	S	*	.	H	α-helix	trans	-71.4	-46.6	179.7	-171.4	170.1	-177.1	0	0	111.4	E578 A582 R583 S584	E578-E580 VanDerWaalsContact C-N 3.34Å; E578-E580 PolarHBondContact O-N 3.25Å; E580-A582 PolarHBondContact O-N 2.93Å; E580-R583 PolarHBondContact O-N 3.14Å; E580-S584 WeakPolarHBondContact O-CB 3.48Å; E580-S584 PolarHBondContact O-N 3.36Å
581	S	83.4	Confident	83.9	Confident	25 Å²	25	72.1 Å²	72.1	18%	0.175	36%	0.357	C	S	.	.	H	α-helix	trans	-59.8	-44.5	173.5	-173.2	0	0	0	0	111.3	E578 R583 S584 M585	E578-S581 PolarHBondContact O-N 2.97Å; S581-R583 PolarHBondContact O-N 3.21Å; S581-S584 WeakPolarHBondContact O-CB 3.46Å; S581-S584 PolarHBondContact O-N 3.29Å; S581-M585 WeakPolarHBondContact O-CG 3.37Å; S581-M585 PolarHBondContact O-N 2.98Å; S581-M585 WeakPolarHBondContact OG-CE 3.34Å
582	A	86.6	Confident	83.4	Confident	12 Å²	12	75.7 Å²	75.7	10%	0.099	37%	0.374	C	S	.	.	H	α-helix	trans	-64.5	-35.6	177.2	0	0	0	0	0	113.4	E576 E578 E580 K586	E576-A582 HydrophobicContact CB-CB 4.06Å; E576-A582 HydrophobicContact CG-CB 4.11Å; E578-A582 WeakPolarHBondContact O-CB 3.26Å; E578-A582 PolarHBondContact O-N 2.99Å; E580-A582 PolarHBondContact O-N 2.93Å; A582-K586 WeakPolarHBondContact O-CG 3.43Å; A582-K586 PolarHBondContact O-N 3.03Å
583	R	84.9	Confident	82.7	Confident	166 Å²	166	77.1 Å²	77.1	63%	0.626	38%	0.38	S	S	*	.	H	α-helix	trans	-68	-48	173.1	-78.5	177.4	-168.5	159.7	3.3	111.1	A579 E580 S581 M585 K586 E587	A579-R583 WeakPolarHBondContact O-CB 3.45Å; A579-R583 VanDerWaalsContact O-CG 3.28Å; A579-R583 WeakPolarHBondContact O-CG 3.38Å; A579-R583 PolarHBondContact O-N 2.92Å; E580-R583 PolarHBondContact O-N 3.14Å; S581-R583 PolarHBondContact O-N 3.21Å; R583-M585 VanDerWaalsContact C-N 3.28Å; R583-M585 PolarHBondContact O-N 2.98Å; R583-K586 PolarHBondContact O-N 2.82Å; R583-E587 WeakPolarHBondContact O-CB 3.42Å; R583-E587 WeakPolarHBondContact O-CG 3.19Å; R583-E587 PolarHBondContact O-N 2.78Å
584	S	86	Confident	81.7	Confident	40 Å²	40	76.9 Å²	76.9	28%	0.28	38%	0.378	S	S	.	.	H	α-helix	trans	-53.8	-44	177.1	173.8	0	0	0	0	112.1	N543 Q545 E580 S581 E587 A588	N543-S584 PolarHBondContact ND2-OG 3.48Å; Q545-S584 PolarHBondContact NE2-O 2.97Å; Q545-S584 PolarHBondContact NE2-OG 2.88Å; E580-S584 WeakPolarHBondContact O-CB 3.48Å; E580-S584 PolarHBondContact O-N 3.36Å; S581-S584 WeakPolarHBondContact O-CB 3.46Å; S581-S584 PolarHBondContact O-N 3.29Å; S584-E587 PolarHBondContact O-N 2.94Å; S584-A588 PolarHBondContact O-N 3.11Å
585	M	85.4	Confident	80.6	Confident	6 Å²	6	70 Å²	70	3%	0.03	36%	0.355	C	S	.	.	H	α-helix	trans	-66.4	-36.9	175.8	-67.9	-177.6	-139	0	0	113.2	N543 L569 M572 A573 E576 S581 R583 A588	N543-M585 HydrophobicContact CB-CE 4.33Å; N543-M585 HydrophobicContact CB-CG 4.24Å; L569-M585 HydrophobicContact CD2-CB 4.31Å; L569-M585 HydrophobicContact CD2-CG 4.1Å; M572-M585 HydrophobicContact CB-SD 3.57Å; M572-M585 VanDerWaalsContact CB-SD 3.57Å; M572-M585 HydrophobicContact CE-SD 4.38Å; A573-M585 HydrophobicContact CB-CB 3.81Å; A573-M585 HydrophobicContact CB-SD 4.45Å; E576-M585 HydrophobicContact CB-CE 4.21Å; E576-M585 HydrophobicContact CG-CE 3.99Å; S581-M585 WeakPolarHBondContact O-CG 3.37Å; S581-M585 PolarHBondContact O-N 2.98Å; S581-M585 WeakPolarHBondContact OG-CE 3.34Å; R583-M585 VanDerWaalsContact C-N 3.28Å; R583-M585 PolarHBondContact O-N 2.98Å; M585-A588 WeakPolarHBondContact O-CB 3.44Å
586	K	82	Confident	79.2	Confident	146 Å²	146	68.9 Å²	68.9	64%	0.635	36%	0.357	S	S	*	.	H	α-helix	trans	-72.2	-33	177.2	-76.7	174.7	-177.6	175.6	0	113.2	A573 A582 R583	A573-K586 HydrophobicContact CB-CD 4.44Å; A573-K586 HydrophobicContact CB-CG 3.75Å; A582-K586 WeakPolarHBondContact O-CG 3.43Å; A582-K586 PolarHBondContact O-N 3.03Å; R583-K586 PolarHBondContact O-N 2.82Å
587	E	78.6	Confident	78.3	Confident	145 Å²	145	68.1 Å²	68.1	68%	0.678	35%	0.354	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.2	-4.8	179.1	-70.6	173.3	-171.7	0	0	112.7	R583 S584 K589	R583-E587 WeakPolarHBondContact O-CB 3.42Å; R583-E587 WeakPolarHBondContact O-CG 3.19Å; R583-E587 PolarHBondContact O-N 2.78Å; S584-E587 PolarHBondContact O-N 2.94Å; E587-K589 PolarHBondContact O-N 3.16Å
588	A	74.8	Confident	78.3	Confident	18 Å²	18	62.4 Å²	62.4	15%	0.149	32%	0.315	C	S	.	.			trans	-60.6	128.7	177.8	0	0	0	0	0	111.3	L569 S584 M585 Y590	L569-A588 HydrophobicContact CD1-CB 3.61Å; S584-A588 PolarHBondContact O-N 3.11Å; M585-A588 WeakPolarHBondContact O-CB 3.44Å; A588-Y590 HydrophobicContact CB-CD2 3.91Å; A588-Y590 HydrophobicContact CB-CE2 4.24Å; A588-Y590 PolarHBondContact O-N 2.77Å
589	K	74	Confident	78.5	Confident	124 Å²	124	56.9 Å²	56.9	54%	0.539	29%	0.289	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.2	17.7	-168.3	-61.4	-176.4	-179.4	-179.8	0	114.8	E587 E591 Q592 F593	E587-K589 PolarHBondContact O-N 3.16Å; K589-E591 VanDerWaalsContact C-N 3.29Å; K589-E591 PolarHBondContact O-N 3.01Å; K589-Q592 HydrophobicContact CB-CB 4.37Å; K589-Q592 CarbonylContact O-C 3.56Å; K589-Q592 WeakPolarHBondContact O-CA 3.25Å; K589-Q592 WeakPolarHBondContact O-CB 3.15Å; K589-Q592 PolarHBondContact O-N 2.99Å; K589-F593 HydrophobicContact CB-CE1 4.24Å; K589-F593 HydrophobicContact CB-CE2 4.23Å; K589-F593 HydrophobicContact CB-CZ 4.03Å; K589-F593 WeakPolarHBondContact O-CG 3.41Å; K589-F593 PolarHBondContact O-N 3.5Å
590	Y	77.4	Confident	78.8	Confident	4 Å²	4	54.7 Å²	54.7	2%	0.016	27%	0.272	C	S	.	.	H	α-helix	trans	-63.6	-31.6	-177.2	-71.8	-76.1	0	0	0	113.8	F536 A548 N549 L569 A588 Q592 F593 A594	F536-Y590 AromaticContact CE2-CE1 3.67Å; F536-Y590 HydrophobicContact CE2-CE1 3.67Å; F536-Y590 HydrophobicContact CZ-CD1 4.35Å; F536-Y590 AromaticContact CZ-CE1 3.88Å; F536-Y590 HydrophobicContact CZ-CE1 3.88Å; A548-Y590 WeakPolarHBondContact CB-OH 3.27Å; N549-Y590 PolarHBondContact OD1-OH 3.13Å; N549-Y590 VanDerWaalsContact OD1-OH 3.13Å; L569-Y590 HydrophobicContact CD1-CD2 3.33Å; L569-Y590 HydrophobicContact CD1-CE2 3.45Å; L569-Y590 VanDerWaalsContact CD1-CE2 3.45Å; L569-Y590 HydrophobicContact CD1-CG 4.47Å; A588-Y590 HydrophobicContact CB-CD2 3.91Å; A588-Y590 HydrophobicContact CB-CE2 4.24Å; A588-Y590 PolarHBondContact O-N 2.77Å; Y590-Q592 VanDerWaalsContact C-N 3.3Å; Y590-F593 AromaticContact CD1-CD2 3.88Å; Y590-F593 HydrophobicContact CD1-CD2 3.88Å; Y590-F593 HydrophobicContact CE1-CD2 4.21Å; Y590-F593 HydrophobicContact CG-CD2 4.36Å; Y590-F593 PolarHBondContact O-N 3.08Å; Y590-A594 PolarHBondContact O-N 2.99Å
591	E	73.8	Confident	79	Confident	35 Å²	35	49.6 Å²	49.6	16%	0.164	25%	0.249	C	C	.	.	H	α-helix	trans	-67.5	-33.5	172.8	-167	170.1	158	0	0	111.4	K570 K589 L595 S637	K570-E591 IonicContact NZ-OE2 2.63Å; K570-E591 PolarHBondContact NZ-OE2 3.39Å; K589-E591 VanDerWaalsContact C-N 3.29Å; K589-E591 PolarHBondContact O-N 3.01Å; E591-L595 WeakPolarHBondContact O-CB 3.14Å; E591-L595 PolarHBondContact O-N 3.31Å; E591-L595 VanDerWaalsContact O-N 3.15Å; E591-S637 WeakPolarHBondContact OE1-CB 3.24Å; E591-S637 PolarHBondContact OE1-N 3.23Å; E591-S637 PolarHBondContact OE1-OG 3.39Å
592	Q	78.6	Confident	79.3	Confident	108 Å²	108	48.4 Å²	48.4	51%	0.505	24%	0.24	S	C	.	.	H	α-helix	trans	-71.4	-44.5	173.3	-65.2	176	-14.8	0	0	110.8	K589 Y590 A594 L595 A596 D597	K589-Q592 HydrophobicContact CB-CB 4.37Å; K589-Q592 CarbonylContact O-C 3.56Å; K589-Q592 WeakPolarHBondContact O-CA 3.25Å; K589-Q592 WeakPolarHBondContact O-CB 3.15Å; K589-Q592 PolarHBondContact O-N 2.99Å; Y590-Q592 VanDerWaalsContact C-N 3.3Å; Q592-A594 VanDerWaalsContact C-N 3.29Å; Q592-A594 PolarHBondContact O-N 3.32Å; Q592-L595 PolarHBondContact O-N 2.75Å; Q592-A596 PolarHBondContact O-N 2.7Å; Q592-D597 VanDerWaalsContact O-OD2 3.09Å
593	F	74.6	Confident	79.5	Confident	34 Å²	34	50.3 Å²	50.3	15%	0.149	25%	0.245	C	C	.	.	I	π-helix	trans	-57.6	-37.5	175.5	-63.9	-29.7	0	0	0	113.1	W552 A562 K589 Y590 D597 V598	W552-F593 HydrophobicContact CH2-CB 4.02Å; W552-F593 HydrophobicContact CH2-CG 4.4Å; W552-F593 HydrophobicContact CZ2-CB 3.95Å; A562-F593 HydrophobicContact CB-CB 4.41Å; K589-F593 HydrophobicContact CB-CE1 4.24Å; K589-F593 HydrophobicContact CB-CE2 4.23Å; K589-F593 HydrophobicContact CB-CZ 4.03Å; K589-F593 WeakPolarHBondContact O-CG 3.41Å; K589-F593 PolarHBondContact O-N 3.5Å; Y590-F593 AromaticContact CD1-CD2 3.88Å; Y590-F593 HydrophobicContact CD1-CD2 3.88Å; Y590-F593 HydrophobicContact CE1-CD2 4.21Å; Y590-F593 HydrophobicContact CG-CD2 4.36Å; Y590-F593 PolarHBondContact O-N 3.08Å; F593-D597 WeakPolarHBondContact CA-OD2 3.2Å; F593-D597 VanDerWaalsContact CD1-OD2 3.26Å; F593-D597 WeakPolarHBondContact CD1-OD2 3.19Å; F593-D597 PolarHBondContact N-OD2 2.64Å; F593-D597 WeakPolarHBondContact O-CB 3.35Å; F593-V598 PolarHBondContact O-N 3.07Å
594	A	71.3	Confident	79.7	Confident	0 Å²	0	46.3 Å²	46.3	0%	0	24%	0.243	C	C	.	.	I	π-helix	trans	-71.8	-41.1	174.2	0	0	0	0	0	112.4	A562 L563 Y590 Q592 F599 F638	A562-A594 HydrophobicContact CB-CB 3.73Å; L563-A594 HydrophobicContact CD2-CB 3.92Å; L563-A594 HydrophobicContact CG-CB 4.02Å; Y590-A594 PolarHBondContact O-N 2.99Å; Q592-A594 VanDerWaalsContact C-N 3.29Å; Q592-A594 PolarHBondContact O-N 3.32Å; A594-F599 VanDerWaalsContact O-CB 3.23Å; A594-F599 WeakPolarHBondContact O-CB 3.41Å; A594-F599 PolarHBondContact O-N 2.68Å; A594-F638 HydrophobicContact CB-CD2 4.37Å
595	L	66.2	Low	79.9	Confident	34 Å²	34	48.6 Å²	48.6	18%	0.178	25%	0.252	C	S	.	.	I	π-helix	trans	-88.9	-62.9	-168.5	175.6	145.9	0	0	0	114.6	E591 Q592 D597 G600 S637 F638 H641	E591-L595 WeakPolarHBondContact O-CB 3.14Å; E591-L595 PolarHBondContact O-N 3.31Å; E591-L595 VanDerWaalsContact O-N 3.15Å; Q592-L595 PolarHBondContact O-N 2.75Å; L595-D597 VanDerWaalsContact C-N 3.28Å; L595-G600 PolarHBondContact O-N 2.89Å; L595-S637 WeakPolarHBondContact CD1-O 3.41Å; L595-F638 HydrophobicContact CB-CD2 4.35Å; L595-F638 HydrophobicContact CD1-CB 4.46Å; L595-H641 HydrophobicContact CD1-CB 4.29Å; L595-H641 HydrophobicContact CG-CB 4.38Å
596	A	59.2	Low	80.1	Confident	59 Å²	59	49.8 Å²	49.8	49%	0.488	26%	0.26	S	S	.	.	I	π-helix	trans	-81.8	-19	-168.5	0	0	0	0	0	111.8	Q592	Q592-A596 PolarHBondContact O-N 2.7Å
597	D	68.3	Low	80.3	Confident	22 Å²	22	47.6 Å²	47.6	12%	0.118	25%	0.252	C	S	.	.	I	π-helix	trans	-111.4	-59	-152.5	-69.7	-24	0	0	0	110.4	Q592 F593 L595 Y1083	Q592-D597 VanDerWaalsContact O-OD2 3.09Å; F593-D597 WeakPolarHBondContact CA-OD2 3.2Å; F593-D597 VanDerWaalsContact CD1-OD2 3.26Å; F593-D597 WeakPolarHBondContact CD1-OD2 3.19Å; F593-D597 PolarHBondContact N-OD2 2.64Å; F593-D597 WeakPolarHBondContact O-CB 3.35Å; L595-D597 VanDerWaalsContact C-N 3.28Å; D597-Y1083 HydrophobicContact CB-CD1 4.05Å; D597-Y1083 HydrophobicContact CB-CD2 4Å; D597-Y1083 HydrophobicContact CB-CE1 3.47Å; D597-Y1083 VanDerWaalsContact CB-CE1 3.47Å; D597-Y1083 HydrophobicContact CB-CE2 3.39Å; D597-Y1083 HydrophobicContact CB-CG 4.29Å; D597-Y1083 WeakPolarHBondContact CB-OH 3.29Å; D597-Y1083 VanDerWaalsContact CG-CE2 3.48Å; D597-Y1083 WeakPolarHBondContact O-CB 3.41Å; D597-Y1083 WeakPolarHBondContact O-CD2 3.34Å; D597-Y1083 WeakPolarHBondContact OD1-CE2 3.48Å; D597-Y1083 PolarHBondContact OD1-OH 3.42Å; D597-Y1083 PolarHBondContact OD2-OH 3.45Å
598	V	84.1	Confident	80.6	Confident	0 Å²	0	42.5 Å²	42.5	0%	0	23%	0.23	C	C	.	.	I	π-helix	trans	-94	-52.2	176.8	-175.2	0	0	0	0	112	W552 A558 V559 F593 G600 E601 C602 E1076 K1080	W552-V598 HydrophobicContact CH2-CG2 3.68Å; W552-V598 HydrophobicContact CZ2-CG2 3.61Å; A558-V598 HydrophobicContact CB-CG1 4.45Å; A558-V598 HydrophobicContact CB-CG2 4.33Å; V559-V598 HydrophobicContact CG2-CB 4.04Å; V559-V598 HydrophobicContact CG2-CG1 3.68Å; F593-V598 PolarHBondContact O-N 3.07Å; V598-G600 PolarHBondContact O-N 2.52Å; V598-E601 PolarHBondContact O-N 3.29Å; V598-C602 PolarHBondContact O-N 3.22Å; V598-C602 PolarHBondContact O-SG 3.49Å; V598-E1076 HydrophobicContact CG1-CG 4.4Å; V598-K1080 HydrophobicContact CG1-CB 4.44Å; V598-K1080 HydrophobicContact CG2-CB 4.37Å; V598-K1080 HydrophobicContact CG2-CG 4.3Å
599	F	91	Very high	81.1	Confident	0 Å²	0	44.3 Å²	44.3	0%	0	23%	0.233	C	C	.	.	I	π-helix	trans	-67.8	-39.2	-173.8	-175.6	-102.3	0	0	0	113.3	V559 A594 E601 C602 Y603 A610 L613 L614 F638 H641 V644	V559-F599 HydrophobicContact CG2-CB 4.45Å; A594-F599 VanDerWaalsContact O-CB 3.23Å; A594-F599 WeakPolarHBondContact O-CB 3.41Å; A594-F599 PolarHBondContact O-N 2.68Å; F599-E601 VanDerWaalsContact C-N 3.33Å; F599-E601 PolarHBondContact O-N 3.2Å; F599-C602 WeakPolarHBondContact O-CB 3.21Å; F599-C602 PolarHBondContact O-N 2.93Å; F599-Y603 WeakPolarHBondContact O-CB 3.45Å; F599-Y603 PolarHBondContact O-N 2.8Å; F599-A610 HydrophobicContact CE2-CB 4.11Å; F599-A610 HydrophobicContact CZ-CB 4.39Å; F599-L613 HydrophobicContact CD2-CD2 4.48Å; F599-L614 HydrophobicContact CD2-CD2 4.18Å; F599-L614 HydrophobicContact CE1-CD1 4.49Å; F599-L614 HydrophobicContact CE2-CD1 3.81Å; F599-L614 HydrophobicContact CE2-CD2 3.7Å; F599-L614 HydrophobicContact CE2-CG 3.65Å; F599-L614 HydrophobicContact CZ-CD1 3.55Å; F599-L614 HydrophobicContact CZ-CD2 4.13Å; F599-L614 HydrophobicContact CZ-CG 3.96Å; F599-F638 HydrophobicContact CB-CE2 4.21Å; F599-F638 HydrophobicContact CD1-CE2 4.48Å; F599-F638 HydrophobicContact CG-CE2 4.24Å; F599-H641 AromaticContact CD1-CE1 3.75Å; F599-H641 AromaticContact CD1-ND1 3.54Å; F599-H641 AromaticContact CE1-CE1 3.83Å; F599-H641 AromaticContact CE1-ND1 3.45Å; F599-H641 WeakPolarHBondContact CE1-ND1 3.46Å; F599-V644 HydrophobicContact CD1-CG2 4.26Å; F599-V644 HydrophobicContact CE1-CG2 3.66Å; F599-V644 HydrophobicContact CZ-CG2 4.16Å
600	G	89.1	Confident	81.8	Confident	17 Å²	17	38.4 Å²	38.4	18%	0.175	21%	0.207	C	C	.	.	H	α-helix	trans	-58.9	-41.7	175.9	0	0	0	0	0	113.2	L595 V598 Y603 S604	L595-G600 PolarHBondContact O-N 2.89Å; V598-G600 PolarHBondContact O-N 2.52Å; G600-Y603 PolarHBondContact O-N 3.26Å; G600-S604 PolarHBondContact O-N 3.28Å; G600-S604 PolarHBondContact O-OG 3.48Å
601	E	88.8	Confident	82.3	Confident	47 Å²	47	39.3 Å²	39.3	22%	0.22	21%	0.211	C	C	.	.	H	α-helix	trans	-73.5	-36	177.5	-162.8	68.6	-135.9	0	0	111.8	V598 F599 Y603 S604 N605 K1086	V598-E601 PolarHBondContact O-N 3.29Å; F599-E601 VanDerWaalsContact C-N 3.33Å; F599-E601 PolarHBondContact O-N 3.2Å; E601-Y603 VanDerWaalsContact C-N 3.33Å; E601-Y603 PolarHBondContact O-N 3.44Å; E601-S604 WeakPolarHBondContact CA-OG 3.4Å; E601-S604 PolarHBondContact O-OG 3.41Å; E601-N605 WeakPolarHBondContact O-CB 3.47Å; E601-N605 PolarHBondContact O-N 3.37Å; E601-N605 VanDerWaalsContact O-N 3.15Å; E601-K1086 IonicContact OE2-NZ 2.79Å; E601-K1086 PolarHBondContact OE2-NZ 3.33Å
602	C	89.9	Confident	82.8	Confident	0 Å²	0	38.5 Å²	38.5	0%	0	21%	0.21	C	C	.	.	H	α-helix	trans	-59.5	-44.1	170	-72.9	0	0	0	0	111.8	V598 F599 S606 W1075	V598-C602 PolarHBondContact O-N 3.22Å; V598-C602 PolarHBondContact O-SG 3.49Å; F599-C602 WeakPolarHBondContact O-CB 3.21Å; F599-C602 PolarHBondContact O-N 2.93Å; C602-S606 PolarHBondContact O-N 3.47Å; C602-W1075 HydrophobicContact CB-CH2 3.61Å; C602-W1075 HydrophobicContact CB-CZ2 4.35Å; C602-W1075 HydrophobicContact CB-CZ3 4.08Å; C602-W1075 WeakPolarHBondContact O-CH2 3.25Å
603	Y	91.1	Very high	83.3	Confident	52 Å²	52	33.3 Å²	33.3	20%	0.204	19%	0.186	C	C	.	.	H	α-helix	trans	-68.6	-42.4	-179.9	180	-104.3	0	0	0	112.4	F599 G600 E601 N605 E607 A610 Y611 G643	F599-Y603 WeakPolarHBondContact O-CB 3.45Å; F599-Y603 PolarHBondContact O-N 2.8Å; G600-Y603 PolarHBondContact O-N 3.26Å; E601-Y603 VanDerWaalsContact C-N 3.33Å; E601-Y603 PolarHBondContact O-N 3.44Å; Y603-N605 VanDerWaalsContact C-N 3.27Å; Y603-N605 PolarHBondContact O-N 3.33Å; Y603-E607 HydrophobicContact CD2-CG 4.25Å; Y603-E607 HydrophobicContact CE2-CB 4.22Å; Y603-E607 HydrophobicContact CE2-CG 3.73Å; Y603-A610 HydrophobicContact CD2-CB 4.39Å; Y603-Y611 HydrophobicContact CE2-CE1 4.05Å; Y603-G643 VanDerWaalsContact CE2-CA 3.44Å
604	S	90.1	Very high	84	Confident	82 Å²	82	31.7 Å²	31.7	57%	0.573	18%	0.179	S	C	*	.	H	α-helix	trans	-65	-31	177.6	61	0	0	0	0	112.9	G600 E601	G600-S604 PolarHBondContact O-N 3.28Å; G600-S604 PolarHBondContact O-OG 3.48Å; E601-S604 WeakPolarHBondContact CA-OG 3.4Å; E601-S604 PolarHBondContact O-OG 3.41Å
605	N	90.6	Very high	84.7	Confident	88 Å²	88	32.6 Å²	32.6	47%	0.471	18%	0.184	S	C	.	.	H	α-helix	trans	-77.4	-50.9	176.8	-173.7	13.2	0	0	0	112.1	E601 Y603 W1075 Q1079	E601-N605 WeakPolarHBondContact O-CB 3.47Å; E601-N605 PolarHBondContact O-N 3.37Å; E601-N605 VanDerWaalsContact O-N 3.15Å; Y603-N605 VanDerWaalsContact C-N 3.27Å; Y603-N605 PolarHBondContact O-N 3.33Å; N605-W1075 HydrophobicContact CB-CZ2 4.45Å; N605-W1075 PolarHBondContact ND2-NE1 3.2Å; N605-Q1079 PolarHBondContact ND2-NE2 3.06Å; N605-Q1079 PolarHBondContact ND2-OE1 2.96Å
606	S	88.1	Confident	85.6	Confident	30 Å²	30	31.1 Å²	31.1	21%	0.21	18%	0.176	C	C	.	.			trans	-152.8	113.5	-179.5	169.8	0	0	0	0	112.6	C602 D608 R609 A610	C602-S606 PolarHBondContact O-N 3.47Å; S606-D608 PolarHBondContact O-N 3.23Å; S606-R609 PolarHBondContact OG-N 2.91Å; S606-A610 WeakPolarHBondContact O-CB 3.34Å; S606-A610 PolarHBondContact O-N 2.79Å; S606-A610 VanDerWaalsContact O-N 3.07Å
607	E	87.5	Confident	86.9	Confident	100 Å²	100	32.1 Å²	32.1	47%	0.467	17%	0.168	S	C	.	.	H	α-helix	trans	-60.1	-47.6	176.4	-59.9	-171.5	-172.3	0	0	113	Y603 R609 A610 Y611	Y603-E607 HydrophobicContact CD2-CG 4.25Å; Y603-E607 HydrophobicContact CE2-CB 4.22Å; Y603-E607 HydrophobicContact CE2-CG 3.73Å; E607-R609 PolarHBondContact O-N 2.91Å; E607-A610 WeakPolarHBondContact O-CB 3.07Å; E607-A610 PolarHBondContact O-N 3.44Å; E607-Y611 HydrophobicContact CB-CE2 3.84Å; E607-Y611 WeakPolarHBondContact O-CD2 3.26Å; E607-Y611 PolarHBondContact O-N 2.73Å; E607-Y611 PolarHBondContact OE2-OH 3.1Å
608	D	83.4	Confident	87.6	Confident	39 Å²	39	31.1 Å²	31.1	21%	0.209	16%	0.162	C	C	.	.	H	α-helix	trans	-64.2	-44.9	-174.1	-68.8	-43.1	0	0	0	112.7	S606 Y611 A612 K650 K706	S606-D608 PolarHBondContact O-N 3.23Å; D608-Y611 PolarHBondContact O-N 2.82Å; D608-A612 PolarHBondContact O-N 3.47Å; D608-K650 IonicContact OD1-NZ 2.8Å; D608-K706 WeakPolarHBondContact OD2-CE 3.18Å; D608-K706 IonicContact OD2-NZ 3.92Å; D608-K706 PolarHBondContact OD2-NZ 3.44Å
609	R	85.4	Confident	87.5	Confident	55 Å²	55	36 Å²	36	21%	0.208	19%	0.185	C	C	.	.	H	α-helix	trans	-64.5	-38.6	173	-70.1	-176.4	175.7	158.2	2.3	112.4	S606 E607 Y611 A612 L613 E705 L709 L1072 W1075	S606-R609 PolarHBondContact OG-N 2.91Å; E607-R609 PolarHBondContact O-N 2.91Å; R609-Y611 VanDerWaalsContact C-N 3.34Å; R609-Y611 PolarHBondContact O-N 2.66Å; R609-A612 PolarHBondContact O-N 3.25Å; R609-L613 PolarHBondContact O-N 3.23Å; R609-E705 IonicContact CZ-OE1 2.92Å; R609-E705 IonicContact CZ-OE2 3.67Å; R609-E705 IonicContact NE-OE1 3.2Å; R609-E705 PolarHBondContact NE-OE1 2.95Å; R609-E705 VanDerWaalsContact NH2-CD 3.32Å; R609-E705 IonicContact NH2-OE1 3.56Å; R609-E705 PolarHBondContact NH2-OE1 3.2Å; R609-E705 IonicContact NH2-OE2 2.69Å; R609-E705 PolarHBondContact NH2-OE2 3.26Å; R609-L709 HydrophobicContact CG-CD1 4.33Å; R609-L1072 HydrophobicContact CB-CD1 3.94Å; R609-L1072 HydrophobicContact CG-CD1 4.3Å; R609-W1075 HydrophobicContact CB-CD2 4.4Å; R609-W1075 HydrophobicContact CB-CE3 4.14Å; R609-W1075 HydrophobicContact CB-CH2 3.68Å; R609-W1075 HydrophobicContact CB-CZ2 4Å; R609-W1075 HydrophobicContact CB-CZ3 3.77Å
610	A	89	Confident	86.9	Confident	0 Å²	0	36.4 Å²	36.4	0%	0	19%	0.188	C	C	.	.	H	α-helix	trans	-65	-37	175.6	0	0	0	0	0	112.2	F599 Y603 S606 E607 L613 L614	F599-A610 HydrophobicContact CE2-CB 4.11Å; F599-A610 HydrophobicContact CZ-CB 4.39Å; Y603-A610 HydrophobicContact CD2-CB 4.39Å; S606-A610 WeakPolarHBondContact O-CB 3.34Å; S606-A610 PolarHBondContact O-N 2.79Å; S606-A610 VanDerWaalsContact O-N 3.07Å; E607-A610 WeakPolarHBondContact O-CB 3.07Å; E607-A610 PolarHBondContact O-N 3.44Å; A610-L613 WeakPolarHBondContact O-CB 3.18Å; A610-L613 PolarHBondContact O-N 2.9Å; A610-L614 PolarHBondContact O-N 2.84Å
611	Y	87.7	Confident	86.7	Confident	23 Å²	23	35.8 Å²	35.8	9%	0.09	18%	0.18	C	C	.	.	H	α-helix	trans	-64.7	-44.5	173.2	-62.1	-29.8	0	0	0	112	Y603 E607 D608 R609 L613 L614 V615 A646 L647 K650	Y603-Y611 HydrophobicContact CE2-CE1 4.05Å; E607-Y611 HydrophobicContact CB-CE2 3.84Å; E607-Y611 WeakPolarHBondContact O-CD2 3.26Å; E607-Y611 PolarHBondContact O-N 2.73Å; E607-Y611 PolarHBondContact OE2-OH 3.1Å; D608-Y611 PolarHBondContact O-N 2.82Å; R609-Y611 VanDerWaalsContact C-N 3.34Å; R609-Y611 PolarHBondContact O-N 2.66Å; Y611-L613 VanDerWaalsContact C-N 3.27Å; Y611-L613 PolarHBondContact O-N 2.65Å; Y611-L614 PolarHBondContact O-N 2.67Å; Y611-V615 PolarHBondContact O-N 3.06Å; Y611-A646 HydrophobicContact CE1-CB 4.41Å; Y611-L647 HydrophobicContact CD1-CB 3.61Å; Y611-L647 HydrophobicContact CD1-CD1 3.85Å; Y611-L647 HydrophobicContact CD1-CD2 4.4Å; Y611-L647 HydrophobicContact CD1-CG 4.14Å; Y611-L647 HydrophobicContact CE1-CB 3.81Å; Y611-L647 HydrophobicContact CG-CB 4.48Å; Y611-L647 HydrophobicContact CG-CD1 3.86Å; Y611-K650 HydrophobicContact CD2-CD 4.43Å; Y611-K650 HydrophobicContact CE2-CD 4.4Å
612	A	85.5	Confident	86.2	Confident	18 Å²	18	35.3 Å²	35.3	15%	0.149	18%	0.182	C	C	.	.	H	α-helix	trans	-61.1	-37.4	175.4	0	0	0	0	0	112	D608 R609 L614 V615 R616 L709 L1072	D608-A612 PolarHBondContact O-N 3.47Å; R609-A612 PolarHBondContact O-N 3.25Å; A612-L614 VanDerWaalsContact C-N 3.27Å; A612-L614 PolarHBondContact O-N 3.43Å; A612-V615 PolarHBondContact O-N 3.29Å; A612-R616 WeakPolarHBondContact O-CB 3.35Å; A612-R616 PolarHBondContact O-N 3.02Å; A612-L709 HydrophobicContact CB-CD2 3.77Å; A612-L1072 HydrophobicContact CB-CD2 4.22Å
613	L	88.3	Confident	85.8	Confident	0 Å²	0	41.2 Å²	41.2	0%	0	21%	0.208	C	C	.	.	H	α-helix	trans	-60.2	-34.6	176.9	-170.5	74.4	0	0	0	112.9	V559 F599 R609 A610 Y611 V626 L1072 E1076	V559-L613 HydrophobicContact CG2-CD2 4.09Å; F599-L613 HydrophobicContact CD2-CD2 4.48Å; R609-L613 PolarHBondContact O-N 3.23Å; A610-L613 WeakPolarHBondContact O-CB 3.18Å; A610-L613 PolarHBondContact O-N 2.9Å; Y611-L613 VanDerWaalsContact C-N 3.27Å; Y611-L613 PolarHBondContact O-N 2.65Å; L613-V626 WeakPolarHBondContact O-CG2 2.99Å; L613-L1072 HydrophobicContact CD1-CD2 4.45Å; L613-L1072 HydrophobicContact CD1-CG 4.37Å; L613-E1076 HydrophobicContact CD1-CB 4.39Å; L613-E1076 HydrophobicContact CD1-CG 4.34Å; L613-E1076 WeakPolarHBondContact CD1-OE2 3.39Å; L613-E1076 HydrophobicContact CD2-CG 4.38Å
614	L	88.6	Confident	85.3	Confident	0 Å²	0	39.3 Å²	39.3	0%	0	20%	0.202	C	C	.	.	H	α-helix	trans	-75.1	-34.7	-178.8	-70.1	177.5	0	0	0	113.4	F599 A610 Y611 A612 V626 L627 F638 V644 L647	F599-L614 HydrophobicContact CD2-CD2 4.18Å; F599-L614 HydrophobicContact CE1-CD1 4.49Å; F599-L614 HydrophobicContact CE2-CD1 3.81Å; F599-L614 HydrophobicContact CE2-CD2 3.7Å; F599-L614 HydrophobicContact CE2-CG 3.65Å; F599-L614 HydrophobicContact CZ-CD1 3.55Å; F599-L614 HydrophobicContact CZ-CD2 4.13Å; F599-L614 HydrophobicContact CZ-CG 3.96Å; A610-L614 PolarHBondContact O-N 2.84Å; Y611-L614 PolarHBondContact O-N 2.67Å; A612-L614 VanDerWaalsContact C-N 3.27Å; A612-L614 PolarHBondContact O-N 3.43Å; L614-V626 HydrophobicContact CD2-CB 4.39Å; L614-V626 HydrophobicContact CD2-CG1 3.91Å; L614-L627 HydrophobicContact CB-CD1 4.35Å; L614-L627 HydrophobicContact CB-CD2 4.46Å; L614-L627 HydrophobicContact CB-CG 4.14Å; L614-L627 HydrophobicContact CD2-CD2 4.47Å; L614-L627 PolarHBondContact O-N 3.21Å; L614-F638 HydrophobicContact CD2-CE1 4.07Å; L614-F638 HydrophobicContact CD2-CZ 3.67Å; L614-V644 HydrophobicContact CD1-CG2 4.14Å; L614-L647 HydrophobicContact CB-CD2 3.78Å; L614-L647 HydrophobicContact CD1-CB 4.47Å; L614-L647 HydrophobicContact CD1-CD2 3.47Å; L614-L647 VanDerWaalsContact CD1-CD2 3.47Å; L614-L647 HydrophobicContact CG-CD2 4.25Å
615	V	85.9	Confident	85.2	Confident	18 Å²	18	35.4 Å²	35.4	11%	0.109	18%	0.175	C	C	.	.	H	α-helix	trans	-97.4	-17	-171	179.2	0	0	0	0	112.2	Y611 A612 T625 L627 L647 L1060 R1062	Y611-V615 PolarHBondContact O-N 3.06Å; A612-V615 PolarHBondContact O-N 3.29Å; V615-T625 WeakPolarHBondContact O-CG2 3.18Å; V615-L627 HydrophobicContact CG2-CD1 4.38Å; V615-L647 HydrophobicContact CG2-CD2 4.03Å; V615-L1060 WeakPolarHBondContact CG1-O 3.25Å; V615-R1062 HydrophobicContact CG1-CB 4.08Å; V615-R1062 PolarHBondContact O-N 2.85Å
616	R	86.8	Confident	85.1	Confident	3 Å²	3	31.2 Å²	31.2	1%	0.011	15%	0.152	C	C	.	.	B	Isolated β-bridge	trans	-64.7	148.3	178.8	78.3	-175.1	-177.3	89.3	0.8	112.3	E557 A612 T625 R1062 L1064 D1069 E1076	E557-R616 IonicContact OE1-CZ 2.83Å; E557-R616 IonicContact OE1-NH1 2.83Å; E557-R616 PolarHBondContact OE1-NH1 3.19Å; E557-R616 IonicContact OE1-NH2 2.71Å; E557-R616 PolarHBondContact OE1-NH2 3.24Å; A612-R616 WeakPolarHBondContact O-CB 3.35Å; A612-R616 PolarHBondContact O-N 3.02Å; R616-T625 WeakPolarHBondContact O-CA 3.42Å; R616-R1062 WeakPolarHBondContact CA-O 3.37Å; R616-L1064 HydrophobicContact CB-CD1 3.66Å; R616-L1064 HydrophobicContact CB-CG 4.41Å; R616-D1069 IonicContact NH1-OD1 3.59Å; R616-D1069 PolarHBondContact NH1-OD1 2.73Å; R616-E1076 IonicContact NH2-OE2 2.64Å; R616-E1076 PolarHBondContact NH2-OE2 3.23Å
617	R	85	Confident	85.1	Confident	81 Å²	81	29.9 Å²	29.9	31%	0.306	14%	0.143	S	C	.	.	B	Isolated β-bridge	trans	-79.8	123.1	165.5	-70.5	-172.7	166.1	168.2	1.2	110.7	K623 T625 E1061 R1062 E1063	R617-K623 HydrophobicContact CB-CB 4.31Å; R617-K623 WeakPolarHBondContact CB-O 3.38Å; R617-K623 VanDerWaalsContact CG-O 3.27Å; R617-K623 WeakPolarHBondContact CG-O 3.42Å; R617-T625 HydrophobicContact CG-CG2 4.4Å; R617-E1061 HydrophobicContact CG-CB 4.43Å; R617-E1061 IonicContact CZ-OE2 3.57Å; R617-E1061 IonicContact NE-OE2 2.68Å; R617-E1061 PolarHBondContact NE-OE2 2.96Å; R617-E1061 IonicContact NH2-OE2 2.87Å; R617-E1061 PolarHBondContact NH2-OE2 3.41Å; R617-R1062 PolarHBondContact N-O 3.11Å; R617-R1062 VanDerWaalsContact N-O 3.15Å; R617-E1063 HydrophobicContact CG-CG 4.41Å; R617-E1063 IonicContact NH1-OE1 2.83Å; R617-E1063 PolarHBondContact NH1-OE1 3.38Å
618	T	84.1	Confident	85	Confident	1 Å²	1	27.3 Å²	27.3	1%	0.006	13%	0.132	C	C	.	.	P	Polyproline II helix	trans	-75.1	143.2	-179.1	54.3	0	0	0	0	112.2	E557 A560 W621 K623 S624 V626	E557-T618 WeakPolarHBondContact OE2-CB 3.23Å; A560-T618 HydrophobicContact CB-CG2 4.05Å; T618-W621 WeakPolarHBondContact OG1-CB 3.43Å; T618-K623 WeakPolarHBondContact O-CA 3.3Å; T618-K623 PolarHBondContact O-N 3.31Å; T618-S624 WeakPolarHBondContact CB-O 3.37Å; T618-S624 WeakPolarHBondContact CG2-O 3.36Å; T618-S624 PolarHBondContact N-O 2.91Å; T618-S624 PolarHBondContact OG1-O 3.35Å; T618-V626 HydrophobicContact CG2-CG2 4.35Å
619	Q	80.8	Confident	85.2	Confident	103 Å²	103	25.6 Å²	25.6	48%	0.481	12%	0.123	S	C	.	.	T	Hydrogen-bonded Turn	trans	-84	-37.5	177.8	-62.4	-165.4	14.4	0	0	111.6	E557 W621 D1069	E557-Q619 PolarHBondContact OE1-N 3.26Å; Q619-W621 VanDerWaalsContact C-N 3.34Å; Q619-W621 PolarHBondContact O-N 3.36Å; Q619-D1069 PolarHBondContact NE2-OD2 2.79Å
620	C	80.1	Confident	85.4	Confident	8 Å²	8	23 Å²	23	5%	0.054	11%	0.113	C	C	.	.	T	Hydrogen-bonded Turn	trans	-79.3	-16.6	-176.7	-59.7	0	0	0	0	113.3	F500 H530 R533 E557	F500-C620 WeakPolarHBondContact CZ-O 3.07Å; H530-C620 VanDerWaalsContact CE1-SG 3.59Å; R533-C620 VanDerWaalsContact CD-O 3.26Å; R533-C620 WeakPolarHBondContact CD-O 3.31Å; R533-C620 PolarHBondContact NH1-O 3.37Å; E557-C620 VanDerWaalsContact OE2-CB 3.25Å; E557-C620 WeakPolarHBondContact OE2-CB 3.42Å; E557-C620 PolarHBondContact OE2-N 3.43Å
621	W	84.8	Confident	85.3	Confident	3 Å²	3	25.1 Å²	25.1	1%	0.011	13%	0.127	C	C	.	.	T	Hydrogen-bonded Turn	trans	-121.8	51.2	-174.4	-57.6	92.2	0	0	0	113.3	L493 F500 R533 L537 A560 A561 A564 T618 Q619 K623 S624 L629	L493-W621 HydrophobicContact CD1-CZ3 4.16Å; F500-W621 HydrophobicContact CE2-CE3 4.18Å; F500-W621 HydrophobicContact CE2-CZ3 4.23Å; F500-W621 AromaticContact CZ-CE3 3.91Å; F500-W621 HydrophobicContact CZ-CE3 3.91Å; F500-W621 HydrophobicContact CZ-CZ3 4.4Å; R533-W621 HydrophobicContact CG-CH2 4.04Å; R533-W621 HydrophobicContact CG-CZ2 3.83Å; L537-W621 HydrophobicContact CD1-CH2 4.45Å; L537-W621 HydrophobicContact CD1-CZ3 4.46Å; L537-W621 HydrophobicContact CD2-CH2 3.81Å; L537-W621 HydrophobicContact CD2-CZ3 3.98Å; L537-W621 HydrophobicContact CG-CH2 4.2Å; A560-W621 HydrophobicContact CB-CG 4.39Å; A561-W621 HydrophobicContact CB-CZ2 3.84Å; A564-W621 HydrophobicContact CB-CD2 4.3Å; A564-W621 HydrophobicContact CB-CE3 3.79Å; A564-W621 HydrophobicContact CB-CH2 3.41Å; A564-W621 VanDerWaalsContact CB-CH2 3.41Å; A564-W621 HydrophobicContact CB-CZ2 3.96Å; A564-W621 HydrophobicContact CB-CZ3 3.31Å; T618-W621 WeakPolarHBondContact OG1-CB 3.43Å; Q619-W621 VanDerWaalsContact C-N 3.34Å; Q619-W621 PolarHBondContact O-N 3.36Å; W621-K623 VanDerWaalsContact C-N 3.32Å; W621-K623 PolarHBondContact O-N 2.97Å; W621-S624 WeakPolarHBondContact O-CB 3.35Å; W621-S624 PolarHBondContact O-N 3.49Å; W621-S624 VanDerWaalsContact O-N 3.09Å; W621-S624 PolarHBondContact O-OG 2.87Å; W621-L629 HydrophobicContact CB-CD1 4.25Å; W621-L629 HydrophobicContact CG-CD1 4.49Å
622	S	78.1	Confident	85.1	Confident	38 Å²	38	26.7 Å²	26.7	27%	0.266	13%	0.134	S	C	.	.	T	Hydrogen-bonded Turn	trans	57.4	36	170	-176.4	0	0	0	0	114.6	S496 K498 S624	S496-S622 VanDerWaalsContact O-CB 3.26Å; S496-S622 WeakPolarHBondContact O-CB 3.36Å; K498-S622 PolarHBondContact N-OG 3.43Å; K498-S622 WeakPolarHBondContact O-CB 3.28Å; K498-S622 PolarHBondContact O-OG 3.36Å; S622-S624 PolarHBondContact O-N 3.42Å
623	K	80.1	Confident	85.1	Confident	123 Å²	123	25.9 Å²	25.9	54%	0.535	13%	0.128	S	C	.	.	T	Hydrogen-bonded Turn	trans	62.8	19.2	-178.1	-58.9	-171.3	165.2	-152.4	0	115	R617 T618 W621 E1063	R617-K623 HydrophobicContact CB-CB 4.31Å; R617-K623 WeakPolarHBondContact CB-O 3.38Å; R617-K623 VanDerWaalsContact CG-O 3.27Å; R617-K623 WeakPolarHBondContact CG-O 3.42Å; T618-K623 WeakPolarHBondContact O-CA 3.3Å; T618-K623 PolarHBondContact O-N 3.31Å; W621-K623 VanDerWaalsContact C-N 3.32Å; W621-K623 PolarHBondContact O-N 2.97Å; K623-E1063 IonicContact NZ-OE1 3.65Å; K623-E1063 PolarHBondContact NZ-OE1 3.44Å
624	S	82	Confident	85	Confident	12 Å²	12	29 Å²	29	8%	0.084	15%	0.145	C	C	.	.			trans	-76.8	148.8	175.4	-46.3	0	0	0	0	110.6	S496 T618 W621 S622	S496-S624 VanDerWaalsContact CA-OG 3.24Å; S496-S624 WeakPolarHBondContact CA-OG 3.33Å; S496-S624 WeakPolarHBondContact CB-OG 3.38Å; T618-S624 WeakPolarHBondContact CB-O 3.37Å; T618-S624 WeakPolarHBondContact CG2-O 3.36Å; T618-S624 PolarHBondContact N-O 2.91Å; T618-S624 PolarHBondContact OG1-O 3.35Å; W621-S624 WeakPolarHBondContact O-CB 3.35Å; W621-S624 PolarHBondContact O-N 3.49Å; W621-S624 VanDerWaalsContact O-N 3.09Å; W621-S624 PolarHBondContact O-OG 2.87Å; S622-S624 PolarHBondContact O-N 3.42Å
625	T	87.3	Confident	85	Confident	0 Å²	0	29 Å²	29	0%	0	15%	0.145	C	C	.	.	B	Isolated β-bridge	trans	-82	156.6	170.8	65.7	0	0	0	0	111	V615 R616 R617 L627 N628 L629 E1061	V615-T625 WeakPolarHBondContact O-CG2 3.18Å; R616-T625 WeakPolarHBondContact O-CA 3.42Å; R617-T625 HydrophobicContact CG-CG2 4.4Å; T625-L627 PolarHBondContact O-N 3.08Å; T625-N628 PolarHBondContact O-N 2.94Å; T625-N628 WeakPolarHBondContact OG1-CB 3Å; T625-N628 PolarHBondContact OG1-N 3.2Å; T625-N628 VanDerWaalsContact OG1-N 3.12Å; T625-N628 PolarHBondContact OG1-ND2 3.49Å; T625-N628 PolarHBondContact OG1-OD1 3.42Å; T625-L629 PolarHBondContact O-N 3.33Å; T625-E1061 HydrophobicContact CG2-CB 3.96Å; T625-E1061 HydrophobicContact CG2-CG 3.7Å
626	V	89.1	Confident	85.1	Confident	1 Å²	1	30.7 Å²	30.7	1%	0.006	15%	0.15	C	C	.	.	H	α-helix	trans	-62.9	-35.5	175.6	176.9	0	0	0	0	110.7	V559 A560 L563 L613 L614 T618 L629 A630 F638	V559-V626 HydrophobicContact CG1-CG1 3.69Å; A560-V626 HydrophobicContact CB-CG2 4.47Å; L563-V626 HydrophobicContact CD1-CG1 3.61Å; L613-V626 WeakPolarHBondContact O-CG2 2.99Å; L614-V626 HydrophobicContact CD2-CB 4.39Å; L614-V626 HydrophobicContact CD2-CG1 3.91Å; T618-V626 HydrophobicContact CG2-CG2 4.35Å; V626-L629 PolarHBondContact O-N 3.48Å; V626-A630 WeakPolarHBondContact O-CB 3.39Å; V626-A630 PolarHBondContact O-N 3.05Å; V626-F638 HydrophobicContact CG1-CE1 4.44Å; V626-F638 HydrophobicContact CG1-CZ 4.05Å
627	L	88.1	Confident	85.1	Confident	1 Å²	1	32.8 Å²	32.8	1%	0.005	17%	0.166	C	C	.	.	H	α-helix	trans	-63.8	-44.4	175.1	-69.7	172.3	0	0	0	112.1	L614 V615 T625 A630 T631 F639 V644 Y1020	L614-L627 HydrophobicContact CB-CD1 4.35Å; L614-L627 HydrophobicContact CB-CD2 4.46Å; L614-L627 HydrophobicContact CB-CG 4.14Å; L614-L627 HydrophobicContact CD2-CD2 4.47Å; L614-L627 PolarHBondContact O-N 3.21Å; V615-L627 HydrophobicContact CG2-CD1 4.38Å; T625-L627 PolarHBondContact O-N 3.08Å; L627-A630 PolarHBondContact O-N 3.14Å; L627-T631 PolarHBondContact O-N 3.32Å; L627-T631 PolarHBondContact O-OG1 3.27Å; L627-F639 HydrophobicContact CD2-CE1 4.02Å; L627-V644 HydrophobicContact CD2-CG1 4.34Å; L627-Y1020 HydrophobicContact CD2-CE2 4.4Å
628	N	85.7	Confident	85.4	Confident	46 Å²	46	29 Å²	29	25%	0.246	15%	0.151	C	C	.	.	H	α-helix	trans	-62.8	-46.2	176.9	-69.8	-3.9	0	0	0	111	T625 A630 T631 E632 E1061	T625-N628 PolarHBondContact O-N 2.94Å; T625-N628 WeakPolarHBondContact OG1-CB 3Å; T625-N628 PolarHBondContact OG1-N 3.2Å; T625-N628 VanDerWaalsContact OG1-N 3.12Å; T625-N628 PolarHBondContact OG1-ND2 3.49Å; T625-N628 PolarHBondContact OG1-OD1 3.42Å; N628-A630 VanDerWaalsContact C-N 3.3Å; N628-A630 PolarHBondContact O-N 3.5Å; N628-T631 PolarHBondContact O-N 2.96Å; N628-E632 WeakPolarHBondContact O-CG 3.4Å; N628-E632 PolarHBondContact O-N 3.38Å; N628-E1061 PolarHBondContact ND2-OE1 3.26Å
629	L	87.8	Confident	85.7	Confident	3 Å²	3	28.9 Å²	28.9	2%	0.016	15%	0.151	C	C	.	.	H	α-helix	trans	-59	-40.7	175.4	-75.5	172.3	0	0	0	112.1	A560 L563 W621 T625 V626 E632 A633	A560-L629 HydrophobicContact CB-CD1 3.95Å; L563-L629 HydrophobicContact CB-CB 4.38Å; W621-L629 HydrophobicContact CB-CD1 4.25Å; W621-L629 HydrophobicContact CG-CD1 4.49Å; T625-L629 PolarHBondContact O-N 3.33Å; V626-L629 PolarHBondContact O-N 3.48Å; L629-E632 PolarHBondContact O-N 2.92Å; L629-A633 WeakPolarHBondContact O-CB 3.3Å; L629-A633 PolarHBondContact O-N 3.26Å
630	A	89.4	Confident	86.1	Confident	0 Å²	0	24.6 Å²	24.6	0%	0	13%	0.133	C	C	.	.	H	α-helix	trans	-66	-39	177	0	0	0	0	0	112.3	L563 V626 L627 N628 A633 D634 A635 F638 F639	L563-A630 HydrophobicContact CD1-CB 3.92Å; L563-A630 HydrophobicContact CD2-CB 4.16Å; V626-A630 WeakPolarHBondContact O-CB 3.39Å; V626-A630 PolarHBondContact O-N 3.05Å; L627-A630 PolarHBondContact O-N 3.14Å; N628-A630 VanDerWaalsContact C-N 3.3Å; N628-A630 PolarHBondContact O-N 3.5Å; A630-A633 PolarHBondContact O-N 3.38Å; A630-D634 PolarHBondContact O-N 2.89Å; A630-A635 HydrophobicContact CB-CB 4.44Å; A630-A635 PolarHBondContact O-N 3.31Å; A630-A635 VanDerWaalsContact O-N 3.09Å; A630-F638 HydrophobicContact CB-CD1 3.56Å; A630-F638 HydrophobicContact CB-CE1 3.83Å; A630-F638 HydrophobicContact CB-CG 4.48Å; A630-F639 HydrophobicContact CB-CD2 4.49Å; A630-F639 HydrophobicContact CB-CE2 3.58Å; A630-F639 HydrophobicContact CB-CZ 3.62Å
631	T	86.5	Confident	86.6	Confident	46 Å²	46	26 Å²	26	28%	0.282	14%	0.139	S	C	.	.	H	α-helix	trans	-65.9	-45.6	175.8	-55.5	0	0	0	0	111	L627 N628 A633 D634 F639 Y1020	L627-T631 PolarHBondContact O-N 3.32Å; L627-T631 PolarHBondContact O-OG1 3.27Å; N628-T631 PolarHBondContact O-N 2.96Å; T631-A633 VanDerWaalsContact C-N 3.3Å; T631-A633 PolarHBondContact O-N 3.49Å; T631-D634 PolarHBondContact O-N 2.95Å; T631-D634 VanDerWaalsContact O-N 3.08Å; T631-F639 WeakPolarHBondContact OG1-CZ 3.49Å; T631-Y1020 HydrophobicContact CG2-CE1 4.31Å; T631-Y1020 WeakPolarHBondContact OG1-CE1 3.22Å; T631-Y1020 PolarHBondContact OG1-OH 2.95Å
632	E	84.2	Confident	86.8	Confident	55 Å²	55	31.3 Å²	31.3	26%	0.257	17%	0.167	S	C	.	.	H	α-helix	trans	-62.6	-37	176	-71.8	-174.7	167.6	0	0	112.4	S496 K567 N628 L629 D634	S496-E632 WeakPolarHBondContact CB-OE2 3.46Å; S496-E632 PolarHBondContact OG-OE1 3.44Å; S496-E632 PolarHBondContact OG-OE2 3.2Å; K567-E632 VanDerWaalsContact CD-O 3.25Å; K567-E632 WeakPolarHBondContact CD-O 3.5Å; K567-E632 WeakPolarHBondContact CE-O 3.41Å; K567-E632 PolarHBondContact NZ-O 3.43Å; N628-E632 WeakPolarHBondContact O-CG 3.4Å; N628-E632 PolarHBondContact O-N 3.38Å; L629-E632 PolarHBondContact O-N 2.92Å; E632-D634 PolarHBondContact O-N 3.48Å
633	A	85.4	Confident	87.3	Confident	1 Å²	1	29.5 Å²	29.5	1%	0.008	16%	0.155	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.8	-9.9	175	0	0	0	0	0	114.5	K567 K570 L629 A630 T631 A635	K567-A633 HydrophobicContact CB-CB 3.93Å; K570-A633 WeakPolarHBondContact CD-O 3.49Å; K570-A633 PolarHBondContact NZ-O 3.47Å; K570-A633 VanDerWaalsContact NZ-O 3.09Å; L629-A633 WeakPolarHBondContact O-CB 3.3Å; L629-A633 PolarHBondContact O-N 3.26Å; A630-A633 PolarHBondContact O-N 3.38Å; T631-A633 VanDerWaalsContact C-N 3.3Å; T631-A633 PolarHBondContact O-N 3.49Å; A633-A635 HydrophobicContact CB-CB 4.13Å; A633-A635 PolarHBondContact O-N 3.45Å
634	D	85.8	Confident	87.9	Confident	67 Å²	67	23.6 Å²	23.6	36%	0.358	13%	0.129	S	C	.	.	T	Hydrogen-bonded Turn	trans	46.3	45.7	-169.1	-173.8	26.7	0	0	0	110.3	K570 A630 T631 E632 K636	K570-D634 PolarHBondContact NZ-O 3.16Å; K570-D634 VanDerWaalsContact NZ-O 3.12Å; A630-D634 PolarHBondContact O-N 2.89Å; T631-D634 PolarHBondContact O-N 2.95Å; T631-D634 VanDerWaalsContact O-N 3.08Å; E632-D634 PolarHBondContact O-N 3.48Å; D634-K636 PolarHBondContact O-N 2.97Å; D634-K636 VanDerWaalsContact OD1-CE 3.22Å; D634-K636 WeakPolarHBondContact OD1-CE 3.48Å; D634-K636 WeakPolarHBondContact OD1-CG 3.47Å; D634-K636 IonicContact OD1-NZ 3.67Å; D634-K636 PolarHBondContact OD1-NZ 3.47Å; D634-K636 IonicContact OD2-NZ 2.79Å; D634-K636 PolarHBondContact OD2-NZ 3.13Å
635	A	88.1	Confident	88.3	Confident	0 Å²	0	23.6 Å²	23.6	0%	0	13%	0.128	C	C	.	.			trans	-81.2	68.4	-176.1	0	0	0	0	0	110.3	L563 A630 A633 S637 F638 F639	L563-A635 HydrophobicContact CD2-CB 3.89Å; A630-A635 HydrophobicContact CB-CB 4.44Å; A630-A635 PolarHBondContact O-N 3.31Å; A630-A635 VanDerWaalsContact O-N 3.09Å; A633-A635 HydrophobicContact CB-CB 4.13Å; A633-A635 PolarHBondContact O-N 3.45Å; A635-S637 VanDerWaalsContact C-N 3.27Å; A635-S637 PolarHBondContact O-N 2.91Å; A635-F638 HydrophobicContact CB-CB 3.83Å; A635-F638 VanDerWaalsContact O-CB 3.3Å; A635-F638 WeakPolarHBondContact O-CB 3.29Å; A635-F638 PolarHBondContact O-N 3.28Å; A635-F639 WeakPolarHBondContact O-CD2 3.28Å; A635-F639 PolarHBondContact O-N 2.95Å
636	K	88.3	Confident	88.4	Confident	52 Å²	52	25 Å²	25	23%	0.226	14%	0.139	C	C	.	.	H	α-helix	trans	-58.8	-38	-172.8	-61.6	-172.8	173	83	0	113.2	D634 F638 F639 A640 I1013 F1014 F1017	D634-K636 PolarHBondContact O-N 2.97Å; D634-K636 VanDerWaalsContact OD1-CE 3.22Å; D634-K636 WeakPolarHBondContact OD1-CE 3.48Å; D634-K636 WeakPolarHBondContact OD1-CG 3.47Å; D634-K636 IonicContact OD1-NZ 3.67Å; D634-K636 PolarHBondContact OD1-NZ 3.47Å; D634-K636 IonicContact OD2-NZ 2.79Å; D634-K636 PolarHBondContact OD2-NZ 3.13Å; K636-F638 VanDerWaalsContact C-N 3.32Å; K636-F639 PolarHBondContact O-N 3.13Å; K636-A640 PolarHBondContact O-N 2.79Å; K636-I1013 HydrophobicContact CB-CG2 3.85Å; K636-I1013 WeakPolarHBondContact O-CG2 3.4Å; K636-F1014 HydrophobicContact CD-CD1 3.45Å; K636-F1014 VanDerWaalsContact CD-CD1 3.45Å; K636-F1014 HydrophobicContact CD-CE1 3.24Å; K636-F1014 HydrophobicContact CD-CZ 4.27Å; K636-F1017 HydrophobicContact CG-CD1 4.41Å; K636-F1017 HydrophobicContact CG-CG 4.28Å
637	S	87.3	Confident	88.4	Confident	48 Å²	48	25.3 Å²	25.3	34%	0.336	14%	0.141	S	C	.	.	H	α-helix	trans	-63.8	-44.5	178.2	-40.6	0	0	0	0	109.3	E591 L595 A635 F639 A640 H641	E591-S637 WeakPolarHBondContact OE1-CB 3.24Å; E591-S637 PolarHBondContact OE1-N 3.23Å; E591-S637 PolarHBondContact OE1-OG 3.39Å; L595-S637 WeakPolarHBondContact CD1-O 3.41Å; A635-S637 VanDerWaalsContact C-N 3.27Å; A635-S637 PolarHBondContact O-N 2.91Å; S637-F639 VanDerWaalsContact C-N 3.33Å; S637-F639 PolarHBondContact O-N 2.87Å; S637-A640 WeakPolarHBondContact O-CA 3.43Å; S637-A640 WeakPolarHBondContact O-CB 3.34Å; S637-A640 PolarHBondContact O-N 2.89Å; S637-H641 PolarHBondContact O-N 3.23Å
638	F	90.8	Very high	88.5	Confident	0 Å²	0	25.3 Å²	25.3	0%	0	14%	0.141	C	C	.	.	H	α-helix	trans	-53.4	-48.1	179.8	-176.7	-99.7	0	0	0	111.8	V559 L563 A594 L595 F599 L614 V626 A630 A635 K636 A640 H641 V644	V559-F638 HydrophobicContact CG1-CE2 4.12Å; V559-F638 HydrophobicContact CG1-CZ 4.26Å; L563-F638 HydrophobicContact CD1-CE1 4.47Å; L563-F638 HydrophobicContact CD1-CZ 4.4Å; L563-F638 HydrophobicContact CD2-CD2 4.41Å; L563-F638 HydrophobicContact CD2-CG 4.28Å; A594-F638 HydrophobicContact CB-CD2 4.37Å; L595-F638 HydrophobicContact CB-CD2 4.35Å; L595-F638 HydrophobicContact CD1-CB 4.46Å; F599-F638 HydrophobicContact CB-CE2 4.21Å; F599-F638 HydrophobicContact CD1-CE2 4.48Å; F599-F638 HydrophobicContact CG-CE2 4.24Å; L614-F638 HydrophobicContact CD2-CE1 4.07Å; L614-F638 HydrophobicContact CD2-CZ 3.67Å; V626-F638 HydrophobicContact CG1-CE1 4.44Å; V626-F638 HydrophobicContact CG1-CZ 4.05Å; A630-F638 HydrophobicContact CB-CD1 3.56Å; A630-F638 HydrophobicContact CB-CE1 3.83Å; A630-F638 HydrophobicContact CB-CG 4.48Å; A635-F638 HydrophobicContact CB-CB 3.83Å; A635-F638 VanDerWaalsContact O-CB 3.3Å; A635-F638 WeakPolarHBondContact O-CB 3.29Å; A635-F638 PolarHBondContact O-N 3.28Å; K636-F638 VanDerWaalsContact C-N 3.32Å; F638-A640 PolarHBondContact O-N 3.03Å; F638-H641 VanDerWaalsContact O-CB 3.26Å; F638-H641 WeakPolarHBondContact O-CB 3.36Å; F638-H641 PolarHBondContact O-N 3.17Å; F638-V644 HydrophobicContact CD1-CG2 4.45Å; F638-V644 HydrophobicContact CE1-CG2 4.11Å; F638-V644 HydrophobicContact CZ-CG2 4.26Å
639	F	89.8	Confident	88.6	Confident	0 Å²	0	25 Å²	25	0%	0	14%	0.14	C	C	.	.	H	α-helix	trans	-66.9	-24.4	175.9	-73.4	-77.6	0	0	0	113.8	L627 A630 T631 A635 K636 S637 H641 V644 Q645 F1017 Y1020	L627-F639 HydrophobicContact CD2-CE1 4.02Å; A630-F639 HydrophobicContact CB-CD2 4.49Å; A630-F639 HydrophobicContact CB-CE2 3.58Å; A630-F639 HydrophobicContact CB-CZ 3.62Å; T631-F639 WeakPolarHBondContact OG1-CZ 3.49Å; A635-F639 WeakPolarHBondContact O-CD2 3.28Å; A635-F639 PolarHBondContact O-N 2.95Å; K636-F639 PolarHBondContact O-N 3.13Å; S637-F639 VanDerWaalsContact C-N 3.33Å; S637-F639 PolarHBondContact O-N 2.87Å; F639-H641 VanDerWaalsContact C-N 3.26Å; F639-H641 PolarHBondContact O-N 3.12Å; F639-V644 HydrophobicContact CD1-CG1 4.09Å; F639-Q645 WeakPolarHBondContact O-CG 3.24Å; F639-Q645 PolarHBondContact O-NE2 3.46Å; F639-F1017 HydrophobicContact CB-CB 4.47Å; F639-F1017 HydrophobicContact CB-CD2 4.09Å; F639-F1017 AromaticContact CD2-CD2 3.35Å; F639-F1017 HydrophobicContact CD2-CD2 3.35Å; F639-F1017 AromaticContact CD2-CE2 3.61Å; F639-F1017 HydrophobicContact CD2-CE2 3.61Å; F639-F1017 AromaticContact CE2-CD2 3.91Å; F639-F1017 HydrophobicContact CE2-CD2 3.91Å; F639-F1017 AromaticContact CE2-CE2 3.66Å; F639-F1017 HydrophobicContact CE2-CE2 3.66Å; F639-F1017 AromaticContact CG-CD2 3.81Å; F639-F1017 HydrophobicContact CG-CD2 3.81Å; F639-F1017 HydrophobicContact CG-CE2 4.4Å; F639-Y1020 HydrophobicContact CD1-CD1 4.2Å; F639-Y1020 HydrophobicContact CD1-CD2 4.09Å; F639-Y1020 AromaticContact CD1-CG 3.81Å; F639-Y1020 HydrophobicContact CD1-CG 3.81Å; F639-Y1020 AromaticContact CE1-CD1 3.68Å; F639-Y1020 HydrophobicContact CE1-CD1 3.68Å; F639-Y1020 AromaticContact CE1-CD2 3.69Å; F639-Y1020 HydrophobicContact CE1-CD2 3.69Å; F639-Y1020 AromaticContact CE1-CE1 3.87Å; F639-Y1020 HydrophobicContact CE1-CE1 3.87Å; F639-Y1020 AromaticContact CE1-CE2 3.85Å; F639-Y1020 HydrophobicContact CE1-CE2 3.85Å; F639-Y1020 AromaticContact CE1-CG 3.59Å; F639-Y1020 HydrophobicContact CE1-CG 3.59Å; F639-Y1020 AromaticContact CE1-CZ 3.92Å; F639-Y1020 HydrophobicContact CZ-CD1 4.03Å; F639-Y1020 AromaticContact CZ-CE1 3.98Å; F639-Y1020 HydrophobicContact CZ-CE1 3.98Å; F639-Y1020 HydrophobicContact CZ-CG 4.39Å
640	A	89.2	Confident	88.6	Confident	13 Å²	13	28.6 Å²	28.6	11%	0.107	16%	0.156	C	C	.	.	H	α-helix	trans	-77.4	-12	178.2	0	0	0	0	0	113.9	K636 S637 F638 I1013 K1016	K636-A640 PolarHBondContact O-N 2.79Å; S637-A640 WeakPolarHBondContact O-CA 3.43Å; S637-A640 WeakPolarHBondContact O-CB 3.34Å; S637-A640 PolarHBondContact O-N 2.89Å; F638-A640 PolarHBondContact O-N 3.03Å; A640-I1013 HydrophobicContact CB-CB 4.13Å; A640-I1013 HydrophobicContact CB-CG1 3.95Å; A640-I1013 HydrophobicContact CB-CG2 3.95Å; A640-K1016 HydrophobicContact CB-CB 4.32Å; A640-K1016 HydrophobicContact CB-CD 3.88Å; A640-K1016 PolarHBondContact O-NZ 3.15Å
641	H	90.9	Very high	88.4	Confident	37 Å²	37	30.1 Å²	30.1	17%	0.171	16%	0.164	C	C	.	.	S	Bend	trans	-61.6	138	177.1	-174.9	-94.9	0	0	0	111.7	L595 F599 S637 F638 F639 G643 V644 Q645	L595-H641 HydrophobicContact CD1-CB 4.29Å; L595-H641 HydrophobicContact CG-CB 4.38Å; F599-H641 AromaticContact CD1-CE1 3.75Å; F599-H641 AromaticContact CD1-ND1 3.54Å; F599-H641 AromaticContact CE1-CE1 3.83Å; F599-H641 AromaticContact CE1-ND1 3.45Å; F599-H641 WeakPolarHBondContact CE1-ND1 3.46Å; S637-H641 PolarHBondContact O-N 3.23Å; F638-H641 VanDerWaalsContact O-CB 3.26Å; F638-H641 WeakPolarHBondContact O-CB 3.36Å; F638-H641 PolarHBondContact O-N 3.17Å; F639-H641 VanDerWaalsContact C-N 3.26Å; F639-H641 PolarHBondContact O-N 3.12Å; H641-G643 VanDerWaalsContact C-N 3.32Å; H641-G643 PolarHBondContact ND1-N 2.95Å; H641-G643 VanDerWaalsContact ND1-N 3.12Å; H641-G643 PolarHBondContact O-N 3.4Å; H641-V644 HydrophobicContact CB-CG2 4.29Å; H641-V644 PolarHBondContact O-N 3.35Å; H641-V644 VanDerWaalsContact O-N 3.12Å; H641-Q645 PolarHBondContact O-N 3.4Å
642	D	89.2	Confident	88.4	Confident	114 Å²	114	29.1 Å²	29.1	61%	0.61	16%	0.155	S	C	*	.	H	α-helix	trans	-62.3	-37.5	-172.5	-68.4	-30	0	0	0	112.5	V644 Q645 A646	D642-V644 PolarHBondContact O-N 3.06Å; D642-Q645 CarbonylContact O-C 3.53Å; D642-Q645 PolarHBondContact O-N 3.28Å; D642-A646 WeakPolarHBondContact O-CB 3.36Å; D642-A646 PolarHBondContact O-N 2.9Å
643	G	89.6	Confident	88.5	Confident	0 Å²	0	27.6 Å²	27.6	0%	0	15%	0.147	C	C	.	.	H	α-helix	trans	-64.7	-35.7	176.3	0	0	0	0	0	114	Y603 H641 A646 L647	Y603-G643 VanDerWaalsContact CE2-CA 3.44Å; H641-G643 VanDerWaalsContact C-N 3.32Å; H641-G643 PolarHBondContact ND1-N 2.95Å; H641-G643 VanDerWaalsContact ND1-N 3.12Å; H641-G643 PolarHBondContact O-N 3.4Å; G643-A646 PolarHBondContact O-N 3.47Å; G643-L647 PolarHBondContact O-N 3.02Å; G643-L647 VanDerWaalsContact O-N 3.12Å
644	V	90.8	Very high	88.4	Confident	0 Å²	0	29.1 Å²	29.1	0%	0	16%	0.162	C	C	.	.	H	α-helix	trans	-70.4	-42.8	174.2	-177.9	0	0	0	0	109.2	F599 L614 L627 F638 F639 H641 D642 A646 L647 L648	F599-V644 HydrophobicContact CD1-CG2 4.26Å; F599-V644 HydrophobicContact CE1-CG2 3.66Å; F599-V644 HydrophobicContact CZ-CG2 4.16Å; L614-V644 HydrophobicContact CD1-CG2 4.14Å; L627-V644 HydrophobicContact CD2-CG1 4.34Å; F638-V644 HydrophobicContact CD1-CG2 4.45Å; F638-V644 HydrophobicContact CE1-CG2 4.11Å; F638-V644 HydrophobicContact CZ-CG2 4.26Å; F639-V644 HydrophobicContact CD1-CG1 4.09Å; H641-V644 HydrophobicContact CB-CG2 4.29Å; H641-V644 PolarHBondContact O-N 3.35Å; H641-V644 VanDerWaalsContact O-N 3.12Å; D642-V644 PolarHBondContact O-N 3.06Å; V644-A646 VanDerWaalsContact C-N 3.31Å; V644-A646 PolarHBondContact O-N 3.43Å; V644-L647 WeakPolarHBondContact O-CB 3.28Å; V644-L647 PolarHBondContact O-N 3.4Å; V644-L648 HydrophobicContact CG1-CD1 4.27Å; V644-L648 HydrophobicContact CG1-CG 4.49Å; V644-L648 VanDerWaalsContact O-CG 3.3Å; V644-L648 WeakPolarHBondContact O-CG 3.44Å; V644-L648 PolarHBondContact O-N 3.25Å
645	Q	91.4	Very high	88	Confident	12 Å²	12	27.6 Å²	27.6	6%	0.056	16%	0.159	C	C	.	.	H	α-helix	trans	-65.7	-31.3	176.9	-68.6	-65.3	-51.3	0	0	113.2	F639 H641 D642 L648 T649 K1016	F639-Q645 WeakPolarHBondContact O-CG 3.24Å; F639-Q645 PolarHBondContact O-NE2 3.46Å; H641-Q645 PolarHBondContact O-N 3.4Å; D642-Q645 CarbonylContact O-C 3.53Å; D642-Q645 PolarHBondContact O-N 3.28Å; Q645-L648 PolarHBondContact O-N 3.37Å; Q645-T649 WeakPolarHBondContact O-CB 3.3Å; Q645-T649 PolarHBondContact O-N 3.44Å; Q645-T649 PolarHBondContact O-OG1 2.98Å; Q645-K1016 HydrophobicContact CG-CD 4.03Å; Q645-K1016 HydrophobicContact CG-CG 4.25Å; Q645-K1016 PolarHBondContact NE2-O 2.92Å
646	A	90.1	Very high	87.8	Confident	28 Å²	28	27.8 Å²	27.8	23%	0.231	16%	0.16	C	C	.	.	H	α-helix	trans	-66.3	-46.7	173	0	0	0	0	0	110.7	Y611 D642 G643 V644 L648 T649 K650	Y611-A646 HydrophobicContact CE1-CB 4.41Å; D642-A646 WeakPolarHBondContact O-CB 3.36Å; D642-A646 PolarHBondContact O-N 2.9Å; G643-A646 PolarHBondContact O-N 3.47Å; V644-A646 VanDerWaalsContact C-N 3.31Å; V644-A646 PolarHBondContact O-N 3.43Å; A646-L648 PolarHBondContact O-N 2.9Å; A646-T649 WeakPolarHBondContact O-CB 3.48Å; A646-T649 PolarHBondContact O-N 3.22Å; A646-T649 VanDerWaalsContact O-N 3.13Å; A646-K650 PolarHBondContact O-N 3.26Å
647	L	88.5	Confident	87.4	Confident	8 Å²	8	26.2 Å²	26.2	4%	0.042	16%	0.155	C	C	.	.	H	α-helix	trans	-57.4	-47.3	172.2	179.6	58.1	0	0	0	111.7	Y611 L614 V615 G643 V644 T649 K650 L651	Y611-L647 HydrophobicContact CD1-CB 3.61Å; Y611-L647 HydrophobicContact CD1-CD1 3.85Å; Y611-L647 HydrophobicContact CD1-CD2 4.4Å; Y611-L647 HydrophobicContact CD1-CG 4.14Å; Y611-L647 HydrophobicContact CE1-CB 3.81Å; Y611-L647 HydrophobicContact CG-CB 4.48Å; Y611-L647 HydrophobicContact CG-CD1 3.86Å; L614-L647 HydrophobicContact CB-CD2 3.78Å; L614-L647 HydrophobicContact CD1-CB 4.47Å; L614-L647 HydrophobicContact CD1-CD2 3.47Å; L614-L647 VanDerWaalsContact CD1-CD2 3.47Å; L614-L647 HydrophobicContact CG-CD2 4.25Å; V615-L647 HydrophobicContact CG2-CD2 4.03Å; G643-L647 PolarHBondContact O-N 3.02Å; G643-L647 VanDerWaalsContact O-N 3.12Å; V644-L647 WeakPolarHBondContact O-CB 3.28Å; V644-L647 PolarHBondContact O-N 3.4Å; L647-T649 PolarHBondContact O-N 3.37Å; L647-K650 CarbonylContact O-C 3.54Å; L647-K650 WeakPolarHBondContact O-CA 3.49Å; L647-K650 WeakPolarHBondContact O-CB 3.39Å; L647-K650 PolarHBondContact O-N 2.8Å; L647-K650 VanDerWaalsContact O-N 3.09Å; L647-L651 HydrophobicContact CD1-CD1 4.29Å; L647-L651 HydrophobicContact CD1-CG 4.24Å; L647-L651 HydrophobicContact CG-CD1 3.99Å; L647-L651 HydrophobicContact CG-CG 4.39Å; L647-L651 WeakPolarHBondContact O-CG 3.2Å; L647-L651 PolarHBondContact O-N 3.2Å
648	L	89	Confident	87.1	Confident	2 Å²	2	27.3 Å²	27.3	1%	0.01	16%	0.16	C	C	.	.	H	α-helix	trans	-63.7	-31.5	178.6	-66	176.1	0	0	0	112.6	V644 Q645 A646 L651 W652 Y1020 I1023	V644-L648 HydrophobicContact CG1-CD1 4.27Å; V644-L648 HydrophobicContact CG1-CG 4.49Å; V644-L648 VanDerWaalsContact O-CG 3.3Å; V644-L648 WeakPolarHBondContact O-CG 3.44Å; V644-L648 PolarHBondContact O-N 3.25Å; Q645-L648 PolarHBondContact O-N 3.37Å; A646-L648 PolarHBondContact O-N 2.9Å; L648-L651 HydrophobicContact CD2-CD1 4.23Å; L648-W652 VanDerWaalsContact O-CB 3.22Å; L648-W652 WeakPolarHBondContact O-CB 3.49Å; L648-W652 PolarHBondContact O-N 2.91Å; L648-Y1020 HydrophobicContact CD1-CD2 3.95Å; L648-Y1020 HydrophobicContact CD1-CG 4.38Å; L648-Y1020 HydrophobicContact CD2-CD2 3.53Å; L648-Y1020 HydrophobicContact CD2-CE2 4.13Å; L648-Y1020 HydrophobicContact CG-CD2 4.37Å; L648-I1023 HydrophobicContact CB-CD1 4.03Å
649	T	89.4	Confident	86.5	Confident	38 Å²	38	34.3 Å²	34.3	23%	0.233	20%	0.197	C	C	.	.	H	α-helix	trans	-69.4	-43.2	172.8	-54.9	0	0	0	0	110.4	Q645 A646 L647 L651 W652 W653 T658 R1019	Q645-T649 WeakPolarHBondContact O-CB 3.3Å; Q645-T649 PolarHBondContact O-N 3.44Å; Q645-T649 PolarHBondContact O-OG1 2.98Å; A646-T649 WeakPolarHBondContact O-CB 3.48Å; A646-T649 PolarHBondContact O-N 3.22Å; A646-T649 VanDerWaalsContact O-N 3.13Å; L647-T649 PolarHBondContact O-N 3.37Å; T649-L651 PolarHBondContact O-N 2.71Å; T649-W652 WeakPolarHBondContact O-CB 3.34Å; T649-W652 PolarHBondContact O-N 3.23Å; T649-W653 PolarHBondContact O-N 2.9Å; T649-W653 VanDerWaalsContact O-N 3.1Å; T649-T658 HydrophobicContact CG2-CG2 4.18Å; T649-R1019 PolarHBondContact OG1-NH2 3.1Å
650	K	86.2	Confident	86.1	Confident	80 Å²	80	35 Å²	35	35%	0.348	20%	0.202	S	C	.	.	H	α-helix	trans	-59.3	-46.5	173.6	-170.6	176.5	-179.8	179.4	0	111.5	D608 Y611 A646 L647 W652 W653 G654	D608-K650 IonicContact OD1-NZ 2.8Å; Y611-K650 HydrophobicContact CD2-CD 4.43Å; Y611-K650 HydrophobicContact CE2-CD 4.4Å; A646-K650 PolarHBondContact O-N 3.26Å; L647-K650 CarbonylContact O-C 3.54Å; L647-K650 WeakPolarHBondContact O-CA 3.49Å; L647-K650 WeakPolarHBondContact O-CB 3.39Å; L647-K650 PolarHBondContact O-N 2.8Å; L647-K650 VanDerWaalsContact O-N 3.09Å; K650-W652 VanDerWaalsContact C-N 3.34Å; K650-W652 PolarHBondContact O-N 3.45Å; K650-W653 PolarHBondContact O-N 3.42Å; K650-G654 PolarHBondContact O-N 2.97Å
651	L	85.6	Confident	85.9	Confident	32 Å²	32	36.5 Å²	36.5	17%	0.168	21%	0.214	C	C	.	.	H	α-helix	trans	-62.3	-38.4	175.3	-71.7	169.9	0	0	0	112.4	L647 L648 T649 G654 P748	L647-L651 HydrophobicContact CD1-CD1 4.29Å; L647-L651 HydrophobicContact CD1-CG 4.24Å; L647-L651 HydrophobicContact CG-CD1 3.99Å; L647-L651 HydrophobicContact CG-CG 4.39Å; L647-L651 WeakPolarHBondContact O-CG 3.2Å; L647-L651 PolarHBondContact O-N 3.2Å; L648-L651 HydrophobicContact CD2-CD1 4.23Å; T649-L651 PolarHBondContact O-N 2.71Å; L651-G654 PolarHBondContact O-N 3.46Å; L651-P748 WeakPolarHBondContact O-CG 3.26Å
652	W	87.4	Confident	85.6	Confident	25 Å²	25	39.4 Å²	39.4	10%	0.095	23%	0.229	C	C	.	.	H	α-helix	trans	-64.4	-40.8	178.2	178.8	-107.6	0	0	0	113.5	L648 T649 K650 P748 V749 F752 I872 I1023	L648-W652 VanDerWaalsContact O-CB 3.22Å; L648-W652 WeakPolarHBondContact O-CB 3.49Å; L648-W652 PolarHBondContact O-N 2.91Å; T649-W652 WeakPolarHBondContact O-CB 3.34Å; T649-W652 PolarHBondContact O-N 3.23Å; K650-W652 VanDerWaalsContact C-N 3.34Å; K650-W652 PolarHBondContact O-N 3.45Å; W652-P748 HydrophobicContact CE3-CB 3.84Å; W652-P748 HydrophobicContact CZ3-CB 4.15Å; W652-P748 WeakPolarHBondContact O-CD 3.47Å; W652-V749 HydrophobicContact CD2-CB 4.27Å; W652-V749 HydrophobicContact CG-CB 4.42Å; W652-V749 HydrophobicContact CZ2-CB 4.17Å; W652-V749 HydrophobicContact CZ2-CG2 4.21Å; W652-V749 WeakPolarHBondContact O-CB 3.16Å; W652-V749 PolarHBondContact O-N 3.09Å; W652-V749 VanDerWaalsContact O-N 3.09Å; W652-F752 HydrophobicContact CH2-CB 3.37Å; W652-F752 HydrophobicContact CH2-CD1 4.15Å; W652-F752 AromaticContact CH2-CD2 3.99Å; W652-F752 HydrophobicContact CH2-CD2 3.99Å; W652-F752 AromaticContact CH2-CG 3.57Å; W652-F752 HydrophobicContact CH2-CG 3.57Å; W652-F752 HydrophobicContact CZ2-CB 3.82Å; W652-F752 HydrophobicContact CZ2-CD1 4Å; W652-F752 AromaticContact CZ2-CG 3.9Å; W652-F752 HydrophobicContact CZ2-CG 3.9Å; W652-F752 HydrophobicContact CZ3-CB 4.35Å; W652-I872 HydrophobicContact CH2-CD1 3.31Å; W652-I872 HydrophobicContact CZ2-CD1 3.64Å; W652-I872 HydrophobicContact CZ3-CD1 3.89Å; W652-I1023 HydrophobicContact CB-CD1 4.46Å; W652-I1023 HydrophobicContact CD2-CG1 4.45Å; W652-I1023 HydrophobicContact CE3-CB 4.42Å; W652-I1023 HydrophobicContact CE3-CG1 3.75Å; W652-I1023 HydrophobicContact CE3-CG2 4.29Å; W652-I1023 HydrophobicContact CZ3-CG1 4.21Å
653	W	85.8	Confident	85.3	Confident	23 Å²	23	37.9 Å²	37.9	9%	0.087	23%	0.228	C	C	.	.	H	α-helix	trans	-82.1	-19.7	177.6	-71.8	102	0	0	0	113.1	T649 K650 A655 M656 T658 T660 I662 L665 V749	T649-W653 PolarHBondContact O-N 2.9Å; T649-W653 VanDerWaalsContact O-N 3.1Å; K650-W653 PolarHBondContact O-N 3.42Å; W653-A655 PolarHBondContact O-N 3.09Å; W653-M656 PolarHBondContact O-N 2.79Å; W653-T658 HydrophobicContact CG-CG2 4.36Å; W653-T660 WeakPolarHBondContact CH2-O 3.33Å; W653-T660 WeakPolarHBondContact CZ3-OG1 3.22Å; W653-I662 HydrophobicContact CH2-CG1 4.49Å; W653-L665 HydrophobicContact CZ3-CD1 3.85Å; W653-V749 HydrophobicContact CD2-CG1 4.5Å; W653-V749 HydrophobicContact CE3-CG1 3.94Å; W653-V749 HydrophobicContact CZ3-CG1 4.36Å; W653-V749 HydrophobicContact CZ3-CG2 4.48Å
654	G	84.3	Confident	85.2	Confident	32 Å²	32	42.1 Å²	42.1	33%	0.33	25%	0.246	S	C	.	.	T	Hydrogen-bonded Turn	trans	63.8	-127.9	178.7	0	0	0	0	0	111.8	K650 L651 M656	K650-G654 PolarHBondContact O-N 2.97Å; L651-G654 PolarHBondContact O-N 3.46Å; G654-M656 PolarHBondContact O-N 3.38Å
655	A	76.8	Confident	84.8	Confident	35 Å²	35	42.3 Å²	42.3	29%	0.289	25%	0.247	S	C	.	.	T	Hydrogen-bonded Turn	trans	-76.2	-4.4	179.7	0	0	0	0	0	114.4	W653 F682 S683 R743	W653-A655 PolarHBondContact O-N 3.09Å; A655-F682 WeakPolarHBondContact O-CA 3.5Å; A655-S683 PolarHBondContact O-N 3.46Å; A655-S683 PolarHBondContact O-OG 3.5Å; A655-R743 HydrophobicContact CB-CB 4.21Å; A655-R743 HydrophobicContact CB-CG 4.16Å
656	M	83	Confident	84.5	Confident	4 Å²	4	44 Å²	44	2%	0.02	26%	0.258	C	S	.	.	B	Isolated β-bridge	trans	-88.3	150.1	175.9	-67	-178.3	-79.1	0	0	111.2	W653 G654 I680 F682 F744 A747 V749 T750	W653-M656 PolarHBondContact O-N 2.79Å; G654-M656 PolarHBondContact O-N 3.38Å; M656-I680 HydrophobicContact CG-CG2 3.96Å; M656-I680 HydrophobicContact SD-CG2 3.87Å; M656-F682 HydrophobicContact CG-CD1 4.05Å; M656-F682 HydrophobicContact CG-CE1 3.71Å; M656-F682 HydrophobicContact CG-CZ 4.32Å; M656-F744 HydrophobicContact CE-CD2 4.41Å; M656-F744 HydrophobicContact SD-CD2 3.76Å; M656-F744 HydrophobicContact SD-CE2 4.11Å; M656-A747 HydrophobicContact CE-CB 3.29Å; M656-V749 HydrophobicContact CE-CG1 3.65Å; M656-T750 HydrophobicContact CE-CG2 3.92Å
657	T	80.6	Confident	84.3	Confident	20 Å²	20	45.8 Å²	45.8	12%	0.123	27%	0.266	C	S	.	.			trans	-72.7	145.2	176.6	62.2	0	0	0	0	112	D659 T660 M681	T657-D659 PolarHBondContact O-N 3.14Å; T657-T660 PolarHBondContact O-N 3.16Å; T657-T660 PolarHBondContact O-OG1 2.8Å; T657-M681 HydrophobicContact CG2-CB 4.05Å; T657-M681 PolarHBondContact N-O 2.87Å; T657-M681 VanDerWaalsContact N-O 3.14Å; T657-M681 PolarHBondContact OG1-O 2.99Å
658	T	80.1	Confident	84.1	Confident	71 Å²	71	45.4 Å²	45.4	44%	0.436	26%	0.264	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.7	-18.6	-175.8	50.5	0	0	0	0	114.2	T649 W653 T660	T649-T658 HydrophobicContact CG2-CG2 4.18Å; W653-T658 HydrophobicContact CG-CG2 4.36Å; T658-T660 PolarHBondContact O-N 3.21Å
659	D	78.4	Confident	83.9	Confident	147 Å²	147	46.9 Å²	46.9	79%	0.786	27%	0.271	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.6	-1.9	-178.2	-65.1	-17.3	0	0	0	113.3	T657 A661	T657-D659 PolarHBondContact O-N 3.14Å; D659-A661 PolarHBondContact O-N 3.06Å
660	T	82.1	Confident	83.7	Confident	15 Å²	15	50.9 Å²	50.9	9%	0.092	29%	0.285	C	S	.	.			trans	-70.3	118.7	179.7	53	0	0	0	0	110.9	W653 T657 T658 I680	W653-T660 WeakPolarHBondContact CH2-O 3.33Å; W653-T660 WeakPolarHBondContact CZ3-OG1 3.22Å; T657-T660 PolarHBondContact O-N 3.16Å; T657-T660 PolarHBondContact O-OG1 2.8Å; T658-T660 PolarHBondContact O-N 3.21Å; T660-I680 HydrophobicContact CG2-CG2 4.39Å
661	A	84.3	Confident	83.7	Confident	44 Å²	44	53.2 Å²	53.2	36%	0.364	30%	0.295	S	S	.	.			trans	-65.4	137.7	177.7	0	0	0	0	0	111.4	D659 S663 K664 L665	D659-A661 PolarHBondContact O-N 3.06Å; A661-S663 PolarHBondContact O-N 3.48Å; A661-S663 VanDerWaalsContact O-N 3.12Å; A661-K664 HydrophobicContact CB-CD 4.39Å; A661-K664 HydrophobicContact CB-CG 4.3Å; A661-K664 WeakPolarHBondContact O-CB 3.27Å; A661-K664 PolarHBondContact O-N 3.47Å; A661-L665 PolarHBondContact O-N 3.13Å
662	I	84.4	Confident	83.4	Confident	97 Å²	97	53.5 Å²	53.5	50%	0.497	30%	0.299	S	S	.	.	H	α-helix	trans	-55.4	-34.7	-179.2	-61.7	171.4	0	0	0	112	W653 K664 L665 V666 F753	W653-I662 HydrophobicContact CH2-CG1 4.49Å; I662-K664 VanDerWaalsContact C-N 3.3Å; I662-K664 PolarHBondContact O-N 3.21Å; I662-L665 WeakPolarHBondContact O-CB 3.37Å; I662-L665 PolarHBondContact O-N 2.94Å; I662-L665 VanDerWaalsContact O-N 3.12Å; I662-V666 HydrophobicContact CG2-CG2 4.29Å; I662-V666 WeakPolarHBondContact O-CG2 3.5Å; I662-V666 PolarHBondContact O-N 2.87Å; I662-F753 HydrophobicContact CG2-CE1 4.35Å; I662-F753 HydrophobicContact CG2-CE2 4.09Å; I662-F753 HydrophobicContact CG2-CZ 3.55Å
663	S	84.4	Confident	83.3	Confident	82 Å²	82	56.2 Å²	56.2	57%	0.573	32%	0.32	S	S	*	.	H	α-helix	trans	-60.7	-37	176.3	55.8	0	0	0	0	112.9	A661 L665 V666 V667	A661-S663 PolarHBondContact O-N 3.48Å; A661-S663 VanDerWaalsContact O-N 3.12Å; S663-L665 VanDerWaalsContact C-N 3.32Å; S663-V666 PolarHBondContact O-N 3.1Å; S663-V667 VanDerWaalsContact O-CG2 3.26Å; S663-V667 WeakPolarHBondContact O-CG2 3.5Å; S663-V667 PolarHBondContact O-N 3.34Å
664	K	86.3	Confident	83.1	Confident	89 Å²	89	57.8 Å²	57.8	39%	0.387	33%	0.33	S	S	.	.	H	α-helix	trans	-66.1	-37.1	175.4	-62.1	178.6	179.3	-179.9	0	111.1	A661 I662 S668 L679	A661-K664 HydrophobicContact CB-CD 4.39Å; A661-K664 HydrophobicContact CB-CG 4.3Å; A661-K664 WeakPolarHBondContact O-CB 3.27Å; A661-K664 PolarHBondContact O-N 3.47Å; I662-K664 VanDerWaalsContact C-N 3.3Å; I662-K664 PolarHBondContact O-N 3.21Å; K664-S668 WeakPolarHBondContact O-CB 3.38Å; K664-S668 PolarHBondContact O-N 3.23Å; K664-S668 PolarHBondContact O-OG 3.16Å; K664-L679 HydrophobicContact CB-CG 4.35Å; K664-L679 HydrophobicContact CD-CD1 4.21Å; K664-L679 HydrophobicContact CD-CG 4.43Å; K664-L679 HydrophobicContact CG-CD1 4.29Å; K664-L679 HydrophobicContact CG-CG 4.43Å
665	L	83.5	Confident	83	Confident	5 Å²	5	56.2 Å²	56.2	3%	0.026	31%	0.314	C	S	.	.	H	α-helix	trans	-66.9	-46.7	176.6	-175.1	150.1	0	0	0	111.4	W653 A661 I662 S663 V667 S668 F669 V749 T750 F753	W653-L665 HydrophobicContact CZ3-CD1 3.85Å; A661-L665 PolarHBondContact O-N 3.13Å; I662-L665 WeakPolarHBondContact O-CB 3.37Å; I662-L665 PolarHBondContact O-N 2.94Å; I662-L665 VanDerWaalsContact O-N 3.12Å; S663-L665 VanDerWaalsContact C-N 3.32Å; L665-V667 PolarHBondContact O-N 2.7Å; L665-S668 PolarHBondContact O-N 3.39Å; L665-F669 WeakPolarHBondContact O-CB 3.31Å; L665-F669 PolarHBondContact O-N 3.4Å; L665-V749 HydrophobicContact CD1-CB 4.46Å; L665-V749 HydrophobicContact CD1-CG1 3.84Å; L665-V749 HydrophobicContact CD1-CG2 3.79Å; L665-T750 HydrophobicContact CD1-CG2 4.07Å; L665-T750 HydrophobicContact CG-CG2 4.39Å; L665-F753 HydrophobicContact CD2-CB 4.3Å; L665-F753 HydrophobicContact CD2-CD2 3.46Å; L665-F753 VanDerWaalsContact CD2-CD2 3.46Å; L665-F753 HydrophobicContact CD2-CE2 3.98Å; L665-F753 HydrophobicContact CD2-CG 3.99Å
666	V	84.4	Confident	83	Confident	46 Å²	46	59.4 Å²	59.4	28%	0.279	32%	0.318	S	S	.	.	H	α-helix	trans	-61.9	-44	178.2	175.8	0	0	0	0	111.2	I662 S663 S668 F669 F670 F753	I662-V666 HydrophobicContact CG2-CG2 4.29Å; I662-V666 WeakPolarHBondContact O-CG2 3.5Å; I662-V666 PolarHBondContact O-N 2.87Å; S663-V666 PolarHBondContact O-N 3.1Å; V666-S668 VanDerWaalsContact C-N 3.34Å; V666-S668 PolarHBondContact O-N 2.87Å; V666-F669 WeakPolarHBondContact O-CB 3.43Å; V666-F669 PolarHBondContact O-N 2.76Å; V666-F670 HydrophobicContact CG1-CD2 3.93Å; V666-F670 HydrophobicContact CG1-CE2 3.76Å; V666-F670 VanDerWaalsContact O-CD2 3.26Å; V666-F670 WeakPolarHBondContact O-CD2 3.35Å; V666-F670 PolarHBondContact O-N 3.33Å; V666-F753 HydrophobicContact CG2-CE1 4.47Å
667	V	85.5	Confident	82.8	Confident	66 Å²	66	62.4 Å²	62.4	40%	0.4	34%	0.337	S	S	.	.	H	α-helix	trans	-62.6	-42.2	176.4	172.4	0	0	0	0	111.1	S663 L665 F669 F670 F671 L674	S663-V667 VanDerWaalsContact O-CG2 3.26Å; S663-V667 WeakPolarHBondContact O-CG2 3.5Å; S663-V667 PolarHBondContact O-N 3.34Å; L665-V667 PolarHBondContact O-N 2.7Å; V667-F669 VanDerWaalsContact C-N 3.3Å; V667-F669 PolarHBondContact O-N 2.59Å; V667-F670 PolarHBondContact O-N 3.31Å; V667-F671 HydrophobicContact CG1-CD2 4.43Å; V667-F671 PolarHBondContact O-N 3.04Å; V667-L674 HydrophobicContact CG1-CD2 3.9Å
668	S	84.9	Confident	82.3	Confident	0 Å²	0	68.2 Å²	68.2	0%	0	37%	0.367	C	S	.	.	H	α-helix	trans	-69.9	-26.7	178.2	-54.4	0	0	0	0	113	K664 L665 V666 F671	K664-S668 WeakPolarHBondContact O-CB 3.38Å; K664-S668 PolarHBondContact O-N 3.23Å; K664-S668 PolarHBondContact O-OG 3.16Å; L665-S668 PolarHBondContact O-N 3.39Å; V666-S668 VanDerWaalsContact C-N 3.34Å; V666-S668 PolarHBondContact O-N 2.87Å; S668-F671 CarbonylContact O-C 3.57Å; S668-F671 VanDerWaalsContact O-C 3.28Å
669	F	84.8	Confident	82.2	Confident	34 Å²	34	67.7 Å²	67.7	15%	0.149	36%	0.361	C	S	.	.	H	α-helix	trans	-68	-46.3	174.3	-174.5	-83	0	0	0	111.7	L665 V666 V667 W745 I757	L665-F669 WeakPolarHBondContact O-CB 3.31Å; L665-F669 PolarHBondContact O-N 3.4Å; V666-F669 WeakPolarHBondContact O-CB 3.43Å; V666-F669 PolarHBondContact O-N 2.76Å; V667-F669 VanDerWaalsContact C-N 3.3Å; V667-F669 PolarHBondContact O-N 2.59Å; F669-W745 AromaticContact CD2-CH2 3.83Å; F669-W745 HydrophobicContact CD2-CH2 3.83Å; F669-W745 AromaticContact CD2-CZ3 3.81Å; F669-W745 HydrophobicContact CD2-CZ3 3.81Å; F669-W745 AromaticContact CE2-CH2 3.8Å; F669-W745 HydrophobicContact CE2-CH2 3.8Å; F669-W745 AromaticContact CE2-CZ3 3.5Å; F669-W745 HydrophobicContact CE2-CZ3 3.5Å; F669-W745 HydrophobicContact CG-CH2 4.48Å; F669-W745 HydrophobicContact CZ-CH2 4.4Å; F669-W745 HydrophobicContact CZ-CZ3 4.3Å; F669-I757 HydrophobicContact CD1-CD1 3.64Å; F669-I757 HydrophobicContact CE1-CD1 3.49Å; F669-I757 VanDerWaalsContact CE1-CD1 3.49Å; F669-I757 HydrophobicContact CE1-CG2 4.49Å; F669-I757 HydrophobicContact CG-CD1 4.33Å; F669-I757 HydrophobicContact CZ-CD1 4.05Å
670	F	85.4	Confident	82.1	Confident	121 Å²	121	60.8 Å²	60.8	53%	0.531	33%	0.325	S	S	.	.	H	α-helix	trans	-76.6	-26	178.2	-73.1	-69.7	0	0	0	113.4	V666 V667 P672 I757	V666-F670 HydrophobicContact CG1-CD2 3.93Å; V666-F670 HydrophobicContact CG1-CE2 3.76Å; V666-F670 VanDerWaalsContact O-CD2 3.26Å; V666-F670 WeakPolarHBondContact O-CD2 3.35Å; V666-F670 PolarHBondContact O-N 3.33Å; V667-F670 PolarHBondContact O-N 3.31Å; F670-P672 WeakPolarHBondContact O-CD 3.3Å; F670-I757 HydrophobicContact CE2-CD1 4.29Å; F670-I757 HydrophobicContact CZ-CD1 3.99Å
671	F	85.9	Confident	81.8	Confident	129 Å²	129	64.3 Å²	64.3	57%	0.566	34%	0.341	S	S	*	.			trans	-123.2	80.3	177.1	-60.9	-80.8	0	0	0	110.7	V667 S668 P673 L674	V667-F671 HydrophobicContact CG1-CD2 4.43Å; V667-F671 PolarHBondContact O-N 3.04Å; S668-F671 CarbonylContact O-C 3.57Å; S668-F671 VanDerWaalsContact O-C 3.28Å; F671-P673 VanDerWaalsContact C-N 3.26Å; F671-P673 VanDerWaalsContact O-N 3.08Å; F671-L674 HydrophobicContact CB-CD1 3.62Å; F671-L674 PolarHBondContact O-N 3.46Å
672	P	80.1	Confident	81.5	Confident	39 Å²	39	62.6 Å²	62.6	25%	0.253	33%	0.325	S	S	.	.	G	3₁₀ helix	trans	-53.5	-29.3	-177.6	-23.8	31.7	0	0	0	115.9	F670 L674 I675 W741	F670-P672 WeakPolarHBondContact O-CD 3.3Å; P672-L674 PolarHBondContact O-N 3.25Å; P672-L674 VanDerWaalsContact O-N 3.12Å; P672-I675 HydrophobicContact CB-CD1 4.35Å; P672-I675 WeakPolarHBondContact O-CB 3.45Å; P672-I675 WeakPolarHBondContact O-CG1 3.44Å; P672-I675 PolarHBondContact O-N 2.66Å; P672-I675 VanDerWaalsContact O-N 3.11Å; P672-W741 HydrophobicContact CB-CH2 3.84Å; P672-W741 HydrophobicContact CB-CZ3 3.66Å
673	P	84.7	Confident	80.6	Confident	81 Å²	81	60.3 Å²	60.3	53%	0.526	32%	0.318	S	S	.	.	G	3₁₀ helix	trans	-58.2	-22.6	174.4	-27.9	36.7	0	0	0	115.7	F671 I675 W676	F671-P673 VanDerWaalsContact C-N 3.26Å; F671-P673 VanDerWaalsContact O-N 3.08Å; P673-I675 VanDerWaalsContact C-N 3.26Å; P673-I675 PolarHBondContact O-N 2.95Å; P673-W676 HydrophobicContact CB-CE3 4.34Å; P673-W676 HydrophobicContact CB-CZ3 4.21Å; P673-W676 HydrophobicContact CG-CZ3 4.46Å
674	L	82.2	Confident	79.2	Confident	56 Å²	56	59.4 Å²	59.4	29%	0.293	31%	0.307	S	S	.	.	G	3₁₀ helix	trans	-73.8	-17.5	179	-81.8	75.5	0	0	0	112.9	V667 F671 P672 W676 T677 L679	V667-L674 HydrophobicContact CG1-CD2 3.9Å; F671-L674 HydrophobicContact CB-CD1 3.62Å; F671-L674 PolarHBondContact O-N 3.46Å; P672-L674 PolarHBondContact O-N 3.25Å; P672-L674 VanDerWaalsContact O-N 3.12Å; L674-W676 PolarHBondContact O-N 2.84Å; L674-T677 WeakPolarHBondContact O-CB 2.98Å; L674-T677 PolarHBondContact O-N 3.11Å; L674-T677 PolarHBondContact O-OG1 3.46Å; L674-L679 HydrophobicContact CB-CD2 4.47Å; L674-L679 HydrophobicContact CD2-CD2 3.97Å
675	I	81	Confident	77.6	Confident	0 Å²	0	57.5 Å²	57.5	0%	0	30%	0.299	C	S	.	.	G	3₁₀ helix	trans	-59.4	-34.6	177.2	-62.8	166.6	0	0	0	110.5	P672 P673 T677 R740 W741 F744	P672-I675 HydrophobicContact CB-CD1 4.35Å; P672-I675 WeakPolarHBondContact O-CB 3.45Å; P672-I675 WeakPolarHBondContact O-CG1 3.44Å; P672-I675 PolarHBondContact O-N 2.66Å; P672-I675 VanDerWaalsContact O-N 3.11Å; P673-I675 VanDerWaalsContact C-N 3.26Å; P673-I675 PolarHBondContact O-N 2.95Å; I675-T677 VanDerWaalsContact C-N 3.25Å; I675-T677 PolarHBondContact O-N 3.25Å; I675-R740 HydrophobicContact CG2-CG 4.2Å; I675-R740 PolarHBondContact O-NE 3.05Å; I675-W741 HydrophobicContact CD1-CE3 4.21Å; I675-W741 HydrophobicContact CD1-CZ3 4.07Å; I675-F744 HydrophobicContact CD1-CB 4.49Å; I675-F744 HydrophobicContact CD1-CD1 3.48Å; I675-F744 VanDerWaalsContact CD1-CD1 3.48Å; I675-F744 HydrophobicContact CD1-CE1 3.71Å; I675-F744 HydrophobicContact CD1-CG 3.91Å; I675-F744 HydrophobicContact CD1-CZ 4.33Å; I675-F744 HydrophobicContact CG1-CD1 4.18Å; I675-F744 HydrophobicContact CG1-CD2 4.36Å; I675-F744 HydrophobicContact CG1-CE1 4.28Å; I675-F744 HydrophobicContact CG1-CE2 4.47Å; I675-F744 HydrophobicContact CG1-CG 4.21Å; I675-F744 HydrophobicContact CG1-CZ 4.42Å; I675-F744 HydrophobicContact CG2-CB 4.07Å; I675-F744 HydrophobicContact CG2-CG 4.24Å
676	W	76.9	Confident	75.9	Confident	102 Å²	102	62.7 Å²	62.7	39%	0.386	32%	0.323	S	S	.	.	G	3₁₀ helix	trans	-80.1	-2.9	-179.5	-58.3	-57	0	0	0	114.2	P673 L674 L737 W741	P673-W676 HydrophobicContact CB-CE3 4.34Å; P673-W676 HydrophobicContact CB-CZ3 4.21Å; P673-W676 HydrophobicContact CG-CZ3 4.46Å; L674-W676 PolarHBondContact O-N 2.84Å; W676-L737 HydrophobicContact CB-CD2 4.11Å; W676-L737 HydrophobicContact CD2-CD2 4Å; W676-L737 HydrophobicContact CG-CD2 3.5Å; W676-L737 VanDerWaalsContact CG-CD2 3.5Å; W676-L737 PolarHBondContact NE1-O 2.71Å; W676-W741 HydrophobicContact CH2-CE3 4.28Å; W676-W741 HydrophobicContact CH2-CZ3 4.19Å; W676-W741 AromaticContact CZ2-CE3 3.72Å; W676-W741 HydrophobicContact CZ2-CE3 3.72Å; W676-W741 HydrophobicContact CZ2-CZ3 4.11Å
677	T	79.1	Confident	74.1	Confident	66 Å²	66	63.7 Å²	63.7	41%	0.405	33%	0.327	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.9	163.4	173.5	72.2	0	0	0	0	111	L674 I675 L679 R740	L674-T677 WeakPolarHBondContact O-CB 2.98Å; L674-T677 PolarHBondContact O-N 3.11Å; L674-T677 PolarHBondContact O-OG1 3.46Å; I675-T677 VanDerWaalsContact C-N 3.25Å; I675-T677 PolarHBondContact O-N 3.25Å; T677-L679 PolarHBondContact O-N 3.12Å; T677-L679 WeakPolarHBondContact OG1-CB 3.38Å; T677-R740 PolarHBondContact O-NH2 3.42Å
678	N	70.7	Confident	72.2	Confident	142 Å²	142	66.8 Å²	66.8	76%	0.759	34%	0.341	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.9	19.1	176.3	-66.8	-7.4	0	0	0	114	I680	N678-I680 VanDerWaalsContact C-N 3.33Å
679	L	76.4	Confident	70.3	Confident	60 Å²	60	73 Å²	73	31%	0.314	38%	0.375	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.1	-32.3	177.4	-171.5	68.1	0	0	0	112.2	K664 L674 T677	K664-L679 HydrophobicContact CB-CG 4.35Å; K664-L679 HydrophobicContact CD-CD1 4.21Å; K664-L679 HydrophobicContact CD-CG 4.43Å; K664-L679 HydrophobicContact CG-CD1 4.29Å; K664-L679 HydrophobicContact CG-CG 4.43Å; L674-L679 HydrophobicContact CB-CD2 4.47Å; L674-L679 HydrophobicContact CD2-CD2 3.97Å; T677-L679 PolarHBondContact O-N 3.12Å; T677-L679 WeakPolarHBondContact OG1-CB 3.38Å
680	I	78.1	Confident	68.3	Low	3 Å²	3	80 Å²	80	2%	0.015	40%	0.4	C	S	.	.	S	Bend	trans	-114.3	126.2	176	-60.8	170	0	0	0	107.4	M656 T660 N678 F682 R740 F744	M656-I680 HydrophobicContact CG-CG2 3.96Å; M656-I680 HydrophobicContact SD-CG2 3.87Å; T660-I680 HydrophobicContact CG2-CG2 4.39Å; N678-I680 VanDerWaalsContact C-N 3.33Å; I680-F682 HydrophobicContact CB-CE2 4.27Å; I680-F682 HydrophobicContact CG2-CD2 4.41Å; I680-F682 HydrophobicContact CG2-CE2 3.84Å; I680-F682 HydrophobicContact CG2-CZ 3.98Å; I680-R740 PolarHBondContact O-NH2 3.24Å; I680-F744 HydrophobicContact CD1-CD2 3.89Å; I680-F744 HydrophobicContact CD1-CE2 3.57Å
681	M	74.5	Confident	66.1	Low	89 Å²	89	80 Å²	80	44%	0.438	41%	0.405	S	S	.	.			trans	-93	138.8	172.9	-71.3	-174.4	68.1	0	0	109.9	T657 E686	T657-M681 HydrophobicContact CG2-CB 4.05Å; T657-M681 PolarHBondContact N-O 2.87Å; T657-M681 VanDerWaalsContact N-O 3.14Å; T657-M681 PolarHBondContact OG1-O 2.99Å; M681-E686 HydrophobicContact CE-CG 4.4Å
682	F	77.9	Confident	63.8	Low	7 Å²	7	77.2 Å²	77.2	3%	0.031	41%	0.413	C	S	.	.	B	Isolated β-bridge	trans	-109.4	141.3	175.2	-67.5	-91.8	0	0	0	109.3	A655 M656 I680 D684 E685 R740 R743 F744	A655-F682 WeakPolarHBondContact O-CA 3.5Å; M656-F682 HydrophobicContact CG-CD1 4.05Å; M656-F682 HydrophobicContact CG-CE1 3.71Å; M656-F682 HydrophobicContact CG-CZ 4.32Å; I680-F682 HydrophobicContact CB-CE2 4.27Å; I680-F682 HydrophobicContact CG2-CD2 4.41Å; I680-F682 HydrophobicContact CG2-CE2 3.84Å; I680-F682 HydrophobicContact CG2-CZ 3.98Å; F682-D684 PolarHBondContact O-N 3.01Å; F682-D684 VanDerWaalsContact O-N 3.1Å; F682-E685 PolarHBondContact O-N 3.35Å; F682-R740 HydrophobicContact CD2-CG 4.07Å; F682-R740 HydrophobicContact CE1-CG 4.47Å; F682-R740 HydrophobicContact CE2-CG 3.43Å; F682-R740 VanDerWaalsContact CE2-CG 3.43Å; F682-R740 VanDerWaalsContact CE2-NE 3.32Å; F682-R740 HydrophobicContact CZ-CG 3.64Å; F682-R743 HydrophobicContact CD1-CB 4.41Å; F682-R743 HydrophobicContact CE1-CB 4.11Å; F682-F744 HydrophobicContact CZ-CB 4.49Å
683	S	64.9	Low	61.7	Low	49 Å²	49	84.3 Å²	84.3	34%	0.343	44%	0.44	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.3	-25.7	-168.8	-53.9	0	0	0	0	114.7	A655	A655-S683 PolarHBondContact O-N 3.46Å; A655-S683 PolarHBondContact O-OG 3.5Å
684	D	56.5	Low	59.2	Low	64 Å²	64	86.8 Å²	86.8	34%	0.342	44%	0.443	S	S	.	.	H	α-helix	trans	-75	-25.3	177	-71.5	-16	0	0	0	113.5	F682 E686 L687 D688 R743	F682-D684 PolarHBondContact O-N 3.01Å; F682-D684 VanDerWaalsContact O-N 3.1Å; D684-E686 PolarHBondContact O-N 3.06Å; D684-L687 PolarHBondContact O-N 2.89Å; D684-D688 PolarHBondContact O-N 2.88Å; D684-R743 IonicContact OD2-CZ 3.33Å; D684-R743 IonicContact OD2-NH1 2.84Å; D684-R743 PolarHBondContact OD2-NH1 3.37Å; D684-R743 IonicContact OD2-NH2 3.42Å; D684-R743 PolarHBondContact OD2-NH2 3.34Å
685	E	52.5	Low	56.9	Low	48 Å²	48	92.7 Å²	92.7	22%	0.224	47%	0.468	C	S	.	.	H	α-helix	trans	-69.4	-17.5	178.4	-66.8	-178.3	159.6	0	0	111.8	F682 N689 R740	F682-E685 PolarHBondContact O-N 3.35Å; E685-N689 VanDerWaalsContact O-CB 3.29Å; E685-N689 WeakPolarHBondContact O-CB 3.35Å; E685-N689 PolarHBondContact O-N 3.28Å; E685-N689 PolarHBondContact O-ND2 2.86Å; E685-R740 IonicContact OE1-CZ 2.82Å; E685-R740 IonicContact OE1-NH1 3.89Å; E685-R740 PolarHBondContact OE1-NH1 2.89Å; E685-R740 IonicContact OE2-NH1 3.94Å
686	E	48.3	Very low	54.8	Low	114 Å²	114	102.1 Å²	102.1	53%	0.533	51%	0.51	S	S	.	.	H	α-helix	trans	-79.5	-32.8	168.7	-89.1	-175.6	152.4	0	0	113.1	M681 D684 R690	M681-E686 HydrophobicContact CE-CG 4.4Å; D684-E686 PolarHBondContact O-N 3.06Å; E686-R690 WeakPolarHBondContact O-CB 3.26Å; E686-R690 PolarHBondContact O-N 3.05Å; E686-R690 VanDerWaalsContact O-N 3.14Å
687	L	45.9	Very low	52.8	Low	68 Å²	68	101 Å²	101	36%	0.356	51%	0.514	S	S	.	.	H	α-helix	trans	-74.6	-45.5	177.3	-72.5	167.7	0	0	0	110.7	D684 N689 R690 D691	D684-L687 PolarHBondContact O-N 2.89Å; L687-N689 VanDerWaalsContact C-N 3.33Å; L687-N689 PolarHBondContact O-N 2.9Å; L687-R690 CarbonylContact O-C 3.54Å; L687-R690 WeakPolarHBondContact O-CA 3.45Å; L687-R690 PolarHBondContact O-N 3.39Å; L687-D691 PolarHBondContact O-N 3.41Å
688	D	45	Very low	50.7	Low	130 Å²	130	105.9 Å²	105.9	70%	0.695	53%	0.532	S	S	*	.	H	α-helix	trans	-63.8	-36.6	176.7	-122.5	-0.1	0	0	0	111.9	D684 R690 G692	D684-D688 PolarHBondContact O-N 2.88Å; D688-R690 VanDerWaalsContact C-N 3.33Å; D688-G692 PolarHBondContact O-N 3.14Å
689	N	46.3	Very low	49.2	Very low	132 Å²	132	107.5 Å²	107.5	71%	0.706	54%	0.54	S	S	*	.	H	α-helix	trans	-73.2	-21.7	173	-86.1	-47.9	0	0	0	113.6	E685 L687	E685-N689 VanDerWaalsContact O-CB 3.29Å; E685-N689 WeakPolarHBondContact O-CB 3.35Å; E685-N689 PolarHBondContact O-N 3.28Å; E685-N689 PolarHBondContact O-ND2 2.86Å; L687-N689 VanDerWaalsContact C-N 3.33Å; L687-N689 PolarHBondContact O-N 2.9Å
690	R	41.6	Very low	47.6	Very low	181 Å²	181	110.8 Å²	110.8	68%	0.683	56%	0.558	S	S	*	*	H	α-helix	trans	-84.3	-39.9	174.4	-96.1	177.8	139.2	171.4	-5.5	112.1	E686 L687 D688 G692 K693	E686-R690 WeakPolarHBondContact O-CB 3.26Å; E686-R690 PolarHBondContact O-N 3.05Å; E686-R690 VanDerWaalsContact O-N 3.14Å; L687-R690 CarbonylContact O-C 3.54Å; L687-R690 WeakPolarHBondContact O-CA 3.45Å; L687-R690 PolarHBondContact O-N 3.39Å; D688-R690 VanDerWaalsContact C-N 3.33Å; R690-G692 VanDerWaalsContact C-N 3.34Å; R690-K693 PolarHBondContact O-N 2.85Å
691	D	39.8	Very low	46.4	Very low	119 Å²	119	112.1 Å²	112.1	64%	0.636	57%	0.567	S	S	*	*	H	α-helix	trans	-70.2	-28.9	178.4	-87.9	-15.7	0	0	0	112.6	L687 K693 K694	L687-D691 PolarHBondContact O-N 3.41Å; D691-K693 PolarHBondContact O-N 3.4Å; D691-K694 PolarHBondContact O-N 3.49Å
692	G	36.6	Very low	45.5	Very low	71 Å²	71	113.5 Å²	113.5	73%	0.732	58%	0.576	S	S	*	*	T	Hydrogen-bonded Turn	trans	-60.8	-3.4	170.3	0	0	0	0	0	115.3	D688 R690	D688-G692 PolarHBondContact O-N 3.14Å; R690-G692 VanDerWaalsContact C-N 3.34Å
693	K	36.1	Very low	44.2	Very low	188 Å²	188	117.1 Å²	117.1	82%	0.817	60%	0.596	S	S	*	*	T	Hydrogen-bonded Turn	trans	-121.9	3.7	-179.4	-105.2	179	-179.6	173.8	0	115.9	R690 D691	R690-K693 PolarHBondContact O-N 2.85Å; D691-K693 PolarHBondContact O-N 3.4Å
694	K	33.3	Very low	43.8	Very low	134 Å²	134	117.7 Å²	117.7	58%	0.583	60%	0.597	S	S	*	*			trans	-139.8	88	177.1	-72.4	-175.7	178.7	179	0	111.9	D691 D703	D691-K694 PolarHBondContact O-N 3.49Å; K694-D703 IonicContact NZ-OD2 3.13Å
695	E	34.4	Very low	43.9	Very low	179 Å²	179	116 Å²	116	84%	0.836	59%	0.587	S	S	*	*			trans	-75.5	133.8	158.1	-91	-178	153.6	0	0	109.6
696	F	37.1	Very low	44	Very low	198 Å²	198	117.1 Å²	117.1	87%	0.868	59%	0.591	S	S	*	*			trans	75.2	97.3	179.8	-65.1	-86.7	0	0	0	117
697	V	34.7	Very low	44.3	Very low	78 Å²	78	114 Å²	114	47%	0.473	59%	0.585	S	S	.	*			trans	-132.6	129.9	161.1	-179.5	0	0	0	0	109.2	S701	V697-S701 WeakPolarHBondContact CG1-OG 3.39Å
698	E	34.4	Very low	44.8	Very low	169 Å²	169	115.4 Å²	115.4	79%	0.79	59%	0.592	S	S	*	*			trans	-54.2	153.3	-179.3	-73.6	170.6	132.9	0	0	113.7	D700 S701	E698-D700 PolarHBondContact O-N 2.77Å; E698-S701 PolarHBondContact O-N 3.3Å
699	L	39.3	Very low	45.4	Very low	177 Å²	177	110.1 Å²	110.1	93%	0.927	56%	0.564	S	S	*	*	T	Hydrogen-bonded Turn	trans	-62.5	8.8	-179.2	-109.5	95.6	0	0	0	115.9
700	D	43.3	Very low	45.7	Very low	128 Å²	128	106.8 Å²	106.8	68%	0.684	55%	0.546	S	S	*	.	T	Hydrogen-bonded Turn	trans	-132.3	19.2	-177.4	-147.9	23.7	0	0	0	113.3	E698 R1071	E698-D700 PolarHBondContact O-N 2.77Å; D700-R1071 IonicContact OD1-NH2 3.47Å
701	S	53	Low	46.1	Very low	31 Å²	31	101.8 Å²	101.8	22%	0.217	54%	0.535	C	S	.	.			trans	-80	144	177.9	174	0	0	0	0	113.3	V697 E698 D703 T704 E705	V697-S701 WeakPolarHBondContact CG1-OG 3.39Å; E698-S701 PolarHBondContact O-N 3.3Å; S701-D703 PolarHBondContact O-N 2.82Å; S701-D703 PolarHBondContact OG-N 3.04Å; S701-D703 VanDerWaalsContact OG-N 3.13Å; S701-T704 WeakPolarHBondContact O-CB 3.49Å; S701-T704 PolarHBondContact O-N 3.12Å; S701-T704 PolarHBondContact O-OG1 3.24Å; S701-E705 PolarHBondContact O-N 3.45Å
702	L	53.9	Low	46.4	Very low	118 Å²	118	100.8 Å²	100.8	62%	0.618	53%	0.53	S	S	*	.	H	α-helix	trans	-48.4	-28.6	167	-84.2	157.7	0	0	0	113	K706	L702-K706 VanDerWaalsContact O-CB 3.23Å; L702-K706 WeakPolarHBondContact O-CB 3.43Å; L702-K706 PolarHBondContact O-N 3.12Å
703	D	50.3	Low	46.6	Very low	83 Å²	83	104.4 Å²	104.4	44%	0.444	53%	0.533	S	S	.	.	H	α-helix	trans	-69.8	-35.3	178.2	-68.2	-31.9	0	0	0	111.8	K694 S701 K706 A707	K694-D703 IonicContact NZ-OD2 3.13Å; S701-D703 PolarHBondContact O-N 2.82Å; S701-D703 PolarHBondContact OG-N 3.04Å; S701-D703 VanDerWaalsContact OG-N 3.13Å; D703-K706 PolarHBondContact O-N 2.72Å; D703-A707 WeakPolarHBondContact O-CB 3.37Å; D703-A707 PolarHBondContact O-N 3.49Å
704	T	58.1	Low	46.6	Very low	61 Å²	61	100.5 Å²	100.5	37%	0.374	52%	0.521	S	S	.	.	H	α-helix	trans	-72.2	-38.9	176.4	-34.4	0	0	0	0	111.5	S701 A707 L708	S701-T704 WeakPolarHBondContact O-CB 3.49Å; S701-T704 PolarHBondContact O-N 3.12Å; S701-T704 PolarHBondContact O-OG1 3.24Å; T704-A707 PolarHBondContact O-N 3.33Å; T704-L708 WeakPolarHBondContact O-CG 3.48Å; T704-L708 PolarHBondContact O-N 3.28Å; T704-L708 VanDerWaalsContact O-N 3.09Å
705	E	56.9	Low	46.6	Very low	28 Å²	28	99.2 Å²	99.2	13%	0.131	52%	0.52	C	S	.	.	H	α-helix	trans	-64.6	-42.9	173.1	-168.2	-171.6	148	0	0	110.9	R609 S701 L708 L709 L1068	R609-E705 IonicContact CZ-OE1 2.92Å; R609-E705 IonicContact CZ-OE2 3.67Å; R609-E705 IonicContact NE-OE1 3.2Å; R609-E705 PolarHBondContact NE-OE1 2.95Å; R609-E705 VanDerWaalsContact NH2-CD 3.32Å; R609-E705 IonicContact NH2-OE1 3.56Å; R609-E705 PolarHBondContact NH2-OE1 3.2Å; R609-E705 IonicContact NH2-OE2 2.69Å; R609-E705 PolarHBondContact NH2-OE2 3.26Å; S701-E705 PolarHBondContact O-N 3.45Å; E705-L708 PolarHBondContact O-N 3.45Å; E705-L709 HydrophobicContact CG-CD1 4.38Å; E705-L709 WeakPolarHBondContact O-CB 3.42Å; E705-L709 VanDerWaalsContact O-CG 3.3Å; E705-L709 WeakPolarHBondContact O-CG 3.3Å; E705-L709 PolarHBondContact O-N 3.39Å; E705-L1068 HydrophobicContact CG-CD1 3.7Å
706	K	55.4	Low	46.6	Very low	73 Å²	73	95.6 Å²	95.6	32%	0.317	51%	0.512	S	S	.	.	H	α-helix	trans	-64.3	-38.9	175.9	-176.7	168.3	175.7	132.8	0	112.2	D608 L702 D703 L709 L710	D608-K706 WeakPolarHBondContact OD2-CE 3.18Å; D608-K706 IonicContact OD2-NZ 3.92Å; D608-K706 PolarHBondContact OD2-NZ 3.44Å; L702-K706 VanDerWaalsContact O-CB 3.23Å; L702-K706 WeakPolarHBondContact O-CB 3.43Å; L702-K706 PolarHBondContact O-N 3.12Å; D703-K706 PolarHBondContact O-N 2.72Å; K706-L709 PolarHBondContact O-N 2.82Å; K706-L710 HydrophobicContact CG-CD1 3.77Å; K706-L710 HydrophobicContact CG-CG 4.49Å; K706-L710 WeakPolarHBondContact O-CB 3.3Å; K706-L710 WeakPolarHBondContact O-CG 2.88Å; K706-L710 PolarHBondContact O-N 3.5Å; K706-L710 VanDerWaalsContact O-N 3.12Å
707	A	55.8	Low	46.2	Very low	48 Å²	48	94.1 Å²	94.1	40%	0.397	51%	0.513	S	S	.	.	H	α-helix	trans	-60.3	-49.1	172.7	0	0	0	0	0	111.1	D703 T704 L709 L710 T711	D703-A707 WeakPolarHBondContact O-CB 3.37Å; D703-A707 PolarHBondContact O-N 3.49Å; T704-A707 PolarHBondContact O-N 3.33Å; A707-L709 VanDerWaalsContact C-N 3.33Å; A707-L709 PolarHBondContact O-N 3.4Å; A707-L710 CarbonylContact O-C 3.41Å; A707-L710 PolarHBondContact O-N 3.09Å; A707-T711 WeakPolarHBondContact O-CG2 3.37Å; A707-T711 PolarHBondContact O-N 3.31Å; A707-T711 PolarHBondContact O-OG1 3.43Å; A707-T711 VanDerWaalsContact O-OG1 3.08Å
708	L	56.3	Low	46	Very low	97 Å²	97	97.4 Å²	97.4	51%	0.508	53%	0.527	S	S	.	.	H	α-helix	trans	-63	-36	178	-70.3	170	0	0	0	113.4	T704 E705 L710 T711 R1062	T704-L708 WeakPolarHBondContact O-CG 3.48Å; T704-L708 PolarHBondContact O-N 3.28Å; T704-L708 VanDerWaalsContact O-N 3.09Å; E705-L708 PolarHBondContact O-N 3.45Å; L708-L710 VanDerWaalsContact C-N 3.26Å; L708-L710 PolarHBondContact O-N 2.89Å; L708-T711 PolarHBondContact O-OG1 2.93Å; L708-R1062 PolarHBondContact O-NH2 3.31Å
709	L	55.8	Low	45.8	Very low	20 Å²	20	95.3 Å²	95.3	11%	0.105	53%	0.526	C	S	.	.	H	α-helix	trans	-70.2	-21	174.7	-71.6	173.8	0	0	0	113	R609 A612 E705 K706 A707 R1062 L1064 L1068	R609-L709 HydrophobicContact CG-CD1 4.33Å; A612-L709 HydrophobicContact CB-CD2 3.77Å; E705-L709 HydrophobicContact CG-CD1 4.38Å; E705-L709 WeakPolarHBondContact O-CB 3.42Å; E705-L709 VanDerWaalsContact O-CG 3.3Å; E705-L709 WeakPolarHBondContact O-CG 3.3Å; E705-L709 PolarHBondContact O-N 3.39Å; K706-L709 PolarHBondContact O-N 2.82Å; A707-L709 VanDerWaalsContact C-N 3.33Å; A707-L709 PolarHBondContact O-N 3.4Å; L709-R1062 PolarHBondContact O-NH1 3.23Å; L709-L1064 HydrophobicContact CD2-CD2 4.15Å; L709-L1068 HydrophobicContact CD2-CD2 3.83Å; L709-L1068 HydrophobicContact CG-CD2 4.35Å
710	L	53.3	Low	45.2	Very low	62 Å²	62	91 Å²	91	33%	0.325	52%	0.516	S	S	.	.	H	α-helix	trans	-108.5	-19.5	-176.5	-65.2	173.9	0	0	0	114.3	K706 A707 L708 D712	K706-L710 HydrophobicContact CG-CD1 3.77Å; K706-L710 HydrophobicContact CG-CG 4.49Å; K706-L710 WeakPolarHBondContact O-CB 3.3Å; K706-L710 WeakPolarHBondContact O-CG 2.88Å; K706-L710 PolarHBondContact O-N 3.5Å; K706-L710 VanDerWaalsContact O-N 3.12Å; A707-L710 CarbonylContact O-C 3.41Å; A707-L710 PolarHBondContact O-N 3.09Å; L708-L710 VanDerWaalsContact C-N 3.26Å; L708-L710 PolarHBondContact O-N 2.89Å; L710-D712 PolarHBondContact O-N 3.5Å
711	T	50.4	Low	45.1	Very low	75 Å²	75	91.5 Å²	91.5	46%	0.46	53%	0.526	S	S	.	.			trans	-71.7	115.2	177.1	44.8	0	0	0	0	110.9	A707 L708 R1062	A707-T711 WeakPolarHBondContact O-CG2 3.37Å; A707-T711 PolarHBondContact O-N 3.31Å; A707-T711 PolarHBondContact O-OG1 3.43Å; A707-T711 VanDerWaalsContact O-OG1 3.08Å; L708-T711 PolarHBondContact O-OG1 2.93Å; T711-R1062 PolarHBondContact O-NH2 2.98Å
712	D	45.5	Very low	44.1	Very low	98 Å²	98	93.6 Å²	93.6	52%	0.524	55%	0.553	S	S	.	*			trans	-64.6	135	163.9	-82.6	-33.5	0	0	0	109.6	L710 D714	L710-D712 PolarHBondContact O-N 3.5Å; D712-D714 PolarHBondContact O-N 3.27Å
713	D	40.5	Very low	42.9	Very low	147 Å²	147	91.2 Å²	91.2	79%	0.786	56%	0.557	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63.6	6.3	177.7	-79.7	-60.5	0	0	0	114.4	D715	D713-D715 VanDerWaalsContact C-N 3.3Å; D713-D715 PolarHBondContact O-N 3.13Å
714	D	37.6	Very low	42.3	Very low	107 Å²	107	97.1 Å²	97.1	57%	0.572	58%	0.582	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.8	-4.5	-177.7	-119.5	9.9	0	0	0	113.3	D712 R742	D712-D714 PolarHBondContact O-N 3.27Å; D714-R742 IonicContact OD2-NH2 3.15Å; D714-R742 PolarHBondContact OD2-NH2 3.12Å; D714-R742 VanDerWaalsContact OD2-NH2 3.15Å
715	D	33.1	Very low	41.1	Very low	107 Å²	107	99.8 Å²	99.8	57%	0.572	60%	0.598	S	S	*	*	S	Bend	trans	-102.5	107	170.9	-97	-37.2	0	0	0	109.6	D713 L717 R739	D713-D715 VanDerWaalsContact C-N 3.3Å; D713-D715 PolarHBondContact O-N 3.13Å; D715-L717 PolarHBondContact O-N 3.06Å; D715-R739 IonicContact OD2-CZ 3.74Å; D715-R739 IonicContact OD2-NH2 2.76Å; D715-R739 PolarHBondContact OD2-NH2 3.32Å
716	P	33.2	Very low	40.3	Very low	102 Å²	102	104.3 Å²	104.3	66%	0.662	63%	0.633	S	S	*	*			trans	-61.1	125.8	174	25.4	-32.1	0	0	0	109	D718	P716-D718 PolarHBondContact O-N 3.15Å
717	L	29.7	Very low	39.7	Very low	168 Å²	168	106.9 Å²	106.9	88%	0.88	65%	0.646	S	S	*	*			trans	-62.2	67	169.6	-87.6	150.1	0	0	0	111.2	D715 T719	D715-L717 PolarHBondContact O-N 3.06Å; L717-T719 PolarHBondContact O-N 2.84Å
718	D	29.9	Very low	39.1	Very low	146 Å²	146	108.3 Å²	108.3	78%	0.781	65%	0.653	S	S	*	*			trans	-94.6	72.6	163.8	-84.6	-26.1	0	0	0	108.5	P716	P716-D718 PolarHBondContact O-N 3.15Å
719	T	30.1	Very low	38.7	Very low	126 Å²	126	109 Å²	109	77%	0.773	67%	0.665	S	S	*	*			trans	-115.9	67.3	159.6	-7.2	0	0	0	0	109.3	L717	L717-T719 PolarHBondContact O-N 2.84Å
720	A	27.7	Very low	38.6	Very low	86 Å²	86	110.4 Å²	110.4	71%	0.711	68%	0.68	S	S	*	*			trans	-73.9	126.5	156	0	0	0	0	0	108.3	G722	A720-G722 PolarHBondContact O-N 3.42Å
721	P	40.3	Very low	38.9	Very low	138 Å²	138	109.7 Å²	109.7	90%	0.896	68%	0.68	S	S	*	*	S	Bend	trans	-78.7	94	178	31.1	-30	0	0	0	108.5
722	G	32	Very low	39.5	Very low	75 Å²	75	109.5 Å²	109.5	77%	0.773	68%	0.679	S	S	*	*			trans	164.2	99.4	172.1	0	0	0	0	0	114.3	A720	A720-G722 PolarHBondContact O-N 3.42Å
723	G	29.4	Very low	40.5	Very low	69 Å²	69	112 Å²	112	71%	0.711	68%	0.681	S	S	*	*			trans	148.2	80.1	164.9	0	0	0	0	0	113.7	T725	G723-T725 PolarHBondContact O-N 2.97Å
724	Q	37.1	Very low	41.8	Very low	207 Å²	207	112.4 Å²	112.4	97%	0.967	67%	0.671	S	S	*	*			trans	-61.2	100.8	164	-75.5	176.7	-16.3	0	0	109.2
725	T	34.1	Very low	43.4	Very low	116 Å²	116	113.7 Å²	113.7	71%	0.712	67%	0.668	S	S	*	*			trans	-117.1	124.1	156.9	43.4	0	0	0	0	107.4	G723 Q727	G723-T725 PolarHBondContact O-N 2.97Å; T725-Q727 PolarHBondContact O-N 3.29Å
726	S	40.2	Very low	45.2	Very low	124 Å²	124	113.2 Å²	113.2	87%	0.867	66%	0.661	S	S	*	*			trans	-58.2	94.7	-179.6	50.6	0	0	0	0	110.7	S728	S726-S728 PolarHBondContact O-N 3.34Å
727	Q	41.6	Very low	47.2	Very low	126 Å²	126	109.3 Å²	109.3	59%	0.589	64%	0.635	S	S	*	*			trans	-68	119.9	172.7	-70	-171.9	11.1	0	0	109.1	T725 C729	T725-Q727 PolarHBondContact O-N 3.29Å; Q727-C729 PolarHBondContact O-N 2.95Å
728	S	43.7	Very low	49.4	Very low	78 Å²	78	106.4 Å²	106.4	55%	0.545	62%	0.619	S	S	.	*			trans	-62.3	131.9	178	172.7	0	0	0	0	111.2	S726 A730 S731	S726-S728 PolarHBondContact O-N 3.34Å; S728-A730 PolarHBondContact O-N 2.88Å; S728-S731 WeakPolarHBondContact O-CB 3.29Å; S728-S731 PolarHBondContact O-N 3.27Å; S728-S731 PolarHBondContact O-OG 3.05Å
729	C	47.4	Very low	51.6	Low	111 Å²	111	105 Å²	105	75%	0.75	60%	0.603	S	S	*	*	H	α-helix	trans	-52.7	-30.1	-179	-159.1	0	0	0	0	113.2	Q727 W733	Q727-C729 PolarHBondContact O-N 2.95Å; C729-W733 WeakPolarHBondContact O-CB 3.37Å; C729-W733 PolarHBondContact O-N 3.38Å; C729-W733 VanDerWaalsContact O-N 3.1Å
730	A	54.8	Low	54	Low	51 Å²	51	99.4 Å²	99.4	42%	0.421	57%	0.568	S	S	.	*	H	α-helix	trans	-67.8	-38.1	175.8	0	0	0	0	0	112.5	S728 V732 W733 W734	S728-A730 PolarHBondContact O-N 2.88Å; A730-V732 VanDerWaalsContact C-N 3.32Å; A730-V732 PolarHBondContact O-N 3.44Å; A730-W733 PolarHBondContact O-N 2.9Å; A730-W734 WeakPolarHBondContact O-CB 3.36Å; A730-W734 PolarHBondContact O-N 3.18Å
731	S	57.9	Low	56.5	Low	46 Å²	46	100.2 Å²	100.2	32%	0.322	55%	0.553	S	S	.	*	H	α-helix	trans	-70	-29.9	-179.7	74.1	0	0	0	0	113	S728 R735	S728-S731 WeakPolarHBondContact O-CB 3.29Å; S728-S731 PolarHBondContact O-N 3.27Å; S728-S731 PolarHBondContact O-OG 3.05Å; S731-R735 WeakPolarHBondContact O-CB 3.5Å; S731-R735 WeakPolarHBondContact O-CG 3.32Å; S731-R735 PolarHBondContact O-N 3.47Å; S731-R735 VanDerWaalsContact O-N 3.15Å; S731-R735 PolarHBondContact O-NE 2.76Å; S731-R735 VanDerWaalsContact O-NE 3.12Å; S731-R735 PolarHBondContact OG-NH2 2.85Å
732	V	64	Low	58.5	Low	72 Å²	72	101.6 Å²	101.6	44%	0.436	54%	0.54	S	S	.	.	H	α-helix	trans	-74.7	-44.1	175	-179.1	0	0	0	0	109.6	A730 R735 F736	A730-V732 VanDerWaalsContact C-N 3.32Å; A730-V732 PolarHBondContact O-N 3.44Å; V732-R735 PolarHBondContact O-N 2.95Å; V732-F736 WeakPolarHBondContact O-CB 3.35Å; V732-F736 PolarHBondContact O-N 3.32Å
733	W	66.8	Low	60.8	Low	151 Å²	151	100.6 Å²	100.6	57%	0.572	51%	0.513	S	S	*	.	H	α-helix	trans	-64.4	-43	176.2	-173.2	74.2	0	0	0	112.9	C729 A730 F736 L737	C729-W733 WeakPolarHBondContact O-CB 3.37Å; C729-W733 PolarHBondContact O-N 3.38Å; C729-W733 VanDerWaalsContact O-N 3.1Å; A730-W733 PolarHBondContact O-N 2.9Å; W733-F736 WeakPolarHBondContact O-CB 3.36Å; W733-F736 PolarHBondContact O-N 2.99Å; W733-L737 HydrophobicContact CD2-CD1 3.7Å; W733-L737 HydrophobicContact CD2-CG 4.28Å; W733-L737 HydrophobicContact CE3-CD1 3.54Å; W733-L737 HydrophobicContact CH2-CD1 3.54Å; W733-L737 HydrophobicContact CZ2-CD1 3.67Å; W733-L737 HydrophobicContact CZ2-CD2 4.35Å; W733-L737 HydrophobicContact CZ2-CG 4.4Å; W733-L737 HydrophobicContact CZ3-CD1 3.45Å; W733-L737 VanDerWaalsContact CZ3-CD1 3.45Å; W733-L737 VanDerWaalsContact O-CG 3.31Å; W733-L737 WeakPolarHBondContact O-CG 3.38Å; W733-L737 PolarHBondContact O-N 3.44Å
734	W	67.4	Low	63.5	Low	154 Å²	154	97.3 Å²	97.3	58%	0.583	48%	0.479	S	S	*	.	H	α-helix	trans	-64.1	-41.5	174	-85.5	101.2	0	0	0	112.4	A730 F736 L737 L738	A730-W734 WeakPolarHBondContact O-CB 3.36Å; A730-W734 PolarHBondContact O-N 3.18Å; W734-F736 VanDerWaalsContact C-N 3.33Å; W734-F736 PolarHBondContact O-N 2.76Å; W734-L737 PolarHBondContact O-N 2.83Å; W734-L738 WeakPolarHBondContact O-CB 3.39Å; W734-L738 WeakPolarHBondContact O-CD1 3.42Å; W734-L738 PolarHBondContact O-N 3.32Å
735	R	70.7	Confident	65.7	Low	134 Å²	134	90.1 Å²	90.1	51%	0.506	44%	0.443	S	S	.	.	H	α-helix	trans	-60.7	-41.7	172.6	-87.5	-178.6	-81	156.2	-6.4	111.8	S731 V732 L738 R739	S731-R735 WeakPolarHBondContact O-CB 3.5Å; S731-R735 WeakPolarHBondContact O-CG 3.32Å; S731-R735 PolarHBondContact O-N 3.47Å; S731-R735 VanDerWaalsContact O-N 3.15Å; S731-R735 PolarHBondContact O-NE 2.76Å; S731-R735 VanDerWaalsContact O-NE 3.12Å; S731-R735 PolarHBondContact OG-NH2 2.85Å; V732-R735 PolarHBondContact O-N 2.95Å; R735-L738 PolarHBondContact O-N 2.88Å; R735-R739 VanDerWaalsContact O-CB 3.28Å; R735-R739 WeakPolarHBondContact O-CB 3.48Å; R735-R739 PolarHBondContact O-N 3.01Å
736	F	71.4	Confident	67.9	Low	97 Å²	97	87.9 Å²	87.9	43%	0.425	43%	0.432	S	S	.	.	H	α-helix	trans	-61.2	-47.8	175.7	178	-95.8	0	0	0	112.2	V732 W733 W734 R739 R740	V732-F736 WeakPolarHBondContact O-CB 3.35Å; V732-F736 PolarHBondContact O-N 3.32Å; W733-F736 WeakPolarHBondContact O-CB 3.36Å; W733-F736 PolarHBondContact O-N 2.99Å; W734-F736 VanDerWaalsContact C-N 3.33Å; W734-F736 PolarHBondContact O-N 2.76Å; F736-R739 PolarHBondContact O-N 3.47Å; F736-R740 PolarHBondContact O-N 2.98Å
737	L	74.4	Confident	70.1	Confident	21 Å²	21	82.1 Å²	82.1	11%	0.11	39%	0.392	C	S	.	.	H	α-helix	trans	-62.5	-44.3	177.7	-68.7	170.8	0	0	0	112.6	W676 W733 W734 R740 W741	W676-L737 HydrophobicContact CB-CD2 4.11Å; W676-L737 HydrophobicContact CD2-CD2 4Å; W676-L737 HydrophobicContact CG-CD2 3.5Å; W676-L737 VanDerWaalsContact CG-CD2 3.5Å; W676-L737 PolarHBondContact NE1-O 2.71Å; W733-L737 HydrophobicContact CD2-CD1 3.7Å; W733-L737 HydrophobicContact CD2-CG 4.28Å; W733-L737 HydrophobicContact CE3-CD1 3.54Å; W733-L737 HydrophobicContact CH2-CD1 3.54Å; W733-L737 HydrophobicContact CZ2-CD1 3.67Å; W733-L737 HydrophobicContact CZ2-CD2 4.35Å; W733-L737 HydrophobicContact CZ2-CG 4.4Å; W733-L737 HydrophobicContact CZ3-CD1 3.45Å; W733-L737 VanDerWaalsContact CZ3-CD1 3.45Å; W733-L737 VanDerWaalsContact O-CG 3.31Å; W733-L737 WeakPolarHBondContact O-CG 3.38Å; W733-L737 PolarHBondContact O-N 3.44Å; W734-L737 PolarHBondContact O-N 2.83Å; L737-R740 PolarHBondContact O-N 3.48Å; L737-W741 VanDerWaalsContact O-CB 3.32Å; L737-W741 WeakPolarHBondContact O-CB 3.21Å; L737-W741 PolarHBondContact O-N 2.99Å
738	L	76.9	Confident	72.3	Confident	106 Å²	106	76.3 Å²	76.3	56%	0.555	37%	0.365	S	S	*	.	H	α-helix	trans	-66.1	-39.4	177.9	-85.9	151.2	0	0	0	111.8	W734 R735 W741 R742	W734-L738 WeakPolarHBondContact O-CB 3.39Å; W734-L738 WeakPolarHBondContact O-CD1 3.42Å; W734-L738 PolarHBondContact O-N 3.32Å; R735-L738 PolarHBondContact O-N 2.88Å; L738-W741 PolarHBondContact O-N 3.17Å; L738-R742 WeakPolarHBondContact O-CB 3.35Å; L738-R742 PolarHBondContact O-N 3.42Å
739	R	75.8	Confident	74.4	Confident	116 Å²	116	72.7 Å²	72.7	44%	0.438	34%	0.34	S	S	.	.	H	α-helix	trans	-62.6	-47.1	176.2	-167.4	178	-169.4	164.2	13.1	110.7	D715 R735 F736 R742 R743	D715-R739 IonicContact OD2-CZ 3.74Å; D715-R739 IonicContact OD2-NH2 2.76Å; D715-R739 PolarHBondContact OD2-NH2 3.32Å; R735-R739 VanDerWaalsContact O-CB 3.28Å; R735-R739 WeakPolarHBondContact O-CB 3.48Å; R735-R739 PolarHBondContact O-N 3.01Å; F736-R739 PolarHBondContact O-N 3.47Å; R739-R742 PolarHBondContact O-N 3.15Å; R739-R743 VanDerWaalsContact NE-NH2 3.14Å; R739-R743 VanDerWaalsContact NH2-NH2 3.14Å; R739-R743 WeakPolarHBondContact O-CB 3.19Å; R739-R743 VanDerWaalsContact O-CG 3.3Å; R739-R743 WeakPolarHBondContact O-CG 3.38Å; R739-R743 PolarHBondContact O-N 3.21Å
740	R	79.8	Confident	76.3	Confident	10 Å²	10	67.5 Å²	67.5	4%	0.038	31%	0.305	C	S	.	.	H	α-helix	trans	-65.8	-40	178.8	-157.5	171.5	177.2	119.8	-0.6	112.1	I675 T677 I680 F682 E685 F736 L737 F744	I675-R740 HydrophobicContact CG2-CG 4.2Å; I675-R740 PolarHBondContact O-NE 3.05Å; T677-R740 PolarHBondContact O-NH2 3.42Å; I680-R740 PolarHBondContact O-NH2 3.24Å; F682-R740 HydrophobicContact CD2-CG 4.07Å; F682-R740 HydrophobicContact CE1-CG 4.47Å; F682-R740 HydrophobicContact CE2-CG 3.43Å; F682-R740 VanDerWaalsContact CE2-CG 3.43Å; F682-R740 VanDerWaalsContact CE2-NE 3.32Å; F682-R740 HydrophobicContact CZ-CG 3.64Å; E685-R740 IonicContact OE1-CZ 2.82Å; E685-R740 IonicContact OE1-NH1 3.89Å; E685-R740 PolarHBondContact OE1-NH1 2.89Å; E685-R740 IonicContact OE2-NH1 3.94Å; F736-R740 PolarHBondContact O-N 2.98Å; L737-R740 PolarHBondContact O-N 3.48Å; R740-F744 WeakPolarHBondContact O-CB 3.31Å; R740-F744 PolarHBondContact O-N 2.93Å
741	W	81.9	Confident	77.8	Confident	102 Å²	102	65.4 Å²	65.4	39%	0.386	29%	0.286	S	S	.	.	H	α-helix	trans	-62.6	-50.4	173.8	-175.9	-93.3	0	0	0	112.1	P672 I675 W676 L737 L738 R743 F744 W745	P672-W741 HydrophobicContact CB-CH2 3.84Å; P672-W741 HydrophobicContact CB-CZ3 3.66Å; I675-W741 HydrophobicContact CD1-CE3 4.21Å; I675-W741 HydrophobicContact CD1-CZ3 4.07Å; W676-W741 HydrophobicContact CH2-CE3 4.28Å; W676-W741 HydrophobicContact CH2-CZ3 4.19Å; W676-W741 AromaticContact CZ2-CE3 3.72Å; W676-W741 HydrophobicContact CZ2-CE3 3.72Å; W676-W741 HydrophobicContact CZ2-CZ3 4.11Å; L737-W741 VanDerWaalsContact O-CB 3.32Å; L737-W741 WeakPolarHBondContact O-CB 3.21Å; L737-W741 PolarHBondContact O-N 2.99Å; L738-W741 PolarHBondContact O-N 3.17Å; W741-R743 PolarHBondContact O-N 3.42Å; W741-F744 PolarHBondContact O-N 3.39Å; W741-W745 AromaticContact CD1-CD1 3.89Å; W741-W745 AromaticContact CD2-CD1 3.63Å; W741-W745 AromaticContact CD2-NE1 3.54Å; W741-W745 AromaticContact CE2-CD1 3.39Å; W741-W745 AromaticContact CE2-NE1 3.25Å; W741-W745 VanDerWaalsContact CE2-NE1 3.25Å; W741-W745 AromaticContact CE3-NE1 3.7Å; W741-W745 AromaticContact CG-CD1 3.95Å; W741-W745 HydrophobicContact CH2-CZ2 4.32Å; W741-W745 AromaticContact CH2-NE1 3.38Å; W741-W745 AromaticContact CZ2-CD1 3.79Å; W741-W745 AromaticContact CZ2-NE1 3.18Å; W741-W745 AromaticContact CZ3-NE1 3.64Å; W741-W745 AromaticContact NE1-CD1 3.54Å; W741-W745 AromaticContact NE1-NE1 3.89Å; W741-W745 PolarHBondContact O-N 3.38Å; W741-W745 VanDerWaalsContact O-N 3.15Å
742	R	81.8	Confident	79.3	Confident	168 Å²	168	64 Å²	64	63%	0.634	28%	0.275	S	S	*	.	H	α-helix	trans	-59.5	-47.2	178.5	-178.3	176.3	169.5	-163.3	-10.8	111	D714 L738 R739 W745 S746	D714-R742 IonicContact OD2-NH2 3.15Å; D714-R742 PolarHBondContact OD2-NH2 3.12Å; D714-R742 VanDerWaalsContact OD2-NH2 3.15Å; L738-R742 WeakPolarHBondContact O-CB 3.35Å; L738-R742 PolarHBondContact O-N 3.42Å; R739-R742 PolarHBondContact O-N 3.15Å; R742-W745 PolarHBondContact O-N 3.11Å; R742-S746 WeakPolarHBondContact O-CB 3.05Å; R742-S746 PolarHBondContact O-N 3.2Å; R742-S746 PolarHBondContact O-OG 2.96Å
743	R	79.9	Confident	80.4	Confident	53 Å²	53	62.8 Å²	62.8	20%	0.2	26%	0.264	C	S	.	.	H	α-helix	trans	-64.5	-38.3	-179.4	-76.3	178.4	172.6	-175.5	-9.9	113.8	A655 F682 D684 R739 W741 S746 A747	A655-R743 HydrophobicContact CB-CB 4.21Å; A655-R743 HydrophobicContact CB-CG 4.16Å; F682-R743 HydrophobicContact CD1-CB 4.41Å; F682-R743 HydrophobicContact CE1-CB 4.11Å; D684-R743 IonicContact OD2-CZ 3.33Å; D684-R743 IonicContact OD2-NH1 2.84Å; D684-R743 PolarHBondContact OD2-NH1 3.37Å; D684-R743 IonicContact OD2-NH2 3.42Å; D684-R743 PolarHBondContact OD2-NH2 3.34Å; R739-R743 VanDerWaalsContact NE-NH2 3.14Å; R739-R743 VanDerWaalsContact NH2-NH2 3.14Å; R739-R743 WeakPolarHBondContact O-CB 3.19Å; R739-R743 VanDerWaalsContact O-CG 3.3Å; R739-R743 WeakPolarHBondContact O-CG 3.38Å; R739-R743 PolarHBondContact O-N 3.21Å; W741-R743 PolarHBondContact O-N 3.42Å; R743-S746 WeakPolarHBondContact CA-OG 3.48Å; R743-S746 PolarHBondContact O-OG 3.26Å; R743-A747 PolarHBondContact O-N 3.29Å
744	F	85.9	Confident	81.3	Confident	0 Å²	0	55.9 Å²	55.9	0%	0	24%	0.24	C	C	.	.	H	α-helix	trans	-64.1	-53.6	175.6	-178.9	-97.1	0	0	0	110.4	M656 I675 I680 F682 R740 W741 S746 A747 T750	M656-F744 HydrophobicContact CE-CD2 4.41Å; M656-F744 HydrophobicContact SD-CD2 3.76Å; M656-F744 HydrophobicContact SD-CE2 4.11Å; I675-F744 HydrophobicContact CD1-CB 4.49Å; I675-F744 HydrophobicContact CD1-CD1 3.48Å; I675-F744 VanDerWaalsContact CD1-CD1 3.48Å; I675-F744 HydrophobicContact CD1-CE1 3.71Å; I675-F744 HydrophobicContact CD1-CG 3.91Å; I675-F744 HydrophobicContact CD1-CZ 4.33Å; I675-F744 HydrophobicContact CG1-CD1 4.18Å; I675-F744 HydrophobicContact CG1-CD2 4.36Å; I675-F744 HydrophobicContact CG1-CE1 4.28Å; I675-F744 HydrophobicContact CG1-CE2 4.47Å; I675-F744 HydrophobicContact CG1-CG 4.21Å; I675-F744 HydrophobicContact CG1-CZ 4.42Å; I675-F744 HydrophobicContact CG2-CB 4.07Å; I675-F744 HydrophobicContact CG2-CG 4.24Å; I680-F744 HydrophobicContact CD1-CD2 3.89Å; I680-F744 HydrophobicContact CD1-CE2 3.57Å; F682-F744 HydrophobicContact CZ-CB 4.49Å; R740-F744 WeakPolarHBondContact O-CB 3.31Å; R740-F744 PolarHBondContact O-N 2.93Å; W741-F744 PolarHBondContact O-N 3.39Å; F744-S746 VanDerWaalsContact C-N 3.32Å; F744-S746 PolarHBondContact O-N 3.03Å; F744-A747 WeakPolarHBondContact O-CB 3.49Å; F744-A747 PolarHBondContact O-N 3.37Å; F744-T750 HydrophobicContact CD1-CG2 4.16Å; F744-T750 HydrophobicContact CD2-CG2 4.11Å; F744-T750 HydrophobicContact CE1-CG2 3.81Å; F744-T750 HydrophobicContact CE2-CG2 3.74Å; F744-T750 HydrophobicContact CG-CG2 4.32Å; F744-T750 HydrophobicContact CZ-CG2 3.59Å; F744-T750 WeakPolarHBondContact O-CG2 3.47Å; F744-T750 PolarHBondContact O-OG1 3.31Å
745	W	83.4	Confident	82.3	Confident	56 Å²	56	49.4 Å²	49.4	21%	0.212	22%	0.217	C	C	.	.	H	α-helix	trans	-75.2	-17.7	-176.2	-67.3	108.7	0	0	0	114.4	F669 W741 R742 A1031	F669-W745 AromaticContact CD2-CH2 3.83Å; F669-W745 HydrophobicContact CD2-CH2 3.83Å; F669-W745 AromaticContact CD2-CZ3 3.81Å; F669-W745 HydrophobicContact CD2-CZ3 3.81Å; F669-W745 AromaticContact CE2-CH2 3.8Å; F669-W745 HydrophobicContact CE2-CH2 3.8Å; F669-W745 AromaticContact CE2-CZ3 3.5Å; F669-W745 HydrophobicContact CE2-CZ3 3.5Å; F669-W745 HydrophobicContact CG-CH2 4.48Å; F669-W745 HydrophobicContact CZ-CH2 4.4Å; F669-W745 HydrophobicContact CZ-CZ3 4.3Å; W741-W745 AromaticContact CD1-CD1 3.89Å; W741-W745 AromaticContact CD2-CD1 3.63Å; W741-W745 AromaticContact CD2-NE1 3.54Å; W741-W745 AromaticContact CE2-CD1 3.39Å; W741-W745 AromaticContact CE2-NE1 3.25Å; W741-W745 VanDerWaalsContact CE2-NE1 3.25Å; W741-W745 AromaticContact CE3-NE1 3.7Å; W741-W745 AromaticContact CG-CD1 3.95Å; W741-W745 HydrophobicContact CH2-CZ2 4.32Å; W741-W745 AromaticContact CH2-NE1 3.38Å; W741-W745 AromaticContact CZ2-CD1 3.79Å; W741-W745 AromaticContact CZ2-NE1 3.18Å; W741-W745 AromaticContact CZ3-NE1 3.64Å; W741-W745 AromaticContact NE1-CD1 3.54Å; W741-W745 AromaticContact NE1-NE1 3.89Å; W741-W745 PolarHBondContact O-N 3.38Å; W741-W745 VanDerWaalsContact O-N 3.15Å; R742-W745 PolarHBondContact O-N 3.11Å; W745-A1031 WeakPolarHBondContact O-CB 3.38Å
746	S	81.3	Confident	83.1	Confident	70 Å²	70	43.9 Å²	43.9	49%	0.49	20%	0.197	S	C	.	.	T	Hydrogen-bonded Turn	trans	-81.9	-11.5	173.6	66.8	0	0	0	0	113.7	R742 R743 F744	R742-S746 WeakPolarHBondContact O-CB 3.05Å; R742-S746 PolarHBondContact O-N 3.2Å; R742-S746 PolarHBondContact O-OG 2.96Å; R743-S746 WeakPolarHBondContact CA-OG 3.48Å; R743-S746 PolarHBondContact O-OG 3.26Å; F744-S746 VanDerWaalsContact C-N 3.32Å; F744-S746 PolarHBondContact O-N 3.03Å
747	A	84.6	Confident	84	Confident	2 Å²	2	41.6 Å²	41.6	2%	0.017	19%	0.189	C	C	.	.	S	Bend	trans	-72.4	134.9	-178.2	0	0	0	0	0	111.5	M656 R743 F744 V749 T750 V751	M656-A747 HydrophobicContact CE-CB 3.29Å; R743-A747 PolarHBondContact O-N 3.29Å; F744-A747 WeakPolarHBondContact O-CB 3.49Å; F744-A747 PolarHBondContact O-N 3.37Å; A747-V749 VanDerWaalsContact C-N 3.26Å; A747-V749 HydrophobicContact CB-CG1 4.17Å; A747-V749 PolarHBondContact O-N 2.92Å; A747-T750 PolarHBondContact O-N 3.49Å; A747-T750 VanDerWaalsContact O-N 3.11Å; A747-T750 PolarHBondContact O-OG1 3.46Å; A747-V751 WeakPolarHBondContact O-CG2 3.29Å; A747-V751 PolarHBondContact O-N 2.92Å; A747-V751 VanDerWaalsContact O-N 3.17Å
748	P	87.8	Confident	84.7	Confident	5 Å²	5	42.6 Å²	42.6	3%	0.032	19%	0.194	C	C	.	.	H	α-helix	trans	-56.6	-38.3	-178.3	-27.6	35.3	0	0	0	113.5	L651 W652 T750 V751 F752 H1027	L651-P748 WeakPolarHBondContact O-CG 3.26Å; W652-P748 HydrophobicContact CE3-CB 3.84Å; W652-P748 HydrophobicContact CZ3-CB 4.15Å; W652-P748 WeakPolarHBondContact O-CD 3.47Å; P748-T750 PolarHBondContact O-N 3.17Å; P748-V751 PolarHBondContact O-N 3.42Å; P748-F752 WeakPolarHBondContact O-CB 3.18Å; P748-F752 PolarHBondContact O-N 3.43Å; P748-H1027 HydrophobicContact CG-CB 4.26Å
749	V	88.1	Confident	85.4	Confident	2 Å²	2	38.8 Å²	38.8	1%	0.012	17%	0.172	C	C	.	.	H	α-helix	trans	-59	-41.6	177.5	62.8	0	0	0	0	113.2	W652 W653 M656 L665 A747 F752 F753	W652-V749 HydrophobicContact CD2-CB 4.27Å; W652-V749 HydrophobicContact CG-CB 4.42Å; W652-V749 HydrophobicContact CZ2-CB 4.17Å; W652-V749 HydrophobicContact CZ2-CG2 4.21Å; W652-V749 WeakPolarHBondContact O-CB 3.16Å; W652-V749 PolarHBondContact O-N 3.09Å; W652-V749 VanDerWaalsContact O-N 3.09Å; W653-V749 HydrophobicContact CD2-CG1 4.5Å; W653-V749 HydrophobicContact CE3-CG1 3.94Å; W653-V749 HydrophobicContact CZ3-CG1 4.36Å; W653-V749 HydrophobicContact CZ3-CG2 4.48Å; M656-V749 HydrophobicContact CE-CG1 3.65Å; L665-V749 HydrophobicContact CD1-CB 4.46Å; L665-V749 HydrophobicContact CD1-CG1 3.84Å; L665-V749 HydrophobicContact CD1-CG2 3.79Å; A747-V749 VanDerWaalsContact C-N 3.26Å; A747-V749 HydrophobicContact CB-CG1 4.17Å; A747-V749 PolarHBondContact O-N 2.92Å; V749-F752 PolarHBondContact O-N 3.49Å; V749-F753 HydrophobicContact CG2-CD2 3.93Å; V749-F753 HydrophobicContact CG2-CE2 3.87Å; V749-F753 VanDerWaalsContact O-CD2 3.25Å; V749-F753 WeakPolarHBondContact O-CD2 3.49Å; V749-F753 PolarHBondContact O-N 2.93Å
750	T	87.1	Confident	86.1	Confident	1 Å²	1	37.3 Å²	37.3	1%	0.006	17%	0.169	C	C	.	.	H	α-helix	trans	-74.1	-35.7	179.1	53.2	0	0	0	0	111.3	M656 L665 F744 A747 P748 F752 F753 G754	M656-T750 HydrophobicContact CE-CG2 3.92Å; L665-T750 HydrophobicContact CD1-CG2 4.07Å; L665-T750 HydrophobicContact CG-CG2 4.39Å; F744-T750 HydrophobicContact CD1-CG2 4.16Å; F744-T750 HydrophobicContact CD2-CG2 4.11Å; F744-T750 HydrophobicContact CE1-CG2 3.81Å; F744-T750 HydrophobicContact CE2-CG2 3.74Å; F744-T750 HydrophobicContact CG-CG2 4.32Å; F744-T750 HydrophobicContact CZ-CG2 3.59Å; F744-T750 WeakPolarHBondContact O-CG2 3.47Å; F744-T750 PolarHBondContact O-OG1 3.31Å; A747-T750 PolarHBondContact O-N 3.49Å; A747-T750 VanDerWaalsContact O-N 3.11Å; A747-T750 PolarHBondContact O-OG1 3.46Å; P748-T750 PolarHBondContact O-N 3.17Å; T750-F752 VanDerWaalsContact C-N 3.32Å; T750-F753 PolarHBondContact O-N 2.96Å; T750-G754 PolarHBondContact O-N 3.25Å
751	V	87.1	Confident	86.7	Confident	7 Å²	7	39 Å²	39	4%	0.042	19%	0.185	C	C	.	.	H	α-helix	trans	-62.5	-42.1	173.9	177.2	0	0	0	0	110.3	A747 P748 G754 N755 R1029 A1031	A747-V751 WeakPolarHBondContact O-CG2 3.29Å; A747-V751 PolarHBondContact O-N 2.92Å; A747-V751 VanDerWaalsContact O-N 3.17Å; P748-V751 PolarHBondContact O-N 3.42Å; V751-G754 PolarHBondContact O-N 3Å; V751-N755 WeakPolarHBondContact O-CB 3.18Å; V751-N755 PolarHBondContact O-N 3.02Å; V751-N755 PolarHBondContact O-ND2 3.49Å; V751-R1029 HydrophobicContact CG1-CB 4.47Å; V751-A1031 HydrophobicContact CG2-CB 4.34Å
752	F	88.7	Confident	87.3	Confident	16 Å²	16	34.1 Å²	34.1	7%	0.07	17%	0.167	C	C	.	.	H	α-helix	trans	-60.1	-55.9	173.7	173.5	-98	0	0	0	111.8	W652 P748 V749 T750 G754 N755 V756 I869 I872 Y1026	W652-F752 HydrophobicContact CH2-CB 3.37Å; W652-F752 HydrophobicContact CH2-CD1 4.15Å; W652-F752 AromaticContact CH2-CD2 3.99Å; W652-F752 HydrophobicContact CH2-CD2 3.99Å; W652-F752 AromaticContact CH2-CG 3.57Å; W652-F752 HydrophobicContact CH2-CG 3.57Å; W652-F752 HydrophobicContact CZ2-CB 3.82Å; W652-F752 HydrophobicContact CZ2-CD1 4Å; W652-F752 AromaticContact CZ2-CG 3.9Å; W652-F752 HydrophobicContact CZ2-CG 3.9Å; W652-F752 HydrophobicContact CZ3-CB 4.35Å; P748-F752 WeakPolarHBondContact O-CB 3.18Å; P748-F752 PolarHBondContact O-N 3.43Å; V749-F752 PolarHBondContact O-N 3.49Å; T750-F752 VanDerWaalsContact C-N 3.32Å; F752-G754 VanDerWaalsContact C-N 3.26Å; F752-G754 PolarHBondContact O-N 3.45Å; F752-N755 WeakPolarHBondContact O-CB 3.46Å; F752-N755 PolarHBondContact O-N 3.13Å; F752-V756 HydrophobicContact CD1-CG2 4.19Å; F752-V756 HydrophobicContact CD2-CG2 4.29Å; F752-V756 HydrophobicContact CE1-CG2 3.73Å; F752-V756 HydrophobicContact CE2-CG2 3.85Å; F752-V756 HydrophobicContact CG-CG2 4.44Å; F752-V756 HydrophobicContact CZ-CG2 3.53Å; F752-V756 WeakPolarHBondContact O-CG2 3.45Å; F752-V756 PolarHBondContact O-N 3.07Å; F752-I869 HydrophobicContact CE2-CG2 4.05Å; F752-I869 HydrophobicContact CZ-CG2 3.96Å; F752-I872 HydrophobicContact CD2-CD1 4.46Å; F752-I872 HydrophobicContact CE1-CG2 4.14Å; F752-I872 HydrophobicContact CE2-CD1 4.38Å; F752-I872 HydrophobicContact CE2-CG2 4.02Å; F752-I872 HydrophobicContact CZ-CG2 3.53Å; F752-Y1026 HydrophobicContact CB-CD1 4.32Å; F752-Y1026 HydrophobicContact CB-CE1 4.48Å; F752-Y1026 HydrophobicContact CD2-CD1 4.42Å; F752-Y1026 HydrophobicContact CD2-CD2 4.14Å; F752-Y1026 AromaticContact CD2-CE1 3.98Å; F752-Y1026 HydrophobicContact CD2-CE1 3.98Å; F752-Y1026 AromaticContact CD2-CE2 3.68Å; F752-Y1026 HydrophobicContact CD2-CE2 3.68Å; F752-Y1026 AromaticContact CD2-CZ 3.6Å; F752-Y1026 HydrophobicContact CE2-CE2 4.18Å
753	F	87.2	Confident	87.8	Confident	47 Å²	47	26.7 Å²	26.7	21%	0.206	14%	0.139	C	C	.	.	H	α-helix	trans	-59.5	-37.9	179.5	-84.6	-70.6	0	0	0	112.6	I662 L665 V666 V749 T750 V756 I757	I662-F753 HydrophobicContact CG2-CE1 4.35Å; I662-F753 HydrophobicContact CG2-CE2 4.09Å; I662-F753 HydrophobicContact CG2-CZ 3.55Å; L665-F753 HydrophobicContact CD2-CB 4.3Å; L665-F753 HydrophobicContact CD2-CD2 3.46Å; L665-F753 VanDerWaalsContact CD2-CD2 3.46Å; L665-F753 HydrophobicContact CD2-CE2 3.98Å; L665-F753 HydrophobicContact CD2-CG 3.99Å; V666-F753 HydrophobicContact CG2-CE1 4.47Å; V749-F753 HydrophobicContact CG2-CD2 3.93Å; V749-F753 HydrophobicContact CG2-CE2 3.87Å; V749-F753 VanDerWaalsContact O-CD2 3.25Å; V749-F753 WeakPolarHBondContact O-CD2 3.49Å; V749-F753 PolarHBondContact O-N 2.93Å; T750-F753 PolarHBondContact O-N 2.96Å; F753-V756 PolarHBondContact O-N 2.66Å; F753-I757 WeakPolarHBondContact O-CB 3.35Å; F753-I757 VanDerWaalsContact O-CG1 3.29Å; F753-I757 WeakPolarHBondContact O-CG1 3.42Å; F753-I757 PolarHBondContact O-N 3Å
754	G	86.9	Confident	88.5	Confident	7 Å²	7	28.2 Å²	28.2	7%	0.072	16%	0.158	C	C	.	.	H	α-helix	trans	-59.3	-47.4	173.1	0	0	0	0	0	112.3	T750 V751 F752 M758	T750-G754 PolarHBondContact O-N 3.25Å; V751-G754 PolarHBondContact O-N 3Å; F752-G754 VanDerWaalsContact C-N 3.26Å; F752-G754 PolarHBondContact O-N 3.45Å; G754-M758 VanDerWaalsContact O-CB 3.29Å; G754-M758 WeakPolarHBondContact O-CB 3.35Å; G754-M758 WeakPolarHBondContact O-CG 3.37Å; G754-M758 PolarHBondContact O-N 3.44Å
755	N	87.4	Confident	88.8	Confident	18 Å²	18	29.8 Å²	29.8	10%	0.096	17%	0.166	C	C	.	.	H	α-helix	trans	-62.3	-42.6	175.3	-77.3	-51.9	0	0	0	112.3	V751 F752 M758 Y759 Y1026 A1033 P1034	V751-N755 WeakPolarHBondContact O-CB 3.18Å; V751-N755 PolarHBondContact O-N 3.02Å; V751-N755 PolarHBondContact O-ND2 3.49Å; F752-N755 WeakPolarHBondContact O-CB 3.46Å; F752-N755 PolarHBondContact O-N 3.13Å; N755-M758 PolarHBondContact O-N 3.23Å; N755-Y759 WeakPolarHBondContact O-CB 3.33Å; N755-Y759 PolarHBondContact O-N 2.92Å; N755-Y1026 HydrophobicContact CB-CE1 4.44Å; N755-A1033 WeakPolarHBondContact OD1-CA 3.42Å; N755-A1033 WeakPolarHBondContact OD1-CB 3.32Å; N755-P1034 WeakPolarHBondContact OD1-CD 3.49Å
756	V	88.8	Confident	89.3	Confident	17 Å²	17	27.3 Å²	27.3	10%	0.103	16%	0.157	C	C	.	.	H	α-helix	trans	-62.7	-49.7	178.8	176.2	0	0	0	0	111.6	F752 F753 M758 Y759 F760 I869	F752-V756 HydrophobicContact CD1-CG2 4.19Å; F752-V756 HydrophobicContact CD2-CG2 4.29Å; F752-V756 HydrophobicContact CE1-CG2 3.73Å; F752-V756 HydrophobicContact CE2-CG2 3.85Å; F752-V756 HydrophobicContact CG-CG2 4.44Å; F752-V756 HydrophobicContact CZ-CG2 3.53Å; F752-V756 WeakPolarHBondContact O-CG2 3.45Å; F752-V756 PolarHBondContact O-N 3.07Å; F753-V756 PolarHBondContact O-N 2.66Å; V756-M758 VanDerWaalsContact C-N 3.33Å; V756-M758 PolarHBondContact O-N 3.38Å; V756-Y759 PolarHBondContact O-N 3.34Å; V756-F760 HydrophobicContact CG1-CD2 3.82Å; V756-F760 HydrophobicContact CG1-CE2 3.68Å; V756-F760 VanDerWaalsContact O-CD2 3.27Å; V756-F760 WeakPolarHBondContact O-CD2 3.46Å; V756-F760 PolarHBondContact O-N 3.24Å; V756-I869 HydrophobicContact CG1-CG2 4.46Å; V756-I869 HydrophobicContact CG2-CG2 3.46Å; V756-I869 VanDerWaalsContact CG2-CG2 3.46Å
757	I	88.8	Confident	89.9	Confident	49 Å²	49	26.2 Å²	26.2	25%	0.251	15%	0.147	S	C	.	.	H	α-helix	trans	-61.7	-45.2	-179.5	-68.8	166.2	0	0	0	110.2	F669 F670 F753 Y759 F760 A761	F669-I757 HydrophobicContact CD1-CD1 3.64Å; F669-I757 HydrophobicContact CE1-CD1 3.49Å; F669-I757 VanDerWaalsContact CE1-CD1 3.49Å; F669-I757 HydrophobicContact CE1-CG2 4.49Å; F669-I757 HydrophobicContact CG-CD1 4.33Å; F669-I757 HydrophobicContact CZ-CD1 4.05Å; F670-I757 HydrophobicContact CE2-CD1 4.29Å; F670-I757 HydrophobicContact CZ-CD1 3.99Å; F753-I757 WeakPolarHBondContact O-CB 3.35Å; F753-I757 VanDerWaalsContact O-CG1 3.29Å; F753-I757 WeakPolarHBondContact O-CG1 3.42Å; F753-I757 PolarHBondContact O-N 3Å; I757-Y759 VanDerWaalsContact C-N 3.3Å; I757-Y759 PolarHBondContact O-N 2.78Å; I757-F760 PolarHBondContact O-N 2.85Å; I757-A761 PolarHBondContact O-N 2.66Å
758	M	89.3	Confident	90.3	Very high	43 Å²	43	31.4 Å²	31.4	21%	0.212	17%	0.167	C	C	.	.	H	α-helix	trans	-65.9	-33.6	177.7	-69	-57.7	-74.6	0	0	112.1	G754 N755 V756 A761 F762 W791 A1033 P1034 F1036	G754-M758 VanDerWaalsContact O-CB 3.29Å; G754-M758 WeakPolarHBondContact O-CB 3.35Å; G754-M758 WeakPolarHBondContact O-CG 3.37Å; G754-M758 PolarHBondContact O-N 3.44Å; N755-M758 PolarHBondContact O-N 3.23Å; V756-M758 VanDerWaalsContact C-N 3.33Å; V756-M758 PolarHBondContact O-N 3.38Å; M758-A761 WeakPolarHBondContact O-CB 3.27Å; M758-A761 PolarHBondContact O-N 2.95Å; M758-F762 PolarHBondContact O-N 3.12Å; M758-W791 HydrophobicContact CB-CZ2 4.13Å; M758-W791 HydrophobicContact CE-CH2 3.36Å; M758-W791 HydrophobicContact CE-CZ2 3.71Å; M758-W791 HydrophobicContact CE-CZ3 4.33Å; M758-W791 VanDerWaalsContact O-CZ2 3.29Å; M758-W791 WeakPolarHBondContact O-CZ2 3.38Å; M758-W791 HydrophobicContact SD-CH2 4.47Å; M758-A1033 HydrophobicContact CB-CB 4.13Å; M758-A1033 HydrophobicContact CG-CB 3.81Å; M758-P1034 VanDerWaalsContact CE-O 3.32Å; M758-P1034 WeakPolarHBondContact CE-O 3.03Å; M758-F1036 HydrophobicContact CE-CD2 4.4Å; M758-F1036 HydrophobicContact CE-CE2 4.08Å
759	Y	90.9	Very high	90.4	Very high	25 Å²	25	31.4 Å²	31.4	10%	0.098	17%	0.166	C	C	.	.	H	α-helix	trans	-68.3	-39.8	175.3	-165.3	-99.4	0	0	0	112.7	N755 V756 I757 A761 F762 L763 F862 R865 L866 I869	N755-Y759 WeakPolarHBondContact O-CB 3.33Å; N755-Y759 PolarHBondContact O-N 2.92Å; V756-Y759 PolarHBondContact O-N 3.34Å; I757-Y759 VanDerWaalsContact C-N 3.3Å; I757-Y759 PolarHBondContact O-N 2.78Å; Y759-A761 VanDerWaalsContact C-N 3.33Å; Y759-F762 HydrophobicContact CD2-CD1 4.23Å; Y759-F762 HydrophobicContact CE2-CD1 4.03Å; Y759-F762 HydrophobicContact CE2-CE1 4.29Å; Y759-F762 WeakPolarHBondContact O-CB 3.23Å; Y759-F762 PolarHBondContact O-N 3.11Å; Y759-L763 HydrophobicContact CD1-CD1 4.07Å; Y759-L763 HydrophobicContact CD1-CG 4.32Å; Y759-L763 HydrophobicContact CE1-CD1 3.8Å; Y759-L763 HydrophobicContact CE1-CD2 4.37Å; Y759-L763 HydrophobicContact CE1-CG 4.06Å; Y759-L763 PolarHBondContact O-N 2.85Å; Y759-F862 PolarHBondContact OH-O 3.49Å; Y759-R865 WeakPolarHBondContact OH-CB 3.2Å; Y759-L866 HydrophobicContact CD1-CD2 3.49Å; Y759-L866 VanDerWaalsContact CD1-CD2 3.49Å; Y759-L866 HydrophobicContact CD1-CG 4.41Å; Y759-L866 HydrophobicContact CE1-CD2 3.59Å; Y759-L866 HydrophobicContact CE1-CG 4.03Å; Y759-I869 HydrophobicContact CD1-CD1 3.84Å; Y759-I869 HydrophobicContact CE1-CD1 4.24Å; Y759-I869 HydrophobicContact CG-CD1 4.09Å
760	F	92.1	Very high	90.6	Very high	85 Å²	85	32 Å²	32	37%	0.373	17%	0.17	S	C	.	.	H	α-helix	trans	-62.6	-41.1	170.8	-83.8	-71.8	0	0	0	111.8	V756 I757 F762 L763 C764 L866 F870	V756-F760 HydrophobicContact CG1-CD2 3.82Å; V756-F760 HydrophobicContact CG1-CE2 3.68Å; V756-F760 VanDerWaalsContact O-CD2 3.27Å; V756-F760 WeakPolarHBondContact O-CD2 3.46Å; V756-F760 PolarHBondContact O-N 3.24Å; I757-F760 PolarHBondContact O-N 2.85Å; F760-F762 VanDerWaalsContact C-N 3.31Å; F760-F762 PolarHBondContact O-N 3.02Å; F760-L763 PolarHBondContact O-N 2.97Å; F760-C764 PolarHBondContact O-N 2.99Å; F760-C764 PolarHBondContact O-SG 3.23Å; F760-C764 VanDerWaalsContact O-SG 3.33Å; F760-L866 HydrophobicContact CE1-CD1 4.12Å; F760-L866 HydrophobicContact CE1-CD2 4.23Å; F760-L866 HydrophobicContact CE2-CD2 4.39Å; F760-L866 HydrophobicContact CZ-CD1 4.41Å; F760-L866 HydrophobicContact CZ-CD2 4Å; F760-F870 HydrophobicContact CE2-CZ 4.4Å; F760-F870 AromaticContact CZ-CZ 3.94Å; F760-F870 HydrophobicContact CZ-CZ 3.94Å
761	A	92.3	Very high	90.7	Very high	45 Å²	45	37.4 Å²	37.4	37%	0.372	20%	0.198	S	C	.	.	H	α-helix	trans	-61.2	-40.1	174.2	0	0	0	0	0	111.9	I757 M758 Y759 C764 L765 W791	I757-A761 PolarHBondContact O-N 2.66Å; M758-A761 WeakPolarHBondContact O-CB 3.27Å; M758-A761 PolarHBondContact O-N 2.95Å; Y759-A761 VanDerWaalsContact C-N 3.33Å; A761-C764 PolarHBondContact O-N 2.83Å; A761-L765 WeakPolarHBondContact O-CB 3.35Å; A761-L765 PolarHBondContact O-N 3.37Å; A761-W791 HydrophobicContact CB-CH2 4.47Å
762	F	93.5	Very high	90.7	Very high	0 Å²	0	43.2 Å²	43.2	0%	0	23%	0.228	C	C	.	.	H	α-helix	trans	-59.1	-48.4	172.6	163.2	-102.6	0	0	0	112.2	M758 Y759 F760 C764 L765 F766 L788 W791 V792 L795 F862	M758-F762 PolarHBondContact O-N 3.12Å; Y759-F762 HydrophobicContact CD2-CD1 4.23Å; Y759-F762 HydrophobicContact CE2-CD1 4.03Å; Y759-F762 HydrophobicContact CE2-CE1 4.29Å; Y759-F762 WeakPolarHBondContact O-CB 3.23Å; Y759-F762 PolarHBondContact O-N 3.11Å; F760-F762 VanDerWaalsContact C-N 3.31Å; F760-F762 PolarHBondContact O-N 3.02Å; F762-C764 PolarHBondContact O-N 3.31Å; F762-L765 PolarHBondContact O-N 3.41Å; F762-F766 HydrophobicContact CE2-CD2 4.29Å; F762-F766 AromaticContact CZ-CD2 3.88Å; F762-F766 HydrophobicContact CZ-CD2 3.88Å; F762-F766 WeakPolarHBondContact O-CB 3.48Å; F762-F766 PolarHBondContact O-N 3.42Å; F762-L788 HydrophobicContact CD2-CD1 3.92Å; F762-L788 HydrophobicContact CE2-CD1 3.53Å; F762-L788 HydrophobicContact CZ-CD1 4.43Å; F762-W791 HydrophobicContact CB-CD2 4.39Å; F762-W791 HydrophobicContact CB-CZ2 4.05Å; F762-W791 HydrophobicContact CD2-CB 4.23Å; F762-W791 AromaticContact CD2-CD1 3.63Å; F762-W791 HydrophobicContact CD2-CD2 4.34Å; F762-W791 AromaticContact CD2-CG 3.82Å; F762-W791 HydrophobicContact CD2-CG 3.82Å; F762-V792 HydrophobicContact CE2-CG2 3.72Å; F762-V792 HydrophobicContact CZ-CG2 4.03Å; F762-L795 HydrophobicContact CZ-CD1 4.49Å; F762-F862 HydrophobicContact CE1-CB 4.31Å; F762-F862 AromaticContact CE1-CD1 3.91Å; F762-F862 HydrophobicContact CE1-CD1 3.91Å; F762-F862 HydrophobicContact CE1-CE1 4.38Å; F762-F862 HydrophobicContact CE1-CG 4.04Å; F762-F862 HydrophobicContact CZ-CD1 4.19Å; F762-F862 HydrophobicContact CZ-CD2 4.42Å; F762-F862 HydrophobicContact CZ-CE1 4.28Å; F762-F862 HydrophobicContact CZ-CE2 4.5Å; F762-F862 HydrophobicContact CZ-CG 4.26Å; F762-F862 HydrophobicContact CZ-CZ 4.44Å
763	L	93.4	Very high	90.4	Very high	12 Å²	12	43.2 Å²	43.2	6%	0.063	23%	0.229	C	C	.	.	H	α-helix	trans	-64.5	-39	178.1	-68.7	177.4	0	0	0	112.4	Y759 F760 F766 T767 F859 F862 L866	Y759-L763 HydrophobicContact CD1-CD1 4.07Å; Y759-L763 HydrophobicContact CD1-CG 4.32Å; Y759-L763 HydrophobicContact CE1-CD1 3.8Å; Y759-L763 HydrophobicContact CE1-CD2 4.37Å; Y759-L763 HydrophobicContact CE1-CG 4.06Å; Y759-L763 PolarHBondContact O-N 2.85Å; F760-L763 PolarHBondContact O-N 2.97Å; L763-F766 PolarHBondContact O-N 3.19Å; L763-T767 WeakPolarHBondContact O-CB 3.49Å; L763-T767 PolarHBondContact O-N 3.24Å; L763-T767 PolarHBondContact O-OG1 2.91Å; L763-F859 HydrophobicContact CB-CE2 4.48Å; L763-F859 HydrophobicContact CD2-CD2 4.5Å; L763-F859 HydrophobicContact CD2-CE2 4.11Å; L763-F862 HydrophobicContact CD2-CB 4.07Å; L763-L866 HydrophobicContact CD1-CD1 3.66Å; L763-L866 HydrophobicContact CD1-CD2 3.99Å; L763-L866 HydrophobicContact CD1-CG 3.89Å
764	C	93.8	Very high	90.1	Very high	86 Å²	86	42.1 Å²	42.1	58%	0.581	22%	0.224	S	C	*	.	H	α-helix	trans	-62.8	-43.4	173.7	-71	0	0	0	0	111.5	F760 A761 F762 T767 Y768	F760-C764 PolarHBondContact O-N 2.99Å; F760-C764 PolarHBondContact O-SG 3.23Å; F760-C764 VanDerWaalsContact O-SG 3.33Å; A761-C764 PolarHBondContact O-N 2.83Å; F762-C764 PolarHBondContact O-N 3.31Å; C764-T767 PolarHBondContact O-N 3.45Å; C764-Y768 WeakPolarHBondContact O-CB 3.47Å; C764-Y768 PolarHBondContact O-N 3.45Å
765	L	92.8	Very high	89.8	Confident	33 Å²	33	45.6 Å²	45.6	17%	0.173	24%	0.237	C	C	.	.	H	α-helix	trans	-63.7	-44.3	175.7	-178.7	65.7	0	0	0	111.4	A761 F762 T767 Y768 V769 P784 M787 L788 W791	A761-L765 WeakPolarHBondContact O-CB 3.35Å; A761-L765 PolarHBondContact O-N 3.37Å; F762-L765 PolarHBondContact O-N 3.41Å; L765-T767 VanDerWaalsContact C-N 3.35Å; L765-T767 PolarHBondContact O-N 2.88Å; L765-Y768 WeakPolarHBondContact O-CB 3.3Å; L765-Y768 PolarHBondContact O-N 3.14Å; L765-V769 HydrophobicContact CD1-CG2 4.5Å; L765-V769 WeakPolarHBondContact O-CG2 3.5Å; L765-V769 PolarHBondContact O-N 3.41Å; L765-P784 HydrophobicContact CD1-CB 4.16Å; L765-M787 HydrophobicContact CD2-CB 4.26Å; L765-L788 HydrophobicContact CD2-CB 4.44Å; L765-W791 HydrophobicContact CD2-CE3 4.49Å
766	F	93.7	Very high	89.2	Confident	4 Å²	4	47.9 Å²	47.9	2%	0.018	26%	0.255	C	S	.	.	H	α-helix	trans	-58.7	-48.4	176.2	-161.1	-52.6	0	0	0	110.5	F762 L763 Y768 V769 L770 L788 F835 L855 F859 F862	F762-F766 HydrophobicContact CE2-CD2 4.29Å; F762-F766 AromaticContact CZ-CD2 3.88Å; F762-F766 HydrophobicContact CZ-CD2 3.88Å; F762-F766 WeakPolarHBondContact O-CB 3.48Å; F762-F766 PolarHBondContact O-N 3.42Å; L763-F766 PolarHBondContact O-N 3.19Å; F766-Y768 VanDerWaalsContact C-N 3.33Å; F766-Y768 PolarHBondContact O-N 3.28Å; F766-V769 PolarHBondContact O-N 3.42Å; F766-L770 HydrophobicContact CD1-CB 4.45Å; F766-L770 WeakPolarHBondContact O-CB 3.42Å; F766-L770 PolarHBondContact O-N 3.49Å; F766-L788 HydrophobicContact CB-CD1 3.96Å; F766-L788 HydrophobicContact CB-CD2 4.5Å; F766-L788 HydrophobicContact CD2-CD1 3.86Å; F766-L788 HydrophobicContact CD2-CD2 4.13Å; F766-L788 HydrophobicContact CG-CD1 4.14Å; F766-L788 HydrophobicContact CG-CD2 4.14Å; F766-F835 HydrophobicContact CE2-CD2 4.12Å; F766-F835 HydrophobicContact CE2-CE2 4.11Å; F766-F835 HydrophobicContact CZ-CD2 4.49Å; F766-L855 WeakPolarHBondContact CE1-O 3.23Å; F766-L855 HydrophobicContact CZ-CD2 4.47Å; F766-F859 HydrophobicContact CB-CD2 4.15Å; F766-F859 HydrophobicContact CB-CE2 4.46Å; F766-F859 HydrophobicContact CD1-CB 3.96Å; F766-F859 AromaticContact CD1-CD2 3.67Å; F766-F859 HydrophobicContact CD1-CD2 3.67Å; F766-F859 HydrophobicContact CD1-CG 4.18Å; F766-F859 HydrophobicContact CE1-CB 3.66Å; F766-F859 HydrophobicContact CE1-CD2 4.26Å; F766-F859 HydrophobicContact CE1-CG 4.37Å; F766-F859 AromaticContact CG-CD2 3.89Å; F766-F859 HydrophobicContact CG-CD2 3.89Å; F766-F859 HydrophobicContact CZ-CB 4.12Å; F766-F862 AromaticContact CE2-CD2 3.97Å; F766-F862 HydrophobicContact CE2-CD2 3.97Å; F766-F862 HydrophobicContact CE2-CE2 4.26Å
767	T	93.4	Very high	88.5	Confident	46 Å²	46	48.9 Å²	48.9	28%	0.282	26%	0.261	S	S	.	.	H	α-helix	trans	-59.9	-43.9	178.4	-56.3	0	0	0	0	111.3	L763 C764 L765 L770 L771 F859	L763-T767 WeakPolarHBondContact O-CB 3.49Å; L763-T767 PolarHBondContact O-N 3.24Å; L763-T767 PolarHBondContact O-OG1 2.91Å; C764-T767 PolarHBondContact O-N 3.45Å; L765-T767 VanDerWaalsContact C-N 3.35Å; L765-T767 PolarHBondContact O-N 2.88Å; T767-L770 PolarHBondContact O-N 3.44Å; T767-L771 HydrophobicContact CG2-CD1 3.71Å; T767-L771 HydrophobicContact CG2-CG 4.3Å; T767-L771 WeakPolarHBondContact O-CB 3.36Å; T767-L771 WeakPolarHBondContact O-CG 3.49Å; T767-L771 PolarHBondContact O-N 3.25Å; T767-F859 WeakPolarHBondContact OG1-CE2 2.85Å; T767-F859 WeakPolarHBondContact OG1-CZ 3.47Å
768	Y	92.9	Very high	87.4	Confident	112 Å²	112	52.6 Å²	52.6	44%	0.439	29%	0.289	S	S	.	.	H	α-helix	trans	-59.5	-48.3	176.6	176.1	-90.4	0	0	0	111.6	C764 L765 F766 L772 D773 P784	C764-Y768 WeakPolarHBondContact O-CB 3.47Å; C764-Y768 PolarHBondContact O-N 3.45Å; L765-Y768 WeakPolarHBondContact O-CB 3.3Å; L765-Y768 PolarHBondContact O-N 3.14Å; F766-Y768 VanDerWaalsContact C-N 3.33Å; F766-Y768 PolarHBondContact O-N 3.28Å; Y768-L772 HydrophobicContact CD2-CB 4.49Å; Y768-L772 HydrophobicContact CD2-CD1 3.63Å; Y768-L772 HydrophobicContact CE2-CB 4.36Å; Y768-L772 HydrophobicContact CE2-CD1 3.67Å; Y768-L772 WeakPolarHBondContact O-CB 3.06Å; Y768-L772 PolarHBondContact O-N 2.92Å; Y768-D773 HydrophobicContact CE1-CB 4.08Å; Y768-D773 PolarHBondContact O-N 3.06Å; Y768-P784 HydrophobicContact CD1-CB 4.39Å; Y768-P784 HydrophobicContact CE1-CB 4.21Å; Y768-P784 HydrophobicContact CE1-CG 4.14Å
769	V	91.3	Very high	86.3	Confident	4 Å²	4	55.8 Å²	55.8	2%	0.024	31%	0.307	C	S	.	.	H	α-helix	trans	-62.5	-46	178.8	171.7	0	0	0	0	111.1	L765 F766 D773 F774 P784 E785 L788	L765-V769 HydrophobicContact CD1-CG2 4.5Å; L765-V769 WeakPolarHBondContact O-CG2 3.5Å; L765-V769 PolarHBondContact O-N 3.41Å; F766-V769 PolarHBondContact O-N 3.42Å; V769-D773 CarbonylContact O-C 3.52Å; V769-D773 PolarHBondContact O-N 2.74Å; V769-F774 WeakPolarHBondContact O-CB 3.32Å; V769-F774 PolarHBondContact O-N 3.2Å; V769-F774 VanDerWaalsContact O-N 3.09Å; V769-P784 HydrophobicContact CG2-CB 4.13Å; V769-E785 HydrophobicContact CG1-CB 3.97Å; V769-E785 HydrophobicContact CG1-CG 3.9Å; V769-E785 HydrophobicContact CG2-CB 4.48Å; V769-L788 HydrophobicContact CB-CD2 4.26Å; V769-L788 HydrophobicContact CG1-CD2 4.2Å; V769-L788 HydrophobicContact CG2-CD2 4.43Å
770	L	90.6	Very high	85.4	Confident	15 Å²	15	56 Å²	56	8%	0.079	32%	0.316	C	S	.	.	H	α-helix	trans	-68.8	-42	-176.8	-171.7	70.2	0	0	0	112.7	F766 T767 R852 L855 A856 F859	F766-L770 HydrophobicContact CD1-CB 4.45Å; F766-L770 WeakPolarHBondContact O-CB 3.42Å; F766-L770 PolarHBondContact O-N 3.49Å; T767-L770 PolarHBondContact O-N 3.44Å; L770-R852 HydrophobicContact CD1-CG 4.44Å; L770-R852 VanDerWaalsContact O-CZ 3.3Å; L770-R852 PolarHBondContact O-NH1 3.36Å; L770-R852 PolarHBondContact O-NH2 3.37Å; L770-L855 HydrophobicContact CD1-CB 4.18Å; L770-A856 HydrophobicContact CD2-CB 3.96Å; L770-F859 HydrophobicContact CD2-CB 4.48Å
771	L	89.7	Confident	84.9	Confident	115 Å²	115	54.4 Å²	54.4	60%	0.602	31%	0.314	S	S	*	.	H	α-helix	trans	-85.9	-40	-175.1	-66.8	-178.5	0	0	0	113.7	T767	T767-L771 HydrophobicContact CG2-CD1 3.71Å; T767-L771 HydrophobicContact CG2-CG 4.3Å; T767-L771 WeakPolarHBondContact O-CB 3.36Å; T767-L771 WeakPolarHBondContact O-CG 3.49Å; T767-L771 PolarHBondContact O-N 3.25Å
772	L	86.3	Confident	84.4	Confident	129 Å²	129	56 Å²	56	68%	0.675	31%	0.313	S	S	*	.	H	α-helix	trans	-108.8	-34.3	-169.3	-62.4	175.2	0	0	0	113.7	Y768	Y768-L772 HydrophobicContact CD2-CB 4.49Å; Y768-L772 HydrophobicContact CD2-CD1 3.63Å; Y768-L772 HydrophobicContact CE2-CB 4.36Å; Y768-L772 HydrophobicContact CE2-CD1 3.67Å; Y768-L772 WeakPolarHBondContact O-CB 3.06Å; Y768-L772 PolarHBondContact O-N 2.92Å
773	D	82.9	Confident	84.1	Confident	16 Å²	16	61 Å²	61	9%	0.086	34%	0.343	C	S	.	.			trans	-120.7	22.7	-165.5	-145.6	20	0	0	0	115.4	Y768 V769 K775 K782 P784	Y768-D773 HydrophobicContact CE1-CB 4.08Å; Y768-D773 PolarHBondContact O-N 3.06Å; V769-D773 CarbonylContact O-C 3.52Å; V769-D773 PolarHBondContact O-N 2.74Å; D773-K775 PolarHBondContact O-N 3.48Å; D773-K782 VanDerWaalsContact CG-CD 3.43Å; D773-K782 WeakPolarHBondContact OD1-CD 3.44Å; D773-K782 WeakPolarHBondContact OD1-CE 3.47Å; D773-K782 IonicContact OD1-NZ 3.12Å; D773-K782 PolarHBondContact OD1-NZ 2.87Å; D773-K782 VanDerWaalsContact OD2-CD 3.25Å; D773-K782 WeakPolarHBondContact OD2-CD 3.31Å; D773-K782 IonicContact OD2-NZ 2.79Å; D773-P784 WeakPolarHBondContact OD2-CG 3.4Å
774	F	82.4	Confident	83.9	Confident	23 Å²	23	61.7 Å²	61.7	10%	0.101	35%	0.349	C	S	.	.			trans	-89	89.3	-179.5	-161.1	-97.4	0	0	0	111.6	V769 R842 F848 R852 L855	V769-F774 WeakPolarHBondContact O-CB 3.32Å; V769-F774 PolarHBondContact O-N 3.2Å; V769-F774 VanDerWaalsContact O-N 3.09Å; F774-R842 HydrophobicContact CE2-CG 4.24Å; F774-R842 HydrophobicContact CZ-CB 4.46Å; F774-R842 HydrophobicContact CZ-CG 3.92Å; F774-F848 HydrophobicContact CD1-CE1 4.08Å; F774-F848 HydrophobicContact CD1-CE2 4.04Å; F774-F848 AromaticContact CD1-CZ 3.43Å; F774-F848 HydrophobicContact CD1-CZ 3.43Å; F774-F848 VanDerWaalsContact CD1-CZ 3.43Å; F774-F848 HydrophobicContact CE1-CD2 4.27Å; F774-F848 AromaticContact CE1-CE1 3.87Å; F774-F848 HydrophobicContact CE1-CE1 3.87Å; F774-F848 AromaticContact CE1-CE2 3.49Å; F774-F848 HydrophobicContact CE1-CE2 3.49Å; F774-F848 VanDerWaalsContact CE1-CE2 3.49Å; F774-F848 AromaticContact CE1-CZ 3.26Å; F774-F848 HydrophobicContact CE1-CZ 3.26Å; F774-F848 HydrophobicContact CZ-CE2 4.09Å; F774-F848 HydrophobicContact CZ-CZ 4.27Å; F774-R852 HydrophobicContact CD1-CB 4.12Å; F774-R852 HydrophobicContact CD1-CG 3.97Å; F774-R852 HydrophobicContact CE1-CB 3.49Å; F774-R852 VanDerWaalsContact CE1-CB 3.49Å; F774-R852 HydrophobicContact CE1-CG 3.86Å; F774-R852 HydrophobicContact CZ-CB 3.97Å; F774-R852 HydrophobicContact CZ-CG 4.45Å; F774-L855 HydrophobicContact CE2-CD1 3.68Å; F774-L855 HydrophobicContact CZ-CD1 4.14Å
775	K	79.3	Confident	83.7	Confident	81 Å²	81	57.8 Å²	57.8	35%	0.352	32%	0.322	S	S	.	.	P	Polyproline II helix	trans	-98.1	146.3	-178.3	-72.3	-168.9	166.9	-165.9	0	114	D773 D779 K782 F848	D773-K775 PolarHBondContact O-N 3.48Å; K775-D779 HydrophobicContact CD-CB 4.27Å; K775-D779 IonicContact NZ-OD2 2.72Å; K775-D779 PolarHBondContact NZ-OD2 2.88Å; K775-K782 HydrophobicContact CD-CD 4.46Å; K775-F848 VanDerWaalsContact C-CZ 3.48Å; K775-F848 WeakPolarHBondContact O-CE2 3.32Å
776	S	75.9	Confident	83.5	Confident	66 Å²	66	60.4 Å²	60.4	46%	0.462	34%	0.335	S	S	.	.	P	Polyproline II helix	trans	-72	150.2	174.1	-49.7	0	0	0	0	112.7	F848	S776-F848 VanDerWaalsContact CA-CZ 3.5Å; S776-F848 WeakPolarHBondContact OG-CE1 3.47Å; S776-F848 WeakPolarHBondContact OG-CZ 3.48Å
777	P	72.4	Confident	83.4	Confident	38 Å²	38	65.1 Å²	65.1	25%	0.247	36%	0.358	C	S	.	.	T	Hydrogen-bonded Turn	trans	-55.4	138	167.6	-18.4	30.7	0	0	0	109.9	E845	P777-E845 HydrophobicContact CB-CG 4.1Å; P777-E845 HydrophobicContact CG-CG 4.19Å
778	P	66.1	Low	83.3	Confident	127 Å²	127	63.1 Å²	63.1	83%	0.825	35%	0.346	S	S	*	.	T	Hydrogen-bonded Turn	cis	-102.9	1.1	29	37.8	-36.3	0	0	0	117	G780	P778-G780 PolarHBondContact O-N 3.46Å
779	D	67.8	Low	83.2	Confident	110 Å²	110	60 Å²	60	59%	0.588	33%	0.334	S	S	*	.	S	Bend	trans	-66	-7.6	-176.1	-92.3	-0.5	0	0	0	114.3	K775	K775-D779 HydrophobicContact CD-CB 4.27Å; K775-D779 IonicContact NZ-OD2 2.72Å; K775-D779 PolarHBondContact NZ-OD2 2.88Å
780	G	70.8	Confident	83.2	Confident	29 Å²	29	64.2 Å²	64.2	30%	0.299	35%	0.352	S	S	.	.			trans	65	174.6	179.1	0	0	0	0	0	114.6	P778 K782	P778-G780 PolarHBondContact O-N 3.46Å; G780-K782 PolarHBondContact O-N 3.39Å
781	P	80.8	Confident	83.3	Confident	52 Å²	52	64.7 Å²	64.7	34%	0.338	35%	0.353	S	S	.	.			trans	-65.2	130.2	171.8	23.7	-30.2	0	0	0	111.1	E785 I786 Y789	P781-E785 WeakPolarHBondContact CA-OE2 3.49Å; P781-E785 HydrophobicContact CB-CB 4.48Å; P781-E785 HydrophobicContact CB-CG 4.39Å; P781-I786 HydrophobicContact CB-CG1 3.91Å; P781-I786 HydrophobicContact CG-CD1 4.42Å; P781-I786 HydrophobicContact CG-CG1 4.17Å; P781-Y789 HydrophobicContact CB-CE2 4.47Å
782	K	82.4	Confident	83.4	Confident	77 Å²	77	59.4 Å²	59.4	34%	0.335	33%	0.325	S	S	.	.			trans	-78.4	163.5	172.4	-75.6	176.3	165.7	-174.1	0	111.5	D773 K775 G780 P784 E785 I786	D773-K782 VanDerWaalsContact CG-CD 3.43Å; D773-K782 WeakPolarHBondContact OD1-CD 3.44Å; D773-K782 WeakPolarHBondContact OD1-CE 3.47Å; D773-K782 IonicContact OD1-NZ 3.12Å; D773-K782 PolarHBondContact OD1-NZ 2.87Å; D773-K782 VanDerWaalsContact OD2-CD 3.25Å; D773-K782 WeakPolarHBondContact OD2-CD 3.31Å; D773-K782 IonicContact OD2-NZ 2.79Å; K775-K782 HydrophobicContact CD-CD 4.46Å; G780-K782 PolarHBondContact O-N 3.39Å; K782-P784 HydrophobicContact CB-CG 4.4Å; K782-E785 WeakPolarHBondContact O-CA 3.43Å; K782-E785 WeakPolarHBondContact O-CB 3.35Å; K782-E785 PolarHBondContact O-N 3.06Å; K782-I786 PolarHBondContact O-N 3.19Å
783	V	87.7	Confident	83.6	Confident	106 Å²	106	58.4 Å²	58.4	64%	0.642	32%	0.316	S	S	*	.	H	α-helix	trans	-45.8	-50.4	179.3	-177.7	0	0	0	0	114.2	E785 I786 M787	V783-E785 VanDerWaalsContact C-N 3.26Å; V783-E785 PolarHBondContact O-N 2.97Å; V783-I786 PolarHBondContact O-N 3.26Å; V783-M787 HydrophobicContact CG1-CG 4.49Å; V783-M787 HydrophobicContact CG1-SD 4.29Å; V783-M787 WeakPolarHBondContact O-CG 3.4Å; V783-M787 PolarHBondContact O-N 3.08Å
784	P	89.2	Confident	84	Confident	27 Å²	27	57.7 Å²	57.7	18%	0.175	31%	0.312	C	S	.	.	H	α-helix	trans	-63.6	-29.7	179.1	23.6	-34.5	0	0	0	113.6	L765 Y768 V769 D773 K782 L788	L765-P784 HydrophobicContact CD1-CB 4.16Å; Y768-P784 HydrophobicContact CD1-CB 4.39Å; Y768-P784 HydrophobicContact CE1-CB 4.21Å; Y768-P784 HydrophobicContact CE1-CG 4.14Å; V769-P784 HydrophobicContact CG2-CB 4.13Å; D773-P784 WeakPolarHBondContact OD2-CG 3.4Å; K782-P784 HydrophobicContact CB-CG 4.4Å; P784-L788 PolarHBondContact O-N 3.37Å
785	E	89.9	Confident	84.2	Confident	3 Å²	3	58.2 Å²	58.2	1%	0.014	32%	0.315	C	S	.	.	H	α-helix	trans	-75.6	-38.7	175.8	-172.8	173.9	-161.1	0	0	111.8	V769 P781 K782 V783 M787 L788 Y789 R842	V769-E785 HydrophobicContact CG1-CB 3.97Å; V769-E785 HydrophobicContact CG1-CG 3.9Å; V769-E785 HydrophobicContact CG2-CB 4.48Å; P781-E785 WeakPolarHBondContact CA-OE2 3.49Å; P781-E785 HydrophobicContact CB-CB 4.48Å; P781-E785 HydrophobicContact CB-CG 4.39Å; K782-E785 WeakPolarHBondContact O-CA 3.43Å; K782-E785 WeakPolarHBondContact O-CB 3.35Å; K782-E785 PolarHBondContact O-N 3.06Å; V783-E785 VanDerWaalsContact C-N 3.26Å; V783-E785 PolarHBondContact O-N 2.97Å; E785-M787 VanDerWaalsContact C-N 3.29Å; E785-M787 PolarHBondContact O-N 3.32Å; E785-L788 WeakPolarHBondContact O-CB 3.46Å; E785-L788 PolarHBondContact O-N 3.12Å; E785-Y789 HydrophobicContact CG-CD1 4.39Å; E785-Y789 HydrophobicContact CG-CE1 3.69Å; E785-Y789 HydrophobicContact CG-CE2 4.23Å; E785-Y789 VanDerWaalsContact O-CD1 3.27Å; E785-Y789 WeakPolarHBondContact O-CD1 3.11Å; E785-Y789 PolarHBondContact O-N 3.21Å; E785-Y789 PolarHBondContact OE1-OH 3.07Å; E785-R842 IonicContact OE1-CZ 3.26Å; E785-R842 IonicContact OE1-NE 2.94Å; E785-R842 IonicContact OE1-NH1 3.17Å; E785-R842 PolarHBondContact OE1-NH1 3.38Å; E785-R842 IonicContact OE1-NH2 2.7Å; E785-R842 PolarHBondContact OE1-NH2 2.88Å; E785-R842 IonicContact OE2-CZ 3.95Å; E785-R842 IonicContact OE2-NH1 2.86Å; E785-R842 PolarHBondContact OE2-NH1 3.38Å; E785-R842 IonicContact OE2-NH2 2.86Å; E785-R842 PolarHBondContact OE2-NH2 3.46Å
786	I	89.1	Confident	84.6	Confident	89 Å²	89	56.2 Å²	56.2	46%	0.456	31%	0.31	S	S	.	.	H	α-helix	trans	-62.3	-40	171.6	-61.4	173.1	0	0	0	110.4	P781 K782 V783 L788 Y789 F790	P781-I786 HydrophobicContact CB-CG1 3.91Å; P781-I786 HydrophobicContact CG-CD1 4.42Å; P781-I786 HydrophobicContact CG-CG1 4.17Å; K782-I786 PolarHBondContact O-N 3.19Å; V783-I786 PolarHBondContact O-N 3.26Å; I786-L788 VanDerWaalsContact C-N 3.32Å; I786-L788 PolarHBondContact O-N 2.71Å; I786-Y789 PolarHBondContact O-N 2.85Å; I786-F790 WeakPolarHBondContact O-CB 3.41Å; I786-F790 PolarHBondContact O-N 3.49Å
787	M	90.6	Very high	85.1	Confident	102 Å²	102	55.5 Å²	55.5	50%	0.502	30%	0.301	S	S	.	.	H	α-helix	trans	-61.5	-39.9	174	-71.2	179.3	76.2	0	0	111.9	L765 V783 E785 F790 W791	L765-M787 HydrophobicContact CD2-CB 4.26Å; V783-M787 HydrophobicContact CG1-CG 4.49Å; V783-M787 HydrophobicContact CG1-SD 4.29Å; V783-M787 WeakPolarHBondContact O-CG 3.4Å; V783-M787 PolarHBondContact O-N 3.08Å; E785-M787 VanDerWaalsContact C-N 3.29Å; E785-M787 PolarHBondContact O-N 3.32Å; M787-F790 PolarHBondContact O-N 3.09Å; M787-W791 WeakPolarHBondContact O-CB 3.49Å; M787-W791 PolarHBondContact O-N 3.24Å
788	L	91.8	Very high	85.6	Confident	5 Å²	5	53.9 Å²	53.9	3%	0.026	29%	0.29	C	S	.	.	H	α-helix	trans	-62.6	-44.6	174.9	-178.1	67.2	0	0	0	111.5	F762 L765 F766 V769 P784 E785 I786 F790 W791 V792 F835	F762-L788 HydrophobicContact CD2-CD1 3.92Å; F762-L788 HydrophobicContact CE2-CD1 3.53Å; F762-L788 HydrophobicContact CZ-CD1 4.43Å; L765-L788 HydrophobicContact CD2-CB 4.44Å; F766-L788 HydrophobicContact CB-CD1 3.96Å; F766-L788 HydrophobicContact CB-CD2 4.5Å; F766-L788 HydrophobicContact CD2-CD1 3.86Å; F766-L788 HydrophobicContact CD2-CD2 4.13Å; F766-L788 HydrophobicContact CG-CD1 4.14Å; F766-L788 HydrophobicContact CG-CD2 4.14Å; V769-L788 HydrophobicContact CB-CD2 4.26Å; V769-L788 HydrophobicContact CG1-CD2 4.2Å; V769-L788 HydrophobicContact CG2-CD2 4.43Å; P784-L788 PolarHBondContact O-N 3.37Å; E785-L788 WeakPolarHBondContact O-CB 3.46Å; E785-L788 PolarHBondContact O-N 3.12Å; I786-L788 VanDerWaalsContact C-N 3.32Å; I786-L788 PolarHBondContact O-N 2.71Å; L788-F790 PolarHBondContact O-N 2.92Å; L788-W791 WeakPolarHBondContact O-CB 3.35Å; L788-W791 PolarHBondContact O-N 3.18Å; L788-W791 VanDerWaalsContact O-N 3.17Å; L788-V792 PolarHBondContact O-N 3.32Å; L788-F835 HydrophobicContact CD2-CE2 4.45Å; L788-F835 HydrophobicContact CG-CE2 4.46Å
789	Y	91.2	Very high	86.4	Confident	46 Å²	46	48.9 Å²	48.9	18%	0.18	26%	0.256	C	S	.	.	H	α-helix	trans	-63.1	-43.9	178.7	-63.9	-4.6	0	0	0	111.5	P781 E785 I786 W791 V792 F793 F835 V839 R842 M843	P781-Y789 HydrophobicContact CB-CE2 4.47Å; E785-Y789 HydrophobicContact CG-CD1 4.39Å; E785-Y789 HydrophobicContact CG-CE1 3.69Å; E785-Y789 HydrophobicContact CG-CE2 4.23Å; E785-Y789 VanDerWaalsContact O-CD1 3.27Å; E785-Y789 WeakPolarHBondContact O-CD1 3.11Å; E785-Y789 PolarHBondContact O-N 3.21Å; E785-Y789 PolarHBondContact OE1-OH 3.07Å; I786-Y789 PolarHBondContact O-N 2.85Å; Y789-W791 VanDerWaalsContact C-N 3.28Å; Y789-W791 PolarHBondContact O-N 2.98Å; Y789-V792 PolarHBondContact O-N 3.24Å; Y789-F793 WeakPolarHBondContact O-CB 3Å; Y789-F793 PolarHBondContact O-N 3.43Å; Y789-F835 HydrophobicContact CD1-CE1 4.32Å; Y789-F835 AromaticContact CD1-CZ 3.72Å; Y789-F835 HydrophobicContact CD1-CZ 3.72Å; Y789-F835 HydrophobicContact CE1-CZ 4.19Å; Y789-V839 HydrophobicContact CD1-CG2 4.26Å; Y789-V839 HydrophobicContact CE1-CG1 4.49Å; Y789-V839 HydrophobicContact CE1-CG2 3.69Å; Y789-V839 HydrophobicContact CE2-CG1 4.15Å; Y789-R842 PolarHBondContact OH-NH1 3.18Å; Y789-M843 HydrophobicContact CE2-CE 4.13Å
790	F	91.4	Very high	87.1	Confident	93 Å²	93	47.3 Å²	47.3	41%	0.408	25%	0.246	S	C	.	.	H	α-helix	trans	-60.4	-40.4	174.4	-179.4	-107.2	0	0	0	111.6	I786 M787 L788 F793 T794 P1035 I1038	I786-F790 WeakPolarHBondContact O-CB 3.41Å; I786-F790 PolarHBondContact O-N 3.49Å; M787-F790 PolarHBondContact O-N 3.09Å; L788-F790 PolarHBondContact O-N 2.92Å; F790-F793 WeakPolarHBondContact O-CB 3.44Å; F790-F793 PolarHBondContact O-N 3.38Å; F790-T794 HydrophobicContact CE1-CG2 4.17Å; F790-T794 HydrophobicContact CE2-CG2 4.47Å; F790-T794 HydrophobicContact CZ-CG2 4.11Å; F790-T794 WeakPolarHBondContact O-CG2 3.45Å; F790-T794 PolarHBondContact O-N 3.48Å; F790-P1035 HydrophobicContact CD1-CB 4.23Å; F790-P1035 HydrophobicContact CE1-CB 3.98Å; F790-I1038 HydrophobicContact CE2-CD1 4.37Å; F790-I1038 HydrophobicContact CZ-CD1 4.42Å; F790-I1038 HydrophobicContact CZ-CG2 4.44Å
791	W	92.4	Very high	87.5	Confident	25 Å²	25	47.5 Å²	47.5	10%	0.095	24%	0.238	C	C	.	.	H	α-helix	trans	-63.2	-49	177.7	-154.1	-61.2	0	0	0	112.3	M758 A761 F762 L765 M787 L788 Y789 F793 T794 L795 P1034 P1035	M758-W791 HydrophobicContact CB-CZ2 4.13Å; M758-W791 HydrophobicContact CE-CH2 3.36Å; M758-W791 HydrophobicContact CE-CZ2 3.71Å; M758-W791 HydrophobicContact CE-CZ3 4.33Å; M758-W791 VanDerWaalsContact O-CZ2 3.29Å; M758-W791 WeakPolarHBondContact O-CZ2 3.38Å; M758-W791 HydrophobicContact SD-CH2 4.47Å; A761-W791 HydrophobicContact CB-CH2 4.47Å; F762-W791 HydrophobicContact CB-CD2 4.39Å; F762-W791 HydrophobicContact CB-CZ2 4.05Å; F762-W791 HydrophobicContact CD2-CB 4.23Å; F762-W791 AromaticContact CD2-CD1 3.63Å; F762-W791 HydrophobicContact CD2-CD2 4.34Å; F762-W791 AromaticContact CD2-CG 3.82Å; F762-W791 HydrophobicContact CD2-CG 3.82Å; L765-W791 HydrophobicContact CD2-CE3 4.49Å; M787-W791 WeakPolarHBondContact O-CB 3.49Å; M787-W791 PolarHBondContact O-N 3.24Å; L788-W791 WeakPolarHBondContact O-CB 3.35Å; L788-W791 PolarHBondContact O-N 3.18Å; L788-W791 VanDerWaalsContact O-N 3.17Å; Y789-W791 VanDerWaalsContact C-N 3.28Å; Y789-W791 PolarHBondContact O-N 2.98Å; W791-F793 VanDerWaalsContact C-N 3.28Å; W791-F793 PolarHBondContact O-N 2.84Å; W791-T794 PolarHBondContact O-N 2.95Å; W791-T794 VanDerWaalsContact O-N 3.08Å; W791-T794 PolarHBondContact O-OG1 3.45Å; W791-L795 PolarHBondContact O-N 3.47Å; W791-L795 VanDerWaalsContact O-N 3.11Å; W791-P1034 VanDerWaalsContact CZ2-O 3.32Å; W791-P1034 WeakPolarHBondContact CZ2-O 3.41Å; W791-P1035 HydrophobicContact CD2-CB 4.2Å; W791-P1035 HydrophobicContact CD2-CG 4.27Å; W791-P1035 HydrophobicContact CE3-CB 4.25Å; W791-P1035 HydrophobicContact CE3-CG 3.93Å; W791-P1035 HydrophobicContact CH2-CG 4.36Å; W791-P1035 HydrophobicContact CZ3-CG 3.98Å
792	V	92.1	Very high	87.2	Confident	4 Å²	4	46.9 Å²	46.9	2%	0.024	23%	0.231	C	C	.	.	H	α-helix	trans	-63	-38	177.5	178.1	0	0	0	0	110.9	F762 L788 Y789 T794 L795 V796 F835	F762-V792 HydrophobicContact CE2-CG2 3.72Å; F762-V792 HydrophobicContact CZ-CG2 4.03Å; L788-V792 PolarHBondContact O-N 3.32Å; Y789-V792 PolarHBondContact O-N 3.24Å; V792-T794 VanDerWaalsContact C-N 3.3Å; V792-T794 PolarHBondContact O-N 3.26Å; V792-L795 WeakPolarHBondContact O-CB 3.5Å; V792-L795 PolarHBondContact O-N 3.31Å; V792-L795 VanDerWaalsContact O-N 3.09Å; V792-V796 HydrophobicContact CG1-CG2 4.48Å; V792-V796 WeakPolarHBondContact O-CG2 3.48Å; V792-V796 PolarHBondContact O-N 3.2Å; V792-F835 HydrophobicContact CB-CD1 4.08Å; V792-F835 HydrophobicContact CB-CE1 3.64Å; V792-F835 HydrophobicContact CB-CE2 4.43Å; V792-F835 HydrophobicContact CB-CZ 3.82Å; V792-F835 HydrophobicContact CG1-CD1 3.57Å; V792-F835 HydrophobicContact CG1-CE1 3.68Å; V792-F835 HydrophobicContact CG1-CG 4.03Å; V792-F835 HydrophobicContact CG1-CZ 4.23Å; V792-F835 HydrophobicContact CG2-CD1 4.29Å; V792-F835 HydrophobicContact CG2-CD2 4.14Å; V792-F835 HydrophobicContact CG2-CE1 3.85Å; V792-F835 HydrophobicContact CG2-CE2 3.7Å; V792-F835 HydrophobicContact CG2-CG 4.4Å; V792-F835 HydrophobicContact CG2-CZ 3.51Å
793	F	90.4	Very high	86.7	Confident	108 Å²	108	44.2 Å²	44.2	47%	0.474	22%	0.221	S	C	.	.	H	α-helix	trans	-57.6	-41.6	172.6	175.1	-104.3	0	0	0	112.5	Y789 F790 W791 L795 V796 L797	Y789-F793 WeakPolarHBondContact O-CB 3Å; Y789-F793 PolarHBondContact O-N 3.43Å; F790-F793 WeakPolarHBondContact O-CB 3.44Å; F790-F793 PolarHBondContact O-N 3.38Å; W791-F793 VanDerWaalsContact C-N 3.28Å; W791-F793 PolarHBondContact O-N 2.84Å; F793-L795 VanDerWaalsContact C-N 3.33Å; F793-L795 PolarHBondContact O-N 3.4Å; F793-V796 PolarHBondContact O-N 3.32Å; F793-L797 HydrophobicContact CD1-CD1 4.14Å; F793-L797 HydrophobicContact CE1-CD1 3.52Å; F793-L797 HydrophobicContact CE1-CG 4.16Å; F793-L797 HydrophobicContact CE2-CG 4.41Å; F793-L797 HydrophobicContact CZ-CD1 3.77Å; F793-L797 HydrophobicContact CZ-CD2 4.21Å; F793-L797 HydrophobicContact CZ-CG 4.06Å; F793-L797 PolarHBondContact O-N 3.44Å
794	T	89.7	Confident	85.6	Confident	1 Å²	1	44 Å²	44	1%	0.006	21%	0.212	C	C	.	.	H	α-helix	trans	-66.9	-31.2	175.3	62.4	0	0	0	0	113.5	F790 W791 V792 E798 P1035 I1038	F790-T794 HydrophobicContact CE1-CG2 4.17Å; F790-T794 HydrophobicContact CE2-CG2 4.47Å; F790-T794 HydrophobicContact CZ-CG2 4.11Å; F790-T794 WeakPolarHBondContact O-CG2 3.45Å; F790-T794 PolarHBondContact O-N 3.48Å; W791-T794 PolarHBondContact O-N 2.95Å; W791-T794 VanDerWaalsContact O-N 3.08Å; W791-T794 PolarHBondContact O-OG1 3.45Å; V792-T794 VanDerWaalsContact C-N 3.3Å; V792-T794 PolarHBondContact O-N 3.26Å; T794-E798 PolarHBondContact O-N 3.43Å; T794-P1035 HydrophobicContact CG2-CB 4.34Å; T794-I1038 HydrophobicContact CG2-CB 4.47Å
795	L	87.4	Confident	84.1	Confident	33 Å²	33	50 Å²	50	17%	0.173	24%	0.236	C	C	.	.	H	α-helix	trans	-67.2	-43.1	172.2	-68.2	174.4	0	0	0	111.2	F762 W791 V792 F793 L797 E798 E799 P1034	F762-L795 HydrophobicContact CZ-CD1 4.49Å; W791-L795 PolarHBondContact O-N 3.47Å; W791-L795 VanDerWaalsContact O-N 3.11Å; V792-L795 WeakPolarHBondContact O-CB 3.5Å; V792-L795 PolarHBondContact O-N 3.31Å; V792-L795 VanDerWaalsContact O-N 3.09Å; F793-L795 VanDerWaalsContact C-N 3.33Å; F793-L795 PolarHBondContact O-N 3.4Å; L795-L797 VanDerWaalsContact C-N 3.31Å; L795-L797 PolarHBondContact O-N 2.92Å; L795-E798 PolarHBondContact O-N 3.4Å; L795-E798 VanDerWaalsContact O-N 3.1Å; L795-E799 PolarHBondContact O-N 2.69Å; L795-P1034 HydrophobicContact CD2-CB 4.07Å; L795-P1034 HydrophobicContact CD2-CG 3.83Å
796	V	88.4	Confident	82.4	Confident	40 Å²	40	53.3 Å²	53.3	24%	0.242	26%	0.256	C	S	.	.	H	α-helix	trans	-59.8	-42.1	175.9	174.4	0	0	0	0	111.3	V792 F793 E798 E799 I800 I832	V792-V796 HydrophobicContact CG1-CG2 4.48Å; V792-V796 WeakPolarHBondContact O-CG2 3.48Å; V792-V796 PolarHBondContact O-N 3.2Å; F793-V796 PolarHBondContact O-N 3.32Å; V796-E798 VanDerWaalsContact C-N 3.28Å; V796-E798 PolarHBondContact O-N 2.68Å; V796-E799 PolarHBondContact O-N 3.33Å; V796-I800 HydrophobicContact CG1-CD1 3.86Å; V796-I800 HydrophobicContact CG1-CG1 4.44Å; V796-I800 WeakPolarHBondContact O-CB 3.39Å; V796-I800 VanDerWaalsContact O-CG1 3.24Å; V796-I800 WeakPolarHBondContact O-CG1 3.22Å; V796-I800 PolarHBondContact O-N 3.27Å; V796-I832 HydrophobicContact CG2-CD1 4.08Å; V796-I832 HydrophobicContact CG2-CG1 4.1Å; V796-I832 HydrophobicContact CG2-CG2 3.71Å
797	L	85.3	Confident	80.7	Confident	50 Å²	50	53.1 Å²	53.1	26%	0.262	26%	0.256	S	S	.	.	H	α-helix	trans	-62.5	-35.3	175.8	-72.1	179.5	0	0	0	112.8	F793 L795 R801 I1038	F793-L797 HydrophobicContact CD1-CD1 4.14Å; F793-L797 HydrophobicContact CE1-CD1 3.52Å; F793-L797 HydrophobicContact CE1-CG 4.16Å; F793-L797 HydrophobicContact CE2-CG 4.41Å; F793-L797 HydrophobicContact CZ-CD1 3.77Å; F793-L797 HydrophobicContact CZ-CD2 4.21Å; F793-L797 HydrophobicContact CZ-CG 4.06Å; F793-L797 PolarHBondContact O-N 3.44Å; L795-L797 VanDerWaalsContact C-N 3.31Å; L795-L797 PolarHBondContact O-N 2.92Å; L797-R801 PolarHBondContact O-N 3.37Å; L797-I1038 HydrophobicContact CD1-CD1 4.42Å
798	E	83.1	Confident	78.8	Confident	5 Å²	5	57.1 Å²	57.1	2%	0.023	27%	0.274	C	S	.	.	H	α-helix	trans	-70.4	-42.5	176.6	-176.3	58.2	-168.8	0	0	112.1	T794 L795 V796 I800 R801 Q802 I1037 H1041	T794-E798 PolarHBondContact O-N 3.43Å; L795-E798 PolarHBondContact O-N 3.4Å; L795-E798 VanDerWaalsContact O-N 3.1Å; V796-E798 VanDerWaalsContact C-N 3.28Å; V796-E798 PolarHBondContact O-N 2.68Å; E798-I800 VanDerWaalsContact C-N 3.29Å; E798-I800 PolarHBondContact O-N 3.25Å; E798-R801 WeakPolarHBondContact O-CB 3.4Å; E798-R801 PolarHBondContact O-N 2.72Å; E798-R801 VanDerWaalsContact O-N 3.12Å; E798-R801 IonicContact OE1-CZ 2.84Å; E798-R801 IonicContact OE1-NE 3.18Å; E798-R801 PolarHBondContact OE1-NE 2.88Å; E798-R801 IonicContact OE1-NH2 3.91Å; E798-R801 PolarHBondContact OE1-NH2 3.12Å; E798-R801 IonicContact OE2-NE 4Å; E798-R801 PolarHBondContact OE2-NE 3.01Å; E798-Q802 WeakPolarHBondContact O-CB 3.4Å; E798-Q802 PolarHBondContact O-N 3.42Å; E798-I1037 HydrophobicContact CB-CD1 4.29Å; E798-I1037 VanDerWaalsContact CD-CD1 3.5Å; E798-I1037 HydrophobicContact CG-CD1 4Å; E798-I1037 WeakPolarHBondContact OE2-CD1 3.3Å; E798-H1041 IonicContact OE2-CE1 3.52Å; E798-H1041 PolarHBondContact OE2-CE1 3.38Å; E798-H1041 IonicContact OE2-NE2 3.09Å; E798-H1041 PolarHBondContact OE2-NE2 2.98Å; E798-H1041 VanDerWaalsContact OE2-NE2 3.1Å
799	E	84.1	Confident	76.9	Confident	22 Å²	22	63 Å²	63	10%	0.103	30%	0.301	C	S	.	.	H	α-helix	trans	-61.8	-39	174.1	-67.3	-58	147.8	0	0	111.6	L795 V796 Q802 S803 Y819 M829 I832	L795-E799 PolarHBondContact O-N 2.69Å; V796-E799 PolarHBondContact O-N 3.33Å; E799-Q802 PolarHBondContact O-N 3.11Å; E799-S803 WeakPolarHBondContact O-CB 3.32Å; E799-S803 PolarHBondContact O-N 3.09Å; E799-Y819 PolarHBondContact OE2-OH 3.23Å; E799-M829 HydrophobicContact CB-CE 4.43Å; E799-I832 HydrophobicContact CG-CD1 4.2Å
800	I	81	Confident	75.2	Confident	77 Å²	77	63.1 Å²	63.1	40%	0.395	30%	0.304	S	S	.	.	H	α-helix	trans	-62.1	-47.3	172.5	-71.8	170.8	0	0	0	109.9	V796 E798 Q802 S803 F804	V796-I800 HydrophobicContact CG1-CD1 3.86Å; V796-I800 HydrophobicContact CG1-CG1 4.44Å; V796-I800 WeakPolarHBondContact O-CB 3.39Å; V796-I800 VanDerWaalsContact O-CG1 3.24Å; V796-I800 WeakPolarHBondContact O-CG1 3.22Å; V796-I800 PolarHBondContact O-N 3.27Å; E798-I800 VanDerWaalsContact C-N 3.29Å; E798-I800 PolarHBondContact O-N 3.25Å; I800-Q802 VanDerWaalsContact C-N 3.34Å; I800-Q802 PolarHBondContact O-N 3.1Å; I800-S803 PolarHBondContact O-N 3.22Å; I800-S803 VanDerWaalsContact O-N 3.16Å; I800-F804 HydrophobicContact CB-CD2 4.47Å; I800-F804 HydrophobicContact CG2-CD2 3.6Å; I800-F804 HydrophobicContact CG2-CE2 3.85Å; I800-F804 WeakPolarHBondContact O-CD2 3.46Å; I800-F804 PolarHBondContact O-N 2.93Å
801	R	79	Confident	73.9	Confident	32 Å²	32	64.4 Å²	64.4	12%	0.121	32%	0.315	C	S	.	.	H	α-helix	trans	-57	-49.2	177.9	-172.6	-161.5	59.4	91.7	2.7	111	L797 E798 S803 F804 F805	L797-R801 PolarHBondContact O-N 3.37Å; E798-R801 WeakPolarHBondContact O-CB 3.4Å; E798-R801 PolarHBondContact O-N 2.72Å; E798-R801 VanDerWaalsContact O-N 3.12Å; E798-R801 IonicContact OE1-CZ 2.84Å; E798-R801 IonicContact OE1-NE 3.18Å; E798-R801 PolarHBondContact OE1-NE 2.88Å; E798-R801 IonicContact OE1-NH2 3.91Å; E798-R801 PolarHBondContact OE1-NH2 3.12Å; E798-R801 IonicContact OE2-NE 4Å; E798-R801 PolarHBondContact OE2-NE 3.01Å; R801-S803 PolarHBondContact O-N 2.9Å; R801-F804 PolarHBondContact O-N 3.47Å; R801-F805 HydrophobicContact CB-CD2 4.44Å; R801-F805 HydrophobicContact CG-CB 4.2Å; R801-F805 HydrophobicContact CG-CD2 3.88Å; R801-F805 HydrophobicContact CG-CG 4.28Å; R801-F805 WeakPolarHBondContact O-CB 3.09Å; R801-F805 PolarHBondContact O-N 3.27Å
802	Q	76	Confident	72.7	Confident	40 Å²	40	68.7 Å²	68.7	19%	0.187	34%	0.339	C	S	.	.	H	α-helix	trans	-62.2	-30.3	180	-175.3	166.4	-5.5	0	0	112.7	E798 E799 I800 T806 E1025	E798-Q802 WeakPolarHBondContact O-CB 3.4Å; E798-Q802 PolarHBondContact O-N 3.42Å; E799-Q802 PolarHBondContact O-N 3.11Å; I800-Q802 VanDerWaalsContact C-N 3.34Å; I800-Q802 PolarHBondContact O-N 3.1Å; Q802-T806 PolarHBondContact O-OG1 2.87Å; Q802-E1025 PolarHBondContact NE2-OE1 2.9Å
803	S	70.5	Confident	71.6	Confident	20 Å²	20	75.7 Å²	75.7	14%	0.14	38%	0.376	C	S	.	.	H	α-helix	trans	-76.7	-36.5	176	-163.7	0	0	0	0	113.5	E799 I800 R801	E799-S803 WeakPolarHBondContact O-CB 3.32Å; E799-S803 PolarHBondContact O-N 3.09Å; I800-S803 PolarHBondContact O-N 3.22Å; I800-S803 VanDerWaalsContact O-N 3.16Å; R801-S803 PolarHBondContact O-N 2.9Å
804	F	65.1	Low	70.6	Confident	103 Å²	103	77 Å²	77	45%	0.452	38%	0.381	S	S	.	.	H	α-helix	trans	-99.9	-38.7	-170.4	-71.6	-72.9	0	0	0	115.3	I800 R801 I812 K815	I800-F804 HydrophobicContact CB-CD2 4.47Å; I800-F804 HydrophobicContact CG2-CD2 3.6Å; I800-F804 HydrophobicContact CG2-CE2 3.85Å; I800-F804 WeakPolarHBondContact O-CD2 3.46Å; I800-F804 PolarHBondContact O-N 2.93Å; R801-F804 PolarHBondContact O-N 3.47Å; F804-I812 HydrophobicContact CD1-CG2 4.5Å; F804-I812 HydrophobicContact CE1-CG2 3.88Å; F804-K815 PolarHBondContact O-NZ 2.73Å; F804-K815 VanDerWaalsContact O-NZ 3.15Å
805	F	58.5	Low	69.7	Low	152 Å²	152	78.8 Å²	78.8	67%	0.667	39%	0.388	S	S	*	.	S	Bend	trans	-95.1	1.2	-162.9	-76.9	-88.9	0	0	0	116.3	R801 D807	R801-F805 HydrophobicContact CB-CD2 4.44Å; R801-F805 HydrophobicContact CG-CB 4.2Å; R801-F805 HydrophobicContact CG-CD2 3.88Å; R801-F805 HydrophobicContact CG-CG 4.28Å; R801-F805 WeakPolarHBondContact O-CB 3.09Å; R801-F805 PolarHBondContact O-N 3.27Å; F805-D807 PolarHBondContact O-N 3.24Å
806	T	54.4	Low	69	Low	73 Å²	73	82.7 Å²	82.7	45%	0.448	40%	0.404	S	S	.	.	S	Bend	trans	-83.4	-4.1	-168.3	-30.8	0	0	0	0	114.6	Q802	Q802-T806 PolarHBondContact O-OG1 2.87Å
807	D	53.3	Low	68.5	Low	84 Å²	84	88 Å²	88	45%	0.449	42%	0.424	S	S	.	.			trans	-169.5	138.1	172.1	-116.9	-33.4	0	0	0	113.8	F805 E809 I810 K815	F805-D807 PolarHBondContact O-N 3.24Å; D807-E809 PolarHBondContact O-N 3.22Å; D807-I810 HydrophobicContact CB-CD1 4.47Å; D807-K815 WeakPolarHBondContact O-CE 3.48Å; D807-K815 PolarHBondContact O-NZ 3.42Å
808	E	49.8	Very low	67.9	Low	187 Å²	187	90.7 Å²	90.7	87%	0.874	44%	0.438	S	S	*	.	S	Bend	trans	-77.6	-11.1	-171.1	-72	-167.1	153.2	0	0	115.3
809	E	51.8	Low	67.6	Low	128 Å²	128	91.3 Å²	91.3	60%	0.598	44%	0.44	S	S	*	.	S	Bend	trans	-118.8	-3.2	-164.7	-61.7	-166.8	158.5	0	0	117.2	K498 D807	K498-E809 IonicContact NZ-OE1 3.07Å; K498-E809 PolarHBondContact NZ-OE1 3.34Å; K498-E809 IonicContact NZ-OE2 2.83Å; K498-E809 PolarHBondContact NZ-OE2 2.98Å; D807-E809 PolarHBondContact O-N 3.22Å
810	I	55.7	Low	67.4	Low	49 Å²	49	93 Å²	93	25%	0.251	45%	0.452	S	S	.	.	S	Bend	trans	-98.2	133.2	-175.2	-53.9	172.3	0	0	0	112	D807 I812 K814 K815	D807-I810 HydrophobicContact CB-CD1 4.47Å; I810-I812 PolarHBondContact O-N 3.49Å; I810-K814 HydrophobicContact CG2-CB 3.81Å; I810-K814 HydrophobicContact CG2-CD 4.45Å; I810-K815 HydrophobicContact CB-CG 4.04Å; I810-K815 HydrophobicContact CG2-CG 3.91Å; I810-K815 VanDerWaalsContact O-CE 3.31Å; I810-K815 WeakPolarHBondContact O-CE 3.19Å
811	N	64.7	Low	67.2	Low	120 Å²	120	95.6 Å²	95.6	64%	0.642	46%	0.463	S	S	*	.			trans	-50.4	130.9	171.7	-76.7	-11	0	0	0	111.9	L813 K814 K815	N811-L813 PolarHBondContact O-N 3.29Å; N811-L813 VanDerWaalsContact O-N 3.07Å; N811-K814 PolarHBondContact O-N 3.06Å; N811-K815 PolarHBondContact O-N 3.27Å
812	I	67	Low	67.3	Low	115 Å²	115	97.4 Å²	97.4	59%	0.59	48%	0.475	S	S	*	.	H	α-helix	trans	-50.9	-38.6	-176.5	-60	165.1	0	0	0	112.8	F804 I810 K814 K815 F816	F804-I812 HydrophobicContact CD1-CG2 4.5Å; F804-I812 HydrophobicContact CE1-CG2 3.88Å; I810-I812 PolarHBondContact O-N 3.49Å; I812-K814 PolarHBondContact O-N 2.74Å; I812-K815 PolarHBondContact O-N 2.83Å; I812-F816 PolarHBondContact O-N 3.3Å
813	L	68.3	Low	67.6	Low	151 Å²	151	99.6 Å²	99.6	79%	0.791	49%	0.488	S	S	*	.	H	α-helix	trans	-64	-37.1	177.6	-84.7	152.2	0	0	0	113.6	N811 K817	N811-L813 PolarHBondContact O-N 3.29Å; N811-L813 VanDerWaalsContact O-N 3.07Å; L813-K817 WeakPolarHBondContact O-CB 3.42Å; L813-K817 PolarHBondContact O-N 2.91Å
814	K	69.2	Low	68.3	Low	136 Å²	136	101.2 Å²	101.2	59%	0.591	49%	0.491	S	S	*	.	H	α-helix	trans	-71.5	-39	176.6	-74.7	-173.2	177.3	-175	0	110.9	I810 N811 I812 K817 L818	I810-K814 HydrophobicContact CG2-CB 3.81Å; I810-K814 HydrophobicContact CG2-CD 4.45Å; N811-K814 PolarHBondContact O-N 3.06Å; I812-K814 PolarHBondContact O-N 2.74Å; K814-K817 WeakPolarHBondContact O-CB 3.44Å; K814-K817 PolarHBondContact O-N 3Å; K814-L818 PolarHBondContact O-N 2.77Å
815	K	70.6	Confident	69.2	Low	37 Å²	37	97 Å²	97	16%	0.161	47%	0.473	C	S	.	.	H	α-helix	trans	-61.2	-48.2	174.9	-66.1	-177	173.7	178.6	0	111.8	F804 D807 I810 N811 I812 K817 L818 Y819	F804-K815 PolarHBondContact O-NZ 2.73Å; F804-K815 VanDerWaalsContact O-NZ 3.15Å; D807-K815 WeakPolarHBondContact O-CE 3.48Å; D807-K815 PolarHBondContact O-NZ 3.42Å; I810-K815 HydrophobicContact CB-CG 4.04Å; I810-K815 HydrophobicContact CG2-CG 3.91Å; I810-K815 VanDerWaalsContact O-CE 3.31Å; I810-K815 WeakPolarHBondContact O-CE 3.19Å; N811-K815 PolarHBondContact O-N 3.27Å; I812-K815 PolarHBondContact O-N 2.83Å; K815-K817 VanDerWaalsContact C-N 3.29Å; K815-K817 PolarHBondContact O-N 3.03Å; K815-L818 PolarHBondContact O-N 2.76Å; K815-Y819 WeakPolarHBondContact O-CB 3.34Å; K815-Y819 PolarHBondContact O-N 3.11Å
816	F	73.8	Confident	70.6	Confident	115 Å²	115	93.8 Å²	93.8	50%	0.504	46%	0.459	S	S	.	.	H	α-helix	trans	-60.9	-40	176.1	-175.7	-101.7	0	0	0	111.8	I812 Y819 V820	I812-F816 PolarHBondContact O-N 3.3Å; F816-Y819 PolarHBondContact O-N 3.19Å; F816-V820 HydrophobicContact CD1-CG2 4.13Å; F816-V820 HydrophobicContact CD2-CG2 4.39Å; F816-V820 HydrophobicContact CE1-CG2 3.71Å; F816-V820 HydrophobicContact CE2-CG2 3.99Å; F816-V820 HydrophobicContact CG-CG2 4.46Å; F816-V820 HydrophobicContact CZ-CG2 3.63Å; F816-V820 WeakPolarHBondContact O-CB 3.36Å; F816-V820 VanDerWaalsContact O-CG2 3.3Å; F816-V820 WeakPolarHBondContact O-CG2 3.47Å; F816-V820 PolarHBondContact O-N 3.41Å
817	K	77.3	Confident	72.2	Confident	152 Å²	152	91.9 Å²	91.9	66%	0.661	45%	0.448	S	S	*	.	H	α-helix	trans	-60.9	-45	175.2	-172.8	-177	177	-173	0	112.4	L813 K814 K815 V820 E821	L813-K817 WeakPolarHBondContact O-CB 3.42Å; L813-K817 PolarHBondContact O-N 2.91Å; K814-K817 WeakPolarHBondContact O-CB 3.44Å; K814-K817 PolarHBondContact O-N 3Å; K815-K817 VanDerWaalsContact C-N 3.29Å; K815-K817 PolarHBondContact O-N 3.03Å; K817-V820 PolarHBondContact O-N 2.88Å; K817-E821 PolarHBondContact O-N 3.45Å; K817-E821 VanDerWaalsContact O-N 3.14Å
818	L	72	Confident	73.8	Confident	107 Å²	107	88.5 Å²	88.5	56%	0.56	43%	0.43	S	S	*	.	H	α-helix	trans	-63.6	-43.4	176.3	-78.2	161.2	0	0	0	111.6	K814 K815 V820 E821	K814-L818 PolarHBondContact O-N 2.77Å; K815-L818 PolarHBondContact O-N 2.76Å; L818-V820 VanDerWaalsContact C-N 3.35Å; L818-V820 PolarHBondContact O-N 3.06Å; L818-E821 WeakPolarHBondContact O-CB 3.47Å; L818-E821 PolarHBondContact O-N 3.17Å; L818-E821 VanDerWaalsContact O-N 3.14Å
819	Y	77.6	Confident	75.6	Confident	17 Å²	17	83.2 Å²	83.2	7%	0.067	41%	0.406	C	S	.	.	H	α-helix	trans	-60.2	-44	177	178.8	-90	0	0	0	112	E799 K815 F816 E821 N825 M829	E799-Y819 PolarHBondContact OE2-OH 3.23Å; K815-Y819 WeakPolarHBondContact O-CB 3.34Å; K815-Y819 PolarHBondContact O-N 3.11Å; F816-Y819 PolarHBondContact O-N 3.19Å; Y819-E821 PolarHBondContact O-N 3.3Å; Y819-N825 HydrophobicContact CD1-CB 4.26Å; Y819-N825 HydrophobicContact CD2-CB 4.42Å; Y819-N825 HydrophobicContact CE1-CB 3.83Å; Y819-N825 HydrophobicContact CE2-CB 4.03Å; Y819-N825 VanDerWaalsContact O-CB 3.32Å; Y819-N825 WeakPolarHBondContact O-CB 3.33Å; Y819-N825 PolarHBondContact O-ND2 3.12Å; Y819-N825 VanDerWaalsContact O-ND2 3.12Å; Y819-M829 HydrophobicContact CE1-CE 3.58Å; Y819-M829 HydrophobicContact CE1-CG 3.98Å; Y819-M829 HydrophobicContact CE1-SD 4.31Å; Y819-M829 WeakPolarHBondContact OH-CE 3.19Å
820	V	79.3	Confident	77.5	Confident	58 Å²	58	80.5 Å²	80.5	35%	0.352	40%	0.398	S	S	.	.	H	α-helix	trans	-73.6	-12.6	178.5	175	0	0	0	0	112.5	F816 K817 L818 K826	F816-V820 HydrophobicContact CD1-CG2 4.13Å; F816-V820 HydrophobicContact CD2-CG2 4.39Å; F816-V820 HydrophobicContact CE1-CG2 3.71Å; F816-V820 HydrophobicContact CE2-CG2 3.99Å; F816-V820 HydrophobicContact CG-CG2 4.46Å; F816-V820 HydrophobicContact CZ-CG2 3.63Å; F816-V820 WeakPolarHBondContact O-CB 3.36Å; F816-V820 VanDerWaalsContact O-CG2 3.3Å; F816-V820 WeakPolarHBondContact O-CG2 3.47Å; F816-V820 PolarHBondContact O-N 3.41Å; K817-V820 PolarHBondContact O-N 2.88Å; L818-V820 VanDerWaalsContact C-N 3.35Å; L818-V820 PolarHBondContact O-N 3.06Å; V820-K826 WeakPolarHBondContact O-CE 3.41Å
821	E	78.1	Confident	79.2	Confident	132 Å²	132	78.2 Å²	78.2	62%	0.617	39%	0.387	S	S	*	.	H	α-helix	trans	-71.7	-34.9	178.1	-166.1	162.7	179.4	0	0	111.8	K817 L818 Y819 K826	K817-E821 PolarHBondContact O-N 3.45Å; K817-E821 VanDerWaalsContact O-N 3.14Å; L818-E821 WeakPolarHBondContact O-CB 3.47Å; L818-E821 PolarHBondContact O-N 3.17Å; L818-E821 VanDerWaalsContact O-N 3.14Å; Y819-E821 PolarHBondContact O-N 3.3Å; E821-K826 WeakPolarHBondContact O-CE 3.33Å; E821-K826 PolarHBondContact O-NZ 3.29Å
822	D	80.6	Confident	80.5	Confident	69 Å²	69	73.9 Å²	73.9	37%	0.369	36%	0.363	S	S	.	.	S	Bend	trans	-66.1	132.2	178.3	-165.9	-20.7	0	0	0	112.1	W824 N825 K826	D822-W824 VanDerWaalsContact C-N 3.31Å; D822-W824 PolarHBondContact O-N 3.24Å; D822-W824 PolarHBondContact OD1-N 2.97Å; D822-N825 HydrophobicContact CB-CB 4.09Å; D822-N825 WeakPolarHBondContact CB-ND2 3.29Å; D822-K826 WeakPolarHBondContact O-CE 3.49Å; D822-K826 WeakPolarHBondContact O-CG 3.48Å; D822-K826 PolarHBondContact O-N 2.83Å
823	N	82.6	Confident	81.7	Confident	87 Å²	87	73.7 Å²	73.7	47%	0.465	36%	0.363	S	S	.	.	H	α-helix	trans	-67.9	-31.4	179	-67.9	-24.8	0	0	0	112.5	K826 C827 E884	N823-K826 PolarHBondContact OD1-NZ 3.48Å; N823-C827 PolarHBondContact O-N 2.87Å; N823-E884 PolarHBondContact ND2-OE1 3.47Å
824	W	84	Confident	82.9	Confident	53 Å²	53	68.8 Å²	68.8	20%	0.201	34%	0.338	C	S	.	.	H	α-helix	trans	-75.6	-40.1	-179.3	-69	111.5	0	0	0	111.8	D822 K826 C827 D828 R865 I867 H868	D822-W824 VanDerWaalsContact C-N 3.31Å; D822-W824 PolarHBondContact O-N 3.24Å; D822-W824 PolarHBondContact OD1-N 2.97Å; W824-K826 VanDerWaalsContact C-N 3.3Å; W824-K826 PolarHBondContact O-N 3.09Å; W824-C827 WeakPolarHBondContact O-CA 3.46Å; W824-C827 WeakPolarHBondContact O-CB 3.19Å; W824-C827 PolarHBondContact O-N 2.98Å; W824-D828 PolarHBondContact O-N 3.22Å; W824-R865 PolarHBondContact O-NH1 3.23Å; W824-I867 HydrophobicContact CH2-CB 4.05Å; W824-I867 HydrophobicContact CH2-CG2 3.87Å; W824-H868 AromaticContact CD1-CD2 3.5Å; W824-H868 VanDerWaalsContact CD1-CD2 3.5Å; W824-H868 AromaticContact CD1-NE2 3.82Å; W824-H868 HydrophobicContact CD2-CB 3.87Å; W824-H868 AromaticContact CD2-CD2 3.55Å; W824-H868 AromaticContact CD2-CG 3.85Å; W824-H868 AromaticContact CE2-CD2 3.62Å; W824-H868 HydrophobicContact CE3-CB 3.68Å; W824-H868 AromaticContact CG-CD2 3.48Å; W824-H868 VanDerWaalsContact CG-CD2 3.48Å; W824-H868 AromaticContact CG-CG 4Å; W824-H868 AromaticContact CG-NE2 3.93Å; W824-H868 HydrophobicContact CH2-CB 4.19Å; W824-H868 HydrophobicContact CZ2-CB 4.37Å; W824-H868 HydrophobicContact CZ3-CB 3.84Å; W824-H868 AromaticContact NE1-CD2 3.58Å
825	N	85.4	Confident	84	Confident	15 Å²	15	63 Å²	63	8%	0.08	31%	0.312	C	S	.	.	H	α-helix	trans	-64.8	-34.5	174.2	-63.7	-14	0	0	0	111.9	Y819 D822 C827 D828 M829	Y819-N825 HydrophobicContact CD1-CB 4.26Å; Y819-N825 HydrophobicContact CD2-CB 4.42Å; Y819-N825 HydrophobicContact CE1-CB 3.83Å; Y819-N825 HydrophobicContact CE2-CB 4.03Å; Y819-N825 VanDerWaalsContact O-CB 3.32Å; Y819-N825 WeakPolarHBondContact O-CB 3.33Å; Y819-N825 PolarHBondContact O-ND2 3.12Å; Y819-N825 VanDerWaalsContact O-ND2 3.12Å; D822-N825 HydrophobicContact CB-CB 4.09Å; D822-N825 WeakPolarHBondContact CB-ND2 3.29Å; N825-C827 VanDerWaalsContact C-N 3.29Å; N825-C827 PolarHBondContact O-N 3.2Å; N825-D828 PolarHBondContact O-N 3Å; N825-M829 WeakPolarHBondContact O-CG 3.43Å; N825-M829 PolarHBondContact O-N 3.09Å
826	K	87.5	Confident	85.1	Confident	84 Å²	84	65 Å²	65	37%	0.365	33%	0.328	S	S	.	.	H	α-helix	trans	-59.6	-41.2	170	-69.5	167.8	-153.9	156	0	111.5	V820 E821 D822 N823 W824 M829 V830	V820-K826 WeakPolarHBondContact O-CE 3.41Å; E821-K826 WeakPolarHBondContact O-CE 3.33Å; E821-K826 PolarHBondContact O-NZ 3.29Å; D822-K826 WeakPolarHBondContact O-CE 3.49Å; D822-K826 WeakPolarHBondContact O-CG 3.48Å; D822-K826 PolarHBondContact O-N 2.83Å; N823-K826 PolarHBondContact OD1-NZ 3.48Å; W824-K826 VanDerWaalsContact C-N 3.3Å; W824-K826 PolarHBondContact O-N 3.09Å; K826-M829 PolarHBondContact O-N 3.3Å; K826-V830 VanDerWaalsContact O-CG2 3.27Å; K826-V830 WeakPolarHBondContact O-CG2 3.09Å; K826-V830 PolarHBondContact O-N 2.92Å
827	C	87.3	Confident	86	Confident	33 Å²	33	62.5 Å²	62.5	22%	0.223	32%	0.322	C	S	.	.	H	α-helix	trans	-63.1	-42.9	177.2	-165.5	0	0	0	0	111.3	N823 W824 N825 V830 A831	N823-C827 PolarHBondContact O-N 2.87Å; W824-C827 WeakPolarHBondContact O-CA 3.46Å; W824-C827 WeakPolarHBondContact O-CB 3.19Å; W824-C827 PolarHBondContact O-N 2.98Å; N825-C827 VanDerWaalsContact C-N 3.29Å; N825-C827 PolarHBondContact O-N 3.2Å; C827-V830 PolarHBondContact O-N 3.01Å; C827-A831 PolarHBondContact O-N 3.29Å
828	D	87.3	Confident	86.7	Confident	14 Å²	14	55.3 Å²	55.3	8%	0.075	29%	0.29	C	S	.	.	H	α-helix	trans	-65.6	-41.5	177.5	-59	-38.2	0	0	0	112	W824 N825 V830 A831 I832 R865	W824-D828 PolarHBondContact O-N 3.22Å; N825-D828 PolarHBondContact O-N 3Å; D828-V830 VanDerWaalsContact C-N 3.32Å; D828-V830 PolarHBondContact O-N 3.49Å; D828-A831 PolarHBondContact O-N 3.39Å; D828-I832 VanDerWaalsContact O-CG1 3.28Å; D828-I832 WeakPolarHBondContact O-CG1 3.11Å; D828-I832 PolarHBondContact O-N 3.1Å; D828-R865 VanDerWaalsContact CG-NH1 3.26Å; D828-R865 VanDerWaalsContact OD1-CD 3.24Å; D828-R865 WeakPolarHBondContact OD1-CD 3.46Å; D828-R865 IonicContact OD1-CZ 3.04Å; D828-R865 IonicContact OD1-NE 2.7Å; D828-R865 PolarHBondContact OD1-NE 3.47Å; D828-R865 VanDerWaalsContact OD1-NE 3.17Å; D828-R865 IonicContact OD1-NH1 3.04Å; D828-R865 PolarHBondContact OD1-NH1 3.04Å; D828-R865 VanDerWaalsContact OD1-NH1 3.11Å; D828-R865 IonicContact OD1-NH2 2.74Å; D828-R865 IonicContact OD2-CZ 3.35Å; D828-R865 IonicContact OD2-NE 2.83Å; D828-R865 IonicContact OD2-NH1 2.74Å; D828-R865 PolarHBondContact OD2-NH1 3.46Å; D828-R865 IonicContact OD2-NH2 3.98Å; D828-R865 PolarHBondContact OD2-NH2 3.47Å
829	M	88.6	Confident	87.6	Confident	75 Å²	75	51.4 Å²	51.4	37%	0.369	27%	0.271	S	S	.	.	H	α-helix	trans	-62.1	-39.3	174.4	-72.7	-67.8	130.3	0	0	112.2	E799 Y819 N825 K826 I832 L833	E799-M829 HydrophobicContact CB-CE 4.43Å; Y819-M829 HydrophobicContact CE1-CE 3.58Å; Y819-M829 HydrophobicContact CE1-CG 3.98Å; Y819-M829 HydrophobicContact CE1-SD 4.31Å; Y819-M829 WeakPolarHBondContact OH-CE 3.19Å; N825-M829 WeakPolarHBondContact O-CG 3.43Å; N825-M829 PolarHBondContact O-N 3.09Å; K826-M829 PolarHBondContact O-N 3.3Å; M829-I832 HydrophobicContact CE-CD1 4.37Å; M829-L833 VanDerWaalsContact O-CB 3.25Å; M829-L833 WeakPolarHBondContact O-CB 3.35Å; M829-L833 PolarHBondContact O-N 3.22Å
830	V	90.9	Very high	88.2	Confident	71 Å²	71	54 Å²	54	43%	0.43	29%	0.292	S	S	.	.	H	α-helix	trans	-66.2	-43.5	174.8	169.5	0	0	0	0	111	K826 C827 D828 L833 L834	K826-V830 VanDerWaalsContact O-CG2 3.27Å; K826-V830 WeakPolarHBondContact O-CG2 3.09Å; K826-V830 PolarHBondContact O-N 2.92Å; C827-V830 PolarHBondContact O-N 3.01Å; D828-V830 VanDerWaalsContact C-N 3.32Å; D828-V830 PolarHBondContact O-N 3.49Å; V830-L833 PolarHBondContact O-N 3.41Å; V830-L834 HydrophobicContact CG1-CD1 3.89Å; V830-L834 HydrophobicContact CG1-CG 4.33Å; V830-L834 WeakPolarHBondContact O-CB 3.29Å; V830-L834 VanDerWaalsContact O-CG 3.31Å; V830-L834 WeakPolarHBondContact O-CG 3.43Å; V830-L834 PolarHBondContact O-N 3.42Å
831	A	91.1	Very high	88.7	Confident	2 Å²	2	52.9 Å²	52.9	2%	0.017	29%	0.286	C	S	.	.	H	α-helix	trans	-61.1	-49.4	176.5	0	0	0	0	0	111.4	C827 D828 L833 L834 F835 V861 F862	C827-A831 PolarHBondContact O-N 3.29Å; D828-A831 PolarHBondContact O-N 3.39Å; A831-L833 VanDerWaalsContact C-N 3.31Å; A831-L833 PolarHBondContact O-N 2.84Å; A831-L834 PolarHBondContact O-N 3.26Å; A831-F835 WeakPolarHBondContact O-CB 3.12Å; A831-F835 PolarHBondContact O-N 3.48Å; A831-V861 HydrophobicContact CB-CB 4.43Å; A831-V861 HydrophobicContact CB-CG1 3.79Å; A831-F862 HydrophobicContact CB-CD1 4.28Å; A831-F862 HydrophobicContact CB-CD2 4.42Å; A831-F862 HydrophobicContact CB-CE1 3.95Å; A831-F862 HydrophobicContact CB-CE2 4.1Å; A831-F862 HydrophobicContact CB-CZ 3.86Å
832	I	91.5	Very high	89.1	Confident	28 Å²	28	46.9 Å²	46.9	14%	0.144	26%	0.257	C	S	.	.	H	α-helix	trans	-61.2	-41.7	178.7	-66.3	162.5	0	0	0	111	V796 E799 D828 M829 F835 V836	V796-I832 HydrophobicContact CG2-CD1 4.08Å; V796-I832 HydrophobicContact CG2-CG1 4.1Å; V796-I832 HydrophobicContact CG2-CG2 3.71Å; E799-I832 HydrophobicContact CG-CD1 4.2Å; D828-I832 VanDerWaalsContact O-CG1 3.28Å; D828-I832 WeakPolarHBondContact O-CG1 3.11Å; D828-I832 PolarHBondContact O-N 3.1Å; M829-I832 HydrophobicContact CE-CD1 4.37Å; I832-F835 PolarHBondContact O-N 3.08Å; I832-V836 WeakPolarHBondContact O-CG2 3.26Å; I832-V836 PolarHBondContact O-N 3.32Å
833	L	92.2	Very high	89.3	Confident	112 Å²	112	48.5 Å²	48.5	59%	0.586	26%	0.264	S	S	*	.	H	α-helix	trans	-63.3	-47.7	177.4	179.9	67.2	0	0	0	111.9	M829 V830 A831 F835 V836 V837	M829-L833 VanDerWaalsContact O-CB 3.25Å; M829-L833 WeakPolarHBondContact O-CB 3.35Å; M829-L833 PolarHBondContact O-N 3.22Å; V830-L833 PolarHBondContact O-N 3.41Å; A831-L833 VanDerWaalsContact C-N 3.31Å; A831-L833 PolarHBondContact O-N 2.84Å; L833-F835 VanDerWaalsContact C-N 3.32Å; L833-F835 PolarHBondContact O-N 3.41Å; L833-V836 PolarHBondContact O-N 3Å; L833-V837 WeakPolarHBondContact O-CG2 3.38Å; L833-V837 PolarHBondContact O-N 2.85Å
834	L	93.6	Very high	89.4	Confident	48 Å²	48	46.7 Å²	46.7	25%	0.251	26%	0.258	S	S	.	.	H	α-helix	trans	-62.8	-39.6	178.2	-73.9	174.5	0	0	0	111.5	V830 A831 V837 G838 V854 I857 D858 V861	V830-L834 HydrophobicContact CG1-CD1 3.89Å; V830-L834 HydrophobicContact CG1-CG 4.33Å; V830-L834 WeakPolarHBondContact O-CB 3.29Å; V830-L834 VanDerWaalsContact O-CG 3.31Å; V830-L834 WeakPolarHBondContact O-CG 3.43Å; V830-L834 PolarHBondContact O-N 3.42Å; A831-L834 PolarHBondContact O-N 3.26Å; L834-V837 PolarHBondContact O-N 3.4Å; L834-G838 PolarHBondContact O-N 3.5Å; L834-V854 HydrophobicContact CD2-CG1 4.45Å; L834-V854 WeakPolarHBondContact O-CG1 3.23Å; L834-I857 HydrophobicContact CD1-CG2 4.47Å; L834-D858 HydrophobicContact CB-CB 4.09Å; L834-D858 WeakPolarHBondContact CB-OD1 3.39Å; L834-V861 HydrophobicContact CD1-CG2 4.01Å
835	F	93.7	Very high	89.2	Confident	13 Å²	13	51 Å²	51	6%	0.057	28%	0.281	C	S	.	.	H	α-helix	trans	-61.1	-47.5	174.6	-172.7	-95.9	0	0	0	112	F766 L788 Y789 V792 A831 I832 L833 V837 G838 V839 L855 D858 F862	F766-F835 HydrophobicContact CE2-CD2 4.12Å; F766-F835 HydrophobicContact CE2-CE2 4.11Å; F766-F835 HydrophobicContact CZ-CD2 4.49Å; L788-F835 HydrophobicContact CD2-CE2 4.45Å; L788-F835 HydrophobicContact CG-CE2 4.46Å; Y789-F835 HydrophobicContact CD1-CE1 4.32Å; Y789-F835 AromaticContact CD1-CZ 3.72Å; Y789-F835 HydrophobicContact CD1-CZ 3.72Å; Y789-F835 HydrophobicContact CE1-CZ 4.19Å; V792-F835 HydrophobicContact CB-CD1 4.08Å; V792-F835 HydrophobicContact CB-CE1 3.64Å; V792-F835 HydrophobicContact CB-CE2 4.43Å; V792-F835 HydrophobicContact CB-CZ 3.82Å; V792-F835 HydrophobicContact CG1-CD1 3.57Å; V792-F835 HydrophobicContact CG1-CE1 3.68Å; V792-F835 HydrophobicContact CG1-CG 4.03Å; V792-F835 HydrophobicContact CG1-CZ 4.23Å; V792-F835 HydrophobicContact CG2-CD1 4.29Å; V792-F835 HydrophobicContact CG2-CD2 4.14Å; V792-F835 HydrophobicContact CG2-CE1 3.85Å; V792-F835 HydrophobicContact CG2-CE2 3.7Å; V792-F835 HydrophobicContact CG2-CG 4.4Å; V792-F835 HydrophobicContact CG2-CZ 3.51Å; A831-F835 WeakPolarHBondContact O-CB 3.12Å; A831-F835 PolarHBondContact O-N 3.48Å; I832-F835 PolarHBondContact O-N 3.08Å; L833-F835 VanDerWaalsContact C-N 3.32Å; L833-F835 PolarHBondContact O-N 3.41Å; F835-V837 PolarHBondContact O-N 3.49Å; F835-G838 PolarHBondContact O-N 3.26Å; F835-V839 HydrophobicContact CD1-CG2 4.1Å; F835-V839 HydrophobicContact CE1-CG2 3.8Å; F835-V839 HydrophobicContact CE2-CG2 4.38Å; F835-V839 HydrophobicContact CZ-CG2 3.97Å; F835-V839 WeakPolarHBondContact O-CB 3.3Å; F835-V839 VanDerWaalsContact O-CG2 3.32Å; F835-V839 WeakPolarHBondContact O-CG2 3.48Å; F835-V839 PolarHBondContact O-N 3.46Å; F835-L855 HydrophobicContact CD2-CD2 3.97Å; F835-L855 HydrophobicContact CE2-CD2 4.31Å; F835-D858 WeakPolarHBondContact CD2-OD2 3.31Å; F835-D858 PolarHBondContact N-OD1 3.04Å; F835-F862 HydrophobicContact CB-CE2 4.4Å; F835-F862 HydrophobicContact CD2-CE2 4.39Å
836	V	92.7	Very high	89.1	Confident	81 Å²	81	58 Å²	58	49%	0.491	32%	0.318	S	S	.	.	H	α-helix	trans	-61.9	-43.5	177.9	171.3	0	0	0	0	111.2	I832 L833 S840	I832-V836 WeakPolarHBondContact O-CG2 3.26Å; I832-V836 PolarHBondContact O-N 3.32Å; L833-V836 PolarHBondContact O-N 3Å; V836-S840 VanDerWaalsContact O-CB 3.3Å; V836-S840 WeakPolarHBondContact O-CB 3.25Å; V836-S840 PolarHBondContact O-N 3.32Å; V836-S840 PolarHBondContact O-OG 3.47Å
837	V	93.6	Very high	89.2	Confident	62 Å²	62	56.5 Å²	56.5	38%	0.376	32%	0.316	S	S	.	.	H	α-helix	trans	-64.2	-45.6	176.1	172.3	0	0	0	0	110.8	L833 L834 F835 V839 S840 C841 V854	L833-V837 WeakPolarHBondContact O-CG2 3.38Å; L833-V837 PolarHBondContact O-N 2.85Å; L834-V837 PolarHBondContact O-N 3.4Å; F835-V837 PolarHBondContact O-N 3.49Å; V837-V839 PolarHBondContact O-N 2.89Å; V837-S840 PolarHBondContact O-N 2.8Å; V837-C841 PolarHBondContact O-N 3.35Å; V837-C841 PolarHBondContact O-SG 3.18Å; V837-V854 HydrophobicContact CG1-CG1 4.4Å
838	G	91.9	Very high	89.2	Confident	0 Å²	0	55.7 Å²	55.7	0%	0	31%	0.309	C	S	.	.	H	α-helix	trans	-61.2	-45	179.6	0	0	0	0	0	112.6	L834 F835 R842	L834-G838 PolarHBondContact O-N 3.5Å; F835-G838 PolarHBondContact O-N 3.26Å; G838-R842 VanDerWaalsContact O-CB 3.27Å; G838-R842 WeakPolarHBondContact O-CB 3.36Å; G838-R842 PolarHBondContact O-N 3.26Å
839	V	90.3	Very high	89.2	Confident	26 Å²	26	61 Å²	61	16%	0.158	33%	0.333	C	S	.	.	H	α-helix	trans	-65	-40.5	174.1	174.3	0	0	0	0	111	Y789 F835 V837 R842 M843 L855	Y789-V839 HydrophobicContact CD1-CG2 4.26Å; Y789-V839 HydrophobicContact CE1-CG1 4.49Å; Y789-V839 HydrophobicContact CE1-CG2 3.69Å; Y789-V839 HydrophobicContact CE2-CG1 4.15Å; F835-V839 HydrophobicContact CD1-CG2 4.1Å; F835-V839 HydrophobicContact CE1-CG2 3.8Å; F835-V839 HydrophobicContact CE2-CG2 4.38Å; F835-V839 HydrophobicContact CZ-CG2 3.97Å; F835-V839 WeakPolarHBondContact O-CB 3.3Å; F835-V839 VanDerWaalsContact O-CG2 3.32Å; F835-V839 WeakPolarHBondContact O-CG2 3.48Å; F835-V839 PolarHBondContact O-N 3.46Å; V837-V839 PolarHBondContact O-N 2.89Å; V839-R842 WeakPolarHBondContact O-CB 3.34Å; V839-R842 PolarHBondContact O-N 2.95Å; V839-M843 HydrophobicContact CG1-CE 3.98Å; V839-M843 WeakPolarHBondContact O-CG 3.42Å; V839-M843 PolarHBondContact O-N 2.9Å; V839-M843 VanDerWaalsContact O-N 3.16Å; V839-L855 HydrophobicContact CG2-CD2 4.41Å
840	S	89.5	Confident	89.2	Confident	72 Å²	72	59.6 Å²	59.6	50%	0.503	33%	0.333	S	S	.	.	H	α-helix	trans	-63.5	-46.2	177.8	-59.3	0	0	0	0	112.2	V836 V837 R842 M843	V836-S840 VanDerWaalsContact O-CB 3.3Å; V836-S840 WeakPolarHBondContact O-CB 3.25Å; V836-S840 PolarHBondContact O-N 3.32Å; V836-S840 PolarHBondContact O-OG 3.47Å; V837-S840 PolarHBondContact O-N 2.8Å; S840-R842 VanDerWaalsContact C-N 3.29Å; S840-R842 PolarHBondContact O-N 3.47Å; S840-M843 PolarHBondContact O-N 2.86Å
841	C	89.7	Confident	89.2	Confident	33 Å²	33	56.2 Å²	56.2	22%	0.223	31%	0.313	C	S	.	.	H	α-helix	trans	-63.9	-35.2	174.4	-70.8	0	0	0	0	111.9	V837 M843 S844 T847	V837-C841 PolarHBondContact O-N 3.35Å; V837-C841 PolarHBondContact O-SG 3.18Å; C841-M843 VanDerWaalsContact C-N 3.26Å; C841-M843 PolarHBondContact O-N 2.99Å; C841-S844 PolarHBondContact O-N 3.04Å; C841-T847 CarbonylContact O-C 3.59Å; C841-T847 PolarHBondContact O-OG1 3.32Å
842	R	87.6	Confident	89.2	Confident	6 Å²	6	59.8 Å²	59.8	2%	0.023	33%	0.326	C	S	.	.	H	α-helix	trans	-62.7	-31	175.4	177.7	-87.4	167.9	114.9	17	112.8	F774 E785 Y789 G838 V839 S840 S844 F848	F774-R842 HydrophobicContact CE2-CG 4.24Å; F774-R842 HydrophobicContact CZ-CB 4.46Å; F774-R842 HydrophobicContact CZ-CG 3.92Å; E785-R842 IonicContact OE1-CZ 3.26Å; E785-R842 IonicContact OE1-NE 2.94Å; E785-R842 IonicContact OE1-NH1 3.17Å; E785-R842 PolarHBondContact OE1-NH1 3.38Å; E785-R842 IonicContact OE1-NH2 2.7Å; E785-R842 PolarHBondContact OE1-NH2 2.88Å; E785-R842 IonicContact OE2-CZ 3.95Å; E785-R842 IonicContact OE2-NH1 2.86Å; E785-R842 PolarHBondContact OE2-NH1 3.38Å; E785-R842 IonicContact OE2-NH2 2.86Å; E785-R842 PolarHBondContact OE2-NH2 3.46Å; Y789-R842 PolarHBondContact OH-NH1 3.18Å; G838-R842 VanDerWaalsContact O-CB 3.27Å; G838-R842 WeakPolarHBondContact O-CB 3.36Å; G838-R842 PolarHBondContact O-N 3.26Å; V839-R842 WeakPolarHBondContact O-CB 3.34Å; V839-R842 PolarHBondContact O-N 2.95Å; S840-R842 VanDerWaalsContact C-N 3.29Å; S840-R842 PolarHBondContact O-N 3.47Å; R842-S844 PolarHBondContact O-N 3.05Å; R842-F848 HydrophobicContact CG-CD2 4.46Å; R842-F848 HydrophobicContact CG-CE2 4.36Å
843	M	83.9	Confident	89.2	Confident	104 Å²	104	62.4 Å²	62.4	51%	0.512	34%	0.343	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.4	-13.5	179.5	-65.8	-58.6	140.5	0	0	113.4	Y789 V839 S840 C841	Y789-M843 HydrophobicContact CE2-CE 4.13Å; V839-M843 HydrophobicContact CG1-CE 3.98Å; V839-M843 WeakPolarHBondContact O-CG 3.42Å; V839-M843 PolarHBondContact O-N 2.9Å; V839-M843 VanDerWaalsContact O-N 3.16Å; S840-M843 PolarHBondContact O-N 2.86Å; C841-M843 VanDerWaalsContact C-N 3.26Å; C841-M843 PolarHBondContact O-N 2.99Å
844	S	84.7	Confident	89.2	Confident	49 Å²	49	58.6 Å²	58.6	34%	0.343	32%	0.324	S	S	.	.	S	Bend	trans	-106.2	130.4	-179.2	171.4	0	0	0	0	111.3	C841 R842 D846 T847 F848	C841-S844 PolarHBondContact O-N 3.04Å; R842-S844 PolarHBondContact O-N 3.05Å; S844-D846 VanDerWaalsContact C-N 3.35Å; S844-D846 PolarHBondContact O-N 2.91Å; S844-T847 WeakPolarHBondContact CB-OG1 3.5Å; S844-T847 PolarHBondContact O-N 2.89Å; S844-T847 PolarHBondContact OG-OG1 3.28Å; S844-F848 PolarHBondContact O-N 3.46Å
845	E	81.1	Confident	89.2	Confident	144 Å²	144	56.7 Å²	56.7	67%	0.673	32%	0.315	S	S	*	.	G	3₁₀ helix	trans	-61.1	-40.3	-177.9	-69.4	-177.9	174.5	0	0	112.4	P777 T847	P777-E845 HydrophobicContact CB-CG 4.1Å; P777-E845 HydrophobicContact CG-CG 4.19Å; E845-T847 VanDerWaalsContact C-N 3.26Å; E845-T847 PolarHBondContact O-N 2.7Å
846	D	83.2	Confident	89.2	Confident	161 Å²	161	58 Å²	58	86%	0.861	33%	0.327	S	S	*	.	G	3₁₀ helix	trans	-70	-21.7	-177.9	-67.8	-29.7	0	0	0	113.4	S844	S844-D846 VanDerWaalsContact C-N 3.35Å; S844-D846 PolarHBondContact O-N 2.91Å
847	T	88.9	Confident	89.2	Confident	52 Å²	52	58.4 Å²	58.4	32%	0.319	33%	0.326	S	S	.	.	G	3₁₀ helix	trans	-118.6	16.4	-174.4	55.7	0	0	0	0	113.3	C841 S844 E845 E849 A850 G851	C841-T847 CarbonylContact O-C 3.59Å; C841-T847 PolarHBondContact O-OG1 3.32Å; S844-T847 WeakPolarHBondContact CB-OG1 3.5Å; S844-T847 PolarHBondContact O-N 2.89Å; S844-T847 PolarHBondContact OG-OG1 3.28Å; E845-T847 VanDerWaalsContact C-N 3.26Å; E845-T847 PolarHBondContact O-N 2.7Å; T847-E849 PolarHBondContact O-N 2.9Å; T847-A850 CarbonylContact O-C 3.18Å; T847-A850 WeakPolarHBondContact O-CB 3.41Å; T847-A850 PolarHBondContact O-N 3.03Å; T847-A850 VanDerWaalsContact O-N 3.14Å; T847-G851 PolarHBondContact O-N 3.23Å
848	F	87.3	Confident	89.2	Confident	16 Å²	16	55.4 Å²	55.4	7%	0.07	31%	0.308	C	S	.	.	H	α-helix	trans	-59	-46.2	-177.5	179.1	-100.5	0	0	0	113.4	F774 K775 S776 R842 S844 A850 G851 R852	F774-F848 HydrophobicContact CD1-CE1 4.08Å; F774-F848 HydrophobicContact CD1-CE2 4.04Å; F774-F848 AromaticContact CD1-CZ 3.43Å; F774-F848 HydrophobicContact CD1-CZ 3.43Å; F774-F848 VanDerWaalsContact CD1-CZ 3.43Å; F774-F848 HydrophobicContact CE1-CD2 4.27Å; F774-F848 AromaticContact CE1-CE1 3.87Å; F774-F848 HydrophobicContact CE1-CE1 3.87Å; F774-F848 AromaticContact CE1-CE2 3.49Å; F774-F848 HydrophobicContact CE1-CE2 3.49Å; F774-F848 VanDerWaalsContact CE1-CE2 3.49Å; F774-F848 AromaticContact CE1-CZ 3.26Å; F774-F848 HydrophobicContact CE1-CZ 3.26Å; F774-F848 HydrophobicContact CZ-CE2 4.09Å; F774-F848 HydrophobicContact CZ-CZ 4.27Å; K775-F848 VanDerWaalsContact C-CZ 3.48Å; K775-F848 WeakPolarHBondContact O-CE2 3.32Å; S776-F848 VanDerWaalsContact CA-CZ 3.5Å; S776-F848 WeakPolarHBondContact OG-CE1 3.47Å; S776-F848 WeakPolarHBondContact OG-CZ 3.48Å; R842-F848 HydrophobicContact CG-CD2 4.46Å; R842-F848 HydrophobicContact CG-CE2 4.36Å; S844-F848 PolarHBondContact O-N 3.46Å; F848-A850 VanDerWaalsContact C-N 3.3Å; F848-A850 PolarHBondContact O-N 3.16Å; F848-G851 PolarHBondContact O-N 3.4Å; F848-G851 VanDerWaalsContact O-N 3.15Å; F848-R852 PolarHBondContact O-N 3.48Å
849	E	87.3	Confident	89.3	Confident	126 Å²	126	57.8 Å²	57.8	59%	0.589	32%	0.318	S	S	*	.	H	α-helix	trans	-66.3	-33.9	176.8	-69.2	-59.7	151.3	0	0	112.2	T847 R852 T853	T847-E849 PolarHBondContact O-N 2.9Å; E849-R852 PolarHBondContact O-N 3.39Å; E849-T853 WeakPolarHBondContact O-CB 3.48Å; E849-T853 PolarHBondContact O-N 2.75Å; E849-T853 PolarHBondContact O-OG1 2.93Å
850	A	89.1	Confident	89.4	Confident	45 Å²	45	62.5 Å²	62.5	37%	0.372	34%	0.34	S	S	.	.	H	α-helix	trans	-66.5	-41.2	172.1	0	0	0	0	0	110.8	T847 F848 R852 T853 V854	T847-A850 CarbonylContact O-C 3.18Å; T847-A850 WeakPolarHBondContact O-CB 3.41Å; T847-A850 PolarHBondContact O-N 3.03Å; T847-A850 VanDerWaalsContact O-N 3.14Å; F848-A850 VanDerWaalsContact C-N 3.3Å; F848-A850 PolarHBondContact O-N 3.16Å; A850-R852 PolarHBondContact O-N 2.83Å; A850-T853 PolarHBondContact O-N 3.34Å; A850-V854 VanDerWaalsContact O-CG2 3.29Å; A850-V854 WeakPolarHBondContact O-CG2 3.38Å; A850-V854 PolarHBondContact O-N 3.39Å
851	G	89.7	Confident	89.5	Confident	0 Å²	0	60.1 Å²	60.1	0%	0	32%	0.323	C	S	.	.	H	α-helix	trans	-59.2	-44.3	173.6	0	0	0	0	0	112.7	T847 F848 T853 V854 L855	T847-G851 PolarHBondContact O-N 3.23Å; F848-G851 PolarHBondContact O-N 3.4Å; F848-G851 VanDerWaalsContact O-N 3.15Å; G851-T853 VanDerWaalsContact C-N 3.33Å; G851-T853 PolarHBondContact O-N 3.47Å; G851-V854 PolarHBondContact O-N 3.5Å; G851-L855 WeakPolarHBondContact O-CB 3.45Å; G851-L855 WeakPolarHBondContact O-CG 3.46Å; G851-L855 PolarHBondContact O-N 2.91Å
852	R	90.9	Very high	89.6	Confident	78 Å²	78	59.1 Å²	59.1	29%	0.294	32%	0.315	S	S	.	.	H	α-helix	trans	-58.7	-45	173.1	-170.4	176.8	174.3	74.5	2.9	111.9	L770 F774 F848 E849 A850 A856	L770-R852 HydrophobicContact CD1-CG 4.44Å; L770-R852 VanDerWaalsContact O-CZ 3.3Å; L770-R852 PolarHBondContact O-NH1 3.36Å; L770-R852 PolarHBondContact O-NH2 3.37Å; F774-R852 HydrophobicContact CD1-CB 4.12Å; F774-R852 HydrophobicContact CD1-CG 3.97Å; F774-R852 HydrophobicContact CE1-CB 3.49Å; F774-R852 VanDerWaalsContact CE1-CB 3.49Å; F774-R852 HydrophobicContact CE1-CG 3.86Å; F774-R852 HydrophobicContact CZ-CB 3.97Å; F774-R852 HydrophobicContact CZ-CG 4.45Å; F848-R852 PolarHBondContact O-N 3.48Å; E849-R852 PolarHBondContact O-N 3.39Å; A850-R852 PolarHBondContact O-N 2.83Å; R852-A856 WeakPolarHBondContact O-CB 3.18Å; R852-A856 PolarHBondContact O-N 3.33Å
853	T	91.3	Very high	89.7	Confident	82 Å²	82	61.4 Å²	61.4	50%	0.503	33%	0.329	S	S	.	.	H	α-helix	trans	-65.3	-44.2	-179.5	-56.5	0	0	0	0	111.4	E849 A850 G851 A856 I857	E849-T853 WeakPolarHBondContact O-CB 3.48Å; E849-T853 PolarHBondContact O-N 2.75Å; E849-T853 PolarHBondContact O-OG1 2.93Å; A850-T853 PolarHBondContact O-N 3.34Å; G851-T853 VanDerWaalsContact C-N 3.33Å; G851-T853 PolarHBondContact O-N 3.47Å; T853-A856 PolarHBondContact O-N 3.15Å; T853-I857 WeakPolarHBondContact O-CG1 3.36Å; T853-I857 PolarHBondContact O-N 2.66Å; T853-I857 VanDerWaalsContact O-N 3.11Å
854	V	94.1	Very high	90	Very high	32 Å²	32	61 Å²	61	19%	0.194	33%	0.328	C	S	.	.	H	α-helix	trans	-64.6	-44.8	177.5	173.2	0	0	0	0	110.9	L834 V837 A850 G851 A856 I857 D858	L834-V854 HydrophobicContact CD2-CG1 4.45Å; L834-V854 WeakPolarHBondContact O-CG1 3.23Å; V837-V854 HydrophobicContact CG1-CG1 4.4Å; A850-V854 VanDerWaalsContact O-CG2 3.29Å; A850-V854 WeakPolarHBondContact O-CG2 3.38Å; A850-V854 PolarHBondContact O-N 3.39Å; G851-V854 PolarHBondContact O-N 3.5Å; V854-A856 VanDerWaalsContact C-N 3.28Å; V854-A856 PolarHBondContact O-N 2.67Å; V854-I857 PolarHBondContact O-N 3.33Å; V854-D858 VanDerWaalsContact O-CB 3.32Å; V854-D858 WeakPolarHBondContact O-CB 3.28Å; V854-D858 PolarHBondContact O-N 3.42Å
855	L	92.2	Very high	90	Very high	9 Å²	9	59.8 Å²	59.8	5%	0.047	32%	0.316	C	S	.	.	H	α-helix	trans	-66.2	-28.6	177	-70.8	171	0	0	0	113	F766 L770 F774 F835 V839 G851 F859	F766-L855 WeakPolarHBondContact CE1-O 3.23Å; F766-L855 HydrophobicContact CZ-CD2 4.47Å; L770-L855 HydrophobicContact CD1-CB 4.18Å; F774-L855 HydrophobicContact CE2-CD1 3.68Å; F774-L855 HydrophobicContact CZ-CD1 4.14Å; F835-L855 HydrophobicContact CD2-CD2 3.97Å; F835-L855 HydrophobicContact CE2-CD2 4.31Å; V839-L855 HydrophobicContact CG2-CD2 4.41Å; G851-L855 WeakPolarHBondContact O-CB 3.45Å; G851-L855 WeakPolarHBondContact O-CG 3.46Å; G851-L855 PolarHBondContact O-N 2.91Å; L855-F859 PolarHBondContact O-N 3.22Å
856	A	93.3	Very high	90.3	Very high	39 Å²	39	54 Å²	54	32%	0.322	29%	0.29	S	S	.	.	H	α-helix	trans	-70.1	-40	173.2	0	0	0	0	0	112.4	L770 R852 T853 V854 M860	L770-A856 HydrophobicContact CD2-CB 3.96Å; R852-A856 WeakPolarHBondContact O-CB 3.18Å; R852-A856 PolarHBondContact O-N 3.33Å; T853-A856 PolarHBondContact O-N 3.15Å; V854-A856 VanDerWaalsContact C-N 3.28Å; V854-A856 PolarHBondContact O-N 2.67Å; A856-M860 PolarHBondContact O-N 3.13Å
857	I	93.2	Very high	90.5	Very high	90 Å²	90	49.8 Å²	49.8	46%	0.462	27%	0.267	S	S	.	.	H	α-helix	trans	-66.5	-42.7	172.6	-66.4	170.2	0	0	0	109.9	L834 T853 V854 F859 M860 V861	L834-I857 HydrophobicContact CD1-CG2 4.47Å; T853-I857 WeakPolarHBondContact O-CG1 3.36Å; T853-I857 PolarHBondContact O-N 2.66Å; T853-I857 VanDerWaalsContact O-N 3.11Å; V854-I857 PolarHBondContact O-N 3.33Å; I857-F859 VanDerWaalsContact C-N 3.33Å; I857-F859 PolarHBondContact O-N 3.27Å; I857-M860 WeakPolarHBondContact O-CA 3.19Å; I857-M860 VanDerWaalsContact O-CB 3.3Å; I857-M860 WeakPolarHBondContact O-CB 3.23Å; I857-M860 PolarHBondContact O-N 3.47Å; I857-V861 PolarHBondContact O-N 3.02Å
858	D	94.3	Very high	90.2	Very high	0 Å²	0	48.5 Å²	48.5	0%	0	26%	0.257	C	S	.	.	H	α-helix	trans	-58.6	-42.6	177.3	-176.4	55.5	0	0	0	112.3	L834 F835 V854 M860 V861 F862	L834-D858 HydrophobicContact CB-CB 4.09Å; L834-D858 WeakPolarHBondContact CB-OD1 3.39Å; F835-D858 WeakPolarHBondContact CD2-OD2 3.31Å; F835-D858 PolarHBondContact N-OD1 3.04Å; V854-D858 VanDerWaalsContact O-CB 3.32Å; V854-D858 WeakPolarHBondContact O-CB 3.28Å; V854-D858 PolarHBondContact O-N 3.42Å; D858-M860 VanDerWaalsContact C-N 3.26Å; D858-M860 PolarHBondContact O-N 3.39Å; D858-V861 WeakPolarHBondContact O-CB 3.41Å; D858-V861 PolarHBondContact O-N 3.47Å; D858-F862 WeakPolarHBondContact O-CD2 3.37Å; D858-F862 PolarHBondContact O-N 3.11Å; D858-F862 VanDerWaalsContact OD2-CE2 3.22Å; D858-F862 WeakPolarHBondContact OD2-CE2 3.38Å
859	F	93.4	Very high	90.1	Very high	50 Å²	50	48.4 Å²	48.4	22%	0.219	26%	0.257	C	S	.	.	H	α-helix	trans	-56.1	-38	171.8	175.3	-104.8	0	0	0	113	L763 F766 T767 L770 L855 I857 V861 T863	L763-F859 HydrophobicContact CB-CE2 4.48Å; L763-F859 HydrophobicContact CD2-CD2 4.5Å; L763-F859 HydrophobicContact CD2-CE2 4.11Å; F766-F859 HydrophobicContact CB-CD2 4.15Å; F766-F859 HydrophobicContact CB-CE2 4.46Å; F766-F859 HydrophobicContact CD1-CB 3.96Å; F766-F859 AromaticContact CD1-CD2 3.67Å; F766-F859 HydrophobicContact CD1-CD2 3.67Å; F766-F859 HydrophobicContact CD1-CG 4.18Å; F766-F859 HydrophobicContact CE1-CB 3.66Å; F766-F859 HydrophobicContact CE1-CD2 4.26Å; F766-F859 HydrophobicContact CE1-CG 4.37Å; F766-F859 AromaticContact CG-CD2 3.89Å; F766-F859 HydrophobicContact CG-CD2 3.89Å; F766-F859 HydrophobicContact CZ-CB 4.12Å; T767-F859 WeakPolarHBondContact OG1-CE2 2.85Å; T767-F859 WeakPolarHBondContact OG1-CZ 3.47Å; L770-F859 HydrophobicContact CD2-CB 4.48Å; L855-F859 PolarHBondContact O-N 3.22Å; I857-F859 VanDerWaalsContact C-N 3.33Å; I857-F859 PolarHBondContact O-N 3.27Å; F859-V861 VanDerWaalsContact C-N 3.34Å; F859-T863 WeakPolarHBondContact O-CB 3.5Å; F859-T863 PolarHBondContact O-N 2.93Å; F859-T863 PolarHBondContact O-OG1 3.44Å
860	M	92.1	Very high	90.1	Very high	125 Å²	125	46.6 Å²	46.6	62%	0.616	25%	0.247	S	C	*	.	H	α-helix	trans	-64.2	-41.1	174.9	-64.4	-179.3	62.2	0	0	111.2	A856 I857 D858 T863 L864	A856-M860 PolarHBondContact O-N 3.13Å; I857-M860 WeakPolarHBondContact O-CA 3.19Å; I857-M860 VanDerWaalsContact O-CB 3.3Å; I857-M860 WeakPolarHBondContact O-CB 3.23Å; I857-M860 PolarHBondContact O-N 3.47Å; D858-M860 VanDerWaalsContact C-N 3.26Å; D858-M860 PolarHBondContact O-N 3.39Å; M860-T863 PolarHBondContact O-N 3.37Å; M860-L864 WeakPolarHBondContact O-CG 3.42Å; M860-L864 PolarHBondContact O-N 2.97Å
861	V	92	Very high	89.8	Confident	22 Å²	22	45 Å²	45	13%	0.133	23%	0.234	C	C	.	.	H	α-helix	trans	-65.1	-46.2	178.2	-175.3	0	0	0	0	110.9	A831 L834 I857 D858 F859 T863 L864 R865	A831-V861 HydrophobicContact CB-CB 4.43Å; A831-V861 HydrophobicContact CB-CG1 3.79Å; L834-V861 HydrophobicContact CD1-CG2 4.01Å; I857-V861 PolarHBondContact O-N 3.02Å; D858-V861 WeakPolarHBondContact O-CB 3.41Å; D858-V861 PolarHBondContact O-N 3.47Å; F859-V861 VanDerWaalsContact C-N 3.34Å; V861-T863 VanDerWaalsContact C-N 3.26Å; V861-T863 PolarHBondContact O-N 2.92Å; V861-L864 WeakPolarHBondContact O-CB 3.34Å; V861-L864 PolarHBondContact O-N 3.45Å; V861-L864 VanDerWaalsContact O-N 3.15Å; V861-R865 PolarHBondContact O-N 3Å
862	F	91.4	Very high	89.6	Confident	12 Å²	12	46.4 Å²	46.4	5%	0.053	24%	0.241	C	C	.	.	H	α-helix	trans	-60.5	-34.8	172.2	-80.2	-65.5	0	0	0	112.2	Y759 F762 L763 F766 A831 F835 D858 R865	Y759-F862 PolarHBondContact OH-O 3.49Å; F762-F862 HydrophobicContact CE1-CB 4.31Å; F762-F862 AromaticContact CE1-CD1 3.91Å; F762-F862 HydrophobicContact CE1-CD1 3.91Å; F762-F862 HydrophobicContact CE1-CE1 4.38Å; F762-F862 HydrophobicContact CE1-CG 4.04Å; F762-F862 HydrophobicContact CZ-CD1 4.19Å; F762-F862 HydrophobicContact CZ-CD2 4.42Å; F762-F862 HydrophobicContact CZ-CE1 4.28Å; F762-F862 HydrophobicContact CZ-CE2 4.5Å; F762-F862 HydrophobicContact CZ-CG 4.26Å; F762-F862 HydrophobicContact CZ-CZ 4.44Å; L763-F862 HydrophobicContact CD2-CB 4.07Å; F766-F862 AromaticContact CE2-CD2 3.97Å; F766-F862 HydrophobicContact CE2-CD2 3.97Å; F766-F862 HydrophobicContact CE2-CE2 4.26Å; A831-F862 HydrophobicContact CB-CD1 4.28Å; A831-F862 HydrophobicContact CB-CD2 4.42Å; A831-F862 HydrophobicContact CB-CE1 3.95Å; A831-F862 HydrophobicContact CB-CE2 4.1Å; A831-F862 HydrophobicContact CB-CZ 3.86Å; F835-F862 HydrophobicContact CB-CE2 4.4Å; F835-F862 HydrophobicContact CD2-CE2 4.39Å; D858-F862 WeakPolarHBondContact O-CD2 3.37Å; D858-F862 PolarHBondContact O-N 3.11Å; D858-F862 VanDerWaalsContact OD2-CE2 3.22Å; D858-F862 WeakPolarHBondContact OD2-CE2 3.38Å; F862-R865 WeakPolarHBondContact O-CB 3.38Å; F862-R865 PolarHBondContact O-N 2.94Å
863	T	90.8	Very high	89.4	Confident	53 Å²	53	46.9 Å²	46.9	33%	0.325	25%	0.247	S	C	.	.	H	α-helix	trans	-69	-38.7	174.9	-56.8	0	0	0	0	112	F859 M860 V861 R865 L866	F859-T863 WeakPolarHBondContact O-CB 3.5Å; F859-T863 PolarHBondContact O-N 2.93Å; F859-T863 PolarHBondContact O-OG1 3.44Å; M860-T863 PolarHBondContact O-N 3.37Å; V861-T863 VanDerWaalsContact C-N 3.26Å; V861-T863 PolarHBondContact O-N 2.92Å; T863-R865 PolarHBondContact O-N 3.12Å; T863-L866 HydrophobicContact CG2-CD1 4.29Å; T863-L866 VanDerWaalsContact O-CB 3.26Å; T863-L866 WeakPolarHBondContact O-CB 2.99Å; T863-L866 WeakPolarHBondContact O-CG 3.32Å; T863-L866 PolarHBondContact O-N 2.97Å
864	L	88.9	Confident	89	Confident	96 Å²	96	50.4 Å²	50.4	50%	0.503	26%	0.255	S	S	.	.	H	α-helix	trans	-60.8	-29.7	175.7	-72.4	173.8	0	0	0	112.4	M860 V861 L866 I867	M860-L864 WeakPolarHBondContact O-CG 3.42Å; M860-L864 PolarHBondContact O-N 2.97Å; V861-L864 WeakPolarHBondContact O-CB 3.34Å; V861-L864 PolarHBondContact O-N 3.45Å; V861-L864 VanDerWaalsContact O-N 3.15Å; L864-L866 PolarHBondContact O-N 3.12Å; L864-I867 HydrophobicContact CD2-CD1 4.05Å; L864-I867 VanDerWaalsContact O-CB 3.31Å; L864-I867 WeakPolarHBondContact O-CB 3.34Å; L864-I867 WeakPolarHBondContact O-CG1 3.26Å; L864-I867 PolarHBondContact O-N 3.42Å
865	R	86.5	Confident	88.6	Confident	23 Å²	23	55.8 Å²	55.8	9%	0.087	28%	0.278	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60.1	-22.9	174.6	-179.9	60.7	175.5	-162.5	-7.8	113.4	Y759 W824 D828 V861 F862 T863 I867 H868	Y759-R865 WeakPolarHBondContact OH-CB 3.2Å; W824-R865 PolarHBondContact O-NH1 3.23Å; D828-R865 VanDerWaalsContact CG-NH1 3.26Å; D828-R865 VanDerWaalsContact OD1-CD 3.24Å; D828-R865 WeakPolarHBondContact OD1-CD 3.46Å; D828-R865 IonicContact OD1-CZ 3.04Å; D828-R865 IonicContact OD1-NE 2.7Å; D828-R865 PolarHBondContact OD1-NE 3.47Å; D828-R865 VanDerWaalsContact OD1-NE 3.17Å; D828-R865 IonicContact OD1-NH1 3.04Å; D828-R865 PolarHBondContact OD1-NH1 3.04Å; D828-R865 VanDerWaalsContact OD1-NH1 3.11Å; D828-R865 IonicContact OD1-NH2 2.74Å; D828-R865 IonicContact OD2-CZ 3.35Å; D828-R865 IonicContact OD2-NE 2.83Å; D828-R865 IonicContact OD2-NH1 2.74Å; D828-R865 PolarHBondContact OD2-NH1 3.46Å; D828-R865 IonicContact OD2-NH2 3.98Å; D828-R865 PolarHBondContact OD2-NH2 3.47Å; V861-R865 PolarHBondContact O-N 3Å; F862-R865 WeakPolarHBondContact O-CB 3.38Å; F862-R865 PolarHBondContact O-N 2.94Å; T863-R865 PolarHBondContact O-N 3.12Å; R865-I867 PolarHBondContact O-N 2.84Å; R865-H868 WeakPolarHBondContact O-CB 3.43Å; R865-H868 PolarHBondContact O-N 3.43Å; R865-H868 VanDerWaalsContact O-N 3.1Å
866	L	86.4	Confident	88.4	Confident	22 Å²	22	59 Å²	59	12%	0.115	30%	0.295	C	S	.	.	H	α-helix	trans	-58.1	-28.9	172.3	-70.7	175.9	0	0	0	112.9	Y759 F760 L763 T863 L864 H868 I869 F870	Y759-L866 HydrophobicContact CD1-CD2 3.49Å; Y759-L866 VanDerWaalsContact CD1-CD2 3.49Å; Y759-L866 HydrophobicContact CD1-CG 4.41Å; Y759-L866 HydrophobicContact CE1-CD2 3.59Å; Y759-L866 HydrophobicContact CE1-CG 4.03Å; F760-L866 HydrophobicContact CE1-CD1 4.12Å; F760-L866 HydrophobicContact CE1-CD2 4.23Å; F760-L866 HydrophobicContact CE2-CD2 4.39Å; F760-L866 HydrophobicContact CZ-CD1 4.41Å; F760-L866 HydrophobicContact CZ-CD2 4Å; L763-L866 HydrophobicContact CD1-CD1 3.66Å; L763-L866 HydrophobicContact CD1-CD2 3.99Å; L763-L866 HydrophobicContact CD1-CG 3.89Å; T863-L866 HydrophobicContact CG2-CD1 4.29Å; T863-L866 VanDerWaalsContact O-CB 3.26Å; T863-L866 WeakPolarHBondContact O-CB 2.99Å; T863-L866 WeakPolarHBondContact O-CG 3.32Å; T863-L866 PolarHBondContact O-N 2.97Å; L864-L866 PolarHBondContact O-N 3.12Å; L866-H868 VanDerWaalsContact C-N 3.27Å; L866-H868 PolarHBondContact O-N 3.22Å; L866-I869 HydrophobicContact CD2-CD1 4.3Å; L866-I869 PolarHBondContact O-N 2.86Å; L866-F870 HydrophobicContact CB-CD2 4.42Å; L866-F870 HydrophobicContact CB-CE2 4.24Å; L866-F870 WeakPolarHBondContact O-CD2 3.44Å; L866-F870 PolarHBondContact O-N 3.34Å
867	I	87	Confident	88.1	Confident	73 Å²	73	57.1 Å²	57.1	37%	0.374	28%	0.279	S	S	.	.	H	α-helix	trans	-60.8	-40.8	178.1	-60.4	172.3	0	0	0	110.2	W824 L864 R865 I869 F870 A871 I880	W824-I867 HydrophobicContact CH2-CB 4.05Å; W824-I867 HydrophobicContact CH2-CG2 3.87Å; L864-I867 HydrophobicContact CD2-CD1 4.05Å; L864-I867 VanDerWaalsContact O-CB 3.31Å; L864-I867 WeakPolarHBondContact O-CB 3.34Å; L864-I867 WeakPolarHBondContact O-CG1 3.26Å; L864-I867 PolarHBondContact O-N 3.42Å; R865-I867 PolarHBondContact O-N 2.84Å; I867-I869 PolarHBondContact O-N 3.26Å; I867-F870 PolarHBondContact O-N 3.47Å; I867-A871 PolarHBondContact O-N 3.36Å; I867-I880 HydrophobicContact CG2-CD1 3.95Å; I867-I880 HydrophobicContact CG2-CG1 3.98Å; I867-I880 HydrophobicContact CG2-CG2 3.86Å; I867-I880 WeakPolarHBondContact O-CD1 3.36Å
868	H	83.6	Confident	87.9	Confident	25 Å²	25	53.8 Å²	53.8	12%	0.116	26%	0.264	C	S	.	.	H	α-helix	trans	-62.3	-42.7	176.9	-173	-122.4	0	0	0	111.8	W824 R865 L866 F870 A871	W824-H868 AromaticContact CD1-CD2 3.5Å; W824-H868 VanDerWaalsContact CD1-CD2 3.5Å; W824-H868 AromaticContact CD1-NE2 3.82Å; W824-H868 HydrophobicContact CD2-CB 3.87Å; W824-H868 AromaticContact CD2-CD2 3.55Å; W824-H868 AromaticContact CD2-CG 3.85Å; W824-H868 AromaticContact CE2-CD2 3.62Å; W824-H868 HydrophobicContact CE3-CB 3.68Å; W824-H868 AromaticContact CG-CD2 3.48Å; W824-H868 VanDerWaalsContact CG-CD2 3.48Å; W824-H868 AromaticContact CG-CG 4Å; W824-H868 AromaticContact CG-NE2 3.93Å; W824-H868 HydrophobicContact CH2-CB 4.19Å; W824-H868 HydrophobicContact CZ2-CB 4.37Å; W824-H868 HydrophobicContact CZ3-CB 3.84Å; W824-H868 AromaticContact NE1-CD2 3.58Å; R865-H868 WeakPolarHBondContact O-CB 3.43Å; R865-H868 PolarHBondContact O-N 3.43Å; R865-H868 VanDerWaalsContact O-N 3.1Å; L866-H868 VanDerWaalsContact C-N 3.27Å; L866-H868 PolarHBondContact O-N 3.22Å; H868-F870 VanDerWaalsContact C-N 3.34Å; H868-F870 PolarHBondContact O-N 3.1Å; H868-A871 WeakPolarHBondContact O-CB 3.42Å; H868-A871 PolarHBondContact O-N 2.88Å; H868-A871 VanDerWaalsContact O-N 3.16Å
869	I	85.3	Confident	87.6	Confident	14 Å²	14	60.1 Å²	60.1	7%	0.072	29%	0.292	C	S	.	.	H	α-helix	trans	-62.5	-42.1	178.4	-63.3	177.6	0	0	0	111.1	F752 V756 Y759 L866 I867 A871 I872	F752-I869 HydrophobicContact CE2-CG2 4.05Å; F752-I869 HydrophobicContact CZ-CG2 3.96Å; V756-I869 HydrophobicContact CG1-CG2 4.46Å; V756-I869 HydrophobicContact CG2-CG2 3.46Å; V756-I869 VanDerWaalsContact CG2-CG2 3.46Å; Y759-I869 HydrophobicContact CD1-CD1 3.84Å; Y759-I869 HydrophobicContact CE1-CD1 4.24Å; Y759-I869 HydrophobicContact CG-CD1 4.09Å; L866-I869 HydrophobicContact CD2-CD1 4.3Å; L866-I869 PolarHBondContact O-N 2.86Å; I867-I869 PolarHBondContact O-N 3.26Å; I869-A871 PolarHBondContact O-N 3.43Å; I869-I872 WeakPolarHBondContact O-CG2 3.37Å
870	F	86.1	Confident	87.4	Confident	88 Å²	88	59.2 Å²	59.2	39%	0.386	29%	0.288	S	S	.	.	H	α-helix	trans	-74.5	-8.8	179	-68.6	-50.8	0	0	0	114.3	F760 L866 I867 H868 I872 H873 L876	F760-F870 HydrophobicContact CE2-CZ 4.4Å; F760-F870 AromaticContact CZ-CZ 3.94Å; F760-F870 HydrophobicContact CZ-CZ 3.94Å; L866-F870 HydrophobicContact CB-CD2 4.42Å; L866-F870 HydrophobicContact CB-CE2 4.24Å; L866-F870 WeakPolarHBondContact O-CD2 3.44Å; L866-F870 PolarHBondContact O-N 3.34Å; I867-F870 PolarHBondContact O-N 3.47Å; H868-F870 VanDerWaalsContact C-N 3.34Å; H868-F870 PolarHBondContact O-N 3.1Å; F870-I872 PolarHBondContact O-N 3.16Å; F870-H873 WeakPolarHBondContact O-CB 3.44Å; F870-H873 PolarHBondContact O-N 2.81Å; F870-H873 VanDerWaalsContact O-N 3.1Å; F870-L876 HydrophobicContact CB-CD1 4.25Å
871	A	83.9	Confident	87	Confident	12 Å²	12	53.6 Å²	53.6	10%	0.099	26%	0.261	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.3	-24.2	176.9	0	0	0	0	0	113	I867 H868 I869 H873 G877 I880 W1015	I867-A871 PolarHBondContact O-N 3.36Å; H868-A871 WeakPolarHBondContact O-CB 3.42Å; H868-A871 PolarHBondContact O-N 2.88Å; H868-A871 VanDerWaalsContact O-N 3.16Å; I869-A871 PolarHBondContact O-N 3.43Å; A871-H873 PolarHBondContact O-N 3.35Å; A871-G877 VanDerWaalsContact O-CA 3.26Å; A871-G877 WeakPolarHBondContact O-CA 3.25Å; A871-I880 HydrophobicContact CB-CD1 4.21Å; A871-W1015 PolarHBondContact O-NE1 3.47Å
872	I	84.5	Confident	86.8	Confident	29 Å²	29	53.2 Å²	53.2	15%	0.149	26%	0.258	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66.8	-22.4	175.9	-158.9	165.7	0	0	0	113.3	W652 F752 I869 F870 K874 W1015 L1022	W652-I872 HydrophobicContact CH2-CD1 3.31Å; W652-I872 HydrophobicContact CZ2-CD1 3.64Å; W652-I872 HydrophobicContact CZ3-CD1 3.89Å; F752-I872 HydrophobicContact CD2-CD1 4.46Å; F752-I872 HydrophobicContact CE1-CG2 4.14Å; F752-I872 HydrophobicContact CE2-CD1 4.38Å; F752-I872 HydrophobicContact CE2-CG2 4.02Å; F752-I872 HydrophobicContact CZ-CG2 3.53Å; I869-I872 WeakPolarHBondContact O-CG2 3.37Å; F870-I872 PolarHBondContact O-N 3.16Å; I872-K874 PolarHBondContact O-N 2.96Å; I872-W1015 WeakPolarHBondContact O-CZ2 3.4Å; I872-L1022 HydrophobicContact CB-CD2 3.54Å; I872-L1022 HydrophobicContact CD1-CD2 3.83Å; I872-L1022 HydrophobicContact CG1-CD2 3.8Å
873	H	86.2	Confident	86.6	Confident	89 Å²	89	56.7 Å²	56.7	41%	0.412	28%	0.28	S	S	.	.	S	Bend	trans	-76.4	130	-172.7	-175.1	-97.4	0	0	0	111.5	F870 A871 Q875 L876 G877	F870-H873 WeakPolarHBondContact O-CB 3.44Å; F870-H873 PolarHBondContact O-N 2.81Å; F870-H873 VanDerWaalsContact O-N 3.1Å; A871-H873 PolarHBondContact O-N 3.35Å; H873-Q875 PolarHBondContact ND1-N 3.27Å; H873-Q875 PolarHBondContact O-N 2.92Å; H873-L876 HydrophobicContact CB-CB 4.26Å; H873-L876 PolarHBondContact O-N 3.45Å; H873-G877 PolarHBondContact O-N 3.48Å
874	K	84.4	Confident	86.4	Confident	155 Å²	155	57.7 Å²	57.7	67%	0.674	28%	0.281	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52	-34	-175.6	-173.8	174.5	-179.2	175.9	0	114.7	I872 P878 W1015	I872-K874 PolarHBondContact O-N 2.96Å; K874-P878 WeakPolarHBondContact O-CD 3.49Å; K874-W1015 VanDerWaalsContact CA-CZ2 3.48Å; K874-W1015 HydrophobicContact CB-CH2 3.87Å; K874-W1015 HydrophobicContact CB-CZ2 4.12Å; K874-W1015 HydrophobicContact CG-CH2 3.92Å; K874-W1015 HydrophobicContact CG-CZ3 4.19Å
875	Q	86.2	Confident	86.1	Confident	145 Å²	145	57.5 Å²	57.5	68%	0.678	27%	0.274	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.6	-22.6	-179.1	-58.3	-178.9	-9.7	0	0	114.4	H873	H873-Q875 PolarHBondContact ND1-N 3.27Å; H873-Q875 PolarHBondContact O-N 2.92Å
876	L	86.9	Confident	86.2	Confident	76 Å²	76	57.8 Å²	57.8	40%	0.398	28%	0.276	S	S	.	.	T	Hydrogen-bonded Turn	trans	-99.8	-35.8	-174.7	-66.1	175.9	0	0	0	111.9	F870 H873 K879 I880	F870-L876 HydrophobicContact CB-CD1 4.25Å; H873-L876 HydrophobicContact CB-CB 4.26Å; H873-L876 PolarHBondContact O-N 3.45Å; L876-K879 WeakPolarHBondContact O-CB 3.46Å; L876-K879 PolarHBondContact O-N 3.4Å; L876-K879 VanDerWaalsContact O-N 3.09Å; L876-I880 WeakPolarHBondContact O-CG1 3.4Å; L876-I880 PolarHBondContact O-N 2.87Å
877	G	87.1	Confident	86.1	Confident	0 Å²	0	61.9 Å²	61.9	0%	0	30%	0.296	C	S	.	.	H	α-helix	trans	-54.6	-53	-178.8	0	0	0	0	0	114.2	A871 H873 K879 I880 I881 W1015	A871-G877 VanDerWaalsContact O-CA 3.26Å; A871-G877 WeakPolarHBondContact O-CA 3.25Å; H873-G877 PolarHBondContact O-N 3.48Å; G877-K879 PolarHBondContact O-N 3.05Å; G877-I880 PolarHBondContact O-N 3.47Å; G877-I881 PolarHBondContact O-N 2.95Å; G877-I881 VanDerWaalsContact O-N 3.1Å; G877-W1015 VanDerWaalsContact CA-CD1 3.49Å
878	P	89.1	Confident	86	Confident	21 Å²	21	65.8 Å²	65.8	14%	0.136	31%	0.31	C	S	.	.	H	α-helix	trans	-58	-33.4	177.3	-26.4	35.1	0	0	0	113.3	K874 I881 I882 W1015	K874-P878 WeakPolarHBondContact O-CD 3.49Å; P878-I881 PolarHBondContact O-N 3.21Å; P878-I882 VanDerWaalsContact O-CG1 3.3Å; P878-I882 WeakPolarHBondContact O-CG1 3.28Å; P878-I882 PolarHBondContact O-N 3.44Å; P878-W1015 HydrophobicContact CG-CB 3.93Å; P878-W1015 HydrophobicContact CG-CD2 4.2Å; P878-W1015 HydrophobicContact CG-CG 3.86Å
879	K	88.7	Confident	86.2	Confident	133 Å²	133	66.4 Å²	66.4	58%	0.578	31%	0.314	S	S	*	.	H	α-helix	trans	-70.7	-38.6	177.4	-61.8	-178.8	-178.9	179.2	0	111.9	L876 G877 I881 I882 V883	L876-K879 WeakPolarHBondContact O-CB 3.46Å; L876-K879 PolarHBondContact O-N 3.4Å; L876-K879 VanDerWaalsContact O-N 3.09Å; G877-K879 PolarHBondContact O-N 3.05Å; K879-I881 VanDerWaalsContact C-N 3.31Å; K879-I881 PolarHBondContact O-N 3.42Å; K879-I882 WeakPolarHBondContact O-CB 3.22Å; K879-I882 PolarHBondContact O-N 3.19Å; K879-V883 WeakPolarHBondContact O-CG2 3.42Å; K879-V883 PolarHBondContact O-N 2.83Å
880	I	87.9	Confident	86.3	Confident	30 Å²	30	67.1 Å²	67.1	15%	0.154	32%	0.32	C	S	.	.	H	α-helix	trans	-63	-40.3	175.9	-67.7	162.6	0	0	0	110.3	I867 A871 L876 G877 I882 V883 E884	I867-I880 HydrophobicContact CG2-CD1 3.95Å; I867-I880 HydrophobicContact CG2-CG1 3.98Å; I867-I880 HydrophobicContact CG2-CG2 3.86Å; I867-I880 WeakPolarHBondContact O-CD1 3.36Å; A871-I880 HydrophobicContact CB-CD1 4.21Å; L876-I880 WeakPolarHBondContact O-CG1 3.4Å; L876-I880 PolarHBondContact O-N 2.87Å; G877-I880 PolarHBondContact O-N 3.47Å; I880-I882 PolarHBondContact O-N 3.48Å; I880-V883 PolarHBondContact O-N 3Å; I880-E884 PolarHBondContact O-N 2.86Å
881	I	84.9	Confident	86.4	Confident	7 Å²	7	69.8 Å²	69.8	4%	0.036	33%	0.331	C	S	.	.	H	α-helix	trans	-64.3	-38.1	176.3	-70.1	-65.5	0	0	0	113.2	G877 P878 K879 R885 T1011 F1014	G877-I881 PolarHBondContact O-N 2.95Å; G877-I881 VanDerWaalsContact O-N 3.1Å; P878-I881 PolarHBondContact O-N 3.21Å; K879-I881 VanDerWaalsContact C-N 3.31Å; K879-I881 PolarHBondContact O-N 3.42Å; I881-R885 PolarHBondContact O-N 3.34Å; I881-T1011 HydrophobicContact CG2-CG2 4.39Å; I881-F1014 HydrophobicContact CG2-CB 4.23Å
882	I	87.4	Confident	86.5	Confident	14 Å²	14	75.5 Å²	75.5	7%	0.072	35%	0.354	C	S	.	.	H	α-helix	trans	-61.4	-49.2	173.7	-70.8	167.2	0	0	0	109.9	P878 K879 I880 E884 R885 M886 F1004 V1007 T1011	P878-I882 VanDerWaalsContact O-CG1 3.3Å; P878-I882 WeakPolarHBondContact O-CG1 3.28Å; P878-I882 PolarHBondContact O-N 3.44Å; K879-I882 WeakPolarHBondContact O-CB 3.22Å; K879-I882 PolarHBondContact O-N 3.19Å; I880-I882 PolarHBondContact O-N 3.48Å; I882-E884 PolarHBondContact O-N 3.41Å; I882-R885 PolarHBondContact O-N 3.03Å; I882-M886 HydrophobicContact CG2-CG 4.3Å; I882-M886 HydrophobicContact CG2-SD 3.43Å; I882-M886 WeakPolarHBondContact CG2-SD 3.46Å; I882-M886 VanDerWaalsContact O-CG 3.24Å; I882-M886 WeakPolarHBondContact O-CG 3.44Å; I882-M886 PolarHBondContact O-N 2.64Å; I882-F1004 HydrophobicContact CD1-CD2 4.22Å; I882-F1004 HydrophobicContact CD1-CE2 3.88Å; I882-F1004 HydrophobicContact CG2-CD2 3.76Å; I882-F1004 HydrophobicContact CG2-CE2 4.31Å; I882-V1007 HydrophobicContact CG1-CG1 3.92Å; I882-T1011 HydrophobicContact CD1-CG2 3.94Å; I882-T1011 HydrophobicContact CG1-CG2 3.47Å; I882-T1011 VanDerWaalsContact CG1-CG2 3.47Å
883	V	87.8	Confident	86.7	Confident	85 Å²	85	74.6 Å²	74.6	52%	0.515	35%	0.349	S	S	.	.	H	α-helix	trans	-58.6	-47.3	179.1	172.6	0	0	0	0	111	K879 I880 R885 M886 M887	K879-V883 WeakPolarHBondContact O-CG2 3.42Å; K879-V883 PolarHBondContact O-N 2.83Å; I880-V883 PolarHBondContact O-N 3Å; V883-R885 VanDerWaalsContact C-N 3.27Å; V883-R885 PolarHBondContact O-N 3.33Å; V883-M886 PolarHBondContact O-N 3.29Å; V883-M886 VanDerWaalsContact O-N 3.16Å; V883-M887 WeakPolarHBondContact O-CG 3.26Å; V883-M887 PolarHBondContact O-N 3.42Å; V883-M887 VanDerWaalsContact O-N 3.08Å
884	E	84.7	Confident	86.8	Confident	74 Å²	74	74.3 Å²	74.3	35%	0.346	35%	0.35	S	S	.	.	H	α-helix	trans	-56.3	-41.1	178.7	-172.6	-176.2	177.4	0	0	112.3	N823 I880 I882 M887	N823-E884 PolarHBondContact ND2-OE1 3.47Å; I880-E884 PolarHBondContact O-N 2.86Å; I882-E884 PolarHBondContact O-N 3.41Å; E884-M887 PolarHBondContact O-N 3.25Å
885	R	83.9	Confident	87.1	Confident	93 Å²	93	72.9 Å²	72.9	35%	0.351	34%	0.344	S	S	.	.	H	α-helix	trans	-72.2	-38	178.2	-71.7	-173.9	177.3	-161.1	2.4	113	I881 I882 V883 M887 K888 F1014	I881-R885 PolarHBondContact O-N 3.34Å; I882-R885 PolarHBondContact O-N 3.03Å; V883-R885 VanDerWaalsContact C-N 3.27Å; V883-R885 PolarHBondContact O-N 3.33Å; R885-M887 PolarHBondContact O-N 3.02Å; R885-K888 PolarHBondContact O-N 2.75Å; R885-F1014 VanDerWaalsContact NH2-CE2 3.3Å
886	M	87.4	Confident	87.2	Confident	28 Å²	28	72.1 Å²	72.1	14%	0.138	34%	0.339	C	S	.	.	H	α-helix	trans	-66.9	-23	177.4	-67.3	170.4	74.8	0	0	112.6	I882 V883 K888 D889 V890 F1000 T1003	I882-M886 HydrophobicContact CG2-CG 4.3Å; I882-M886 HydrophobicContact CG2-SD 3.43Å; I882-M886 WeakPolarHBondContact CG2-SD 3.46Å; I882-M886 VanDerWaalsContact O-CG 3.24Å; I882-M886 WeakPolarHBondContact O-CG 3.44Å; I882-M886 PolarHBondContact O-N 2.64Å; V883-M886 PolarHBondContact O-N 3.29Å; V883-M886 VanDerWaalsContact O-N 3.16Å; M886-K888 PolarHBondContact O-N 3.37Å; M886-D889 PolarHBondContact O-N 3.03Å; M886-V890 WeakPolarHBondContact O-CG2 3.48Å; M886-V890 PolarHBondContact O-N 3.29Å; M886-F1000 HydrophobicContact CB-CD1 4.35Å; M886-F1000 HydrophobicContact CB-CE1 4.3Å; M886-F1000 HydrophobicContact CE-CB 3.28Å; M886-F1000 HydrophobicContact CE-CD1 3.45Å; M886-F1000 VanDerWaalsContact CE-CD1 3.45Å; M886-F1000 HydrophobicContact CE-CD2 3.7Å; M886-F1000 HydrophobicContact CE-CE1 4.17Å; M886-F1000 HydrophobicContact CE-CE2 4.38Å; M886-F1000 HydrophobicContact CE-CG 3.18Å; M886-T1003 HydrophobicContact CG-CG2 3.94Å
887	M	85.1	Confident	87.3	Confident	109 Å²	109	69.4 Å²	69.4	54%	0.537	33%	0.325	S	S	.	.	H	α-helix	trans	-60.1	-26	176.5	-72.1	-58.8	-67.3	0	0	113.7	V883 E884 R885 V890 F891	V883-M887 WeakPolarHBondContact O-CG 3.26Å; V883-M887 PolarHBondContact O-N 3.42Å; V883-M887 VanDerWaalsContact O-N 3.08Å; E884-M887 PolarHBondContact O-N 3.25Å; R885-M887 PolarHBondContact O-N 3.02Å; M887-V890 WeakPolarHBondContact O-CB 3.47Å; M887-V890 PolarHBondContact O-N 2.94Å; M887-V890 HydrophobicContact SD-CG2 4.1Å; M887-F891 PolarHBondContact O-N 3.41Å; M887-F891 VanDerWaalsContact O-N 3.09Å
888	K	84.6	Confident	87.4	Confident	155 Å²	155	72 Å²	72	67%	0.674	34%	0.343	S	S	*	.	H	α-helix	trans	-67	-41.3	173.7	-68.1	-175.9	-179	176.4	0	111.5	R885 M886 F891 F892	R885-K888 PolarHBondContact O-N 2.75Å; M886-K888 PolarHBondContact O-N 3.37Å; K888-F891 PolarHBondContact O-N 3.32Å; K888-F892 WeakPolarHBondContact O-CD2 3.34Å; K888-F892 PolarHBondContact O-N 3.11Å
889	D	87.1	Confident	87.6	Confident	37 Å²	37	75 Å²	75	20%	0.198	36%	0.36	C	S	.	.	H	α-helix	trans	-69.3	-38	176.9	-56.4	-26.1	0	0	0	111	M886 F891 F892 F893 F1000 T1003	M886-D889 PolarHBondContact O-N 3.03Å; D889-F891 VanDerWaalsContact C-N 3.27Å; D889-F891 PolarHBondContact O-N 2.73Å; D889-F892 PolarHBondContact O-N 3.11Å; D889-F893 WeakPolarHBondContact O-CB 3.22Å; D889-F893 PolarHBondContact O-N 3.19Å; D889-F1000 HydrophobicContact CB-CE1 4.49Å; D889-T1003 WeakPolarHBondContact OD2-CB 3.33Å; D889-T1003 PolarHBondContact OD2-OG1 3.28Å
890	V	88.3	Confident	87.8	Confident	30 Å²	30	73.1 Å²	73.1	18%	0.182	35%	0.35	C	S	.	.	H	α-helix	trans	-55.2	-44.2	171.9	177.2	0	0	0	0	110.7	M886 M887 F893 L894 F1000	M886-V890 WeakPolarHBondContact O-CG2 3.48Å; M886-V890 PolarHBondContact O-N 3.29Å; M887-V890 WeakPolarHBondContact O-CB 3.47Å; M887-V890 PolarHBondContact O-N 2.94Å; M887-V890 HydrophobicContact SD-CG2 4.1Å; V890-F893 WeakPolarHBondContact O-CB 3.41Å; V890-F893 PolarHBondContact O-N 3.13Å; V890-L894 HydrophobicContact CG1-CD1 3.72Å; V890-L894 HydrophobicContact CG1-CG 4.03Å; V890-L894 WeakPolarHBondContact O-CB 3.13Å; V890-L894 WeakPolarHBondContact O-CG 3.46Å; V890-L894 PolarHBondContact O-N 3.24Å; V890-F1000 HydrophobicContact CG2-CE1 3.64Å; V890-F1000 HydrophobicContact CG2-CZ 3.44Å; V890-F1000 VanDerWaalsContact CG2-CZ 3.44Å
891	F	88	Confident	88	Confident	143 Å²	143	72.4 Å²	72.4	63%	0.627	35%	0.346	S	S	*	.	H	α-helix	trans	-63.7	-46.5	-177.4	-178.9	-96.3	0	0	0	112.1	M887 K888 D889 F893 L894 F895	M887-F891 PolarHBondContact O-N 3.41Å; M887-F891 VanDerWaalsContact O-N 3.09Å; K888-F891 PolarHBondContact O-N 3.32Å; D889-F891 VanDerWaalsContact C-N 3.27Å; D889-F891 PolarHBondContact O-N 2.73Å; F891-F893 VanDerWaalsContact C-N 3.31Å; F891-F893 PolarHBondContact O-N 3.32Å; F891-L894 PolarHBondContact O-N 2.96Å; F891-F895 PolarHBondContact O-N 3.29Å; F891-F895 VanDerWaalsContact O-N 3.14Å
892	F	85.9	Confident	88.3	Confident	132 Å²	132	76 Å²	76	58%	0.579	37%	0.365	S	S	*	.	H	α-helix	trans	-63.2	-38.8	175.5	-70.4	-65.9	0	0	0	111.9	K888 D889 F895 F896	K888-F892 WeakPolarHBondContact O-CD2 3.34Å; K888-F892 PolarHBondContact O-N 3.11Å; D889-F892 PolarHBondContact O-N 3.11Å; F892-F895 WeakPolarHBondContact O-CB 3.36Å; F892-F895 PolarHBondContact O-N 3.08Å; F892-F896 WeakPolarHBondContact O-CD2 3.4Å; F892-F896 PolarHBondContact O-N 2.82Å
893	F	88.7	Confident	88.6	Confident	11 Å²	11	78 Å²	78	5%	0.048	38%	0.383	C	S	.	.	H	α-helix	trans	-63.5	-47.9	174.7	176.1	-101.2	0	0	0	112.8	D889 V890 F891 F895 F896 L897 L992 L993 L996 M999	D889-F893 WeakPolarHBondContact O-CB 3.22Å; D889-F893 PolarHBondContact O-N 3.19Å; V890-F893 WeakPolarHBondContact O-CB 3.41Å; V890-F893 PolarHBondContact O-N 3.13Å; F891-F893 VanDerWaalsContact C-N 3.31Å; F891-F893 PolarHBondContact O-N 3.32Å; F893-F895 PolarHBondContact O-N 3.48Å; F893-F896 PolarHBondContact O-N 2.97Å; F893-F896 VanDerWaalsContact O-N 3.12Å; F893-L897 HydrophobicContact CE1-CB 4.3Å; F893-L897 HydrophobicContact CE1-CD2 3.99Å; F893-L897 HydrophobicContact CZ-CB 4.49Å; F893-L897 HydrophobicContact CZ-CD2 4.49Å; F893-L897 PolarHBondContact O-N 3.04Å; F893-L992 HydrophobicContact CE2-CB 3.88Å; F893-L992 WeakPolarHBondContact CE2-O 3.4Å; F893-L992 HydrophobicContact CZ-CB 4.18Å; F893-L993 HydrophobicContact CZ-CD2 4.4Å; F893-L996 HydrophobicContact CB-CD1 3.86Å; F893-L996 HydrophobicContact CD1-CD1 3.86Å; F893-L996 HydrophobicContact CD1-CD2 3.94Å; F893-L996 HydrophobicContact CD1-CG 4.33Å; F893-L996 HydrophobicContact CD2-CB 4.01Å; F893-L996 HydrophobicContact CD2-CD1 4.12Å; F893-L996 HydrophobicContact CE1-CB 4.4Å; F893-L996 HydrophobicContact CE1-CD1 4.47Å; F893-L996 HydrophobicContact CE1-CD2 3.8Å; F893-L996 HydrophobicContact CE1-CG 4.45Å; F893-L996 HydrophobicContact CE2-CB 3.89Å; F893-L996 HydrophobicContact CG-CB 4.32Å; F893-L996 HydrophobicContact CG-CD1 3.66Å; F893-L996 HydrophobicContact CG-CD2 4.47Å; F893-L996 HydrophobicContact CG-CG 4.37Å; F893-L996 HydrophobicContact CZ-CB 4.09Å; F893-L996 HydrophobicContact CZ-CD2 4.23Å; F893-M999 HydrophobicContact CB-CE 3.93Å; F893-M999 HydrophobicContact CD2-CE 4.14Å; F893-M999 HydrophobicContact CG-CE 4.41Å
894	L	88.5	Confident	88.9	Confident	83 Å²	83	74.6 Å²	74.6	44%	0.435	36%	0.361	S	S	.	.	H	α-helix	trans	-58.4	-32.9	178.7	-79.6	173.6	0	0	0	111.7	V890 F891 S898	V890-L894 HydrophobicContact CG1-CD1 3.72Å; V890-L894 HydrophobicContact CG1-CG 4.03Å; V890-L894 WeakPolarHBondContact O-CB 3.13Å; V890-L894 WeakPolarHBondContact O-CG 3.46Å; V890-L894 PolarHBondContact O-N 3.24Å; F891-L894 PolarHBondContact O-N 2.96Å; L894-S898 VanDerWaalsContact O-CB 3.23Å; L894-S898 WeakPolarHBondContact O-CB 3.33Å; L894-S898 PolarHBondContact O-N 3.19Å; L894-S898 PolarHBondContact O-OG 2.93Å
895	F	89.8	Confident	89.2	Confident	124 Å²	124	71 Å²	71	54%	0.544	35%	0.345	S	S	.	.	H	α-helix	trans	-62.6	-51.6	174	177.9	-99.1	0	0	0	111.9	F891 F892 F893 L897 S898 V899	F891-F895 PolarHBondContact O-N 3.29Å; F891-F895 VanDerWaalsContact O-N 3.14Å; F892-F895 WeakPolarHBondContact O-CB 3.36Å; F892-F895 PolarHBondContact O-N 3.08Å; F893-F895 PolarHBondContact O-N 3.48Å; F895-L897 PolarHBondContact O-N 3.25Å; F895-S898 PolarHBondContact O-N 2.89Å; F895-V899 HydrophobicContact CE1-CG2 4.43Å; F895-V899 HydrophobicContact CE2-CG2 4.5Å; F895-V899 HydrophobicContact CZ-CG2 4.28Å; F895-V899 WeakPolarHBondContact O-CG2 3.48Å; F895-V899 PolarHBondContact O-N 3.34Å; F895-V899 VanDerWaalsContact O-N 3.11Å
896	F	88.6	Confident	89.6	Confident	130 Å²	130	70.5 Å²	70.5	57%	0.57	35%	0.351	S	S	*	.	H	α-helix	trans	-62.4	-42.3	176.9	-71	-65.4	0	0	0	112.2	F892 F893 S898 V899 W900	F892-F896 WeakPolarHBondContact O-CD2 3.4Å; F892-F896 PolarHBondContact O-N 2.82Å; F893-F896 PolarHBondContact O-N 2.97Å; F893-F896 VanDerWaalsContact O-N 3.12Å; F896-S898 PolarHBondContact O-N 3.1Å; F896-V899 PolarHBondContact O-N 3.02Å; F896-W900 PolarHBondContact O-N 3.35Å; F896-W900 VanDerWaalsContact O-N 3.16Å
897	L	90.3	Very high	89.8	Confident	19 Å²	19	70.8 Å²	70.8	10%	0.099	36%	0.358	C	S	.	.	H	α-helix	trans	-61.8	-43.8	177.1	-175.4	67.3	0	0	0	111.4	F893 F895 W900 L901 I934 T988 L992	F893-L897 HydrophobicContact CE1-CB 4.3Å; F893-L897 HydrophobicContact CE1-CD2 3.99Å; F893-L897 HydrophobicContact CZ-CB 4.49Å; F893-L897 HydrophobicContact CZ-CD2 4.49Å; F893-L897 PolarHBondContact O-N 3.04Å; F895-L897 PolarHBondContact O-N 3.25Å; L897-W900 PolarHBondContact O-N 3.33Å; L897-L901 WeakPolarHBondContact O-CB 3.49Å; L897-L901 PolarHBondContact O-N 2.96Å; L897-I934 HydrophobicContact CD1-CD1 3.9Å; L897-I934 HydrophobicContact CD2-CD1 4.25Å; L897-I934 HydrophobicContact CG-CD1 4.32Å; L897-T988 HydrophobicContact CD1-CG2 4.29Å; L897-L992 HydrophobicContact CD1-CD1 4.15Å
898	S	89.6	Confident	90	Very high	55 Å²	55	66.4 Å²	66.4	39%	0.385	34%	0.338	S	S	.	.	H	α-helix	trans	-64.4	-43.5	-179.4	-61.5	0	0	0	0	112.1	L894 F895 F896 W900 L901 I902	L894-S898 VanDerWaalsContact O-CB 3.23Å; L894-S898 WeakPolarHBondContact O-CB 3.33Å; L894-S898 PolarHBondContact O-N 3.19Å; L894-S898 PolarHBondContact O-OG 2.93Å; F895-S898 PolarHBondContact O-N 2.89Å; F896-S898 PolarHBondContact O-N 3.1Å; S898-W900 VanDerWaalsContact C-N 3.33Å; S898-W900 PolarHBondContact O-N 3.16Å; S898-L901 PolarHBondContact O-N 3.44Å; S898-I902 WeakPolarHBondContact O-CB 3.47Å; S898-I902 WeakPolarHBondContact O-CD1 3.46Å; S898-I902 WeakPolarHBondContact O-CG1 3.49Å; S898-I902 PolarHBondContact O-N 3.39Å
899	V	92.4	Very high	90.2	Very high	83 Å²	83	59.9 Å²	59.9	50%	0.503	31%	0.31	S	S	.	.	H	α-helix	trans	-59.8	-45.7	176.6	172.5	0	0	0	0	110.8	F895 F896 A903	F895-V899 HydrophobicContact CE1-CG2 4.43Å; F895-V899 HydrophobicContact CE2-CG2 4.5Å; F895-V899 HydrophobicContact CZ-CG2 4.28Å; F895-V899 WeakPolarHBondContact O-CG2 3.48Å; F895-V899 PolarHBondContact O-N 3.34Å; F895-V899 VanDerWaalsContact O-N 3.11Å; F896-V899 PolarHBondContact O-N 3.02Å; V899-A903 WeakPolarHBondContact O-CB 3.42Å; V899-A903 PolarHBondContact O-N 2.94Å; V899-A903 VanDerWaalsContact O-N 3.14Å
900	W	92.1	Very high	90.2	Very high	94 Å²	94	60.9 Å²	60.9	36%	0.356	32%	0.323	S	S	.	.	H	α-helix	trans	-66.9	-41.6	178.8	-173.2	-113.2	0	0	0	112.6	F896 L897 S898 A903 Y904 F984 V987	F896-W900 PolarHBondContact O-N 3.35Å; F896-W900 VanDerWaalsContact O-N 3.16Å; L897-W900 PolarHBondContact O-N 3.33Å; S898-W900 VanDerWaalsContact C-N 3.33Å; S898-W900 PolarHBondContact O-N 3.16Å; W900-A903 PolarHBondContact O-N 3.33Å; W900-Y904 PolarHBondContact O-N 3.29Å; W900-F984 AromaticContact CD1-CD2 3.83Å; W900-F984 AromaticContact CD1-CE2 3.87Å; W900-F984 AromaticContact NE1-CD2 3.52Å; W900-V987 HydrophobicContact CD2-CG1 4.38Å; W900-V987 HydrophobicContact CZ2-CB 4.03Å; W900-V987 HydrophobicContact CZ2-CG1 3.96Å; W900-V987 HydrophobicContact CZ2-CG2 4.04Å
901	L	92.3	Very high	90.2	Very high	15 Å²	15	61.7 Å²	61.7	8%	0.079	33%	0.326	C	S	.	.	H	α-helix	trans	-62.1	-46.8	178.3	-176.4	158.6	0	0	0	111.6	L897 S898 A903 Y904 G905 L927 P930 Y931 I934	L897-L901 WeakPolarHBondContact O-CB 3.49Å; L897-L901 PolarHBondContact O-N 2.96Å; S898-L901 PolarHBondContact O-N 3.44Å; L901-A903 PolarHBondContact O-N 3.26Å; L901-Y904 PolarHBondContact O-N 3.15Å; L901-G905 PolarHBondContact O-N 3.25Å; L901-L927 HydrophobicContact CD2-CD2 4.16Å; L901-P930 HydrophobicContact CD2-CB 4.07Å; L901-P930 HydrophobicContact CG-CB 3.96Å; L901-Y931 HydrophobicContact CD1-CD2 4.19Å; L901-I934 HydrophobicContact CD1-CD1 4.04Å
902	I	92.6	Very high	90	Very high	83 Å²	83	55.4 Å²	55.4	43%	0.426	30%	0.299	S	S	.	.	H	α-helix	trans	-61.5	-45.2	177.4	-66.8	164.3	0	0	0	110.2	S898 Y904 G905 V906 L927	S898-I902 WeakPolarHBondContact O-CB 3.47Å; S898-I902 WeakPolarHBondContact O-CD1 3.46Å; S898-I902 WeakPolarHBondContact O-CG1 3.49Å; S898-I902 PolarHBondContact O-N 3.39Å; I902-Y904 PolarHBondContact O-N 3.47Å; I902-G905 PolarHBondContact O-N 2.88Å; I902-V906 HydrophobicContact CG2-CG2 4.11Å; I902-V906 WeakPolarHBondContact O-CB 3.26Å; I902-V906 VanDerWaalsContact O-CG2 3.27Å; I902-V906 WeakPolarHBondContact O-CG2 3.45Å; I902-V906 PolarHBondContact O-N 3.03Å; I902-L927 HydrophobicContact CB-CD2 4.45Å; I902-L927 HydrophobicContact CG1-CD2 3.56Å
903	A	93.3	Very high	89.9	Confident	55 Å²	55	50 Å²	50	46%	0.455	28%	0.276	S	S	.	.	H	α-helix	trans	-60.1	-48.6	-179.8	0	0	0	0	0	112	V899 W900 L901 A907	V899-A903 WeakPolarHBondContact O-CB 3.42Å; V899-A903 PolarHBondContact O-N 2.94Å; V899-A903 VanDerWaalsContact O-N 3.14Å; W900-A903 PolarHBondContact O-N 3.33Å; L901-A903 PolarHBondContact O-N 3.26Å; A903-A907 VanDerWaalsContact O-CB 3.26Å; A903-A907 WeakPolarHBondContact O-CB 3.05Å; A903-A907 PolarHBondContact O-N 3.5Å; A903-A907 VanDerWaalsContact O-N 3.09Å
904	Y	93.3	Very high	89.5	Confident	13 Å²	13	53 Å²	53	5%	0.051	30%	0.296	C	S	.	.	H	α-helix	trans	-65.3	-42.4	176.9	165.5	-104.3	0	0	0	112.5	W900 L901 I902 A907 T908 P930 H933 L980 L981 F984	W900-Y904 PolarHBondContact O-N 3.29Å; L901-Y904 PolarHBondContact O-N 3.15Å; I902-Y904 PolarHBondContact O-N 3.47Å; Y904-A907 PolarHBondContact O-N 3.05Å; Y904-T908 VanDerWaalsContact CE2-OG1 3.27Å; Y904-T908 WeakPolarHBondContact CE2-OG1 3.47Å; Y904-T908 WeakPolarHBondContact O-CB 3.44Å; Y904-T908 PolarHBondContact O-N 2.89Å; Y904-T908 PolarHBondContact O-OG1 3.14Å; Y904-P930 HydrophobicContact CD1-CB 3.87Å; Y904-P930 HydrophobicContact CD1-CG 4.11Å; Y904-P930 HydrophobicContact CE1-CB 4.01Å; Y904-P930 HydrophobicContact CE1-CG 4.11Å; Y904-H933 AromaticContact CE1-ND1 3.8Å; Y904-H933 PolarHBondContact OH-ND1 3.07Å; Y904-L980 HydrophobicContact CD2-CB 4.4Å; Y904-L980 HydrophobicContact CE2-CB 4.22Å; Y904-L981 VanDerWaalsContact OH-CD1 3.3Å; Y904-L981 WeakPolarHBondContact OH-CD1 3.47Å; Y904-F984 HydrophobicContact CD1-CB 4.37Å; Y904-F984 AromaticContact CD1-CD1 3.99Å; Y904-F984 HydrophobicContact CD1-CD1 3.99Å; Y904-F984 AromaticContact CD1-CD2 3.5Å; Y904-F984 HydrophobicContact CD1-CD2 3.5Å; Y904-F984 VanDerWaalsContact CD1-CD2 3.5Å; Y904-F984 HydrophobicContact CD1-CE1 4.11Å; Y904-F984 AromaticContact CD1-CE2 3.63Å; Y904-F984 HydrophobicContact CD1-CE2 3.63Å; Y904-F984 AromaticContact CD1-CG 3.68Å; Y904-F984 HydrophobicContact CD1-CG 3.68Å; Y904-F984 AromaticContact CD1-CZ 3.92Å; Y904-F984 HydrophobicContact CD1-CZ 3.92Å; Y904-F984 HydrophobicContact CD2-CB 3.68Å; Y904-F984 HydrophobicContact CD2-CD2 4.03Å; Y904-F984 AromaticContact CD2-CG 3.91Å; Y904-F984 HydrophobicContact CD2-CG 3.91Å; Y904-F984 HydrophobicContact CE1-CB 4.49Å; Y904-F984 AromaticContact CE1-CD1 3.84Å; Y904-F984 HydrophobicContact CE1-CD1 3.84Å; Y904-F984 HydrophobicContact CE1-CD2 4.2Å; Y904-F984 HydrophobicContact CE1-CE1 4.04Å; Y904-F984 HydrophobicContact CE1-CE2 4.38Å; Y904-F984 AromaticContact CE1-CG 3.92Å; Y904-F984 HydrophobicContact CE1-CG 3.92Å; Y904-F984 HydrophobicContact CE1-CZ 4.3Å; Y904-F984 HydrophobicContact CE2-CB 3.82Å; Y904-F984 HydrophobicContact CE2-CG 4.13Å; Y904-F984 HydrophobicContact CG-CB 3.98Å; Y904-F984 HydrophobicContact CG-CD1 4.43Å; Y904-F984 AromaticContact CG-CD2 3.4Å; Y904-F984 HydrophobicContact CG-CD2 3.4Å; Y904-F984 VanDerWaalsContact CG-CD2 3.4Å; Y904-F984 AromaticContact CG-CE2 3.94Å; Y904-F984 HydrophobicContact CG-CE2 3.94Å; Y904-F984 AromaticContact CG-CG 3.68Å; Y904-F984 HydrophobicContact CG-CG 3.68Å
905	G	91.5	Very high	89.1	Confident	0 Å²	0	55.9 Å²	55.9	0%	0	31%	0.312	C	S	.	.	H	α-helix	trans	-67.3	-43.2	-178	0	0	0	0	0	113.8	L901 I902 T908 Q909 A926	L901-G905 PolarHBondContact O-N 3.25Å; I902-G905 PolarHBondContact O-N 2.88Å; G905-T908 PolarHBondContact O-N 3.07Å; G905-Q909 WeakPolarHBondContact O-CB 3.26Å; G905-Q909 PolarHBondContact O-N 3.04Å; G905-A926 VanDerWaalsContact CA-O 3.28Å; G905-A926 WeakPolarHBondContact CA-O 3.3Å
906	V	91.9	Very high	88.6	Confident	81 Å²	81	50.7 Å²	50.7	49%	0.491	29%	0.289	S	S	.	.	H	α-helix	trans	-65.9	-42.6	174.2	174	0	0	0	0	110.7	I902 T908 Q909 A910 A926	I902-V906 HydrophobicContact CG2-CG2 4.11Å; I902-V906 WeakPolarHBondContact O-CB 3.26Å; I902-V906 VanDerWaalsContact O-CG2 3.27Å; I902-V906 WeakPolarHBondContact O-CG2 3.45Å; I902-V906 PolarHBondContact O-N 3.03Å; V906-T908 PolarHBondContact O-N 3.38Å; V906-Q909 PolarHBondContact O-N 3.32Å; V906-A910 VanDerWaalsContact O-CB 3.28Å; V906-A910 WeakPolarHBondContact O-CB 3.38Å; V906-A910 PolarHBondContact O-N 3.25Å; V906-A926 HydrophobicContact CG2-CB 4.5Å
907	A	91.6	Very high	88.2	Confident	35 Å²	35	47 Å²	47	29%	0.289	28%	0.279	S	S	.	.	H	α-helix	trans	-61.6	-44	176.4	0	0	0	0	0	112	A903 Y904 A910 L911	A903-A907 VanDerWaalsContact O-CB 3.26Å; A903-A907 WeakPolarHBondContact O-CB 3.05Å; A903-A907 PolarHBondContact O-N 3.5Å; A903-A907 VanDerWaalsContact O-N 3.09Å; Y904-A907 PolarHBondContact O-N 3.05Å; A907-A910 PolarHBondContact O-N 2.87Å; A907-L911 WeakPolarHBondContact O-CB 3.29Å; A907-L911 VanDerWaalsContact O-CG 3.23Å; A907-L911 WeakPolarHBondContact O-CG 3.29Å; A907-L911 PolarHBondContact O-N 3.2Å
908	T	89.2	Confident	87.9	Confident	16 Å²	16	48 Å²	48	10%	0.098	28%	0.281	C	S	.	.	H	α-helix	trans	-65.4	-43.4	178.1	-58.7	0	0	0	0	111.6	Y904 G905 V906 L911 L912 V977	Y904-T908 VanDerWaalsContact CE2-OG1 3.27Å; Y904-T908 WeakPolarHBondContact CE2-OG1 3.47Å; Y904-T908 WeakPolarHBondContact O-CB 3.44Å; Y904-T908 PolarHBondContact O-N 2.89Å; Y904-T908 PolarHBondContact O-OG1 3.14Å; G905-T908 PolarHBondContact O-N 3.07Å; V906-T908 PolarHBondContact O-N 3.38Å; T908-L911 PolarHBondContact O-N 3.1Å; T908-L912 VanDerWaalsContact O-CB 3.27Å; T908-L912 WeakPolarHBondContact O-CB 3.17Å; T908-L912 PolarHBondContact O-N 3.07Å; T908-V977 HydrophobicContact CG2-CG1 3.89Å
909	Q	88.6	Confident	87.5	Confident	19 Å²	19	51.3 Å²	51.3	9%	0.089	29%	0.293	C	S	.	.	H	α-helix	trans	-62.2	-44.4	175.7	177.4	63.3	20.7	0	0	111.5	G905 V906 L911 H913 V922	G905-Q909 WeakPolarHBondContact O-CB 3.26Å; G905-Q909 PolarHBondContact O-N 3.04Å; V906-Q909 PolarHBondContact O-N 3.32Å; Q909-L911 VanDerWaalsContact C-N 3.35Å; Q909-L911 PolarHBondContact O-N 3.3Å; Q909-H913 PolarHBondContact NE2-O 3.11Å; Q909-H913 CarbonylContact O-C 3.58Å; Q909-H913 WeakPolarHBondContact O-CA 3.37Å; Q909-H913 PolarHBondContact O-N 2.91Å; Q909-V922 HydrophobicContact CG-CG1 4.32Å
910	A	88.5	Confident	87.1	Confident	58 Å²	58	53 Å²	53	48%	0.479	30%	0.299	S	S	.	.	H	α-helix	trans	-65	-36.6	179.5	0	0	0	0	0	112.8	V906 A907	V906-A910 VanDerWaalsContact O-CB 3.28Å; V906-A910 WeakPolarHBondContact O-CB 3.38Å; V906-A910 PolarHBondContact O-N 3.25Å; A907-A910 PolarHBondContact O-N 2.87Å
911	L	87.7	Confident	86.6	Confident	46 Å²	46	52.7 Å²	52.7	24%	0.241	30%	0.298	C	S	.	.	H	α-helix	trans	-79.6	-38.7	-179.6	-68.8	173.6	0	0	0	113	A907 T908 Q909 N970 A973 L976 V977 L980	A907-L911 WeakPolarHBondContact O-CB 3.29Å; A907-L911 VanDerWaalsContact O-CG 3.23Å; A907-L911 WeakPolarHBondContact O-CG 3.29Å; A907-L911 PolarHBondContact O-N 3.2Å; T908-L911 PolarHBondContact O-N 3.1Å; Q909-L911 VanDerWaalsContact C-N 3.35Å; Q909-L911 PolarHBondContact O-N 3.3Å; L911-N970 WeakPolarHBondContact O-CB 3.49Å; L911-A973 HydrophobicContact CB-CB 4.25Å; L911-A973 HydrophobicContact CD2-CB 4.03Å; L911-L976 HydrophobicContact CD1-CD2 3.92Å; L911-L976 HydrophobicContact CD1-CG 4.19Å; L911-L976 HydrophobicContact CD2-CD2 4.39Å; L911-V977 HydrophobicContact CB-CG2 3.67Å; L911-V977 HydrophobicContact CD1-CG2 4.08Å; L911-L980 HydrophobicContact CD1-CD1 3.66Å
912	L	84.3	Confident	86.4	Confident	11 Å²	11	54 Å²	54	6%	0.058	31%	0.307	C	S	.	.	H	α-helix	trans	-89.9	-38.7	-174.4	-167.2	64.8	0	0	0	112.8	T908 P969 N970	T908-L912 VanDerWaalsContact O-CB 3.27Å; T908-L912 WeakPolarHBondContact O-CB 3.17Å; T908-L912 PolarHBondContact O-N 3.07Å; L912-P969 HydrophobicContact CD1-CB 3.92Å; L912-P969 HydrophobicContact CG-CB 4.31Å; L912-P969 WeakPolarHBondContact O-CA 3.4Å; L912-N970 PolarHBondContact O-N 3.21Å
913	H	83.3	Confident	86.1	Confident	20 Å²	20	56.2 Å²	56.2	9%	0.093	31%	0.313	C	S	.	.			trans	-137.9	73.2	-176.6	-63.7	-62.8	0	0	0	112	Q909 N915 R925	Q909-H913 PolarHBondContact NE2-O 3.11Å; Q909-H913 CarbonylContact O-C 3.58Å; Q909-H913 WeakPolarHBondContact O-CA 3.37Å; Q909-H913 PolarHBondContact O-N 2.91Å; H913-N915 VanDerWaalsContact C-N 3.34Å; H913-N915 PolarHBondContact O-N 2.87Å; H913-R925 PolarHBondContact CD2-NH1 3.04Å; H913-R925 PolarHBondContact NE2-NH1 3.29Å
914	P	80.7	Confident	85.8	Confident	73 Å²	73	59.3 Å²	59.3	47%	0.474	31%	0.314	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.6	-29.4	-172.5	23.2	-33.3	0	0	0	114.8
915	N	78.8	Confident	85.4	Confident	143 Å²	143	60.5 Å²	60.5	77%	0.765	32%	0.318	S	S	*	.	T	Hydrogen-bonded Turn	trans	-120.6	31.8	-168.7	-63.5	-28	0	0	0	114	H913 P917	H913-N915 VanDerWaalsContact C-N 3.34Å; H913-N915 PolarHBondContact O-N 2.87Å; N915-P917 VanDerWaalsContact O-CD 3.27Å; N915-P917 WeakPolarHBondContact O-CD 3.49Å
916	D	80.9	Confident	85.3	Confident	15 Å²	15	60.9 Å²	60.9	8%	0.08	32%	0.321	C	S	.	.			trans	-78.5	114.1	176.9	-164.8	-18.5	0	0	0	110.6	R918 V922 R925	D916-R918 VanDerWaalsContact C-N 3.25Å; D916-R918 PolarHBondContact O-N 3.32Å; D916-R918 WeakPolarHBondContact OD1-CB 3.18Å; D916-R918 IonicContact OD1-CZ 2.97Å; D916-R918 PolarHBondContact OD1-N 2.9Å; D916-R918 VanDerWaalsContact OD1-N 3.15Å; D916-R918 IonicContact OD1-NE 3.04Å; D916-R918 PolarHBondContact OD1-NE 3.01Å; D916-R918 IonicContact OD1-NH2 2.7Å; D916-R918 IonicContact OD2-CZ 3.65Å; D916-R918 IonicContact OD2-NE 3.01Å; D916-R918 IonicContact OD2-NH2 3.79Å; D916-R918 PolarHBondContact OD2-NH2 3.3Å; D916-V922 HydrophobicContact CB-CG2 4.22Å; D916-R925 IonicContact OD2-NH1 2.71Å; D916-R925 PolarHBondContact OD2-NH1 3.41Å
917	P	79.2	Confident	85.1	Confident	53 Å²	53	60.3 Å²	60.3	34%	0.344	32%	0.315	S	S	.	.			trans	-77.4	-7.5	-177.9	32.6	-35.9	0	0	0	113.5	N915 I919 I960	N915-P917 VanDerWaalsContact O-CD 3.27Å; N915-P917 WeakPolarHBondContact O-CD 3.49Å; P917-I919 PolarHBondContact O-N 3.29Å; P917-I960 HydrophobicContact CG-CB 4.4Å; P917-I960 HydrophobicContact CG-CG2 4.15Å
918	R	83.9	Confident	85	Confident	40 Å²	40	64.4 Å²	64.4	15%	0.151	32%	0.324	C	S	.	.			trans	-85.2	99.9	-175.4	-63.6	173.8	-62.5	170.4	12	111.3	D916 D920 W921 V922 I960 L961	D916-R918 VanDerWaalsContact C-N 3.25Å; D916-R918 PolarHBondContact O-N 3.32Å; D916-R918 WeakPolarHBondContact OD1-CB 3.18Å; D916-R918 IonicContact OD1-CZ 2.97Å; D916-R918 PolarHBondContact OD1-N 2.9Å; D916-R918 VanDerWaalsContact OD1-N 3.15Å; D916-R918 IonicContact OD1-NE 3.04Å; D916-R918 PolarHBondContact OD1-NE 3.01Å; D916-R918 IonicContact OD1-NH2 2.7Å; D916-R918 IonicContact OD2-CZ 3.65Å; D916-R918 IonicContact OD2-NE 3.01Å; D916-R918 IonicContact OD2-NH2 3.79Å; D916-R918 PolarHBondContact OD2-NH2 3.3Å; R918-D920 VanDerWaalsContact C-N 3.32Å; R918-D920 PolarHBondContact O-N 2.94Å; R918-W921 HydrophobicContact CB-CB 4.05Å; R918-W921 HydrophobicContact CB-CG 4.47Å; R918-W921 PolarHBondContact O-N 3.07Å; R918-V922 VanDerWaalsContact O-CG2 3.3Å; R918-V922 WeakPolarHBondContact O-CG2 3.44Å; R918-V922 PolarHBondContact O-N 3.24Å; R918-I960 WeakPolarHBondContact CD-O 3.37Å; R918-I960 HydrophobicContact CG-CG2 4.39Å; R918-L961 HydrophobicContact CG-CD1 4.3Å
919	I	82.8	Confident	84.9	Confident	124 Å²	124	66.3 Å²	66.3	64%	0.636	33%	0.329	S	S	*	.	H	α-helix	trans	-55.3	-43.4	-178.2	-63.3	178.1	0	0	0	112.3	P917 W921 V922 F923	P917-I919 PolarHBondContact O-N 3.29Å; I919-W921 PolarHBondContact O-N 3.34Å; I919-V922 PolarHBondContact O-N 3.02Å; I919-F923 HydrophobicContact CG2-CD2 3.57Å; I919-F923 HydrophobicContact CG2-CE2 3.46Å; I919-F923 VanDerWaalsContact CG2-CE2 3.46Å; I919-F923 VanDerWaalsContact O-CD2 3.27Å; I919-F923 WeakPolarHBondContact O-CD2 3.48Å; I919-F923 PolarHBondContact O-N 2.68Å
920	D	82.3	Confident	85	Confident	118 Å²	118	65.6 Å²	65.6	63%	0.631	33%	0.326	S	S	*	.	H	α-helix	trans	-59.5	-45.1	178.5	-178.2	74.3	0	0	0	112.9	R918 F923 R924	R918-D920 VanDerWaalsContact C-N 3.32Å; R918-D920 PolarHBondContact O-N 2.94Å; D920-F923 PolarHBondContact O-N 2.98Å; D920-R924 WeakPolarHBondContact O-CB 3.4Å; D920-R924 PolarHBondContact O-N 3Å
921	W	82.9	Confident	85.1	Confident	88 Å²	88	68.1 Å²	68.1	33%	0.333	32%	0.324	S	S	.	.	H	α-helix	trans	-70.3	-35.4	177.9	-83.2	85.4	0	0	0	112.6	R918 I919 R924 R925	R918-W921 HydrophobicContact CB-CB 4.05Å; R918-W921 HydrophobicContact CB-CG 4.47Å; R918-W921 PolarHBondContact O-N 3.07Å; I919-W921 PolarHBondContact O-N 3.34Å; W921-R924 PolarHBondContact O-N 3.36Å; W921-R925 WeakPolarHBondContact O-CB 3.46Å; W921-R925 VanDerWaalsContact O-CG 3.27Å; W921-R925 WeakPolarHBondContact O-CG 3.24Å; W921-R925 PolarHBondContact O-N 3.42Å
922	V	86.8	Confident	85.1	Confident	42 Å²	42	67.6 Å²	67.6	26%	0.255	32%	0.321	S	S	.	.	H	α-helix	trans	-62.6	-48.6	174.5	171.1	0	0	0	0	110.2	Q909 D916 R918 I919 R924 R925 A926	Q909-V922 HydrophobicContact CG-CG1 4.32Å; D916-V922 HydrophobicContact CB-CG2 4.22Å; R918-V922 VanDerWaalsContact O-CG2 3.3Å; R918-V922 WeakPolarHBondContact O-CG2 3.44Å; R918-V922 PolarHBondContact O-N 3.24Å; I919-V922 PolarHBondContact O-N 3.02Å; V922-R924 PolarHBondContact O-N 3.12Å; V922-R925 PolarHBondContact O-N 3.1Å; V922-A926 WeakPolarHBondContact O-CB 3.17Å; V922-A926 PolarHBondContact O-N 2.94Å
923	F	87.5	Confident	85.3	Confident	130 Å²	130	67.4 Å²	67.4	57%	0.57	32%	0.32	S	S	*	.	H	α-helix	trans	-61.8	-43.2	175.9	-84.5	-69.8	0	0	0	112.2	I919 D920 R925 A926 L927	I919-F923 HydrophobicContact CG2-CD2 3.57Å; I919-F923 HydrophobicContact CG2-CE2 3.46Å; I919-F923 VanDerWaalsContact CG2-CE2 3.46Å; I919-F923 VanDerWaalsContact O-CD2 3.27Å; I919-F923 WeakPolarHBondContact O-CD2 3.48Å; I919-F923 PolarHBondContact O-N 2.68Å; D920-F923 PolarHBondContact O-N 2.98Å; F923-R925 VanDerWaalsContact C-N 3.32Å; F923-R925 PolarHBondContact O-N 3.12Å; F923-A926 PolarHBondContact O-N 3.2Å; F923-L927 HydrophobicContact CD1-CD1 4.08Å; F923-L927 PolarHBondContact O-N 2.61Å
924	R	86	Confident	85.6	Confident	121 Å²	121	67.4 Å²	67.4	46%	0.457	32%	0.32	S	S	.	.	I	π-helix	trans	-62.8	-36.6	177.2	-167.9	174.6	-177.5	-174.1	1	112.6	D920 W921 V922 Y928 R929	D920-R924 WeakPolarHBondContact O-CB 3.4Å; D920-R924 PolarHBondContact O-N 3Å; W921-R924 PolarHBondContact O-N 3.36Å; V922-R924 PolarHBondContact O-N 3.12Å; R924-Y928 HydrophobicContact CG-CD1 4.04Å; R924-Y928 HydrophobicContact CG-CG 4.46Å; R924-Y928 VanDerWaalsContact O-CB 3.32Å; R924-Y928 WeakPolarHBondContact O-CB 3.41Å; R924-Y928 PolarHBondContact O-N 3.44Å; R924-R929 PolarHBondContact O-N 3.45Å
925	R	85.5	Confident	85.8	Confident	37 Å²	37	70.5 Å²	70.5	14%	0.14	33%	0.326	C	S	.	.	I	π-helix	trans	-80	-35.1	177.8	-72.4	173.1	175.1	-179.2	-8.9	113.1	H913 D916 W921 V922 F923 P930	H913-R925 PolarHBondContact CD2-NH1 3.04Å; H913-R925 PolarHBondContact NE2-NH1 3.29Å; D916-R925 IonicContact OD2-NH1 2.71Å; D916-R925 PolarHBondContact OD2-NH1 3.41Å; W921-R925 WeakPolarHBondContact O-CB 3.46Å; W921-R925 VanDerWaalsContact O-CG 3.27Å; W921-R925 WeakPolarHBondContact O-CG 3.24Å; W921-R925 PolarHBondContact O-N 3.42Å; V922-R925 PolarHBondContact O-N 3.1Å; F923-R925 VanDerWaalsContact C-N 3.32Å; F923-R925 PolarHBondContact O-N 3.12Å; R925-P930 WeakPolarHBondContact O-CD 3.08Å
926	A	89.1	Confident	86.1	Confident	8 Å²	8	66.2 Å²	66.2	7%	0.066	32%	0.316	C	S	.	.	I	π-helix	trans	-80.9	-26.6	-178.1	0	0	0	0	0	113.7	G905 V906 V922 F923	G905-A926 VanDerWaalsContact CA-O 3.28Å; G905-A926 WeakPolarHBondContact CA-O 3.3Å; V906-A926 HydrophobicContact CG2-CB 4.5Å; V922-A926 WeakPolarHBondContact O-CB 3.17Å; V922-A926 PolarHBondContact O-N 2.94Å; F923-A926 PolarHBondContact O-N 3.2Å
927	L	88.8	Confident	86.3	Confident	69 Å²	69	71.4 Å²	71.4	36%	0.361	34%	0.34	S	S	.	.	I	π-helix	trans	-117.1	-56.5	-178.2	-60.5	176.3	0	0	0	112.3	L901 I902 F923 Y931	L901-L927 HydrophobicContact CD2-CD2 4.16Å; I902-L927 HydrophobicContact CB-CD2 4.45Å; I902-L927 HydrophobicContact CG1-CD2 3.56Å; F923-L927 HydrophobicContact CD1-CD1 4.08Å; F923-L927 PolarHBondContact O-N 2.61Å; L927-Y931 WeakPolarHBondContact O-CB 3.19Å; L927-Y931 PolarHBondContact O-N 3.36Å
928	Y	88.6	Confident	86.6	Confident	121 Å²	121	71.1 Å²	71.1	48%	0.475	34%	0.335	S	S	.	.	I	π-helix	trans	-70	-40.5	-170.2	179.7	-99.7	0	0	0	113.1	R924 Y931 L932	R924-Y928 HydrophobicContact CG-CD1 4.04Å; R924-Y928 HydrophobicContact CG-CG 4.46Å; R924-Y928 VanDerWaalsContact O-CB 3.32Å; R924-Y928 WeakPolarHBondContact O-CB 3.41Å; R924-Y928 PolarHBondContact O-N 3.44Å; Y928-Y931 WeakPolarHBondContact O-CB 3.3Å; Y928-Y931 PolarHBondContact O-N 2.9Å; Y928-L932 HydrophobicContact CD1-CD1 4.04Å; Y928-L932 HydrophobicContact CE1-CD1 3.46Å; Y928-L932 VanDerWaalsContact CE1-CD1 3.46Å; Y928-L932 HydrophobicContact CE1-CG 4.22Å; Y928-L932 WeakPolarHBondContact O-CG 3.46Å; Y928-L932 PolarHBondContact O-N 3.14Å
929	R	86.8	Confident	86.2	Confident	57 Å²	57	71.3 Å²	71.3	22%	0.215	34%	0.341	C	S	.	.	H	α-helix	trans	-66.3	-50.9	177.2	-73.6	-172.1	176.9	-132.2	-0.8	113.4	R924 Y931 L932 H933 D942	R924-R929 PolarHBondContact O-N 3.45Å; R929-Y931 PolarHBondContact O-N 2.95Å; R929-L932 WeakPolarHBondContact O-CB 3.42Å; R929-L932 PolarHBondContact O-N 3.21Å; R929-H933 PolarHBondContact O-CD2 3.37Å; R929-H933 PolarHBondContact O-N 3.14Å; R929-D942 IonicContact CZ-OD2 3.7Å; R929-D942 VanDerWaalsContact CZ-OD2 3.26Å; R929-D942 IonicContact NH1-OD2 3.98Å; R929-D942 PolarHBondContact NH1-OD2 3.48Å; R929-D942 IonicContact NH2-OD2 3.78Å; R929-D942 PolarHBondContact NH2-OD2 3.1Å
930	P	90.3	Very high	85.8	Confident	3 Å²	3	68.7 Å²	68.7	2%	0.019	33%	0.328	C	S	.	.	H	α-helix	trans	-52.6	-37.4	171.6	-34.4	38.8	0	0	0	114.7	L901 Y904 R925 H933	L901-P930 HydrophobicContact CD2-CB 4.07Å; L901-P930 HydrophobicContact CG-CB 3.96Å; Y904-P930 HydrophobicContact CD1-CB 3.87Å; Y904-P930 HydrophobicContact CD1-CG 4.11Å; Y904-P930 HydrophobicContact CE1-CB 4.01Å; Y904-P930 HydrophobicContact CE1-CG 4.11Å; R925-P930 WeakPolarHBondContact O-CD 3.08Å; P930-H933 WeakPolarHBondContact O-CB 3.27Å; P930-H933 PolarHBondContact O-N 2.95Å
931	Y	90.6	Very high	85.4	Confident	112 Å²	112	67.7 Å²	67.7	44%	0.439	32%	0.323	S	S	.	.	H	α-helix	trans	-61.1	-46.5	173.9	177.3	-103.6	0	0	0	112	L901 L927 Y928 R929 H933 I934 F935	L901-Y931 HydrophobicContact CD1-CD2 4.19Å; L927-Y931 WeakPolarHBondContact O-CB 3.19Å; L927-Y931 PolarHBondContact O-N 3.36Å; Y928-Y931 WeakPolarHBondContact O-CB 3.3Å; Y928-Y931 PolarHBondContact O-N 2.9Å; R929-Y931 PolarHBondContact O-N 2.95Å; Y931-H933 VanDerWaalsContact C-N 3.28Å; Y931-H933 PolarHBondContact O-N 3.38Å; Y931-I934 WeakPolarHBondContact O-CB 3.32Å; Y931-I934 PolarHBondContact O-N 2.95Å; Y931-F935 HydrophobicContact CD1-CE2 4.31Å; Y931-F935 HydrophobicContact CD2-CE2 4.45Å; Y931-F935 HydrophobicContact CE1-CD2 4.32Å; Y931-F935 AromaticContact CE1-CE2 3.69Å; Y931-F935 HydrophobicContact CE1-CE2 3.69Å; Y931-F935 AromaticContact CE2-CE2 3.86Å; Y931-F935 HydrophobicContact CE2-CE2 3.86Å; Y931-F935 AromaticContact CZ-CE2 3.45Å; Y931-F935 VanDerWaalsContact CZ-CE2 3.45Å
932	L	88.4	Confident	84.8	Confident	35 Å²	35	66.9 Å²	66.9	18%	0.183	33%	0.325	C	S	.	.	H	α-helix	trans	-64.7	-29.9	176.5	-68.2	179.7	0	0	0	113.3	Y928 R929 I934 F935 G936 Q937	Y928-L932 HydrophobicContact CD1-CD1 4.04Å; Y928-L932 HydrophobicContact CE1-CD1 3.46Å; Y928-L932 VanDerWaalsContact CE1-CD1 3.46Å; Y928-L932 HydrophobicContact CE1-CG 4.22Å; Y928-L932 WeakPolarHBondContact O-CG 3.46Å; Y928-L932 PolarHBondContact O-N 3.14Å; R929-L932 WeakPolarHBondContact O-CB 3.42Å; R929-L932 PolarHBondContact O-N 3.21Å; L932-I934 PolarHBondContact O-N 2.97Å; L932-F935 PolarHBondContact O-N 3.09Å; L932-F935 VanDerWaalsContact O-N 3.13Å; L932-G936 PolarHBondContact O-N 2.84Å; L932-Q937 HydrophobicContact CB-CB 4.24Å; L932-Q937 PolarHBondContact O-N 2.93Å
933	H	88.1	Confident	84.3	Confident	6 Å²	6	65.3 Å²	65.3	3%	0.028	32%	0.315	C	S	.	.	H	α-helix	trans	-61.6	-32.8	176.1	-63	177.7	0	0	0	112.2	Y904 R929 P930 Y931 F935 G936 I938 I943 F984	Y904-H933 AromaticContact CE1-ND1 3.8Å; Y904-H933 PolarHBondContact OH-ND1 3.07Å; R929-H933 PolarHBondContact O-CD2 3.37Å; R929-H933 PolarHBondContact O-N 3.14Å; P930-H933 WeakPolarHBondContact O-CB 3.27Å; P930-H933 PolarHBondContact O-N 2.95Å; Y931-H933 VanDerWaalsContact C-N 3.28Å; Y931-H933 PolarHBondContact O-N 3.38Å; H933-F935 VanDerWaalsContact C-N 3.27Å; H933-F935 PolarHBondContact O-N 3.2Å; H933-G936 PolarHBondContact O-N 3.48Å; H933-I938 HydrophobicContact CB-CG1 4.42Å; H933-I943 VanDerWaalsContact CE1-CD1 3.49Å; H933-I943 WeakPolarHBondContact CE1-CD1 3.18Å; H933-F984 HydrophobicContact CB-CE1 4.02Å
934	I	88.9	Confident	84	Confident	20 Å²	20	60.5 Å²	60.5	10%	0.103	30%	0.295	C	S	.	.	H	α-helix	trans	-62.2	-37.2	176.7	-61.3	164.7	0	0	0	110.7	L897 L901 Y931 L932 G936 F984 T988	L897-I934 HydrophobicContact CD1-CD1 3.9Å; L897-I934 HydrophobicContact CD2-CD1 4.25Å; L897-I934 HydrophobicContact CG-CD1 4.32Å; L901-I934 HydrophobicContact CD1-CD1 4.04Å; Y931-I934 WeakPolarHBondContact O-CB 3.32Å; Y931-I934 PolarHBondContact O-N 2.95Å; L932-I934 PolarHBondContact O-N 2.97Å; I934-G936 PolarHBondContact O-N 3.17Å; I934-F984 HydrophobicContact CD1-CZ 4.19Å; I934-F984 HydrophobicContact CG1-CE1 4.03Å; I934-F984 HydrophobicContact CG1-CZ 3.77Å; I934-T988 HydrophobicContact CG1-CG2 4.43Å
935	F	85.6	Confident	83.3	Confident	138 Å²	138	56 Å²	56	61%	0.605	29%	0.285	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.1	3.4	176.4	-65.8	-78.2	0	0	0	113.8	Y931 L932 H933	Y931-F935 HydrophobicContact CD1-CE2 4.31Å; Y931-F935 HydrophobicContact CD2-CE2 4.45Å; Y931-F935 HydrophobicContact CE1-CD2 4.32Å; Y931-F935 AromaticContact CE1-CE2 3.69Å; Y931-F935 HydrophobicContact CE1-CE2 3.69Å; Y931-F935 AromaticContact CE2-CE2 3.86Å; Y931-F935 HydrophobicContact CE2-CE2 3.86Å; Y931-F935 AromaticContact CZ-CE2 3.45Å; Y931-F935 VanDerWaalsContact CZ-CE2 3.45Å; L932-F935 PolarHBondContact O-N 3.09Å; L932-F935 VanDerWaalsContact O-N 3.13Å; H933-F935 VanDerWaalsContact C-N 3.27Å; H933-F935 PolarHBondContact O-N 3.2Å
936	G	84.4	Confident	82.5	Confident	53 Å²	53	58.5 Å²	58.5	55%	0.546	31%	0.313	S	S	.	.	T	Hydrogen-bonded Turn	trans	83.3	5	179	0	0	0	0	0	115	L932 H933 I934 I938	L932-G936 PolarHBondContact O-N 2.84Å; H933-G936 PolarHBondContact O-N 3.48Å; I934-G936 PolarHBondContact O-N 3.17Å; G936-I938 VanDerWaalsContact C-N 3.31Å; G936-I938 PolarHBondContact O-N 3.33Å
937	Q	86.4	Confident	81.7	Confident	125 Å²	125	65.2 Å²	65.2	58%	0.584	34%	0.337	S	S	*	.			trans	-82	78.9	172	-69.1	-175.3	4.2	0	0	109.9	L932 P939	L932-Q937 HydrophobicContact CB-CB 4.24Å; L932-Q937 PolarHBondContact O-N 2.93Å; Q937-P939 VanDerWaalsContact O-CD 3.26Å; Q937-P939 WeakPolarHBondContact O-CD 3.29Å
938	I	85.4	Confident	80.9	Confident	47 Å²	47	63.9 Å²	63.9	24%	0.241	33%	0.329	C	S	.	.			trans	-99.3	104.1	-178.8	-55.5	168.1	0	0	0	108.3	H933 G936 L940 I943 L981 L985	H933-I938 HydrophobicContact CB-CG1 4.42Å; G936-I938 VanDerWaalsContact C-N 3.31Å; G936-I938 PolarHBondContact O-N 3.33Å; I938-L940 HydrophobicContact CG2-CD2 3.77Å; I938-L940 HydrophobicContact CG2-CG 4.02Å; I938-L940 PolarHBondContact O-N 3.49Å; I938-I943 HydrophobicContact CG2-CD1 4.33Å; I938-L981 HydrophobicContact CG2-CD1 4.44Å; I938-L981 HydrophobicContact CG2-CD2 3.92Å; I938-L985 HydrophobicContact CD1-CD1 3.64Å; I938-L985 HydrophobicContact CD1-CD2 4.33Å
939	P	74.8	Confident	80	Confident	43 Å²	43	62 Å²	62	28%	0.279	33%	0.332	S	S	.	.			trans	-73.8	80.9	175.4	31.9	-34	0	0	0	109.1	Q937 D941 D942 I943	Q937-P939 VanDerWaalsContact O-CD 3.26Å; Q937-P939 WeakPolarHBondContact O-CD 3.29Å; P939-D941 PolarHBondContact O-N 3.46Å; P939-D942 HydrophobicContact CB-CB 4.24Å; P939-D942 HydrophobicContact CG-CB 4.48Å; P939-D942 PolarHBondContact O-N 3.01Å; P939-I943 HydrophobicContact CG-CD1 4.37Å; P939-I943 PolarHBondContact O-N 3.02Å
940	L	75.3	Confident	78.9	Confident	70 Å²	70	67.6 Å²	67.6	37%	0.366	37%	0.366	S	S	.	.	H	α-helix	trans	-58.6	-29.2	179.7	-70.1	170.6	0	0	0	111.8	I938 D942 I943 D944	I938-L940 HydrophobicContact CG2-CD2 3.77Å; I938-L940 HydrophobicContact CG2-CG 4.02Å; I938-L940 PolarHBondContact O-N 3.49Å; L940-D942 PolarHBondContact O-N 3.2Å; L940-I943 PolarHBondContact O-N 3.32Å; L940-D944 WeakPolarHBondContact O-CB 3.32Å; L940-D944 PolarHBondContact O-N 3.16Å
941	D	72.4	Confident	77.9	Confident	97 Å²	97	72.7 Å²	72.7	52%	0.519	39%	0.392	S	S	.	.	H	α-helix	trans	-68.2	-18.7	178.4	-54.9	-31	0	0	0	113.3	P939 M948	P939-D941 PolarHBondContact O-N 3.46Å; D941-M948 WeakPolarHBondContact O-CG 3.48Å
942	D	72.2	Confident	77	Confident	71 Å²	71	72.7 Å²	72.7	38%	0.38	40%	0.404	S	S	.	.	H	α-helix	trans	-104.3	-9.7	178.7	-78.3	-5.2	0	0	0	113.1	R929 P939 L940 M948	R929-D942 IonicContact CZ-OD2 3.7Å; R929-D942 VanDerWaalsContact CZ-OD2 3.26Å; R929-D942 IonicContact NH1-OD2 3.98Å; R929-D942 PolarHBondContact NH1-OD2 3.48Å; R929-D942 IonicContact NH2-OD2 3.78Å; R929-D942 PolarHBondContact NH2-OD2 3.1Å; P939-D942 HydrophobicContact CB-CB 4.24Å; P939-D942 HydrophobicContact CG-CB 4.48Å; P939-D942 PolarHBondContact O-N 3.01Å; L940-D942 PolarHBondContact O-N 3.2Å; D942-M948 WeakPolarHBondContact O-CE 3.4Å
943	I	76.3	Confident	76.4	Confident	9 Å²	9	73.6 Å²	73.6	5%	0.046	41%	0.412	C	S	.	.	H	α-helix	trans	-114.5	-40.1	-173.9	-60	170.9	0	0	0	110.8	H933 I938 P939 L940 N974 V977	H933-I943 VanDerWaalsContact CE1-CD1 3.49Å; H933-I943 WeakPolarHBondContact CE1-CD1 3.18Å; I938-I943 HydrophobicContact CG2-CD1 4.33Å; P939-I943 HydrophobicContact CG-CD1 4.37Å; P939-I943 PolarHBondContact O-N 3.02Å; L940-I943 PolarHBondContact O-N 3.32Å; I943-N974 PolarHBondContact O-OD1 3.05Å; I943-V977 HydrophobicContact CG2-CG1 3.76Å
944	D	79.8	Confident	76	Confident	28 Å²	28	74.5 Å²	74.5	15%	0.15	42%	0.418	C	S	.	.			trans	-91.2	110.7	-178.9	-175.5	9.2	0	0	0	111.2	L940 A946 R947 M948 N974	L940-D944 WeakPolarHBondContact O-CB 3.32Å; L940-D944 PolarHBondContact O-N 3.16Å; D944-A946 PolarHBondContact O-N 3.48Å; D944-A946 WeakPolarHBondContact OD1-CB 3.2Å; D944-A946 PolarHBondContact OD1-N 3.46Å; D944-R947 HydrophobicContact CB-CB 4.46Å; D944-R947 PolarHBondContact O-N 3.06Å; D944-R947 IonicContact OD2-NE 3.49Å; D944-M948 PolarHBondContact O-N 3.17Å; D944-M948 VanDerWaalsContact O-N 3.09Å; D944-N974 PolarHBondContact OD1-ND2 3.42Å
945	A	71.3	Confident	75.1	Confident	28 Å²	28	82 Å²	82	23%	0.231	45%	0.453	C	S	.	.	T	Hydrogen-bonded Turn	trans	-56.8	-19.6	176.6	0	0	0	0	0	114.4	K971 N974	A945-K971 HydrophobicContact CB-CG 4.33Å; A945-N974 HydrophobicContact CB-CB 4.24Å; A945-N974 PolarHBondContact N-ND2 3.23Å; A945-N974 PolarHBondContact N-OD1 3.31Å
946	A	70.1	Confident	74.8	Confident	89 Å²	89	79.3 Å²	79.3	74%	0.736	44%	0.444	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.8	-22.3	176	0	0	0	0	0	113.8	D944	D944-A946 PolarHBondContact O-N 3.48Å; D944-A946 WeakPolarHBondContact OD1-CB 3.2Å; D944-A946 PolarHBondContact OD1-N 3.46Å
947	R	70.5	Confident	74.3	Confident	149 Å²	149	80 Å²	80	56%	0.562	44%	0.441	S	S	*	.	T	Hydrogen-bonded Turn	trans	-105.8	-12.7	-179.8	-65.7	-175.8	-176.3	-166.5	0.5	113.4	D944	D944-R947 HydrophobicContact CB-CB 4.46Å; D944-R947 PolarHBondContact O-N 3.06Å; D944-R947 IonicContact OD2-NE 3.49Å
948	M	73.1	Confident	73.7	Confident	41 Å²	41	77.7 Å²	77.7	20%	0.202	44%	0.435	C	S	.	.	S	Bend	trans	-58.1	129.2	176.2	-82.3	172.9	178	0	0	111.9	D941 D942 D944 P969	D941-M948 WeakPolarHBondContact O-CG 3.48Å; D942-M948 WeakPolarHBondContact O-CE 3.4Å; D944-M948 PolarHBondContact O-N 3.17Å; D944-M948 VanDerWaalsContact O-N 3.09Å; M948-P969 HydrophobicContact CE-CB 4.04Å; M948-P969 HydrophobicContact CE-CG 4.03Å; M948-P969 HydrophobicContact SD-CB 4.17Å; M948-P969 HydrophobicContact SD-CG 3.56Å; M948-P969 VanDerWaalsContact SD-CG 3.56Å
949	P	68.4	Low	73.1	Confident	82 Å²	82	79.1 Å²	79.1	53%	0.532	44%	0.441	S	S	.	.			trans	-63.3	146.1	170.6	24.5	-31.1	0	0	0	110.7	I951	P949-I951 HydrophobicContact CB-CG1 4.26Å; P949-I951 HydrophobicContact CG-CD1 3.74Å; P949-I951 HydrophobicContact CG-CG1 4.02Å; P949-I951 PolarHBondContact O-N 3.2Å
950	N	65.6	Low	73.2	Confident	173 Å²	173	77.2 Å²	77.2	93%	0.925	43%	0.429	S	S	*	.			trans	-68.4	81	175.3	-79.2	-27.8	0	0	0	110.4
951	I	67.4	Low	73.1	Confident	110 Å²	110	79.5 Å²	79.5	56%	0.564	44%	0.441	S	S	*	.			trans	-92.7	140	175.6	-59.5	165.4	0	0	0	108.8	P949 C953 P966	P949-I951 HydrophobicContact CB-CG1 4.26Å; P949-I951 HydrophobicContact CG-CD1 3.74Å; P949-I951 HydrophobicContact CG-CG1 4.02Å; P949-I951 PolarHBondContact O-N 3.2Å; I951-C953 PolarHBondContact O-N 3.02Å; I951-P966 HydrophobicContact CG2-CG 4.06Å
952	T	72.6	Confident	73.3	Confident	113 Å²	113	81.2 Å²	81.2	69%	0.693	45%	0.446	S	S	*	.			trans	-61.2	115.4	167.9	29.2	0	0	0	0	109.8
953	C	76	Confident	73.2	Confident	53 Å²	53	80.4 Å²	80.4	36%	0.358	45%	0.454	S	S	.	.			trans	-119.6	156.7	179.2	72.2	0	0	0	0	110.7	I951 P966 C968	I951-C953 PolarHBondContact O-N 3.02Å; C953-P966 WeakPolarHBondContact CA-O 3.24Å; C953-C968 HydrophobicContact CB-CB 3.95Å; C953-C968 WeakPolarHBondContact CB-SG 3.32Å; C953-C968 VanDerWaalsContact SG-CA 3.52Å; C953-C968 WeakPolarHBondContact SG-CB 3.22Å; C953-C968 CovalentContact SG-SG 2.04Å; C953-C968 PolarHBondContact SG-SG 3.44Å
954	T	78.7	Confident	73	Confident	25 Å²	25	86.7 Å²	86.7	15%	0.153	48%	0.483	C	S	.	.	B	Isolated β-bridge	trans	-131.8	147.2	-176.4	-82.2	0	0	0	0	110.7	N956 Q959 P966	T954-N956 HydrophobicContact CG2-CB 3.57Å; T954-Q959 HydrophobicContact CG2-CB 4.09Å; T954-Q959 PolarHBondContact OG1-OE1 3.33Å; T954-P966 PolarHBondContact N-O 2.68Å; T954-P966 VanDerWaalsContact N-O 3.14Å
955	E	71.8	Confident	72.6	Confident	178 Å²	178	87.7 Å²	87.7	83%	0.832	49%	0.488	S	S	*	.			trans	-99.1	-6.5	172.9	-63.2	-170.1	165.8	0	0	113.7	C968	E955-C968 HydrophobicContact CG-CB 4.4Å
956	N	78.2	Confident	72.8	Confident	81 Å²	81	89.1 Å²	89.1	43%	0.433	50%	0.495	S	S	.	.			trans	-76.5	121.2	-178.4	-164.6	-2.7	0	0	0	112.1	T954 T958 Q959 I960	T954-N956 HydrophobicContact CG2-CB 3.57Å; N956-T958 VanDerWaalsContact C-N 3.34Å; N956-T958 PolarHBondContact O-N 2.98Å; N956-T958 PolarHBondContact OD1-OG1 3.49Å; N956-Q959 PolarHBondContact O-N 3.46Å; N956-I960 WeakPolarHBondContact O-CD1 3.33Å; N956-I960 VanDerWaalsContact O-CG1 3.26Å; N956-I960 WeakPolarHBondContact O-CG1 3.46Å; N956-I960 PolarHBondContact O-N 3.19Å
957	S	73.2	Confident	73.2	Confident	67 Å²	67	85.5 Å²	85.5	47%	0.469	46%	0.464	S	S	.	.	H	α-helix	trans	-63.3	-32.5	-171.8	54.6	0	0	0	0	114.3	L961	S957-L961 WeakPolarHBondContact O-CB 3.49Å; S957-L961 PolarHBondContact O-N 3.06Å; S957-L961 VanDerWaalsContact O-N 3.09Å
958	T	74.3	Confident	73.5	Confident	77 Å²	77	80 Å²	80	47%	0.472	45%	0.448	S	S	.	.	H	α-helix	trans	-70.3	-45.4	-179.8	53.3	0	0	0	0	112.4	N956 I960 L961 E962	N956-T958 VanDerWaalsContact C-N 3.34Å; N956-T958 PolarHBondContact O-N 2.98Å; N956-T958 PolarHBondContact OD1-OG1 3.49Å; T958-I960 VanDerWaalsContact C-N 3.27Å; T958-I960 PolarHBondContact O-N 3.43Å; T958-L961 PolarHBondContact O-N 3.33Å; T958-E962 WeakPolarHBondContact O-CG 3.42Å; T958-E962 PolarHBondContact O-N 3.21Å; T958-E962 VanDerWaalsContact O-N 3.08Å
959	Q	73.5	Confident	73.8	Confident	77 Å²	77	79.6 Å²	79.6	36%	0.36	45%	0.448	S	S	.	.	H	α-helix	trans	-67.4	-27.9	177.8	-67.8	-177.2	-1.8	0	0	112.7	T954 N956 G963 H964	T954-Q959 HydrophobicContact CG2-CB 4.09Å; T954-Q959 PolarHBondContact OG1-OE1 3.33Å; N956-Q959 PolarHBondContact O-N 3.46Å; Q959-G963 PolarHBondContact O-N 3.4Å; Q959-H964 PolarHBondContact O-N 2.89Å
960	I	75.9	Confident	74.3	Confident	4 Å²	4	78.8 Å²	78.8	2%	0.021	44%	0.439	C	S	.	.	H	α-helix	trans	-73.5	-41.8	174.8	-63.8	161.8	0	0	0	110.5	P917 R918 N956 T958 G963 P967	P917-I960 HydrophobicContact CG-CB 4.4Å; P917-I960 HydrophobicContact CG-CG2 4.15Å; R918-I960 WeakPolarHBondContact CD-O 3.37Å; R918-I960 HydrophobicContact CG-CG2 4.39Å; N956-I960 WeakPolarHBondContact O-CD1 3.33Å; N956-I960 VanDerWaalsContact O-CG1 3.26Å; N956-I960 WeakPolarHBondContact O-CG1 3.46Å; N956-I960 PolarHBondContact O-N 3.19Å; T958-I960 VanDerWaalsContact C-N 3.27Å; T958-I960 PolarHBondContact O-N 3.43Å; I960-G963 PolarHBondContact O-N 3.1Å; I960-P967 HydrophobicContact CD1-CB 4.16Å
961	L	74.6	Confident	75	Confident	118 Å²	118	77.7 Å²	77.7	62%	0.618	43%	0.427	S	S	*	.	H	α-helix	trans	-67.7	-37.6	-179.9	-164.3	74.5	0	0	0	112.2	R918 S957 T958 G963	R918-L961 HydrophobicContact CG-CD1 4.3Å; S957-L961 WeakPolarHBondContact O-CB 3.49Å; S957-L961 PolarHBondContact O-N 3.06Å; S957-L961 VanDerWaalsContact O-N 3.09Å; T958-L961 PolarHBondContact O-N 3.33Å; L961-G963 PolarHBondContact O-N 2.84Å
962	E	75.4	Confident	75.6	Confident	133 Å²	133	81.9 Å²	81.9	62%	0.621	44%	0.437	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.5	-12	175.3	-69.5	173.6	178.5	0	0	113	T958 H964	T958-E962 WeakPolarHBondContact O-CG 3.42Å; T958-E962 PolarHBondContact O-N 3.21Å; T958-E962 VanDerWaalsContact O-N 3.08Å; E962-H964 PolarHBondContact O-CD2 3.48Å
963	G	70.9	Confident	76	Confident	54 Å²	54	77 Å²	77	56%	0.557	41%	0.408	S	S	*	.	T	Hydrogen-bonded Turn	trans	81	15.1	173.5	0	0	0	0	0	115.4	Q959 I960 L961	Q959-G963 PolarHBondContact O-N 3.4Å; I960-G963 PolarHBondContact O-N 3.1Å; L961-G963 PolarHBondContact O-N 2.84Å
964	H	72.6	Confident	76.4	Confident	140 Å²	140	75.3 Å²	75.3	65%	0.648	40%	0.395	S	S	*	.	S	Bend	trans	-76.9	-34.9	-176.4	-73.8	-146.6	0	0	0	113.1	Q959 E962	Q959-H964 PolarHBondContact O-N 2.89Å; E962-H964 PolarHBondContact O-CD2 3.48Å
965	L	71.3	Confident	76.8	Confident	50 Å²	50	82.3 Å²	82.3	26%	0.262	42%	0.419	S	S	.	.	S	Bend	trans	-141.1	147.2	177.2	-76	94.9	0	0	0	111.6
966	P	74.1	Confident	77.6	Confident	58 Å²	58	76.6 Å²	76.6	38%	0.377	39%	0.394	S	S	.	.	P	Polyproline II helix	trans	-74.2	153.7	176.8	30.8	-34.7	0	0	0	112.8	I951 C953 T954	I951-P966 HydrophobicContact CG2-CG 4.06Å; C953-P966 WeakPolarHBondContact CA-O 3.24Å; T954-P966 PolarHBondContact N-O 2.68Å; T954-P966 VanDerWaalsContact N-O 3.14Å
967	P	78.7	Confident	78	Confident	12 Å²	12	72.7 Å²	72.7	8%	0.078	37%	0.373	C	S	.	.	B	Isolated β-bridge	trans	-68.1	138.1	175.1	28.8	-34.8	0	0	0	111.1	I960	I960-P967 HydrophobicContact CD1-CB 4.16Å
968	C	77.8	Confident	78.7	Confident	35 Å²	35	72.5 Å²	72.5	24%	0.236	37%	0.366	C	S	.	.	P	Polyproline II helix	trans	-65.5	134.6	176.4	-64.3	0	0	0	0	111.5	C953 E955	C953-C968 HydrophobicContact CB-CB 3.95Å; C953-C968 WeakPolarHBondContact CB-SG 3.32Å; C953-C968 VanDerWaalsContact SG-CA 3.52Å; C953-C968 WeakPolarHBondContact SG-CB 3.22Å; C953-C968 CovalentContact SG-SG 2.04Å; C953-C968 PolarHBondContact SG-SG 3.44Å; E955-C968 HydrophobicContact CG-CB 4.4Å
969	P	78.5	Confident	79.5	Confident	31 Å²	31	72.8 Å²	72.8	20%	0.201	36%	0.364	C	S	.	.	P	Polyproline II helix	trans	-76	142.3	173.1	28.7	-30.5	0	0	0	111.1	L912 M948 K971	L912-P969 HydrophobicContact CD1-CB 3.92Å; L912-P969 HydrophobicContact CG-CB 4.31Å; L912-P969 WeakPolarHBondContact O-CA 3.4Å; M948-P969 HydrophobicContact CE-CB 4.04Å; M948-P969 HydrophobicContact CE-CG 4.03Å; M948-P969 HydrophobicContact SD-CB 4.17Å; M948-P969 HydrophobicContact SD-CG 3.56Å; M948-P969 VanDerWaalsContact SD-CG 3.56Å; P969-K971 PolarHBondContact O-N 3.11Å
970	N	80.3	Confident	80.3	Confident	65 Å²	65	71.5 Å²	71.5	35%	0.348	36%	0.359	S	S	.	.			trans	-77.2	109.1	176.2	-175.2	-2.1	0	0	0	111.1	L911 L912 Y972	L911-N970 WeakPolarHBondContact O-CB 3.49Å; L912-N970 PolarHBondContact O-N 3.21Å; N970-Y972 VanDerWaalsContact C-N 3.32Å; N970-Y972 PolarHBondContact O-N 3.47Å; N970-Y972 WeakPolarHBondContact OD1-CB 3.44Å; N970-Y972 PolarHBondContact OD1-N 3.17Å; N970-Y972 VanDerWaalsContact OD1-N 3.08Å
971	K	78.6	Confident	80.9	Confident	151 Å²	151	71.8 Å²	71.8	66%	0.657	36%	0.361	S	S	*	.	S	Bend	trans	-73.4	-19.8	-177.6	-61.8	-174.7	-179.8	-177.6	0	113.9	A945 P969	A945-K971 HydrophobicContact CB-CG 4.33Å; P969-K971 PolarHBondContact O-N 3.11Å
972	Y	81.4	Confident	81.7	Confident	198 Å²	198	70.3 Å²	70.3	78%	0.776	36%	0.356	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.7	-42.7	-176.1	177.1	-99.6	0	0	0	112.7	N970	N970-Y972 VanDerWaalsContact C-N 3.32Å; N970-Y972 PolarHBondContact O-N 3.47Å; N970-Y972 WeakPolarHBondContact OD1-CB 3.44Å; N970-Y972 PolarHBondContact OD1-N 3.17Å; N970-Y972 VanDerWaalsContact OD1-N 3.08Å
973	A	80.7	Confident	82.5	Confident	10 Å²	10	67.5 Å²	67.5	8%	0.083	35%	0.345	C	S	.	.	T	Hydrogen-bonded Turn	trans	-95.8	7.5	-175.7	0	0	0	0	0	114.1	L911 W975 L976 V977	L911-A973 HydrophobicContact CB-CB 4.25Å; L911-A973 HydrophobicContact CD2-CB 4.03Å; A973-W975 VanDerWaalsContact C-N 3.33Å; A973-W975 PolarHBondContact O-N 3.03Å; A973-L976 WeakPolarHBondContact O-CB 3.44Å; A973-L976 PolarHBondContact O-N 2.95Å; A973-V977 PolarHBondContact O-N 3.48Å; A973-V977 VanDerWaalsContact O-N 3.12Å
974	N	84.8	Confident	83.5	Confident	18 Å²	18	65 Å²	65	10%	0.096	32%	0.319	C	S	.	.	H	α-helix	trans	-57.3	-42.2	-175.4	-174.3	54.7	0	0	0	113	I943 D944 A945 L976 V977 I978	I943-N974 PolarHBondContact O-OD1 3.05Å; D944-N974 PolarHBondContact OD1-ND2 3.42Å; A945-N974 HydrophobicContact CB-CB 4.24Å; A945-N974 PolarHBondContact N-ND2 3.23Å; A945-N974 PolarHBondContact N-OD1 3.31Å; N974-L976 VanDerWaalsContact C-N 3.25Å; N974-L976 PolarHBondContact O-N 3.43Å; N974-V977 PolarHBondContact O-N 2.84Å; N974-V977 VanDerWaalsContact O-N 3.16Å; N974-I978 WeakPolarHBondContact O-CG1 3.47Å; N974-I978 PolarHBondContact O-N 2.9Å
975	W	86.4	Confident	84.4	Confident	171 Å²	171	60.2 Å²	60.2	65%	0.648	30%	0.298	S	S	*	.	H	α-helix	trans	-60.7	-35.4	178.3	71.2	-89.6	0	0	0	112.5	A973 L979	A973-W975 VanDerWaalsContact C-N 3.33Å; A973-W975 PolarHBondContact O-N 3.03Å; W975-L979 HydrophobicContact CZ3-CD2 4.29Å; W975-L979 WeakPolarHBondContact O-CB 3.42Å; W975-L979 PolarHBondContact O-N 3.02Å
976	L	87.9	Confident	85.3	Confident	58 Å²	58	62.7 Å²	62.7	30%	0.304	31%	0.311	S	S	.	.	H	α-helix	trans	-73.5	-36.4	178.1	-178.5	62.6	0	0	0	111.1	L911 A973 N974 L979 L980	L911-L976 HydrophobicContact CD1-CD2 3.92Å; L911-L976 HydrophobicContact CD1-CG 4.19Å; L911-L976 HydrophobicContact CD2-CD2 4.39Å; A973-L976 WeakPolarHBondContact O-CB 3.44Å; A973-L976 PolarHBondContact O-N 2.95Å; N974-L976 VanDerWaalsContact C-N 3.25Å; N974-L976 PolarHBondContact O-N 3.43Å; L976-L979 HydrophobicContact CD1-CD2 4.28Å; L976-L979 PolarHBondContact O-N 3.36Å; L976-L980 HydrophobicContact CG-CD1 4.21Å; L976-L980 WeakPolarHBondContact O-CB 3.43Å; L976-L980 VanDerWaalsContact O-CG 3.31Å; L976-L980 WeakPolarHBondContact O-CG 3.15Å; L976-L980 PolarHBondContact O-N 3.45Å
977	V	87.7	Confident	86.1	Confident	0 Å²	0	61.5 Å²	61.5	0%	0	30%	0.302	C	S	.	.	H	α-helix	trans	-64.1	-42	174.5	175	0	0	0	0	111.2	T908 L911 I943 A973 N974 L980 L981	T908-V977 HydrophobicContact CG2-CG1 3.89Å; L911-V977 HydrophobicContact CB-CG2 3.67Å; L911-V977 HydrophobicContact CD1-CG2 4.08Å; I943-V977 HydrophobicContact CG2-CG1 3.76Å; A973-V977 PolarHBondContact O-N 3.48Å; A973-V977 VanDerWaalsContact O-N 3.12Å; N974-V977 PolarHBondContact O-N 2.84Å; N974-V977 VanDerWaalsContact O-N 3.16Å; V977-L980 PolarHBondContact O-N 2.95Å; V977-L981 WeakPolarHBondContact O-CB 3.34Å; V977-L981 PolarHBondContact O-N 3.11Å
978	I	88.1	Confident	86.6	Confident	63 Å²	63	61 Å²	61	32%	0.323	30%	0.299	S	S	.	.	H	α-helix	trans	-64	-42.5	174.5	-64.1	169.3	0	0	0	110.7	N974 L981 V982	N974-I978 WeakPolarHBondContact O-CG1 3.47Å; N974-I978 PolarHBondContact O-N 2.9Å; I978-L981 WeakPolarHBondContact O-CB 2.72Å; I978-L981 PolarHBondContact O-N 2.66Å; I978-V982 WeakPolarHBondContact O-CG2 3.31Å; I978-V982 PolarHBondContact O-N 3.08Å; I978-V982 VanDerWaalsContact O-N 3.08Å
979	L	89.9	Confident	87	Confident	83 Å²	83	62.1 Å²	62.1	44%	0.435	30%	0.303	S	S	.	.	H	α-helix	trans	-61.9	-45.7	175.3	-178.4	67.4	0	0	0	111.8	W975 L976 L981 V982 I983	W975-L979 HydrophobicContact CZ3-CD2 4.29Å; W975-L979 WeakPolarHBondContact O-CB 3.42Å; W975-L979 PolarHBondContact O-N 3.02Å; L976-L979 HydrophobicContact CD1-CD2 4.28Å; L976-L979 PolarHBondContact O-N 3.36Å; L979-L981 VanDerWaalsContact C-N 3.31Å; L979-L981 PolarHBondContact O-N 3.36Å; L979-V982 PolarHBondContact O-N 3.04Å; L979-I983 HydrophobicContact CD1-CD1 4.36Å; L979-I983 HydrophobicContact CG-CD1 4Å; L979-I983 WeakPolarHBondContact O-CG1 3.42Å; L979-I983 PolarHBondContact O-N 2.95Å
980	L	90.4	Very high	87.5	Confident	49 Å²	49	65 Å²	65	26%	0.257	32%	0.319	S	S	.	.	H	α-helix	trans	-62.6	-36.3	176.4	-77.6	169.9	0	0	0	111.9	Y904 L911 L976 V977 I983 F984	Y904-L980 HydrophobicContact CD2-CB 4.4Å; Y904-L980 HydrophobicContact CE2-CB 4.22Å; L911-L980 HydrophobicContact CD1-CD1 3.66Å; L976-L980 HydrophobicContact CG-CD1 4.21Å; L976-L980 WeakPolarHBondContact O-CB 3.43Å; L976-L980 VanDerWaalsContact O-CG 3.31Å; L976-L980 WeakPolarHBondContact O-CG 3.15Å; L976-L980 PolarHBondContact O-N 3.45Å; V977-L980 PolarHBondContact O-N 2.95Å; L980-I983 PolarHBondContact O-N 3.09Å; L980-F984 WeakPolarHBondContact O-CB 3.43Å; L980-F984 PolarHBondContact O-N 2.95Å
981	L	89.8	Confident	88	Confident	11 Å²	11	66.6 Å²	66.6	6%	0.058	33%	0.328	C	S	.	.	H	α-helix	trans	-62.8	-44.9	173.7	174.6	67.5	0	0	0	111.4	Y904 I938 V977 I978 L979 F984 L985	Y904-L981 VanDerWaalsContact OH-CD1 3.3Å; Y904-L981 WeakPolarHBondContact OH-CD1 3.47Å; I938-L981 HydrophobicContact CG2-CD1 4.44Å; I938-L981 HydrophobicContact CG2-CD2 3.92Å; V977-L981 WeakPolarHBondContact O-CB 3.34Å; V977-L981 PolarHBondContact O-N 3.11Å; I978-L981 WeakPolarHBondContact O-CB 2.72Å; I978-L981 PolarHBondContact O-N 2.66Å; L979-L981 VanDerWaalsContact C-N 3.31Å; L979-L981 PolarHBondContact O-N 3.36Å; L981-F984 PolarHBondContact O-N 3.39Å; L981-L985 HydrophobicContact CD1-CD1 4.15Å; L981-L985 HydrophobicContact CD1-CG 4.28Å; L981-L985 HydrophobicContact CG-CD1 4.2Å; L981-L985 WeakPolarHBondContact O-CB 3.08Å; L981-L985 VanDerWaalsContact O-CG 3.29Å; L981-L985 WeakPolarHBondContact O-CG 3.14Å; L981-L985 PolarHBondContact O-N 3.03Å
982	V	90.7	Very high	88.4	Confident	86 Å²	86	60.4 Å²	60.4	52%	0.521	30%	0.302	S	S	.	.	H	α-helix	trans	-63.8	-45.7	177	173.9	0	0	0	0	111.1	I978 L979 F984 L985 L986	I978-V982 WeakPolarHBondContact O-CG2 3.31Å; I978-V982 PolarHBondContact O-N 3.08Å; I978-V982 VanDerWaalsContact O-N 3.08Å; L979-V982 PolarHBondContact O-N 3.04Å; V982-F984 VanDerWaalsContact C-N 3.34Å; V982-F984 PolarHBondContact O-N 3.29Å; V982-L985 PolarHBondContact O-N 3.39Å; V982-L986 WeakPolarHBondContact O-CB 3.19Å; V982-L986 PolarHBondContact O-N 2.8Å
983	I	92.1	Very high	88.8	Confident	75 Å²	75	54 Å²	54	39%	0.385	28%	0.28	S	S	.	.	H	α-helix	trans	-61.9	-44.3	176.5	-67.5	168.9	0	0	0	110.3	L979 L980 L986 V987	L979-I983 HydrophobicContact CD1-CD1 4.36Å; L979-I983 HydrophobicContact CG-CD1 4Å; L979-I983 WeakPolarHBondContact O-CG1 3.42Å; L979-I983 PolarHBondContact O-N 2.95Å; L980-I983 PolarHBondContact O-N 3.09Å; I983-L986 PolarHBondContact O-N 3.38Å; I983-V987 HydrophobicContact CG2-CG2 4.31Å; I983-V987 WeakPolarHBondContact O-CB 3.36Å; I983-V987 WeakPolarHBondContact O-CG2 3.2Å; I983-V987 PolarHBondContact O-N 3.24Å
984	F	92.3	Very high	89.2	Confident	2 Å²	2	57.6 Å²	57.6	1%	0.009	30%	0.298	C	S	.	.	H	α-helix	trans	-57.6	-51.6	177.4	172.9	-102	0	0	0	110.8	W900 Y904 H933 I934 L980 L981 V982 L986 V987 T988	W900-F984 AromaticContact CD1-CD2 3.83Å; W900-F984 AromaticContact CD1-CE2 3.87Å; W900-F984 AromaticContact NE1-CD2 3.52Å; Y904-F984 HydrophobicContact CD1-CB 4.37Å; Y904-F984 AromaticContact CD1-CD1 3.99Å; Y904-F984 HydrophobicContact CD1-CD1 3.99Å; Y904-F984 AromaticContact CD1-CD2 3.5Å; Y904-F984 HydrophobicContact CD1-CD2 3.5Å; Y904-F984 VanDerWaalsContact CD1-CD2 3.5Å; Y904-F984 HydrophobicContact CD1-CE1 4.11Å; Y904-F984 AromaticContact CD1-CE2 3.63Å; Y904-F984 HydrophobicContact CD1-CE2 3.63Å; Y904-F984 AromaticContact CD1-CG 3.68Å; Y904-F984 HydrophobicContact CD1-CG 3.68Å; Y904-F984 AromaticContact CD1-CZ 3.92Å; Y904-F984 HydrophobicContact CD1-CZ 3.92Å; Y904-F984 HydrophobicContact CD2-CB 3.68Å; Y904-F984 HydrophobicContact CD2-CD2 4.03Å; Y904-F984 AromaticContact CD2-CG 3.91Å; Y904-F984 HydrophobicContact CD2-CG 3.91Å; Y904-F984 HydrophobicContact CE1-CB 4.49Å; Y904-F984 AromaticContact CE1-CD1 3.84Å; Y904-F984 HydrophobicContact CE1-CD1 3.84Å; Y904-F984 HydrophobicContact CE1-CD2 4.2Å; Y904-F984 HydrophobicContact CE1-CE1 4.04Å; Y904-F984 HydrophobicContact CE1-CE2 4.38Å; Y904-F984 AromaticContact CE1-CG 3.92Å; Y904-F984 HydrophobicContact CE1-CG 3.92Å; Y904-F984 HydrophobicContact CE1-CZ 4.3Å; Y904-F984 HydrophobicContact CE2-CB 3.82Å; Y904-F984 HydrophobicContact CE2-CG 4.13Å; Y904-F984 HydrophobicContact CG-CB 3.98Å; Y904-F984 HydrophobicContact CG-CD1 4.43Å; Y904-F984 AromaticContact CG-CD2 3.4Å; Y904-F984 HydrophobicContact CG-CD2 3.4Å; Y904-F984 VanDerWaalsContact CG-CD2 3.4Å; Y904-F984 AromaticContact CG-CE2 3.94Å; Y904-F984 HydrophobicContact CG-CE2 3.94Å; Y904-F984 AromaticContact CG-CG 3.68Å; Y904-F984 HydrophobicContact CG-CG 3.68Å; H933-F984 HydrophobicContact CB-CE1 4.02Å; I934-F984 HydrophobicContact CD1-CZ 4.19Å; I934-F984 HydrophobicContact CG1-CE1 4.03Å; I934-F984 HydrophobicContact CG1-CZ 3.77Å; L980-F984 WeakPolarHBondContact O-CB 3.43Å; L980-F984 PolarHBondContact O-N 2.95Å; L981-F984 PolarHBondContact O-N 3.39Å; V982-F984 VanDerWaalsContact C-N 3.34Å; V982-F984 PolarHBondContact O-N 3.29Å; F984-L986 PolarHBondContact O-N 2.92Å; F984-V987 PolarHBondContact O-N 2.94Å; F984-T988 HydrophobicContact CD2-CG2 3.95Å; F984-T988 HydrophobicContact CE1-CG2 4.25Å; F984-T988 HydrophobicContact CE2-CG2 3.6Å; F984-T988 HydrophobicContact CG-CG2 4.42Å; F984-T988 HydrophobicContact CZ-CG2 3.78Å; F984-T988 WeakPolarHBondContact O-CB 3.42Å; F984-T988 WeakPolarHBondContact O-CG2 3.48Å; F984-T988 PolarHBondContact O-N 3.07Å; F984-T988 PolarHBondContact O-OG1 2.99Å
985	L	90.3	Very high	89.4	Confident	38 Å²	38	60.6 Å²	60.6	20%	0.199	31%	0.314	C	S	.	.	H	α-helix	trans	-63.6	-37.4	178.6	-68.9	172.3	0	0	0	112.9	I938 L981 V982 T988 N989	I938-L985 HydrophobicContact CD1-CD1 3.64Å; I938-L985 HydrophobicContact CD1-CD2 4.33Å; L981-L985 HydrophobicContact CD1-CD1 4.15Å; L981-L985 HydrophobicContact CD1-CG 4.28Å; L981-L985 HydrophobicContact CG-CD1 4.2Å; L981-L985 WeakPolarHBondContact O-CB 3.08Å; L981-L985 VanDerWaalsContact O-CG 3.29Å; L981-L985 WeakPolarHBondContact O-CG 3.14Å; L981-L985 PolarHBondContact O-N 3.03Å; V982-L985 PolarHBondContact O-N 3.39Å; L985-T988 WeakPolarHBondContact CA-OG1 3.24Å; L985-T988 PolarHBondContact O-OG1 3.23Å; L985-N989 VanDerWaalsContact O-CB 3.23Å; L985-N989 WeakPolarHBondContact O-CB 3.32Å; L985-N989 PolarHBondContact O-N 3.21Å
986	L	90.9	Very high	89.5	Confident	102 Å²	102	53.8 Å²	53.8	53%	0.534	29%	0.29	S	S	.	.	I	π-helix	trans	-63.3	-50.9	175.3	-175.1	154.9	0	0	0	110.2	V982 I983 F984 V990 L991	V982-L986 WeakPolarHBondContact O-CB 3.19Å; V982-L986 PolarHBondContact O-N 2.8Å; I983-L986 PolarHBondContact O-N 3.38Å; F984-L986 PolarHBondContact O-N 2.92Å; L986-V990 HydrophobicContact CG-CG2 4.45Å; L986-V990 WeakPolarHBondContact O-CA 3.45Å; L986-V990 WeakPolarHBondContact O-CB 3.26Å; L986-V990 PolarHBondContact O-N 3.44Å; L986-L991 PolarHBondContact O-N 2.59Å
987	V	91.1	Very high	89.7	Confident	34 Å²	34	56 Å²	56	21%	0.206	30%	0.301	C	S	.	.	I	π-helix	trans	-65.3	-44.4	-179	173.7	0	0	0	0	111.1	W900 I983 F984 L991 L992	W900-V987 HydrophobicContact CD2-CG1 4.38Å; W900-V987 HydrophobicContact CZ2-CB 4.03Å; W900-V987 HydrophobicContact CZ2-CG1 3.96Å; W900-V987 HydrophobicContact CZ2-CG2 4.04Å; I983-V987 HydrophobicContact CG2-CG2 4.31Å; I983-V987 WeakPolarHBondContact O-CB 3.36Å; I983-V987 WeakPolarHBondContact O-CG2 3.2Å; I983-V987 PolarHBondContact O-N 3.24Å; F984-V987 PolarHBondContact O-N 2.94Å; V987-L991 WeakPolarHBondContact O-CB 3.34Å; V987-L991 PolarHBondContact O-N 3.32Å; V987-L992 HydrophobicContact CG1-CD1 4.33Å; V987-L992 HydrophobicContact CG1-CG 4.41Å; V987-L992 WeakPolarHBondContact O-CG 3.36Å; V987-L992 PolarHBondContact O-N 2.93Å
988	T	89.3	Confident	89.8	Confident	1 Å²	1	58.8 Å²	58.8	1%	0.006	32%	0.324	C	S	.	.	I	π-helix	trans	-70.3	-51.3	-179.1	54.2	0	0	0	0	112	L897 I934 F984 L985 L992 L993	L897-T988 HydrophobicContact CD1-CG2 4.29Å; I934-T988 HydrophobicContact CG1-CG2 4.43Å; F984-T988 HydrophobicContact CD2-CG2 3.95Å; F984-T988 HydrophobicContact CE1-CG2 4.25Å; F984-T988 HydrophobicContact CE2-CG2 3.6Å; F984-T988 HydrophobicContact CG-CG2 4.42Å; F984-T988 HydrophobicContact CZ-CG2 3.78Å; F984-T988 WeakPolarHBondContact O-CB 3.42Å; F984-T988 WeakPolarHBondContact O-CG2 3.48Å; F984-T988 PolarHBondContact O-N 3.07Å; F984-T988 PolarHBondContact O-OG1 2.99Å; L985-T988 WeakPolarHBondContact CA-OG1 3.24Å; L985-T988 PolarHBondContact O-OG1 3.23Å; T988-L992 HydrophobicContact CG2-CD1 4.38Å; T988-L992 WeakPolarHBondContact O-CB 3.38Å; T988-L992 PolarHBondContact O-N 2.95Å; T988-L993 WeakPolarHBondContact O-CG 3.41Å; T988-L993 PolarHBondContact O-N 3.26Å
989	N	86.9	Confident	89.9	Confident	59 Å²	59	58.5 Å²	58.5	32%	0.316	32%	0.322	S	S	.	.	I	π-helix	trans	-86.2	-35	-170.2	-63.3	-16.2	0	0	0	113.4	L985 L993	L985-N989 VanDerWaalsContact O-CB 3.23Å; L985-N989 WeakPolarHBondContact O-CB 3.32Å; L985-N989 PolarHBondContact O-N 3.21Å; N989-L993 HydrophobicContact CB-CD1 4.37Å; N989-L993 WeakPolarHBondContact OD1-CD1 3.44Å
990	V	88.9	Confident	89.9	Confident	90 Å²	90	57.1 Å²	57.1	55%	0.545	31%	0.313	S	S	.	.	I	π-helix	trans	-88	-37.7	-179.3	-175.2	0	0	0	0	111.6	L986 N994	L986-V990 HydrophobicContact CG-CG2 4.45Å; L986-V990 WeakPolarHBondContact O-CA 3.45Å; L986-V990 WeakPolarHBondContact O-CB 3.26Å; L986-V990 PolarHBondContact O-N 3.44Å; V990-N994 WeakPolarHBondContact O-CB 3.39Å; V990-N994 PolarHBondContact O-ND2 3.19Å
991	L	89	Confident	89.9	Confident	100 Å²	100	57.5 Å²	57.5	52%	0.524	32%	0.319	S	S	.	.	I	π-helix	trans	-98.1	-59.5	-175.7	-170.9	142.3	0	0	0	111.9	L986 V987 L995	L986-L991 PolarHBondContact O-N 2.59Å; V987-L991 WeakPolarHBondContact O-CB 3.34Å; V987-L991 PolarHBondContact O-N 3.32Å; L991-L995 VanDerWaalsContact O-CB 3.28Å; L991-L995 WeakPolarHBondContact O-CB 3.31Å; L991-L995 PolarHBondContact O-N 3.18Å
992	L	88.8	Confident	89.9	Confident	21 Å²	21	64.4 Å²	64.4	11%	0.11	35%	0.345	C	S	.	.	I	π-helix	trans	-70	-48.5	-172.1	-65.2	176.8	0	0	0	112.8	F893 L897 V987 T988 N994 L995 L996	F893-L992 HydrophobicContact CE2-CB 3.88Å; F893-L992 WeakPolarHBondContact CE2-O 3.4Å; F893-L992 HydrophobicContact CZ-CB 4.18Å; L897-L992 HydrophobicContact CD1-CD1 4.15Å; V987-L992 HydrophobicContact CG1-CD1 4.33Å; V987-L992 HydrophobicContact CG1-CG 4.41Å; V987-L992 WeakPolarHBondContact O-CG 3.36Å; V987-L992 PolarHBondContact O-N 2.93Å; T988-L992 HydrophobicContact CG2-CD1 4.38Å; T988-L992 WeakPolarHBondContact O-CB 3.38Å; T988-L992 PolarHBondContact O-N 2.95Å; L992-N994 PolarHBondContact O-N 3.04Å; L992-L995 WeakPolarHBondContact O-CB 3.45Å; L992-L995 PolarHBondContact O-N 3.07Å; L992-L996 PolarHBondContact O-N 3.26Å
993	L	87.9	Confident	89.7	Confident	62 Å²	62	61.3 Å²	61.3	33%	0.325	33%	0.327	S	S	.	.	H	α-helix	trans	-63	-39.8	178.7	-71.5	-176.4	0	0	0	112.4	F893 T988 N989 L995 L996 I997	F893-L993 HydrophobicContact CZ-CD2 4.4Å; T988-L993 WeakPolarHBondContact O-CG 3.41Å; T988-L993 PolarHBondContact O-N 3.26Å; N989-L993 HydrophobicContact CB-CD1 4.37Å; N989-L993 WeakPolarHBondContact OD1-CD1 3.44Å; L993-L995 VanDerWaalsContact C-N 3.33Å; L993-L995 PolarHBondContact O-N 3.33Å; L993-L996 WeakPolarHBondContact O-CB 3.34Å; L993-L996 PolarHBondContact O-N 3.45Å; L993-I997 WeakPolarHBondContact O-CG1 3.25Å; L993-I997 PolarHBondContact O-N 3.28Å
994	N	89.4	Confident	89.5	Confident	86 Å²	86	61.7 Å²	61.7	46%	0.46	33%	0.326	S	S	.	.	H	α-helix	trans	-67.7	-34.5	175.9	-75.2	-29.2	0	0	0	112.3	V990 L992 I997 A998	V990-N994 WeakPolarHBondContact O-CB 3.39Å; V990-N994 PolarHBondContact O-ND2 3.19Å; L992-N994 PolarHBondContact O-N 3.04Å; N994-I997 PolarHBondContact O-N 3.49Å; N994-A998 WeakPolarHBondContact O-CB 3.34Å; N994-A998 PolarHBondContact O-N 3.08Å
995	L	89	Confident	89.3	Confident	81 Å²	81	67.9 Å²	67.9	42%	0.424	36%	0.355	S	S	.	.	H	α-helix	trans	-64.3	-40.4	171.4	-175.6	149.6	0	0	0	111.1	L991 L992 L993 A998 M999	L991-L995 VanDerWaalsContact O-CB 3.28Å; L991-L995 WeakPolarHBondContact O-CB 3.31Å; L991-L995 PolarHBondContact O-N 3.18Å; L992-L995 WeakPolarHBondContact O-CB 3.45Å; L992-L995 PolarHBondContact O-N 3.07Å; L993-L995 VanDerWaalsContact C-N 3.33Å; L993-L995 PolarHBondContact O-N 3.33Å; L995-A998 PolarHBondContact O-N 3.38Å; L995-M999 HydrophobicContact CD2-CE 3.46Å; L995-M999 VanDerWaalsContact CD2-CE 3.46Å; L995-M999 HydrophobicContact CD2-CG 4.09Å; L995-M999 HydrophobicContact CD2-SD 3.64Å; L995-M999 WeakPolarHBondContact O-CG 3.39Å; L995-M999 PolarHBondContact O-N 3.25Å
996	L	89.6	Confident	89	Confident	28 Å²	28	70 Å²	70	15%	0.147	37%	0.369	C	S	.	.	H	α-helix	trans	-59.9	-46.6	173.3	-176.4	64.9	0	0	0	111.7	F893 L992 L993 A998 M999 F1000	F893-L996 HydrophobicContact CB-CD1 3.86Å; F893-L996 HydrophobicContact CD1-CD1 3.86Å; F893-L996 HydrophobicContact CD1-CD2 3.94Å; F893-L996 HydrophobicContact CD1-CG 4.33Å; F893-L996 HydrophobicContact CD2-CB 4.01Å; F893-L996 HydrophobicContact CD2-CD1 4.12Å; F893-L996 HydrophobicContact CE1-CB 4.4Å; F893-L996 HydrophobicContact CE1-CD1 4.47Å; F893-L996 HydrophobicContact CE1-CD2 3.8Å; F893-L996 HydrophobicContact CE1-CG 4.45Å; F893-L996 HydrophobicContact CE2-CB 3.89Å; F893-L996 HydrophobicContact CG-CB 4.32Å; F893-L996 HydrophobicContact CG-CD1 3.66Å; F893-L996 HydrophobicContact CG-CD2 4.47Å; F893-L996 HydrophobicContact CG-CG 4.37Å; F893-L996 HydrophobicContact CZ-CB 4.09Å; F893-L996 HydrophobicContact CZ-CD2 4.23Å; L992-L996 PolarHBondContact O-N 3.26Å; L993-L996 WeakPolarHBondContact O-CB 3.34Å; L993-L996 PolarHBondContact O-N 3.45Å; L996-A998 VanDerWaalsContact C-N 3.3Å; L996-A998 PolarHBondContact O-N 3.35Å; L996-M999 HydrophobicContact CD1-CE 4.07Å; L996-M999 PolarHBondContact O-N 3.16Å; L996-F1000 HydrophobicContact CD1-CD1 4.1Å; L996-F1000 HydrophobicContact CD1-CD2 4.44Å; L996-F1000 HydrophobicContact CD1-CE1 3.54Å; L996-F1000 HydrophobicContact CD1-CE2 3.93Å; L996-F1000 HydrophobicContact CD1-CZ 3.44Å; L996-F1000 VanDerWaalsContact CD1-CZ 3.44Å; L996-F1000 HydrophobicContact CD2-CE2 4.03Å; L996-F1000 HydrophobicContact CD2-CZ 4.16Å; L996-F1000 HydrophobicContact CG-CD2 4.14Å; L996-F1000 HydrophobicContact CG-CE1 4.27Å; L996-F1000 HydrophobicContact CG-CE2 3.77Å; L996-F1000 HydrophobicContact CG-CZ 3.83Å; L996-F1000 WeakPolarHBondContact O-CB 3.27Å; L996-F1000 VanDerWaalsContact O-CG 3.32Å; L996-F1000 WeakPolarHBondContact O-CG 3.28Å; L996-F1000 PolarHBondContact O-N 3.41Å
997	I	90.7	Very high	88.6	Confident	106 Å²	106	65.6 Å²	65.6	54%	0.544	35%	0.347	S	S	.	.	H	α-helix	trans	-59.7	-42.4	176.1	-65.4	166	0	0	0	110.5	L993 N994 F1000 S1001	L993-I997 WeakPolarHBondContact O-CG1 3.25Å; L993-I997 PolarHBondContact O-N 3.28Å; N994-I997 PolarHBondContact O-N 3.49Å; I997-F1000 PolarHBondContact O-N 2.98Å; I997-S1001 WeakPolarHBondContact O-CB 3.32Å; I997-S1001 PolarHBondContact O-N 2.83Å
998	A	90.5	Very high	88.2	Confident	58 Å²	58	69.1 Å²	69.1	48%	0.479	36%	0.361	S	S	.	.	H	α-helix	trans	-65.3	-45.7	178.2	0	0	0	0	0	112.5	N994 L995 L996 F1000 S1001 Y1002	N994-A998 WeakPolarHBondContact O-CB 3.34Å; N994-A998 PolarHBondContact O-N 3.08Å; L995-A998 PolarHBondContact O-N 3.38Å; L996-A998 VanDerWaalsContact C-N 3.3Å; L996-A998 PolarHBondContact O-N 3.35Å; A998-F1000 VanDerWaalsContact C-N 3.34Å; A998-F1000 PolarHBondContact O-N 3.47Å; A998-S1001 PolarHBondContact O-N 3.24Å; A998-Y1002 PolarHBondContact O-N 3.35Å
999	M	89.4	Confident	87.7	Confident	56 Å²	56	72.2 Å²	72.2	28%	0.276	39%	0.392	S	S	.	.	H	α-helix	trans	-60.3	-45.6	175.3	-70.3	-171.5	-54.2	0	0	111	F893 L995 L996 S1001 Y1002 T1003	F893-M999 HydrophobicContact CB-CE 3.93Å; F893-M999 HydrophobicContact CD2-CE 4.14Å; F893-M999 HydrophobicContact CG-CE 4.41Å; L995-M999 HydrophobicContact CD2-CE 3.46Å; L995-M999 VanDerWaalsContact CD2-CE 3.46Å; L995-M999 HydrophobicContact CD2-CG 4.09Å; L995-M999 HydrophobicContact CD2-SD 3.64Å; L995-M999 WeakPolarHBondContact O-CG 3.39Å; L995-M999 PolarHBondContact O-N 3.25Å; L996-M999 HydrophobicContact CD1-CE 4.07Å; L996-M999 PolarHBondContact O-N 3.16Å; M999-S1001 PolarHBondContact O-N 2.75Å; M999-Y1002 PolarHBondContact O-N 3.2Å; M999-T1003 PolarHBondContact O-N 3.3Å; M999-T1003 PolarHBondContact O-OG1 2.9Å
1000	F	90.2	Very high	87.5	Confident	55 Å²	55	73.4 Å²	73.4	24%	0.241	40%	0.399	C	S	.	.	H	α-helix	trans	-61.2	-43	175.5	-78.4	-2.2	0	0	0	113	M886 D889 V890 L996 I997 A998 Y1002 F1004	M886-F1000 HydrophobicContact CB-CD1 4.35Å; M886-F1000 HydrophobicContact CB-CE1 4.3Å; M886-F1000 HydrophobicContact CE-CB 3.28Å; M886-F1000 HydrophobicContact CE-CD1 3.45Å; M886-F1000 VanDerWaalsContact CE-CD1 3.45Å; M886-F1000 HydrophobicContact CE-CD2 3.7Å; M886-F1000 HydrophobicContact CE-CE1 4.17Å; M886-F1000 HydrophobicContact CE-CE2 4.38Å; M886-F1000 HydrophobicContact CE-CG 3.18Å; D889-F1000 HydrophobicContact CB-CE1 4.49Å; V890-F1000 HydrophobicContact CG2-CE1 3.64Å; V890-F1000 HydrophobicContact CG2-CZ 3.44Å; V890-F1000 VanDerWaalsContact CG2-CZ 3.44Å; L996-F1000 HydrophobicContact CD1-CD1 4.1Å; L996-F1000 HydrophobicContact CD1-CD2 4.44Å; L996-F1000 HydrophobicContact CD1-CE1 3.54Å; L996-F1000 HydrophobicContact CD1-CE2 3.93Å; L996-F1000 HydrophobicContact CD1-CZ 3.44Å; L996-F1000 VanDerWaalsContact CD1-CZ 3.44Å; L996-F1000 HydrophobicContact CD2-CE2 4.03Å; L996-F1000 HydrophobicContact CD2-CZ 4.16Å; L996-F1000 HydrophobicContact CG-CD2 4.14Å; L996-F1000 HydrophobicContact CG-CE1 4.27Å; L996-F1000 HydrophobicContact CG-CE2 3.77Å; L996-F1000 HydrophobicContact CG-CZ 3.83Å; L996-F1000 WeakPolarHBondContact O-CB 3.27Å; L996-F1000 VanDerWaalsContact O-CG 3.32Å; L996-F1000 WeakPolarHBondContact O-CG 3.28Å; L996-F1000 PolarHBondContact O-N 3.41Å; I997-F1000 PolarHBondContact O-N 2.98Å; A998-F1000 VanDerWaalsContact C-N 3.34Å; A998-F1000 PolarHBondContact O-N 3.47Å; F1000-Y1002 VanDerWaalsContact C-N 3.35Å; F1000-F1004 WeakPolarHBondContact O-CB 3.46Å; F1000-F1004 PolarHBondContact O-N 2.9Å
1001	S	90.3	Very high	87.3	Confident	56 Å²	56	69.6 Å²	69.6	39%	0.392	38%	0.376	S	S	.	.	H	α-helix	trans	-63.5	-41.7	177.2	-173.7	0	0	0	0	111.5	I997 A998 M999 Q1005	I997-S1001 WeakPolarHBondContact O-CB 3.32Å; I997-S1001 PolarHBondContact O-N 2.83Å; A998-S1001 PolarHBondContact O-N 3.24Å; M999-S1001 PolarHBondContact O-N 2.75Å; S1001-Q1005 VanDerWaalsContact O-CG 3.31Å; S1001-Q1005 WeakPolarHBondContact O-CG 3.16Å; S1001-Q1005 PolarHBondContact O-N 3.28Å
1002	Y	90.2	Very high	87.2	Confident	156 Å²	156	68 Å²	68	61%	0.612	37%	0.368	S	S	*	.	H	α-helix	trans	-63.5	-52.8	176.6	175.3	-101.1	0	0	0	111.2	A998 M999 F1000 F1004 Q1005 V1006	A998-Y1002 PolarHBondContact O-N 3.35Å; M999-Y1002 PolarHBondContact O-N 3.2Å; F1000-Y1002 VanDerWaalsContact C-N 3.35Å; Y1002-F1004 VanDerWaalsContact C-N 3.3Å; Y1002-F1004 PolarHBondContact O-N 3.45Å; Y1002-Q1005 PolarHBondContact O-N 2.91Å; Y1002-V1006 HydrophobicContact CD1-CG2 4.47Å; Y1002-V1006 HydrophobicContact CD2-CG2 4.39Å; Y1002-V1006 HydrophobicContact CE1-CG2 4.1Å; Y1002-V1006 HydrophobicContact CE2-CG2 4Å; Y1002-V1006 WeakPolarHBondContact O-CG2 3.48Å; Y1002-V1006 PolarHBondContact O-N 3.45Å
1003	T	87.2	Confident	87.2	Confident	21 Å²	21	69.4 Å²	69.4	13%	0.129	38%	0.375	C	S	.	.	H	α-helix	trans	-62.4	-38.9	179.2	-61.5	0	0	0	0	111.4	M886 D889 M999 V1006 V1007	M886-T1003 HydrophobicContact CG-CG2 3.94Å; D889-T1003 WeakPolarHBondContact OD2-CB 3.33Å; D889-T1003 PolarHBondContact OD2-OG1 3.28Å; M999-T1003 PolarHBondContact O-N 3.3Å; M999-T1003 PolarHBondContact O-OG1 2.9Å; T1003-V1006 PolarHBondContact O-N 2.95Å; T1003-V1007 HydrophobicContact CG2-CG2 4.03Å; T1003-V1007 WeakPolarHBondContact O-CB 3.32Å; T1003-V1007 WeakPolarHBondContact O-CG2 3.41Å; T1003-V1007 PolarHBondContact O-N 3.17Å
1004	F	88.1	Confident	87.1	Confident	84 Å²	84	68.3 Å²	68.3	37%	0.368	37%	0.368	S	S	.	.	H	α-helix	trans	-58.9	-49.9	174.4	-179.8	-94.1	0	0	0	111.7	I882 F1000 Y1002 V1006 V1007 Q1008	I882-F1004 HydrophobicContact CD1-CD2 4.22Å; I882-F1004 HydrophobicContact CD1-CE2 3.88Å; I882-F1004 HydrophobicContact CG2-CD2 3.76Å; I882-F1004 HydrophobicContact CG2-CE2 4.31Å; F1000-F1004 WeakPolarHBondContact O-CB 3.46Å; F1000-F1004 PolarHBondContact O-N 2.9Å; Y1002-F1004 VanDerWaalsContact C-N 3.3Å; Y1002-F1004 PolarHBondContact O-N 3.45Å; F1004-V1006 PolarHBondContact O-N 3.43Å; F1004-V1007 PolarHBondContact O-N 3.47Å; F1004-Q1008 WeakPolarHBondContact O-CB 3.38Å; F1004-Q1008 PolarHBondContact O-N 3.49Å
1005	Q	86.7	Confident	87.2	Confident	132 Å²	132	64.8 Å²	64.8	62%	0.617	35%	0.348	S	S	*	.	H	α-helix	trans	-62.2	-43.9	179.5	-74.6	175.2	0.2	0	0	112.4	S1001 Y1002 V1007	S1001-Q1005 VanDerWaalsContact O-CG 3.31Å; S1001-Q1005 WeakPolarHBondContact O-CG 3.16Å; S1001-Q1005 PolarHBondContact O-N 3.28Å; Y1002-Q1005 PolarHBondContact O-N 2.91Å; Q1005-V1007 VanDerWaalsContact C-N 3.33Å; Q1005-V1007 PolarHBondContact O-N 2.95Å
1006	V	84.3	Confident	87.2	Confident	83 Å²	83	62.5 Å²	62.5	50%	0.503	33%	0.334	S	S	.	.	H	α-helix	trans	-64.9	-39	178.9	172	0	0	0	0	111.4	Y1002 T1003 F1004	Y1002-V1006 HydrophobicContact CD1-CG2 4.47Å; Y1002-V1006 HydrophobicContact CD2-CG2 4.39Å; Y1002-V1006 HydrophobicContact CE1-CG2 4.1Å; Y1002-V1006 HydrophobicContact CE2-CG2 4Å; Y1002-V1006 WeakPolarHBondContact O-CG2 3.48Å; Y1002-V1006 PolarHBondContact O-N 3.45Å; T1003-V1006 PolarHBondContact O-N 2.95Å; F1004-V1006 PolarHBondContact O-N 3.43Å
1007	V	82.6	Confident	87.1	Confident	9 Å²	9	62.3 Å²	62.3	6%	0.055	33%	0.332	C	S	.	.	H	α-helix	trans	-83.8	-35.2	-174.2	174.7	0	0	0	0	111.6	I882 T1003 F1004 Q1005 G1009 N1010 T1011	I882-V1007 HydrophobicContact CG1-CG1 3.92Å; T1003-V1007 HydrophobicContact CG2-CG2 4.03Å; T1003-V1007 WeakPolarHBondContact O-CB 3.32Å; T1003-V1007 WeakPolarHBondContact O-CG2 3.41Å; T1003-V1007 PolarHBondContact O-N 3.17Å; F1004-V1007 PolarHBondContact O-N 3.47Å; Q1005-V1007 VanDerWaalsContact C-N 3.33Å; Q1005-V1007 PolarHBondContact O-N 2.95Å; V1007-G1009 VanDerWaalsContact C-N 3.28Å; V1007-G1009 PolarHBondContact O-N 2.99Å; V1007-N1010 PolarHBondContact O-N 3.47Å; V1007-N1010 VanDerWaalsContact O-N 3.11Å; V1007-T1011 HydrophobicContact CB-CG2 4.47Å; V1007-T1011 HydrophobicContact CG1-CG2 3.38Å; V1007-T1011 WeakPolarHBondContact O-CG2 3.36Å; V1007-T1011 PolarHBondContact O-N 3.17Å; V1007-T1011 VanDerWaalsContact O-N 3.14Å
1008	Q	83.1	Confident	86.9	Confident	108 Å²	108	60.5 Å²	60.5	51%	0.505	32%	0.322	S	S	.	.	H	α-helix	trans	-57.3	-35.5	-175.8	-176.5	-179.8	2.9	0	0	113.7	F1004 N1010 T1011	F1004-Q1008 WeakPolarHBondContact O-CB 3.38Å; F1004-Q1008 PolarHBondContact O-N 3.49Å; Q1008-N1010 VanDerWaalsContact C-N 3.25Å; Q1008-N1010 PolarHBondContact O-N 3.29Å; Q1008-T1011 PolarHBondContact O-OG1 3.41Å; Q1008-T1011 VanDerWaalsContact O-OG1 3.07Å
1009	G	78.6	Confident	86.8	Confident	65 Å²	65	59.6 Å²	59.6	67%	0.67	31%	0.306	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.8	-28.6	179.9	0	0	0	0	0	114.1	V1007	V1007-G1009 VanDerWaalsContact C-N 3.28Å; V1007-G1009 PolarHBondContact O-N 2.99Å
1010	N	82.7	Confident	86.7	Confident	85 Å²	85	57.3 Å²	57.3	46%	0.455	29%	0.294	S	S	.	.	T	Hydrogen-bonded Turn	trans	-115.3	-1.3	-173	-65.6	-21.3	0	0	0	113.6	V1007 Q1008 D1012 I1013 F1014	V1007-N1010 PolarHBondContact O-N 3.47Å; V1007-N1010 VanDerWaalsContact O-N 3.11Å; Q1008-N1010 VanDerWaalsContact C-N 3.25Å; Q1008-N1010 PolarHBondContact O-N 3.29Å; N1010-D1012 VanDerWaalsContact C-N 3.34Å; N1010-D1012 PolarHBondContact O-N 2.99Å; N1010-I1013 WeakPolarHBondContact O-CB 3.2Å; N1010-I1013 PolarHBondContact O-N 3.34Å; N1010-F1014 HydrophobicContact CB-CD2 4.19Å; N1010-F1014 HydrophobicContact CB-CE2 3.7Å; N1010-F1014 WeakPolarHBondContact O-CD2 3.21Å; N1010-F1014 PolarHBondContact O-N 3.26Å
1011	T	86.1	Confident	86.4	Confident	10 Å²	10	57.9 Å²	57.9	6%	0.061	30%	0.3	C	S	.	.	H	α-helix	trans	-64.9	-33.6	-173.5	43.7	0	0	0	0	114.4	I881 I882 V1007 Q1008 I1013 F1014 W1015	I881-T1011 HydrophobicContact CG2-CG2 4.39Å; I882-T1011 HydrophobicContact CD1-CG2 3.94Å; I882-T1011 HydrophobicContact CG1-CG2 3.47Å; I882-T1011 VanDerWaalsContact CG1-CG2 3.47Å; V1007-T1011 HydrophobicContact CB-CG2 4.47Å; V1007-T1011 HydrophobicContact CG1-CG2 3.38Å; V1007-T1011 WeakPolarHBondContact O-CG2 3.36Å; V1007-T1011 PolarHBondContact O-N 3.17Å; V1007-T1011 VanDerWaalsContact O-N 3.14Å; Q1008-T1011 PolarHBondContact O-OG1 3.41Å; Q1008-T1011 VanDerWaalsContact O-OG1 3.07Å; T1011-I1013 VanDerWaalsContact C-N 3.28Å; T1011-I1013 PolarHBondContact O-N 3.39Å; T1011-F1014 PolarHBondContact O-N 3.44Å; T1011-W1015 WeakPolarHBondContact O-CB 3.38Å; T1011-W1015 PolarHBondContact O-N 3.45Å
1012	D	86.6	Confident	86.1	Confident	65 Å²	65	55.9 Å²	55.9	35%	0.348	29%	0.285	S	S	.	.	H	α-helix	trans	-60.5	-41.1	176.4	-174.7	61.2	0	0	0	111.1	N1010 W1015 K1016	N1010-D1012 VanDerWaalsContact C-N 3.34Å; N1010-D1012 PolarHBondContact O-N 2.99Å; D1012-W1015 PolarHBondContact O-N 2.99Å; D1012-K1016 WeakPolarHBondContact O-CB 3.42Å; D1012-K1016 WeakPolarHBondContact O-CG 3.38Å; D1012-K1016 PolarHBondContact O-N 2.84Å; D1012-K1016 WeakPolarHBondContact OD2-CE 3.46Å; D1012-K1016 IonicContact OD2-NZ 3.69Å; D1012-K1016 PolarHBondContact OD2-NZ 2.9Å
1013	I	87.9	Confident	85.9	Confident	52 Å²	52	48.7 Å²	48.7	27%	0.267	26%	0.257	S	S	.	.	H	α-helix	trans	-62.5	-48.3	177	-61.5	171.3	0	0	0	110.3	K636 A640 N1010 T1011 W1015 K1016 F1017	K636-I1013 HydrophobicContact CB-CG2 3.85Å; K636-I1013 WeakPolarHBondContact O-CG2 3.4Å; A640-I1013 HydrophobicContact CB-CB 4.13Å; A640-I1013 HydrophobicContact CB-CG1 3.95Å; A640-I1013 HydrophobicContact CB-CG2 3.95Å; N1010-I1013 WeakPolarHBondContact O-CB 3.2Å; N1010-I1013 PolarHBondContact O-N 3.34Å; T1011-I1013 VanDerWaalsContact C-N 3.28Å; T1011-I1013 PolarHBondContact O-N 3.39Å; I1013-W1015 VanDerWaalsContact C-N 3.34Å; I1013-W1015 PolarHBondContact O-N 2.88Å; I1013-K1016 PolarHBondContact O-N 3.28Å; I1013-F1017 PolarHBondContact O-N 3.49Å; I1013-F1017 VanDerWaalsContact O-N 3.1Å
1014	F	86.4	Confident	85.6	Confident	39 Å²	39	49.8 Å²	49.8	17%	0.171	26%	0.264	C	S	.	.	H	α-helix	trans	-63	-40.2	178.1	-68.7	-71.2	0	0	0	112.3	K636 I881 R885 N1010 T1011 F1017 Q1018	K636-F1014 HydrophobicContact CD-CD1 3.45Å; K636-F1014 VanDerWaalsContact CD-CD1 3.45Å; K636-F1014 HydrophobicContact CD-CE1 3.24Å; K636-F1014 HydrophobicContact CD-CZ 4.27Å; I881-F1014 HydrophobicContact CG2-CB 4.23Å; R885-F1014 VanDerWaalsContact NH2-CE2 3.3Å; N1010-F1014 HydrophobicContact CB-CD2 4.19Å; N1010-F1014 HydrophobicContact CB-CE2 3.7Å; N1010-F1014 WeakPolarHBondContact O-CD2 3.21Å; N1010-F1014 PolarHBondContact O-N 3.26Å; T1011-F1014 PolarHBondContact O-N 3.44Å; F1014-F1017 PolarHBondContact O-N 3.23Å; F1014-Q1018 PolarHBondContact O-N 2.99Å
1015	W	90.3	Very high	85.2	Confident	12 Å²	12	47.4 Å²	47.4	5%	0.045	25%	0.253	C	S	.	.	H	α-helix	trans	-66.8	-45	177.8	171.8	69.8	0	0	0	112	A871 I872 K874 G877 P878 T1011 D1012 I1013 F1017 Q1018 R1019	A871-W1015 PolarHBondContact O-NE1 3.47Å; I872-W1015 WeakPolarHBondContact O-CZ2 3.4Å; K874-W1015 VanDerWaalsContact CA-CZ2 3.48Å; K874-W1015 HydrophobicContact CB-CH2 3.87Å; K874-W1015 HydrophobicContact CB-CZ2 4.12Å; K874-W1015 HydrophobicContact CG-CH2 3.92Å; K874-W1015 HydrophobicContact CG-CZ3 4.19Å; G877-W1015 VanDerWaalsContact CA-CD1 3.49Å; P878-W1015 HydrophobicContact CG-CB 3.93Å; P878-W1015 HydrophobicContact CG-CD2 4.2Å; P878-W1015 HydrophobicContact CG-CG 3.86Å; T1011-W1015 WeakPolarHBondContact O-CB 3.38Å; T1011-W1015 PolarHBondContact O-N 3.45Å; D1012-W1015 PolarHBondContact O-N 2.99Å; I1013-W1015 VanDerWaalsContact C-N 3.34Å; I1013-W1015 PolarHBondContact O-N 2.88Å; W1015-F1017 VanDerWaalsContact C-N 3.26Å; W1015-F1017 PolarHBondContact O-N 3.09Å; W1015-Q1018 PolarHBondContact O-N 3.31Å; W1015-Q1018 VanDerWaalsContact O-N 3.16Å; W1015-R1019 WeakPolarHBondContact O-CB 3.11Å; W1015-R1019 PolarHBondContact O-N 2.94Å
1016	K	89.2	Confident	85	Confident	32 Å²	32	41.7 Å²	41.7	14%	0.139	23%	0.226	C	C	.	.	H	α-helix	trans	-59.9	-35.9	176.5	-78.4	176.2	176.6	169.9	0	112.6	A640 Q645 D1012 I1013 Y1020	A640-K1016 HydrophobicContact CB-CB 4.32Å; A640-K1016 HydrophobicContact CB-CD 3.88Å; A640-K1016 PolarHBondContact O-NZ 3.15Å; Q645-K1016 HydrophobicContact CG-CD 4.03Å; Q645-K1016 HydrophobicContact CG-CG 4.25Å; Q645-K1016 PolarHBondContact NE2-O 2.92Å; D1012-K1016 WeakPolarHBondContact O-CB 3.42Å; D1012-K1016 WeakPolarHBondContact O-CG 3.38Å; D1012-K1016 PolarHBondContact O-N 2.84Å; D1012-K1016 WeakPolarHBondContact OD2-CE 3.46Å; D1012-K1016 IonicContact OD2-NZ 3.69Å; D1012-K1016 PolarHBondContact OD2-NZ 2.9Å; I1013-K1016 PolarHBondContact O-N 3.28Å; K1016-Y1020 PolarHBondContact O-N 3.46Å
1017	F	88.8	Confident	84.8	Confident	24 Å²	24	40.2 Å²	40.2	11%	0.105	21%	0.214	C	C	.	.	H	α-helix	trans	-68	-45.9	172.4	178.9	-109.7	0	0	0	112.5	K636 F639 I1013 F1014 W1015 R1019 Y1020 N1021	K636-F1017 HydrophobicContact CG-CD1 4.41Å; K636-F1017 HydrophobicContact CG-CG 4.28Å; F639-F1017 HydrophobicContact CB-CB 4.47Å; F639-F1017 HydrophobicContact CB-CD2 4.09Å; F639-F1017 AromaticContact CD2-CD2 3.35Å; F639-F1017 HydrophobicContact CD2-CD2 3.35Å; F639-F1017 AromaticContact CD2-CE2 3.61Å; F639-F1017 HydrophobicContact CD2-CE2 3.61Å; F639-F1017 AromaticContact CE2-CD2 3.91Å; F639-F1017 HydrophobicContact CE2-CD2 3.91Å; F639-F1017 AromaticContact CE2-CE2 3.66Å; F639-F1017 HydrophobicContact CE2-CE2 3.66Å; F639-F1017 AromaticContact CG-CD2 3.81Å; F639-F1017 HydrophobicContact CG-CD2 3.81Å; F639-F1017 HydrophobicContact CG-CE2 4.4Å; I1013-F1017 PolarHBondContact O-N 3.49Å; I1013-F1017 VanDerWaalsContact O-N 3.1Å; F1014-F1017 PolarHBondContact O-N 3.23Å; W1015-F1017 VanDerWaalsContact C-N 3.26Å; W1015-F1017 PolarHBondContact O-N 3.09Å; F1017-R1019 VanDerWaalsContact C-N 3.3Å; F1017-R1019 PolarHBondContact O-N 3.03Å; F1017-Y1020 WeakPolarHBondContact O-CB 3.38Å; F1017-Y1020 PolarHBondContact O-N 3.19Å; F1017-N1021 PolarHBondContact O-N 3.47Å
1018	Q	85.2	Confident	84.4	Confident	69 Å²	69	42.7 Å²	42.7	32%	0.322	23%	0.232	S	C	.	.	H	α-helix	trans	-64.5	-35.5	175.9	-76.2	-171.6	-22.2	0	0	113	F1014 W1015 Y1020 N1021 L1022	F1014-Q1018 PolarHBondContact O-N 2.99Å; W1015-Q1018 PolarHBondContact O-N 3.31Å; W1015-Q1018 VanDerWaalsContact O-N 3.16Å; Q1018-Y1020 PolarHBondContact O-N 3.29Å; Q1018-N1021 PolarHBondContact O-N 2.93Å; Q1018-L1022 PolarHBondContact O-N 3.48Å
1019	R	89	Confident	84.1	Confident	39 Å²	39	39.5 Å²	39.5	15%	0.147	22%	0.215	C	C	.	.	H	α-helix	trans	-55.8	-41	173.7	179.2	-174.6	174.9	-148.5	-1.4	111	T649 W1015 F1017 L1022 I1023	T649-R1019 PolarHBondContact OG1-NH2 3.1Å; W1015-R1019 WeakPolarHBondContact O-CB 3.11Å; W1015-R1019 PolarHBondContact O-N 2.94Å; F1017-R1019 VanDerWaalsContact C-N 3.3Å; F1017-R1019 PolarHBondContact O-N 3.03Å; R1019-L1022 PolarHBondContact O-N 3.05Å; R1019-I1023 HydrophobicContact CG-CD1 3.73Å; R1019-I1023 HydrophobicContact CG-CG1 4.35Å; R1019-I1023 WeakPolarHBondContact O-CB 3.47Å; R1019-I1023 WeakPolarHBondContact O-CG1 3.34Å; R1019-I1023 PolarHBondContact O-N 3.42Å
1020	Y	87.5	Confident	84.1	Confident	8 Å²	8	36.7 Å²	36.7	3%	0.031	19%	0.185	C	C	.	.	H	α-helix	trans	-58.3	-54.9	174.7	165.8	-100.3	0	0	0	111.8	L627 T631 F639 L648 K1016 F1017 Q1018 L1022 I1023 V1024	L627-Y1020 HydrophobicContact CD2-CE2 4.4Å; T631-Y1020 HydrophobicContact CG2-CE1 4.31Å; T631-Y1020 WeakPolarHBondContact OG1-CE1 3.22Å; T631-Y1020 PolarHBondContact OG1-OH 2.95Å; F639-Y1020 HydrophobicContact CD1-CD1 4.2Å; F639-Y1020 HydrophobicContact CD1-CD2 4.09Å; F639-Y1020 AromaticContact CD1-CG 3.81Å; F639-Y1020 HydrophobicContact CD1-CG 3.81Å; F639-Y1020 AromaticContact CE1-CD1 3.68Å; F639-Y1020 HydrophobicContact CE1-CD1 3.68Å; F639-Y1020 AromaticContact CE1-CD2 3.69Å; F639-Y1020 HydrophobicContact CE1-CD2 3.69Å; F639-Y1020 AromaticContact CE1-CE1 3.87Å; F639-Y1020 HydrophobicContact CE1-CE1 3.87Å; F639-Y1020 AromaticContact CE1-CE2 3.85Å; F639-Y1020 HydrophobicContact CE1-CE2 3.85Å; F639-Y1020 AromaticContact CE1-CG 3.59Å; F639-Y1020 HydrophobicContact CE1-CG 3.59Å; F639-Y1020 AromaticContact CE1-CZ 3.92Å; F639-Y1020 HydrophobicContact CZ-CD1 4.03Å; F639-Y1020 AromaticContact CZ-CE1 3.98Å; F639-Y1020 HydrophobicContact CZ-CE1 3.98Å; F639-Y1020 HydrophobicContact CZ-CG 4.39Å; L648-Y1020 HydrophobicContact CD1-CD2 3.95Å; L648-Y1020 HydrophobicContact CD1-CG 4.38Å; L648-Y1020 HydrophobicContact CD2-CD2 3.53Å; L648-Y1020 HydrophobicContact CD2-CE2 4.13Å; L648-Y1020 HydrophobicContact CG-CD2 4.37Å; K1016-Y1020 PolarHBondContact O-N 3.46Å; F1017-Y1020 WeakPolarHBondContact O-CB 3.38Å; F1017-Y1020 PolarHBondContact O-N 3.19Å; Q1018-Y1020 PolarHBondContact O-N 3.29Å; Y1020-L1022 PolarHBondContact O-N 3.35Å; Y1020-I1023 PolarHBondContact O-N 3.42Å; Y1020-V1024 HydrophobicContact CD2-CG2 4.01Å; Y1020-V1024 HydrophobicContact CE1-CG2 4.12Å; Y1020-V1024 HydrophobicContact CE2-CG2 3.53Å; Y1020-V1024 WeakPolarHBondContact O-CG2 3.48Å; Y1020-V1024 PolarHBondContact O-N 3.28Å
1021	N	83.6	Confident	83.7	Confident	67 Å²	67	34.8 Å²	34.8	36%	0.358	18%	0.181	S	C	.	.	H	α-helix	trans	-56.3	-41.8	-178.8	-68.4	-19.9	0	0	0	111.6	F1017 Q1018 V1024 E1025	F1017-N1021 PolarHBondContact O-N 3.47Å; Q1018-N1021 PolarHBondContact O-N 2.93Å; N1021-V1024 PolarHBondContact O-N 2.8Å; N1021-E1025 WeakPolarHBondContact O-CB 3.48Å; N1021-E1025 PolarHBondContact O-N 2.89Å
1022	L	83.3	Confident	83.4	Confident	14 Å²	14	37.9 Å²	37.9	7%	0.073	20%	0.196	C	C	.	.	H	α-helix	trans	-67.7	-39.8	178.2	-166.3	69.2	0	0	0	112.5	I872 Q1018 R1019 Y1020 E1025 Y1026	I872-L1022 HydrophobicContact CB-CD2 3.54Å; I872-L1022 HydrophobicContact CD1-CD2 3.83Å; I872-L1022 HydrophobicContact CG1-CD2 3.8Å; Q1018-L1022 PolarHBondContact O-N 3.48Å; R1019-L1022 PolarHBondContact O-N 3.05Å; Y1020-L1022 PolarHBondContact O-N 3.35Å; L1022-E1025 WeakPolarHBondContact O-CB 3.32Å; L1022-E1025 PolarHBondContact O-N 3.34Å; L1022-Y1026 HydrophobicContact CD1-CD2 4.18Å; L1022-Y1026 HydrophobicContact CD1-CE2 3.69Å; L1022-Y1026 HydrophobicContact CD2-CE2 4.45Å; L1022-Y1026 HydrophobicContact CG-CD2 3.97Å; L1022-Y1026 HydrophobicContact CG-CE2 3.84Å; L1022-Y1026 VanDerWaalsContact O-CD2 3.26Å; L1022-Y1026 WeakPolarHBondContact O-CD2 3.48Å; L1022-Y1026 PolarHBondContact O-N 2.94Å
1023	I	85.8	Confident	83.1	Confident	4 Å²	4	35.4 Å²	35.4	2%	0.021	19%	0.185	C	C	.	.	H	α-helix	trans	-64.4	-45.4	176.8	-71.2	168.8	0	0	0	110.6	L648 W652 R1019 Y1020 E1025 Y1026 H1027	L648-I1023 HydrophobicContact CB-CD1 4.03Å; W652-I1023 HydrophobicContact CB-CD1 4.46Å; W652-I1023 HydrophobicContact CD2-CG1 4.45Å; W652-I1023 HydrophobicContact CE3-CB 4.42Å; W652-I1023 HydrophobicContact CE3-CG1 3.75Å; W652-I1023 HydrophobicContact CE3-CG2 4.29Å; W652-I1023 HydrophobicContact CZ3-CG1 4.21Å; R1019-I1023 HydrophobicContact CG-CD1 3.73Å; R1019-I1023 HydrophobicContact CG-CG1 4.35Å; R1019-I1023 WeakPolarHBondContact O-CB 3.47Å; R1019-I1023 WeakPolarHBondContact O-CG1 3.34Å; R1019-I1023 PolarHBondContact O-N 3.42Å; Y1020-I1023 PolarHBondContact O-N 3.42Å; I1023-E1025 VanDerWaalsContact C-N 3.27Å; I1023-E1025 PolarHBondContact O-N 2.76Å; I1023-Y1026 PolarHBondContact O-N 2.9Å; I1023-H1027 VanDerWaalsContact O-CB 3.29Å; I1023-H1027 WeakPolarHBondContact O-CB 3.27Å; I1023-H1027 PolarHBondContact O-N 3Å
1024	V	81.3	Confident	82.7	Confident	45 Å²	45	33.4 Å²	33.4	27%	0.273	18%	0.176	S	C	.	.	H	α-helix	trans	-59.5	-41.9	176.9	173.6	0	0	0	0	110.5	Y1020 N1021 H1027 S1028 L1060	Y1020-V1024 HydrophobicContact CD2-CG2 4.01Å; Y1020-V1024 HydrophobicContact CE1-CG2 4.12Å; Y1020-V1024 HydrophobicContact CE2-CG2 3.53Å; Y1020-V1024 WeakPolarHBondContact O-CG2 3.48Å; Y1020-V1024 PolarHBondContact O-N 3.28Å; N1021-V1024 PolarHBondContact O-N 2.8Å; V1024-H1027 PolarHBondContact O-N 3.06Å; V1024-S1028 PolarHBondContact O-N 2.99Å; V1024-S1028 VanDerWaalsContact O-N 3.1Å; V1024-L1060 HydrophobicContact CG2-CD1 4.42Å; V1024-L1060 HydrophobicContact CG2-CD2 4.31Å
1025	E	80.8	Confident	82.4	Confident	33 Å²	33	32.2 Å²	32.2	15%	0.154	17%	0.172	C	C	.	.	H	α-helix	trans	-58	-53.6	174.7	-173.6	-176.3	178.7	0	0	111.7	Q802 N1021 L1022 I1023 H1027 S1028 R1029	Q802-E1025 PolarHBondContact NE2-OE1 2.9Å; N1021-E1025 WeakPolarHBondContact O-CB 3.48Å; N1021-E1025 PolarHBondContact O-N 2.89Å; L1022-E1025 WeakPolarHBondContact O-CB 3.32Å; L1022-E1025 PolarHBondContact O-N 3.34Å; I1023-E1025 VanDerWaalsContact C-N 3.27Å; I1023-E1025 PolarHBondContact O-N 2.76Å; E1025-H1027 VanDerWaalsContact C-N 3.34Å; E1025-H1027 PolarHBondContact O-N 3.23Å; E1025-S1028 PolarHBondContact O-N 3.31Å; E1025-S1028 PolarHBondContact O-OG 3.2Å; E1025-R1029 WeakPolarHBondContact O-CG 3.38Å; E1025-R1029 PolarHBondContact O-N 3.15Å; E1025-R1029 IonicContact OE1-CZ 3.05Å; E1025-R1029 IonicContact OE1-NE 3.14Å; E1025-R1029 IonicContact OE1-NH2 3.41Å; E1025-R1029 PolarHBondContact OE1-NH2 2.95Å
1026	Y	81.1	Confident	82	Confident	13 Å²	13	37.5 Å²	37.5	5%	0.051	20%	0.195	C	C	.	.	H	α-helix	trans	-69.2	-27.8	-179.6	-80.7	-73.5	0	0	0	114.2	F752 N755 L1022 I1023 S1028 R1029	F752-Y1026 HydrophobicContact CB-CD1 4.32Å; F752-Y1026 HydrophobicContact CB-CE1 4.48Å; F752-Y1026 HydrophobicContact CD2-CD1 4.42Å; F752-Y1026 HydrophobicContact CD2-CD2 4.14Å; F752-Y1026 AromaticContact CD2-CE1 3.98Å; F752-Y1026 HydrophobicContact CD2-CE1 3.98Å; F752-Y1026 AromaticContact CD2-CE2 3.68Å; F752-Y1026 HydrophobicContact CD2-CE2 3.68Å; F752-Y1026 AromaticContact CD2-CZ 3.6Å; F752-Y1026 HydrophobicContact CE2-CE2 4.18Å; N755-Y1026 HydrophobicContact CB-CE1 4.44Å; L1022-Y1026 HydrophobicContact CD1-CD2 4.18Å; L1022-Y1026 HydrophobicContact CD1-CE2 3.69Å; L1022-Y1026 HydrophobicContact CD2-CE2 4.45Å; L1022-Y1026 HydrophobicContact CG-CD2 3.97Å; L1022-Y1026 HydrophobicContact CG-CE2 3.84Å; L1022-Y1026 VanDerWaalsContact O-CD2 3.26Å; L1022-Y1026 WeakPolarHBondContact O-CD2 3.48Å; L1022-Y1026 PolarHBondContact O-N 2.94Å; I1023-Y1026 PolarHBondContact O-N 2.9Å; Y1026-S1028 VanDerWaalsContact C-N 3.33Å; Y1026-R1029 PolarHBondContact O-N 3.18Å
1027	H	80.3	Confident	81.7	Confident	51 Å²	51	36.1 Å²	36.1	24%	0.236	19%	0.19	C	C	.	.	H	α-helix	trans	-67.8	-35.1	173.7	-172	-77.8	0	0	0	111.6	P748 I1023 V1024 E1025 R1029	P748-H1027 HydrophobicContact CG-CB 4.26Å; I1023-H1027 VanDerWaalsContact O-CB 3.29Å; I1023-H1027 WeakPolarHBondContact O-CB 3.27Å; I1023-H1027 PolarHBondContact O-N 3Å; V1024-H1027 PolarHBondContact O-N 3.06Å; E1025-H1027 VanDerWaalsContact C-N 3.34Å; E1025-H1027 PolarHBondContact O-N 3.23Å; H1027-R1029 VanDerWaalsContact C-N 3.33Å
1028	S	74.8	Confident	81.4	Confident	62 Å²	62	36.9 Å²	36.9	43%	0.434	19%	0.194	S	C	.	.	H	α-helix	trans	-78	-14.9	176.9	77.9	0	0	0	0	114.1	V1024 E1025 Y1026	V1024-S1028 PolarHBondContact O-N 2.99Å; V1024-S1028 VanDerWaalsContact O-N 3.1Å; E1025-S1028 PolarHBondContact O-N 3.31Å; E1025-S1028 PolarHBondContact O-OG 3.2Å; Y1026-S1028 VanDerWaalsContact C-N 3.33Å
1029	R	77.4	Confident	81.4	Confident	41 Å²	41	38.5 Å²	38.5	16%	0.155	20%	0.204	C	C	.	.	S	Bend	trans	-76	144.7	-176.9	-78.5	176.8	-176.5	-133.1	-0.5	111.6	V751 E1025 Y1026 H1027	V751-R1029 HydrophobicContact CG1-CB 4.47Å; E1025-R1029 WeakPolarHBondContact O-CG 3.38Å; E1025-R1029 PolarHBondContact O-N 3.15Å; E1025-R1029 IonicContact OE1-CZ 3.05Å; E1025-R1029 IonicContact OE1-NE 3.14Å; E1025-R1029 IonicContact OE1-NH2 3.41Å; E1025-R1029 PolarHBondContact OE1-NH2 2.95Å; Y1026-R1029 PolarHBondContact O-N 3.18Å; H1027-R1029 VanDerWaalsContact C-N 3.33Å
1030	P	78.1	Confident	80.9	Confident	6 Å²	6	37.5 Å²	37.5	4%	0.039	20%	0.203	C	C	.	.			trans	-59.2	152.4	169.4	-22.4	33.2	0	0	0	112.8	L1032 I1037 S1040	P1030-L1032 PolarHBondContact O-N 3.49Å; P1030-I1037 HydrophobicContact CG-CG1 4.44Å; P1030-S1040 WeakPolarHBondContact CB-OG 3.48Å
1031	A	75.3	Confident	80.4	Confident	44 Å²	44	38.3 Å²	38.3	36%	0.364	21%	0.207	S	C	.	.	S	Bend	trans	-65.7	-23.3	-177.6	0	0	0	0	0	114.5	W745 V751	W745-A1031 WeakPolarHBondContact O-CB 3.38Å; V751-A1031 HydrophobicContact CG2-CB 4.34Å
1032	L	79.1	Confident	80.3	Confident	75 Å²	75	39.4 Å²	39.4	39%	0.393	21%	0.212	S	C	.	.	S	Bend	trans	-88.3	123.2	-178	-66.2	173.5	0	0	0	110.8	P1030 F1036 I1037 I1039	P1030-L1032 PolarHBondContact O-N 3.49Å; L1032-F1036 HydrophobicContact CB-CB 4.48Å; L1032-I1037 WeakPolarHBondContact O-CB 3.31Å; L1032-I1037 WeakPolarHBondContact O-CG1 3.48Å; L1032-I1039 HydrophobicContact CD1-CB 4.29Å
1033	A	80.4	Confident	79.9	Confident	13 Å²	13	41 Å²	41	11%	0.107	22%	0.224	C	C	.	.	P	Polyproline II helix	trans	-72.8	154	173.6	0	0	0	0	0	112.1	N755 M758 F1036 I1037	N755-A1033 WeakPolarHBondContact OD1-CA 3.42Å; N755-A1033 WeakPolarHBondContact OD1-CB 3.32Å; M758-A1033 HydrophobicContact CB-CB 4.13Å; M758-A1033 HydrophobicContact CG-CB 3.81Å; A1033-F1036 PolarHBondContact O-N 3.45Å; A1033-I1037 PolarHBondContact O-N 3.29Å
1034	P	79.7	Confident	79.2	Confident	11 Å²	11	44.6 Å²	44.6	7%	0.071	24%	0.241	C	C	.	.	T	Hydrogen-bonded Turn	trans	-54.3	134.5	168.8	-24.3	34.4	0	0	0	110.8	N755 M758 W791 L795 I1037	N755-P1034 WeakPolarHBondContact OD1-CD 3.49Å; M758-P1034 VanDerWaalsContact CE-O 3.32Å; M758-P1034 WeakPolarHBondContact CE-O 3.03Å; W791-P1034 VanDerWaalsContact CZ2-O 3.32Å; W791-P1034 WeakPolarHBondContact CZ2-O 3.41Å; L795-P1034 HydrophobicContact CD2-CB 4.07Å; L795-P1034 HydrophobicContact CD2-CG 3.83Å; P1034-I1037 HydrophobicContact CB-CG2 4.46Å; P1034-I1037 HydrophobicContact CG-CG2 4.33Å
1035	P	78.6	Confident	78.8	Confident	14 Å²	14	47.9 Å²	47.9	9%	0.091	26%	0.257	C	S	.	.	T	Hydrogen-bonded Turn	cis	-93.4	-5.5	13.7	36.9	-35.3	0	0	0	114.8	F790 W791 T794 I1037	F790-P1035 HydrophobicContact CD1-CB 4.23Å; F790-P1035 HydrophobicContact CE1-CB 3.98Å; W791-P1035 HydrophobicContact CD2-CB 4.2Å; W791-P1035 HydrophobicContact CD2-CG 4.27Å; W791-P1035 HydrophobicContact CE3-CB 4.25Å; W791-P1035 HydrophobicContact CE3-CG 3.93Å; W791-P1035 HydrophobicContact CH2-CG 4.36Å; W791-P1035 HydrophobicContact CZ3-CG 3.98Å; T794-P1035 HydrophobicContact CG2-CB 4.34Å; P1035-I1037 PolarHBondContact O-N 2.92Å
1036	F	83.4	Confident	78.5	Confident	122 Å²	122	51.2 Å²	51.2	54%	0.535	27%	0.274	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.7	-7.9	-174.4	-56.4	-65.8	0	0	0	113.8	M758 L1032 A1033 I1038 I1039	M758-F1036 HydrophobicContact CE-CD2 4.4Å; M758-F1036 HydrophobicContact CE-CE2 4.08Å; L1032-F1036 HydrophobicContact CB-CB 4.48Å; A1033-F1036 PolarHBondContact O-N 3.45Å; F1036-I1038 PolarHBondContact O-N 3.47Å; F1036-I1038 VanDerWaalsContact O-N 3.11Å; F1036-I1039 PolarHBondContact O-N 2.88Å; F1036-I1039 VanDerWaalsContact O-N 3.11Å
1037	I	83.4	Confident	77.8	Confident	4 Å²	4	55.6 Å²	55.6	2%	0.021	30%	0.298	C	S	.	.	H	α-helix	trans	-55.5	-27.1	176.9	-159.4	167.7	0	0	0	113.3	E798 P1030 L1032 A1033 P1034 P1035 I1039 S1040 H1041	E798-I1037 HydrophobicContact CB-CD1 4.29Å; E798-I1037 VanDerWaalsContact CD-CD1 3.5Å; E798-I1037 HydrophobicContact CG-CD1 4Å; E798-I1037 WeakPolarHBondContact OE2-CD1 3.3Å; P1030-I1037 HydrophobicContact CG-CG1 4.44Å; L1032-I1037 WeakPolarHBondContact O-CB 3.31Å; L1032-I1037 WeakPolarHBondContact O-CG1 3.48Å; A1033-I1037 PolarHBondContact O-N 3.29Å; P1034-I1037 HydrophobicContact CB-CG2 4.46Å; P1034-I1037 HydrophobicContact CG-CG2 4.33Å; P1035-I1037 PolarHBondContact O-N 2.92Å; I1037-I1039 PolarHBondContact O-N 2.69Å; I1037-S1040 WeakPolarHBondContact O-CA 3.32Å; I1037-S1040 WeakPolarHBondContact O-CB 3.42Å; I1037-S1040 PolarHBondContact O-N 3.01Å; I1037-H1041 PolarHBondContact O-CD2 3.25Å; I1037-H1041 PolarHBondContact O-N 2.91Å
1038	I	82	Confident	77.1	Confident	39 Å²	39	56.6 Å²	56.6	20%	0.2	31%	0.31	C	S	.	.	H	α-helix	trans	-57.9	-32.4	177.7	-162	168.2	0	0	0	112.8	F790 T794 L797 F1036 S1040 H1041 I1042	F790-I1038 HydrophobicContact CE2-CD1 4.37Å; F790-I1038 HydrophobicContact CZ-CD1 4.42Å; F790-I1038 HydrophobicContact CZ-CG2 4.44Å; T794-I1038 HydrophobicContact CG2-CB 4.47Å; L797-I1038 HydrophobicContact CD1-CD1 4.42Å; F1036-I1038 PolarHBondContact O-N 3.47Å; F1036-I1038 VanDerWaalsContact O-N 3.11Å; I1038-S1040 VanDerWaalsContact C-N 3.31Å; I1038-S1040 PolarHBondContact O-N 3.31Å; I1038-H1041 PolarHBondContact O-N 3.46Å; I1038-I1042 HydrophobicContact CG1-CD1 3.99Å; I1038-I1042 HydrophobicContact CG1-CG1 4.38Å; I1038-I1042 WeakPolarHBondContact O-CB 3.33Å; I1038-I1042 VanDerWaalsContact O-CG1 3.22Å; I1038-I1042 WeakPolarHBondContact O-CG1 3.36Å; I1038-I1042 PolarHBondContact O-N 2.97Å
1039	I	83.9	Confident	76.7	Confident	104 Å²	104	61.3 Å²	61.3	53%	0.533	33%	0.327	S	S	.	.	H	α-helix	trans	-65.1	-40.3	177	-58.9	172.4	0	0	0	109.8	L1032 F1036 I1037 S1043	L1032-I1039 HydrophobicContact CD1-CB 4.29Å; F1036-I1039 PolarHBondContact O-N 2.88Å; F1036-I1039 VanDerWaalsContact O-N 3.11Å; I1037-I1039 PolarHBondContact O-N 2.69Å; I1039-S1043 WeakPolarHBondContact O-CB 3.41Å; I1039-S1043 PolarHBondContact O-N 2.94Å
1040	S	78.3	Confident	76.2	Confident	17 Å²	17	64.9 Å²	64.9	12%	0.119	35%	0.353	C	S	.	.	H	α-helix	trans	-66.1	-46.3	175.5	-173.7	0	0	0	0	111.3	P1030 I1037 I1038 I1042 S1043 Q1044	P1030-S1040 WeakPolarHBondContact CB-OG 3.48Å; I1037-S1040 WeakPolarHBondContact O-CA 3.32Å; I1037-S1040 WeakPolarHBondContact O-CB 3.42Å; I1037-S1040 PolarHBondContact O-N 3.01Å; I1038-S1040 VanDerWaalsContact C-N 3.31Å; I1038-S1040 PolarHBondContact O-N 3.31Å; S1040-I1042 PolarHBondContact O-N 2.87Å; S1040-S1043 PolarHBondContact O-N 3.29Å; S1040-S1043 VanDerWaalsContact O-N 3.16Å; S1040-S1043 PolarHBondContact O-OG 3.45Å; S1040-Q1044 WeakPolarHBondContact O-CG 3.39Å; S1040-Q1044 PolarHBondContact O-N 3.42Å
1041	H	78.9	Confident	74.9	Confident	26 Å²	26	72.3 Å²	72.3	12%	0.12	39%	0.385	C	S	.	.	H	α-helix	trans	-59.7	-45.4	177.9	-69.2	-52.3	0	0	0	111.9	E798 I1037 I1038 S1043 Q1044 L1045	E798-H1041 IonicContact OE2-CE1 3.52Å; E798-H1041 PolarHBondContact OE2-CE1 3.38Å; E798-H1041 IonicContact OE2-NE2 3.09Å; E798-H1041 PolarHBondContact OE2-NE2 2.98Å; E798-H1041 VanDerWaalsContact OE2-NE2 3.1Å; I1037-H1041 PolarHBondContact O-CD2 3.25Å; I1037-H1041 PolarHBondContact O-N 2.91Å; I1038-H1041 PolarHBondContact O-N 3.46Å; H1041-S1043 VanDerWaalsContact C-N 3.34Å; H1041-S1043 PolarHBondContact O-N 3.3Å; H1041-Q1044 PolarHBondContact O-N 3.37Å; H1041-L1045 WeakPolarHBondContact O-CB 3.36Å; H1041-L1045 PolarHBondContact O-N 2.81Å
1042	I	80.4	Confident	73.4	Confident	90 Å²	90	81.8 Å²	81.8	46%	0.462	41%	0.411	S	S	.	.	H	α-helix	trans	-61.2	-43.5	175.5	-69.5	167.4	0	0	0	110.3	I1038 S1040 Q1044 L1045 I1046	I1038-I1042 HydrophobicContact CG1-CD1 3.99Å; I1038-I1042 HydrophobicContact CG1-CG1 4.38Å; I1038-I1042 WeakPolarHBondContact O-CB 3.33Å; I1038-I1042 VanDerWaalsContact O-CG1 3.22Å; I1038-I1042 WeakPolarHBondContact O-CG1 3.36Å; I1038-I1042 PolarHBondContact O-N 2.97Å; S1040-I1042 PolarHBondContact O-N 2.87Å; I1042-Q1044 PolarHBondContact O-N 3.36Å; I1042-L1045 PolarHBondContact O-N 2.88Å; I1042-I1046 HydrophobicContact CG2-CD1 3.61Å; I1042-I1046 HydrophobicContact CG2-CG1 4.36Å; I1042-I1046 WeakPolarHBondContact O-CB 3.2Å; I1042-I1046 WeakPolarHBondContact O-CD1 3.46Å; I1042-I1046 WeakPolarHBondContact O-CG1 3.48Å; I1042-I1046 PolarHBondContact O-N 2.93Å
1043	S	75.4	Confident	71.7	Confident	48 Å²	48	81.8 Å²	81.8	34%	0.336	42%	0.416	S	S	.	.	H	α-helix	trans	-63.1	-42.2	177.8	76.7	0	0	0	0	112.6	I1039 S1040 H1041 I1046 L1047	I1039-S1043 WeakPolarHBondContact O-CB 3.41Å; I1039-S1043 PolarHBondContact O-N 2.94Å; S1040-S1043 PolarHBondContact O-N 3.29Å; S1040-S1043 VanDerWaalsContact O-N 3.16Å; S1040-S1043 PolarHBondContact O-OG 3.45Å; H1041-S1043 VanDerWaalsContact C-N 3.34Å; H1041-S1043 PolarHBondContact O-N 3.3Å; S1043-I1046 PolarHBondContact O-N 2.98Å; S1043-L1047 WeakPolarHBondContact O-CB 3.41Å; S1043-L1047 WeakPolarHBondContact O-CD1 3.49Å; S1043-L1047 PolarHBondContact O-N 3.42Å
1044	Q	71.1	Confident	69.8	Low	78 Å²	78	89.3 Å²	89.3	36%	0.364	45%	0.449	S	S	.	.	H	α-helix	trans	-67.7	-39.2	177.6	-74.6	178.2	-25.5	0	0	112	S1040 H1041 I1042 L1047 C1048	S1040-Q1044 WeakPolarHBondContact O-CG 3.39Å; S1040-Q1044 PolarHBondContact O-N 3.42Å; H1041-Q1044 PolarHBondContact O-N 3.37Å; I1042-Q1044 PolarHBondContact O-N 3.36Å; Q1044-L1047 PolarHBondContact O-N 2.96Å; Q1044-C1048 VanDerWaalsContact O-CB 3.28Å; Q1044-C1048 WeakPolarHBondContact O-CB 3.32Å; Q1044-C1048 PolarHBondContact O-N 2.95Å
1045	L	72.7	Confident	68.1	Low	115 Å²	115	92 Å²	92	60%	0.602	47%	0.467	S	S	*	.	H	α-helix	trans	-61.4	-44.5	172.9	-113.8	160.4	0	0	0	111.4	H1041 I1042 C1048 M1049	H1041-L1045 WeakPolarHBondContact O-CB 3.36Å; H1041-L1045 PolarHBondContact O-N 2.81Å; I1042-L1045 PolarHBondContact O-N 2.88Å; L1045-C1048 PolarHBondContact O-N 3.39Å; L1045-M1049 WeakPolarHBondContact O-CG 3.38Å; L1045-M1049 PolarHBondContact O-N 3.42Å; L1045-M1049 VanDerWaalsContact O-N 3.12Å
1046	I	73.6	Confident	66.4	Low	102 Å²	102	99.4 Å²	99.4	52%	0.523	50%	0.498	S	S	.	.	H	α-helix	trans	-65.3	-43.1	177.3	-67.7	165.7	0	0	0	110.8	I1042 S1043 M1049 V1050	I1042-I1046 HydrophobicContact CG2-CD1 3.61Å; I1042-I1046 HydrophobicContact CG2-CG1 4.36Å; I1042-I1046 WeakPolarHBondContact O-CB 3.2Å; I1042-I1046 WeakPolarHBondContact O-CD1 3.46Å; I1042-I1046 WeakPolarHBondContact O-CG1 3.48Å; I1042-I1046 PolarHBondContact O-N 2.93Å; S1043-I1046 PolarHBondContact O-N 2.98Å; I1046-M1049 PolarHBondContact O-N 3.37Å; I1046-V1050 WeakPolarHBondContact O-CG2 3.3Å; I1046-V1050 PolarHBondContact O-N 3.4Å
1047	L	67.5	Low	64.6	Low	106 Å²	106	97.8 Å²	97.8	56%	0.555	49%	0.493	S	S	*	.	H	α-helix	trans	-62.6	-43.9	176.5	-95.2	129.8	0	0	0	112	S1043 Q1044 M1049 V1050 K1051	S1043-L1047 WeakPolarHBondContact O-CB 3.41Å; S1043-L1047 WeakPolarHBondContact O-CD1 3.49Å; S1043-L1047 PolarHBondContact O-N 3.42Å; Q1044-L1047 PolarHBondContact O-N 2.96Å; L1047-M1049 PolarHBondContact O-N 3.44Å; L1047-V1050 PolarHBondContact O-N 3.41Å; L1047-V1050 VanDerWaalsContact O-N 3.08Å; L1047-K1051 PolarHBondContact O-N 3.27Å
1048	C	64.9	Low	62.8	Low	72 Å²	72	103.1 Å²	103.1	49%	0.486	52%	0.517	S	S	.	.	H	α-helix	trans	-60.2	-33.7	175.7	-171.6	0	0	0	0	112.6	Q1044 L1045	Q1044-C1048 VanDerWaalsContact O-CB 3.28Å; Q1044-C1048 WeakPolarHBondContact O-CB 3.32Å; Q1044-C1048 PolarHBondContact O-N 2.95Å; L1045-C1048 PolarHBondContact O-N 3.39Å
1049	M	66.8	Low	61.3	Low	161 Å²	161	105.7 Å²	105.7	79%	0.793	53%	0.528	S	S	*	.	H	α-helix	trans	-77.7	-19.3	177.1	-66.4	-72.1	-79.4	0	0	113.5	L1045 I1046 L1047	L1045-M1049 WeakPolarHBondContact O-CG 3.38Å; L1045-M1049 PolarHBondContact O-N 3.42Å; L1045-M1049 VanDerWaalsContact O-N 3.12Å; I1046-M1049 PolarHBondContact O-N 3.37Å; L1047-M1049 PolarHBondContact O-N 3.44Å
1050	V	67.3	Low	60	Low	116 Å²	116	101.6 Å²	101.6	70%	0.703	51%	0.507	S	S	*	.	H	α-helix	trans	-112.7	-28.6	-171.9	176.6	0	0	0	0	113.6	I1046 L1047	I1046-V1050 WeakPolarHBondContact O-CG2 3.3Å; I1046-V1050 PolarHBondContact O-N 3.4Å; L1047-V1050 PolarHBondContact O-N 3.41Å; L1047-V1050 VanDerWaalsContact O-N 3.08Å
1051	K	50.4	Low	59.5	Low	161 Å²	161	102.5 Å²	102.5	70%	0.7	51%	0.51	S	S	*	.	S	Bend	trans	-144.1	158	175.4	-81.7	-171.8	174.4	-174.6	0	110.6	L1047	L1047-K1051 PolarHBondContact O-N 3.27Å
1052	R	44.4	Very low	59.1	Low	243 Å²	243	104 Å²	104	92%	0.917	51%	0.514	S	S	*	.	P	Polyproline II helix	trans	-58.1	125.8	164.3	-91.2	-175.9	179.5	164.1	-1	108.1	E1054	R1052-E1054 PolarHBondContact O-N 3.01Å
1053	P	42.7	Very low	58.5	Low	76 Å²	76	104.7 Å²	104.7	49%	0.494	52%	0.516	S	S	.	.	P	Polyproline II helix	trans	-70.1	121.1	177.4	27.3	-30.9	0	0	0	109.3
1054	E	41.2	Very low	58.3	Low	171 Å²	171	103.6 Å²	103.6	80%	0.799	51%	0.506	S	S	*	.	P	Polyproline II helix	trans	-73.8	120.6	156	-78.3	166.8	175.7	0	0	106.5	R1052	R1052-E1054 PolarHBondContact O-N 3.01Å
1055	S	43.7	Very low	58.5	Low	66 Å²	66	103.9 Å²	103.9	46%	0.462	52%	0.515	S	S	.	.	P	Polyproline II helix	trans	-81.2	136.1	-176.2	73.6	0	0	0	0	109.4	Q1057 E1058	S1055-Q1057 PolarHBondContact O-N 3.14Å; S1055-E1058 WeakPolarHBondContact O-CG 3.49Å; S1055-E1058 PolarHBondContact O-N 2.63Å
1056	K	43.4	Very low	58.6	Low	171 Å²	171	102.9 Å²	102.9	74%	0.743	51%	0.513	S	S	*	.	G	3₁₀ helix	trans	-64.6	8.3	174.4	-66.7	-178.3	177.4	-179.2	0	114.2	E1058	K1056-E1058 PolarHBondContact O-N 2.92Å
1057	Q	44.6	Very low	58.7	Low	88 Å²	88	100.1 Å²	100.1	41%	0.411	51%	0.51	S	S	.	.	G	3₁₀ helix	trans	-74.9	-11.8	176	-155.9	157.9	-15.4	0	0	111.7	S1055 H1059 L1060	S1055-Q1057 PolarHBondContact O-N 3.14Å; Q1057-H1059 PolarHBondContact O-N 3.09Å; Q1057-L1060 PolarHBondContact O-N 3.25Å
1058	E	46.6	Very low	59.2	Low	115 Å²	115	96 Å²	96	54%	0.537	49%	0.488	S	S	.	.	G	3₁₀ helix	trans	-62.1	-15.1	177.1	-70.6	175.6	170.7	0	0	115.3	S1055 K1056	S1055-E1058 WeakPolarHBondContact O-CG 3.49Å; S1055-E1058 PolarHBondContact O-N 2.63Å; K1056-E1058 PolarHBondContact O-N 2.92Å
1059	H	49.3	Very low	60	Low	94 Å²	94	92.9 Å²	92.9	44%	0.435	47%	0.467	S	S	.	.	G	3₁₀ helix	trans	-83.3	-22.8	175.8	-78.7	31.6	0	0	0	113.8	Q1057	Q1057-H1059 PolarHBondContact O-N 3.09Å
1060	L	57.3	Low	60.9	Low	18 Å²	18	90.8 Å²	90.8	9%	0.094	46%	0.455	C	S	.	.	T	Hydrogen-bonded Turn	trans	-94.2	-11.8	176.8	-137.5	108.4	0	0	0	112.4	V615 V1024 Q1057	V615-L1060 WeakPolarHBondContact CG1-O 3.25Å; V1024-L1060 HydrophobicContact CG2-CD1 4.42Å; V1024-L1060 HydrophobicContact CG2-CD2 4.31Å; Q1057-L1060 PolarHBondContact O-N 3.25Å
1061	E	67.8	Low	61.8	Low	35 Å²	35	92 Å²	92	16%	0.164	45%	0.447	C	S	.	.	S	Bend	trans	-132.4	106.9	177.5	-53.2	-168.1	164.5	0	0	109.6	R617 T625 N628	R617-E1061 HydrophobicContact CG-CB 4.43Å; R617-E1061 IonicContact CZ-OE2 3.57Å; R617-E1061 IonicContact NE-OE2 2.68Å; R617-E1061 PolarHBondContact NE-OE2 2.96Å; R617-E1061 IonicContact NH2-OE2 2.87Å; R617-E1061 PolarHBondContact NH2-OE2 3.41Å; T625-E1061 HydrophobicContact CG2-CB 3.96Å; T625-E1061 HydrophobicContact CG2-CG 3.7Å; N628-E1061 PolarHBondContact ND2-OE1 3.26Å
1062	R	69.8	Low	63.5	Low	58 Å²	58	84.7 Å²	84.7	22%	0.219	42%	0.415	C	S	.	.	B	Isolated β-bridge	trans	-106.4	128.3	-178.2	-163.9	170.5	-176.5	-169.4	-4.1	111.1	V615 R616 R617 L708 L709 T711	V615-R1062 HydrophobicContact CG1-CB 4.08Å; V615-R1062 PolarHBondContact O-N 2.85Å; R616-R1062 WeakPolarHBondContact CA-O 3.37Å; R617-R1062 PolarHBondContact N-O 3.11Å; R617-R1062 VanDerWaalsContact N-O 3.15Å; L708-R1062 PolarHBondContact O-NH2 3.31Å; L709-R1062 PolarHBondContact O-NH1 3.23Å; T711-R1062 PolarHBondContact O-NH2 2.98Å
1063	E	67.7	Low	65.6	Low	105 Å²	105	74.5 Å²	74.5	49%	0.491	38%	0.379	S	S	.	.			trans	-85.2	112.5	165.1	-70.4	-164.3	168.1	0	0	108.5	R617 K623	R617-E1063 HydrophobicContact CG-CG 4.41Å; R617-E1063 IonicContact NH1-OE1 2.83Å; R617-E1063 PolarHBondContact NH1-OE1 3.38Å; K623-E1063 IonicContact NZ-OE1 3.65Å; K623-E1063 PolarHBondContact NZ-OE1 3.44Å
1064	L	70.9	Confident	67.9	Low	24 Å²	24	75.1 Å²	75.1	13%	0.126	38%	0.381	C	S	.	.			trans	-82	147.4	176.5	-69.6	165.4	0	0	0	110	R616 L709 V1066 L1068 D1069 L1072	R616-L1064 HydrophobicContact CB-CD1 3.66Å; R616-L1064 HydrophobicContact CB-CG 4.41Å; L709-L1064 HydrophobicContact CD2-CD2 4.15Å; L1064-V1066 PolarHBondContact O-N 3.31Å; L1064-L1068 HydrophobicContact CD2-CD2 3.97Å; L1064-D1069 HydrophobicContact CB-CB 4.16Å; L1064-L1072 HydrophobicContact CD1-CD2 3.84Å
1065	P	76.4	Confident	70.2	Confident	85 Å²	85	68.1 Å²	68.1	55%	0.552	35%	0.347	S	S	*	.			trans	-55.3	139	170.8	-23.1	32.2	0	0	0	111.1	G1067 L1068 D1069	P1065-G1067 PolarHBondContact O-N 2.71Å; P1065-G1067 VanDerWaalsContact O-N 3.07Å; P1065-L1068 HydrophobicContact CB-CB 4.47Å; P1065-L1068 WeakPolarHBondContact O-CA 3Å; P1065-L1068 WeakPolarHBondContact O-CB 3.5Å; P1065-L1068 PolarHBondContact O-N 2.84Å; P1065-D1069 PolarHBondContact O-N 3.46Å
1066	V	75.5	Confident	72.5	Confident	94 Å²	94	65.1 Å²	65.1	57%	0.57	33%	0.326	S	S	*	.	H	α-helix	trans	-52.1	-39.5	-172.1	-177.1	0	0	0	0	113.1	L1064 Q1070	L1064-V1066 PolarHBondContact O-N 3.31Å; V1066-Q1070 WeakPolarHBondContact O-CG 3.34Å; V1066-Q1070 PolarHBondContact O-N 2.94Å; V1066-Q1070 VanDerWaalsContact O-N 3.11Å
1067	G	75.4	Confident	74.7	Confident	44 Å²	44	59.1 Å²	59.1	45%	0.454	30%	0.304	S	S	.	.	H	α-helix	trans	-69.2	-33.4	178.1	0	0	0	0	0	114.1	P1065 R1071	P1065-G1067 PolarHBondContact O-N 2.71Å; P1065-G1067 VanDerWaalsContact O-N 3.07Å; G1067-R1071 WeakPolarHBondContact O-CG 3.41Å; G1067-R1071 PolarHBondContact O-N 3.41Å
1068	L	77.6	Confident	77	Confident	20 Å²	20	58.4 Å²	58.4	11%	0.105	31%	0.305	C	S	.	.	H	α-helix	trans	-77	-38.8	176.9	-173.5	63.2	0	0	0	111	E705 L709 L1064 P1065 R1071 L1072	E705-L1068 HydrophobicContact CG-CD1 3.7Å; L709-L1068 HydrophobicContact CD2-CD2 3.83Å; L709-L1068 HydrophobicContact CG-CD2 4.35Å; L1064-L1068 HydrophobicContact CD2-CD2 3.97Å; P1065-L1068 HydrophobicContact CB-CB 4.47Å; P1065-L1068 WeakPolarHBondContact O-CA 3Å; P1065-L1068 WeakPolarHBondContact O-CB 3.5Å; P1065-L1068 PolarHBondContact O-N 2.84Å; L1068-R1071 PolarHBondContact O-N 2.76Å; L1068-L1072 WeakPolarHBondContact O-CB 3.44Å; L1068-L1072 PolarHBondContact O-N 3.19Å
1069	D	81.8	Confident	79.1	Confident	6 Å²	6	53.4 Å²	53.4	3%	0.032	28%	0.282	C	S	.	.	H	α-helix	trans	-62.5	-43.8	176.6	-170.4	48.2	0	0	0	111.6	R616 Q619 L1064 P1065 R1071 L1072 I1073	R616-D1069 IonicContact NH1-OD1 3.59Å; R616-D1069 PolarHBondContact NH1-OD1 2.73Å; Q619-D1069 PolarHBondContact NE2-OD2 2.79Å; L1064-D1069 HydrophobicContact CB-CB 4.16Å; P1065-D1069 PolarHBondContact O-N 3.46Å; D1069-R1071 PolarHBondContact O-N 3.16Å; D1069-L1072 PolarHBondContact O-N 3.26Å; D1069-I1073 WeakPolarHBondContact O-CG1 3.34Å; D1069-I1073 PolarHBondContact O-N 3.47Å
1070	Q	85	Confident	81	Confident	116 Å²	116	49.1 Å²	49.1	54%	0.542	26%	0.262	S	S	.	.	H	α-helix	trans	-61.5	-41.6	174.3	-74.7	178.7	-6	0	0	113	V1066 L1072 I1073 T1074	V1066-Q1070 WeakPolarHBondContact O-CG 3.34Å; V1066-Q1070 PolarHBondContact O-N 2.94Å; V1066-Q1070 VanDerWaalsContact O-N 3.11Å; Q1070-L1072 VanDerWaalsContact C-N 3.32Å; Q1070-L1072 PolarHBondContact O-N 2.94Å; Q1070-I1073 PolarHBondContact O-N 2.78Å; Q1070-T1074 WeakPolarHBondContact O-CB 3.43Å; Q1070-T1074 PolarHBondContact O-N 3.49Å; Q1070-T1074 PolarHBondContact O-OG1 3.43Å
1071	R	86	Confident	82.6	Confident	143 Å²	143	52.6 Å²	52.6	54%	0.54	28%	0.278	S	S	.	.	H	α-helix	trans	-62.3	-40.6	175.3	-74.1	175.6	-179.8	-163.4	-2.5	111.3	D700 G1067 L1068 D1069 T1074 W1075	D700-R1071 IonicContact OD1-NH2 3.47Å; G1067-R1071 WeakPolarHBondContact O-CG 3.41Å; G1067-R1071 PolarHBondContact O-N 3.41Å; L1068-R1071 PolarHBondContact O-N 2.76Å; D1069-R1071 PolarHBondContact O-N 3.16Å; R1071-T1074 PolarHBondContact O-N 3.35Å; R1071-W1075 WeakPolarHBondContact O-CB 3.42Å; R1071-W1075 PolarHBondContact O-N 3.21Å
1072	L	86.4	Confident	83.7	Confident	7 Å²	7	55 Å²	55	4%	0.037	29%	0.292	C	S	.	.	H	α-helix	trans	-67.6	-41.4	178.5	-169.3	65.8	0	0	0	112	R609 A612 L613 L1064 L1068 D1069 Q1070 T1074 W1075 E1076	R609-L1072 HydrophobicContact CB-CD1 3.94Å; R609-L1072 HydrophobicContact CG-CD1 4.3Å; A612-L1072 HydrophobicContact CB-CD2 4.22Å; L613-L1072 HydrophobicContact CD1-CD2 4.45Å; L613-L1072 HydrophobicContact CD1-CG 4.37Å; L1064-L1072 HydrophobicContact CD1-CD2 3.84Å; L1068-L1072 WeakPolarHBondContact O-CB 3.44Å; L1068-L1072 PolarHBondContact O-N 3.19Å; D1069-L1072 PolarHBondContact O-N 3.26Å; Q1070-L1072 VanDerWaalsContact C-N 3.32Å; Q1070-L1072 PolarHBondContact O-N 2.94Å; L1072-T1074 VanDerWaalsContact C-N 3.35Å; L1072-W1075 HydrophobicContact CD1-CE3 3.76Å; L1072-W1075 HydrophobicContact CD1-CZ3 4.11Å; L1072-W1075 PolarHBondContact O-N 3.21Å; L1072-E1076 WeakPolarHBondContact O-CB 3.39Å; L1072-E1076 PolarHBondContact O-N 2.87Å
1073	I	88.3	Confident	84.6	Confident	29 Å²	29	53.4 Å²	53.4	15%	0.149	29%	0.286	C	S	.	.	H	α-helix	trans	-63.6	-41	174.3	-66.6	165.3	0	0	0	111	P556 E557 D1069 Q1070 E1076 T1077	P556-I1073 HydrophobicContact CB-CG2 4.39Å; E557-I1073 HydrophobicContact CG-CG1 4.47Å; D1069-I1073 WeakPolarHBondContact O-CG1 3.34Å; D1069-I1073 PolarHBondContact O-N 3.47Å; Q1070-I1073 PolarHBondContact O-N 2.78Å; I1073-E1076 PolarHBondContact O-N 2.91Å; I1073-T1077 WeakPolarHBondContact O-CB 3.4Å; I1073-T1077 PolarHBondContact O-N 3.12Å; I1073-T1077 PolarHBondContact O-OG1 2.86Å
1074	T	90.3	Very high	85.6	Confident	88 Å²	88	50.6 Å²	50.6	54%	0.54	27%	0.274	S	S	.	.	H	α-helix	trans	-64.8	-43.3	176.7	-52.9	0	0	0	0	110.4	Q1070 R1071 L1072 T1077 V1078	Q1070-T1074 WeakPolarHBondContact O-CB 3.43Å; Q1070-T1074 PolarHBondContact O-N 3.49Å; Q1070-T1074 PolarHBondContact O-OG1 3.43Å; R1071-T1074 PolarHBondContact O-N 3.35Å; L1072-T1074 VanDerWaalsContact C-N 3.35Å; T1074-T1077 PolarHBondContact O-N 3.44Å; T1074-V1078 WeakPolarHBondContact O-CG2 3.27Å; T1074-V1078 PolarHBondContact O-N 2.76Å
1075	W	90.6	Very high	86.5	Confident	25 Å²	25	52 Å²	52	10%	0.095	29%	0.29	C	S	.	.	H	α-helix	trans	-61.5	-46.2	175.5	172.5	77.6	0	0	0	112.3	C602 N605 R609 R1071 L1072 T1077 V1078 Q1079	C602-W1075 HydrophobicContact CB-CH2 3.61Å; C602-W1075 HydrophobicContact CB-CZ2 4.35Å; C602-W1075 HydrophobicContact CB-CZ3 4.08Å; C602-W1075 WeakPolarHBondContact O-CH2 3.25Å; N605-W1075 HydrophobicContact CB-CZ2 4.45Å; N605-W1075 PolarHBondContact ND2-NE1 3.2Å; R609-W1075 HydrophobicContact CB-CD2 4.4Å; R609-W1075 HydrophobicContact CB-CE3 4.14Å; R609-W1075 HydrophobicContact CB-CH2 3.68Å; R609-W1075 HydrophobicContact CB-CZ2 4Å; R609-W1075 HydrophobicContact CB-CZ3 3.77Å; R1071-W1075 WeakPolarHBondContact O-CB 3.42Å; R1071-W1075 PolarHBondContact O-N 3.21Å; L1072-W1075 HydrophobicContact CD1-CE3 3.76Å; L1072-W1075 HydrophobicContact CD1-CZ3 4.11Å; L1072-W1075 PolarHBondContact O-N 3.21Å; W1075-T1077 VanDerWaalsContact C-N 3.3Å; W1075-T1077 PolarHBondContact O-N 3.49Å; W1075-V1078 PolarHBondContact O-N 3Å; W1075-Q1079 HydrophobicContact CD2-CG 4.3Å; W1075-Q1079 HydrophobicContact CZ2-CG 4.11Å; W1075-Q1079 WeakPolarHBondContact O-CG 3.2Å; W1075-Q1079 PolarHBondContact O-N 3.11Å; W1075-Q1079 PolarHBondContact O-NE2 2.86Å
1076	E	91.3	Very high	87.1	Confident	2 Å²	2	52.6 Å²	52.6	1%	0.009	28%	0.283	C	S	.	.	H	α-helix	trans	-57.1	-44.4	174.3	-176.9	-171.1	176.8	0	0	110.9	A558 V559 V598 L613 R616 L1072 I1073 V1078 Q1079 K1080	A558-E1076 PolarHBondContact N-OE1 3.47Å; V559-E1076 PolarHBondContact N-OE1 3.36Å; V598-E1076 HydrophobicContact CG1-CG 4.4Å; L613-E1076 HydrophobicContact CD1-CB 4.39Å; L613-E1076 HydrophobicContact CD1-CG 4.34Å; L613-E1076 WeakPolarHBondContact CD1-OE2 3.39Å; L613-E1076 HydrophobicContact CD2-CG 4.38Å; R616-E1076 IonicContact NH2-OE2 2.64Å; R616-E1076 PolarHBondContact NH2-OE2 3.23Å; L1072-E1076 WeakPolarHBondContact O-CB 3.39Å; L1072-E1076 PolarHBondContact O-N 2.87Å; I1073-E1076 PolarHBondContact O-N 2.91Å; E1076-V1078 PolarHBondContact O-N 2.68Å; E1076-Q1079 PolarHBondContact O-N 3.31Å; E1076-Q1079 VanDerWaalsContact O-N 3.17Å; E1076-K1080 PolarHBondContact O-N 3.46Å
1077	T	91.1	Very high	87.6	Confident	45 Å²	45	50 Å²	50	28%	0.276	27%	0.268	S	S	.	.	H	α-helix	trans	-62.6	-42.7	178.8	-55.5	0	0	0	0	111.3	I1073 T1074 W1075 Q1079 K1080 E1081	I1073-T1077 WeakPolarHBondContact O-CB 3.4Å; I1073-T1077 PolarHBondContact O-N 3.12Å; I1073-T1077 PolarHBondContact O-OG1 2.86Å; T1074-T1077 PolarHBondContact O-N 3.44Å; W1075-T1077 VanDerWaalsContact C-N 3.3Å; W1075-T1077 PolarHBondContact O-N 3.49Å; T1077-Q1079 VanDerWaalsContact C-N 3.32Å; T1077-Q1079 PolarHBondContact O-N 2.86Å; T1077-K1080 WeakPolarHBondContact O-CB 3.48Å; T1077-K1080 PolarHBondContact O-N 3.49Å; T1077-E1081 WeakPolarHBondContact O-CG 3.28Å; T1077-E1081 PolarHBondContact O-N 3.46Å
1078	V	91.5	Very high	88.1	Confident	74 Å²	74	53.3 Å²	53.3	45%	0.448	27%	0.271	S	S	.	.	H	α-helix	trans	-62.7	-39.4	174.8	173.3	0	0	0	0	111.5	T1074 W1075 E1076 E1081 N1082	T1074-V1078 WeakPolarHBondContact O-CG2 3.27Å; T1074-V1078 PolarHBondContact O-N 2.76Å; W1075-V1078 PolarHBondContact O-N 3Å; E1076-V1078 PolarHBondContact O-N 2.68Å; V1078-E1081 PolarHBondContact O-N 3.19Å; V1078-N1082 PolarHBondContact O-N 3.37Å; V1078-N1082 PolarHBondContact O-ND2 2.82Å
1079	Q	90.6	Very high	88.6	Confident	10 Å²	10	60.5 Å²	60.5	5%	0.047	30%	0.297	C	S	.	.	H	α-helix	trans	-66.4	-39.4	176.7	-61.6	-33.8	-74	0	0	111.9	N605 W1075 E1076 T1077 N1082 Y1083	N605-Q1079 PolarHBondContact ND2-NE2 3.06Å; N605-Q1079 PolarHBondContact ND2-OE1 2.96Å; W1075-Q1079 HydrophobicContact CD2-CG 4.3Å; W1075-Q1079 HydrophobicContact CZ2-CG 4.11Å; W1075-Q1079 WeakPolarHBondContact O-CG 3.2Å; W1075-Q1079 PolarHBondContact O-N 3.11Å; W1075-Q1079 PolarHBondContact O-NE2 2.86Å; E1076-Q1079 PolarHBondContact O-N 3.31Å; E1076-Q1079 VanDerWaalsContact O-N 3.17Å; T1077-Q1079 VanDerWaalsContact C-N 3.32Å; T1077-Q1079 PolarHBondContact O-N 2.86Å; Q1079-N1082 PolarHBondContact O-N 3.45Å; Q1079-Y1083 WeakPolarHBondContact O-CB 3.46Å; Q1079-Y1083 PolarHBondContact O-N 2.75Å
1080	K	90.6	Very high	88.9	Confident	4 Å²	4	65.8 Å²	65.8	2%	0.017	32%	0.321	C	S	.	.	H	α-helix	trans	-58.3	-47.1	172.9	176.9	-165.4	68.1	175.8	0	111.5	A553 G555 A558 V598 E1076 T1077 N1082 Y1083 L1084	A553-K1080 WeakPolarHBondContact O-CE 3.4Å; A553-K1080 PolarHBondContact O-NZ 3.4Å; G555-K1080 PolarHBondContact O-NZ 2.85Å; A558-K1080 HydrophobicContact CB-CD 3.72Å; A558-K1080 HydrophobicContact CB-CG 4.3Å; V598-K1080 HydrophobicContact CG1-CB 4.44Å; V598-K1080 HydrophobicContact CG2-CB 4.37Å; V598-K1080 HydrophobicContact CG2-CG 4.3Å; E1076-K1080 PolarHBondContact O-N 3.46Å; T1077-K1080 WeakPolarHBondContact O-CB 3.48Å; T1077-K1080 PolarHBondContact O-N 3.49Å; K1080-N1082 PolarHBondContact O-N 3.22Å; K1080-Y1083 WeakPolarHBondContact O-CB 3.43Å; K1080-Y1083 PolarHBondContact O-N 3.45Å; K1080-L1084 HydrophobicContact CG-CD1 4.16Å; K1080-L1084 HydrophobicContact CG-CG 4.45Å; K1080-L1084 WeakPolarHBondContact O-CG 3.23Å; K1080-L1084 PolarHBondContact O-N 3.15Å
1081	E	90.2	Very high	88.9	Confident	91 Å²	91	66 Å²	66	43%	0.425	32%	0.322	S	S	.	.	H	α-helix	trans	-62.4	-43	177.7	-66.9	-53.4	133	0	0	112.1	T1077 V1078 Y1083 L1084 A1085	T1077-E1081 WeakPolarHBondContact O-CG 3.28Å; T1077-E1081 PolarHBondContact O-N 3.46Å; V1078-E1081 PolarHBondContact O-N 3.19Å; E1081-Y1083 VanDerWaalsContact C-N 3.27Å; E1081-Y1083 PolarHBondContact O-N 3.03Å; E1081-L1084 PolarHBondContact O-N 3.06Å; E1081-A1085 WeakPolarHBondContact O-CB 3.38Å; E1081-A1085 PolarHBondContact O-N 3.29Å
1082	N	90.4	Very high	88.8	Confident	85 Å²	85	66.1 Å²	66.1	46%	0.455	32%	0.323	S	S	.	.	H	α-helix	trans	-58.7	-42	174.8	-73.5	-20.8	0	0	0	111.6	V1078 Q1079 K1080 K1086	V1078-N1082 PolarHBondContact O-N 3.37Å; V1078-N1082 PolarHBondContact O-ND2 2.82Å; Q1079-N1082 PolarHBondContact O-N 3.45Å; K1080-N1082 PolarHBondContact O-N 3.22Å; N1082-K1086 WeakPolarHBondContact O-CB 3.47Å; N1082-K1086 PolarHBondContact O-N 3.02Å; N1082-K1086 VanDerWaalsContact O-N 3.08Å
1083	Y	88.1	Confident	88.9	Confident	24 Å²	24	71 Å²	71	9%	0.094	35%	0.346	C	S	.	.	H	α-helix	trans	-64.5	-49.3	174.8	166.2	-96.9	0	0	0	111.9	D597 Q1079 K1080 E1081 A1085 K1086 V1087	D597-Y1083 HydrophobicContact CB-CD1 4.05Å; D597-Y1083 HydrophobicContact CB-CD2 4Å; D597-Y1083 HydrophobicContact CB-CE1 3.47Å; D597-Y1083 VanDerWaalsContact CB-CE1 3.47Å; D597-Y1083 HydrophobicContact CB-CE2 3.39Å; D597-Y1083 HydrophobicContact CB-CG 4.29Å; D597-Y1083 WeakPolarHBondContact CB-OH 3.29Å; D597-Y1083 VanDerWaalsContact CG-CE2 3.48Å; D597-Y1083 WeakPolarHBondContact O-CB 3.41Å; D597-Y1083 WeakPolarHBondContact O-CD2 3.34Å; D597-Y1083 WeakPolarHBondContact OD1-CE2 3.48Å; D597-Y1083 PolarHBondContact OD1-OH 3.42Å; D597-Y1083 PolarHBondContact OD2-OH 3.45Å; Q1079-Y1083 WeakPolarHBondContact O-CB 3.46Å; Q1079-Y1083 PolarHBondContact O-N 2.75Å; K1080-Y1083 WeakPolarHBondContact O-CB 3.43Å; K1080-Y1083 PolarHBondContact O-N 3.45Å; E1081-Y1083 VanDerWaalsContact C-N 3.27Å; E1081-Y1083 PolarHBondContact O-N 3.03Å; Y1083-A1085 VanDerWaalsContact C-N 3.29Å; Y1083-A1085 PolarHBondContact O-N 3.42Å; Y1083-K1086 CarbonylContact O-C 3.5Å; Y1083-K1086 WeakPolarHBondContact O-CA 3.32Å; Y1083-K1086 VanDerWaalsContact O-CB 3.29Å; Y1083-K1086 WeakPolarHBondContact O-CB 3.47Å; Y1083-K1086 PolarHBondContact O-N 2.88Å; Y1083-V1087 HydrophobicContact CD1-CG2 4.17Å; Y1083-V1087 HydrophobicContact CD2-CG2 4.08Å; Y1083-V1087 HydrophobicContact CE1-CG2 3.45Å; Y1083-V1087 VanDerWaalsContact CE1-CG2 3.45Å; Y1083-V1087 HydrophobicContact CE2-CG2 3.37Å; Y1083-V1087 HydrophobicContact CG-CG2 4.42Å; Y1083-V1087 WeakPolarHBondContact O-CG2 3.23Å; Y1083-V1087 PolarHBondContact O-N 3.36Å; Y1083-V1087 WeakPolarHBondContact OH-CG2 3.32Å
1084	L	89.6	Confident	89.1	Confident	46 Å²	46	72.1 Å²	72.1	24%	0.241	36%	0.356	C	S	.	.	H	α-helix	trans	-58.5	-42.2	179.7	-72.3	174.9	0	0	0	111.4	W552 A553 K1080 E1081 K1086 V1087 E1088	W552-L1084 HydrophobicContact CZ3-CD2 4.2Å; A553-L1084 HydrophobicContact CB-CD1 3.86Å; K1080-L1084 HydrophobicContact CG-CD1 4.16Å; K1080-L1084 HydrophobicContact CG-CG 4.45Å; K1080-L1084 WeakPolarHBondContact O-CG 3.23Å; K1080-L1084 PolarHBondContact O-N 3.15Å; E1081-L1084 PolarHBondContact O-N 3.06Å; L1084-K1086 VanDerWaalsContact C-N 3.31Å; L1084-K1086 PolarHBondContact O-N 3.44Å; L1084-V1087 PolarHBondContact O-N 2.83Å; L1084-E1088 WeakPolarHBondContact O-CB 3.16Å; L1084-E1088 PolarHBondContact O-N 2.84Å
1085	A	90.1	Very high	89.1	Confident	55 Å²	55	72.8 Å²	72.8	46%	0.455	36%	0.364	S	S	.	.	H	α-helix	trans	-62.7	-36.5	174.3	0	0	0	0	0	112.6	E1081 Y1083 R1089	E1081-A1085 WeakPolarHBondContact O-CB 3.38Å; E1081-A1085 PolarHBondContact O-N 3.29Å; Y1083-A1085 VanDerWaalsContact C-N 3.29Å; Y1083-A1085 PolarHBondContact O-N 3.42Å; A1085-R1089 WeakPolarHBondContact O-CB 3.45Å; A1085-R1089 PolarHBondContact O-N 2.93Å
1086	K	88.9	Confident	89.1	Confident	96 Å²	96	77.2 Å²	77.2	42%	0.417	39%	0.386	S	S	.	.	H	α-helix	trans	-68.3	-41.9	175.6	-174.1	-174.6	-173.4	-178.9	0	111.6	E601 N1082 Y1083 L1084 R1089 Q1090	E601-K1086 IonicContact OE2-NZ 2.79Å; E601-K1086 PolarHBondContact OE2-NZ 3.33Å; N1082-K1086 WeakPolarHBondContact O-CB 3.47Å; N1082-K1086 PolarHBondContact O-N 3.02Å; N1082-K1086 VanDerWaalsContact O-N 3.08Å; Y1083-K1086 CarbonylContact O-C 3.5Å; Y1083-K1086 WeakPolarHBondContact O-CA 3.32Å; Y1083-K1086 VanDerWaalsContact O-CB 3.29Å; Y1083-K1086 WeakPolarHBondContact O-CB 3.47Å; Y1083-K1086 PolarHBondContact O-N 2.88Å; L1084-K1086 VanDerWaalsContact C-N 3.31Å; L1084-K1086 PolarHBondContact O-N 3.44Å; K1086-R1089 PolarHBondContact O-N 3.31Å; K1086-Q1090 WeakPolarHBondContact O-CG 3.45Å; K1086-Q1090 PolarHBondContact O-N 3.35Å
1087	V	85.9	Confident	88.9	Confident	40 Å²	40	79.6 Å²	79.6	24%	0.242	40%	0.397	C	S	.	.	H	α-helix	trans	-63.4	-48.5	175	175.5	0	0	0	0	111	Y1083 L1084 R1089 Q1090 Q1091	Y1083-V1087 HydrophobicContact CD1-CG2 4.17Å; Y1083-V1087 HydrophobicContact CD2-CG2 4.08Å; Y1083-V1087 HydrophobicContact CE1-CG2 3.45Å; Y1083-V1087 VanDerWaalsContact CE1-CG2 3.45Å; Y1083-V1087 HydrophobicContact CE2-CG2 3.37Å; Y1083-V1087 HydrophobicContact CG-CG2 4.42Å; Y1083-V1087 WeakPolarHBondContact O-CG2 3.23Å; Y1083-V1087 PolarHBondContact O-N 3.36Å; Y1083-V1087 WeakPolarHBondContact OH-CG2 3.32Å; L1084-V1087 PolarHBondContact O-N 2.83Å; V1087-R1089 VanDerWaalsContact C-N 3.27Å; V1087-R1089 PolarHBondContact O-N 3.16Å; V1087-Q1090 PolarHBondContact O-N 3.45Å; V1087-Q1090 VanDerWaalsContact O-N 3.1Å; V1087-Q1091 WeakPolarHBondContact O-CB 3.42Å; V1087-Q1091 PolarHBondContact O-N 2.91Å
1088	E	86.6	Confident	88.9	Confident	113 Å²	113	82.6 Å²	82.6	53%	0.528	41%	0.406	S	S	.	.	H	α-helix	trans	-56.7	-47.7	178.2	-179.4	173	-165.1	0	0	109.3	L1084 Q1090 Q1091 W1092	L1084-E1088 WeakPolarHBondContact O-CB 3.16Å; L1084-E1088 PolarHBondContact O-N 2.84Å; E1088-Q1090 PolarHBondContact O-N 3.14Å; E1088-Q1091 PolarHBondContact O-N 3.37Å; E1088-W1092 PolarHBondContact O-N 3.14Å; E1088-W1092 PolarHBondContact OE1-NE1 3.21Å
1089	R	88.3	Confident	88.9	Confident	171 Å²	171	84.8 Å²	84.8	65%	0.645	42%	0.415	S	S	*	.	H	α-helix	trans	-57.3	-45.6	174.3	-175.3	178.7	-69.3	159.3	-0.2	112.8	A1085 K1086 V1087 Q1091 W1092 E1093	A1085-R1089 WeakPolarHBondContact O-CB 3.45Å; A1085-R1089 PolarHBondContact O-N 2.93Å; K1086-R1089 PolarHBondContact O-N 3.31Å; V1087-R1089 VanDerWaalsContact C-N 3.27Å; V1087-R1089 PolarHBondContact O-N 3.16Å; R1089-Q1091 VanDerWaalsContact C-N 3.33Å; R1089-Q1091 PolarHBondContact O-N 3.48Å; R1089-W1092 PolarHBondContact O-N 3.49Å; R1089-E1093 WeakPolarHBondContact O-CB 3.45Å; R1089-E1093 WeakPolarHBondContact O-CG 3.49Å; R1089-E1093 PolarHBondContact O-N 2.93Å
1090	Q	87.6	Confident	88.8	Confident	117 Å²	117	89.1 Å²	89.1	55%	0.547	43%	0.433	S	S	.	.	H	α-helix	trans	-63.6	-38.2	177.2	-75.1	177.9	-2.4	0	0	112.3	K1086 V1087 E1088 E1093 S1094	K1086-Q1090 WeakPolarHBondContact O-CG 3.45Å; K1086-Q1090 PolarHBondContact O-N 3.35Å; V1087-Q1090 PolarHBondContact O-N 3.45Å; V1087-Q1090 VanDerWaalsContact O-N 3.1Å; E1088-Q1090 PolarHBondContact O-N 3.14Å; Q1090-E1093 CarbonylContact O-C 3.58Å; Q1090-E1093 PolarHBondContact O-N 3.3Å; Q1090-S1094 PolarHBondContact O-N 2.82Å
1091	Q	85.1	Confident	88.7	Confident	120 Å²	120	90.4 Å²	90.4	56%	0.561	44%	0.442	S	S	*	.	H	α-helix	trans	-65.1	-44.3	175.7	-174.4	172.5	-9.6	0	0	110.8	V1087 E1088 R1089 E1093 S1094 E1097	V1087-Q1091 WeakPolarHBondContact O-CB 3.42Å; V1087-Q1091 PolarHBondContact O-N 2.91Å; E1088-Q1091 PolarHBondContact O-N 3.37Å; R1089-Q1091 VanDerWaalsContact C-N 3.33Å; R1089-Q1091 PolarHBondContact O-N 3.48Å; Q1091-E1093 VanDerWaalsContact C-N 3.27Å; Q1091-E1093 PolarHBondContact O-N 2.92Å; Q1091-S1094 WeakPolarHBondContact O-CB 3.15Å; Q1091-S1094 PolarHBondContact O-N 3.45Å; Q1091-E1097 WeakPolarHBondContact O-CB 3.37Å
1092	W	83.5	Confident	88.7	Confident	147 Å²	147	90 Å²	90	56%	0.557	45%	0.446	S	S	*	.	H	α-helix	trans	-61.7	-33.9	171.7	-77.8	109.5	0	0	0	112.8	E1088 R1089 S1094	E1088-W1092 PolarHBondContact O-N 3.14Å; E1088-W1092 PolarHBondContact OE1-NE1 3.21Å; R1089-W1092 PolarHBondContact O-N 3.49Å; W1092-S1094 VanDerWaalsContact C-N 3.35Å
1093	E	89.1	Confident	88.6	Confident	110 Å²	110	88.6 Å²	88.6	51%	0.514	44%	0.442	S	S	.	.	H	α-helix	trans	-79.6	-15.8	177.8	-75.8	177.3	-169	0	0	113.9	R1089 Q1090 Q1091 K1098	R1089-E1093 WeakPolarHBondContact O-CB 3.45Å; R1089-E1093 WeakPolarHBondContact O-CG 3.49Å; R1089-E1093 PolarHBondContact O-N 2.93Å; Q1090-E1093 CarbonylContact O-C 3.58Å; Q1090-E1093 PolarHBondContact O-N 3.3Å; Q1091-E1093 VanDerWaalsContact C-N 3.27Å; Q1091-E1093 PolarHBondContact O-N 2.92Å; E1093-K1098 WeakPolarHBondContact O-CD 3.47Å; E1093-K1098 VanDerWaalsContact O-CE 3.23Å; E1093-K1098 WeakPolarHBondContact O-CE 3.07Å; E1093-K1098 PolarHBondContact O-NZ 3.23Å
1094	S	92.5	Very high	88.3	Confident	52 Å²	52	90 Å²	90	36%	0.364	46%	0.456	S	S	.	.	S	Bend	trans	-58.7	138.2	179.6	-179.2	0	0	0	0	111.5	Q1090 Q1091 W1092 E1096 E1097 K1098	Q1090-S1094 PolarHBondContact O-N 2.82Å; Q1091-S1094 WeakPolarHBondContact O-CB 3.15Å; Q1091-S1094 PolarHBondContact O-N 3.45Å; W1092-S1094 VanDerWaalsContact C-N 3.35Å; S1094-E1096 PolarHBondContact O-N 3.32Å; S1094-E1096 PolarHBondContact OG-N 3.43Å; S1094-E1097 PolarHBondContact O-N 3.43Å; S1094-K1098 WeakPolarHBondContact O-CB 3.47Å; S1094-K1098 WeakPolarHBondContact O-CG 3.44Å; S1094-K1098 PolarHBondContact O-N 3.18Å
1095	S	90.1	Very high	88.4	Confident	101 Å²	101	94 Å²	94	71%	0.706	47%	0.471	S	S	*	.	H	α-helix	trans	-57.8	-33.9	176.8	-56.3	0	0	0	0	112.2	L1099	S1095-L1099 WeakPolarHBondContact O-CB 3.5Å; S1095-L1099 PolarHBondContact O-N 2.86Å
1096	E	89.8	Confident	88.3	Confident	119 Å²	119	95.3 Å²	95.3	56%	0.556	47%	0.473	S	S	*	.	H	α-helix	trans	-67.4	-46.8	178.7	-169.1	-172.2	154.7	0	0	111.5	S1094 L1099 K1100	S1094-E1096 PolarHBondContact O-N 3.32Å; S1094-E1096 PolarHBondContact OG-N 3.43Å; E1096-L1099 PolarHBondContact O-N 2.93Å; E1096-K1100 WeakPolarHBondContact O-CG 3.19Å; E1096-K1100 PolarHBondContact O-N 3.04Å; E1096-K1100 VanDerWaalsContact OE1-CE 3.25Å; E1096-K1100 WeakPolarHBondContact OE1-CE 3.33Å; E1096-K1100 IonicContact OE1-NZ 3.71Å; E1096-K1100 PolarHBondContact OE1-NZ 2.91Å
1097	E	88.1	Confident	87.8	Confident	51 Å²	51	96.8 Å²	96.8	24%	0.238	48%	0.482	C	S	.	.	H	α-helix	trans	-72.3	-37.4	-179.4	-164.6	55.9	-141.7	0	0	111.5	Q1091 S1094 L1099 K1100 T1101	Q1091-E1097 WeakPolarHBondContact O-CB 3.37Å; S1094-E1097 PolarHBondContact O-N 3.43Å; E1097-L1099 VanDerWaalsContact C-N 3.29Å; E1097-L1099 PolarHBondContact O-N 3.13Å; E1097-K1100 PolarHBondContact O-N 3.4Å; E1097-T1101 VanDerWaalsContact O-CB 3.29Å; E1097-T1101 WeakPolarHBondContact O-CB 3.48Å; E1097-T1101 PolarHBondContact O-N 3.33Å; E1097-T1101 PolarHBondContact O-OG1 3.04Å
1098	K	90.9	Very high	87.3	Confident	108 Å²	108	98.2 Å²	98.2	47%	0.47	49%	0.493	S	S	.	.	H	α-helix	trans	-59.5	-40.8	169.5	-77.1	174.8	174.2	155.8	0	111.5	E1093 S1094 T1102	E1093-K1098 WeakPolarHBondContact O-CD 3.47Å; E1093-K1098 VanDerWaalsContact O-CE 3.23Å; E1093-K1098 WeakPolarHBondContact O-CE 3.07Å; E1093-K1098 PolarHBondContact O-NZ 3.23Å; S1094-K1098 WeakPolarHBondContact O-CB 3.47Å; S1094-K1098 WeakPolarHBondContact O-CG 3.44Å; S1094-K1098 PolarHBondContact O-N 3.18Å; K1098-T1102 VanDerWaalsContact O-CB 3.25Å; K1098-T1102 WeakPolarHBondContact O-CB 3.47Å; K1098-T1102 PolarHBondContact O-N 3.32Å; K1098-T1102 PolarHBondContact O-OG1 3.24Å
1099	L	91.4	Very high	87.1	Confident	120 Å²	120	97.8 Å²	97.8	63%	0.628	49%	0.494	S	S	*	.	H	α-helix	trans	-69.9	-41	177.3	-173.5	140.6	0	0	0	111.5	S1095 E1096 E1097 T1102 S1103	S1095-L1099 WeakPolarHBondContact O-CB 3.5Å; S1095-L1099 PolarHBondContact O-N 2.86Å; E1096-L1099 PolarHBondContact O-N 2.93Å; E1097-L1099 VanDerWaalsContact C-N 3.29Å; E1097-L1099 PolarHBondContact O-N 3.13Å; L1099-T1102 PolarHBondContact O-N 3.03Å; L1099-S1103 WeakPolarHBondContact O-CB 3.39Å; L1099-S1103 PolarHBondContact O-N 3.18Å
1100	K	88.3	Confident	86.5	Confident	101 Å²	101	95.6 Å²	95.6	44%	0.439	49%	0.494	S	S	.	.	H	α-helix	trans	-60.6	-46.6	172.1	-76	175.5	-173.3	162.4	0	111.7	E1096 E1097 S1103 S1104	E1096-K1100 WeakPolarHBondContact O-CG 3.19Å; E1096-K1100 PolarHBondContact O-N 3.04Å; E1096-K1100 VanDerWaalsContact OE1-CE 3.25Å; E1096-K1100 WeakPolarHBondContact OE1-CE 3.33Å; E1096-K1100 IonicContact OE1-NZ 3.71Å; E1096-K1100 PolarHBondContact OE1-NZ 2.91Å; E1097-K1100 PolarHBondContact O-N 3.4Å; K1100-S1103 WeakPolarHBondContact O-CB 3.44Å; K1100-S1103 PolarHBondContact O-N 3.44Å; K1100-S1104 WeakPolarHBondContact O-CB 3.45Å; K1100-S1104 PolarHBondContact O-N 3.32Å; K1100-S1104 PolarHBondContact O-OG 3.03Å
1101	T	88.9	Confident	85.6	Confident	31 Å²	31	95 Å²	95	19%	0.19	49%	0.49	C	S	.	.	H	α-helix	trans	-64.8	-39.7	177.4	-59.2	0	0	0	0	111.5	E1097 S1104 K1105	E1097-T1101 VanDerWaalsContact O-CB 3.29Å; E1097-T1101 WeakPolarHBondContact O-CB 3.48Å; E1097-T1101 PolarHBondContact O-N 3.33Å; E1097-T1101 PolarHBondContact O-OG1 3.04Å; T1101-S1104 WeakPolarHBondContact CA-OG 3.28Å; T1101-S1104 PolarHBondContact O-OG 3.26Å; T1101-K1105 HydrophobicContact CG2-CD 4.09Å; T1101-K1105 VanDerWaalsContact O-CB 3.27Å; T1101-K1105 WeakPolarHBondContact O-CB 3.27Å; T1101-K1105 WeakPolarHBondContact O-CG 3.27Å; T1101-K1105 PolarHBondContact O-N 3.37Å
1102	T	90.4	Very high	85.2	Confident	83 Å²	83	93.7 Å²	93.7	51%	0.509	49%	0.486	S	S	.	.	H	α-helix	trans	-67.7	-41.6	175.2	-56.9	0	0	0	0	110.3	K1098 L1099 K1105 V1106	K1098-T1102 VanDerWaalsContact O-CB 3.25Å; K1098-T1102 WeakPolarHBondContact O-CB 3.47Å; K1098-T1102 PolarHBondContact O-N 3.32Å; K1098-T1102 PolarHBondContact O-OG1 3.24Å; L1099-T1102 PolarHBondContact O-N 3.03Å; T1102-K1105 PolarHBondContact O-N 3.17Å; T1102-V1106 HydrophobicContact CG2-CG2 4.26Å; T1102-V1106 VanDerWaalsContact O-CB 3.32Å; T1102-V1106 WeakPolarHBondContact O-CB 3.47Å; T1102-V1106 WeakPolarHBondContact O-CG2 3.43Å; T1102-V1106 PolarHBondContact O-N 3.09Å
1103	S	88.4	Confident	85	Confident	55 Å²	55	90.2 Å²	90.2	39%	0.385	48%	0.481	S	S	.	.	H	α-helix	trans	-61.4	-46.1	174.9	-179	0	0	0	0	111.6	L1099 K1100 V1106 Q1107	L1099-S1103 WeakPolarHBondContact O-CB 3.39Å; L1099-S1103 PolarHBondContact O-N 3.18Å; K1100-S1103 WeakPolarHBondContact O-CB 3.44Å; K1100-S1103 PolarHBondContact O-N 3.44Å; S1103-V1106 PolarHBondContact O-N 3.47Å; S1103-Q1107 WeakPolarHBondContact O-CB 3.45Å; S1103-Q1107 VanDerWaalsContact O-CG 3.32Å; S1103-Q1107 WeakPolarHBondContact O-CG 3.32Å; S1103-Q1107 PolarHBondContact O-N 3.5Å
1104	S	81.6	Confident	84	Confident	54 Å²	54	86.3 Å²	86.3	38%	0.378	47%	0.47	S	S	.	.	H	α-helix	trans	-67.2	-37.7	178	68.1	0	0	0	0	112.1	K1100 T1101 Q1107 S1108	K1100-S1104 WeakPolarHBondContact O-CB 3.45Å; K1100-S1104 PolarHBondContact O-N 3.32Å; K1100-S1104 PolarHBondContact O-OG 3.03Å; T1101-S1104 WeakPolarHBondContact CA-OG 3.28Å; T1101-S1104 PolarHBondContact O-OG 3.26Å; S1104-Q1107 PolarHBondContact O-N 3.36Å; S1104-S1108 WeakPolarHBondContact O-CB 3.26Å; S1104-S1108 PolarHBondContact O-N 2.9Å; S1104-S1108 PolarHBondContact O-OG 3.35Å
1105	K	90.4	Very high	82.9	Confident	130 Å²	130	85.6 Å²	85.6	57%	0.565	47%	0.471	S	S	*	.	H	α-helix	trans	-64.7	-43.9	171.3	-75.4	174.5	-179.3	177.6	0	111.8	T1101 T1102 S1108 L1109	T1101-K1105 HydrophobicContact CG2-CD 4.09Å; T1101-K1105 VanDerWaalsContact O-CB 3.27Å; T1101-K1105 WeakPolarHBondContact O-CB 3.27Å; T1101-K1105 WeakPolarHBondContact O-CG 3.27Å; T1101-K1105 PolarHBondContact O-N 3.37Å; T1102-K1105 PolarHBondContact O-N 3.17Å; K1105-S1108 CarbonylContact O-C 3.6Å; K1105-S1108 WeakPolarHBondContact O-CB 3.38Å; K1105-S1108 PolarHBondContact O-N 2.98Å; K1105-L1109 WeakPolarHBondContact O-CB 3.3Å; K1105-L1109 WeakPolarHBondContact O-CG 3.11Å; K1105-L1109 PolarHBondContact O-N 3.49Å
1106	V	89.3	Confident	81.9	Confident	82 Å²	82	86.7 Å²	86.7	50%	0.497	46%	0.464	S	S	.	.	H	α-helix	trans	-63.7	-41	176.1	168	0	0	0	0	110.7	T1102 S1103 S1108 L1109 L1110	T1102-V1106 HydrophobicContact CG2-CG2 4.26Å; T1102-V1106 VanDerWaalsContact O-CB 3.32Å; T1102-V1106 WeakPolarHBondContact O-CB 3.47Å; T1102-V1106 WeakPolarHBondContact O-CG2 3.43Å; T1102-V1106 PolarHBondContact O-N 3.09Å; S1103-V1106 PolarHBondContact O-N 3.47Å; V1106-S1108 VanDerWaalsContact C-N 3.33Å; V1106-S1108 PolarHBondContact O-N 3.03Å; V1106-L1109 PolarHBondContact O-N 2.87Å; V1106-L1110 VanDerWaalsContact O-CB 3.31Å; V1106-L1110 WeakPolarHBondContact O-CB 3.47Å; V1106-L1110 PolarHBondContact O-N 3.4Å
1107	Q	76.9	Confident	80.9	Confident	128 Å²	128	87 Å²	87	60%	0.598	46%	0.463	S	S	*	.	H	α-helix	trans	-62.7	-40.6	172.7	-76.1	178	-7.5	0	0	111.8	S1103 S1104 L1110 K1111	S1103-Q1107 WeakPolarHBondContact O-CB 3.45Å; S1103-Q1107 VanDerWaalsContact O-CG 3.32Å; S1103-Q1107 WeakPolarHBondContact O-CG 3.32Å; S1103-Q1107 PolarHBondContact O-N 3.5Å; S1104-Q1107 PolarHBondContact O-N 3.36Å; Q1107-L1110 PolarHBondContact O-N 3.42Å; Q1107-K1111 PolarHBondContact O-N 3.04Å
1108	S	76.8	Confident	79.7	Confident	69 Å²	69	87.4 Å²	87.4	48%	0.483	47%	0.467	S	S	.	.	H	α-helix	trans	-65.6	-40.6	175.5	-58.9	0	0	0	0	111.9	S1104 K1105 V1106 K1111 I1112	S1104-S1108 WeakPolarHBondContact O-CB 3.26Å; S1104-S1108 PolarHBondContact O-N 2.9Å; S1104-S1108 PolarHBondContact O-OG 3.35Å; K1105-S1108 CarbonylContact O-C 3.6Å; K1105-S1108 WeakPolarHBondContact O-CB 3.38Å; K1105-S1108 PolarHBondContact O-N 2.98Å; V1106-S1108 VanDerWaalsContact C-N 3.33Å; V1106-S1108 PolarHBondContact O-N 3.03Å; S1108-K1111 WeakPolarHBondContact O-CB 3.29Å; S1108-K1111 PolarHBondContact O-N 3.5Å; S1108-I1112 WeakPolarHBondContact O-CG1 3.36Å; S1108-I1112 PolarHBondContact O-N 3.37Å; S1108-I1112 VanDerWaalsContact O-N 3.09Å
1109	L	82.1	Confident	78.5	Confident	105 Å²	105	87.9 Å²	87.9	55%	0.55	47%	0.471	S	S	.	.	H	α-helix	trans	-66.1	-41.7	173.7	-73.2	173.9	0	0	0	111.6	K1105 V1106 K1111 I1112 V1113	K1105-L1109 WeakPolarHBondContact O-CB 3.3Å; K1105-L1109 WeakPolarHBondContact O-CG 3.11Å; K1105-L1109 PolarHBondContact O-N 3.49Å; V1106-L1109 PolarHBondContact O-N 2.87Å; L1109-K1111 PolarHBondContact O-N 3.4Å; L1109-I1112 PolarHBondContact O-N 2.79Å; L1109-I1112 VanDerWaalsContact O-N 3.12Å; L1109-V1113 WeakPolarHBondContact O-CB 3.49Å; L1109-V1113 VanDerWaalsContact O-CG2 3.31Å; L1109-V1113 WeakPolarHBondContact O-CG2 3.27Å; L1109-V1113 PolarHBondContact O-N 3.3Å
1110	L	74.9	Confident	77.5	Confident	124 Å²	124	88 Å²	88	65%	0.649	47%	0.468	S	S	*	.	H	α-helix	trans	-59.7	-37.3	175.4	-172.5	69.5	0	0	0	110.9	V1106 Q1107 G1114	V1106-L1110 VanDerWaalsContact O-CB 3.31Å; V1106-L1110 WeakPolarHBondContact O-CB 3.47Å; V1106-L1110 PolarHBondContact O-N 3.4Å; Q1107-L1110 PolarHBondContact O-N 3.42Å; L1110-G1114 PolarHBondContact O-N 3.44Å
1111	K	68.5	Low	76.6	Confident	104 Å²	104	91.5 Å²	91.5	45%	0.452	48%	0.479	S	S	.	.	H	α-helix	trans	-63.2	-46.4	173.3	-176.9	179.9	178	177.1	0	111.9	S339 Q1107 S1108 L1109 G1114 G1115	S339-K1111 WeakPolarHBondContact OG-CE 3.44Å; S339-K1111 PolarHBondContact OG-NZ 2.83Å; Q1107-K1111 PolarHBondContact O-N 3.04Å; S1108-K1111 WeakPolarHBondContact O-CB 3.29Å; S1108-K1111 PolarHBondContact O-N 3.5Å; L1109-K1111 PolarHBondContact O-N 3.4Å; K1111-G1114 PolarHBondContact O-N 3.5Å; K1111-G1115 PolarHBondContact O-N 2.96Å
1112	I	78.2	Confident	75.6	Confident	94 Å²	94	97.4 Å²	97.4	48%	0.482	50%	0.497	S	S	.	.	H	α-helix	trans	-63.2	-44.6	178.1	-66.3	166	0	0	0	110.6	S1108 L1109 G1114 G1115 F1116	S1108-I1112 WeakPolarHBondContact O-CG1 3.36Å; S1108-I1112 PolarHBondContact O-N 3.37Å; S1108-I1112 VanDerWaalsContact O-N 3.09Å; L1109-I1112 PolarHBondContact O-N 2.79Å; L1109-I1112 VanDerWaalsContact O-N 3.12Å; I1112-G1114 VanDerWaalsContact C-N 3.35Å; I1112-G1114 PolarHBondContact O-N 3.08Å; I1112-G1115 PolarHBondContact O-N 3.24Å; I1112-F1116 HydrophobicContact CG2-CD2 3.76Å; I1112-F1116 HydrophobicContact CG2-CE2 3.48Å; I1112-F1116 VanDerWaalsContact CG2-CE2 3.48Å; I1112-F1116 VanDerWaalsContact O-CD2 3.24Å; I1112-F1116 WeakPolarHBondContact O-CD2 3.35Å; I1112-F1116 PolarHBondContact O-N 3.38Å
1113	V	77.4	Confident	74.7	Confident	73 Å²	73	99.1 Å²	99.1	44%	0.442	50%	0.503	S	S	.	.	H	α-helix	trans	-64.5	-38.2	177	172.8	0	0	0	0	111.7	L1109 G1115 F1116 K1117	L1109-V1113 WeakPolarHBondContact O-CB 3.49Å; L1109-V1113 VanDerWaalsContact O-CG2 3.31Å; L1109-V1113 WeakPolarHBondContact O-CG2 3.27Å; L1109-V1113 PolarHBondContact O-N 3.3Å; V1113-G1115 VanDerWaalsContact C-N 3.35Å; V1113-F1116 PolarHBondContact O-N 2.84Å; V1113-K1117 PolarHBondContact O-N 2.89Å
1114	G	69.9	Low	74	Confident	29 Å²	29	100.5 Å²	100.5	30%	0.299	51%	0.509	S	S	.	.	H	α-helix	trans	-57.3	-48.4	170.9	0	0	0	0	0	111.5	L1110 K1111 I1112 F1116 K1117 D1118	L1110-G1114 PolarHBondContact O-N 3.44Å; K1111-G1114 PolarHBondContact O-N 3.5Å; I1112-G1114 VanDerWaalsContact C-N 3.35Å; I1112-G1114 PolarHBondContact O-N 3.08Å; G1114-F1116 VanDerWaalsContact C-N 3.32Å; G1114-F1116 PolarHBondContact O-N 3.43Å; G1114-K1117 PolarHBondContact O-N 2.94Å; G1114-D1118 PolarHBondContact O-N 3.46Å; G1114-D1118 VanDerWaalsContact O-N 3.1Å
1115	G	67.9	Low	73.4	Confident	37 Å²	37	100.9 Å²	100.9	38%	0.381	51%	0.511	S	S	.	.	H	α-helix	trans	-58.8	-39.3	174.4	0	0	0	0	0	113.5	K1111 I1112 V1113 D1118 Q1119	K1111-G1115 PolarHBondContact O-N 2.96Å; I1112-G1115 PolarHBondContact O-N 3.24Å; V1113-G1115 VanDerWaalsContact C-N 3.35Å; G1115-D1118 PolarHBondContact O-N 2.88Å; G1115-Q1119 PolarHBondContact O-N 3.29Å
1116	F	69.1	Low	72.6	Confident	124 Å²	124	98.3 Å²	98.3	54%	0.544	51%	0.506	S	S	.	.	H	α-helix	trans	-65.5	-41.7	174.7	-82.9	-65.5	0	0	0	112.9	I1112 V1113 G1114 D1118 Q1119 E1120	I1112-F1116 HydrophobicContact CG2-CD2 3.76Å; I1112-F1116 HydrophobicContact CG2-CE2 3.48Å; I1112-F1116 VanDerWaalsContact CG2-CE2 3.48Å; I1112-F1116 VanDerWaalsContact O-CD2 3.24Å; I1112-F1116 WeakPolarHBondContact O-CD2 3.35Å; I1112-F1116 PolarHBondContact O-N 3.38Å; V1113-F1116 PolarHBondContact O-N 2.84Å; G1114-F1116 VanDerWaalsContact C-N 3.32Å; G1114-F1116 PolarHBondContact O-N 3.43Å; F1116-D1118 VanDerWaalsContact C-N 3.25Å; F1116-D1118 PolarHBondContact O-N 3.09Å; F1116-Q1119 WeakPolarHBondContact O-CB 3.35Å; F1116-Q1119 PolarHBondContact O-N 3.43Å; F1116-E1120 WeakPolarHBondContact O-CB 3.37Å; F1116-E1120 PolarHBondContact O-N 2.99Å
1117	K	68.6	Low	72.1	Confident	124 Å²	124	98.9 Å²	98.9	54%	0.539	50%	0.504	S	S	.	.	H	α-helix	trans	-61.8	-35.4	175.3	-77.6	-172.3	173.9	-173.8	0	112.2	V1113 G1114 E1120 R1121	V1113-K1117 PolarHBondContact O-N 2.89Å; G1114-K1117 PolarHBondContact O-N 2.94Å; K1117-E1120 PolarHBondContact O-N 3.47Å; K1117-R1121 WeakPolarHBondContact O-CG 3.07Å; K1117-R1121 PolarHBondContact O-N 2.98Å
1118	D	63.8	Low	71.9	Confident	60 Å²	60	94.6 Å²	94.6	32%	0.321	49%	0.49	S	S	.	.	H	α-helix	trans	-74.2	-33.6	176.1	-68.7	-31.3	0	0	0	112.2	G1114 G1115 F1116 R1121 R1122	G1114-D1118 PolarHBondContact O-N 3.46Å; G1114-D1118 VanDerWaalsContact O-N 3.1Å; G1115-D1118 PolarHBondContact O-N 2.88Å; F1116-D1118 VanDerWaalsContact C-N 3.25Å; F1116-D1118 PolarHBondContact O-N 3.09Å; D1118-R1121 IonicContact OD1-CZ 3.5Å; D1118-R1121 IonicContact OD1-NH1 2.7Å; D1118-R1121 PolarHBondContact OD1-NH1 2.9Å; D1118-R1122 WeakPolarHBondContact O-CG 3.28Å; D1118-R1122 PolarHBondContact O-N 3.28Å
1119	Q	66.4	Low	72	Confident	119 Å²	119	96.5 Å²	96.5	56%	0.556	49%	0.491	S	S	*	.	H	α-helix	trans	-64	-40.9	168.1	-75.5	-174.2	-22.3	0	0	112.3	G1115 F1116 R1122 L1123	G1115-Q1119 PolarHBondContact O-N 3.29Å; F1116-Q1119 WeakPolarHBondContact O-CB 3.35Å; F1116-Q1119 PolarHBondContact O-N 3.43Å; Q1119-R1122 WeakPolarHBondContact O-CB 3.4Å; Q1119-R1122 PolarHBondContact O-N 2.83Å; Q1119-L1123 PolarHBondContact O-N 2.88Å
1120	E	69.3	Low	72.1	Confident	123 Å²	123	96 Å²	96	58%	0.575	49%	0.493	S	S	*	.	H	α-helix	trans	-62.7	-44.7	176	-174.1	176.6	-164.4	0	0	111.2	F1116 K1117 R1122 L1123 V1124	F1116-E1120 WeakPolarHBondContact O-CB 3.37Å; F1116-E1120 PolarHBondContact O-N 2.99Å; K1117-E1120 PolarHBondContact O-N 3.47Å; E1120-R1122 VanDerWaalsContact C-N 3.3Å; E1120-R1122 PolarHBondContact O-N 3.46Å; E1120-L1123 WeakPolarHBondContact O-CB 3.49Å; E1120-L1123 PolarHBondContact O-N 2.97Å; E1120-L1123 VanDerWaalsContact O-N 3.12Å; E1120-V1124 WeakPolarHBondContact O-CG2 3.31Å; E1120-V1124 PolarHBondContact O-N 3.2Å
1121	R	68.6	Low	72.3	Confident	174 Å²	174	96.2 Å²	96.2	66%	0.657	49%	0.485	S	S	*	.	H	α-helix	trans	-58.2	-40.7	172.6	-74.8	171.4	179.2	165.3	-6.3	112.5	K1117 D1118 S1125	K1117-R1121 WeakPolarHBondContact O-CG 3.07Å; K1117-R1121 PolarHBondContact O-N 2.98Å; D1118-R1121 IonicContact OD1-CZ 3.5Å; D1118-R1121 IonicContact OD1-NH1 2.7Å; D1118-R1121 PolarHBondContact OD1-NH1 2.9Å; R1121-S1125 WeakPolarHBondContact O-CB 3.26Å; R1121-S1125 PolarHBondContact O-N 3.4Å
1122	R	68.7	Low	73	Confident	154 Å²	154	94.3 Å²	94.3	58%	0.581	48%	0.475	S	S	*	.	H	α-helix	trans	-65.4	-41.8	174.9	-72.2	176.9	-173.9	-179.9	5.2	111.2	D1118 Q1119 E1120 S1125 V1126	D1118-R1122 WeakPolarHBondContact O-CG 3.28Å; D1118-R1122 PolarHBondContact O-N 3.28Å; Q1119-R1122 WeakPolarHBondContact O-CB 3.4Å; Q1119-R1122 PolarHBondContact O-N 2.83Å; E1120-R1122 VanDerWaalsContact C-N 3.3Å; E1120-R1122 PolarHBondContact O-N 3.46Å; R1122-S1125 PolarHBondContact O-N 3.04Å; R1122-V1126 WeakPolarHBondContact O-CG2 3.21Å; R1122-V1126 PolarHBondContact O-N 3.33Å
1123	L	72.3	Confident	73.1	Confident	119 Å²	119	93.1 Å²	93.1	62%	0.623	48%	0.475	S	S	*	.	H	α-helix	trans	-62.3	-45.6	177	-166.7	81.2	0	0	0	111.3	Q1119 E1120 S1125 V1126 E1127	Q1119-L1123 PolarHBondContact O-N 2.88Å; E1120-L1123 WeakPolarHBondContact O-CB 3.49Å; E1120-L1123 PolarHBondContact O-N 2.97Å; E1120-L1123 VanDerWaalsContact O-N 3.12Å; L1123-S1125 VanDerWaalsContact C-N 3.3Å; L1123-S1125 PolarHBondContact O-N 3.45Å; L1123-V1126 PolarHBondContact O-N 3.17Å; L1123-E1127 WeakPolarHBondContact O-CB 3.27Å; L1123-E1127 PolarHBondContact O-N 3.29Å
1124	V	73.2	Confident	73.4	Confident	84 Å²	84	91.4 Å²	91.4	51%	0.509	47%	0.472	S	S	.	.	H	α-helix	trans	-61.6	-39.4	176.4	172.2	0	0	0	0	111.2	E1120 E1127 A1128	E1120-V1124 WeakPolarHBondContact O-CG2 3.31Å; E1120-V1124 PolarHBondContact O-N 3.2Å; V1124-E1127 PolarHBondContact O-N 2.83Å; V1124-A1128 WeakPolarHBondContact O-CB 3.49Å; V1124-A1128 PolarHBondContact O-N 2.99Å
1125	S	68.2	Low	74	Confident	62 Å²	62	94.9 Å²	94.9	43%	0.434	48%	0.48	S	S	.	.	H	α-helix	trans	-65.3	-42.5	174.7	178.5	0	0	0	0	112.5	R1121 R1122 L1123 A1128 Q1129	R1121-S1125 WeakPolarHBondContact O-CB 3.26Å; R1121-S1125 PolarHBondContact O-N 3.4Å; R1122-S1125 PolarHBondContact O-N 3.04Å; L1123-S1125 VanDerWaalsContact C-N 3.3Å; L1123-S1125 PolarHBondContact O-N 3.45Å; S1125-A1128 PolarHBondContact O-N 3.47Å; S1125-Q1129 WeakPolarHBondContact O-CG 3.37Å; S1125-Q1129 PolarHBondContact O-N 3.05Å
1126	V	74.7	Confident	74.7	Confident	76 Å²	76	94.4 Å²	94.4	46%	0.461	47%	0.47	S	S	.	.	H	α-helix	trans	-65.9	-41.6	175.9	170.8	0	0	0	0	110.6	R1122 L1123 A1128 Q1129 V1130	R1122-V1126 WeakPolarHBondContact O-CG2 3.21Å; R1122-V1126 PolarHBondContact O-N 3.33Å; L1123-V1126 PolarHBondContact O-N 3.17Å; V1126-A1128 VanDerWaalsContact C-N 3.32Å; V1126-A1128 PolarHBondContact O-N 3.4Å; V1126-Q1129 WeakPolarHBondContact O-CB 3.27Å; V1126-Q1129 PolarHBondContact O-N 3.03Å; V1126-Q1129 VanDerWaalsContact O-N 3.14Å; V1126-V1130 HydrophobicContact CG1-CG2 4.27Å; V1126-V1130 WeakPolarHBondContact O-CG2 3.39Å; V1126-V1130 PolarHBondContact O-N 3.38Å
1127	E	77.5	Confident	75.3	Confident	95 Å²	95	94 Å²	94	44%	0.444	47%	0.472	S	S	.	.	H	α-helix	trans	-61.5	-40.9	176.1	-167.1	-169.2	147.8	0	0	111.4	L1123 V1124 Q1129 V1130 R1131	L1123-E1127 WeakPolarHBondContact O-CB 3.27Å; L1123-E1127 PolarHBondContact O-N 3.29Å; V1124-E1127 PolarHBondContact O-N 2.83Å; E1127-Q1129 VanDerWaalsContact C-N 3.35Å; E1127-Q1129 PolarHBondContact O-N 2.86Å; E1127-V1130 PolarHBondContact O-N 2.7Å; E1127-R1131 VanDerWaalsContact O-CB 3.26Å; E1127-R1131 WeakPolarHBondContact O-CB 3.41Å; E1127-R1131 PolarHBondContact O-N 3.42Å; E1127-R1131 IonicContact OE1-CZ 3.53Å; E1127-R1131 IonicContact OE1-NH1 3.51Å; E1127-R1131 IonicContact OE1-NH2 3.63Å; E1127-R1131 PolarHBondContact OE1-NH2 3.49Å
1128	A	74.2	Confident	75.9	Confident	37 Å²	37	91 Å²	91	31%	0.306	47%	0.467	S	S	.	.	H	α-helix	trans	-63	-39.3	173.6	0	0	0	0	0	112.4	V1124 S1125 V1126 Y1132	V1124-A1128 WeakPolarHBondContact O-CB 3.49Å; V1124-A1128 PolarHBondContact O-N 2.99Å; S1125-A1128 PolarHBondContact O-N 3.47Å; V1126-A1128 VanDerWaalsContact C-N 3.32Å; V1126-A1128 PolarHBondContact O-N 3.4Å; A1128-Y1132 WeakPolarHBondContact O-CB 3.23Å; A1128-Y1132 PolarHBondContact O-N 3.4Å
1129	Q	79	Confident	76.8	Confident	109 Å²	109	91.4 Å²	91.4	51%	0.509	46%	0.464	S	S	.	.	H	α-helix	trans	-67.7	-42.5	174.8	-72.6	178.3	-7.1	0	0	112.3	S1125 V1126 E1127 Y1132 C1133	S1125-Q1129 WeakPolarHBondContact O-CG 3.37Å; S1125-Q1129 PolarHBondContact O-N 3.05Å; V1126-Q1129 WeakPolarHBondContact O-CB 3.27Å; V1126-Q1129 PolarHBondContact O-N 3.03Å; V1126-Q1129 VanDerWaalsContact O-N 3.14Å; E1127-Q1129 VanDerWaalsContact C-N 3.35Å; E1127-Q1129 PolarHBondContact O-N 2.86Å; Q1129-Y1132 WeakPolarHBondContact O-CB 3.44Å; Q1129-Y1132 PolarHBondContact O-N 3.17Å; Q1129-C1133 PolarHBondContact O-N 2.94Å; Q1129-C1133 PolarHBondContact O-SG 3.31Å; Q1129-C1133 VanDerWaalsContact O-SG 3.41Å
1130	V	82.9	Confident	77.4	Confident	96 Å²	96	89.6 Å²	89.6	58%	0.582	46%	0.457	S	S	*	.	H	α-helix	trans	-64.9	-42	176.9	171.2	0	0	0	0	110.8	V1126 E1127 Y1132 C1133 G1134	V1126-V1130 HydrophobicContact CG1-CG2 4.27Å; V1126-V1130 WeakPolarHBondContact O-CG2 3.39Å; V1126-V1130 PolarHBondContact O-N 3.38Å; E1127-V1130 PolarHBondContact O-N 2.7Å; V1130-Y1132 VanDerWaalsContact C-N 3.35Å; V1130-C1133 PolarHBondContact O-N 2.94Å; V1130-G1134 PolarHBondContact O-N 3.27Å
1131	R	80.4	Confident	77.8	Confident	128 Å²	128	86.6 Å²	86.6	48%	0.483	45%	0.453	S	S	.	.	H	α-helix	trans	-59.5	-46.3	173.9	-174.3	-178.1	-69.5	106.3	1.3	110.9	E1127 G1134 E1135	E1127-R1131 VanDerWaalsContact O-CB 3.26Å; E1127-R1131 WeakPolarHBondContact O-CB 3.41Å; E1127-R1131 PolarHBondContact O-N 3.42Å; E1127-R1131 IonicContact OE1-CZ 3.53Å; E1127-R1131 IonicContact OE1-NH1 3.51Å; E1127-R1131 IonicContact OE1-NH2 3.63Å; E1127-R1131 PolarHBondContact OE1-NH2 3.49Å; R1131-G1134 PolarHBondContact O-N 3.15Å; R1131-E1135 WeakPolarHBondContact O-CG 3.45Å; R1131-E1135 PolarHBondContact O-N 2.97Å
1132	Y	82.6	Confident	78	Confident	63 Å²	63	82.1 Å²	82.1	25%	0.247	44%	0.44	C	S	.	.	H	α-helix	trans	-60.7	-45.1	174.9	174.9	-106	0	0	0	112.5	A1128 Q1129 V1130 G1134 E1135 V1136 P1156 K1157 A1158	A1128-Y1132 WeakPolarHBondContact O-CB 3.23Å; A1128-Y1132 PolarHBondContact O-N 3.4Å; Q1129-Y1132 WeakPolarHBondContact O-CB 3.44Å; Q1129-Y1132 PolarHBondContact O-N 3.17Å; V1130-Y1132 VanDerWaalsContact C-N 3.35Å; Y1132-G1134 VanDerWaalsContact C-N 3.3Å; Y1132-G1134 PolarHBondContact O-N 3.37Å; Y1132-E1135 PolarHBondContact O-N 3.02Å; Y1132-V1136 HydrophobicContact CD1-CG2 4.33Å; Y1132-V1136 HydrophobicContact CD2-CG2 4.21Å; Y1132-V1136 HydrophobicContact CE1-CG2 3.9Å; Y1132-V1136 HydrophobicContact CE2-CG2 3.75Å; Y1132-V1136 HydrophobicContact CG-CG2 4.48Å; Y1132-V1136 WeakPolarHBondContact O-CB 2.91Å; Y1132-V1136 VanDerWaalsContact O-CG2 3.28Å; Y1132-V1136 WeakPolarHBondContact O-CG2 3.08Å; Y1132-V1136 PolarHBondContact O-N 3.3Å; Y1132-P1156 HydrophobicContact CD2-CB 4.28Å; Y1132-P1156 HydrophobicContact CE2-CB 3.85Å; Y1132-P1156 WeakPolarHBondContact CE2-O 3.3Å; Y1132-P1156 PolarHBondContact OH-O 3.36Å; Y1132-K1157 VanDerWaalsContact CE2-O 3.3Å; Y1132-K1157 WeakPolarHBondContact CE2-O 3.42Å; Y1132-A1158 HydrophobicContact CE1-CB 4.32Å; Y1132-A1158 VanDerWaalsContact CE2-CA 3.45Å; Y1132-A1158 HydrophobicContact CE2-CB 4.36Å; Y1132-A1158 PolarHBondContact OH-N 3.29Å
1133	C	80.8	Confident	78.1	Confident	70 Å²	70	75.9 Å²	75.9	47%	0.473	42%	0.42	S	S	.	.	H	α-helix	trans	-61	-39.7	174.4	-73	0	0	0	0	112	Q1129 V1130 V1136 L1137	Q1129-C1133 PolarHBondContact O-N 2.94Å; Q1129-C1133 PolarHBondContact O-SG 3.31Å; Q1129-C1133 VanDerWaalsContact O-SG 3.41Å; V1130-C1133 PolarHBondContact O-N 2.94Å; C1133-V1136 PolarHBondContact O-N 2.92Å; C1133-L1137 WeakPolarHBondContact O-CB 3.44Å; C1133-L1137 VanDerWaalsContact O-CG 3.26Å; C1133-L1137 WeakPolarHBondContact O-CG 3.47Å; C1133-L1137 PolarHBondContact O-N 3.33Å
1134	G	84.1	Confident	77.9	Confident	37 Å²	37	78.3 Å²	78.3	38%	0.381	43%	0.425	S	S	.	.	H	α-helix	trans	-62	-44.4	173.7	0	0	0	0	0	112.5	V1130 R1131 Y1132 L1137 S1138	V1130-G1134 PolarHBondContact O-N 3.27Å; R1131-G1134 PolarHBondContact O-N 3.15Å; Y1132-G1134 VanDerWaalsContact C-N 3.3Å; Y1132-G1134 PolarHBondContact O-N 3.37Å; G1134-L1137 PolarHBondContact O-N 3.09Å; G1134-S1138 WeakPolarHBondContact O-CB 3.27Å; G1134-S1138 PolarHBondContact O-N 3.06Å
1135	E	82.5	Confident	77.7	Confident	101 Å²	101	78.4 Å²	78.4	47%	0.472	44%	0.435	S	S	.	.	H	α-helix	trans	-63.4	-41.5	175.5	-74	174.6	-171.9	0	0	112.1	R1131 Y1132 S1138 W1139 P1156	R1131-E1135 WeakPolarHBondContact O-CG 3.45Å; R1131-E1135 PolarHBondContact O-N 2.97Å; Y1132-E1135 PolarHBondContact O-N 3.02Å; E1135-S1138 PolarHBondContact O-N 3.3Å; E1135-W1139 VanDerWaalsContact O-CB 3.29Å; E1135-W1139 WeakPolarHBondContact O-CB 3.44Å; E1135-W1139 PolarHBondContact O-N 3.32Å; E1135-P1156 HydrophobicContact CB-CB 4.37Å; E1135-P1156 HydrophobicContact CB-CG 4.31Å
1136	V	81.8	Confident	77.7	Confident	27 Å²	27	80.8 Å²	80.8	16%	0.164	44%	0.439	C	S	.	.	H	α-helix	trans	-66.3	-42.6	176	171.9	0	0	0	0	111.4	Y1132 C1133 W1139 M1140 P1156	Y1132-V1136 HydrophobicContact CD1-CG2 4.33Å; Y1132-V1136 HydrophobicContact CD2-CG2 4.21Å; Y1132-V1136 HydrophobicContact CE1-CG2 3.9Å; Y1132-V1136 HydrophobicContact CE2-CG2 3.75Å; Y1132-V1136 HydrophobicContact CG-CG2 4.48Å; Y1132-V1136 WeakPolarHBondContact O-CB 2.91Å; Y1132-V1136 VanDerWaalsContact O-CG2 3.28Å; Y1132-V1136 WeakPolarHBondContact O-CG2 3.08Å; Y1132-V1136 PolarHBondContact O-N 3.3Å; C1133-V1136 PolarHBondContact O-N 2.92Å; V1136-W1139 PolarHBondContact O-N 3.16Å; V1136-M1140 HydrophobicContact CG1-CE 3.63Å; V1136-M1140 HydrophobicContact CG1-SD 4.37Å; V1136-M1140 WeakPolarHBondContact O-CB 3.47Å; V1136-M1140 VanDerWaalsContact O-CG 3.31Å; V1136-M1140 WeakPolarHBondContact O-CG 3.48Å; V1136-M1140 PolarHBondContact O-N 2.87Å; V1136-P1156 HydrophobicContact CG2-CB 3.96Å; V1136-P1156 HydrophobicContact CG2-CG 4.01Å
1137	L	82.7	Confident	76.8	Confident	115 Å²	115	82.4 Å²	82.4	60%	0.602	45%	0.454	S	S	*	.	H	α-helix	trans	-66.3	-39.9	176.3	-75.1	169.9	0	0	0	111.8	C1133 G1134 M1140 A1141	C1133-L1137 WeakPolarHBondContact O-CB 3.44Å; C1133-L1137 VanDerWaalsContact O-CG 3.26Å; C1133-L1137 WeakPolarHBondContact O-CG 3.47Å; C1133-L1137 PolarHBondContact O-N 3.33Å; G1134-L1137 PolarHBondContact O-N 3.09Å; L1137-M1140 PolarHBondContact O-N 3.33Å; L1137-A1141 VanDerWaalsContact O-CB 3.29Å; L1137-A1141 WeakPolarHBondContact O-CB 3.37Å; L1137-A1141 PolarHBondContact O-N 3.38Å
1138	S	81.3	Confident	75.5	Confident	62 Å²	62	82.1 Å²	82.1	43%	0.434	46%	0.459	S	S	.	.	H	α-helix	trans	-63	-44.3	173.4	-171.3	0	0	0	0	111.1	G1134 E1135 A1141 E1142	G1134-S1138 WeakPolarHBondContact O-CB 3.27Å; G1134-S1138 PolarHBondContact O-N 3.06Å; E1135-S1138 PolarHBondContact O-N 3.3Å; S1138-A1141 PolarHBondContact O-N 3.21Å; S1138-E1142 WeakPolarHBondContact O-CB 3.02Å; S1138-E1142 WeakPolarHBondContact O-CG 3.38Å; S1138-E1142 PolarHBondContact O-N 3.41Å
1139	W	82.4	Confident	74.6	Confident	68 Å²	68	89.8 Å²	89.8	26%	0.258	49%	0.493	S	S	.	.	H	α-helix	trans	-60.6	-47.9	174.9	176.7	86.3	0	0	0	111	E1135 V1136 A1141 E1142 C1143 C1151 K1153 A1155 P1156	E1135-W1139 VanDerWaalsContact O-CB 3.29Å; E1135-W1139 WeakPolarHBondContact O-CB 3.44Å; E1135-W1139 PolarHBondContact O-N 3.32Å; V1136-W1139 PolarHBondContact O-N 3.16Å; W1139-A1141 PolarHBondContact O-N 2.91Å; W1139-E1142 PolarHBondContact O-N 3.22Å; W1139-C1143 WeakPolarHBondContact O-CB 3.43Å; W1139-C1143 PolarHBondContact O-N 3.25Å; W1139-C1143 PolarHBondContact O-SG 3.3Å; W1139-C1151 HydrophobicContact CZ2-CB 4.25Å; W1139-K1153 PolarHBondContact NE1-O 3.07Å; W1139-A1155 HydrophobicContact CH2-CB 4.37Å; W1139-A1155 HydrophobicContact CZ2-CB 4.08Å; W1139-P1156 HydrophobicContact CB-CG 3.99Å; W1139-P1156 HydrophobicContact CG-CG 4.29Å
1140	M	77.5	Confident	73.3	Confident	82 Å²	82	93 Å²	93	40%	0.404	51%	0.506	S	S	.	.	H	α-helix	trans	-58.8	-46.3	175.6	-73.9	-179.1	-174.2	0	0	111.6	V1136 L1137 C1143 F1144	V1136-M1140 HydrophobicContact CG1-CE 3.63Å; V1136-M1140 HydrophobicContact CG1-SD 4.37Å; V1136-M1140 WeakPolarHBondContact O-CB 3.47Å; V1136-M1140 VanDerWaalsContact O-CG 3.31Å; V1136-M1140 WeakPolarHBondContact O-CG 3.48Å; V1136-M1140 PolarHBondContact O-N 2.87Å; L1137-M1140 PolarHBondContact O-N 3.33Å; M1140-C1143 PolarHBondContact O-N 3.12Å; M1140-F1144 HydrophobicContact CB-CD2 4.49Å; M1140-F1144 HydrophobicContact CB-CE2 4.45Å; M1140-F1144 WeakPolarHBondContact O-CD2 3.09Å; M1140-F1144 PolarHBondContact O-N 3.49Å
1141	A	79.1	Confident	71.9	Confident	60 Å²	60	90.5 Å²	90.5	50%	0.496	49%	0.492	S	S	.	.	H	α-helix	trans	-62.7	-41.7	179.3	0	0	0	0	0	112.4	L1137 S1138 W1139 F1144 A1145	L1137-A1141 VanDerWaalsContact O-CB 3.29Å; L1137-A1141 WeakPolarHBondContact O-CB 3.37Å; L1137-A1141 PolarHBondContact O-N 3.38Å; S1138-A1141 PolarHBondContact O-N 3.21Å; W1139-A1141 PolarHBondContact O-N 2.91Å; A1141-F1144 PolarHBondContact O-N 2.93Å; A1141-A1145 WeakPolarHBondContact O-CB 3.5Å; A1141-A1145 PolarHBondContact O-N 3.32Å
1142	E	72.9	Confident	70.8	Confident	80 Å²	80	93.8 Å²	93.8	37%	0.374	51%	0.513	S	S	.	.	H	α-helix	trans	-63.5	-43.8	173.6	-78.7	-176.8	-175.4	0	0	111.7	S1138 W1139 F1144 A1145 Q1146 K1153	S1138-E1142 WeakPolarHBondContact O-CB 3.02Å; S1138-E1142 WeakPolarHBondContact O-CG 3.38Å; S1138-E1142 PolarHBondContact O-N 3.41Å; W1139-E1142 PolarHBondContact O-N 3.22Å; E1142-F1144 VanDerWaalsContact C-N 3.32Å; E1142-F1144 PolarHBondContact O-N 3.41Å; E1142-A1145 PolarHBondContact O-N 3.08Å; E1142-Q1146 PolarHBondContact O-N 2.78Å; E1142-K1153 IonicContact OE1-NZ 2.73Å; E1142-K1153 IonicContact OE2-NZ 2.64Å; E1142-K1153 PolarHBondContact OE2-NZ 3.4Å
1143	C	69.1	Low	69.7	Low	23 Å²	23	96.7 Å²	96.7	16%	0.155	53%	0.526	C	S	.	.	H	α-helix	trans	-64.6	-35.8	177.4	-58	0	0	0	0	111.9	W1139 M1140 C1151	W1139-C1143 WeakPolarHBondContact O-CB 3.43Å; W1139-C1143 PolarHBondContact O-N 3.25Å; W1139-C1143 PolarHBondContact O-SG 3.3Å; M1140-C1143 PolarHBondContact O-N 3.12Å; C1143-C1151 HydrophobicContact CB-CB 3.85Å; C1143-C1151 WeakPolarHBondContact CB-SG 3.34Å; C1143-C1151 WeakPolarHBondContact SG-CB 3.26Å; C1143-C1151 CovalentContact SG-SG 2.04Å; C1143-C1151 PolarHBondContact SG-SG 3.14Å
1144	F	68.6	Low	68.8	Low	170 Å²	170	100.8 Å²	100.8	75%	0.746	54%	0.544	S	S	*	.	H	α-helix	trans	-71.7	-34.8	174.5	-78.7	-63.2	0	0	0	112.9	M1140 A1141 E1142 Q1146 S1147	M1140-F1144 HydrophobicContact CB-CD2 4.49Å; M1140-F1144 HydrophobicContact CB-CE2 4.45Å; M1140-F1144 WeakPolarHBondContact O-CD2 3.09Å; M1140-F1144 PolarHBondContact O-N 3.49Å; A1141-F1144 PolarHBondContact O-N 2.93Å; E1142-F1144 VanDerWaalsContact C-N 3.32Å; E1142-F1144 PolarHBondContact O-N 3.41Å; F1144-Q1146 VanDerWaalsContact C-N 3.28Å; F1144-Q1146 PolarHBondContact O-N 3.09Å; F1144-S1147 PolarHBondContact O-N 3.01Å
1145	A	69.4	Low	68	Low	85 Å²	85	101.7 Å²	101.7	70%	0.702	55%	0.548	S	S	*	.	H	α-helix	trans	-67.2	-26	178.7	0	0	0	0	0	113.5	A1141 E1142	A1141-A1145 WeakPolarHBondContact O-CB 3.5Å; A1141-A1145 PolarHBondContact O-N 3.32Å; E1142-A1145 PolarHBondContact O-N 3.08Å
1146	Q	67.3	Low	67.5	Low	112 Å²	112	98.2 Å²	98.2	52%	0.523	53%	0.534	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.2	-3.2	-179.9	-69.1	-177	-4	0	0	114.4	E1142 F1144 T1148	E1142-Q1146 PolarHBondContact O-N 2.78Å; F1144-Q1146 VanDerWaalsContact C-N 3.28Å; F1144-Q1146 PolarHBondContact O-N 3.09Å; Q1146-T1148 PolarHBondContact O-N 3.08Å; Q1146-T1148 VanDerWaalsContact O-N 3.12Å
1147	S	56.2	Low	66.6	Low	111 Å²	111	106.1 Å²	106.1	78%	0.776	57%	0.566	S	S	*	*	T	Hydrogen-bonded Turn	trans	52.1	32.9	173.1	60.6	0	0	0	0	115.7	F1144	F1144-S1147 PolarHBondContact O-N 3.01Å
1148	T	50.9	Low	65.5	Low	89 Å²	89	103.6 Å²	103.6	55%	0.546	56%	0.562	S	S	.	*	S	Bend	trans	-138.6	135.8	170.1	48.2	0	0	0	0	109.9	Q1146 K1150	Q1146-T1148 PolarHBondContact O-N 3.08Å; Q1146-T1148 VanDerWaalsContact O-N 3.12Å; T1148-K1150 PolarHBondContact O-N 3.43Å
1149	L	54.4	Low	64.1	Low	197 Å²	197	104.4 Å²	104.4	100%	1.031	57%	0.566	S	S	*	*	S	Bend	trans	-64.7	11.9	179.7	-88.7	150.9	0	0	0	114.7
1150	K	51.4	Low	62.1	Low	178 Å²	178	106 Å²	106	77%	0.774	59%	0.587	S	S	*	*			trans	-130.3	104.5	178	-92.1	-175.5	171.9	-177.4	0	109.4	T1148	T1148-K1150 PolarHBondContact O-N 3.43Å
1151	C	54.9	Low	60.2	Low	42 Å²	42	108.2 Å²	108.2	28%	0.284	61%	0.611	S	S	.	*			trans	-81.6	124.1	172.4	-147.1	0	0	0	0	109	W1139 C1143 K1153	W1139-C1151 HydrophobicContact CZ2-CB 4.25Å; C1143-C1151 HydrophobicContact CB-CB 3.85Å; C1143-C1151 WeakPolarHBondContact CB-SG 3.34Å; C1143-C1151 WeakPolarHBondContact SG-CB 3.26Å; C1143-C1151 CovalentContact SG-SG 2.04Å; C1143-C1151 PolarHBondContact SG-SG 3.14Å; C1151-K1153 PolarHBondContact O-N 3.28Å
1152	E	57.2	Low	57.9	Low	197 Å²	197	113.8 Å²	113.8	92%	0.921	62%	0.624	S	S	*	*	S	Bend	trans	-76.8	-5.5	178.9	-73.7	-173.5	158.4	0	0	113.5
1153	K	59.5	Low	56	Low	124 Å²	124	114.2 Å²	114.2	54%	0.539	64%	0.641	S	S	.	*	S	Bend	trans	-95.9	131.7	173.7	-87.9	-176.9	-178.9	171.4	0	111.7	W1139 E1142 C1151	W1139-K1153 PolarHBondContact NE1-O 3.07Å; E1142-K1153 IonicContact OE1-NZ 2.73Å; E1142-K1153 IonicContact OE2-NZ 2.64Å; E1142-K1153 PolarHBondContact OE2-NZ 3.4Å; C1151-K1153 PolarHBondContact O-N 3.28Å
1154	D	62.5	Low	54.1	Low	156 Å²	156	120.3 Å²	120.3	83%	0.834	67%	0.672	S	S	*	*	P	Polyproline II helix	trans	-55.9	140.6	169.1	-73	-34.1	0	0	0	111.4
1155	A	66.5	Low	52.4	Low	57 Å²	57	121 Å²	121	47%	0.471	68%	0.678	S	S	.	*	P	Polyproline II helix	trans	-63.8	143.6	178.5	0	0	0	0	0	111.2	W1139 K1157	W1139-A1155 HydrophobicContact CH2-CB 4.37Å; W1139-A1155 HydrophobicContact CZ2-CB 4.08Å; A1155-K1157 PolarHBondContact O-N 3.26Å
1156	P	72.1	Confident	50.5	Low	28 Å²	28	123.1 Å²	123.1	18%	0.182	68%	0.682	C	S	.	*	P	Polyproline II helix	trans	-53.7	131.2	172.7	-22.8	32.4	0	0	0	110	Y1132 E1135 V1136 W1139	Y1132-P1156 HydrophobicContact CD2-CB 4.28Å; Y1132-P1156 HydrophobicContact CE2-CB 3.85Å; Y1132-P1156 WeakPolarHBondContact CE2-O 3.3Å; Y1132-P1156 PolarHBondContact OH-O 3.36Å; E1135-P1156 HydrophobicContact CB-CB 4.37Å; E1135-P1156 HydrophobicContact CB-CG 4.31Å; V1136-P1156 HydrophobicContact CG2-CB 3.96Å; V1136-P1156 HydrophobicContact CG2-CG 4.01Å; W1139-P1156 HydrophobicContact CB-CG 3.99Å; W1139-P1156 HydrophobicContact CG-CG 4.29Å
1157	K	63	Low	48.8	Very low	192 Å²	192	122.2 Å²	122.2	84%	0.835	69%	0.693	S	S	*	*	P	Polyproline II helix	trans	-83	131.6	178.9	-71.3	178.3	-178.7	172.6	0	109.3	Y1132 A1155	Y1132-K1157 VanDerWaalsContact CE2-O 3.3Å; Y1132-K1157 WeakPolarHBondContact CE2-O 3.42Å; A1155-K1157 PolarHBondContact O-N 3.26Å
1158	A	59.1	Low	47.5	Very low	63 Å²	63	125.1 Å²	125.1	52%	0.521	70%	0.7	S	S	.	*	P	Polyproline II helix	trans	-55.4	140.2	175.5	0	0	0	0	0	110.5	Y1132 S1160	Y1132-A1158 HydrophobicContact CE1-CB 4.32Å; Y1132-A1158 VanDerWaalsContact CE2-CA 3.45Å; Y1132-A1158 HydrophobicContact CE2-CB 4.36Å; Y1132-A1158 PolarHBondContact OH-N 3.29Å; A1158-S1160 PolarHBondContact O-N 3.31Å
1159	P	52.3	Low	46.3	Very low	78 Å²	78	126.9 Å²	126.9	51%	0.506	71%	0.711	S	S	.	*			trans	-57.9	115.5	173.6	22	-30	0	0	0	108.5
1160	S	39.8	Very low	45.3	Very low	102 Å²	102	123.4 Å²	123.4	71%	0.713	70%	0.7	S	S	*	*			trans	-73.3	131	177.8	62.5	0	0	0	0	108.9	A1158 K1162	A1158-S1160 PolarHBondContact O-N 3.31Å; S1160-K1162 PolarHBondContact O-N 3.41Å
1161	S	37.7	Very low	44.1	Very low	128 Å²	128	123.8 Å²	123.8	90%	0.895	71%	0.705	S	S	*	*	S	Bend	trans	-70.9	18.5	-177.2	57.2	0	0	0	0	114.7	A1163	S1161-A1163 PolarHBondContact O-N 3.2Å
1162	K	31.6	Very low	42.8	Very low	177 Å²	177	127 Å²	127	77%	0.77	73%	0.728	S	S	*	*			trans	-93.5	94.3	176.3	-74.5	-171.7	178.4	-177.7	0	109.5	S1160 D1164	S1160-K1162 PolarHBondContact O-N 3.41Å; K1162-D1164 PolarHBondContact O-N 3.46Å; K1162-D1164 VanDerWaalsContact O-N 3.13Å
1163	A	31.9	Very low	41.3	Very low	89 Å²	89	127 Å²	127	74%	0.736	73%	0.727	S	S	*	*			trans	-65.8	102.8	164	0	0	0	0	0	109.3	S1161	S1161-A1163 PolarHBondContact O-N 3.2Å
1164	D	29.1	Very low	39.8	Very low	152 Å²	152	126.1 Å²	126.1	81%	0.813	74%	0.737	S	S	*	*			trans	-79.6	115	160.4	-90	-28.9	0	0	0	108.5	K1162 T1166	K1162-D1164 PolarHBondContact O-N 3.46Å; K1162-D1164 VanDerWaalsContact O-N 3.13Å; D1164-T1166 PolarHBondContact O-N 2.04Å
1165	H	34.5	Very low	38.2	Very low	185 Å²	185	128 Å²	128	86%	0.856	74%	0.74	S	S	*	*			trans	-73.4	102	167.5	-82.7	-70.1	0	0	0	109.5
1166	T	28.3	Very low	36.3	Very low	128 Å²	128	134.3 Å²	134.3	79%	0.785	76%	0.761	S	S	*	*			trans	-141.1	108.6	157.4	40.7	0	0	0	0	111	D1164	D1164-T1166 PolarHBondContact O-N 2.04Å
1167	A	31.2	Very low	34	Very low	93 Å²	93	142.3 Å²	142.3	77%	0.769	80%	0.795	S	S	*	*			trans	53.5	98.2	146.2	0	0	0	0	0	119.8
1168	D	29.6	Very low	32.3	Very low	173 Å²	173	137.2 Å²	137.2	93%	0.925	79%	0.789	S	S	*	*			trans	-76	122.7	152.2	-79.3	-36.4	0	0	0	109.8
1169	T	26.8	Very low	30.7	Very low	125 Å²	125	144.9 Å²	144.9	77%	0.767	80%	0.804	S	S	*	*			trans	-118	126.9	154.6	-30.2	0	0	0	0	105.9	Q1171	T1169-Q1171 PolarHBondContact O-N 3.49Å
1170	P	32.3	Very low	29.4	Very low	124 Å²	124	148.6 Å²	148.6	81%	0.805	82%	0.815	S	S	*	*			trans	-84.3	121	-176.4	31.5	-28.8	0	0	0	109.4
1171	Q	26	Very low	28.8	Very low	186 Å²	186	151.3 Å²	151.3	87%	0.869	82%	0.816	S	S	*	*			trans	-127.2	126.8	156.1	-88.5	-171.4	-20.4	0	0	111.1	T1169	T1169-Q1171 PolarHBondContact O-N 3.49Å
1172	S	27.4	Very low	28.3	Very low	110 Å²	110	153.3 Å²	153.3	77%	0.769	81%	0.812	S	S	*	*			trans	-50.9	132.6	173.7	48.3	0	0	0	0	113.8
1173	H	27.2	Very low	28	Very low	196 Å²	196	153.7 Å²	153.7	91%	0.907	82%	0.816	S	S	*	*			trans	-85.1	115.6	153.6	-87.6	-80.5	0	0	0	109.2
1174	S	26.3	Very low	27.8	Very low	107 Å²	107	158 Å²	158	75%	0.748	82%	0.821	S	S	*	*			trans	-108.1	127.9	149	54.5	0	0	0	0	107.1
1175	E	29.7	Very low	28.2	Very low	194 Å²	194	156.3 Å²	156.3	91%	0.907	82%	0.818	S	S	*	*			trans	-61	154.2	179	-73.8	175.2	141.6	0	0	113
1176	Q	25.6	Very low	28	Very low	191 Å²	191	156.8 Å²	156.8	89%	0.893	82%	0.818	S	S	*	*			trans	-60.3	147.1	179.7	-67.1	166.6	-48	0	0	113
1177	E	25.1	Very low	28.8	Very low	195 Å²	195	157 Å²	157	91%	0.911	82%	0.821	S	S	*	*				-161.8	134.8	107.5	-108	-177.9	178.5	0	0	113.7
1178	A	26.6	Very low	28.7	Very low	85 Å²	85	156 Å²	156	70%	0.702	82%	0.821	S	S	*	*			trans	85.9	105	150.7	0	0	0	0	0	122.4
1179	R	25.7	Very low	28.6	Very low	224 Å²	224	156.9 Å²	156.9	85%	0.845	82%	0.819	S	S	*	*				100.9	118.4	126.8	-72.3	177.2	-176.5	-169.5	0.9	120.7
1180	Q	25.3	Very low	29.6	Very low	156 Å²	156	156.8 Å²	156.8	73%	0.729	82%	0.82	S	S	*	*			trans	36.2	133	131.4	-72.4	171.9	-54.4	0	0	117.6
1181	E	27.1	Very low	29.4	Very low	159 Å²	159	154.1 Å²	154.1	74%	0.743	82%	0.815	S	S	*	*			cis	-173.6	151	37.7	-125.6	158.7	-155.3	0	0	109.5
1182	E	26.3	Very low	29.6	Very low	170 Å²	170	157.2 Å²	157.2	79%	0.794	82%	0.82	S	S	*	*			trans	29	138	151.2	-82.6	173.9	167.1	0	0	126.6
1183	E	26.6	Very low	29.6	Very low	185 Å²	185	155.5 Å²	155.5	86%	0.864	82%	0.82	S	S	*	*			trans	101.8	130.2	139.1	-83	-173.3	167.2	0	0	123.1
1184	E	26.9	Very low	29.8	Very low	181 Å²	181	150.4 Å²	150.4	85%	0.846	81%	0.812	S	S	*	*			trans	-51.5	-176.6	176.8	-85.8	-165.2	147.2	0	0	117.3
1185	P	37.7	Very low	29.9	Very low	115 Å²	115	152 Å²	152	75%	0.747	81%	0.812	S	S	*	*			cis	-135	177.5	-0.8	18.2	8.9	0	0	0	116.2
1186	K	31.2	Very low	29.9	Very low	196 Å²	196	151.2 Å²	151.2	85%	0.852	81%	0.806	S	S	*	*			trans	-50.8	171.8	157.4	-77.9	176.9	-180	173.1	0	113.2
1187	P	44.9	Very low	29.9	Very low	132 Å²	132	151.4 Å²	151.4	86%	0.857	80%	0.804	S	S	*	*			cis	-138.9	-170.1	29.2	34.2	-8.8	0	0	0	113.2
1188	G	27.5	Very low	30.3	Very low	73 Å²	73	151.5 Å²	151.5	75%	0.753	80%	0.802	S	S	*	*			cis	178.1	162.2	18.2	0	0	0	0	0	110.9
1189	H	28.1	Very low	30.8	Very low	191 Å²	191	152.8 Å²	152.8	88%	0.884	80%	0.803	S	S	*	*			trans	-63.3	-173.8	170.9	-97.6	-42.6	0	0	0	114
1190	P	48.9	Very low	31	Very low	122 Å²	122	151.7 Å²	151.7	79%	0.792	80%	0.8	S	S	*	*			cis	-138.6	-176.6	-25.5	31.4	-10.3	0	0	0	113.3
1191	G	28	Very low	31.3	Very low	68 Å²	68	149.9 Å²	149.9	70%	0.701	79%	0.794	S	S	*	*			trans	156.8	105.8	150.7	0	0	0	0	0	119.3
1192	Y	29.6	Very low	31.4	Very low	251 Å²	251	148.8 Å²	148.8	98%	0.984	79%	0.793	S	S	*	*			trans	31.5	137.5	134.2	-93.4	-96.6	0	0	0	122.4
1193	G	28.1	Very low	31.6	Very low	74 Å²	74	153.6 Å²	153.6	76%	0.763	82%	0.816	S	S	*	*			trans	148.1	116.4	138.3	0	0	0	0	0	116.9
1194	A	30.4	Very low	31.9	Very low	89 Å²	89	152 Å²	152	74%	0.736	81%	0.813	S	S	*	*			trans	-62.8	149.8	175.1	0	0	0	0	0	114.7
1195	N	28	Very low	32.2	Very low	141 Å²	141	150.5 Å²	150.5	75%	0.754	81%	0.812	S	S	*	*				161.5	134.3	111.7	-99.2	-44.5	0	0	0	113.4
1196	K	29.3	Very low	31.9	Very low	177 Å²	177	152.4 Å²	152.4	77%	0.77	82%	0.815	S	S	*	*			trans	49	133.7	135.3	-77.3	179.6	178.4	174.1	0	121.9
1197	K	27.1	Very low	31.9	Very low	196 Å²	196	149.9 Å²	149.9	85%	0.852	81%	0.813	S	S	*	*			trans	93.8	115.7	142.7	-77.4	175.8	176	-172.9	0	117.9
1198	F	32.6	Very low	31.1	Very low	197 Å²	197	151 Å²	151	86%	0.864	81%	0.81	S	S	*	*			trans	-25.1	150.8	143.1	-83.4	-86.9	0	0	0	113.7
1199	P	38.2	Very low	31.3	Very low	112 Å²	112	156.2 Å²	156.2	73%	0.727	81%	0.814	S	S	*	*			cis	-153.1	172.1	49.9	43.8	-23.3	0	0	0	118.2
1200	Y	29.8	Very low	31.5	Very low	200 Å²	200	153.7 Å²	153.7	78%	0.784	81%	0.809	S	S	*	*			trans	55.3	125.8	140.1	-104.4	-124.7	0	0	0	123.3
1201	I	30.1	Very low	30.2	Very low	119 Å²	119	156.2 Å²	156.2	61%	0.61	81%	0.81	S	S	*	*				91	132.5	123.3	-93.2	-167.6	0	0	0	122
1202	D	29.8	Very low	30.4	Very low	135 Å²	135	163.5 Å²	163.5	72%	0.722	82%	0.819	S	S	*	*			trans	52	115.2	154.4	-57.6	-9.7	0	0	0	121
1203	E	31.7	Very low	30.5	Very low	271 Å²	271	155.5 Å²	155.5	100%	1.266	80%	0.804	S	S	*	*				-151.4	0	98.3	-98	-178.7	175	0	0	111

Retrieved 1,203 of 1,203 residues in 469.4 ms (Link to these results)

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